smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(CCCCCN1C(=O)/C(=C/c2cccc(O)c2)SC1=S)Nc1ccc(O)cc1 15044367 CCNHAZBMFGWBGJ-RGEXLXHISA-N 442.562 4.498 10 10 IICE CCCCOc1ccc(/C=C2\SC(=S)N(c3ccccc3C(N)=O)C2=O)cc1OC 39861518 XFFXYKDNGWBAHO-UYRXBGFRSA-N 442.562 4.379 10 10 IICE COC(=O)c1ccc(N2N=C(C)/C(=C\c3ccc(-c4cccc(C(=O)O)c4)o3)C2=O)cc1 103504134 APGHUSHARVDNKF-DEDYPNTBSA-N 430.416 4.238 10 10 IICE Brc1cc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)ccc1CNC1CC1 705664237 YBNNRQIPPSNIRE-BGYRXZFFSA-N 426.402 4.269 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCc2ccc(N3CCCCC3=O)cc2)cc1F 731403761 VIHKXFBENNUDNN-UHFFFAOYSA-N 426.536 4.188 10 10 IICE O=C(Nc1ccc(-c2ncon2)cc1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743141849 DTHXJLDALBHZKX-INIZCTEOSA-N 429.427 4.129 10 10 IICE C[C@H](NC(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1)c1ccc(N2CCOCC2)cc1 743564750 PDYMEJXURBYTMK-JXHRLWIKSA-N 442.629 4.028 10 10 IICE COc1ccc(OCC(=O)c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)c(C(N)=O)c1 748034884 YXGIAQKTKCHFEI-UHFFFAOYSA-N 430.863 4.256 10 10 IICE C[C@@H](Cn1ncc2ccccc2c1=O)N[C@H](C)c1cc(Br)cc(Cl)c1O 756777228 HABZIIATRDVSPH-NWDGAFQWSA-N 436.737 4.257 10 10 IICE CCN(CC)C(=O)c1ccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 766741549 VBRVCZUGWCCYQK-UHFFFAOYSA-N 447.579 4.495 10 10 IICE CSc1ccc(O[C@@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768532797 HNJKPNIZWRINEN-IBGZPJMESA-N 439.625 4.024 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccnn1C1CCCCC1 768885766 KADPHLZQZGGVPO-UHFFFAOYSA-N 436.604 4.242 10 10 IICE C[C@H](NC(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1)c1ccc(N(C)C)cc1 791722122 WZGTYVUUTVEAQI-HRAATJIYSA-N 429.536 4.377 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CCCO4)cc2Cl)C1 800636666 NAEPKOQMCJTUAB-INIZCTEOSA-N 441.959 4.156 10 10 IICE O=C(NCc1ccc(Oc2cccc(F)c2)nc1)NCc1cc(Br)ccc1O 805033000 BVTQNTMGCPQGNZ-UHFFFAOYSA-N 446.276 4.481 10 10 IICE C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1cc(Br)ccc1O 809712745 CTQYMLFBHCUAOH-ZDUSSCGKSA-N 425.754 4.335 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)C2CC2)cc1 1124905547 NRUKJKDPRNGGPO-SANMLTNESA-N 435.568 4.292 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@H](NC(=O)OC(C)(C)C)c3ccccc3)C2)cc1 1130826632 FREKVZGAXVJWCJ-UGKGYDQZSA-N 439.556 4.046 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ncoc3-c3cccc(C(F)(F)F)c3)C2)cc1 1130826813 KFIJHZISGXKMNG-MRXNPFEDSA-N 431.414 4.378 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3cccc(OCC(F)(F)F)n3)c2C)cc1 1140036191 DRTLLPZEMHQZCR-UHFFFAOYSA-N 433.430 4.369 10 10 IICE Cc1ccc(C(=O)N2CCC[C@H](C(=O)Nc3ccccn3)C2)cc1-n1c(C)cc(C=O)c1C 1148333675 HVWMAWIBSYNYBF-NRFANRHFSA-N 444.535 4.101 10 10 IICE C[C@H](NC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1)c1ccc(N(C)C)cc1 1154668484 HUFKOCHIJJRREF-INIZCTEOSA-N 441.528 4.184 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc2c(c1)OC(F)(F)O2 1156287712 PZQHQZAYUQEKQX-UHFFFAOYSA-N 434.439 4.010 10 10 IICE Cc1cc(C(=O)Cn2nc([N+](=O)[O-])nc2Br)c(C)n1-c1ccc(C(C)C)cc1 1166696783 LTGUBJVCOVBHSU-UHFFFAOYSA-N 446.305 4.363 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC3CN(C(=O)OCc4ccccc4)C3)c2C)c1 1251808962 DXOKGELTNRFOFP-UHFFFAOYSA-N 446.551 4.223 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCSCC(C)C)cs1 1290394646 UFMMFPGMWCTKRA-UHFFFAOYSA-N 431.631 4.365 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CC3)nnc2N2C[C@H](C)O[C@@H](C(F)(F)F)C2)cc1 1295414381 GSEKPXYYJIIVFM-HNAYVOBHSA-N 437.510 4.206 10 10 IICE Cc1cc(-c2nnc(Nc3cnn(C)c3)n2CCCCCCO)c(C)n1-c1ccccc1 1304196110 IDRCUKYPXTWGMT-UHFFFAOYSA-N 433.560 4.382 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)c(C)n1-c1cccc(F)c1 1307299264 UZLZUUKQTMXJHZ-DEOSSOPVSA-N 437.446 4.022 10 10 IICE CCS(=O)(=O)c1ccc([C@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1312669713 CKAWBPHGZDCRJK-SFHVURJKSA-N 439.581 4.448 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1Cc1cccc(C(F)(F)F)n1 1314749504 CJHZQEDGBQOACK-UHFFFAOYSA-N 440.429 4.144 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1ccc(Cl)cc1 1348764158 UGVCLXUWFRYUEG-GZTJUZNOSA-N 434.945 4.387 10 10 IICE Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1357129077 OCEKFUCPXGQUKO-KRWDZBQOSA-N 436.581 4.207 10 10 IICE COC(=O)CCOc1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1358144595 VNSGQXOXXWPRTM-UHFFFAOYSA-N 436.508 4.109 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C)n([C@H](C)C2CC2)n1 1448682122 DBYWSVCPNYZKOK-QGZVFWFLSA-N 426.561 4.165 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N2CCOc3c2ccc(F)c3F)C1 1460951930 LLQRBQKVYOYNTA-UHFFFAOYSA-N 430.451 4.297 10 10 IICE CCOc1ccccc1C(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 1464251577 AUAIJEYFJVTALL-UHFFFAOYSA-N 449.526 4.230 10 10 IICE C[C@]1(c2ccccc2)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1471562752 SNXZZAFDELWHBH-JOCHJYFZSA-N 442.562 4.406 10 10 IICE CC(C)CN(Cc1ccccn1)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1473817215 KQZHGMNUJDAPLV-GOSISDBHSA-N 441.531 4.342 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)[C@@H](O)Cc1ccccc1 1478529243 XPHAYMKMEHQDFU-STSQHVNTSA-N 429.992 4.368 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1503168864 KKGITDUHQICUND-UHFFFAOYSA-N 437.588 4.396 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@@H](C)[C@@H]2C)n1Cc1ccc(N2CCOCC2)cc1 1513095944 WKFJBWPFGMATPN-FHWLQOOXSA-N 429.634 4.007 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@H](COC)C2)cc1 1515530860 GFUYLIKYABJOKV-GMAHTHKFSA-N 441.620 4.277 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCc3ccccc3C(F)(F)F)cc2F)CC1 1521017407 WCWUEAPOPBNISN-UHFFFAOYSA-N 437.481 4.235 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cc2cc[nH]c2cn1 1530667767 QVPORHPJRMMKHG-GDNBJRDFSA-N 428.564 4.245 10 10 IICE CCOC(=O)Nc1ccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)c(Cl)c1 1539247458 SLMJBGYIPGZUER-UHFFFAOYSA-N 430.936 4.303 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)CC(=O)Nc2cccc(Cl)c2)cc1 1540545747 ZBJRTIAIVIHJOW-UHFFFAOYSA-N 437.927 4.200 10 10 IICE CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1540724090 PILFIJWGDQEHSQ-UHFFFAOYSA-N 433.508 4.016 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc3n(n2)CCC[C@H]3NC(=O)OC(C)(C)C)cc1 1544580090 DUYVFZUMDAPECU-LJQANCHMSA-N 441.576 4.019 10 10 IICE CC[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)[C@@H](O)c1c(F)cccc1F 1545596736 YFSXLPNWMXPIAV-NBGIEHNGSA-N 442.506 4.435 10 10 IICE CCc1nnc(N2C[C@H](C)C(F)(F)[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1546561055 IJZPYDZCYPEDFY-CALCHBBNSA-N 435.588 4.170 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@H](N(C)C)C23CCC3)c(C)n1-c1cccc(Br)c1 1557693386 GVXULLDCWXIWRP-PMACEKPBSA-N 430.390 4.459 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1 1566848967 FCFUWNJEJHNVMA-OAHLLOKOSA-N 433.932 4.312 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccnc(OCCN(C)C)c2)c1 1583899122 JUBWOTXHZLFYFY-UHFFFAOYSA-N 426.948 4.013 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1sc(-c2ccccc2)nc1C 1597567486 PHIZACVLJLTUBU-UHFFFAOYSA-N 430.913 4.293 10 10 IICE CCCN1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(CC)CC)cc2)CC1=O 1614872135 WRMMOKFINJWFLM-FQEVSTJZSA-N 440.636 4.135 10 10 IICE COC(=O)CC(C)(C)CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1627272108 SULRERXMJWFRBH-UHFFFAOYSA-N 445.317 4.077 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3(C)C)cc2)CC1 1628608493 FEFCKFBYUCPXMM-RTWAWAEBSA-N 429.605 4.479 10 10 IICE Cc1nc([C@@H](NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c2cnn(C)c2)no1 1628637461 QZOUMTRXXPQYLS-QFIPXVFZSA-N 432.528 4.162 10 10 IICE Cc1cc(C)c(C)c(OCCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1630549854 BBXKHQPYHLWPDL-OALUTQOASA-N 428.548 4.450 10 10 IICE CC(C)(C)OC(=O)NCc1ncc(C(=O)NCc2ccc(N3CCCCC3)cc2)s1 1630700967 IFJMTKZRCHETIG-UHFFFAOYSA-N 430.574 4.088 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](C(=O)Nc3cn[nH]c3)c3ccccc3)c2C)c1 1632057819 KOEMKIHIYSYWIN-QHCPKHFHSA-N 427.508 4.235 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2cccc(F)c2)c(C)n1-c1ccc(Cl)cc1 1633647424 JUFNMIYKZHAEQD-UHFFFAOYSA-N 427.907 4.437 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)C3(c4ccccc4)CCCC3)CC2)c(OC)c1 1634370743 DRHKJQVXJMEDRO-HXUWFJFHSA-N 437.584 4.436 10 10 IICE C[C@H](NC(=O)N[C@H]1C[C@H]2CC[C@@H]([C@@H]1C)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634434691 FIZLWBQCRCLZAV-HZDRLRHHSA-N 430.593 4.289 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](CC(=O)OC(C)(C)C)C3)ccc21 1635359569 KYSFKUHHQOAKQY-LJQANCHMSA-N 428.573 4.489 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1 1635890270 LEFYWSGAPOMAQO-UHFFFAOYSA-N 445.519 4.068 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC(N3CCCOCC3)CC2)cc1 1637445830 BCSPQUNKRVGRBH-UHFFFAOYSA-N 435.572 4.495 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2(C(=O)OCc3ccccc3)CCC2)cc1 1637615210 ZLTVMCCONLNLAG-UHFFFAOYSA-N 444.531 4.231 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@]1(C)CC(c2cccc(Cl)c2F)=NO1 1639341181 OYEXSLRPTIWMJT-CMJOXMDJSA-N 431.939 4.484 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)NCc3cccc(Br)c3O)cccc21 1640089003 XPVZGZRWQLSNNV-UHFFFAOYSA-N 447.329 4.382 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1Cl 1645412282 BNTSVRQBJJQBKZ-IAGOWNOFSA-N 433.955 4.235 10 10 IICE CC(C)(C)OC(=O)NC1(C(=O)NCc2c(O)ccc3ccccc23)Cc2ccccc2C1 1647790950 CRYRMHBFVSSCMZ-UHFFFAOYSA-N 432.520 4.224 10 10 IICE C[C@@]1(Cc2ccc(F)cc2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683195699 LBMFJGRQLXEUEZ-DEOSSOPVSA-N 447.501 4.247 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 1686826102 APGVITSEQUIXRB-GOSISDBHSA-N 440.563 4.191 10 10 IICE C=C1CCN(c2nnc(C(=O)NC(CC)CC)n2Cc2ccc(N(CC)CC)cc2)CC1 1705761744 YXUGHYYBPSKRTF-UHFFFAOYSA-N 438.620 4.247 10 10 IICE C=CCCCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1705806830 NNQAFGVKSLZEJS-JOCHJYFZSA-N 439.604 4.001 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCO[C@@](C)(C(C)(C)C)C1 1742141655 KXXVJASWUDSOAE-RUZDIDTESA-N 425.621 4.295 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)cc1C 1743641184 LBXIMQRXLFHPHV-XMSQKQJNSA-N 425.621 4.467 10 10 IICE CC[C@H](C)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752767624 GKJAHJHKEAFAOU-MOPGFXCFSA-N 429.584 4.442 10 10 IICE CC[C@@H](C)c1nnc(N2CCC([C@@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1763603223 WLAGIJGTVAGBMV-YLJYHZDGSA-N 429.584 4.298 10 10 IICE CCO[C@]1(c2nnc(N3CC[C@H](C)[C@H]3C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1765869137 KAXMEVVTLGWWNV-WZOHSFFVSA-N 441.620 4.059 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1767706183 WZFKOWYYKVIHAV-KNQAVFIVSA-N 437.588 4.393 10 10 IICE COCCN1C(=O)C(Nc2cccc(F)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420807 WEJVFZAVNBHQST-UHFFFAOYSA-N 433.483 4.072 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3cccc(OC(=O)CC(C)(C)C)c3)CC2)cc1 1874736761 UDLFHBPZNFZMNH-UHFFFAOYSA-N 438.568 4.432 10 10 IICE O=c1c2ccc(C(F)(F)F)cc2nc2n1CCC2=Cc1ccc(N2CCOCC2)cc1 2053613216 YVWSXBUATRYWCD-UHFFFAOYSA-N 427.426 4.196 10 10 IICE C[C@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)C(=CC=Cc2ccccc2)SC1=S 2314837832 XEQBBNFFVROLEV-CQSZACIVSA-N 438.530 4.169 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2ccc(O[C@@H](C)C(=O)O)cc2)SC1=S 2314929394 LZVGVNIXNYGHNY-ZDUSSCGKSA-N 429.519 4.343 10 10 IICE CCCC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323823675 FCFQSJGWAMJZAP-LBPRGKRZSA-N 432.336 4.433 10 10 IICE COc1cccc2c1O[C@H](C)C(/C=C1/SC(=S)N(CCCCCC(=O)O)C1=O)=C2 33514464 MQRASQFHYMPBRK-LVLBFHFTSA-N 433.551 4.249 10 10 IICE CCN(CC)c1ccc(CN(Cc2ccco2)C(=O)CC(C)C)c(OS(C)(=O)=O)c1 37422945 BORCIPYHQCUHDN-UHFFFAOYSA-N 436.574 4.039 10 10 IICE CCCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CCC)c2N2CCCC2)SC1=S 39989985 QVSKEYHQNFAMAJ-AQTBWJFISA-N 444.626 4.040 10 10 IICE CCCCCN1C(=O)/C(=C2/SC(=S)N(CCCC(=O)OCC)C2=O)c2ccccc21 206864236 YXJIMKBVRBKPLE-VHEBQXMUSA-N 446.594 4.138 10 10 IICE Nc1ccc(N(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c2ccccc2)cc1 242876271 GJDOBXMGPPMEOE-UHFFFAOYSA-N 430.508 4.073 10 10 IICE Cc1nc2sccn2c1CN(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 444299796 WLIKJKKMMQRHLY-UHFFFAOYSA-N 435.597 4.084 10 10 IICE O=C(O)/C=C\c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c(Br)c1 705929618 GUFTVCVQXIEFBT-BDNAOYLZSA-N 427.342 4.115 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(Br)s3)cc2F)C[C@H](C)O1 733922256 TWDWMCGBPURCNY-STQMWFEESA-N 441.366 4.122 10 10 IICE C[C@H](NC(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1)c1ccc(N2CCOCC2)cc1 743564754 PDYMEJXURBYTMK-NOXFTYBFSA-N 442.629 4.028 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(CC(=O)c3cc(C)n(-c4ccc(OC(F)F)cc4)c3C)[C@H]2C1 755052539 FABOHIBDEQIPOY-UNWVZKJWSA-N 448.510 4.147 10 10 IICE CCN(CC)c1ccc(CNC(=O)N(CCO)Cc2cc(Br)cs2)cc1 755594842 YKCWGMAKDMPDPS-UHFFFAOYSA-N 440.407 4.061 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)O[C@@H]1CCc2cccnc21 1128192888 DTKAURGKQXRPGE-QRYYFKOISA-N 428.510 4.043 10 10 IICE CC(C)[C@@H](SCc1ccccc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661061 DQALYVCMZHSQRN-JOCHJYFZSA-N 434.552 4.376 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(S(N)(=O)=O)c1 1154583906 RCYFKOYSFYTMNU-NRFANRHFSA-N 445.972 4.276 10 10 IICE CCN(CCNC(=O)OC(C)(C)C)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1166911223 IGIUZPDCOJSZJE-UHFFFAOYSA-N 427.545 4.202 10 10 IICE CN(C)c1ccc([C@H](CNc2nnc(C(F)(F)F)s2)NC(=O)OC(C)(C)C)cc1 1186367827 JCORFTHGCCBFQS-ZDUSSCGKSA-N 431.484 4.301 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3C[C@H](c4ccccc4)[C@](F)(CO)C3)c2C)c1 1254073446 IBRCZSBAZSBESX-AOYPEHQESA-N 435.543 4.412 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(S(=O)(=O)N3CCCC[C@H]3C)c2)cc1 1264668549 PGJHBFBQJNYHNF-LJQANCHMSA-N 443.613 4.026 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc4c(Br)cncc4s3)C2)cc1 1278861005 DXSMLHNMJWYKFK-LBPRGKRZSA-N 432.343 4.076 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2CCNC(=O)C2CC2)c(C)n1-c1ccccc1 1289353450 PJUNVVILFVNDQL-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CCCS(=O)(=O)Nc1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1292013015 IEQJHKCKFDDYJY-UHFFFAOYSA-N 439.537 4.311 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@](C)(CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1295275443 SOGPKQICGKKFSW-VWLOTQADSA-N 447.620 4.311 10 10 IICE COCC(=O)N1CCc2cc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)ccc21 1296753575 IPVWKNMGKVNOKR-UHFFFAOYSA-N 445.519 4.003 10 10 IICE FC(F)Oc1ccc2c(c1)CCCN2Cc1nnnn1-c1ccc(C(F)(F)F)cc1 1307536823 CQLBFCWQRPUUQL-UHFFFAOYSA-N 425.361 4.235 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCc2cn(C)c3ncccc23)cc1 1313176313 URJDENFVZLGXDU-UHFFFAOYSA-N 431.540 4.187 10 10 IICE CCOCC(C)(C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1314290108 RWVRFRFIOQFGOE-JOCHJYFZSA-N 441.620 4.429 10 10 IICE CCn1cc(-c2nn(C)cc2C(=O)N2CC(C)(C)Oc3ccc(C(F)(F)F)cc32)cn1 1439528527 IKBBZFADOVXRRA-UHFFFAOYSA-N 433.434 4.140 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@@H]1C[C@H]1CN(C(=O)/C=C/c2cccnc2)c2ccccc21 1439584671 KOLUYKQKHKAXOT-YGEFIYNQSA-N 449.551 4.251 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@]3(F)CCN(C(=O)OC(C)(C)C)C3)c2C)c1 1454622544 FLVFOORHHVETSR-XMMPIXPASA-N 429.536 4.368 10 10 IICE COC(=O)CC1(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CCOCC1 1467980068 SHPJPBDXCNGVHN-UHFFFAOYSA-N 426.557 4.307 10 10 IICE CCOC(=O)c1c(NC(=O)CN2Cc3c[nH]nc3[C@H](C)C2)sc(C)c1-c1ccccc1 1473703261 GLQBPFWTJAGZKF-CQSZACIVSA-N 438.553 4.181 10 10 IICE CCOCc1nnc(N2CCC(c3nccs3)CC2)n1Cc1ccc(N(C)C)cc1C 1503053859 RZTMXFBOZYCHBQ-UHFFFAOYSA-N 440.617 4.078 10 10 IICE COc1ccc(N2CCN(c3nnc([C@@H]4CCCCO4)n3CCCC(C)C)CC2)cc1F 1504296097 MQLJCSQCVMXQJL-QFIPXVFZSA-N 445.583 4.430 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CSCN3C(=O)C(C)(C)C)cc2Cl)C1 1524245941 UGAJMJOFDBPWES-HNAYVOBHSA-N 438.037 4.140 10 10 IICE CC(C)c1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1[N+](=O)[O-] 1533992535 WOIIGBJTCYNUAM-UHFFFAOYSA-N 436.556 4.180 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2Cc2sc(C)nc2C)cs1 1542898417 RHHYISXTMVFFEG-UHFFFAOYSA-N 440.598 4.097 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 1545632405 KPQCEXONAFGYRJ-LJQANCHMSA-N 443.931 4.156 10 10 IICE CCCCCn1c([C@@H]2CCCOC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1546975278 LCRBLKDUXPQELP-HXUWFJFHSA-N 427.593 4.088 10 10 IICE Cc1cc(CCNC(=O)CCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)n1-c1ccccc1 1587460914 FHADFZNLJOFXNU-UHFFFAOYSA-N 436.468 4.202 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccccn1 1618934591 VNIGDTNSMSWSFE-IBGZPJMESA-N 430.556 4.419 10 10 IICE CO[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CC1(C)C 1619530746 LGMUZPZRNYHWON-JOCHJYFZSA-N 425.621 4.295 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H]2CCc3ncc(Br)n3C2)c1 1623397607 BHGUBBLUMVMUPJ-CQSZACIVSA-N 447.764 4.451 10 10 IICE CN(c1ccc(CNC(=O)c2cc(Br)cn3ncnc23)cc1)C1CCCCC1 1625905232 NAHZPGPORWIBOI-UHFFFAOYSA-N 442.361 4.191 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCCOc3cc(OC)cc(OC)c3)c2C)cc1 1630344265 UGEVGJHZIRNGPR-UHFFFAOYSA-N 438.524 4.319 10 10 IICE COC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)c1 1631612002 HYZMJNOQQWMETH-NRFANRHFSA-N 425.529 4.061 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N[C@H](C)C(C)C)c(C)n1-c1cccc(Cl)c1 1633273772 OIEDUBYMFMLWMI-FOIQADDNSA-N 434.005 4.423 10 10 IICE O=C(NCc1cccc(O)c1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 1633506955 CYVUBECBNKUQCU-UHFFFAOYSA-N 445.319 4.251 10 10 IICE Cc1ccc(NC(=O)N(C)C)cc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1634261816 TYJFQPUOUVPUBL-UHFFFAOYSA-N 432.524 4.490 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1 1634944683 IIUNVWNOOSQQKB-HNNXBMFYSA-N 425.451 4.433 10 10 IICE COc1cccc(Cn2cccc(NC(=O)c3cc(C)n(-c4ccccc4C)c3C)c2=O)n1 1648797878 KBVJASCVXKJUDJ-UHFFFAOYSA-N 442.519 4.268 10 10 IICE Cc1cc(CNC(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c(C)n1-c1ccccc1 1675114548 DXKDAPVFQNVGEH-UHFFFAOYSA-N 444.579 4.332 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CC[C@H](CN2CCCCC2)C1 1707305129 QTRWFMQWTROHPS-JOCHJYFZSA-N 438.664 4.212 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1C[C@@H](C)[C@H](C(F)(F)F)C1 1742138822 DZXPQLDXFXKEOK-CRAIPNDOSA-N 432.494 4.331 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCCC2)nnc1N(C)Cc1ncc(Cl)n1C 1742141771 OCPLLKFGZGODJN-UHFFFAOYSA-N 442.011 4.382 10 10 IICE CC[C@@H](C)c1nnc(N2CCC([C@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)cc1C 1743642801 YPHSGCUTBQODJQ-GCJKJVERSA-N 425.621 4.467 10 10 IICE CO[C@@H](C)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1748383263 ZDZHKNZZJSLLME-KRWDZBQOSA-N 440.979 4.265 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3Cc3ncccc3C)CC2)cc1 1748847729 LREVOHJIVXVIAT-UHFFFAOYSA-N 448.615 4.344 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2CCNC(=O)C2CC2)c(C)n1-c1ccccc1 1751409947 QXYQWDNJIRNRFL-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCC[C@H]2CSC)cc1 1764939962 ZKRZGOYQUDXMMB-IRLDBZIGSA-N 443.661 4.398 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1772875861 WIFHXKPFLHGUCP-UHFFFAOYSA-N 436.604 4.457 10 10 IICE CC[C@@](C)(NC(=O)c1cccc2ccccc12)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862238386 ZYQQZOORLBANQF-HHHXNRCGSA-N 445.563 4.096 10 10 IICE O=C(O)C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951321656 AZLMYDKWDCRTMV-INIZCTEOSA-N 433.460 4.022 10 10 IICE COC(=O)c1nn(Cc2cc(C(F)(F)F)ccc2O)c(C(F)(F)F)c1Br 2079208167 PEJUOTOSAWXTIB-UHFFFAOYSA-N 447.129 4.224 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C3CC3)c(CN)c2I)cc1C 2079979067 KRAZCUOBBOWVRQ-SFHVURJKSA-N 437.325 4.146 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@@](F)(CNCc2cc(Br)cc(F)c2O)C1 2115646137 VJLBJUHDOJKPCJ-CKSWESSHSA-N 435.309 4.026 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 2297342530 CTEQJPXSFBXNJX-UHFFFAOYSA-N 443.843 4.303 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3F)C2=O)ccc1OCCC(=O)O 2314933591 BTOOEORROBCTKD-UHFFFAOYSA-N 447.509 4.484 10 10 IICE CC(C)Oc1cccc(C=C2SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)c1 2321582947 KRFNMYFNERDMJP-UHFFFAOYSA-N 443.502 4.276 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(O)c1Br 2352677161 XFFXORAWGBFMTH-MUJYYYPQSA-N 425.367 4.483 10 10 IICE COC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(c4ccc(OC)cc4)C(=O)N=C3O)o2)cc1 2259618 CGTAZNBRPQGDLP-CPNJWEJPSA-N 446.415 4.249 10 10 IICE CCN(CC)c1ccc(CN(CC(C)C)C(=O)CC(C)C)c(OS(=O)(=O)CC)c1 6710493 OAUXDJVHBSDWPE-UHFFFAOYSA-N 426.623 4.292 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14459708 UVOPBZDOGNPAGL-HYFFOGBASA-N 428.554 4.258 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C/c1ccc(N(C)C)cc1 33332209 CSIDXEPMIDTVGP-LDADJPATSA-N 426.900 4.292 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1 104914629 BDFVACMHKIBBPT-HSZRJFAPSA-N 447.535 4.419 10 10 IICE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1Br 105367897 LJUNWIYVTFXNBJ-MRXNPFEDSA-N 432.362 4.188 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(C(=O)N4CCCCCC4)CC3)c2C)cc1 247841036 PXJMNLYFGQXPCP-UHFFFAOYSA-N 437.584 4.358 10 10 IICE O=C(O)CCCN1C(=O)/C(=C/c2nc3ccc(Br)cc3s2)SC1=S 772177386 TTYQJEBGQZXIAD-XFFZJAGNSA-N 443.369 4.125 10 10 IICE Cc1cccn2c(=O)c(C(=O)OCC(=O)Nc3ccc(N=Nc4ccccc4)cc3)cnc12 773692438 PKQNDBBQYZRZDX-UHFFFAOYSA-N 441.447 4.214 10 10 IICE CC(C)NC(=O)[C@H](C(C)C)N1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1081156729 ACODGNACFTUZCN-HNRFISLBSA-N 441.416 4.200 10 10 IICE Cc1cc(C(=O)N[C@@H](Cn2ccnc2)C(C)(C)C)c(C)n1-c1ccc(Br)cn1 1136395037 YPBBFUOLUKYWGJ-SFHVURJKSA-N 444.377 4.293 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1Cc2c(C)cccc2N1C(=O)OC(C)(C)C 1140198390 BNEJPBLMPXUAKW-SFHVURJKSA-N 431.529 4.169 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCc2ccccc2N2CCOCC2)cc1 1141518950 UEABSSADSVZERW-UHFFFAOYSA-N 447.579 4.344 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)c1 1141692358 WPEOFSNATNLDLY-QHCPKHFHSA-N 430.596 4.343 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(Br)c(C)c3)CC2)cc1 1168331259 BFRFNVMNSPWALU-KRWDZBQOSA-N 446.389 4.305 10 10 IICE CC(=O)c1ccc2c(c1)CN(C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 1222589681 FVVUIJOSIZNKOE-IBGZPJMESA-N 429.467 4.185 10 10 IICE COc1ccccc1[C@@H](CNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)OC(C)C 1235033770 VXISWMLXPIBFAU-NTKDMRAZSA-N 427.589 4.466 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC[C@@H](O)c2ccc(-c3ccccc3)cc2)N(C)C)cc1 1256236294 FLHAWPPBHKLBQR-CLJLJLNGSA-N 446.595 4.055 10 10 IICE CCOCc1nnc(N(C)C2Cc3ccccc3C2)n1CCCSc1nccs1 1297037406 RZPGVNWLXOTAMY-UHFFFAOYSA-N 429.615 4.057 10 10 IICE CN(C(=O)OC(C)(C)C)[C@H](CC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1297440782 QFBMIGLMFBSSAR-OAHLLOKOSA-N 443.382 4.443 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](C(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1305554750 RJUQDKAXYALCDH-LPHOPBHVSA-N 439.526 4.454 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)CSc1nccn1-c1cccc(Cl)c1C 1449125594 UQTWHNICQVTSKA-UHFFFAOYSA-N 436.961 4.434 10 10 IICE C[C@H](CN(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nccs1 1458215971 ODGACMWIUJNAHQ-KWWJGWKXSA-N 449.598 4.136 10 10 IICE O=c1c(Cl)c(NCc2cccc(Cl)c2O)cnn1-c1ccc(C(F)(F)F)cn1 1458702643 UDVPDQILWDWEFU-UHFFFAOYSA-N 431.201 4.271 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)Nc1cc(C(F)(F)F)ccc1-n1cncn1 1459779412 MPQNNVVCWMEGAW-UHFFFAOYSA-N 445.445 4.076 10 10 IICE CC1(Nc2nc(CC(=O)NCc3ccc(N4CCSCC4)cc3)cs2)CCCC1 1464264418 XTVYSNYMTFJNBV-UHFFFAOYSA-N 430.643 4.300 10 10 IICE Cc1cc(CCNC(=O)N(CCc2ccccc2)CCN(C)C)c(C)n1-c1ccccc1 1470968813 ISUKJQHCWNYBRP-UHFFFAOYSA-N 432.612 4.453 10 10 IICE COCCN(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CCOCC1 1471431228 PMNYNANUAJGCPT-UHFFFAOYSA-N 435.362 4.124 10 10 IICE CC[C@@H](C)c1nnc(N(CC)CC2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1512834235 GLEKEIAXUQWHGO-LJQANCHMSA-N 425.621 4.285 10 10 IICE Cc1cccc(C)c1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1526634108 OWFVLLZVERMATF-UNOMPAQXSA-N 428.554 4.350 10 10 IICE C[C@H]1CC(F)(F)CCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1532074398 IPMJGQJXKPBSPY-LQELWAHVSA-N 430.567 4.376 10 10 IICE C/C(=C\C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1537839935 RQOZIEAIZUJFFF-JQIJEIRASA-N 445.485 4.127 10 10 IICE C[C@H](CNC(=O)OC(C)(C)C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccccc1O 1541884716 MRPKHRGEGQCJFK-QGZVFWFLSA-N 443.592 4.439 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H](O)c3ccc(Cl)c(Cl)c3)cc2F)C[C@@H](C)O1 1543234198 YVFBHJOUKIOGFI-RDXCRGQUSA-N 441.330 4.096 10 10 IICE Cc1c(Cl)cccc1-n1ccnc1SCC(=O)NCc1ccc(N(C)C)c(F)c1 1544308606 ORVKIMSUVDALSU-UHFFFAOYSA-N 432.952 4.448 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccn1[C@H](C)Cc1ccccc1 1546152090 RXBXMTAEWUEWAV-QGZVFWFLSA-N 440.927 4.466 10 10 IICE COCCN(C)c1nnc(-c2cn(C)c3ccccc23)n1CCCSc1nccs1 1555513884 ULNBOUROUUWVLJ-UHFFFAOYSA-N 442.614 4.158 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@H](CNC(=O)OC(C)(C)C)C2CC2)c1 1556284979 UDNPPMHBJYPOGC-JOCHJYFZSA-N 439.556 4.282 10 10 IICE COc1cc(C[C@H](CO)CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc(OC)c1 1566387647 RIDLQVYLOWGYOR-NRFANRHFSA-N 436.552 4.001 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(Br)cc(N(C)C)c3)c2)CC1 1567269094 QIZXITNYPJTMQV-UHFFFAOYSA-N 445.405 4.298 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cc(Cl)ccc1O 1583821073 SZQGCFKHVVZLJJ-MGPUTAFESA-N 448.947 4.160 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc4c(c3)CCN4C(=O)OC(C)(C)C)C2)cc1 1585988716 QHXJXAPAVLBVRG-IBGZPJMESA-N 437.540 4.002 10 10 IICE CC(C)[C@H](NC(=O)NCc1ccccc1)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1587475518 DPUMVVRXQWKBOP-DEOSSOPVSA-N 436.600 4.159 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C[C@@H](C)O1 1612969146 YGBMCQSMSYQANS-HUUCEWRRSA-N 435.644 4.183 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(SC)CC1 1613317019 UEIBOZWYLJOQAA-MRXNPFEDSA-N 433.597 4.162 10 10 IICE CCC1(Cn2c(C(=O)NC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)CCC1 1613733011 XTMWHYUNKKEQOW-UHFFFAOYSA-N 438.620 4.233 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1 1618809816 LMNOCMYRRHCWML-IBGZPJMESA-N 441.535 4.249 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccc(OC)cc1 1620496313 VGRCMLGOVXFBAH-UHFFFAOYSA-N 442.515 4.321 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H](O)c1ccc(Cl)cc1 1626510767 AFRMXPDGANQUOP-OAQYLSRUSA-N 432.948 4.152 10 10 IICE CCN1CC[C@@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)[C@@H](C)C1 1629674020 MCKAGEHXDMCUDP-IFXJQAMLSA-N 433.394 4.054 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Cl)nc(N2CCCC2)c1 1631426034 VTKSODZGEXTWGM-SFHVURJKSA-N 449.382 4.089 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c(C)n1-c1cccc(Cl)c1 1632551177 DTEOYFUOFUGASN-UHFFFAOYSA-N 443.956 4.322 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)c1 1634973049 TUYGSMFXXRHWGT-HXUWFJFHSA-N 433.552 4.428 10 10 IICE C[C@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cc(Cl)cc2c1OCC2 1638652174 XBEBINGORFKFAK-KXBFYZLASA-N 430.932 4.432 10 10 IICE Cc1cc(C(=O)N2CCC(CO)(NCC(C)C)CC2)c(C)n1-c1cccc(C(C)C)c1 1647823600 WIIROIJWTABHOY-UHFFFAOYSA-N 425.617 4.430 10 10 IICE COc1ccc([C@@H](CNC(=O)CN[C@@H](C)c2ccccc2O)c2c[nH]c3ccccc23)cc1 1648054016 MVOIAKRCFJQQPY-FDDCHVKYSA-N 443.547 4.481 10 10 IICE CN(CC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(OCc2ccccc2)cc1 1653310120 FXUBPUVKUBGYOC-RUZDIDTESA-N 434.511 4.441 10 10 IICE COc1cc(NC2CCN(Cc3ccc(N4CCC(OC)CC4)cc3)CC2)cc(OC)c1 1657643747 ZLWWGCRCXNYLJG-UHFFFAOYSA-N 439.600 4.396 10 10 IICE CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1676653845 YXJLYSUOJKDFGX-ZKMPZPQNSA-N 438.616 4.165 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(OCc4ccc(F)cc4)CC3)C2)cc1 1682188512 SPNSOIVORHJZKL-FQEVSTJZSA-N 441.547 4.051 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@@H](Oc4ccccc4Cl)C3)C2)cc1 1683337002 ROHCHQZCEVNPRE-FXAWDEMLSA-N 429.948 4.038 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCc2c(F)cc(O)cc2F)cc1 1685380040 WEIBLOPSANAMOA-UHFFFAOYSA-N 429.467 4.284 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2C[C@H]2C[C@H]2C)c(C)n1-c1ccccc1 1692987738 LOVZHOSTJXWENJ-YLJYHZDGSA-N 448.615 4.360 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H]2c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1694108834 SEXQCBNNPMHUPY-OXJNMPFZSA-N 425.556 4.120 10 10 IICE CCC[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1695146501 HTYXVORKANZKPD-NRFANRHFSA-N 443.661 4.182 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1sc(C)nc1C 1696248231 LXCOPJAXZWTYGP-UHFFFAOYSA-N 440.617 4.173 10 10 IICE CCOCc1nnc(N(C)[C@H]2CC[C@H](SCC)C2)n1Cc1ccc2c(c1)CCCN2C 1710641440 XGKTYCPHLYJSLC-SFTDATJTSA-N 443.661 4.356 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1 1769198197 OOCRYHOCUCVQDT-PGRDOPGGSA-N 437.588 4.250 10 10 IICE CC(=O)N1CCCc2cc(-c3csc(SCC(=O)c4ccc(O)c(O)c4)n3)ccc21 1860814326 DRGVHMKKGZULON-UHFFFAOYSA-N 440.546 4.495 10 10 IICE O=C(OCc1ccccc1)N1CCC(NCc2cc(Br)cc(F)c2O)CC1 1948158827 AMPPUBHDYHXMHR-UHFFFAOYSA-N 437.309 4.185 10 10 IICE COc1ccc(O)c([C@](C)(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c1 1951726731 CISHYOMVQTUPOY-VWLOTQADSA-N 433.460 4.239 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C3(C)CC3)c(CO)c2I)c(O)c1 2079025242 KWXUJUDADVPNCH-MRXNPFEDSA-N 438.309 4.045 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(CCC(=O)OCC)C2=O)cc1OCC 2314761290 RNZGQHXGZCFOFU-UHFFFAOYSA-N 437.583 4.419 10 10 IICE Cc1cc(C)c([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@H]32)c(C)c1 14457785 UMFXZUOSQDYRFL-BPYKYCOYSA-N 438.593 4.459 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550810 WKGVFLPSQQEGBS-UEXGIBASSA-N 427.526 4.498 10 10 IICE Cc1ccc(N2C(=O)C[C@H](N3C(=O)/C(=C\C=C/c4ccccc4)SC3=S)C2=O)cc1 15304156 DNRROVRYDPUHRR-FILYCYRDSA-N 434.542 4.085 10 10 IICE CCN(CC)CN1C(=O)/C(=C2\SC(=S)N(c3cccc(C)c3)C2=O)c2ccccc21 38206442 VQXQIAHIIFZESG-VXPUYCOJSA-N 437.590 4.417 10 10 IICE CC[C@@]1(c2ccc(NC(=O)c3cc(C)n(-c4ccccc4)c3C)cc2)CCC(=O)NC1=O 72023173 JHQYNOIZVVZCSO-SANMLTNESA-N 429.520 4.431 10 10 IICE CNC(=O)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(Cl)c1 435910931 HFXXBVJWNITNTH-UHFFFAOYSA-N 438.959 4.060 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@]2(NCc2cc(Br)cc(F)c2O)C1 715736273 HFSOPBPCPHTCNY-ORAYPTAESA-N 429.330 4.173 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCCC[C@H]3CNC(=O)OC(C)(C)C)ccc21 728519214 ZCCDFHKRAJJQHW-FQEVSTJZSA-N 443.588 4.424 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@@H](c2ccc(Cl)cc2)C1 732449784 NTJZGVWFMCELJU-GOSISDBHSA-N 431.939 4.139 10 10 IICE O=C(Cc1coc(-c2ccc(F)cc2)n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742801927 UQDFIPAPPSIXPW-KRWDZBQOSA-N 445.441 4.410 10 10 IICE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 761284205 TVPFGQPICNQBDD-WCRBZPEASA-N 439.943 4.005 10 10 IICE CC(C)(C)OC(=O)NC1[C@H]2CCC[C@H]1CC(C(=O)NCCCSc1nccs1)C2 796411470 AWYABIFCTOOTBB-JUVOFCAFSA-N 439.647 4.461 10 10 IICE CC1CCN(c2ccc(CNC(=O)N(CC(=O)N3CCCCCC3)C(C)C)cc2)CC1 806766541 VRYIZVIBSMLMHQ-UHFFFAOYSA-N 428.621 4.246 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(F)c1Br 815911703 LIEHRNAXJXMOAG-UHFFFAOYSA-N 446.364 4.050 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccncc2OCC(F)(F)F)CCCC1 1128375564 SWIUUWPGURYRHC-UHFFFAOYSA-N 447.457 4.181 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](C)[C@H]3C(=O)OC(C)(C)C)ccc21 1129949602 ABZISCVDVRXXCC-ZHRRBRCNSA-N 428.573 4.487 10 10 IICE C[C@H]1c2ccccc2C[C@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1130926948 SJVQPJNVEHSNBS-NQUKFLFOSA-N 440.565 4.262 10 10 IICE O=C(N[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1139443839 VOWKELGHZFWKMI-DOTOQJQBSA-N 448.953 4.194 10 10 IICE COc1ccc(C(=O)CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1[N+](=O)[O-] 1171005246 MPQPOUYWGZFCPT-UHFFFAOYSA-N 441.871 4.277 10 10 IICE Cc1ccc(C[C@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1229772757 ITEQPXWNGZWUQS-HXUWFJFHSA-N 429.511 4.027 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3c[nH]c4c(Cl)cccc34)C2)cc1 1230300632 HMGYHKNAIMPVRU-INIZCTEOSA-N 426.948 4.198 10 10 IICE COc1cc(N2CCN(C(=O)c3cc(Cl)cc(Cl)c3F)CC2)cc(OC)c1OC 1267906009 SZUWOFFCVNRPQG-UHFFFAOYSA-N 443.302 4.121 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)C[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291472978 XNILCZKKMXTLQY-FHWLQOOXSA-N 429.584 4.298 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@](C)(OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291532053 LIOHNQQZZKPESL-CYFREDJKSA-N 443.661 4.398 10 10 IICE CCCN1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)CC1=O 1294721962 PXDGYOZQHKPBLG-UHFFFAOYSA-N 448.615 4.457 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(=O)OC(C)(C)C)cc3)cc2F)C[C@@H](C)O1 1350933501 OCZPFKGDBBGOSO-CALCHBBNSA-N 442.531 4.325 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(C)(C)COCc3ccccc3)cc2F)C[C@@H](C)O1 1354660007 ZFBBOMZRRFGQRN-KDURUIRLSA-N 428.548 4.299 10 10 IICE Cc1nc(-c2c(C)noc2C)sc1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1357128204 KYFLVSRTFZBRHG-CYBMUJFWSA-N 426.542 4.051 10 10 IICE COC(=O)c1ccc(OCCNC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)cc1 1360231209 HLOZHWUKRALYHR-UHFFFAOYSA-N 426.900 4.343 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1442343462 PQQSFMNDMFTXME-NRFANRHFSA-N 427.545 4.229 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc3cccc(O)c23)c1 1443642797 TXGHAVNLUOEFSH-UHFFFAOYSA-N 425.488 4.290 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 1444974352 JHARWZXBIBYOID-DCFHFQCYSA-N 443.591 4.476 10 10 IICE CC(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446563459 GAUCFGVEUSDRQT-VQTJNVASSA-N 434.577 4.229 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](c3c(F)cccc3Cl)N3CCCCC3)CC2)cc1 1458037157 CXKLJZCTTWEZHW-QHCPKHFHSA-N 445.966 4.364 10 10 IICE Cc1cc(C(=O)Cn2cnc3cc(Cl)ccc3c2=O)c(C)n1-c1ccc(Cl)cn1 1458880672 OQUYAWGCKILIDD-UHFFFAOYSA-N 427.291 4.389 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)c(C)n1-c1ccccc1 1463077867 NNNPDTINVVFJDU-OAQYLSRUSA-N 425.573 4.398 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(N(C)c2ccccc2)nc1 1466399696 VKCPYFNBQXMXLZ-UHFFFAOYSA-N 439.899 4.024 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(N)=O)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1468432916 CXROSWKHHIPELG-FQEVSTJZSA-N 440.341 4.203 10 10 IICE CCOC(=O)c1csc(CCNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)n1 1469824911 IGOIYRPYLWFWTL-UHFFFAOYSA-N 440.569 4.078 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C1 1470556136 MZUDIPWDBOWCHE-IPMKNSEASA-N 432.609 4.031 10 10 IICE Brc1cc(CNCc2cn(-c3ccccc3)nn2)ccc1N1CCCCC1 1474043531 KHSQPSZTTLNCFY-UHFFFAOYSA-N 426.362 4.310 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCOC3)n2CCOC(C)(C)C)c(C)n1-c1ccccc1 1510607398 UNXKQOVYDHNBOD-NRFANRHFSA-N 437.588 4.393 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3cccc(C(C)(C)C)c3)cc2F)CC1 1521010809 UPBVQNBAIKPDLX-IBGZPJMESA-N 441.591 4.349 10 10 IICE CCc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1S(C)(=O)=O 1524705768 ZLEZZSOTNPXIGC-MRXNPFEDSA-N 449.016 4.472 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC(=O)N2CCc3ccccc3C2)cc1 1529518125 OTAUVMPTSDOPBP-UHFFFAOYSA-N 441.535 4.483 10 10 IICE Cc1cc(CNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1535144384 YWDQMSIDUJOYKX-NRFANRHFSA-N 443.613 4.453 10 10 IICE Cc1cc(C)c(CC(=O)NCc2ccc(N3CCOCC3)cc2)c(C)c1Br 1542302438 SGZFORQNQWTIGK-UHFFFAOYSA-N 431.374 4.070 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@]2(F)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1544267349 DSQIYLAHBNYHNA-WATLYSKOSA-N 441.547 4.320 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)[C@@H]1CC 1546780794 PHZBLMXAXHDYAN-KCYOGNPLSA-N 432.572 4.034 10 10 IICE CCS[C@H]1CCCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1552571514 ONXJMULBSUSJOV-GHTZIAJQSA-N 447.624 4.495 10 10 IICE CCOC(=O)c1nn(CC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)c2ccccc2c1=O 1559370713 KUTQIGCOJBXLPT-UHFFFAOYSA-N 443.503 4.172 10 10 IICE C[C@@H](NC(=O)NCc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccc(N(C)C)cc1 1564596255 AYTATEOHJDUSAE-QGZVFWFLSA-N 426.561 4.338 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccn(-c2cc(F)cc(F)c2)n1 1566306379 JGCNKSCGWXIEPG-UHFFFAOYSA-N 436.256 4.281 10 10 IICE Cc1cc(CC(=O)NC[C@H](O)COc2ccc(C(F)(F)F)cc2)c(C)n1-c1ccccc1 1566334532 HBKYNTBSCBXENT-NRFANRHFSA-N 446.469 4.212 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1 1570514625 JJRJJYOKIBYTDK-ZDUSSCGKSA-N 426.296 4.058 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(F)cc(Br)c1N 1588193277 QKDPFNFAJIXUIH-UHFFFAOYSA-N 446.114 4.301 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC[C@H](C)N(C)C(=O)OC(C)(C)C)CCCC1 1616953581 LCABZTZAUVDVGY-KRWDZBQOSA-N 443.588 4.290 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CC[C@H](O)c1ccc(C(C)(C)C)cc1 1623928851 QSAZOADGALKHDB-FQEVSTJZSA-N 447.959 4.359 10 10 IICE CCOc1ccc(-c2nc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cs2)cc1 1627464458 NJTRCTXWORNROG-QFIPXVFZSA-N 438.597 4.308 10 10 IICE O=C(c1cc(F)cc(Br)c1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631218782 DGIIFMGINGIBLE-AWEZNQCLSA-N 426.257 4.254 10 10 IICE Cc1cc(C(=O)N[C@H](CO)C(=O)OCc2ccccc2)c(C)n1-c1ccc(C(C)C)cc1 1632169342 RMJDAJUMNIZDIY-XMMPIXPASA-N 434.536 4.052 10 10 IICE CNC(=O)CC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1640230054 VKGRADZLTXTQMS-SFHVURJKSA-N 446.389 4.378 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3C3CCCCC3)cc2F)C[C@@H](C)O1 1653176139 ZANJSRBFOJIQPB-SELNLUPBSA-N 431.596 4.100 10 10 IICE CCN(C)c1ccc(CN2CCC([C@@H]3OCCC[C@@H]3NC(=O)OC(C)(C)C)CC2)cc1 1658889617 MZUNTTUQAPHTGC-GOTSBHOMSA-N 431.621 4.427 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c(C)n1-c1ccccc1 1684319088 ZMEJSLDTFUYVOR-VWLOTQADSA-N 435.568 4.457 10 10 IICE CCN(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1686826805 PWEIUYCZBDSHPH-NQIIRXRSSA-N 432.609 4.033 10 10 IICE Cc1nnc(N2CCC([C@H](O)c3ccc(F)cc3)CC2)n1CCCSc1nccs1 1693475897 UZHHEDAASFMRQF-LJQANCHMSA-N 447.605 4.315 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1696364451 LRPAPBKLGQQWBK-OAQYLSRUSA-N 448.615 4.324 10 10 IICE Cc1cccc(-c2nnc(N3C[C@@H](C)OC(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1707589587 ZRWNKGINOLQUPG-LJQANCHMSA-N 434.588 4.075 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@H](C)N(CC)C[C@@H]2C)cc1 1710026142 YVEMDGRQSZPIIO-SFTDATJTSA-N 447.631 4.154 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1749987383 UKBYZLNRCLSZMZ-ICSRJNTNSA-N 429.609 4.051 10 10 IICE C[C@H]1C[C@@H](C)CN(C(C)(C)Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)C1 1751996318 XSYSYLIEUQVFKO-XQBPLPMBSA-N 441.620 4.228 10 10 IICE CC[C@@H](C)c1nnc(N2CCc3c(ccnc3O)C2)n1Cc1ccc(N(CC)CC)cc1 1752731064 YZEQCQATVDDUNR-GOSISDBHSA-N 434.588 4.349 10 10 IICE CC[C@@H]1CCCN1c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N(CC)CC)cc1 1763362421 RVUGPLIOSPJIKX-HXUWFJFHSA-N 447.587 4.199 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCO[C@@H](C)C1 1763747505 GXXRYURNCYQGEV-FHWLQOOXSA-N 445.583 4.081 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)cc1OC 1860086815 JCYPPTAWQLNHRG-CPNJWEJPSA-N 439.562 4.414 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)c1O 1860087891 YQCFBQRJMPWYNX-XMHGGMMESA-N 442.562 4.033 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1cccc(O)c1O 1952822969 FXBSRZPUOXDWSG-NZQKXSOJSA-N 445.471 4.495 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@@H](NCc1cc(Br)ccc1O)C2 2232281992 NPXSFUXFGZVIHC-OSMBCOQSSA-N 425.367 4.326 10 10 IICE COc1cc(C=C2C(=N)N3N=CSC3=NC2=O)ccc1OCc1ccc(Cl)cc1 2293462032 BTKVFXZYTLEJMZ-UHFFFAOYSA-N 426.885 4.177 10 10 IICE Cc1ccc(CNC(=O)C[C@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380723122 UDFNRLZGKAMSMH-HNNXBMFYSA-N 443.382 4.409 10 10 IICE Cc1ccc(CNC(=O)c2ccc(NC(=O)OC(C)(C)C)cn2)c(O)c1Br 2380746660 PGZHQMZFWLJHNQ-UHFFFAOYSA-N 436.306 4.135 10 10 IICE Cc1ccsc1[C@H]1Nc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2[C@H]2C=CC[C@@H]21 14456147 TVZJABPZMJNSFD-DBSRCYSRSA-N 430.595 4.340 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C/c3cc(Cl)ccc3O)SC2=S)cc1 15037878 YEVGWVQLNNGIBZ-BOPFTXTBSA-N 448.953 4.284 10 10 IICE O=C1C[C@H](N2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C(=O)N1c1ccc(Cl)cc1 34781799 JTXFAFAIAQZWRA-WNLSXJKCSA-N 446.912 4.012 10 10 IICE Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C)C3=O)c(Oc3ccccc3Cl)nc12 39835944 XEIZANJZXBPISK-XNTDXEJSSA-N 443.937 4.280 10 10 IICE Cc1ccccc1-c1nc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)no1 476370955 GHDICWBLGTYVIB-UHFFFAOYSA-N 443.551 4.083 10 10 IICE O=C1/C(=C\c2ccc(-c3cccc(F)c3)s2)SC(=S)N1CCN1CCOCC1 725903780 ACJMGVVMIZXRSW-QGOAFFKASA-N 434.583 4.088 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1C[C@H]1c1cc(F)ccc1F 741542523 RJCDKNDQHAPSQY-WMZOPIPTSA-N 440.412 4.240 10 10 IICE CCc1sc(-c2nnc(CN(CC(=O)OC)Cc3cc(Cl)ccc3O)o2)cc1C 749295849 BQMAWTFRFGOMNJ-UHFFFAOYSA-N 435.933 4.203 10 10 IICE CN1C(=O)c2cccc3c(S(=O)(=O)Nc4nc5c(s4)CCc4ccccc4-5)ccc1c23 753690227 DFKDEBWLAQXVQN-UHFFFAOYSA-N 447.541 4.453 10 10 IICE C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)N(Cc1ccccc1O)C1CCCCC1 764465790 FYYRDFFZMKDMEQ-SFHVURJKSA-N 434.540 4.035 10 10 IICE O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)N(Cc1ccccc1O)C[C@H]1CCCO1 764764588 ZRYVUPHFOWVFRQ-FGZHOGPDSA-N 438.572 4.472 10 10 IICE C[C@H](CCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NC(=O)OC(C)(C)C 764989455 YSPPEHCPSVKDFE-HZPDHXFCSA-N 441.519 4.066 10 10 IICE C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769047768 QUMDBEPXHLAOOC-SFHVURJKSA-N 442.554 4.399 10 10 IICE CC(C)c1noc2ncc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc12 771063307 FEJXAOPAKAQKIB-QGZVFWFLSA-N 428.920 4.100 10 10 IICE C[C@H](NC(=O)CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1 1125877745 MFSILBPMLXIDGO-KRWDZBQOSA-N 445.510 4.031 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C[C@H](C)S(=O)(=O)c3ccc(F)cc3)c2C)c1 1132264461 SGVZYABOGWMEBC-SFHVURJKSA-N 442.556 4.410 10 10 IICE Cc1cc(C(=O)N2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)c(C)n1-c1cccc(Cl)c1 1136563778 KBPFKUHMJGRNOH-RTBURBONSA-N 443.035 4.378 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(Cc3ccccc3)C[C@H](O)C(F)(F)F)ccc21 1138152170 BPESIAFAWDIZCS-QFIPXVFZSA-N 448.485 4.470 10 10 IICE COc1cc(CNC(=O)c2cc3cc(O)c(O)cc3s2)ccc1OCC(F)(F)F 1141762782 ZFWJBGYFUBUIFJ-UHFFFAOYSA-N 427.400 4.192 10 10 IICE Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1F 1148444485 SLGVTFLZIWVEDO-LBPRGKRZSA-N 441.381 4.182 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2CCNC3=O)c(C)n1-c1ccccc1Br 1161749471 SQNNGZKUDAQPHW-UHFFFAOYSA-N 438.325 4.395 10 10 IICE Oc1ccccc1CN(C[C@H]1CCCO1)c1ncnc(C(F)(F)F)c1Br 1185839004 VPQAKGAEEPYXBQ-GFCCVEGCSA-N 432.240 4.149 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)C2CC2)cc1 1225076987 VQQKYMMUZRCDDB-KRWDZBQOSA-N 430.955 4.498 10 10 IICE Cc1c(Br)cccc1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1264688864 BMOVFERKMUCFAQ-HUUCEWRRSA-N 449.364 4.369 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)C1 1264967749 ZHAYJIMPFLHKGB-UHFFFAOYSA-N 437.496 4.481 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1c(C)noc1C 1266353793 COLZQCVLQLPVCY-KTZOAPACSA-N 447.557 4.289 10 10 IICE CCOC1CC(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1 1289510817 MIICMQLGCQPHDY-UHFFFAOYSA-N 429.318 4.303 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2(Cc3cccc(F)c3)CCOCC2)cc1 1298322947 SPBJYASOHSDVOW-UHFFFAOYSA-N 448.538 4.496 10 10 IICE CN(Cc1cscn1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1298434344 YOTJAHOMWXOMSH-UHFFFAOYSA-N 442.658 4.270 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)CC[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1304750015 OETURABISCCLCB-WMZOPIPTSA-N 439.583 4.018 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)C(C)C 1314464516 ITKPSPPEDQBFKV-VWLOTQADSA-N 439.604 4.232 10 10 IICE CCCN1C[C@@H](C(=O)Nc2sc(C)c(-c3ccc(F)cc3)c2C(=O)OCC)CC1=O 1349145524 BBYTYUSZIUBPLC-HNNXBMFYSA-N 432.517 4.236 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3csc(C4CCCCC4)n3)CC2)cc1 1350977258 VMLZJWJHDYNOCW-UHFFFAOYSA-N 442.629 4.142 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1359794496 XRQNRBKPDCLSFN-KDURUIRLSA-N 445.702 4.408 10 10 IICE CCNC(=O)Oc1cccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1437183171 OGUIDUMUXOEHOD-UHFFFAOYSA-N 435.524 4.122 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(Br)cc2Cl)N(C)C)cc1 1439959926 ICHCZNBIKQMIPB-IBGZPJMESA-N 438.797 4.130 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3ccc(Br)cc3Cl)CC2)cc1 1446421400 SRPDYMMPEXPVMV-UHFFFAOYSA-N 437.765 4.393 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 1448681881 BODWQGXHQHRWQI-UHFFFAOYSA-N 438.484 4.078 10 10 IICE COc1ccccc1Nc1ccccc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1455221097 BAIWUEKOADHVLI-UHFFFAOYSA-N 430.552 4.121 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(N=S(C)(C)=O)cc2)cc1 1456089867 UTFOVBHOZJSIEJ-UHFFFAOYSA-N 427.492 4.316 10 10 IICE CC(C)[C@H](Cc1ccccc1)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1460774190 GZDVZHCEKPGZIC-QHCPKHFHSA-N 426.516 4.257 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 1469518677 PGBCDHJPLBFPJA-CLOONOSVSA-N 446.636 4.328 10 10 IICE C[C@H](Cc1cn(C)c2ccc(F)cc12)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1478810287 CVACNFCOOXBTGY-UTKZUKDTSA-N 439.531 4.345 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1503150019 BETGBAIPTBUFHB-KRWDZBQOSA-N 444.630 4.150 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C[C@@H](C)O1 1512479380 PYFLJXOJNDPXNY-HZPDHXFCSA-N 447.605 4.261 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)COc2ccc(Br)cc2Cl)cc1 1527595040 GPJYCUKQROKSTH-UHFFFAOYSA-N 441.753 4.085 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(C)nc4ccc(Br)cc34)C2)cc1 1528317167 AHFWAWUQZPFMIJ-INIZCTEOSA-N 440.341 4.323 10 10 IICE Cc1c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cccc1S(=O)(=O)NC1CC1 1532015485 OGNNSANINVLREI-UHFFFAOYSA-N 437.565 4.024 10 10 IICE CCCc1ccc(-c2nc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)sc2C)cc1 1540515958 YDAOPJKKQUCPFM-UHFFFAOYSA-N 445.566 4.400 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CC(C)(C)C)c3ccccc3)CC2)cc1 1540817982 JTIUHMZBJFOFME-ZXYASIKESA-N 449.595 4.194 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@]3(C)CCCS3)CC2)cc1F 1554960164 BFTQMRWRMZPUAS-QHCPKHFHSA-N 447.624 4.237 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NOCc1ccc(F)cc1Br 1564944913 BIGUPINILKENRZ-CQSZACIVSA-N 438.341 4.325 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2C[C@H](C(=O)OC(C)(C)C)c3ccccc32)c1 1565007491 PLPCKTIHERAGQE-GKCIPKSASA-N 426.513 4.331 10 10 IICE COc1ccc(CCC2CCN(C(=O)N[C@H]3CCN(c4ccc(OC)cc4)C3)CC2)cc1 1565055864 MHLXYYQUJDHAOR-QFIPXVFZSA-N 437.584 4.337 10 10 IICE Cc1cc(CCNC(=O)N(Cc2ccc(C(N)=O)cc2F)C2CC2)c(C)n1-c1ccccc1 1565162361 UDUCHMAEKBNENM-UHFFFAOYSA-N 448.542 4.249 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1-n1c(C)cc(C=O)c1C 1568471142 AWDRGKUVNKLDKS-OALUTQOASA-N 446.551 4.476 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C(=O)OC(C)(C)C)CC[C@H]3C)ccc21 1598054527 ZLLSSZSTCZBZAA-OXQOHEQNSA-N 428.573 4.487 10 10 IICE C[C@@H]1CCCN(CCCCn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)C1 1612800733 HFDNOSSNAGNPSB-HXUWFJFHSA-N 436.604 4.138 10 10 IICE COc1ccc2c(c1)N(C(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CCO2 1620580979 NDLRAYXVUYTBBE-UHFFFAOYSA-N 442.313 4.299 10 10 IICE O=C(CC1(CC(=O)Nc2nccs2)CCCCC1)NCc1ccc2cccnc2c1O 1630531724 BKLBOCGYYBLGLH-UHFFFAOYSA-N 438.553 4.383 10 10 IICE COc1ccc(-n2cc(C(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)nn2)cc1 1637244254 YSLCIZRGNWHPDY-GOSISDBHSA-N 428.492 4.385 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1 1686763574 KKABLPNKHOKYEA-FCHUYYIVSA-N 448.533 4.314 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Nc3ccccc3Cl)CC2)N(C)C)cc1 1687806313 DDUHCROCLFJLCS-QHCPKHFHSA-N 444.023 4.295 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H]2c2nncn2C)n1Cc1ccc(N(CC)CC)cc1 1708504984 RISGNNNMPCAHEK-NQIIRXRSSA-N 436.608 4.156 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCS[C@@H](C)[C@@H]2C)cc1 1710027013 VPIYFYSNNGZOHT-CMKODMSKSA-N 429.634 4.007 10 10 IICE CSC[C@@H]1CCCN1c1nnc(-c2cccnc2)n1CCCSc1nccs1 1731093624 LVSGOFAELQBNRR-INIZCTEOSA-N 432.644 4.311 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CC[C@@H](C)[C@@H]2C)cc1 1764941214 GVOIGQRXCRISRK-SQVLJLFZSA-N 441.620 4.131 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@H]3CCC(F)(F)C3)CC2)cc1F 1768705243 ZNAGQDAQQOEESO-INIZCTEOSA-N 437.510 4.311 10 10 IICE C[C@H]1CCCN(C(=O)Cn2c3c(c4ccccc42)CCN2C(=O)c4ccccc4N(C)[C@@H]32)C1 1860347509 SMFAOHRBFXMGTM-HFJWLAOPSA-N 442.563 4.047 10 10 IICE CC(C)(C)OC(=O)N1CCC(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1860601334 XKUVSGIREBRQJY-UHFFFAOYSA-N 434.492 4.048 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNCc2cc(Cl)cc(Br)c2O)C1 2031662754 MHPDQRTYMSPUIP-KZULUSFZSA-N 431.758 4.155 10 10 IICE CCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C2CCCCC2)C1=O 2053515910 PARJXZUDPJJTQA-UHFFFAOYSA-N 428.583 4.050 10 10 IICE O=C(CN1C(=O)C(=Cc2cccs2)SC1=S)Nc1cccc(Br)c1 2296881946 FCKCPARTQAHYKN-UHFFFAOYSA-N 439.381 4.351 10 10 IICE O=C1C(=Cc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)SC(=S)N1c1cccc(Cl)c1 2313533079 VDRZOZGJLHDQPD-UHFFFAOYSA-N 437.842 4.268 10 10 IICE O=C(O)CCCCCN1C(=O)C(=Cc2ccc(-c3ccc(C(=O)O)cc3)o2)SC1=S 2314486057 AODXBFQMCSQRFJ-UHFFFAOYSA-N 445.518 4.491 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CNC(=O)C=Cc3cccc([N+](=O)[O-])c3)cc2)c1 2328616049 GTBQPQDALKTLHR-UHFFFAOYSA-N 444.491 4.243 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@]2(NC(=O)OC(C)(C)C)CC2(C)C)c(O)c1Br 2381130866 GAAVDVZLJWDLLV-FQEVSTJZSA-N 441.366 4.115 10 10 IICE O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccnc1)N2 14547161 HEPZVZBTBUTURQ-RQTOMXEWSA-N 431.561 4.429 10 10 IICE O=C(COc1ccc(/C=C2\SC(=S)NC2=O)cc1)Nc1ccccc1C(F)(F)F 15055988 WXBOFLIIOJJAHZ-DHDCSXOGSA-N 438.452 4.212 10 10 IICE O=C1/C(=C\c2ccc(-c3cccc(C(F)(F)F)c3)o2)SC(=S)N1N1CCOCC1 35519095 JWGVNXXTARZINK-LFIBNONCSA-N 440.468 4.414 10 10 IICE Cc1cccc(/N=N/c2c(O)c(S(=O)(=O)O)cc3cc(S(=O)(=O)O)ccc23)c1C 98088389 XTNYFVZUKCSDKW-FMQUCBEESA-N 436.467 4.071 10 10 IICE C[C@@H](NCc1cc(Br)cc(F)c1O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 715828244 OAAFXEQZTWGUSA-OLZOCXBDSA-N 431.346 4.419 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(c2cccnc2)CC1 768948189 DKCHTYFTWGJWGF-LJQANCHMSA-N 430.499 4.241 10 10 IICE CC[C@@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nc2ccccc2[nH]1 769037571 PKGAGHCVZBVIIA-JOCHJYFZSA-N 446.599 4.045 10 10 IICE CCc1noc(C)c1-c1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 771727463 ZAUOTEQRSIEYQC-GXDHUFHOSA-N 446.579 4.491 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCC1(CCOCc2ccccc2)CC1 805298926 WAGLPQWCTBPBOP-UHFFFAOYSA-N 433.346 4.341 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)/C=C/c3ccc(Br)o3)cc2F)C[C@@H](C)O1 917709421 IADAURYTEFPHDY-QLNSKBQOSA-N 437.309 4.124 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(F)c([N+](=O)[O-])c1 1124331832 LKTYTEPPDAYQFT-CXUHLZMHSA-N 449.460 4.103 10 10 IICE CCc1nc(C)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1128505703 AWSCZGBQJPVTMP-UVTDQMKNSA-N 435.571 4.383 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CC[C@H]1c1ccc(Cl)cc1F 1129661087 FGFBCFDDLGVHBM-RDJZCZTQSA-N 438.877 4.404 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H](c1ccncc1)C1CC1 1134646184 ICXCPZQWZFBSOM-LVSKKATPSA-N 441.553 4.080 10 10 IICE Cc1cccc2c1C[C@H](C(=O)NCc1ccc3cccnc3c1O)N2C(=O)OC(C)(C)C 1162612664 NXBSXQMJZQFYLX-HXUWFJFHSA-N 433.508 4.231 10 10 IICE Cc1ccc(CN2CCO[C@H](CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2)cc1 1163942274 RMAAUEARKSNBQF-HSZRJFAPSA-N 445.519 4.447 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CN(C(=O)OC(C)(C)C)c2ccccc2)cc1 1164597362 KXLGZXCCHVJFKO-UHFFFAOYSA-N 427.545 4.032 10 10 IICE CCS[C@H]1CCCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 1190936119 VHLKEDXXDZUAKA-SJORKVTESA-N 436.577 4.397 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](C)c3ccc(F)cc3OC(F)F)C2)cc1 1225548188 DZVUXKGQBVJCKQ-GJZGRUSLSA-N 437.462 4.322 10 10 IICE CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1251980679 CNAHKESUPPDVBW-UGKGYDQZSA-N 446.636 4.423 10 10 IICE Cc1nc(-c2ccn(C)n2)sc1CC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1264452670 XRCZCHQMCVDWBT-UHFFFAOYSA-N 449.580 4.283 10 10 IICE Cc1ccc([C@H](NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)[C@H](C)S(C)(=O)=O)cc1 1297147332 CQVDHRPFWSPNKR-FDDCHVKYSA-N 442.556 4.446 10 10 IICE COC(=O)c1ccc(CNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)s1 1312894711 NZBCKRHLKMYBQR-UHFFFAOYSA-N 427.526 4.106 10 10 IICE CCOc1ccc([C@@]2(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2(Cl)Cl)cc1 1356250431 FQZHGSGOIXECLW-HXUWFJFHSA-N 425.331 4.422 10 10 IICE Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1357835139 CXWXTHUQMYFKNE-HZPDHXFCSA-N 429.492 4.203 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCNc3nccc(C(F)(F)F)n3)c2C)c1 1444353636 WGEUVUXQYYTPTR-UHFFFAOYSA-N 431.462 4.362 10 10 IICE CN(OCc1ccccc1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1446532560 TXAFAPLXTDLSEB-AQTBWJFISA-N 430.526 4.007 10 10 IICE CC(C)Oc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1[N+](=O)[O-] 1465951018 HKBJFCGHCFCWFD-GOSISDBHSA-N 447.919 4.135 10 10 IICE CCOC[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1503139022 OLHIEEDKYOUQFH-NRFANRHFSA-N 443.661 4.256 10 10 IICE CN(Cc1ccccc1F)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1503486497 AVVFTMBZEWUWQK-MRXNPFEDSA-N 433.578 4.196 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCCC(F)(F)C1 1525799011 HNURRTHYCFHGHL-QTNMRXCUSA-N 428.501 4.111 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CSc3ccccc3Br)C2)cc1 1526246088 BMXXSMNHCWQODX-HNNXBMFYSA-N 435.387 4.193 10 10 IICE CC(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1526967596 IOWDGJQQXZNPGR-NQIIRXRSSA-N 433.593 4.030 10 10 IICE CC(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1526967598 IOWDGJQQXZNPGR-WIYYLYMNSA-N 433.593 4.030 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCc2ccccc2S(C)(=O)=O)c1 1534461471 FPUVRKIAWIUVKM-UHFFFAOYSA-N 430.957 4.124 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1(c2cccc(F)c2)CC1 1538706064 YGCUDOLHLQLZQF-LDADJPATSA-N 444.528 4.362 10 10 IICE Cc1cc(C(=O)Nc2ccc(OCCO)cc2)c(C)n1-c1ccccc1Br 1545632334 IODNBTWTLWXGSO-UHFFFAOYSA-N 429.314 4.480 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC[C@@H](C[C@H]4CCOC4)C3)nnc2C(C)(C)C)cc1F 1552836757 JLLFSGRDDNSDGN-AZUAARDMSA-N 443.611 4.472 10 10 IICE CS[C@H]1CCCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1555885814 PGKYAULXCYGXQP-QFIPXVFZSA-N 443.661 4.083 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](N(CC)CC)C2)sc(C)c1-c1ccccc1 1559577030 URVLNAWQAALWJO-IBGZPJMESA-N 443.613 4.255 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(c2cccc(Cl)c2C)CC1 1564946170 LDVBWGHDJFKDJI-SFHVURJKSA-N 429.008 4.486 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)O[C@]3(CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613204374 RSFHXUFQGQLYOR-WZOHSFFVSA-N 441.620 4.070 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@]3(CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613204375 RSFHXUFQGQLYOR-ZYLNGJIFSA-N 441.620 4.070 10 10 IICE CC(C)[C@@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1617538608 GMENFQGBXICUEY-QJMRKGMQSA-N 445.554 4.182 10 10 IICE Cc1nc(C2CCC2)sc1CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634585 BTKSSDRMLJDFAK-SFHVURJKSA-N 434.005 4.401 10 10 IICE CCN1C[C@@H](CN(C)C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)Oc2ccccc21 1624611625 OVMUZRIIPLOPBH-HSZRJFAPSA-N 431.536 4.266 10 10 IICE O=C(Cc1ccc(O)c(O)c1)NC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 1625736082 FYAUGJSSDHZKDF-LJQANCHMSA-N 442.968 4.271 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3cc(C(F)(F)F)cc(Cl)n3)CC2)cc1 1626318923 NFCVEDAMMQIXAX-UHFFFAOYSA-N 427.854 4.044 10 10 IICE C[C@@H]1[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)[C@@H]1c1ccccc1 1628495580 MVTGATFTDYSXDT-ZMVGRULKSA-N 437.584 4.484 10 10 IICE CCn1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(-c2ccccc2)n1 1630263421 WWFAIAZAAWTSLE-FQEVSTJZSA-N 438.959 4.323 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)CC2)cc1 1630713385 JNEIUEPMNQCPDC-UHFFFAOYSA-N 442.274 4.402 10 10 IICE Cc1ccc(C(=O)N[C@H](Cc2ccccc2)c2ncon2)cc1-n1c(C)cc(C=O)c1C 1631494143 WXVLUGYINIIUBF-JOCHJYFZSA-N 428.492 4.312 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(OCCN(C)C(=O)OC(C)(C)C)c1 1633347317 SBPKKQAGGUNIMT-UHFFFAOYSA-N 441.572 4.237 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1C 1633997013 TWUCFJNCEWKFOZ-UHFFFAOYSA-N 437.565 4.404 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(Cl)c(CN(C)CCO)c3)c2C)cc1 1634837087 RIVUADSOIYRIMD-UHFFFAOYSA-N 441.959 4.433 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3ccccc3C(=O)OC(C)(C)C)CC2)cc1 1637346867 FUJHZMJXXIDBAJ-UHFFFAOYSA-N 439.556 4.072 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)COCc1nccn1C 1638240719 FWDXUDHKEZDLRM-IBGZPJMESA-N 446.473 4.248 10 10 IICE C[C@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1644258511 DVNHSDPIEYUKOK-MORSLUCNSA-N 442.437 4.276 10 10 IICE O=C(CCc1cccc(OCc2ccccc2)c1)NCc1ccc(N2CCC(O)CC2)cc1 1646435722 UHFOGQLFFHDPKJ-UHFFFAOYSA-N 444.575 4.476 10 10 IICE CC1CCC(N(CC(=O)NCc2ccc(N(C)C)cc2)Cc2ccc3c(c2)OCO3)CC1 1652434998 KTIAHRTUFDUDSO-UHFFFAOYSA-N 437.584 4.178 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@]34CCN(C(=O)OC(C)(C)C)C4)cc2)CC1 1655839025 VYMFIVQSQOOACM-VWLOTQADSA-N 429.605 4.277 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccccc4Br)CCC3)C2)cc1 1674326447 JPLYVYYVKJSFLB-INIZCTEOSA-N 444.373 4.415 10 10 IICE CC[C@@H](C)[C@H](Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C)OC 1693974211 MOMJNQPNJTYVDA-KNQAVFIVSA-N 443.636 4.362 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC[C@H]1CCOC1 1695513324 PQXJSGJOBJWKTH-OAQYLSRUSA-N 437.588 4.252 10 10 IICE Cc1nnc(N(C)Cc2nc(C(F)(F)F)cs2)n1Cc1ccc2c(c1)CCCN2C 1707863156 SKYMCWDVUCXVLE-UHFFFAOYSA-N 436.507 4.129 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(=O)N(C)C 1709704127 ISZZYNKQYWNASD-UHFFFAOYSA-N 436.604 4.457 10 10 IICE CS[C@@H](C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1731040885 NGYQSCJJQOXMGI-SFHVURJKSA-N 431.650 4.091 10 10 IICE CC[C@@H](Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1764241391 UVZQZQFWZNCMIU-QFIPXVFZSA-N 434.588 4.310 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1765282447 JCNMNSQMSHMJHA-OAQYLSRUSA-N 445.702 4.410 10 10 IICE CCN(CC)CCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CCCC2)C1=O 1873169797 VPLCZXISFDYKRI-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CC[C@H](NC[C@@H]1[C@H]2C[C@H]2CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 1906022757 DUSZTTAQKKNCFD-ZFZWDLNGSA-N 425.367 4.451 10 10 IICE [N-]=[N+]=NC[C@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2I)C1 1912186132 AAMFIYWXTVBFJF-SSDOTTSWSA-N 425.057 4.370 10 10 IICE CC(C)(C(=O)O)[C@@H](NC(=O)OCc1ccccc1)c1cc(Br)cc(F)c1O 1951965987 HGTKLUUWVUTXMK-INIZCTEOSA-N 440.265 4.372 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNCc1cc(Br)ccc1O)CC(F)(F)F 2053667894 RSVFBZAGMYRVPP-GFCCVEGCSA-N 427.261 4.090 10 10 IICE CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCC(=O)Nc1ccc(C)cc1 2297366086 UVDOZLLCUFYVNR-UHFFFAOYSA-N 442.562 4.242 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccccc3F)C2=O)cc1OC)C(=O)O 2314933348 VIFUKCVXVRDAPW-OAHLLOKOSA-N 447.509 4.482 10 10 IICE COC(=O)c1ccc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)cc1 2321698474 MNGOPFHCYZMJKK-UHFFFAOYSA-N 429.548 4.205 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C23CCC3)c(O)c1Br 2352684820 TZYIHFRBIRRTGM-CABCVRRESA-N 425.367 4.389 10 10 IICE CC[C@@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3cccc(C)c3)s2)C1=O 11636312 KSLIHZXGMDRGST-INIZCTEOSA-N 433.624 4.400 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14470800 FRVPGFYRPRNZIK-AVYPCKFXSA-N 433.917 4.325 10 10 IICE CCN(CC)c1ccc(N2C(=O)/C(=C\c3ccccc3OCC(=O)O)SC2=S)cc1 16909834 QEQGYYXXUZOARV-CPNJWEJPSA-N 442.562 4.402 10 10 IICE Cc1ccc2ccc([C@H](Nc3ccc(S(N)(=O)=O)cc3)c3ccc(F)cc3)c(O)c2n1 54621262 QBFQPDGTYOJEGY-OAQYLSRUSA-N 437.496 4.237 10 10 IICE COc1ccc(N2CCN(c3nccc4ccc(C(=O)N5CCCCC5)cc34)CC2)cc1 65002071 JKDJKSXMIPHUTC-UHFFFAOYSA-N 430.552 4.196 10 10 IICE CC[C@H](NC[C@H]1CN(C)CCN1Cc1ccccc1)c1cc(Br)ccc1O 694741859 MBMMFESSCDTUHC-FPOVZHCZSA-N 432.406 4.012 10 10 IICE CC[S@](=O)CCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 739581056 ZOMSEYJJUUKNKC-YLFKJBHBSA-N 447.604 4.286 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccccc3Sc3ccccc3)CC2)cc1 742056742 AYRHCTVKIBBZDD-UHFFFAOYSA-N 447.604 4.398 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(I)c(Cl)c1 749920200 VSXAVYRIZOFWTM-UHFFFAOYSA-N 442.684 4.034 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCO[C@@H]2c2cnn(Cc3ccccc3)c2)cc1 752826847 QLDDBXMJOYLSFQ-LOSJGSFVSA-N 432.568 4.172 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)n1 771269731 PZOUDLYLGUACER-CQSZACIVSA-N 429.571 4.294 10 10 IICE CCN1CC[C@@H](NCc2cccc(Br)c2O)[C@H]1c1cc(F)c(F)c(F)c1 782391237 JPEAAMSNYSVFQM-SJLPKXTDSA-N 429.280 4.497 10 10 IICE COc1cc(NS(=O)(=O)c2ccc(Br)c(Cl)c2Cl)ccc1O 797819459 JTFBGPXFRSGRNQ-UHFFFAOYSA-N 427.103 4.271 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc([N+](=O)[O-])ncc1Br 798153688 ZQJMIBNMAGCAMO-UHFFFAOYSA-N 433.306 4.015 10 10 IICE CO[C@@](C)(c1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1)C1CC1 810336278 GBXBGXCBRLQUAX-FIIODCPWSA-N 435.596 4.237 10 10 IICE Cc1ccccc1[C@H](C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918023558 CJOUHBSYLDRNSO-UFYCRDLUSA-N 427.564 4.057 10 10 IICE Cc1cc(C(=O)COC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)c(C)n1-c1ccc(F)cc1 920721556 XWWHGKZTKIXVSR-GOSISDBHSA-N 442.531 4.244 10 10 IICE CON(C[C@H]1CCC[C@@H](C)C1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1141631574 GWFHANJBDZDGOS-CABCVRRESA-N 438.571 4.084 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)cc1 1228489459 ZWDAOWQRJNZGOT-BHIFYINESA-N 427.593 4.068 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4ccc(C)c(C)c4)CCC3)CC2)cc1F 1248090767 UDUGFMLNOJPJLC-UHFFFAOYSA-N 425.548 4.405 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H](c2ccc(F)c(F)c2)c2nccn2C)cc1 1251504722 JAWVCQBKIXKAOV-QFIPXVFZSA-N 441.526 4.476 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O 1296609010 ITGPTWKNHSTROE-LJQANCHMSA-N 443.519 4.355 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1296922876 MDLPIAZTWISZGT-PMACEKPBSA-N 431.600 4.469 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1299752640 WDNLCGGJBFAXKP-FQEVSTJZSA-N 433.603 4.491 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1313121145 VRURGYCQHNVSLM-OFVILXPXSA-N 435.616 4.168 10 10 IICE COC(=O)C[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1cccs1 1354574597 CJSICILTTWPHCH-GOSISDBHSA-N 426.538 4.011 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2nc(C)nc3sc(C)c(C)c23)cc1 1437387662 XROONDDAGMKTEJ-UHFFFAOYSA-N 444.626 4.312 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H](O)c2ccc(Cl)c(Cl)c2)cc1 1442617181 PGVFHRWHJSQSFZ-WIYYLYMNSA-N 437.367 4.301 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1449116511 FVZDMRMZZVEWKB-DJJJIMSYSA-N 442.339 4.021 10 10 IICE Cc1nc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)sc1C 1463206481 HWCPGFAIEALZNB-UHFFFAOYSA-N 428.315 4.484 10 10 IICE Cc1cc(C(=O)N[C@H](c2nc(=O)o[nH]2)C(C)(C)C)c(C)n1-c1ccc(Br)cc1 1469341591 IBCSKPPNMFZHSB-MRXNPFEDSA-N 447.333 4.050 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3[C@H]4CC[C@H]3CC(CC(F)(F)F)C4)C2)cc1 1478861229 WNRBZYJBCUMNNW-SNRMKQJTSA-N 425.495 4.427 10 10 IICE CCCN1C[C@@H](C(=O)Nc2sc(C)c(-c3ccc(C)cc3)c2C(=O)OCC)CC1=O 1523247223 QDMBLYLCAYJFKT-KRWDZBQOSA-N 428.554 4.406 10 10 IICE COc1c(Br)cccc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1525593668 LSXVGMLBRZAJQY-UHFFFAOYSA-N 436.261 4.485 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)C2CC2)cc1 1526185593 LIHOSGBHKJSKLL-XMMPIXPASA-N 435.568 4.435 10 10 IICE CC1=C(C)C[C@@](C)(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 1527974243 SREWQODZXPKUEM-VWLOTQADSA-N 437.563 4.085 10 10 IICE CO[C@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C1CCCC1 1530035428 FVCDHGJPRDTSAX-QRYYFKOISA-N 438.640 4.051 10 10 IICE Cc1cnc([C@H](C)CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1538119367 RGQFPBVIGUWHQQ-DZZSIBQASA-N 449.598 4.102 10 10 IICE CCOC(=O)[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1542488999 VRDVLWNVWIWLRS-LJQANCHMSA-N 433.346 4.414 10 10 IICE C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC(=O)N(C(C)(C)C)C3)c2C(=O)OC(C)(C)C)C1 1544362687 YYGAXGVQBLLQLN-KGLIPLIRSA-N 434.602 4.414 10 10 IICE COCC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccco1 1546122935 CBJCVAZOANEEFB-KRWDZBQOSA-N 432.318 4.352 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CC[C@@H](OCC(C)C)C2)cc1 1547449150 UASPQHIINZWYNZ-DHIUTWEWSA-N 441.620 4.275 10 10 IICE COCCN(CC(C)C)c1nnc(-c2cccc(C)n2)n1Cc1ccc2c(c1)CCCN2C 1555543583 FOVNQUQFJUTUDC-UHFFFAOYSA-N 448.615 4.188 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c(C)n1-c1ccccc1Br 1565611581 KZIBPJNURCOAOR-GOEBONIOSA-N 446.389 4.376 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Oc2ccc(NC(C)=O)c(F)c2F)CCCC1 1587311954 YAPISDWJWXYCNY-UHFFFAOYSA-N 428.435 4.371 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccc(F)cc2)no1 1595584143 MMWFXERUHYDUAM-GOSISDBHSA-N 429.879 4.234 10 10 IICE COc1cccc(-c2noc(SCC(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)n2)c1 1596952902 IXMMBIWDINRLOS-UHFFFAOYSA-N 440.569 4.341 10 10 IICE CCOC(=O)c1cnn2c(C(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)ccnc12 1597567481 PEOYLPVROJSBAU-KRWDZBQOSA-N 444.491 4.015 10 10 IICE C[C@@H]1CCCN(CCCCn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1612803929 QUVAYPHHJFHTGG-OAQYLSRUSA-N 448.615 4.118 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)c2)n1 1625319308 YTNRBNAQUHJVRL-UHFFFAOYSA-N 431.540 4.413 10 10 IICE CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1627005827 GWHFHIYLDCVCDL-OAQYLSRUSA-N 433.593 4.002 10 10 IICE COc1cc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc(OC)c1OC 1628685059 VYEHCFACFVUBPA-UHFFFAOYSA-N 436.508 4.171 10 10 IICE CC(C)(C)[C@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1634338557 GTHLGDZDYQZTCS-LEWJYISDSA-N 428.621 4.183 10 10 IICE CCCN(CC(F)(F)F)C(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1641743488 NKHRRSCWJDEYOG-UHFFFAOYSA-N 443.510 4.265 10 10 IICE Cc1cc(C(=O)NCc2ccc(OCC(F)(F)F)nn2)c(C)n1-c1ccc(Cl)cc1 1645212592 SUNLNQUNWZKKLU-UHFFFAOYSA-N 438.837 4.409 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(Br)cc(Cl)c3O)C2)cc1 1648855077 PBWHFGWOVRRBED-LBPRGKRZSA-N 439.737 4.073 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@H]1C[C@@H]1CN(C(=O)c2cc(O)cs2)c2ccccc21 1652447835 LTTMZOIVZJOUAE-HZPDHXFCSA-N 444.553 4.224 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2)c1ccc(N(C)C)cc1 1680279975 HCPZNTOSJOGEDK-OVQGTLEDSA-N 430.593 4.291 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2CC2(C)COC2)c(C)n1-c1ccccc1 1692989326 TWFBXPOXPCCOMG-UHFFFAOYSA-N 433.478 4.388 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1707254445 XCOLJXXCCNFZBZ-MRXNPFEDSA-N 434.510 4.301 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708430562 OOFAFOZFBQHDOX-GBESFXJTSA-N 429.634 4.007 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1724196535 RZLNVYVZXCKSMC-HKUYNNGSSA-N 434.588 4.066 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)[C@H]2CCSC2)cc1 1746089985 LGGGIILDSMTAOH-NRFANRHFSA-N 436.629 4.485 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CCc1ccsc1 1747720702 QCEIYZRNXZJJHL-UHFFFAOYSA-N 439.629 4.353 10 10 IICE Cc1nnc(N2CCC(CCN3CCCC[C@H]3C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1751903493 PFSVASSBLPKSTE-LJQANCHMSA-N 442.627 4.321 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCOCC3(CCC3)C2)cc1F 1768496280 FYPUXSJYKPSTGD-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@@H](C1CCCCC1)N(C)C 1768680961 BACMHDNATPGYBQ-QHCPKHFHSA-N 448.615 4.116 10 10 IICE CC(=O)Nc1cccc(C(=O)N(c2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)c1 1859889021 DOCKQPIGZKUDFX-UHFFFAOYSA-N 426.472 4.476 10 10 IICE CCCCCNC(=O)CCn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860345097 TUDKHAIRZJSBSA-UHFFFAOYSA-N 428.536 4.271 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc2c(c1)ncn2Cc1cccnc1 1891020784 ACIDVXKHKFRASV-RDPSFJRHSA-N 437.547 4.398 10 10 IICE CCN1CC(=Cc2ccc(N3CCOCC3)cc2)c2nc3ccccc3c(C(=O)O)c2C1 2040457899 BZVMNQGYDICVDE-UHFFFAOYSA-N 429.520 4.146 10 10 IICE O=C(CN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccc(Br)cc1 2296807602 BKLUYGWAZHEARK-UHFFFAOYSA-N 439.381 4.351 10 10 IICE Cc1ccc(CN(C)CC(C)(C)CN2C(=O)c3ccccc3C2=O)c(O)c1Br 2327792441 JXVCJXUIRYNAOD-UHFFFAOYSA-N 445.357 4.217 10 10 IICE Cc1ccc(CN2CCCN(Cc3ccccc3)CCOCC2)c(O)c1Br 2381132127 WSLYDSQEXPBTIA-UHFFFAOYSA-N 433.390 4.188 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@H]3C=CC[C@@H]32)c1O 14459729 BNXIVOFWWPVMKY-CKJXQJPGSA-N 428.554 4.304 10 10 IICE CC(=O)c1cccc(N2C(=O)/C(=C\c3ccccc3OCCC(=O)O)SC2=S)c1 16911438 ZTCKTPLXWUEXRQ-LDADJPATSA-N 427.503 4.149 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1/C(=O)N(c2cccc(Cl)c2)C(=S)N=C1O 33405997 XFYQZJJQWWYGSS-VGOFMYFVSA-N 432.885 4.037 10 10 IICE O=C(NC[C@H]1CCCCN1Cc1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 743358984 PLKDNLUQZNURKP-DNQXCXABSA-N 437.584 4.138 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccc(F)cc2F)cc1 749473923 XUTOPMUAOTTWGB-RTFZILSDSA-N 441.522 4.121 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(C2CCOCC2)CC1 752680567 HYVSCDFUZUQCCU-IBGZPJMESA-N 437.531 4.105 10 10 IICE Cc1cc(C(=O)N[C@H]2CC[C@@H](N3CCN(C)CC3)CC2)c(C)n1-c1cccc(Cl)c1 763228562 FSCAQZFTHIIPAG-OYRHEFFESA-N 429.008 4.036 10 10 IICE Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773994555 NOSHQUWMDQFMGR-CQSZACIVSA-N 445.489 4.389 10 10 IICE C[C@@H](c1ccccc1)N1CCC(NC(=O)NCc2cc(Br)ccc2O)CC1 805123763 AILSSTZIKFFTHK-HNNXBMFYSA-N 432.362 4.180 10 10 IICE CCOc1c(Cl)cccc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1125187853 JTMHNXVKOYILIT-HOTGVXAUSA-N 434.939 4.350 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccn(S(=O)(=O)c2ccc(C)cc2)c1 1155704656 MZPSALFWIIJSIN-UHFFFAOYSA-N 426.538 4.182 10 10 IICE COc1ccc(N(CC(C)C)C[C@H](O)COc2cc(F)cc(Br)c2)cc1 1195256579 AJYPLPMXHSWWSR-SFHVURJKSA-N 426.326 4.499 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC12CCN(C(=O)OC(C)(C)C)CC2 1230199277 AVZFZXRBWJSQMJ-IBGZPJMESA-N 444.620 4.177 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1 1230813250 RUQKSUWSZJMLDB-TZIWHRDSSA-N 437.540 4.211 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@H]3CCCC[C@@H]3c3ccccc3)cc2)CC1 1251102674 XPTPTQIBYKZAKU-ILBGXUMGSA-N 448.611 4.162 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)cc1 1264452237 GVCZMWHYXQOFTC-QFIPXVFZSA-N 439.462 4.346 10 10 IICE CCN(CCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1C 1264593071 BILFLBITDBBBHX-UHFFFAOYSA-N 432.612 4.359 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccnc3SCc3ccc(F)cc3)CC2)cc1 1266268151 BKGZHHSSYBNFBA-UHFFFAOYSA-N 437.540 4.484 10 10 IICE CCN(C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(C)(C)C 1274138228 PSVBJKQSKQMSCZ-UVTDQMKNSA-N 441.416 4.297 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCC[C@@H](C(F)F)C1 1289423490 MDYLTEUJFLXRCR-GOSISDBHSA-N 428.531 4.188 10 10 IICE CCCc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 1293087174 DCUPSVLTEHKPLS-UHFFFAOYSA-N 439.575 4.199 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)cc1 1293125570 MXIMCYPTSYCGCP-SFHVURJKSA-N 441.572 4.455 10 10 IICE Cc1ccc2oc(CNC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)cc2c1 1300879222 AZWPZNQLNGKTNA-UHFFFAOYSA-N 442.518 4.239 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1306442465 OJKGKKHFNHCLRH-HYBUGGRVSA-N 448.615 4.162 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@H]1CCCCO1 1316054852 SKTFCEJVFQLZRJ-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cccc4ccccc34)n2)cc1 1323613792 INULBDHVFSCUEC-UHFFFAOYSA-N 437.546 4.400 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CC[C@H](C)C2 1349304979 OMKJDVKMQUDZGS-GJZGRUSLSA-N 432.586 4.169 10 10 IICE Cc1ccc(C(F)(F)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 1354783922 IDTAJGVBQPJOCP-UHFFFAOYSA-N 428.401 4.259 10 10 IICE Cc1cc(C(F)(F)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cnc1Cl 1355130399 LXVQNGHQUINXCW-KBPBESRZSA-N 441.881 4.204 10 10 IICE CC(C)COc1cccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1355131196 UESBDFFKALKGHX-OALUTQOASA-N 444.547 4.169 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3cc(Cl)cc4ccccc34)cc2)C1 1358168301 PIMICOAHIQXFCW-IBGZPJMESA-N 435.955 4.054 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc(C)n(-c2ccccc2Br)n1 1360273234 HOLVJKZKCHTGEQ-UHFFFAOYSA-N 427.346 4.248 10 10 IICE CC(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1438307349 YVIQWPNEGZPOHP-RUZDIDTESA-N 446.526 4.078 10 10 IICE COc1cccc(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1439871112 FCAGHPDGIUWYNQ-UHFFFAOYSA-N 437.297 4.349 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2cccc(N3CCOC3=O)c2)cc1 1444270464 RMQLYGHNNVLYAA-SFHVURJKSA-N 445.519 4.283 10 10 IICE Cc1c(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)nnn1Cc1ccccc1F 1448445316 JNZMRZLQEAVKSX-UHFFFAOYSA-N 431.471 4.246 10 10 IICE C[C@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)cc1 1460741808 QRGVSCZIJKKTPF-ZDUSSCGKSA-N 428.401 4.240 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1cccc2oc(C)nc12 1471258847 QECXTYKRQGIRAP-UHFFFAOYSA-N 432.318 4.379 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1 1478947134 SXFMKMQKRQOPEX-UHFFFAOYSA-N 430.593 4.266 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CC[C@@H]2COCCO2)c(C)n1-c1ccccc1 1510607432 VGBPHIXLFHLBKR-JOCHJYFZSA-N 437.588 4.250 10 10 IICE COc1cc(N2CCN(C(=O)C3(Cc4cccc(Cl)c4)CC3)CC2)cc(OC)c1OC 1528358230 HSUTYNDCEMLKLP-UHFFFAOYSA-N 444.959 4.037 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)n(-c4cccc(C(F)(F)F)c4)n3)CC2)cc1 1534017137 HSDQUWKIBQIKND-UHFFFAOYSA-N 444.457 4.171 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1 1540537760 JCJYKLXFIGVHHL-RUZDIDTESA-N 441.547 4.242 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(-c2ccc(Cl)cc2Cl)on1 1542301008 UYCSSYJXTVEZNH-UHFFFAOYSA-N 432.307 4.415 10 10 IICE CCOC(=O)[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1542488827 PXOXGZOPZNXCLB-IBGZPJMESA-N 433.346 4.414 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ncc(Br)cn2)cc1 1543115336 MXUYQETVHPPMIV-UHFFFAOYSA-N 441.329 4.161 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2C)cc1 1556611493 UHZMBOTXPWRLAB-NRFANRHFSA-N 448.441 4.465 10 10 IICE CC[C@@H](c1ccccc1)N(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)C(C)C 1560021554 NRQUANHELQWSCD-AHWVRZQESA-N 425.617 4.040 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC/C=C\c2ccc(Br)cc2)N(C)C)cc1 1564815096 UUEGAGIEAZHQOQ-RMUOZIPVSA-N 445.405 4.130 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4ccc(F)cc4)CC3)C2)cc1 1564962510 LYSLOOWASPXPSG-NRFANRHFSA-N 425.548 4.325 10 10 IICE CC(C)(CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)Cc1ccc(Cl)cc1 1584506739 HSTUEBKMKVMJIR-UHFFFAOYSA-N 442.003 4.317 10 10 IICE CCOC(=O)[C@H]1CCCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1586961125 HAHNUBOFAYWXDZ-INIZCTEOSA-N 433.346 4.272 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc(C(F)(F)F)c1O 1596392693 JSPQTNZDUPMEGW-UHFFFAOYSA-N 448.363 4.196 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1nc2c(s1)C[C@H](C)CC2 1603311522 SCQGPYBDHXKFON-MRXNPFEDSA-N 425.602 4.448 10 10 IICE Cc1ccc([C@H](C)N(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)c1 1615239386 CVXDMLMXGZSCEI-NJYVYQBISA-N 441.591 4.365 10 10 IICE CCOC(=O)c1c(C)[nH]c(C(=O)CN(Cc2ccco2)c2ccc(OC)c(F)c2)c1C 1615887219 PPAOXTOYYWWHDT-UHFFFAOYSA-N 428.460 4.438 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc21 1622634520 ANPBUUOQORKDKX-GOSISDBHSA-N 442.947 4.076 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3nc4cc(Br)cnc4[nH]3)ccc21 1628266217 QUMOKZZGEJWJSS-UHFFFAOYSA-N 442.317 4.191 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cc(OCc4ccccc4)ccc3O)c2)CC1 1633444383 PMAITTFIHYHCDZ-UHFFFAOYSA-N 431.536 4.365 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)CC(=O)c2ccc(F)cc2)C1 1635622632 DKDFDVYSEGFIKL-GOSISDBHSA-N 435.543 4.325 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)C[C@@H](O)COCc3ccccc3)c2C)c1 1637578300 ULTSBCGLFPGVIV-RUZDIDTESA-N 435.568 4.122 10 10 IICE CCc1cccc2c1N(CC(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)CCC2 1657668062 FMBUCLUZBPYBBW-OALUTQOASA-N 439.575 4.071 10 10 IICE COc1ccc([C@@H](O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1686827113 WGMDTXYAGWXPFW-UQBPGWFLSA-N 439.600 4.156 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1686856087 HAUNWYMWIIXHMP-FPOVZHCZSA-N 434.584 4.334 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)N(C)C(=O)OC(C)(C)C 1693999869 VVGOMWFJKRXKMK-DLBZAZTESA-N 431.581 4.389 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@@H](C)[C@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1708566220 QVLJUMZXOYZNJA-KSZLIROESA-N 447.624 4.146 10 10 IICE CCCN(CCC)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709730688 ITHOWVMDBGHOID-UHFFFAOYSA-N 448.615 4.224 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@](C)(OC)C3CC3)CC2)cc1 1730180513 REFBNNUIJGCRNP-RUZDIDTESA-N 441.620 4.017 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@@H]4CCCOC4)n3CCC=C(C)C)CC2)cc1 1730180901 VUETZLCZMNDELH-OAQYLSRUSA-N 439.604 4.254 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)C[C@H]2CCCOC2)cc1F 1747571711 JGIXNCNROHQDRI-LJQANCHMSA-N 443.592 4.047 10 10 IICE CC(C)c1nnc(N2CC[C@@](O)(c3ccc(F)cc3)C2)n1CCCSc1nccs1 1760914592 NLBLXKGXIRTCCK-NRFANRHFSA-N 447.605 4.277 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1762876622 ZUXJDNGTXIYLQG-KNQAVFIVSA-N 441.620 4.372 10 10 IICE CCc1nnc(N(C)[C@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764699990 BOFUGYCNHOIZTO-XXBNENTESA-N 425.621 4.112 10 10 IICE COc1ccc(CCNC(=O)c2ccc3[nH]c(-c4ccc(N(C)C)cc4)nc3c2)cc1OC 1872742632 IIBPCUOHNMSNDT-UHFFFAOYSA-N 444.535 4.286 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCNCc1cc(Br)ccc1O)C(F)(F)F 1913259202 ATPHTSOXSXMMJQ-ZDUSSCGKSA-N 427.261 4.090 10 10 IICE N=C1C(=Cc2ccc(O)c(Br)c2)C(=O)N=C2SC=C(c3ccccc3)N12 2296394043 KMBXPKAPHWMXQS-UHFFFAOYSA-N 426.295 4.459 10 10 IICE COc1ccc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3cccc(C)c3)C2=O)cc1OC 2314836898 LOPYDHBOTABOJA-AWEZNQCLSA-N 442.562 4.241 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc(OC)c(OC)c(OC)c3)SC2=S)cc1OC 2321689142 PPFSBMRRJCDUFH-UHFFFAOYSA-N 447.534 4.135 10 10 IICE CC[C@H](C)[C@H](CC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2380720007 FLIHZCQOBBKXOS-WFASDCNBSA-N 443.382 4.409 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](C)N(C(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2381128397 TXILMFNUCQJSLV-CYBMUJFWSA-N 441.366 4.210 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nncn3-c3ccccc3)c2C)cc1 11427080 ZTTCWWXENVFWDE-UHFFFAOYSA-N 446.532 4.436 10 10 IICE Cc1ccccc1N1C(=O)N=C(O)/C(=C/c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1=O 59860176 IIAJPMPWGGRIDR-JXAWBTAJSA-N 434.452 4.400 10 10 IICE COc1ccc(N2CCN(C(=O)CNc3cc4oc5ccccc5c4cc3OC)CC2)cc1 138026783 FLBRPJAVZMOGCQ-UHFFFAOYSA-N 445.519 4.364 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3C(C)=O)[C@@H]2c2ccc(O)c(O)c2)cc1 526610633 OIBMWSAEMLCRFZ-HSZRJFAPSA-N 431.444 4.366 10 10 IICE Cc1cc(CCNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)c(C)n1-c1ccccc1 742499127 ONBSRXIRQNCUMN-UHFFFAOYSA-N 436.943 4.250 10 10 IICE COCCOc1ccc(Br)cc1NCc1ccc(N2CCOCC2)c(F)c1 778119800 YTSUYPNQKUTNCT-UHFFFAOYSA-N 439.325 4.062 10 10 IICE COc1cccc(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)c2cc(C)nc(Cl)c2)c1O 788516012 LUDSAGPQDKZABM-INIZCTEOSA-N 449.935 4.030 10 10 IICE CC(=O)Nc1cc(C(=O)NCc2cc(Br)ccc2O)cc(C(F)(F)F)c1 804736453 TUGVGLLCXZWOMT-UHFFFAOYSA-N 431.208 4.062 10 10 IICE CCOc1ccc(-n2c(C)cc(/C=C3/C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)c2C)cc1 1083904634 KLXZVWSEUJRWRO-HMAPJEAMSA-N 447.466 4.298 10 10 IICE CC1(C)C[C@@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 1129509839 JTALUQKATRZIPM-LUYJPIOASA-N 438.640 4.051 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 1142352141 SKHZUYFRBQCKKB-ICSRJNTNSA-N 439.556 4.330 10 10 IICE Cc1c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)nnn1-c1ccc(OC(C)C)cc1 1264287382 VAMJQBDLTNUGFE-UHFFFAOYSA-N 433.556 4.235 10 10 IICE Cc1ccsc1[C@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1295488371 DRSAFUKXLXEQAL-INIZCTEOSA-N 434.359 4.085 10 10 IICE Cc1cc(C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)c(C)n1-c1ccc(Br)cc1 1296584215 GDCLKYPFGGMFJX-HNNXBMFYSA-N 434.378 4.232 10 10 IICE CCCOc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(OC)c1 1360045440 GXUNLIIUURTEBD-UHFFFAOYSA-N 434.483 4.484 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccccc3OCc3cccs3)c2)CC1 1360597477 LKISYYXBBMAHIZ-UHFFFAOYSA-N 435.549 4.281 10 10 IICE CCCCN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccncc1 1438463850 HYEBANWDUASTQP-UHFFFAOYSA-N 429.432 4.212 10 10 IICE Cc1cc2sc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)c(C)c2cc1C 1439325401 HAADSHJDHGLCTN-UHFFFAOYSA-N 435.593 4.458 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)N(C)C)cc1 1439960581 NDGMWADGOFNHAT-NRFANRHFSA-N 426.561 4.132 10 10 IICE Cc1ccc(C(=O)N2CCCN(C(=O)c3ccsc3)CC2)cc1-n1c(C)cc(C=O)c1C 1441945796 FKUXSXNKOIQYGO-UHFFFAOYSA-N 449.576 4.265 10 10 IICE Cc1cc(CC(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1445350646 QGZKRDOSFRYAQV-RTBURBONSA-N 432.008 4.296 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-c4ccc(C=O)cc4)cc3)c2)CC1 1447791083 CLEDABAUCXFYBW-UHFFFAOYSA-N 427.504 4.087 10 10 IICE CC(C)[C@@H]1N(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC12CCC2 1450392297 GCNYKKIZDKTALY-GTVARFKMSA-N 432.586 4.454 10 10 IICE Cc1cc(-c2csc(NC(=O)CNC(=O)N3CCCC3)n2)c(C)n1-c1ccc(F)cc1 1457526537 JBJIDQOBDUFHIE-UHFFFAOYSA-N 441.532 4.101 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(C4CCCCC4)C3=O)cc2Cl)C1 1469961671 XFQRAYMRPIEWCP-UWJYYQICSA-N 447.023 4.309 10 10 IICE CCN(CC)[C@@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O)c1ccco1 1515521793 GKXMOVCEPDBEHA-SIKLNZKXSA-N 439.560 4.148 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(Cn4cc(Cl)cn4)s3)CC2)cc1 1517327304 FKOGNMMPTGUXLH-UHFFFAOYSA-N 430.961 4.007 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cn(CCc4ccccc4)nn3)cc2Cl)C1 1524252731 CIGSQJZKNIHTBB-GOSISDBHSA-N 437.975 4.341 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccccc2)cc1 1525919273 YHAXQNNTIOTDKO-JOCHJYFZSA-N 425.573 4.458 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](OCC3CCCC3)c3ccccc3)CC2)c(OC)c1 1534594871 GIGCJEXKWOGQMG-VWLOTQADSA-N 438.568 4.301 10 10 IICE COc1cc(N2CCN(C(=O)c3cc4c(s3)CCCCCC4)CC2)cc(OC)c1OC 1536624624 FDNAGRFNJPOUCH-UHFFFAOYSA-N 444.597 4.395 10 10 IICE CC(C)Cc1nnc(N2CCOC(C)(C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1541479376 YQJPHOBKDSKGHX-IBGZPJMESA-N 443.661 4.082 10 10 IICE CN(C(=O)c1cn(Cc2ccccc2)nc1-c1cccnc1)c1ccc(C(F)(F)F)nn1 1542610193 NGXBHWXIUPFDJG-UHFFFAOYSA-N 438.413 4.079 10 10 IICE CCn1c(CCNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)nc2ccccc21 1542843514 MWBOVRBQTVBAPG-UHFFFAOYSA-N 428.536 4.178 10 10 IICE CC1CCN(c2ccc(CNC(=O)C(F)(F)n3cc(-c4ccccc4)nn3)cc2)CC1 1543145742 BXVJPARSSLMQBM-UHFFFAOYSA-N 425.483 4.047 10 10 IICE CCN(CC)c1ccc(CNC(=O)CNC(=O)c2ccc(Cl)c(Cl)c2)cc1F 1565688239 OVPATDZHXLWWBN-UHFFFAOYSA-N 426.319 4.025 10 10 IICE Cc1ccc(C(=O)N(C)c2ccc(OCCN(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1565720179 GJNUQVXQTJVWRT-UHFFFAOYSA-N 433.552 4.432 10 10 IICE COc1cc(C)c(C)cc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1587171080 PVIJXNGSZGTAOT-UHFFFAOYSA-N 430.416 4.248 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1603393812 UCYVDAVUOVBBTE-SFTDATJTSA-N 439.648 4.358 10 10 IICE CN(CCCOc1ccc(F)cc1)C(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1615954233 NRRRRNCRUMTHKR-UHFFFAOYSA-N 440.437 4.404 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1616668160 DMGUMFCDJZZYNU-SIKLNZKXSA-N 443.661 4.431 10 10 IICE CCc1cnccc1[C@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1624023002 MZUSZPTWQHNCFS-BXUJETTOSA-N 443.569 4.252 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc(N3CCN(C)CC3)ccc2[N+](=O)[O-])cc1 1626846044 JCIUGHVMOVRSSJ-UHFFFAOYSA-N 433.512 4.006 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(Cl)c3)ccc21 1626941312 WZNHMKXAUFLRPZ-HTAPYJJXSA-N 446.378 4.212 10 10 IICE CCOC(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)nc1C 1627421710 XMLBEPNYDNRMOH-UHFFFAOYSA-N 447.535 4.488 10 10 IICE COc1ccc(C(=O)C[C@@H](C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1627616765 YAMWRTIQDOZNRX-MRXNPFEDSA-N 446.494 4.291 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1629879753 TWKYTNHWGKAZGO-UHFFFAOYSA-N 447.670 4.267 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Cl)cc3NCC(F)(F)F)CC2)cc1F 1630202187 OTVZCKSDFJHKJN-UHFFFAOYSA-N 445.844 4.424 10 10 IICE Cc1cc(CC(=O)N[C@@H]([C@H]2CCCO2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1631196087 TWXYVAXCIWJQQN-GGAORHGYSA-N 430.976 4.116 10 10 IICE CC[C@@H](CSc1ccccc1)NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1633461578 POJTUVWZRCELNW-SFHVURJKSA-N 429.586 4.106 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@@H](O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cn1 1635867986 OZIGXCFZSCUCBG-ZUOKHONESA-N 446.320 4.243 10 10 IICE COC(=O)c1ccc2c(c1)CCCCN2C(=O)/C=C/[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1636044040 LSURKXYZNWVSFE-HGZMWJMZSA-N 442.556 4.346 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@@H]3CCN(c4ccccc4)C3=O)c2C)c1 1637578494 YWXWPFGTLDINRA-XMMPIXPASA-N 430.552 4.349 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@@H](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1639814275 RACKZUJDPWATLA-WOJBJXKFSA-N 447.620 4.263 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1SCc1cscn1 1641200740 MAUFYJCBCYZZDJ-UHFFFAOYSA-N 439.606 4.327 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1O 1643253125 BSYAMGQGBSEAFS-XZOQPEGZSA-N 440.515 4.261 10 10 IICE COC(=O)c1sc2nc(C)nc(NC[C@@H]3CCN(c4ccc(OC)cc4)C3)c2c1C 1651172007 QZDINFXODWRCIU-HNNXBMFYSA-N 426.542 4.042 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)N(C)C)cc1 1679471157 MNUOMMMPGVKYFH-RTWAWAEBSA-N 430.980 4.222 10 10 IICE Cc1cc(CCNC(=O)NC[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1684443582 BHNCKUXIHTYNJY-TYKWCNGQSA-N 440.588 4.239 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](c1ccc(F)c(F)c1)c1nccn1C 1685690135 LEMPQMNXHVTXAH-OAQYLSRUSA-N 427.499 4.085 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3cccc(F)c3)C[C@H]3CCCO3)C2)cc1 1686854779 CWADVAHRGXJBOJ-GBXCKJPGSA-N 441.547 4.051 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCS[C@@H](C)[C@H]1C 1693005548 JIAZSKQLCFSITB-MOPGFXCFSA-N 436.629 4.017 10 10 IICE Cc1csc(CCCCn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)n1 1693320977 HQEOBELQSUKTHW-UHFFFAOYSA-N 436.585 4.413 10 10 IICE CS[C@@H](Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1698354773 NZRJYQVAKXXLRR-FQEVSTJZSA-N 425.602 4.384 10 10 IICE CO[C@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1711583324 MDLXZMXJQZVFTO-FGZHOGPDSA-N 441.620 4.427 10 10 IICE C[C@@H]1CCCN1CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1726584757 FUJHAOVAXKPUSO-SYYKKAFVSA-N 441.620 4.023 10 10 IICE Cc1nnc(N(Cc2cccc([N+](=O)[O-])c2)C2CC2)n1CCCSc1nccs1 1742766969 VZFDGRRISMNVMW-UHFFFAOYSA-N 430.559 4.303 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCC(C)C)CCOC1 1746656568 QTNSKFZLWQGWFO-VWLOTQADSA-N 441.620 4.213 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2Cc2ccsc2)c(C)n1-c1ccccc1 1751416986 SJXZUNMNNMRXEG-INIZCTEOSA-N 448.596 4.163 10 10 IICE Cc1cc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CCCCCO)on1 1762679791 IZYDTZGYZJKLDC-UHFFFAOYSA-N 448.571 4.296 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1cc(COC(C)(C)C)on1 1767111942 KYPMNQRJWTZPHR-UHFFFAOYSA-N 427.549 4.269 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCCO4)n3CCCC(C)C)CC2)cc1 1770259037 VJZWWVROYSRUIN-JOCHJYFZSA-N 427.593 4.291 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2nccs2)sc(C)c1-c1ccc(C)c(C)c1 1860764495 COJIEKGBWBVDII-UHFFFAOYSA-N 429.523 4.161 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccccc2[N+](=O)[O-])cc1 1865678063 ROGFSCNWHHHGPH-RCCKNPSSSA-N 429.432 4.447 10 10 IICE CCOC(=O)c1c(-c2ccc([N+](=O)[O-])cc2)csc1NC(=O)Cc1ccc(N)cc1 1865956848 INBZFRNXDKXJEG-UHFFFAOYSA-N 425.466 4.263 10 10 IICE CCN[C@H](c1ccc2c(c1)CCN2C)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044754825 PZURYZPXUYJBMJ-ISKFKSNPSA-N 439.600 4.440 10 10 IICE C[C@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1cc(F)ccc1O 2084724213 FLYHLBJUBYBZDW-RXVVDRJESA-N 443.563 4.303 10 10 IICE COCCN1C(=O)C(=C2C(=O)N(Cc3ccc(Cl)cc3)c3ccccc32)SC1=S 2296537443 MXQDPDKZTZOKGI-UHFFFAOYSA-N 444.965 4.105 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cccn1Cc1cccc2ccccc12 2297060356 QXHAMRPETIELEC-UHFFFAOYSA-N 439.446 4.495 10 10 IICE CC(C)N1C(=O)C(=Cc2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 2314414929 REWRRPMMKFGJGK-UHFFFAOYSA-N 428.583 4.049 10 10 IICE Cc1ccc(CNC(=O)[C@H](C(C)C)[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2380721821 MRSJUOAHODHUPR-DZGCQCFKSA-N 443.382 4.265 10 10 IICE CC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C/c1ccc(N(C)C)c(Br)c1 8780902 YJMSUGYSQYAZJK-CXUHLZMHSA-N 428.286 4.019 10 10 IICE Cc1cccc(OCC2=NN3C(=N)/C(=C/c4ccc(Br)o4)C(=O)N=C3S2)c1 33311475 JOBAZBXUANLYPS-TUQWILOLSA-N 445.298 4.049 10 10 IICE O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1nc(-c2ccc(Br)cc2)cs1 40858605 YUXVXXLIRIXPPY-UHFFFAOYSA-N 440.300 4.282 10 10 IICE O=C1/C(=C/N2CCN(C/C=C\c3ccccc3)CC2)SC(=S)N1CCc1ccccc1 102676198 DDCSDFUIZUSMAW-RZOZFNPQSA-N 449.645 4.262 10 10 IICE CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 112599868 JAJKWNMLJDVZPV-QFIPXVFZSA-N 428.548 4.340 10 10 IICE CN(C)c1ccc([C@@H]2C[C@H]2C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 730477364 GQAZMCDUPQGHOH-LEWJYISDSA-N 447.501 4.028 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCSCC3)cc2)cnn1-c1ccccc1Cl 732656995 QSNVSQLZKWZFPE-UHFFFAOYSA-N 426.973 4.317 10 10 IICE CC(C)CC[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 743774506 ADQSDCVKPIMJGZ-GRFAERAESA-N 440.656 4.033 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCCCCOCc3ccccc3)cc2F)C[C@@H](C)O1 747861297 ICSVRVACGVEXAU-BGYRXZFFSA-N 443.563 4.236 10 10 IICE Cc1cc(CCNC(=O)NCCc2nnc(-c3ccccc3)o2)c(C)n1-c1ccccc1 749165992 KYYYRUBHTDICLG-UHFFFAOYSA-N 429.524 4.229 10 10 IICE C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N[C@H](C)c1cc2ccccc2o1 751930713 IALGOKHDTSXFNP-CABCVRRESA-N 449.532 4.485 10 10 IICE Cc1nc2c(s1)[C@@H](NC(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CCC2 780833978 IRBXZQMLPVWBEC-KSSFIOAISA-N 436.528 4.399 10 10 IICE CCC(=O)N1CCc2cc(C(=O)COC(=O)c3sccc3-n3c(C)ccc3C)ccc21 919568980 UQWZGDUNIFMQKN-UHFFFAOYSA-N 436.533 4.494 10 10 IICE CCCNC(=O)[C@@H](C(C)C)N1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1081156941 XUGHMYKZIYLHOF-YVGNARHYSA-N 441.416 4.201 10 10 IICE COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)ccc1OCCC(C)C 1084460916 QHSCGIKVOCWHIJ-WOJGMQOQSA-N 442.899 4.440 10 10 IICE CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438454 LCUHNWIHTRYPEJ-YLJYHZDGSA-N 445.947 4.303 10 10 IICE COc1ccc(CN2CC[C@H]2C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1 1141518798 RRXWNQMRWWKWMJ-VWLOTQADSA-N 433.552 4.158 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1 1141773063 YEEPNNFCYWTALE-UHFFFAOYSA-N 425.529 4.036 10 10 IICE COc1cccc(CN2CCC(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1166085924 PTCSWIXNNKPJLB-UHFFFAOYSA-N 445.563 4.310 10 10 IICE Cc1cc(C(C)(C)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1Br 1264687714 GUZZSAHAGXEEPL-UHFFFAOYSA-N 449.364 4.327 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(OCC(F)(F)F)c4ccccc4n3)C2)cc1 1278860803 BJHHXGNRDZAEPH-HNNXBMFYSA-N 445.441 4.193 10 10 IICE Cc1cc(CNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1287661058 MXWFZSAVUNLXKA-NRFANRHFSA-N 433.527 4.402 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@H](NC(=O)c2ccc(O)cc2)c2ccccc2)cc1 1291711723 UYOPHNXLALXMLO-VWLOTQADSA-N 445.563 4.416 10 10 IICE O=C(NCc1c(O)cccc1O)[C@H](Oc1ccc(F)cc1Br)c1ccccc1 1304053566 NZYBZHAAYCKETB-HXUWFJFHSA-N 446.272 4.436 10 10 IICE CC1CCN(c2ccc(Cn3c(-c4cnn(C)c4)nnc3N(C)CC(C)(C)C)cc2)CC1 1305066709 NXTXDLNUWFWKNZ-UHFFFAOYSA-N 435.620 4.446 10 10 IICE Cc1cc(-c2csc(NC(=O)C[C@@H]3CCCS3(=O)=O)n2)c(C)n1-c1ccc(F)cc1 1306327327 DLHDGAIACJTTKS-KRWDZBQOSA-N 447.557 4.263 10 10 IICE COc1ccc(N2CCCN(CC(=O)Nc3nc(-c4ccc(F)cc4)cs3)CC2)cc1 1307423773 HYMGAMNRGMNOAD-UHFFFAOYSA-N 440.544 4.109 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCO[C@@H]1C(C)C 1314304483 CMTVTMCUFBMYLJ-ZJSXRUAMSA-N 441.620 4.112 10 10 IICE C[C@H]1CN(C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)c2cc(Br)ccc2O1 1459595600 XUNOZXIQMYMXRM-SWLSCSKDSA-N 437.334 4.177 10 10 IICE CC[C@@H](C)[C@@H](NC(=O)c1ccc(C)c(O)c1O)C(=O)N1CCC(Cc2ccccc2)CC1 1465004295 NREUZUNWDOFMFH-VGOFRKELSA-N 438.568 4.032 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1F 1465004834 HXTMOQNKJYXQMU-JOCHJYFZSA-N 427.520 4.089 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc([C@H]3CCCN3C)[nH]n2)cc1 1465006414 NAFSBLCEWMBGHB-XMMPIXPASA-N 433.556 4.098 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@H](CSc4ccccc4)C3)C2)cc1 1478859014 AGGKPGPRCQJWNI-PMACEKPBSA-N 425.598 4.345 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CC(C)C)C(=O)[C@@H]1C 1514788911 KJLUIPKNMSCUAD-NRFANRHFSA-N 448.615 4.456 10 10 IICE CCCN1CCC(N(C)c2nnc(CC)n2Cc2ccc(N3CCC(C)CC3)cc2)CC1 1514911143 LEEXXHCIVWMYMI-UHFFFAOYSA-N 438.664 4.436 10 10 IICE COC1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)SC)C1 1517904377 OYGJVJZWIYYYSF-KRWDZBQOSA-N 425.602 4.329 10 10 IICE CSC[C@@H]1CCCN1c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1520255908 OBLWASGDRWQPBW-KRWDZBQOSA-N 446.671 4.235 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(Br)c1 1534309879 YNVUFPXPJLFEAV-IYBDPMFKSA-N 449.364 4.369 10 10 IICE COc1ccc(N2CCC(NC(=O)CN(Cc3ccccc3)c3ccccc3)CC2)cc1 1537032214 DFIVOWMBIJCRBR-UHFFFAOYSA-N 429.564 4.487 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@H]3CCC[C@@H](C(F)(F)F)C3)cc2F)CC1 1537536132 XPPKCTKTJFEKEW-FUHWJXTLSA-N 429.502 4.343 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)/C=C\c3ccc4c(c3)NC(=O)CO4)cc2Cl)C1 1538422507 XKPPQNKOFSWZKO-CXOKCQFOSA-N 439.943 4.237 10 10 IICE O=C(Nc1cccc(N2CCCCC2)c1)c1ccc(NCCN2CCOCC2)c(Cl)c1 1543905272 NBUNANOJFHVNAV-UHFFFAOYSA-N 442.991 4.327 10 10 IICE Cc1c(Cl)ccc2c(CC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)coc12 1544538196 NTWMXYKKISCZMY-UHFFFAOYSA-N 426.944 4.462 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](CC(C)C)NCC(F)(F)F 1545508913 RWURVRDLWINAFK-AWEZNQCLSA-N 425.289 4.070 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3nc(C)nc3-c3ccccc3)c2C)cc1 1559370306 UZCXVARFJHGLCS-UHFFFAOYSA-N 428.492 4.331 10 10 IICE COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)Cc1ccc(N2CCC(OC)CC2)cc1 1559626799 XIHOWWWLEQNFDT-QFIPXVFZSA-N 436.474 4.065 10 10 IICE Cc1sc(=O)n(CC(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1-c1ccccc1 1565663549 HEECADJWVJAABB-UHFFFAOYSA-N 435.593 4.438 10 10 IICE CNc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)c1 1565884146 JHOUMRXVHUCQLP-HXUWFJFHSA-N 446.979 4.444 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc([N+](=O)[O-])ccc3SC(C)C)C2)cc1 1585664425 BJMXDZAFJODEJW-MRXNPFEDSA-N 429.542 4.360 10 10 IICE CC(C)(C)O[C@H]1C[C@@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1585854534 YQWRCCHNGYKKII-MBWVZJLXSA-N 438.640 4.192 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Br)cc4cccnc34)C2)cc1 1587112132 BIEIWXZFGXVOSW-INIZCTEOSA-N 426.314 4.015 10 10 IICE CN1CCC[C@H](c2cccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c2)C1 1610276614 BQAYZSVMYPQWFO-FQEVSTJZSA-N 443.538 4.496 10 10 IICE CC(=O)N/C(=C/c1cccs1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1617900716 LIUPHPCFYUTDQR-RVZJCZPVSA-N 431.989 4.431 10 10 IICE Brc1ccc(COC2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)cc1 1620680850 SIPYLVOHHRWZBF-UHFFFAOYSA-N 445.401 4.467 10 10 IICE CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1624850976 FFWDSVDYLKSRKS-QGZVFWFLSA-N 431.536 4.365 10 10 IICE CN(c1ccc(CNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)cc1)C1CCCCC1 1625905512 VYRDFCDKMDFAMO-UHFFFAOYSA-N 438.963 4.079 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)N(C)C)cc1 1627463746 DWRZFYVZBKZYHE-OAQYLSRUSA-N 446.382 4.278 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCn3c(Br)cnc3C2)c1 1634057248 JNBKMGIDJXMRKV-UHFFFAOYSA-N 433.737 4.363 10 10 IICE COc1ccccc1Nc1nc2sc(C(=O)NCc3ccc(O)cc3O)cc2s1 1638351919 IEXNAFVRHCUUHB-UHFFFAOYSA-N 427.507 4.451 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cccc(Br)c1O 1640084358 SSBNNOFYHOZNCZ-UHFFFAOYSA-N 427.298 4.305 10 10 IICE CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccc(F)c(Cl)c1 1653289853 XNYNDTWCUJPFFD-UHFFFAOYSA-N 436.870 4.325 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC2(CCCN(C(=O)OC(C)(C)C)C2)C1 1673743934 IVCPSXBHCRVKRC-IBGZPJMESA-N 444.620 4.035 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3CCC3CCCC3)cc2)CC1 1676126128 OWDJPLJKFXGBBS-HSZRJFAPSA-N 426.605 4.033 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCC3CCN(CC4CC4)CC3)cc2Cl)C1 1681827716 KWGOMBXULFFZOR-SFHVURJKSA-N 433.040 4.498 10 10 IICE CCc1nnc(N(C)[C@H]2CCN(Cc3ccccc3)C2)n1CCCSc1nccs1 1709029741 LONUQRAJVVUBHM-IBGZPJMESA-N 442.658 4.190 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1746095733 VERRFANQUDAWRT-GHTZIAJQSA-N 427.593 4.028 10 10 IICE CCOC[C@@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1747286765 UMBJBURMSBRZEY-HXUWFJFHSA-N 439.629 4.216 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@H](N3CCCC3)C2)cc1F 1747571057 AZVPQCOTEMUQNS-FQEVSTJZSA-N 442.627 4.185 10 10 IICE CCOCc1nnc(N2CCC([C@@H]3CCCO3)CC2)n1Cc1ccc(N(CC)CC)cc1 1767830002 WQCTXRGGGNAVMM-QHCPKHFHSA-N 441.620 4.105 10 10 IICE CC(=C\c1ccccc1)/C=C1/SC(=S)N([C@@H]2CC(=O)N(c3ccc(C)cc3)C2=O)C1=O 1772759308 MHYXYOUEGHKRLY-LTZVSHBVSA-N 448.569 4.475 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4cccc(C)c4)n4ccccc34)CC2)cc1 1858349310 VGFOIHMHJNSXOL-UHFFFAOYSA-N 426.520 4.281 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NC2CCCCC2)sc(C)c1-c1ccc(F)cc1 1860759599 YGFAHKQQZCLQNP-UHFFFAOYSA-N 432.517 4.427 10 10 IICE CCC1=NN(Cc2c(F)cccc2Cl)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679285 FFEKPAPCKGLUJW-MDWZMJQESA-N 445.834 4.350 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2060640376 UJCVHGWEGZZHSL-HSZRJFAPSA-N 443.548 4.132 10 10 IICE CN1CCCc2cc([C@@H](CN)N(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2074370646 JDKLFMQGAMATRI-XMMPIXPASA-N 438.616 4.096 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@@H](F)CNCc2ccc(Br)cc2O)CC1 2106954869 CVDOUMXHSQMSJH-INIZCTEOSA-N 431.346 4.230 10 10 IICE COc1ccc(Br)c(CN[C@@H]2[C@@H]3CCCCN(C(=O)OC(C)(C)C)[C@@H]32)c1O 2236055448 PWDXRZLZMBBDPX-VUCTXSBTSA-N 441.366 4.041 10 10 IICE COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)C1=Cc1ccc(OC)c(OC)c1OC 2293891581 AKMNOLURYMQWPH-HNNXBMFYSA-N 437.492 4.146 10 10 IICE COc1cc(C=C2C(=O)NN(c3cccc(Cl)c3)C2=O)ccc1OCc1ccccc1 2297302794 FUVXINPWYXHASM-UHFFFAOYSA-N 434.879 4.389 10 10 IICE COC(=O)CN1C(=O)C(=Cc2ccc(OCc3ccccc3Cl)cc2)SC1=S 2297457012 JTKQTRYMSPMKHN-UHFFFAOYSA-N 433.938 4.293 10 10 IICE Cc1cc(C=C2C(=O)N(C)C(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1 2313560563 XUFWSCVRCNPAJI-UHFFFAOYSA-N 444.447 4.011 10 10 IICE Cc1ccc(CN[C@@H](C)[C@@H]2[C@H]3C[C@H]2N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352946235 HWMLRONLEDLISU-ARLBYUKCSA-N 425.367 4.197 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)/C2=C\NCc2ccco2)cc1 16212564 MBMMXFXAFOETOV-JXAWBTAJSA-N 430.489 4.323 10 10 IICE CC(=O)N1CCN(C2=NC(=O)/C(=C/c3ccc(-c4cccc(C(F)(F)F)c4)o3)S2)CC1 35252239 AZHUARHLUJEDRI-PDGQHHTCSA-N 449.454 4.100 10 10 IICE C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 97553932 HOMUMYYXWQZAEU-QEOITGFPSA-N 447.579 4.293 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)c(Br)c1 705882447 JDAPJTRHTHXLKY-JBPLPALLSA-N 426.402 4.255 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3sccc3SC(F)F)CC2)cc1 730518187 FPZFFNRVBIICSG-UHFFFAOYSA-N 441.569 4.014 10 10 IICE CN1CCCc2cc(NC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccc21 743125806 MBAOWLYDNYYKDV-GOSISDBHSA-N 430.499 4.461 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCCC3)cs1 748674169 PCQVQTNKKZAPRU-UHFFFAOYSA-N 445.522 4.407 10 10 IICE Cc1ccc(/C=C\C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(Br)c1 749407269 ULRMWYLUSIIOGQ-ALCCZGGFSA-N 447.348 4.187 10 10 IICE Cc1ccc(CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c(OC[C@H]2CCOC2)c1 756081864 WGJNYWOUGMDNBF-NRFANRHFSA-N 437.584 4.351 10 10 IICE CC(=O)Nc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(F)cc1F 766492460 YJKMRUYXFYSKSV-UHFFFAOYSA-N 440.494 4.283 10 10 IICE Cc1nc([C@H]2CCCN2CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cs1 775730580 NBOVFWYTDLYWOZ-OAQYLSRUSA-N 431.517 4.003 10 10 IICE COc1cc(N(C)Cc2cc3c(cc2Br)OCCCO3)cc(OC)c1OC 777589862 DHNHKKBUTSTMFX-UHFFFAOYSA-N 438.318 4.273 10 10 IICE C[C@@H](NC(=O)N1CCC[C@@]2(CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 805311152 YKQHCSKSJLDCES-HOYKHHGWSA-N 430.593 4.246 10 10 IICE CCOc1ccccc1CCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916456786 RLPLANHHOTXYGB-UHFFFAOYSA-N 436.474 4.190 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCc3cc(Cl)c4c(c3)OCCO4)ccc21 1124617937 DIRAJFCCYIQONJ-UHFFFAOYSA-N 442.943 4.302 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)cc1 1125234392 AXQUEJRKFAGMER-JOCHJYFZSA-N 425.573 4.490 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](C)c1nc(-c2ccccc2)no1 1152968234 VEEDBYJUWNQTRQ-INIZCTEOSA-N 428.492 4.490 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)CSCC1CCN(C(=O)OC(C)(C)C)CC1 1165944372 JHQIRMXGWREHKH-UHFFFAOYSA-N 435.634 4.091 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)NC(C)(C)C)c(C)n1-c1ccccc1Br 1178489850 HVRGTLDDPMNQMG-IBGZPJMESA-N 446.389 4.376 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ncn(-c4ccccc4)n3)cc2Cl)C1 1227208964 RAYAQAVWGVBSOD-QGZVFWFLSA-N 438.963 4.156 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(Br)c2nccnc2c1 1264287314 RLTRXXNLLTWKHD-UHFFFAOYSA-N 425.330 4.265 10 10 IICE COCCOc1cc(C(=O)OC)ccc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1287881653 LMYLUWAFPWRHJR-UHFFFAOYSA-N 436.508 4.087 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nc(C(C)C)n(-c3cccc(F)c3)n2)cc1F 1293224931 JNUUXPUZRZCJPQ-UHFFFAOYSA-N 427.499 4.445 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCC[C@@]2(C)NC(=O)OC(C)(C)C)cc1 1300282621 WRITUBYKKMSIDM-GBXCKJPGSA-N 433.593 4.063 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F 1304089862 OWILFCHJSBDNGS-LJQANCHMSA-N 440.446 4.068 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N2CCC[C@H](C(F)F)C2)cc1 1313681466 SCSYWDLJXXHTMC-SFHVURJKSA-N 441.530 4.111 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CCCC2 1353748103 JRJANUGZJVDXRU-OAHLLOKOSA-N 432.586 4.312 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCOc3ccc(C)cc3Cl)cc2F)CC1 1435074514 JFHDHMBPUZUHGO-UHFFFAOYSA-N 447.982 4.405 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)c1 1441391210 QTJHWCMNOIPMEB-UHFFFAOYSA-N 429.476 4.202 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Cl)c(Cl)ccc4[nH]3)CC2)c(OC)c1 1454472595 KZBVHPAHTJJPCR-UHFFFAOYSA-N 434.323 4.454 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1cccnc1 1460931468 BJYVBEGXVKOFHX-ATVHPVEESA-N 445.635 4.219 10 10 IICE CO[C@@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C(F)(F)F 1463210750 YEBWCZWAZFMEFX-LBPRGKRZSA-N 443.223 4.065 10 10 IICE C[C@H](CC(=O)NCc1ccc2c(c1)CCCN2C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1464509985 FDLNHBNLGBDVAR-WIYYLYMNSA-N 429.605 4.359 10 10 IICE Cc1cc(C(=O)N2C[C@@]3(C)CN(C)C[C@]3(C)C2)c(C)n1-c1ccc(Br)cc1 1470674210 LFJOHHUCGIJSLK-FGZHOGPDSA-N 430.390 4.270 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@H](CCc2ccccc2)c2ccccn2)N(C)C)cc1 1471081463 FZBQBIYLJOTFCM-CLJLJLNGSA-N 445.611 4.424 10 10 IICE CCC[C@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N[C@H](C)c1ccccc1O 1471195131 DBGLANMLQFQZTF-KDOFPFPSSA-N 448.361 4.000 10 10 IICE C[C@H]1C[C@H](C)CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C1 1512003671 XUZOMCHVZCQRPB-IRXDYDNUSA-N 428.631 4.385 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C[C@@H](C)O1 1512479381 PYFLJXOJNDPXNY-IYBDPMFKSA-N 447.605 4.261 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4cccc(Cl)c4)CCC3)cc2F)CC1 1521010220 PIPDOWQRTKTTPX-UHFFFAOYSA-N 429.967 4.359 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(OC(F)(F)F)c(C)c3)cc2F)CC1 1521016645 OGTOJRFMVIESQT-UHFFFAOYSA-N 439.453 4.105 10 10 IICE CCc1c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cnn1-c1ccc(Cl)cc1 1527714846 KGEVZPSURHOKFC-UHFFFAOYSA-N 438.959 4.449 10 10 IICE O=C(NC[C@H]1CCCc2ccccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1543369463 TXUBNASJJFMYRM-MRXNPFEDSA-N 442.562 4.104 10 10 IICE CO[C@H](Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1554662771 QQGRCVJJYSXXRI-XMMPIXPASA-N 448.615 4.172 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1 1564945931 IFSZVLLMSOIYKB-OALUTQOASA-N 429.008 4.471 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 1564946460 PXGNXEXABICUEY-CUNXSJBXSA-N 434.628 4.300 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCCc2sccc2C1 1565644872 HNGCZDXXMLNIJI-LDADJPATSA-N 446.594 4.454 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4cccc(Cl)c4F)no3)CC2)cc1F 1566347468 LQTYWUDZNDDXQJ-UHFFFAOYSA-N 433.842 4.244 10 10 IICE Cc1cc(C(=O)NC[C@](C)(O)c2ccccc2)c(C)n1-c1ccccc1Br 1586369290 WUHBDZYFYIPELG-QFIPXVFZSA-N 427.342 4.494 10 10 IICE CC(C)Cc1nnc(N(C)CCc2cccs2)n1Cc1ccc(N2CCOCC2)cc1 1603341669 OGUNIHNABISMAK-UHFFFAOYSA-N 439.629 4.102 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NCCc1cccc(Cl)c1Cl 1616180970 SXFUNGCZUSNTGZ-SFHVURJKSA-N 437.367 4.039 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)cc1 1616533622 KIZISKRVSVGAQU-UHFFFAOYSA-N 427.545 4.180 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CC(=O)N(CCc4ccc(F)cc4)C3)c2C)c1 1624075518 RSZFIQMVXHHRED-QHCPKHFHSA-N 447.554 4.249 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(SC(F)(F)F)o3)cc2F)CC1 1627360201 CZPSNDNOCBIAPE-UHFFFAOYSA-N 431.455 4.103 10 10 IICE Cc1cc(C2CCN(C(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)CC2)n[nH]1 1632808010 QWFQPRZQCKMCIT-UHFFFAOYSA-N 442.361 4.303 10 10 IICE Cc1ccc(S(=O)(=O)C2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)cc1 1633831537 LVYKYUDZXMORKE-UHFFFAOYSA-N 436.577 4.481 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccccc1C(=O)c1ccc(Br)cc1 1638353032 ZSZSOSJSSCCLEQ-UHFFFAOYSA-N 426.266 4.021 10 10 IICE CCC[C@@H](C)C(=O)NCCNC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1641225116 ALXMMODBKBMAKV-CQSZACIVSA-N 434.378 4.139 10 10 IICE CCSc1nc(C)c([C@H](CC)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)s1 1642155582 XLAOTJQOEINWSV-IBGZPJMESA-N 433.643 4.335 10 10 IICE Cc1cc(C(=O)CN2C(=O)CN(/C=C\c3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cn1 1643647073 NQGJGUOEBWYOLQ-KHPPLWFESA-N 448.910 4.260 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]2C(C)(C)O)sc(C)c1-c1ccccc1 1645002103 WVTUXJOMGFTFLJ-KRWDZBQOSA-N 430.570 4.074 10 10 IICE Brc1cc(CN2CCC(NC3CCOCC3)CC2)ccc1N1CCCCC1 1653011620 GEUVQQAOZPHZCY-UHFFFAOYSA-N 436.438 4.172 10 10 IICE C[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1ccc(OCc2ccc(F)cc2)cc1 1653012380 VMENTGWYQWHUPV-IBGZPJMESA-N 435.543 4.438 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3nnc(C(F)(F)F)n3)c2C)ccc1Br 1653080237 HDSCHZRTEVKHBI-UHFFFAOYSA-N 442.239 4.053 10 10 IICE Cc1ccc(N(C)c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)cc1 1693107436 KUCBVKYYRIBKOC-UHFFFAOYSA-N 442.614 4.116 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CC1CN(C(=O)OC(C)(C)C)C1 1696701017 ULFFYYAAPJMPEM-UHFFFAOYSA-N 443.592 4.076 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)Cc1cnn(C)c1C 1707305973 RUPQFMBATIJRBS-UHFFFAOYSA-N 449.628 4.031 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H](C(F)F)C1 1724235435 KYLZUCKZGZUPLC-AZUAARDMSA-N 433.547 4.424 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2C[C@@H](COC)O[C@H](C)C2)cc1 1746089496 CJONNCDRLCITFM-XXBNENTESA-N 441.620 4.070 10 10 IICE CO[C@H](C)Cn1c(-c2ccc(Br)s2)nnc1N(C)Cc1ccccc1O 1748380757 RIBLSXPHDPPNIM-GFCCVEGCSA-N 437.363 4.146 10 10 IICE CC(C)CSCCn1c(C2CC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1750870294 FHTIXXWUUGVNEI-UHFFFAOYSA-N 429.634 4.018 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](C(C)C)N2CCCC2)n1 1751604154 OWCNXDWWAVNQJV-JOCHJYFZSA-N 434.588 4.111 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1765427018 CQZAEWDTVDAEKX-PXDATVDWSA-N 437.588 4.129 10 10 IICE O=C(CCNCc1c(F)cccc1Cl)Nc1cccc2c1C(=O)c1ccccc1C2=O 1860711138 UBIZYFLBTKOGNX-UHFFFAOYSA-N 436.870 4.373 10 10 IICE CNC(=O)[C@@H]1CCCC[C@H]1C(=O)Nc1sc2c(c1C(=O)OC)CC[C@@H](C(C)(C)C)C2 1866192038 FAMLBHZRVKNFDE-RBSFLKMASA-N 434.602 4.177 10 10 IICE Cc1ccc2oc(=O)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(C)c2c1 1866290975 NZDDXONGOJFULP-QHCPKHFHSA-N 447.579 4.433 10 10 IICE CCc1cccc2c(=O)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c12 1866414785 RLICPUDILVXXSQ-XMMPIXPASA-N 446.595 4.114 10 10 IICE CN(C)c1ccc(-c2nc3cc(C(=O)N4CCN(c5ccc(F)cc5)CC4)ccc3[nH]2)cc1 1873505771 CZFVGOJEKVFJCR-UHFFFAOYSA-N 443.526 4.397 10 10 IICE Cc1c(C2CC2)nn(Cc2c(O)cccc2Br)c1I 2079783989 WIOQQAUXEBWARZ-UHFFFAOYSA-N 433.087 4.190 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](CNCc1c(O)cccc1Br)C2 2103442194 RRNGBWXZIMHKSR-QKDCVEJESA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N[C@@](C)(CNCc1cc(Br)cc(F)c1O)C1CCC1 2137709615 VAMDYJXPGOYYNL-IBGZPJMESA-N 431.346 4.467 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 2293115938 UJWBISMYNHUKSX-UHFFFAOYSA-N 437.795 4.175 10 10 IICE CCOC(=O)c1sc(NC=C2C(=O)N(c3ccccc3)N=C2C)c(C(=O)OCC)c1C 2296800532 DFQCVHUBOKWECB-UHFFFAOYSA-N 441.509 4.128 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1ccccc1Br 2296885392 SBMUCOFLTBUKBU-UHFFFAOYSA-N 437.340 4.272 10 10 IICE COc1ccc(Cl)cc1C=C1C(=O)NC(=S)N(c2cccc(Cl)c2Cl)C1=O 2297334842 VVGFCZKYVSGXIG-UHFFFAOYSA-N 441.723 4.487 10 10 IICE Cc1ccc(OCCOc2ccc(C=C3C(=N)N4N=CSC4=NC3=O)cc2Cl)cc1 2297461299 OSINYSXDFMWGJE-UHFFFAOYSA-N 440.912 4.355 10 10 IICE O=C(CN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1nc2ccc(F)cc2s1 2314563207 YWLSKNVSHBVKON-UHFFFAOYSA-N 429.523 4.275 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3[C@@H](NC(=O)OC(C)(C)C)C[C@H]3C2)c(O)c1Br 2352682486 YEMKSQCQRHJOEU-WCVJEAGWSA-N 425.367 4.245 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)c(O)c1Br 2381133781 SNHHICIZCKGWKJ-ZFWWWQNUSA-N 441.366 4.020 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@@H](c2ccccc2Cl)N3)CC1 226748373 JNCQFZUXRIAJTR-STSQHVNTSA-N 444.000 4.103 10 10 IICE Cc1cc(OC[C@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)ccc1Cl 256038943 UNVRPWKBZLSYAO-FYYLOGMGSA-N 432.992 4.135 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cccc(NC(=O)N2CCCC2)c1 586670609 SZIZYLSKTVFYHN-UHFFFAOYSA-N 439.471 4.342 10 10 IICE COc1ccc(N2CCC(NC(=O)NCc3ccccc3CN3CCCCC3)CC2)cc1 726610155 ITCXEGAKEOLHNE-UHFFFAOYSA-N 436.600 4.149 10 10 IICE NC(=O)c1ccc(Oc2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cc2)cc1 735520397 ZWQIRPSXXLFLKN-QHCPKHFHSA-N 446.503 4.105 10 10 IICE O=C(NCc1cn2cc(Cl)ccc2n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743546559 OQTDNSYTWLPBQK-OAHLLOKOSA-N 449.889 4.057 10 10 IICE C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(Cl)c(Cl)c1O 756770301 WPPYPXLNDOPYJM-AWEZNQCLSA-N 443.396 4.475 10 10 IICE COc1ccc(N2CCN(C(=O)c3c[nH]c4cccc(Br)c34)CC2)cc1F 764545880 YTQPIHWNKJAGTM-UHFFFAOYSA-N 432.293 4.041 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2CCCN(c3ncccn3)C2)cc1 772065728 VKYCYDGZCYCZBP-LJQANCHMSA-N 429.528 4.357 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 774363183 IDOQUOIKAIGRGO-UHFFFAOYSA-N 445.302 4.369 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 779401780 YCEDBJBLGNKGBT-LOSJGSFVSA-N 436.600 4.271 10 10 IICE COc1ccc(N2CCC(NC(=O)CCC(=O)c3ccc(OC)cc3Cl)CC2)cc1 779900121 RFPPNXPFHHHXGK-UHFFFAOYSA-N 430.932 4.105 10 10 IICE CC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)c1ccccc1 800048514 DBZFYGSNJIQMFI-JTSKRJEESA-N 427.976 4.460 10 10 IICE COC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802683858 BKXAACMKEVQRTN-FYYLOGMGSA-N 449.599 4.394 10 10 IICE C/C=C\c1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(OC)c1 917710591 NPIVVJLPMFKDFY-SPCWZHTESA-N 442.531 4.176 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(OC(F)(F)F)cc3)cc2F)C[C@H](C)O1 917711454 GNYUKIJJWHAHRR-GJZGRUSLSA-N 440.437 4.197 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O[C@H](C)C2 920881783 RHIJKHDYVAMSTH-VGCSBSMUSA-N 436.552 4.136 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Cl)cccc3C(F)(F)F)CC2)c(OC)c1 1132036355 OQONXTDEBVPJJU-UHFFFAOYSA-N 428.838 4.338 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc2ccccc2cc1O 1136285110 QBQGXYDBRJRLMO-UHFFFAOYSA-N 430.426 4.331 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3[C@@H]2O)c(C)n1-c1ccc(Br)cc1 1141668761 MASGYPJRFFGMGB-CTNGQTDRSA-N 441.325 4.081 10 10 IICE COC(=O)c1cc(-c2ccccc2CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)[nH]n1 1152733567 KVXWUOHBTCTZLJ-UHFFFAOYSA-N 446.482 4.340 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)c2C)cc1C 1165856096 HEKPOKXSDJBFRS-UHFFFAOYSA-N 446.463 4.319 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)cc1 1265131486 ANTNFSLREDAVQS-UHFFFAOYSA-N 430.552 4.172 10 10 IICE O=C(COC1CCCCC1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1289508043 GHNJOKPUVVTTFF-UHFFFAOYSA-N 429.318 4.447 10 10 IICE CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1295452895 DDJFJHQJCAZRMK-IBGZPJMESA-N 440.565 4.085 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1C 1296870060 AAFHPEJWPBVBDC-QHCPKHFHSA-N 429.564 4.366 10 10 IICE COc1ccc(NC(=O)CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)cc1 1307464657 HNAWWVOVTJZXDV-UHFFFAOYSA-N 425.529 4.111 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@@H]2C(=O)Nc3c(F)cccc32)sc2c1CC[C@H](C)C2 1348718349 FYIORFPMSUXFKJ-FZMZJTMJSA-N 430.501 4.253 10 10 IICE C[C@@H](Oc1ccccn1)C(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 1350241324 XOXJLCPZNGPJOC-CQSZACIVSA-N 432.388 4.136 10 10 IICE CN(C)c1ccc(CNC(=O)[C@]2(c3ccccc3)C[C@@H](NC(=O)OC(C)(C)C)C2)cc1F 1434915417 RYBVXWZNYRQYBV-FEHRVWHQSA-N 441.547 4.133 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)cc1 1441096711 HYMNIDFVDYZXOS-DEOSSOPVSA-N 445.519 4.205 10 10 IICE Cc1ccc(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)cc1-n1c(C)cc(C=O)c1C 1446179015 XWIPNXCCIBJDMZ-GOSISDBHSA-N 432.520 4.467 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1456076730 QKSCWQRILCEYTI-HNNXBMFYSA-N 441.519 4.019 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccnc(Cl)c1F 1460809138 YAIRUMXMTBQVHB-UKTHLTGXSA-N 439.896 4.243 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)/C=C\c1cc2cnn(C(C)C)c2[nH]c1=O 1469205549 NHUITGAEHSGYOT-QKWWCAPFSA-N 434.540 4.189 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)c(C)n1-c1ccccc1 1479064293 OYIMVBIMOQGTQI-RUZDIDTESA-N 435.568 4.457 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@@H]2CCC(=O)N2)n1CCCC(C)(C)C 1503473195 KGGWUCUUVHONSX-NRFANRHFSA-N 438.620 4.292 10 10 IICE Cc1c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cccc1[N+](=O)[O-] 1530526074 XWLBYICTZJYEER-GZTJUZNOSA-N 445.497 4.272 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](C(=O)OC(C)(C)C)c2ccnn2C)c1 1530752894 UCUWCRJUOZQLLR-HXUWFJFHSA-N 442.947 4.294 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c(C)n1-c1ccccc1 1534543300 SBKJCGJHKCQTBR-JOCHJYFZSA-N 449.982 4.455 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2csc(-c3c(F)cccc3F)n2)N(C)C)cc1 1537482538 GKTZCRJPZHJZLH-IBGZPJMESA-N 430.524 4.187 10 10 IICE CC1=C(C)CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1542043986 NAZKKGDCORRDBF-UHFFFAOYSA-N 427.568 4.047 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CC(C)(C)OC[C@@H]1C 1542228829 WMTFCMXMUQQGMT-SFHVURJKSA-N 439.629 4.357 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1 1543181601 ZPWMXIGZNKMFHP-UHFFFAOYSA-N 429.520 4.398 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c[nH]nc1-c1ccc(Cl)cc1 1545632966 ZWNMZSXQBZKUFM-GOSISDBHSA-N 445.350 4.484 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccc3c(c2)OCCN(C(=O)OC(C)(C)C)C3)c1 1545684154 LTVYEIMRLWWQEX-HNNXBMFYSA-N 442.512 4.021 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H](c1cccs1)N(C)C 1546418550 DAAPZDLBTNODEQ-NRFANRHFSA-N 438.645 4.442 10 10 IICE CC[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1546696570 DGAFWTCLWUBPEQ-GOSISDBHSA-N 429.584 4.127 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1csc(-c2cccs2)n1 1557639066 FVDGLEZYEYFBLE-UHFFFAOYSA-N 441.622 4.427 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@H](COc4ccccc4Cl)C3)C2)cc1 1565055637 HSAHMMABFJJNFS-RTBURBONSA-N 443.975 4.428 10 10 IICE CC(C)(CC1CCCCCC1)NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1565363763 XOXSNWLMWYORRO-UHFFFAOYSA-N 428.621 4.327 10 10 IICE Cc1nc2c(Cl)cccc2cc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1596684406 LLURMKCZSUTISJ-UHFFFAOYSA-N 431.870 4.241 10 10 IICE COc1cc(Br)c(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1OC 1597801109 XOBZXJYEVSYIQU-AWEZNQCLSA-N 435.362 4.202 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1614266496 MHBXROHVFIUDSY-YUXAGFNASA-N 427.593 4.028 10 10 IICE COc1cc(N(C)c2nnc(C)n2CCCSc2nccs2)cc(OC)c1OC 1619120114 UTIMPMSUHOTBQB-UHFFFAOYSA-N 435.575 4.019 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@](CO)(Cc3ccccc3)C2)cc1 1625256786 ATQWHLRLSKYIKG-MUUNZHRXSA-N 444.575 4.293 10 10 IICE Cc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)n[nH]2)cc1 1629055390 IUAWIFLDYOOJJV-QGZVFWFLSA-N 426.467 4.385 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(CC(=O)NC3CCCC3)CC2)cc1 1631034381 QGUMNCSCGRBYND-UHFFFAOYSA-N 449.595 4.137 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)cc2Cl)C1 1634720175 PVGRSEUAGSVIEX-HRAATJIYSA-N 447.023 4.023 10 10 IICE Cc1cc(C(=O)NCCc2cnc3c(Cl)cnn3c2)c(C)n1-c1cccc(Cl)c1 1637892428 MBXZQMKHWXUIIK-UHFFFAOYSA-N 428.323 4.416 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NN3Cc4ccc(Br)cc4C3=O)c2C)c1 1645711505 IMFOPEWNCXSCCH-UHFFFAOYSA-N 438.325 4.466 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](n3ccnn3)CC2)c(C)n1-c1cccc(Br)c1 1647874658 KXDIAUZAXCCSDT-SFHVURJKSA-N 442.361 4.316 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Cc2ccccc2Cl)CC1 1674711921 DGYWKYQERADIEM-UHFFFAOYSA-N 442.003 4.465 10 10 IICE CC[C@]1(C(=O)OC(C)(C)C)CCCN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)C1 1682188065 FMKDOEVXOVTDJY-CLOONOSVSA-N 445.604 4.065 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H]1CN(C)C(=O)OC(C)(C)C 1683253278 GQGKLHIQVQWYMM-NQIIRXRSSA-N 432.609 4.033 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC1CC2(CC(NC(=O)OC(C)(C)C)C2)C1 1685796478 XMFQFDDBAMQGEJ-UHFFFAOYSA-N 430.593 4.120 10 10 IICE CC[C@H](C)[C@@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1708372072 VPYYXSXAFOFGDU-WMZHIEFXSA-N 441.620 4.080 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C 1710908296 RZOCVELQGHTAJM-PMERELPUSA-N 427.618 4.213 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCCN(C(C)C)CC2)cc1 1728379175 GXXLUQGGNXTLHY-UHFFFAOYSA-N 447.631 4.155 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1728449804 JOFIPAHZVZFINY-UHFFFAOYSA-N 435.620 4.057 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCOC4)n3CC(C)(C)C(C)C)CC2)cc1 1748848146 VMLZWYGTLGZBDO-FQEVSTJZSA-N 441.620 4.190 10 10 IICE Cc1cc(-c2nnc(N3CCOCC3)n2CCCOCC(C)C)c(C)n1-c1ccccc1 1751412095 PIBQZALSSQNMQV-UHFFFAOYSA-N 437.588 4.252 10 10 IICE C[C@@H]1CCCN(CCCCn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752174930 OGSVRFZPFJHNRR-IRLDBZIGSA-N 441.620 4.026 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)C)CCO1 1763475871 KPABTSKVLKMVPB-QFIPXVFZSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N(C)Cc2ccoc2)cc1 1766613150 DJKRPXJMCJFPAF-UHFFFAOYSA-N 447.587 4.264 10 10 IICE CO[C@@H](CCn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)C(F)(F)F 1768068580 RJWCLLIUOXOABI-KRWDZBQOSA-N 440.491 4.240 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H](C)SC)CC2)cc1F 1768704872 QPKIPBFPSYGNAU-INIZCTEOSA-N 435.613 4.093 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3CCCN3Cc3ccccc3F)cccc21 1868173984 KHWWHYUXWXNJOR-QFIPXVFZSA-N 428.463 4.204 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010404790 VJMOMDRUCRPOLA-MOPGFXCFSA-N 431.537 4.036 10 10 IICE COc1ccc([C@@H](n2nc(C3CCC3)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2080008274 YWTOWNUKHVVWRV-QGZVFWFLSA-N 436.350 4.362 10 10 IICE C[C@H](NCc1cccc(Br)c1O)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116250437 GXUXWECRDQAGHZ-LRDDRELGSA-N 425.323 4.492 10 10 IICE COc1ccc(Br)c(CNC(C)(C)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1O 2236053929 BVNDURFTNFETDP-INIZCTEOSA-N 443.382 4.431 10 10 IICE COc1ccc(NCc2cccc(Br)c2O)cc1I 2265782350 ZVAASLJAPWHWOP-UHFFFAOYSA-N 434.071 4.380 10 10 IICE N=C1C(=Cc2ccc(-c3ccc(C(=O)O)cc3)o2)C(=O)N=C2SC(c3ccccc3)=NN12 2293332607 KDLXIVDOPBICPN-UHFFFAOYSA-N 442.456 4.312 10 10 IICE O=[N+]([O-])[C@@H]1CCc2c(c(S(=O)(=O)O)cc(O)c2N=Nc2c(O)ccc3ccccc23)C1 2296565797 FEHJAXFOIHYSTA-GFCCVEGCSA-N 443.437 4.047 10 10 IICE CCOC(=O)c1cccc(N2C(=O)C(=Cc3ccc(O)c(OCC)c3)SC2=S)c1 2314731976 LAXHLUCSENTDCD-UHFFFAOYSA-N 429.519 4.373 10 10 IICE COc1ccc(C2=NN(c3ccccc3)C(=O)C2=Cc2cc(OC)c(O)c(OC)c2)cc1 2332147388 ACCSKLRIOZZWQQ-UHFFFAOYSA-N 430.460 4.253 10 10 IICE CCOC(=O)c1[nH]c2ccccc2c1/C=C1\C(=O)N(c2ccc(F)cc2)C(=S)N=C1O 38172465 FPYRWCFSAJVQGG-WJDWOHSUSA-N 437.452 4.155 10 10 IICE Oc1c(Cl)cc(Br)cc1[C@H]1Nn2c(COc3ccccc3)nnc2S1 59168804 WVLZPTXGNYHEOP-HNNXBMFYSA-N 439.722 4.327 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1OCC 206931031 HVYLTHRPPKHYTF-CPNJWEJPSA-N 442.562 4.339 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@@H](c2cccc(Cl)c2)N3)CC1 226716109 OESDAGULAZQRDM-ZRCGQRJVSA-N 444.000 4.103 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1F 727602021 JGZHYCYFNMIJTP-OAQYLSRUSA-N 444.938 4.203 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@@H]3CCCc4cc(OC)ccc43)cc2F)CC1 730194655 UKNMVQPZZYLAMJ-NRFANRHFSA-N 439.575 4.103 10 10 IICE C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754245447 GXBXLVRJOMMNNL-PFONDFGASA-N 431.439 4.385 10 10 IICE Cc1ccn(-c2ccccc2NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 759523376 RUKKOLYNQIUBCO-QZTJIDSGSA-N 437.519 4.255 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C/c2ccc(Br)c(F)c2)SC1=S 763114704 SSICNCUFJYRRAP-LCYFTJDESA-N 432.336 4.434 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)c2)c1C 766385777 JDIOCICFHWGUGI-UHFFFAOYSA-N 432.568 4.413 10 10 IICE Cc1cccc(C)c1NC(=O)COC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 769664035 VHLQHISSANEVAB-UHFFFAOYSA-N 433.552 4.207 10 10 IICE O=C(Nc1nc(C(F)(F)F)cs1)C(=O)N(Cc1ccccc1O)C1CCCCC1 793035172 LRCODGPEYJYLKJ-UHFFFAOYSA-N 427.448 4.168 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2cccc(Br)c2O)[C@H](c2cccnc2)C1 800532812 XOSFFMYGMNWOOC-SFHVURJKSA-N 448.361 4.344 10 10 IICE CC(=O)C(=O)COC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccc(Cl)cc1 808496923 DEKVQGVAIDGKDB-UHFFFAOYSA-N 447.878 4.115 10 10 IICE Cc1cc(C(=O)N2CC[C@H](N3CCC3)[C@H](F)C2)c(C)n1-c1ccccc1Br 819532146 UHVLMRGKBIYHQU-QUCCMNQESA-N 434.353 4.115 10 10 IICE CC(C)Cn1cc([C@@H]2N(Cc3cccc(Br)c3O)CC23CCOCC3)cn1 849477971 CUHHUEPHGHITBK-FQEVSTJZSA-N 434.378 4.361 10 10 IICE CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cccc(Cl)c3C)n2)s1 915290880 BCEBRJBAEDMZPR-UHFFFAOYSA-N 441.987 4.270 10 10 IICE CCOc1ccc([C@H](C)NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 918200107 XIURMZFHQMXBTC-KURKYZTESA-N 429.536 4.398 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccn(-c3cccc(Br)c3)n2)cc1 1125166941 QKJBWMWLXBMXFU-UHFFFAOYSA-N 427.346 4.411 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc4c(F)ccc(F)c4c3)cc2F)C[C@H](C)O1 1125255804 CCRXVNYZKOSHIW-KBPBESRZSA-N 429.442 4.196 10 10 IICE Cc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1Cl 1125256315 IDFHARBWCOTPNX-KBPBESRZSA-N 435.883 4.239 10 10 IICE CCN(C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)[C@H]1CCN(c2ccccc2)C1=O 1144623909 SZXSEHZFLOZIQR-DEOSSOPVSA-N 431.536 4.370 10 10 IICE Cc1cc(C(=O)OC(C)(C)C)cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 1151903694 RNHIYFCAWSRROC-OAQYLSRUSA-N 425.525 4.477 10 10 IICE COc1cc(N2CCN(C(=O)c3sc4ccccc4c3C)CC2)c([N+](=O)[O-])cc1OC 1185466546 IHTNGEZAADNSEE-UHFFFAOYSA-N 441.509 4.098 10 10 IICE Oc1ccccc1CN(Cc1cn(-c2ccc(Cl)c(Cl)c2)nn1)C[C@@H]1CCCO1 1192011294 AIZOXOODMCEXCJ-SFHVURJKSA-N 433.339 4.461 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3[C@H](O)C(F)(F)F)cc2Cl)C1 1235834051 NAZQKHOBUSHRSG-BVGQSLNGSA-N 433.902 4.174 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(NC(=O)NCc3c(O)ccc4c3CCCC4)CCC[C@@H]12 1256543785 UCLHNXRAIVYSJE-YKSBVNFPSA-N 429.561 4.002 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3cc(Cl)cc(Cl)c3)CC2)c(OC)c1 1287478774 WBBZAQKIIOKLTI-UHFFFAOYSA-N 439.339 4.128 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H]1/C=C\c1ccccc1 1312833180 GJYYIMHOOMEFFV-GWQNQTGSSA-N 427.495 4.189 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCCc3cc(-c4ccccc4)no3)C2)cc1 1312902142 JDPNDHJVPHAPSQ-FQEVSTJZSA-N 448.567 4.451 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(CC2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1313776820 GSOSOFHADYINTK-FQEVSTJZSA-N 429.584 4.270 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](COC)C1 1315773054 DFJDRLKGDDDLHW-GHTZIAJQSA-N 437.588 4.108 10 10 IICE CN(C)Cc1ccc(NCc2ccc(N3CCN(C)CC3)c(F)c2)cc1Br 1326128528 LGMAYNSFKRIQRT-UHFFFAOYSA-N 435.385 4.014 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1C(=O)Nc2ccc(Br)cc21 1350044292 HDUDFCCPELLXJH-IBGZPJMESA-N 444.373 4.378 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1)C1CCCCC1 1442451097 SESGYVOMKJPZOS-QHCPKHFHSA-N 436.512 4.173 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@H](Cc2ccccc2Cl)C(N)=O)c1 1444207493 LILABPBZGRERGY-KRWDZBQOSA-N 444.362 4.475 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCSc1cccc(Cl)c1 1446816797 QZDSSUACSUAMLM-UHFFFAOYSA-N 428.337 4.383 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccnn2Cc2cccc(Br)c2)cc1 1464786769 ZZCWRGFQIVPKIL-UHFFFAOYSA-N 427.262 4.109 10 10 IICE O=C(CCOc1cc(Cl)cc(Cl)c1)NCc1ccc(N2CCC(CO)CC2)cc1 1465395021 KUZRAYLIHQJMDI-UHFFFAOYSA-N 437.367 4.287 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1csc(-c2ccccc2Cl)n1 1470446685 VRJZFZRUVPIXOU-UHFFFAOYSA-N 427.957 4.355 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CCC3(CCOCC3)CO2)cc1 1479198019 BULUQEWLDKQNKF-JOCHJYFZSA-N 441.572 4.033 10 10 IICE C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1C 1493971216 FNHUUZNZAPCALR-MOPGFXCFSA-N 443.611 4.373 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(C)(C)COC 1495642868 YZDWIPCQONZBDK-LJQANCHMSA-N 429.609 4.190 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](COC)OC)C1 1514090981 RSLVUZLHYCZBCV-UNMCSNQZSA-N 437.588 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c(Nc3cnn(C)c3)nnc2-c2ccc(Cl)nc2)cc1 1515530607 VHNALIYUOFGBPA-UHFFFAOYSA-N 436.951 4.365 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cc2ccccc2o1 1515589741 UXKFGGAUOISNBU-ODLFYWEKSA-N 440.521 4.480 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)O1 1519283114 OWGCLQKDBBJKHS-NPYCQEQBSA-N 444.959 4.000 10 10 IICE O=C(CCCc1ccc2c(c1)CCCC2)NCc1cc(F)c(N2CCOCC2)c(F)c1 1527864082 ITDYQPBMSVGIOK-UHFFFAOYSA-N 428.523 4.319 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3cc(C(F)(F)F)ccc3n2C)N(C)C)cc1 1539236380 STXMAUJATJKMAG-NRFANRHFSA-N 432.490 4.296 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)c1 1542683983 MERZINPBQBFNKI-UHFFFAOYSA-N 435.568 4.161 10 10 IICE COC(=O)CCN(C[C@@H]1CCCO1)C(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1543790515 YAGPXFLOOLATJL-QFIPXVFZSA-N 426.557 4.402 10 10 IICE Cc1cc(C(=O)N[C@H]2Cc3cccc(O)c3C2)c(C)n1-c1ccccc1Br 1556198252 ZTOVYCBBQJJFGU-INIZCTEOSA-N 425.326 4.459 10 10 IICE COC(=O)c1ccc2nc(CNC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)[nH]c2c1 1556868390 YRPRXVKHNPZDMG-UHFFFAOYSA-N 436.899 4.340 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)N(C)C)cc1 1558722803 CPBNXVSHEZMXJF-IBGZPJMESA-N 447.352 4.168 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CO[C@@H](CCC(=O)OC(C)(C)C)C3)cc2)CC1 1565663586 IKDNHNFNRUCBAU-IRLDBZIGSA-N 430.589 4.066 10 10 IICE Cc1cc(CCNC(=O)[C@@H](O)c2cccc(Br)c2)c(C)n1-c1ccccc1 1586622373 SQTQONZAZXQXNG-NRFANRHFSA-N 427.342 4.249 10 10 IICE Cc1occc1CN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1611859222 IVFRDQQNGOQBFI-UHFFFAOYSA-N 441.551 4.137 10 10 IICE Cc1cccc(-c2nnc(N3CCC[C@H](C(F)F)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1612204319 WGYHIWRMPIBCJM-KRWDZBQOSA-N 444.505 4.383 10 10 IICE CCCCN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1614491464 VXUDTXJDMKXPDY-OAQYLSRUSA-N 429.634 4.358 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CN(C(=O)OC(C)(C)C)CC3(C)C)ccc21 1617850966 DSCBPURYDAEZNJ-OAQYLSRUSA-N 443.588 4.280 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@](C)(O)c2ccccc2Br)cc1 1626193939 LGYAXWRMHBXCDD-JOCHJYFZSA-N 427.342 4.494 10 10 IICE CC1CCN(c2ccc(CNC(=O)C3(CC(=O)OC(C)(C)C)CCOCC3)cc2)CC1 1628608609 HKEIMGXRZHZGRM-UHFFFAOYSA-N 430.589 4.068 10 10 IICE O=C(c1cc(=O)c(OCc2ccc(F)cc2)co1)N(Cc1ccco1)Cc1ccccc1O 1629944045 ZZFUCIBZUSUPEQ-UHFFFAOYSA-N 449.434 4.499 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1634398103 COOFJLBREUEDOB-DENIHFKCSA-N 440.588 4.193 10 10 IICE Cc1cc(C(=O)N2CCN3C(=O)N(CC(C)C)C[C@@H]3C2)c(C)n1-c1cccc(C(C)C)c1 1635788519 DYKZVZRUBBXFGQ-QHCPKHFHSA-N 436.600 4.436 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](c2cccc(Cl)c2)C2CCCCC2)c1 1636177328 WSSWOULWYQBDIY-FQEVSTJZSA-N 436.961 4.469 10 10 IICE CN(C)c1ccc(CNc2ncnc3c2cnn3-c2cccc(Br)c2)cc1F 1639363463 HFJZSZXRBSOENW-UHFFFAOYSA-N 441.308 4.395 10 10 IICE O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1OCc1ccccc1 1640200764 WGYJCAKMCNQAPT-UHFFFAOYSA-N 434.496 4.142 10 10 IICE COc1ccc(C(=O)c2ccccc2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1640232024 HVGIBWQTCIXPKV-VWLOTQADSA-N 445.563 4.025 10 10 IICE O=C(Cc1ccc(I)cc1)NCc1ccc(N2CCCCC2)cc1 1643394510 JDHCOSFWHBYPCL-UHFFFAOYSA-N 434.321 4.140 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@H]1CCN([C@H](C)c2ccc(F)cc2)C1=O 1657431353 LCRSHRSOJOEICE-KUHUBIRLSA-N 435.337 4.478 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](C)c3cccc(OC(F)(F)F)c3)C2)cc1 1673823628 XHXDPTKCFPMIPM-CVEARBPZSA-N 437.462 4.481 10 10 IICE COC(=O)[C@@H]1CN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)Cc2ccccc21 1684600940 ZGQWJUQQXYADGS-XMMPIXPASA-N 431.536 4.385 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3oc(-c4ccccc4)cc3C2)N(C)C)cc1 1684607927 XOVZZWVEJDVYQO-HSZRJFAPSA-N 432.568 4.383 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@@H]1CCCCC1(F)F 1696701262 ZCUZQODYWZKSMP-SFHVURJKSA-N 427.499 4.431 10 10 IICE Cc1ccc(-c2nnc(N3CCS[C@H](C)[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1724327328 SVKWSDPOLZUGDE-HZPDHXFCSA-N 429.565 4.430 10 10 IICE CC(C)c1nnc(N2CCC(C(F)(F)F)CC2)n1Cc1ccc(N2CCOCC2)cc1 1760908041 NLBNDZHHQRNIDP-UHFFFAOYSA-N 437.510 4.065 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](SC)C(C)(C)C 1762192431 BLEWRFMWBDTNOP-LJQANCHMSA-N 447.649 4.316 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC1(C)C 1770651645 OTLPICKZKIIURI-MRXNPFEDSA-N 449.671 4.431 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1772854412 VHYLTGBWFUILNV-GOSISDBHSA-N 436.604 4.313 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)NC(=O)c3c(C)ccc4ccccc34)CC2)cc1 1861903397 XWZCUVRZMDCFKD-UHFFFAOYSA-N 445.563 4.014 10 10 IICE CC(C)[C@@H](C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1)N1C(=O)c2ccccc2C1=O 1865902177 UCTKYEVHOSVUHN-QHCPKHFHSA-N 427.504 4.119 10 10 IICE O=C(N[C@H](CCc1cccc(O)c1O)C(=O)O)OCC1c2ccccc2-c2ccccc21 1951401120 CIAMLDJAHYZELY-OAQYLSRUSA-N 433.460 4.022 10 10 IICE NCc1cc(F)c(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1Br 2148931793 COCJEHATVQNEML-PKOBYXMFSA-N 432.381 4.395 10 10 IICE Oc1ccc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156285018 PIBWBRJYFZSFPQ-FQEVSTJZSA-N 431.374 4.068 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CCN(Cc4ccccc4)[C@H]3C2)c(Br)c1 2188889452 YGDNJHYRSSEKAP-RXVVDRJESA-N 427.342 4.258 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@H]2CNC(=O)OC(C)(C)C)c(O)c1Br 2381133778 SNHHICIZCKGWKJ-DZGCQCFKSA-N 441.366 4.020 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1 9228754 SMBXHZDTIPVCPS-UHFFFAOYSA-N 449.507 4.297 10 10 IICE COc1ccc(CCn2c(-c3ccc(N4CCCC4)cc3)cc(C(N)=O)c2C)cc1OC 43223925 NBNQAYKAXKEFST-UHFFFAOYSA-N 433.552 4.423 10 10 IICE Cc1occc1C(=O)NC1CCN(CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 727437430 RLJSLRUXLGBWLD-UHFFFAOYSA-N 437.515 4.212 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1ccc3c(c1)CCCN3C)O[C@@H](C)C2 730828696 WZMWCYSNDUAXQI-XUEUYAKLSA-N 435.568 4.146 10 10 IICE C[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](c2ccccc2)O1 745903847 JDYIJQIRTDGFQC-JUXOCIIHSA-N 445.510 4.428 10 10 IICE CN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769046851 CRXXDTJSJYUVBJ-UHFFFAOYSA-N 433.021 4.275 10 10 IICE O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2cc(Br)ccc2O)C1)C1CCCC1 779619310 KZXIQXVGBFOPTE-HNNXBMFYSA-N 447.377 4.386 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1nc2ccccc2cc1Br 811522487 AMDGXSXMPWACNB-UHFFFAOYSA-N 436.103 4.395 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CC(=O)N(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 1126079537 DALQMHUQSNRXOT-AUSIDOKSSA-N 445.966 4.468 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3cc(Br)ccc3C3CC3)c2)CC1 1128143875 KCRUVJWDHRHRSO-UHFFFAOYSA-N 442.357 4.247 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCO[C@H](c3nccn3C)C2)c(C)n1-c1ccc(Cl)cc1 1129764485 MXUCSGRAEFRCLO-FPOVZHCZSA-N 426.948 4.060 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H](c1ccccn1)C1CC1 1134170551 NKIMPXXKTDEOQF-LVSKKATPSA-N 441.553 4.080 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H]3C)ccc21 1137902014 SIZRQLYKOXXJMJ-DLBZAZTESA-N 443.588 4.374 10 10 IICE Cc1cc(CC(=O)NC[C@@H](O)c2cccc(Br)c2)c(C)n1-c1ccccc1 1138765138 XFXMCTAUWHQPDV-OAQYLSRUSA-N 427.342 4.249 10 10 IICE Cc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1 1142528457 YKMCIOGYRMIONZ-UHFFFAOYSA-N 428.598 4.244 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCN1CC(F)(F)F 1235836276 ZIMHQERJWKORJM-CVEARBPZSA-N 446.945 4.354 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ncsc3-c3ccccc3)cc2F)C[C@@H](C)O1 1264688933 DFAVXJYHPOJQFC-HZPDHXFCSA-N 425.529 4.493 10 10 IICE CC(C)(C)OC(=O)NCCc1ccc2c(c1)CCCN2C(=O)/C=C/c1cncc(F)c1 1289668723 XKHVNABGBIZDMK-VQHVLOKHSA-N 425.504 4.281 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2 1290290806 MDNCQLOEIGQTID-UHFFFAOYSA-N 429.586 4.380 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC[C@H]1OC 1291443257 VIQFDRWFZCFCFH-IEIRFRATSA-N 441.620 4.080 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](CN(CC)CC)C2)n1Cc1ccc2c(c1)CCCN2C 1291501780 VZOPDHDKTPLZRP-UNMCSNQZSA-N 438.664 4.390 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(-c3ccc(F)cc3)n(C)n2)cc1 1292382610 UQPDPXGWEMFKDK-JOCHJYFZSA-N 436.531 4.114 10 10 IICE CC(C)[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1302770077 MZCJNMFZMGPPFR-OAQYLSRUSA-N 443.661 4.038 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC(C)(C)C(C)C 1303330505 VWVMVCAFLJYGHF-UHFFFAOYSA-N 440.636 4.335 10 10 IICE O=C(NCc1c(O)cccc1F)c1ccc(NC(=O)c2cccc(Br)c2)cc1 1303878136 LRWIDQMINOQOTA-UHFFFAOYSA-N 443.272 4.476 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CC(C)(C)OC[C@@H]1C 1304240882 ODXKGTOUGKAYOD-IBGZPJMESA-N 425.621 4.437 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)CCc1cn(C)nn1 1306451436 MKNUDJUCHVXZSW-LJQANCHMSA-N 431.462 4.059 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1306564409 ATZAZSHTIFNSIC-QGZVFWFLSA-N 432.576 4.154 10 10 IICE COc1ccc(N2CCN(CCCNc3cc(C(F)(F)F)ccc3[N+](=O)[O-])CC2)cc1 1306918732 UPIQAJNJXVKAQE-UHFFFAOYSA-N 438.450 4.246 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2C[C@H](OCc3ccccc3)C2(C)C)N(C)C)cc1 1312555704 KYZJOBMBANDSAF-HJOGWXRNSA-N 438.616 4.038 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F 1312886383 UUECTIRCEJLPFD-SFHVURJKSA-N 432.559 4.044 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CCC=C(C)C2)cc1 1313678272 GKQZUYLIBBMSTA-GMAHTHKFSA-N 439.604 4.053 10 10 IICE COCCN(c1nnc(-c2cccnc2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@@H](C)C1 1316080424 MECKWSPRELNAIW-NTKDMRAZSA-N 448.615 4.404 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc2scc(-c3ccccc3)n2c1=O 1318167862 VYZUVCMYJCEBBS-UHFFFAOYSA-N 432.549 4.151 10 10 IICE C[C@H](NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CCCC1(C)C)c1ccc(N2CCOCC2)cc1 1357128140 KJCSRWVETIRSQA-RXVVDRJESA-N 445.604 4.126 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(-c2cccc(Br)c2)no1 1361102471 TWFRURXYIZILAF-UHFFFAOYSA-N 428.286 4.209 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)cc1F 1441742632 NICLXKXAVBZSBQ-UHFFFAOYSA-N 433.527 4.448 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(-c2cccc(Cl)c2)nc1O 1451918583 PIDBFBLTXJHDRO-UHFFFAOYSA-N 440.883 4.019 10 10 IICE C[C@H]1Oc2ccccc2N(CCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1=O 1464536199 JKRLDNFZLDXARJ-LJQANCHMSA-N 435.568 4.276 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)cc1 1466932558 XVILKNUDMNKTKP-SIKLNZKXSA-N 436.474 4.049 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H](CC(C)(C)C(N)=O)C2)c(C)n1-c1ccc(Cl)cc1 1468199722 UEPABFPLELNRED-SFHVURJKSA-N 429.992 4.430 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCCOc1cccc(F)c1 1471534156 GDTMUMBKYSWIHN-UHFFFAOYSA-N 425.298 4.294 10 10 IICE CC[C@@H]1c2ccccc2CCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1473168154 ORCJMOXDJQUIQF-KHCICDEESA-N 439.575 4.065 10 10 IICE CSc1ccc([C@H](C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1473427453 AXQIRXNUAIFUFS-HNNXBMFYSA-N 430.529 4.473 10 10 IICE CC[C@]1(C)CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1513562466 CQSKUIHKYKARGY-RUZDIDTESA-N 425.621 4.378 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3CC(OCc4ccccc4)C3)cc2F)C[C@@H](C)O1 1516815579 MSMSTGCYFKXJSR-NFAVZRQZSA-N 426.532 4.051 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@]3(CCCOC3)C2)cc1F 1517004086 WGMSWVAMOKZDEP-DEOSSOPVSA-N 429.584 4.127 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)OCc2ccccc2S(=O)(=O)N(C)C)c1 1521114369 CSAFDHQMUDFHKW-UHFFFAOYSA-N 446.956 4.355 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1ccccc1Cl 1522184857 JOHUNXKFQMADPI-GZTJUZNOSA-N 434.945 4.387 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3F)C2=O)cc1 1531594379 KTRJXHDXXOFXCG-HXUWFJFHSA-N 425.891 4.422 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3c(C)nn(-c4ccccn4)c3C)c2C)c1 1531612785 WIWTWFVNYBVRPT-UHFFFAOYSA-N 427.552 4.459 10 10 IICE CC(C)(C)c1ncc(/C=C/C(=O)N(CCN2CCOCC2)c2ccccc2Cl)s1 1535294797 PBSOGTFCPWTDPF-CMDGGOBGSA-N 434.005 4.473 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nn1C1CCOCC1 1538420592 BMWPFARQWIHPSP-INIZCTEOSA-N 430.980 4.363 10 10 IICE Cc1cc(C(=O)NCCCN2CCCC[C@@H]2C)c(C)n1-c1ccc(Br)cn1 1539017526 OLGYGLSSHAVRQG-HNNXBMFYSA-N 433.394 4.246 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccnc(Oc3ccc(F)cc3F)c2)N(C)C)cc1 1539704553 BORKXHQSBOXVNE-OAQYLSRUSA-N 440.494 4.251 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(N2CCC(C)CC2)nc1 1541429159 YIXHZUPPPPJBJL-UHFFFAOYSA-N 448.615 4.498 10 10 IICE CCN(Cc1ccc(Cl)s1)c1nnc(C)n1Cc1ccc(N2CCOCC2)c(F)c1 1547505784 SQMXRANECHDANA-UHFFFAOYSA-N 449.983 4.352 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1CCCN(C)C1CCCCC1 1554174995 GAMFXBBVGHQKAW-NRFANRHFSA-N 441.620 4.169 10 10 IICE Cc1cc(C(=O)NC(C)(C)CCN2CCOCC2)c(C)n1-c1ccccc1Br 1557602962 WBDQMQRMHCDHIV-UHFFFAOYSA-N 448.405 4.087 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1C 1565905857 CPEVCFRELOKVSK-RLWLMLJZSA-N 431.580 4.422 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@H](C)c1ccccc1 1566185378 GGWDJBGTHILKMJ-LSDHHAIUSA-N 430.551 4.177 10 10 IICE Cc1ccc(C)c(N2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)c1 1566647422 ZLSYJUJBWDLYKG-UHFFFAOYSA-N 429.564 4.415 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cccc2c1OCC2 1586379000 JMGXOJJXNOBAAP-VBKFSLOCSA-N 430.576 4.303 10 10 IICE CCCCc1nc(C)c(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 1595583994 LAWJEIQTMGWDDG-GOSISDBHSA-N 436.021 4.476 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc(I)cc2Cl)cc1 1595753811 YKYHPWSIIYEVSR-UHFFFAOYSA-N 428.617 4.359 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(Br)cc1 1598276737 IEXWNPHGNCUBKO-OAQYLSRUSA-N 430.390 4.011 10 10 IICE O=C(CCC[S@@](=O)c1ccc(Br)cc1)NCc1cccc(Cl)c1O 1606860796 UEZQMALPMYJGQX-XMMPIXPASA-N 430.751 4.012 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)cc1[N+](=O)[O-] 1613693809 QWBWJMLHWPQIDE-UHFFFAOYSA-N 426.400 4.190 10 10 IICE C[C@@H]1CC(=O)CC[C@H]1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616573195 QVJNDWUQAFISEG-IUODEOHRSA-N 427.302 4.103 10 10 IICE Cc1ccc([C@H](CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)N2CCOCC2)o1 1623524125 FVWIKWYIDCDXCW-QFIPXVFZSA-N 441.959 4.452 10 10 IICE C[C@H]1CC(=O)Nc2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)cc2N1 1624286088 GOXNVMIIKDMFOG-KRWDZBQOSA-N 432.524 4.331 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1C 1629640102 UHUHSQIUBCZXEX-PGRDOPGGSA-N 441.572 4.157 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@H](c2ccccc2)c2ncc[nH]2)cc1 1631612524 PTQTVQMKAREKBA-DNQXCXABSA-N 432.568 4.206 10 10 IICE Cc1ccc(C(=O)Nc2ccc(CCNC(=O)N(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1631699137 DQLPMDPMYYTKAO-UHFFFAOYSA-N 446.551 4.281 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(OCc3ccccc3)ccc2[N+](=O)[O-])cc1 1632050494 VPXJELUWLMIYMS-UHFFFAOYSA-N 449.507 4.391 10 10 IICE Cc1ccc(C2=NO[C@@H](CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)cc1C 1634897181 WJRUPMQZLSLAFQ-XMMPIXPASA-N 429.520 4.446 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1c(Cl)cccc1-n1ccnc1 1635642152 JZKOSIAVECMYIG-QGZVFWFLSA-N 425.964 4.331 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC3(CCOCC3)CO2)c(C)n1-c1ccccc1Br 1635878228 VTRKGTXPHZGNQK-QGZVFWFLSA-N 447.373 4.172 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C 1639827208 KKGFMSQXILDZQU-UHFFFAOYSA-N 427.501 4.214 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CC[C@@H](C)N(C(=O)OC(C)(C)C)C3)ccc21 1642247097 GAUHINQBFFQDFC-UZLBHIALSA-N 443.588 4.422 10 10 IICE COC(=O)/C=C/c1ccc(N2CC(Cc3cccc(Br)c3)C2)c([N+](=O)[O-])c1 1643261830 BDAHNANJWHJHEZ-SOFGYWHQSA-N 431.286 4.222 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCO[C@@H](C(C)C)C2)sc(C)c1-c1ccccc1 1653877194 DCIVRTLBNNGVHJ-GOSISDBHSA-N 430.570 4.196 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H]2CN(c3ccc(Cl)cc3)CCO2)cc1 1683874792 JYVPDPXYMJQNQF-HSZRJFAPSA-N 445.007 4.233 10 10 IICE COC[C@H](NC(=O)NCc1c(O)ccc2c1CCCC2)c1cccc(Br)c1 1684723526 RBMTUUCZOSTSLW-IBGZPJMESA-N 433.346 4.220 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1691927414 OWHHSNWMNYQURJ-WOJBJXKFSA-N 429.584 4.298 10 10 IICE CCN(CC)c1nnc(Cc2cn3ccccc3n2)n1CCCSc1nccs1 1695632377 JJHXXLSOYLBGGZ-UHFFFAOYSA-N 427.603 4.002 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CC=CCC1 1729718930 SFMWYPSYLVTZMP-OAQYLSRUSA-N 446.599 4.281 10 10 IICE CNC(=O)CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1CC1 1748240797 URZKZICHOOSYPL-UHFFFAOYSA-N 434.588 4.115 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1752143348 ZYIHBARLNJOUHJ-HXUWFJFHSA-N 448.615 4.116 10 10 IICE CCCCN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764049666 CMWWSVTVUYWQQS-UHFFFAOYSA-N 448.615 4.142 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1C[C@H]1N(C)CCCC1(C)C 1768684661 XDWDMYWBRDZTAH-JOCHJYFZSA-N 425.621 4.473 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H](C)SC)CC2)cc1F 1768704873 QPKIPBFPSYGNAU-MRXNPFEDSA-N 435.613 4.093 10 10 IICE CCOC(=O)Oc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1865865023 OBOQVGUIDSUSFF-HSZRJFAPSA-N 439.556 4.245 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(O)c2cc(F)cc(F)c2n1 1866500034 RKNKGHIBRGKHNC-UHFFFAOYSA-N 430.366 4.246 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C(C)C)c(CO)c1I 2079958759 RDLYVQDDGVYJBV-OAHLLOKOSA-N 428.314 4.425 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1CCNCc1ccc(Br)cc1O 2226208171 SWWXOYLDGRTZSU-CQSZACIVSA-N 435.309 4.279 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)c1O 2236055270 OZVNHGFZHVCQHV-DAXOMENPSA-N 441.366 4.041 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3cccc(C)c3)nc3c(C)cccn3c2=O)SC1=S 2314507474 KCCOKCSTJLEKTK-UHFFFAOYSA-N 437.546 4.325 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccccc3)SC2=S)cc1 2314836101 ABGLVOYEBQBVLI-AWEZNQCLSA-N 440.546 4.092 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](CC2CC2)NC(=O)OC(C)(C)C)c(O)c1Br 2381139219 UEUQZPIFVUNFHB-OAHLLOKOSA-N 441.366 4.115 10 10 IICE COc1ccc(N2C(=O)N=C(O)/C(=C\c3ccc(-c4ccccc4[N+](=O)[O-])o3)C2=O)cc1 1201100 GBTWDVPHTXXPNR-SFQUDFHCSA-N 433.376 4.370 10 10 IICE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(\C)Nc1ccc(Cl)cc1C 19637177 TZUBCBLGSXEMAR-DEDYPNTBSA-N 442.859 4.208 10 10 IICE Cc1cc(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1F 26141686 COLYBAACHPHRIF-MRXNPFEDSA-N 428.529 4.470 10 10 IICE CC(=O)N1C(=O)/C(=C2/SC(Nc3cc(Cl)cc(Cl)c3)=NC2=O)c2ccccc21 33341802 XCGLEPMSQOVGMF-FOCLMDBBSA-N 432.288 4.339 10 10 IICE CCc1cccc2c(C3=CCN(c4ncnc5c4c(Br)nn5C)CC3)c[nH]c12 110848344 LEDKUGPGGANOBN-UHFFFAOYSA-N 437.345 4.463 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)OCC(=O)N3)c(C)n1-c1ccccc1Br 195589024 TYUVSPWGEZXWNX-UHFFFAOYSA-N 440.297 4.440 10 10 IICE COc1ccc(/C=C2\SC(=S)N(c3cccc(C(C)=O)c3)C2=O)c(C(=O)O)c1OC 210401709 RDAJJAVFMCNRNU-YBEGLDIGSA-N 443.502 4.010 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CCC(c4ccccc4Br)CC3)cc2N1 302600028 YFJYSEVWFZSGOH-UHFFFAOYSA-N 432.274 4.072 10 10 IICE Cc1nn(CC(C)C)c(C)c1CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726565422 MQEWYXDNIISSNH-UHFFFAOYSA-N 434.531 4.085 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@H]1C[C@@H]1c1cccc(F)c1 742769303 CQOMHTRAVBIUMG-QUCCMNQESA-N 437.437 4.036 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1 743808434 UGFSAUXQQNJUPR-UGSOOPFHSA-N 431.330 4.412 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1)c1ccncc1 758164382 XIMCAFYQPASBOW-UHFFFAOYSA-N 438.292 4.147 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)c(C)n1-c1cccc(Cl)c1 763772418 GINBAWMQKJVBTM-PZJWPPBQSA-N 428.916 4.305 10 10 IICE Cc1cc(Br)cc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1O 776252754 XKJNNLNABXMEPS-UHFFFAOYSA-N 444.417 4.285 10 10 IICE COc1ccc(O)c(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)c2cc(C)nc(Cl)c2)c1 788516834 SSIWYWQDWFPQQP-KRWDZBQOSA-N 449.935 4.030 10 10 IICE Cc1cc(Br)c(O)c(CN(CCO)Cc2ccc(Br)s2)c1 792196585 NNXUGUCVPMDDFI-UHFFFAOYSA-N 435.181 4.282 10 10 IICE Cc1ccc([C@H](NCc2cc(C)cc(Br)c2O)[C@@H](C)S(C)(=O)=O)cc1 798088166 IJVSRBDXBAPIPB-RDTXWAMCSA-N 426.376 4.036 10 10 IICE C[C@@H]1c2ccsc2CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 824650997 RSERJNYMSUTBQC-GFCCVEGCSA-N 432.457 4.191 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3ccc(C(C)(C)C)cc3)cc2F)CC1 1125908667 VUULFIXZLDSCBF-IBGZPJMESA-N 441.591 4.349 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 1137816836 SMWNNPVZJKPUQE-QGZVFWFLSA-N 447.926 4.489 10 10 IICE COc1ccc([C@@H]2CN(Cc3ccc(N(C)C)cc3)C[C@H]2NC(=O)OC(C)(C)C)cc1 1175522451 HATSKDYVXNZQCL-XZOQPEGZSA-N 425.573 4.254 10 10 IICE CCc1nc(NC(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)sc1C 1191582063 LGEAPRMQEDCGFK-UHFFFAOYSA-N 429.567 4.492 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCc2ccccc2CN(C)C(=O)OC(C)(C)C)c1 1230627863 CXFNEOXIJCZKBY-INIZCTEOSA-N 443.544 4.328 10 10 IICE CC[C@@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCO1 1289510803 LYDKTZHCKXINIW-UKRRQHHQSA-N 429.318 4.303 10 10 IICE COc1ccc(Nc2ccc(C(=O)NCc3ccc(N4CCOCC4)cc3)cc2)c(OC)c1 1292065951 OQJYJVXNFGKKBI-UHFFFAOYSA-N 447.535 4.214 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1C[C@H]1CCCO[C@@H]1C(C)(C)C 1298363917 OLNNWVBGUXWMDL-KNQAVFIVSA-N 437.588 4.467 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CCCC4)n3CC(C)(C)OC)CC2)cc1 1300247053 HMDZZHYJFNVLQQ-UHFFFAOYSA-N 441.620 4.161 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1 1300955870 GTWJDBFZRRTROY-RLLQIKCJSA-N 437.588 4.249 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCOC1 1300958434 VZFJIUPHNCSTTL-GHTZIAJQSA-N 437.588 4.108 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C1 1304916776 IETXDVJJVJBLPV-IAGOWNOFSA-N 428.631 4.385 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1 1315775683 NLKKPPDHQQSGHI-AZUAARDMSA-N 437.588 4.250 10 10 IICE CC(C)Cc1ccc(CCCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 1355064135 GYZRIDHCYVSYBA-DEOSSOPVSA-N 435.612 4.226 10 10 IICE C[C@@H](NC(=O)c1cc(F)cc(Br)c1F)c1ccc(N2CCOCC2)cc1 1357928326 MLFIAVINSYCGMX-GFCCVEGCSA-N 425.273 4.055 10 10 IICE CC(C)(C)c1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)nn1 1435268474 SKUAPKPICPISDU-NTCAYCPXSA-N 444.557 4.143 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC2(c3ccc(F)cc3)CCOCC2)cc1 1442227474 QLPYEPXVHLVRGG-UHFFFAOYSA-N 448.538 4.453 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccnc1SCc1ccc(Br)cc1 1455355651 DWTUPSDDZNTUSS-UHFFFAOYSA-N 445.338 4.478 10 10 IICE COC(=O)CN(CCC(F)(F)F)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1457563108 AKNKGCRASDIPSU-UHFFFAOYSA-N 430.854 4.244 10 10 IICE Cc1cc(C(=O)Cn2nc(C(F)(F)F)cc2Br)c(C)n1-c1ccc(F)cn1 1459133776 OWHBBQCLVDUZNB-UHFFFAOYSA-N 445.214 4.489 10 10 IICE Cc1ccc(O[C@H](C)C(=O)N2CCN(Cc3ccc(N(C)C)c(C)c3)CC2)c(Cl)c1 1459639847 SKIXKPRHAOXBKE-LJQANCHMSA-N 429.992 4.135 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)C1(c2cccc(OC(F)(F)F)c2)CCC1 1464452080 MOGBXZBTLCBSMQ-UHFFFAOYSA-N 434.458 4.160 10 10 IICE Cc1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C)n1C[C@H]1CCCOC1 1466290282 VNJAETVHPMLPAN-IFMALSPDSA-N 426.557 4.059 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@@H](Oc1ccc(F)cc1Br)c1ccccc1 1471661601 VAYIHDLTEANMJF-FQEVSTJZSA-N 446.272 4.436 10 10 IICE CC1CCN(c2ccc(Cn3c(N4CC[C@@H](C)[C@@H](O)C4)nnc3C(C)(C)C)cc2)CC1 1493873164 JTRAOPIPDFOGKK-KNQAVFIVSA-N 425.621 4.067 10 10 IICE C[C@H]1C[C@H](C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1511989848 SMLCNIYPHXXNQS-PMACEKPBSA-N 439.648 4.315 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(Br)c(SC)c3)C2)cc1 1537108988 IAZYFIAKDSOAGR-AWEZNQCLSA-N 435.387 4.436 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1Cc2cc(F)ccc2N(C(=O)/C=C\c2cncc(F)c2)C1 1538219173 WNSZEMJCTWZABO-OUOZUETKSA-N 429.467 4.103 10 10 IICE Cc1cc(C)n([C@H]2CCCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)n1 1543004338 SKFSFMPWDDDUPL-FQEVSTJZSA-N 439.583 4.310 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)CC(F)(F)F)cc1 1547447478 YAJPZQJYGUYVIC-SFHVURJKSA-N 425.499 4.413 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)cc1[N+](=O)[O-] 1559395868 MKGHELOOEFMMND-UHFFFAOYSA-N 440.427 4.498 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)C3CN(C(=O)OC(C)(C)C)C3)c2C)c1 1565193210 RPJXLIUEFUYKAC-UHFFFAOYSA-N 426.561 4.163 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(c3nncn3C(C)C)CC2)cc1 1565622745 ZSHROSYIPPCKPA-UHFFFAOYSA-N 433.556 4.028 10 10 IICE Cc1cc(C(=O)N[C@H]2CN(c3ccccc3)C2=O)c(C)n1-c1ccc(Br)cc1 1567495561 LEEWUDDKOSJODR-FQEVSTJZSA-N 438.325 4.002 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)c1 1567579248 UPGABWAMINISKX-UHFFFAOYSA-N 430.957 4.389 10 10 IICE Cc1cc(Br)c2oc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)cc2c1 1583476808 XKEIEQGWRYPZND-UHFFFAOYSA-N 442.357 4.186 10 10 IICE C[C@H](NC(=O)C1(c2ccc(I)cc2)CC1)c1ccc(N(C)C)cc1 1585423612 JLKFOWGEOBTGOS-AWEZNQCLSA-N 434.321 4.266 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1csc(-c2ccc(O)cc2)n1 1595582498 CXEBZSXFGCBRQP-KRWDZBQOSA-N 443.956 4.269 10 10 IICE CN(C)CCOc1cc(CNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)ccn1 1598189043 LCHBWHVOTHAVGW-UHFFFAOYSA-N 446.555 4.433 10 10 IICE O=C(N[C@@H](C(=O)NCCCSc1nccs1)c1ccccc1)OCc1ccccc1 1616241741 PYEINWKAPLGCHI-LJQANCHMSA-N 441.578 4.409 10 10 IICE COC(=O)CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(C)n(-c2ccccn2)c1C 1617057339 JCYMNQWROFYVDD-UHFFFAOYSA-N 445.441 4.323 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC[C@H]2CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1618252214 BCXQJONKUJHWCG-RDJZCZTQSA-N 444.403 4.409 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC(C)(C)N1CCc2ccccc2C1 1625765623 JSYBIMSOOYNOAD-UHFFFAOYSA-N 429.564 4.473 10 10 IICE Cc1cc(C(=O)N2C[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)c(C)n1-c1ccc(F)cc1 1627004251 FAWZFENYOAJWKD-DYESRHJHSA-N 427.520 4.315 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(Br)cc(Br)c1 1627073823 WLPOEYRZYYHNRQ-UHFFFAOYSA-N 436.103 4.395 10 10 IICE COc1ccc(N2CCN(C(=O)CC[C@@H](O)c3ccc(C(C)(C)C)cc3)CC2)cc1F 1630202308 SKMLFVKOTPYHHW-JOCHJYFZSA-N 428.548 4.294 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3sc(SC(F)(F)F)nc3C)CC2)cc1 1630714021 XVKXVHQHSNUNHR-UHFFFAOYSA-N 445.532 4.353 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](C[C@@H]2CCCO2)C(F)(F)F)cc1 1631608347 ULWSSILQHSYYDW-SLFFLAALSA-N 428.495 4.008 10 10 IICE Cc1cc(C(=O)NCc2cccc(N(C)C)n2)c(C)n1-c1ccc(Br)cc1 1632108819 CGEBVCCFFOKPFR-UHFFFAOYSA-N 427.346 4.248 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@H]4C[C@@H](N(C)C)CC[C@H]4C3)cc2Cl)C1 1634720130 OOINAAVYYSLACE-PMXSJFBMSA-N 433.040 4.448 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1 1637227760 BWBUOLHATHBHAZ-LJQANCHMSA-N 447.501 4.366 10 10 IICE CCCOc1c(Cl)cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1OC 1646430954 HEAQYXDLJBVXCD-UHFFFAOYSA-N 432.948 4.029 10 10 IICE Cc1cc(C(=O)NC2CC(NCC(F)(F)F)C2)c(C)n1-c1ccc(Br)cc1 1653105668 DJQJDPNVVAQPGX-UHFFFAOYSA-N 444.295 4.269 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N[C@H](C)c2ccccc2O)sc2c1CC[C@@H](C)C2 1655349814 UJTKOMOQWSCXNV-RBSFLKMASA-N 430.570 4.433 10 10 IICE CC(C)c1ccc(O[C@@H](C)CNC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1672572252 QBYAISNPGBUTSQ-CYFREDJKSA-N 426.605 4.245 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2C[C@H]2C[C@H]2C)c(C)n1-c1ccccc1 1692981280 FRRRRABREMWZRV-WIYYLYMNSA-N 448.615 4.217 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(NC(C)=O)CC1 1694981807 QFBNHELWTPGNGF-POHAHGRESA-N 446.599 4.424 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1695624198 JRGUYNZNSWAJKM-DEOSSOPVSA-N 448.615 4.164 10 10 IICE CCN(CC)[C@H](C)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1695666759 IZKJNBWUNUNHPM-OAQYLSRUSA-N 447.631 4.307 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccccn1 1696425092 ZVVNHIFFFRQRFJ-UHFFFAOYSA-N 430.556 4.421 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1nccs1 1708508470 HHQWQUYXRKXGLO-SFHVURJKSA-N 440.617 4.216 10 10 IICE CCOCc1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1710661873 XQFZRCZDGABCRU-LJQANCHMSA-N 443.661 4.289 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC[C@@H]3CCO[C@@H](C)C3)CC2)cc1F 1748849375 NKUHSMLDRZMTLX-RBUKOAKNSA-N 445.583 4.081 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1C 1749709072 RXZBRJLGBKAUQE-UHFFFAOYSA-N 447.587 4.067 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC1CCOCC1 1763710156 GRICJKKHPLUSSB-HXUWFJFHSA-N 441.620 4.334 10 10 IICE CC(C)Oc1cccc(CNCCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1860714508 HXHMHXUQXVNBQI-UHFFFAOYSA-N 442.515 4.368 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)N[C@@H](C)CC)sc(C)c1-c1ccc(OCC)cc1 1860762537 JITQOSPGGAHLPZ-ZDUSSCGKSA-N 432.542 4.152 10 10 IICE C[C@H]1C[C@@H](CNCc2cc(Br)cc(F)c2O)CN(C(=O)OC(C)(C)C)C1 2115922177 GWDNWXWXELEIGB-STQMWFEESA-N 431.346 4.277 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CNCc2cc(Br)ccc2O)CC12CCC2 2116698955 PSDIWKNBHPTDFQ-AWEZNQCLSA-N 425.367 4.424 10 10 IICE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)CC[C@H](NC(=O)OCc2ccccc2)C(F)(F)F)C1 2180964111 SLBBUVXCYIMAOU-HOTGVXAUSA-N 427.427 4.173 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(N4CCCCC4)SC3=NC2=O)c(C)n1-c1ccccc1 2297352639 IORCZNSHSQHKFO-UHFFFAOYSA-N 432.553 4.157 10 10 IICE O=C1Cc2cc(N[C@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)ccc2N1 733797726 FNUFRSWKWLAQTB-NRFANRHFSA-N 425.448 4.341 10 10 IICE COc1cccc(N2CCC[C@@H](NC(=O)N(Cc3ccco3)Cc3ccccc3O)C2)c1 735385924 RBNLUACUVDVCQU-HXUWFJFHSA-N 435.524 4.375 10 10 IICE Cc1sc(NS(=O)(=O)c2cn(CC(C)C)cn2)nc1-c1c(F)cc(F)cc1F 748639742 LZYWKQYWWVNUER-UHFFFAOYSA-N 430.477 4.189 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCO[C@H](c2ccsc2)C1 758740564 NAAFYVQBIWNYHW-IBGZPJMESA-N 437.512 4.101 10 10 IICE Cc1ccc(-n2cccn2)cc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 789411136 SPLZEPXDDOTSSP-UHFFFAOYSA-N 444.583 4.034 10 10 IICE CC(C)n1ncc2c1C[C@H](NCc1cc(Br)cc(Br)c1O)CC2 792183451 NRJGNQQLWRSVFI-CQSZACIVSA-N 443.183 4.342 10 10 IICE CC(C)OCCOCc1cccc(NC(=O)NCc2cc(Br)ccc2O)c1 806239393 PANWJVFVBMVIGJ-UHFFFAOYSA-N 437.334 4.418 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC1CCN(C(=O)c2ccccc2)CC1 807168287 ULPFLXUIAZFLLG-UHFFFAOYSA-N 434.584 4.123 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4c(Br)cncc4s3)CC2)cc1 1125749990 AXPTYUCEYCBMKN-UHFFFAOYSA-N 446.370 4.466 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)CCOc4ccccc43)cc2Cl)C1 1128488807 UXJRJNLQWAIYLO-QGZVFWFLSA-N 441.959 4.008 10 10 IICE Cc1onc(-c2ccccc2Cl)c1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549871 XQXUCKSVQCZLJR-UHFFFAOYSA-N 447.869 4.348 10 10 IICE CCc1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc(Cl)n1 1136903460 DPZGNBBLHHDMKE-LJQANCHMSA-N 446.979 4.359 10 10 IICE Cc1cc(C(=O)NCc2ncccc2N(C)C)c(C)n1-c1cccc(Br)c1 1141647285 RQEVSHBMBMFDMI-UHFFFAOYSA-N 427.346 4.248 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@@H]1c1ccccn1 1142285731 JENIAZUMOAMMRR-XWALVKJWSA-N 441.553 4.176 10 10 IICE Cc1cc(CNC(=O)c2ccc(NS(C)(=O)=O)cc2Cl)c(C)n1-c1ccccc1 1170859721 XRRXUSHRABCDBB-UHFFFAOYSA-N 431.945 4.049 10 10 IICE Cc1cc(CNC(=O)N[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1234335212 AXCRELDJYGYHRW-FCHUYYIVSA-N 445.485 4.428 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 1292433713 WVCJOFQUIDZFME-QHCPKHFHSA-N 435.955 4.207 10 10 IICE CC[C@](O)(C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1294858227 BLVTZURWPXUHKS-DENIHFKCSA-N 437.367 4.077 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccncc1 1296816585 WQUVKSPPATVFDY-HSZRJFAPSA-N 425.916 4.351 10 10 IICE COC1CCN(c2ccc(CN3CCOc4ccc(Br)cc4C3)cc2)CC1 1307716552 VOOVIODTBPLFEH-UHFFFAOYSA-N 431.374 4.459 10 10 IICE Cc1ccc(C(=O)N[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)cc1 1350629035 QSOSTWXJERJUAS-QHCPKHFHSA-N 440.499 4.164 10 10 IICE CC(C)(C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc([N+](=O)[O-])cc1F 1354578810 ZZJPHMKEYLBNNP-UHFFFAOYSA-N 432.407 4.426 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N(C)Cc1cnn(C)c1C 1361097848 JHAKNVBUSLJGHQ-UHFFFAOYSA-N 435.620 4.112 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@@]12CCCN(C(=O)OC(C)(C)C)C2 1436848298 MJAFNZLOWHBZMC-CTIGNXTNSA-N 429.605 4.145 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2OCC[C@@H]3O)c(C)n1-c1ccc(Br)cn1 1447445611 AIFPGLJERFFATC-SFHVURJKSA-N 442.313 4.320 10 10 IICE CC(C)[C@@H](c1ccccc1)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1459576484 WOYURKCCXWJTJK-UNVFRBQDSA-N 441.591 4.385 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCCN(C(=O)Cc4ccccc4)C3)c2C)c1 1467402734 UIZBELDRMPAISP-HSZRJFAPSA-N 429.564 4.366 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCOc3ccc(C(F)(F)F)cc3)C2)cc1 1470773538 QGWLQEZGUMYFAY-QGZVFWFLSA-N 437.462 4.013 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCC34CCCCC4)cc2F)C[C@@H](C)O1 1473639903 BNHUJXQEEARZFM-SELNLUPBSA-N 431.596 4.148 10 10 IICE CCN(C)c1nnc(-c2ccc(Br)s2)n1Cc1ccc(N(C)C)c(F)c1 1501456428 GKPWOPWNQWHZET-UHFFFAOYSA-N 438.370 4.479 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)S1 1512458154 NXFQHKREMSUDNT-QINHECLXSA-N 433.597 4.103 10 10 IICE CCC1(CC)CCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1513600861 XPFXUGUJGHOVRU-IBGZPJMESA-N 429.584 4.442 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC(C)(C)O[C@](C)(C(F)(F)F)C3)ccc21 1527199764 VXVNNMXCDCSNMA-NRFANRHFSA-N 426.479 4.477 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(S(=O)(=O)c3ccc(F)cc3)CCCCC2)cc1 1527393969 LGVXDKHRVSLGHR-UHFFFAOYSA-N 446.588 4.465 10 10 IICE C[C@H](NC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O)c1ccc(N(C)C)cc1 1529467497 MMBJHLUPZQINJL-KRWDZBQOSA-N 427.504 4.040 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](SCc3ccccc3)C(C)C)CC2)c(OC)c1 1530968695 WZIQQLCUGOEPNV-HSZRJFAPSA-N 428.598 4.310 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C1CCC(F)CC1 1533764859 VKHILAYGQFFYIZ-PAHRPUINSA-N 438.565 4.450 10 10 IICE Cc1ccc2c(Cl)c(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)sc2c1 1535155598 AMMFIPSSDHOXML-UHFFFAOYSA-N 441.984 4.495 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541792180 OMFDRWVAIWTQTO-AEFFLSMTSA-N 427.524 4.216 10 10 IICE CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)C(=O)c1ccc(N=NC(N)=O)cc1 1543170149 ZPNMYXKTSVICNI-UHFFFAOYSA-N 441.797 4.232 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)cc1F 1556327981 QWKGEWFYALLYCA-IBGZPJMESA-N 439.462 4.304 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCC1 1564667896 KNUHRPIVAOUYEO-AVRDEDQJSA-N 446.636 4.375 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1 1564945930 IFSZVLLMSOIYKB-MOPGFXCFSA-N 429.008 4.471 10 10 IICE CC[C@@H](c1ccccc1)N1CCN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 1564962683 NDUVIIJZSKPACR-OFVILXPXSA-N 436.600 4.000 10 10 IICE Cc1ccc(C(=O)NC[C@@H](O)COc2c(C)cccc2C)cc1-n1c(C)cc(C=O)c1C 1566334987 ROAZCAYLSMOKPP-HSZRJFAPSA-N 434.536 4.002 10 10 IICE COCCC1(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCC1 1586619218 FNPLMCSGYDNLQE-FQEVSTJZSA-N 433.593 4.032 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 1586800571 SSIJCWSXLOAZTB-UHFFFAOYSA-N 445.947 4.047 10 10 IICE Cc1ccc(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1587475777 KIGZNFPTWGOCPS-RUZDIDTESA-N 445.563 4.018 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1)OC 1613613040 FSOORUCGQSBPSE-DENIHFKCSA-N 437.588 4.393 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C 1614954054 TXHRWSZDSKUDBE-UHFFFAOYSA-N 436.604 4.361 10 10 IICE COCCN(CC(C)C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)cc1C 1619897390 RTLQBRUAMBQPRI-UHFFFAOYSA-N 436.604 4.180 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCc2cnc(NC(=O)OC(C)(C)C)s2)cc1 1628468749 JTQLLFFQJGZILC-UHFFFAOYSA-N 448.589 4.026 10 10 IICE Cc1cc(C)c(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)s1 1628494003 BGPRAEOJBSENAJ-LJQANCHMSA-N 431.602 4.356 10 10 IICE COCCN(C[C@H](O)C(F)(F)F)C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1631628116 HNMUMKJRMVDPLM-IBGZPJMESA-N 438.450 4.180 10 10 IICE Cc1noc(C)c1[C@@H](C)CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1632313326 DKSMNTUDBJIONA-NSHDSACASA-N 431.334 4.390 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2nc(-c3ccccc3F)cs2)cc1 1634877911 MMHJVFBMGWJBJI-UHFFFAOYSA-N 428.533 4.236 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](O)c1ccccc1C(F)(F)F 1635676939 RRTWHCBQJAUIAO-INIZCTEOSA-N 432.236 4.256 10 10 IICE C/C=C\[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1638244094 RBOHNQHQCCPMKH-GQTLSGCOSA-N 429.605 4.167 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(I)cc1F 1638693400 DBBOPQLYNUJBAV-UHFFFAOYSA-N 438.284 4.351 10 10 IICE COc1ccc2c(c1)CN(CC(=O)NCc1ccc(N(C)C)cc1)[C@H](C1CCCCC1)C2 1642020759 OIUQYAHODQCQMI-SANMLTNESA-N 435.612 4.385 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1673745259 RRYDOWJHPBRGOP-NQIIRXRSSA-N 446.636 4.327 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1687794009 TXLXESSATDKRIC-SAABIXHNSA-N 429.517 4.000 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1692445943 WDISPWZBEVFCSY-JOCHJYFZSA-N 443.661 4.254 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN1CCCCC1 1694106861 ASSIONSLNCYUFM-OAQYLSRUSA-N 440.636 4.003 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(CC)C[C@H]2CCCO2)cc1 1710026199 ALFWUMQFWVAVKM-DHIUTWEWSA-N 441.620 4.420 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@H]1CCSC1 1729405471 XWGWKVVKJDVECL-FQEVSTJZSA-N 443.661 4.093 10 10 IICE CC(C)Cc1nnc(N2CCSC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1741487388 DBJLGJAUIWMDNX-SFHVURJKSA-N 431.675 4.020 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1743287372 UCKDGIOUXDAASJ-HUUCEWRRSA-N 425.649 4.100 10 10 IICE Cc1ccc(-c2nnc(N(C)CCC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)o1 1751474468 CYGQZJRVIKTUIL-UHFFFAOYSA-N 441.551 4.353 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3nccs3)n2Cc2ccc(N(C)C)cc2C)n1 1751605075 JOFJRZNNMIGHKD-UHFFFAOYSA-N 433.585 4.164 10 10 IICE COCCO[C@@H](C)c1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1771171896 HSAQIFPEFJWZLD-ROUUACIJSA-N 447.599 4.128 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCC(C)=C(C)C2)n1CCCSc1nccs1 1771292499 MPPIDIZCBYSATJ-ROUUACIJSA-N 449.646 4.188 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1772868043 YNBYUBVSKVRCCV-QFIPXVFZSA-N 437.588 4.394 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ncc(C)s2)sc(C)c1-c1ccc(C)cc1 1860767806 IZJBRGRNOBWDOX-UHFFFAOYSA-N 429.523 4.161 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(C)C)c(CN)c2I)c(O)c1 2078984783 ZKTWNWLCXCAKRN-QGZVFWFLSA-N 425.314 4.083 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](CNCc1ccc(Br)cc1O)C2 2103450450 GIFPDRZLYMJGGD-FFGGFLGDSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNCc1c(O)cccc1Br)C2 2126087275 PHRZEOMOQWCKJW-VBQJREDUSA-N 425.367 4.280 10 10 IICE CCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(Cl)c1OCC 2297337267 DLIYCZFUYVRXRE-UHFFFAOYSA-N 449.290 4.457 10 10 IICE CN1C(=O)C(=Cc2cc(Br)ccc2OCc2ccc(Cl)cc2)NC1=S 2297559893 SJASCKZHVAIXFJ-UHFFFAOYSA-N 437.746 4.369 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2ccc(OCc3cccc(C)c3)cc2)SC1=S 2314769602 SLRBGRJSBOZXNQ-UHFFFAOYSA-N 427.547 4.338 10 10 IICE CCCC[C@@H](NC(=O)C=Cc1ccc(C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 2328562693 CZMJHMDKPJWUNK-RUZDIDTESA-N 449.595 4.041 10 10 IICE Cc1ccc(CN(C)C(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2380793639 SXYUKYGLNVXNEL-UHFFFAOYSA-N 441.366 4.069 10 10 IICE COCCN1C(=O)/C(=C\c2cc3cc(C)ccc3nc2N2CCCCC2)SC1=S 12948425 KFBJPUHVRFCJEW-XMHGGMMESA-N 427.595 4.381 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccccc2O)SC1=S)Nc1nccs1 15045131 QNZFBWDUDHIDPS-QINSGFPZSA-N 433.580 4.249 10 10 IICE Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2\C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)o1 20239015 JHLXBNLPGLLOHB-IREIBJAOSA-N 449.370 4.345 10 10 IICE CCc1ccc(/C=C2/C(=O)N(CCc3ccc(OC)c(OC)c3)C(C)=C2C(=O)OC)cc1 33448400 BALZTTXHZPEAJW-RCCKNPSSSA-N 435.520 4.182 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C1=O 102946249 WSGKQVVMELCKIC-OIKHISIKSA-N 439.518 4.381 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(OC(F)F)cc2)C1 435661468 FZMOLTLMEFVBOB-UHFFFAOYSA-N 427.495 4.326 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@H]1c1ccc2c(c1)OCO2 728303938 NCABZRRHFDMNEI-FQEVSTJZSA-N 425.554 4.015 10 10 IICE O=C1/C(=C\c2cnn3ccccc23)SC(=S)N1C1CCN(Cc2ccccc2)CC1 729688384 WTCUNRUYKDNLHP-KGENOOAVSA-N 434.590 4.200 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(F)c(N3CCCS3(=O)=O)c2)c1C 731648553 NUZIZRYUMRJELI-UHFFFAOYSA-N 441.528 4.334 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2cccc(Br)c2O)cc1 765751965 VJEONKZXIMQNOP-UHFFFAOYSA-N 435.318 4.109 10 10 IICE Cc1cc(Br)c(O)c(CN(C)[C@H](CO)c2cccc(Br)c2)c1 781906755 BQCDFZFPRYCJJP-MRXNPFEDSA-N 429.152 4.391 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(C)O[C@@]2(CCOC2)C1 801963197 FOZZEQQEDSPVBL-VWLOTQADSA-N 435.572 4.147 10 10 IICE CN1[C@H]2CC[C@H]1CC([C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccc(Cl)cc1)C2 802409033 PEFVXCHSGKLPMO-LDFSFROLSA-N 426.944 4.495 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1C[C@@H]1c1ccc(Br)cc1 804739797 UDWFHDMOHNBXIE-CABCVRRESA-N 425.120 4.337 10 10 IICE Cc1cc(C(=O)N2CC3(CCOCC3)[C@H]2c2cnn(CC(C)C)c2)c(C)n1-c1ccccn1 849530241 SJWHOPOFICWWCT-XMMPIXPASA-N 447.583 4.336 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)cc1 1124586325 YTGSKCDTMDKMOX-MOPGFXCFSA-N 441.538 4.082 10 10 IICE O=C(Nc1cccc(N2CCCC2)c1)c1ccccc1-n1ncc(Cl)c(Cl)c1=O 1125188212 NQFBZUZHCGHVGI-UHFFFAOYSA-N 429.307 4.392 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(Cl)c(N)c3Cl)cc2F)C[C@@H](C)O1 1141901986 VNWHJWFYJZVAGA-VXGBXAGGSA-N 426.319 4.258 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3C[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]4C3)c2C)cc1 1156375025 XEKYVYJDGVAADD-KDURUIRLSA-N 439.556 4.042 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1162114540 NMXMFVZVURUTQR-VGSWGCGISA-N 441.572 4.236 10 10 IICE CCCCN(C)C(=O)CSCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 1165961449 YHTZDBSFRBKICY-UHFFFAOYSA-N 430.570 4.040 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(C(C)(C)C)n4ncnc4n3)cc2Cl)C1 1270433927 YICPMWOJWNOVIP-HNNXBMFYSA-N 440.979 4.242 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(F)c1 1287797237 WQUAPXXYPBCDLL-LICLKQGHSA-N 434.489 4.203 10 10 IICE Cc1cc(CC(=O)N2CSC[C@@H]2C(=O)N[C@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1293236756 RLYJVFBCRNCUFQ-IIBYNOLFSA-N 448.032 4.352 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1sc([C@@H]2CCOC2)nc1C 1294685683 RQSOZBSKEWNOCX-GFCCVEGCSA-N 425.348 4.086 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-c2cccc(Cl)c2)no1 1295590851 QHZABOVRHUALHU-UHFFFAOYSA-N 435.263 4.169 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCC2(O)CCN(Cc3ccccc3)CC2)c1 1299426494 LMIDVNRYXBEKFH-UHFFFAOYSA-N 431.580 4.159 10 10 IICE CC[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1306426821 CVEVOSAUMJDWLL-VXKWHMMOSA-N 427.593 4.029 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(Cl)cc3C(F)(F)F)CC2)cc1 1307323623 DAJICLJCATUCBY-UHFFFAOYSA-N 428.838 4.095 10 10 IICE CN(C)c1ccc2c(c1)OCCN2Cc1ccnc(-c2ccc(Br)cc2)n1 1307649025 UHVZHCFSDAJIMI-UHFFFAOYSA-N 425.330 4.371 10 10 IICE C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1312832589 AFAFLPPGEXHXDX-HNNXBMFYSA-N 437.918 4.227 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC[C@@H](CNC(=O)C(C)(C)C)C3)c2C)c1 1313132718 OUXIUUIYFHMAMC-NRFANRHFSA-N 438.616 4.486 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N(C)Cc2ncc(Cl)n2C)cc1 1313680739 OHHHUEHGZNFIJV-UHFFFAOYSA-N 442.011 4.463 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CCc3ccc(F)c4ccccc34)CC2)cc1 1352409982 OMKRGAXPYMOMIR-UHFFFAOYSA-N 449.570 4.249 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CC[C@@H](CN3CCCCC3)C2)nnc1C(C)(C)C 1361098647 YVLLQFIKIURION-NRFANRHFSA-N 438.664 4.311 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3ccc(C(C)C)c(C)c3)cc2F)CC1 1435073624 GEWBKIJKDWBGPL-HXUWFJFHSA-N 441.591 4.483 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(c4cccc(C)c4)CCCCC3)CC2)cc1 1442477058 VJFRPKIPHSYMBL-UHFFFAOYSA-N 435.612 4.144 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1c(O)cnc2c(F)cccc12 1448686859 PGBOXVSKSGQPKX-UHFFFAOYSA-N 439.487 4.082 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)cc1 1464100775 XYLRRCFNQNYJCG-AREMUKBSSA-N 430.596 4.203 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3c4ccccc4CC[C@@H]3C(C)C)CC2)c(OC)c1 1469707163 GVXRMPNWMAQMTI-PXDATVDWSA-N 437.584 4.495 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 1470555090 AYCRVZXZZGMKOM-RXVVDRJESA-N 425.548 4.436 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3cn(C)nn3)C2)c(C)n1-c1ccccc1Br 1472327108 AUKMEHHFAQGYCR-INIZCTEOSA-N 442.361 4.005 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)Cc1ccc(F)cc1 1473127497 QEMJIDZHIVAJBW-KDURUIRLSA-N 445.554 4.107 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCN1C(=O)OC(C)(C)C 1509138924 PMMPRLUEXIAHJN-IBGZPJMESA-N 443.592 4.218 10 10 IICE CCO[C@@]1(c2nnc(N3CCCCCC3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1516207800 NQKLIOLSTBHYKD-VWLOTQADSA-N 441.620 4.205 10 10 IICE Cc1ccc([C@@H](CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)N2CCOCC2)cc1 1517288481 JVLJQUBJPGCJQI-AREMUKBSSA-N 431.580 4.135 10 10 IICE COc1cc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc(OC)c1Br 1523554142 QYTSTRFUIWCBLK-UHFFFAOYSA-N 433.346 4.339 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)cc2c1OCCO2 1533142623 IFNISPADZAVQFR-UHFFFAOYSA-N 433.346 4.337 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ncoc1-c1ccccc1Cl 1535345864 QFHIFHTVOFBKDZ-UHFFFAOYSA-N 433.842 4.040 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 1540516865 HKLLIMBCWFWQPP-UHFFFAOYSA-N 427.346 4.281 10 10 IICE CCOC(=O)c1cnn(-c2ccc(NC(=O)c3ccc(C)c(O)c3O)cc2)c1C(F)(F)F 1540590903 FSEDEXOAYPILRJ-UHFFFAOYSA-N 449.385 4.040 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1542490030 AVLQDIKLGKQFNU-WOJBJXKFSA-N 430.980 4.199 10 10 IICE CCOC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1556597521 OVRRVPDPBPYKQH-AEFFLSMTSA-N 448.361 4.103 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccoc3C3(O)CCOCC3)cc2Cl)C1 1568142159 ODTGDNXLAXMAEW-MRXNPFEDSA-N 432.948 4.097 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Br)cc(OC(C)C)c2)cc1 1586648771 BIBPWVVFPYWAIE-UHFFFAOYSA-N 435.362 4.453 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(CCc4ccccc4)ccc3O)CC2)cc1F 1631378083 XMVMKPLYHFRXRL-UHFFFAOYSA-N 434.511 4.288 10 10 IICE CCS(=O)(=O)c1ccc([C@H](C)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1636269804 NPBCSDZHEJLJNR-KRWDZBQOSA-N 438.549 4.191 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Nc3nccs3)cc2F)N(C)C)cc1 1637004616 IMKFJRNVIYYWGG-FQEVSTJZSA-N 427.549 4.125 10 10 IICE O=C(C[C@@H]1C(=O)Nc2ccc(Br)cc21)NCc1ccc(N2CCCCC2)cc1 1638693591 HEVOLNXOJWMUMM-IBGZPJMESA-N 442.357 4.182 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2COc2cccc(C=O)c2)N(C)C)cc1 1640231981 GBXOUKHFPBJJSH-SANMLTNESA-N 445.563 4.177 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(C)CCOCCN(C)C(=O)OC(C)(C)C)c1C 1640659565 PJAVGDHSYUKZML-UHFFFAOYSA-N 443.588 4.358 10 10 IICE COc1ccc(N2CCN(Cc3cc(Br)ccc3Cl)CC2)c(OC)c1 1644225339 HBQIEMZOFKWSDT-UHFFFAOYSA-N 425.754 4.442 10 10 IICE COc1ccc(N2CCCN(CC(=O)Nc3ccc(OCc4ccccc4)cc3)CC2)cc1 1644370830 FYGANJMSZNMKEX-UHFFFAOYSA-N 445.563 4.425 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccccc3Cc3ccccc3)CC2)c(OC)c1 1648084619 XGLCYACVQPPNBX-UHFFFAOYSA-N 445.563 4.055 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4cccs4)C3=O)c2C)cc1C 1651720922 WPPMYSKLFZPQDM-DEOSSOPVSA-N 435.549 4.422 10 10 IICE Brc1ccc(-n2cc(CNCc3ccc(N4CCSCC4)cc3)cn2)cc1 1656075050 PECIQHYPTFOYCA-UHFFFAOYSA-N 443.414 4.478 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)N(C)C)cc1 1676653177 HEGHMWRLLLCVQJ-XMMPIXPASA-N 444.570 4.298 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NC3CCC4(CCCCC4)CC3)cc2)CC1 1686115631 HLCFQOSVRBFWMK-UHFFFAOYSA-N 426.605 4.081 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)[C@H](C)S(C)(=O)=O 1695341127 GGZNEYZQGNVQRK-HKUYNNGSSA-N 443.617 4.020 10 10 IICE C=C(C)CN(CC)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1705717370 IPKPNHXMOMKJIE-OAQYLSRUSA-N 441.645 4.176 10 10 IICE CN(OC1CCCC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1729564448 LZIGOONBXMEPHB-UHFFFAOYSA-N 427.593 4.062 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC(NC(C)C)CC2)cc1 1746089812 UWUYMRUYNCSHKS-UHFFFAOYSA-N 449.647 4.145 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CC=C(C(F)(F)F)CC2)cc1 1764938432 MHRRLGLOYBIMHD-GOSISDBHSA-N 449.521 4.375 10 10 IICE CCOC[C@@H]1CCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1766489218 GMGRGVMGTSSXHE-SJORKVTESA-N 437.635 4.021 10 10 IICE CC(C)OC(=O)c1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)c1 1860087061 XMNDBNOJMWCTRF-GIJQJNRQSA-N 427.503 4.386 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010404791 VJMOMDRUCRPOLA-OALUTQOASA-N 431.537 4.036 10 10 IICE COc1ccc([C@H](n2nc(C(F)(F)F)c(CN)c2Br)C(C)(C)C)c(O)c1 2079863490 TZQUITMIFXWITN-AWEZNQCLSA-N 436.272 4.473 10 10 IICE C[C@@H]1C[C@@H](CNCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2115816131 BCRJUEBPSIERRG-OLZOCXBDSA-N 431.346 4.419 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@@]2(NCc2cc(Br)cc(F)c2O)C1 2182446912 DBUQZYXXHHWKSD-RBUKOAKNSA-N 447.320 4.265 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c(Br)c1 2188889450 YGDNJHYRSSEKAP-GHTZIAJQSA-N 427.342 4.258 10 10 IICE COc1ccc(Br)c(CNc2ncccc2CNC(=O)OC(C)(C)C)c1O 2236054684 LQQLAZBXEOYHQF-UHFFFAOYSA-N 438.322 4.195 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(OCc3ccccc3)cc2)SC1=S)c1cccnc1 2314736057 RADWNAOAPHUXTH-UHFFFAOYSA-N 447.541 4.207 10 10 IICE Cc1ccc(CNCC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)c(O)c1Br 2352948729 TUOCOFLYOLPLTO-HOCLYGCPSA-N 427.383 4.446 10 10 IICE CCOc1ccc(S(=O)(=O)c2nnn(-c3ccc(N)cc3)c2-c2ccc(C)cc2)cc1 11730558 FQRXMFPQFMZBOU-UHFFFAOYSA-N 434.521 4.056 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc(Br)ccc1O)N2 14460952 GVDHMLUQYWVWLX-QEEYODRMSA-N 449.370 4.232 10 10 IICE N=C1/C(=C\c2cc(Br)ccc2O)C(=O)N=C2SC=C(c3ccccc3)N12 101469224 YGAUHFXFADPETH-OVDNTTTISA-N 426.295 4.459 10 10 IICE CCCCCCN1C(=O)/C(=C2/SC(=S)N(CCCC(=O)O)C2=O)c2ccccc21 206851506 DRKMAZRFCGKLRJ-ISLYRVAYSA-N 432.567 4.050 10 10 IICE COC(=O)c1c(F)cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1F 512576438 FZUWKQRWJOFEGT-UHFFFAOYSA-N 441.478 4.111 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)cc1Br 705846072 OZWMAGKEICDCIO-NPWUYRIISA-N 427.386 4.288 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2cnccn2)c(C)n1-c1cccc(Br)c1 740966140 QHAGECNOOGTTCS-SREVYHEPSA-N 440.297 4.086 10 10 IICE Cc1cc(C(=O)COC(=O)c2nccc3ccccc23)c(C)n1-c1ccc2c(c1)OCO2 743197406 MDBWREYKVBKSEI-UHFFFAOYSA-N 428.444 4.411 10 10 IICE CCN1CCN(c2ccc(CNC(=O)NCc3ccc(-c4cccnc4)cc3)cc2F)CC1 745808330 KEIOOBRLLXYXEJ-UHFFFAOYSA-N 447.558 4.029 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccccc1CSC1=NCCS1 804739210 AWCOBAHYNBJFOK-UHFFFAOYSA-N 437.384 4.421 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1Cc2cc(Cl)ccc2O1 807932206 UEGOFNLZLBLWNV-JOCHJYFZSA-N 430.932 4.032 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@H](C)c3ncc(Br)cn3)cc2)CC1 814298125 PLPVTGJTJJTQAA-OAHLLOKOSA-N 432.366 4.036 10 10 IICE Cc1cc(C(=O)CSc2n[nH]c(-c3ccccc3O)n2)c(C)n1-c1ccc2c(c1)OCO2 914866881 LXKWRPKEUHXXIA-UHFFFAOYSA-N 448.504 4.289 10 10 IICE C[C@@H]1CN(c2ccc(CNS(=O)(=O)/C=C/c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917918457 PFHANCNTECTUKM-UETGSQEOSA-N 438.952 4.183 10 10 IICE CC[C@@H]1N[C@@](N=Nc2ccc([N+](=O)[O-])cc2)(P(=O)(OC(C)C)OC(C)C)OC1=O 1088716040 OBJIVGDTIWTEFE-RDJZCZTQSA-N 428.382 4.258 10 10 IICE CC[C@@](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)(C(=O)OC)c1ccccc1 1129793457 VNBSRGPYOZHVMX-MHZLTWQESA-N 448.563 4.166 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2CCCN(CCc3ccccc3)C2)cc1 1136480603 RQAQPVNHTVRRMA-VPUSJEBWSA-N 449.639 4.215 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC1(C)C 1137349266 MJCWAQRNADXHPB-INIZCTEOSA-N 441.366 4.149 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1-n1c(C)cc(C=O)c1C 1138353268 NVYRLGQXHLWBIW-SFHVURJKSA-N 439.556 4.296 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@H]2CC[C@@H](C1)S2 1147742151 YXPDYMFPOXOOKY-QDFKPCHESA-N 438.665 4.226 10 10 IICE C[C@H]1CCCCN1CCOc1ccccc1C(=O)NCc1cccc(Br)c1O 1156792746 OZKGEDXQZHTCOE-INIZCTEOSA-N 447.373 4.338 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@@H](NC(N)=O)C(C)(C)C)n2)c(C)n1-c1ccc(F)cc1 1160529497 BPJHZQRHGNPHDT-GOSISDBHSA-N 443.548 4.378 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(F)(F)c1cc(Cl)ccc1Cl 1167761924 CRYUTVKIPDESKI-UHFFFAOYSA-N 429.294 4.363 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1233973041 HWKSMHGCCYRJTE-JOCHJYFZSA-N 440.588 4.287 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1C[C@H]1c1ccccc1 1277235073 PMPOCPPBGMAVIQ-JCOOVGHISA-N 440.565 4.337 10 10 IICE C[C@@H]1CCCCN1CCCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1291097933 FCKZAMOQZUJVCH-OAQYLSRUSA-N 448.615 4.261 10 10 IICE O=C(NCCCOC1CCN(Cc2ccccc2)CC1)c1cc2cc(O)c(O)cc2s1 1294544275 VEGFEKCLVFWQFP-UHFFFAOYSA-N 440.565 4.114 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)cc(F)c1N 1294686648 ZLTNUHAIWLPDCE-UHFFFAOYSA-N 446.114 4.301 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(OCCN3CCNC3=O)cc2C)c1 1296870490 GBQREDBZQWXPRN-UHFFFAOYSA-N 446.551 4.367 10 10 IICE C[C@H](NC(=O)c1ccccc1Sc1ccc(S(C)(=O)=O)cc1)c1ccccc1O 1302538511 SUXOQWGQAVYGGQ-HNNXBMFYSA-N 427.547 4.438 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 1347811907 QQOIUINEUWTIGH-UHFFFAOYSA-N 425.554 4.375 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C(C)(C)n1cc(NC(=O)OC(C)(C)C)cn1 1352614408 CBTLZKRBEITSFU-UHFFFAOYSA-N 441.576 4.224 10 10 IICE CCOc1cccc2c1OCC(C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)=C2 1435330795 ARNJTDLQWBHYAD-SFHVURJKSA-N 444.478 4.248 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cn(Cc2ccc(Cl)cc2Cl)nn1 1441191781 ZQFPLJSJXIFQHX-UHFFFAOYSA-N 430.339 4.163 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@H](C(=O)NCCCSc2nccs2)C1 1443486174 BJUBBEIMEORKLR-HNNXBMFYSA-N 425.620 4.169 10 10 IICE CC[C@@H](C)COc1cc([N+](=O)[O-])c(CN2CCOc3cc(N(C)C)ccc32)cc1OC 1459875045 KOFAMVFOCXFDNG-MRXNPFEDSA-N 429.517 4.493 10 10 IICE COc1ccccc1C1(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCCCC1 1460741247 NGCVXASWMYSJSO-UHFFFAOYSA-N 444.522 4.328 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(OCC(F)(F)F)o2)cc1 1464594100 GERINETUDZTILZ-QGZVFWFLSA-N 426.435 4.108 10 10 IICE Cc1cc(CCNC(=O)NCCOc2ncccc2C(F)(F)F)c(C)n1-c1ccccc1 1469452602 DOXRPJNZWIEREP-UHFFFAOYSA-N 446.473 4.429 10 10 IICE CCOCc1nnc(N(C)[C@@H]2C[C@H](OCC)C23CCC3)n1Cc1ccc(N(C)C)cc1C 1503005789 BQGBKBPHLQAFRS-YADHBBJMSA-N 441.620 4.021 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1csc(C)c1 1503014285 MQAIBXZMUGFULL-UHFFFAOYSA-N 425.602 4.469 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2cccs2)cc1F 1503391338 AMOYKHJPYRKGHR-FQEVSTJZSA-N 429.565 4.471 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCC(OC(C)C)CC1 1510676424 XTVQKHJQGYJJBL-UHFFFAOYSA-N 434.588 4.157 10 10 IICE C[C@@H]1SCCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)[C@@H]1C 1512599051 WWZUUMDLGGZEIO-CVEARBPZSA-N 446.671 4.233 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]([C@@H]2CCCO2)C1 1545504667 AOHLZJGYWVUVPO-CBQOVEMMSA-N 446.588 4.326 10 10 IICE COc1ccc(N2CCN(c3nnc(CC4CCCC4)n3CCCSC)CC2)cc1F 1554960902 RQKITVKQLBWBIO-UHFFFAOYSA-N 447.624 4.238 10 10 IICE CSc1ccc([C@H](CNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)N(C)C)cc1 1564814836 PYXYOSZQIIIRRF-QHCPKHFHSA-N 426.630 4.453 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2c(NC(=O)c3ccco3)sc3c2CCC3)c1 1566374289 BWAOAYCZWJKDQQ-GFCCVEGCSA-N 426.494 4.287 10 10 IICE CCN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCC(C)CC3)cc2)[C@@H]1c1cccc(C)c1 1585545421 RLJFOMGCILSRLG-RSXGOPAZSA-N 433.596 4.457 10 10 IICE CC[C@@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1586061352 PLKYEVSEIPHHJV-RTWAWAEBSA-N 432.406 4.428 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CC(=O)N(c4ccc(F)c(F)c4)C3)c2C)c1 1587880884 LWSFHUWAEIAYRE-IBGZPJMESA-N 437.490 4.350 10 10 IICE C[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ncccc1F 1626503007 HYOKROUVKYCLJF-QJMZJAKPSA-N 435.571 4.141 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(F)(F)c1cccc(Br)c1 1628857952 SXFZHFWOQXOKOI-UHFFFAOYSA-N 439.300 4.036 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCOc3ccc(C(F)(F)F)cn3)c2C)cc1 1630470086 HBNVWMZNGQMKPH-UHFFFAOYSA-N 433.430 4.325 10 10 IICE Cc1cc(C(=O)NC2(C(N)=O)CCC(C)(C)CC2)c(C)n1-c1cccc(Br)c1 1636517314 SBGBUEOEQYZRAP-UHFFFAOYSA-N 446.389 4.411 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H](C)c1ccccc1[N+](=O)[O-] 1638707680 PCSNQLHQXFMJCS-CYBMUJFWSA-N 436.306 4.398 10 10 IICE C[C@H](S[C@H](C)C(=O)OC(C)(C)C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652801235 SDQURUJZVUXNOW-UONOGXRCSA-N 439.533 4.252 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H](C)Oc3ccc(C(C)C)cc3)C2)cc1 1680998293 VMNSMRMQXBPVTA-VQTJNVASSA-N 425.573 4.412 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCOc2c(Br)cccc2C1 1683421129 GTCIWZMOMNANDE-MRXNPFEDSA-N 446.389 4.359 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCSC[C@H]3c3ccc(Cl)cc3)C2)cc1 1683945822 WVBUMFDDTWZLBQ-NQIIRXRSSA-N 431.989 4.427 10 10 IICE Cc1nnc(N(C)Cc2ccc(Br)s2)n1Cc1ccc2c(c1)CCCN2C 1707858125 GBMIQXVYIGJGFZ-UHFFFAOYSA-N 446.418 4.478 10 10 IICE FC(F)(F)[C@H]1CN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CCO1 1712859176 UUVHVTUHWQWHCW-CQSZACIVSA-N 447.552 4.342 10 10 IICE CCc1nnc(N(CC)C[C@@H]2COc3ccccc3O2)n1CCCSc1nccs1 1727519215 OINZRIPEQBJNPZ-MRXNPFEDSA-N 445.614 4.146 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1728382420 NKKFXPVMNZFBOU-FPOVZHCZSA-N 441.620 4.070 10 10 IICE CC(C)[C@@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1741402694 HHDHDVZOPKRKIU-NRFANRHFSA-N 442.608 4.115 10 10 IICE C[C@@H]1C[C@H]1n1c([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nnc1N(C)Cc1ccccc1O 1742977508 SYLMBCLJRPHTIU-NZSAHSFTSA-N 441.576 4.316 10 10 IICE CC(C)c1nnc(N(C)C[C@H]2COc3ccccc3O2)n1CCCSc1nccs1 1750613394 OAQBTVMGPIBDCZ-INIZCTEOSA-N 445.614 4.317 10 10 IICE Cc1cc(-c2nnc(N(C)C3CCC3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1751415143 GTTFMTMJNJPPNU-UHFFFAOYSA-N 434.588 4.210 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1764208568 QACFIHBMRHVJER-FQEVSTJZSA-N 437.588 4.394 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)cc1Br 1911927885 IEAMOZGPYMJVRV-OALUTQOASA-N 427.342 4.115 10 10 IICE NCc1ccc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(Br)c1 2153349161 RPNDOAXXHVLBLA-DHIUTWEWSA-N 426.402 4.400 10 10 IICE CCOC(=O)c1sc(N2N=C(C)C(=Cc3ccc(OCC)cc3OCC)C2=O)nc1C 2297313161 GQRQSLYKDXHWPP-UHFFFAOYSA-N 443.525 4.232 10 10 IICE Cc1c(C=C2SC(=S)N(CC(=O)O)C2=O)c2ccccc2n1Cc1ccccc1F 2297578071 CVFZRLVJHFLQET-UHFFFAOYSA-N 440.521 4.423 10 10 IICE CCCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(C(=O)O)cc2)SC1=S 2314767742 HUKZTCOSDCZCQB-GOSISDBHSA-N 441.530 4.281 10 10 IICE O=C(CN1C(=O)C(=Cc2ccccc2O)SC1=S)Nc1ccccc1C(F)(F)F 2314827319 BMJQUYFKVKWIBM-UHFFFAOYSA-N 438.452 4.251 10 10 IICE CCN(CC)c1ccc(C=C2SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)cc1 2318683848 JMCXFZSDAPCEIW-IBGZPJMESA-N 440.590 4.430 10 10 IICE O=[N+]([O-])c1ccc(N2CCN(C(=S)c3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC2)cc1 26771259 DUYJRRRQJPEFHO-UHFFFAOYSA-N 438.465 4.261 10 10 IICE O=C(Nc1cccc2c1C(=O)c1cccc(NC(=O)C(F)(F)F)c1C2=O)c1ccccc1 39899531 UERCKLQVJLUYOX-UHFFFAOYSA-N 438.361 4.215 10 10 IICE Cc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S 47152174 CHDPSOBNONBHAR-ATVHPVEESA-N 427.507 4.133 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 170245014 UOESVCORHLDWNO-FQEVSTJZSA-N 430.548 4.210 10 10 IICE COc1ccc(-c2cnc(CCC(=O)NC3CCN(c4ccc(OC)cc4)CC3)o2)cc1 726561826 UPEUADZQYOAQFI-UHFFFAOYSA-N 435.524 4.077 10 10 IICE COc1ccc(N2CCC(NC(=O)NCCc3coc(-c4ccc(F)cc4)n3)CC2)cc1 726712544 WZGOGOVEKJURFK-UHFFFAOYSA-N 438.503 4.000 10 10 IICE O=C(COc1ccc(Cl)c2cccnc12)N(Cc1ccccc1O)C[C@H]1CCCO1 731856942 VSDNRDIRHPLSBJ-QGZVFWFLSA-N 426.900 4.180 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C[C@H](C)c3cccc(C(F)(F)F)c3)CC2)cc1 737817963 CUWGGHVTOPABQU-SFHVURJKSA-N 449.517 4.146 10 10 IICE Fc1ccc([C@@H](NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c2cnccn2)cc1 753620393 ZULJNIWHGQLLIO-JOCHJYFZSA-N 446.448 4.350 10 10 IICE CN1C(=O)C[C@@H](NCc2cccc(Br)c2O)[C@@H]1c1ccc(Cl)c(F)c1 754832669 JRTQIGDEIXGHBU-WBVHZDCISA-N 427.701 4.009 10 10 IICE COc1ccc(N2CCC(N3C(=O)N[C@@H](C[C@@H]4CCCc5ccccc54)C3=O)CC2)cc1 761221178 ICOBOFHQXSNPKW-CYFREDJKSA-N 433.552 4.095 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1c(F)cccc1Br 768910706 GUAAIPZDLZAVEK-UHFFFAOYSA-N 446.364 4.050 10 10 IICE Cc1cc(Br)c(O)c(CN(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)c1 781908383 HUCFIIYCOWCXLZ-HNNXBMFYSA-N 430.751 4.077 10 10 IICE COc1cc(Cl)cc(CNc2ccc(NS(=O)(=O)Cc3ccccc3)cn2)c1O 793306169 XQNJUHWLIZBAIG-UHFFFAOYSA-N 433.917 4.003 10 10 IICE CC(=O)Nc1ccc(NC(=S)NNc2nnc(-c3ccccc3)n2-c2ccccc2)cc1 915121803 LWGGIXNQNXDZLX-UHFFFAOYSA-N 443.536 4.206 10 10 IICE Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(Cl)n1 919253385 YUHRUPGVBYISDO-CYBMUJFWSA-N 448.862 4.003 10 10 IICE CCN1C(=O)NC(=O)/C(=C/c2cn(Cc3ccc(Cl)c(Cl)c3)c3ccccc23)C1=O 1084521253 NLHGKCFXQALGEI-YBEGLDIGSA-N 442.302 4.478 10 10 IICE COC[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(F)cc1 1122007713 HGKFYJHPZGURJE-PXNSSMCTSA-N 437.462 4.083 10 10 IICE COc1cccc(-c2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)on2)c1 1125948833 ULQOLWMUSSNBFG-UHFFFAOYSA-N 443.450 4.350 10 10 IICE CCc1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1OC 1128975272 FLNADTPOQAQJAG-UHFFFAOYSA-N 430.416 4.194 10 10 IICE O=C(CCc1ccc(F)c2c1CCCC2)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549493 NGKWMDDKNYWVDA-UHFFFAOYSA-N 432.486 4.068 10 10 IICE Cn1ccc(Nc2ccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)n1 1137082091 OQTNLCMYTCZJPH-SFHVURJKSA-N 441.482 4.164 10 10 IICE Cc1cc(C(=O)NCCOc2ccc(Cl)cn2)c(C)n1-c1ccc(Br)cn1 1137500601 NJHXZAJNDJTRFN-UHFFFAOYSA-N 449.736 4.109 10 10 IICE COc1ccc(N2CCN(C(=O)CCCc3ccc(Br)cc3)CC2)cc1F 1150239026 AMYXYDRSPTYIDX-UHFFFAOYSA-N 435.337 4.268 10 10 IICE C[C@H](N[C@@H](C)c1cccc(F)c1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1192803161 PEUNRARMVMHOAF-KBPBESRZSA-N 434.442 4.418 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCOCc2ccccc2)NC(=O)OC(C)(C)C)cc1 1293792170 FPKWVXWIEWZONK-QFIPXVFZSA-N 441.572 4.042 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)CCC(F)(F)F)cc1F 1298056137 KQVSIHRLBCWUBL-QGZVFWFLSA-N 429.462 4.162 10 10 IICE CN(C[C@@H]1CCCOC1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1298560343 YCJBUUZSFNOHPP-DLBZAZTESA-N 437.635 4.021 10 10 IICE COC1(CCn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)CCC1 1299792132 UXNOEEZDZOWAKK-UHFFFAOYSA-N 441.620 4.008 10 10 IICE O=C(c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1)N1Cc2cccc(O)c2C1 1302786932 LWTRDNQHBNNHIN-UHFFFAOYSA-N 428.897 4.002 10 10 IICE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1cccc(O)c1O 1303194694 JMHADMZONTVYCS-UHFFFAOYSA-N 446.503 4.031 10 10 IICE CC[C@@H]1CCC[C@@H]1Cn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccccc1O 1306306604 KSKFYXXJJOJWEE-QZTJIDSGSA-N 434.544 4.094 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC2(C(F)(F)F)CC2)NC(=O)OC(C)(C)C)cc1 1322932701 QISLFTUFMJPZMI-INIZCTEOSA-N 429.483 4.167 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3cc(Cl)cc(Cl)c3)cc2F)C[C@H](C)O1 1350933555 PBSPOHLZKANJCG-KBPBESRZSA-N 441.330 4.441 10 10 IICE Cc1cc(-c2csc(NC(=O)Cn3cnnn3)n2)c(C)n1-c1ccc(Cl)c(Cl)c1 1351485929 HWCBKBQRQGQIKN-UHFFFAOYSA-N 448.339 4.150 10 10 IICE C[C@H](Oc1ccc(F)cc1)c1nnc(N2CCOCC2)n1CCCSc1nccs1 1360751285 YBHAPIRCMYTPQC-HNNXBMFYSA-N 449.577 4.033 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2ccnc(OC(F)F)c2)o1 1361180715 GKYRXGQAIDYEFE-UHFFFAOYSA-N 441.438 4.233 10 10 IICE COc1cccc(OC(F)(F)F)c1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 1447322172 RVZXKHCFICMMIS-UHFFFAOYSA-N 437.462 4.377 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nc(-c4ccc(F)cc4)oc3=O)c2C)cc1 1458882135 QMTTVPWVGRDLKB-UHFFFAOYSA-N 435.455 4.332 10 10 IICE O=C(NCCn1ccc2cc(Cl)ccc21)N(Cc1ccccc1O)C[C@H]1CCCO1 1470089202 ZTFWAPIBYBNREP-HXUWFJFHSA-N 427.932 4.391 10 10 IICE COc1ccc(N2CCN(C(=O)CCCc3ncc(-c4ccccc4)o3)CC2)c(OC)c1 1470858533 MAHKNAKKRGNCLT-UHFFFAOYSA-N 435.524 4.030 10 10 IICE Cc1ccc(O)c(CNC(=O)NCC[C@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)c1 1471068570 LEFDKEBIAXHARU-KRWDZBQOSA-N 425.529 4.429 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(C)=O 1501697048 XYBGWZFEVWWEKN-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1515524690 HJNVXQVDDFOTHS-HSZRJFAPSA-N 436.604 4.039 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C[C@H]1c1ccc(F)cc1F 1529276324 LRTPHUQAWIBPFT-FCHUYYIVSA-N 438.474 4.401 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cc(Cl)c3N)cc2F)C[C@H](C)O1 1543232985 ACPCXYTYAIMQPT-RYUDHWBXSA-N 426.319 4.258 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc2c(cn1)CCCC2 1544469217 YUSPJZRZUKFJAJ-WQRHYEAKSA-N 441.553 4.330 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)cc(C(F)(F)F)c3)CC2)cc1 1544743783 GCOVDKXJGDTBMI-UHFFFAOYSA-N 443.263 4.439 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)[C@H]2CCC[C@H](C)C2)cc1 1547444293 LJOOXBAAEBFPGX-UGKGYDQZSA-N 440.636 4.326 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)C[C@@H]2CC=CCC2)cc1F 1552833333 PHCXHEFQUOMMLH-QUCCMNQESA-N 427.568 4.218 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1 1556897516 MSPCVPRJHBERBU-QFQXNSOFSA-N 429.564 4.228 10 10 IICE C[C@@H](NC(=O)Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)c1ccccc1O 1557966618 KLVDEBGMLLLNAX-CYBMUJFWSA-N 443.297 4.420 10 10 IICE COC(=O)c1ccc2c(c1)CCCCN2C(=O)C1=CCCN(C(=O)OC(C)(C)C)CC1 1558577489 OVFYYOJUGZNUON-UHFFFAOYSA-N 428.529 4.100 10 10 IICE Cc1ncc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(Cl)c1Cl 1558949141 MBZXHRYTCFEDLG-AWEZNQCLSA-N 428.747 4.450 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Nc4ccccc4Cl)CC3)C2)cc1 1564963116 TTXRKVFWZYWKNK-SFHVURJKSA-N 442.991 4.461 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@@H](CSc3ccccc3)C2)N(C)C)cc1 1565452645 IOJPPRKEGYAMIL-XXBNENTESA-N 426.630 4.179 10 10 IICE COc1cc(/C=C/C(=O)NCc2c(O)ccc3c2CCCC3)cc(Br)c1O 1566359904 RFTHCNXCTFBPDH-RMKNXTFCSA-N 432.314 4.077 10 10 IICE CCCCc1cnc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)nc1 1587292080 FGSSWIJXRCPBQH-GZTJUZNOSA-N 444.557 4.188 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1 1597561098 OLDZLGVNRIRFMY-GOSISDBHSA-N 438.549 4.046 10 10 IICE COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)NCc2c(O)cccc2O)c1 1597568997 MABWAIANMDOEAF-UHFFFAOYSA-N 429.476 4.198 10 10 IICE Cc1cc(NC(=O)CN(Cc2ccccc2O)C[C@H]2CCCO2)ccc1Br 1616179511 FWLUJKVJYDZYAV-GOSISDBHSA-N 433.346 4.083 10 10 IICE Cc1cc(C(=O)N[C@H](CCC(C)(C)C)C(N)=O)c(C)n1-c1ccc(Br)cc1 1626298912 DQKDGUFNNPBHQR-GOSISDBHSA-N 434.378 4.267 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cn(C)c2ccc(F)cc12 1626511943 SXCPUGYQAJPEHE-UHFFFAOYSA-N 425.504 4.320 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(C(=O)N2CCCCC2)c1 1629972738 XKUMJCMNQARKKY-UHFFFAOYSA-N 445.357 4.443 10 10 IICE O=C(OCc1ccccc1)N1CC(NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1 1636074578 ACALVZFNFZQIRU-UHFFFAOYSA-N 437.540 4.258 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(C)(C)O[C@](C)(C(F)(F)F)C2)cc1 1636538363 PVYYHUYQOFJUOW-QFIPXVFZSA-N 436.474 4.408 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)Cc1ccccc1F 1647778855 XXNGMPFDEDTMQY-OALUTQOASA-N 445.554 4.107 10 10 IICE COC(=O)/C=C\c1ccc(OC)c(OCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)c1 1652813296 AEZVNXYPYCNMFF-POHAHGRESA-N 438.455 4.085 10 10 IICE C[C@@H](NC(=O)N1CCOC[C@H]1c1ccc(Br)cc1)c1ccc(N(C)C)cc1 1686173063 AANSYJIZDRORMT-QRWLVFNGSA-N 432.362 4.359 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)C2)cc1 1686855008 OBFWCQXFTYTHQS-IBGZPJMESA-N 426.517 4.050 10 10 IICE C#CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN1CCC[C@H](C)C1 1705547017 PTVSNJNXRAQNLS-FQEVSTJZSA-N 430.600 4.154 10 10 IICE CCc1nnc(N(C)[C@@H]2CCN(Cc3ccccc3)C2)n1CCCSc1nccs1 1709029742 LONUQRAJVVUBHM-LJQANCHMSA-N 442.658 4.190 10 10 IICE CC(C)[C@H]1CCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C1 1723224567 YDLVGQRZSRDPCO-SFHVURJKSA-N 428.631 4.385 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2COC(C)(C)OC2)n1CCCSc1nccs1 1726889203 ORYHWPLIOQWQCI-OAHLLOKOSA-N 439.651 4.266 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)CCCc2ccccn2)cc1F 1729329346 XSXSEVZMAZJBJS-UHFFFAOYSA-N 445.546 4.058 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@@]3(CCCOC3)C2)cc1 1746087586 ZWSTUZHNYRFBMG-CPJSRVTESA-N 441.620 4.070 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)(C)C)OC 1749324348 JDBSGRIBRDYRPM-OAQYLSRUSA-N 439.604 4.496 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1C[C@H](O)CC2(CCCC2)C1 1761697705 CWBSKMSYLMPCSI-JOCHJYFZSA-N 439.648 4.421 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](OC)[C@H](OC)C1 1763995723 KNNZWBNMFYIOIZ-ZRZAMGCNSA-N 437.588 4.393 10 10 IICE CCN(c1nnc(C(=O)N2CCCC2)n1CCCSc1nccs1)[C@@H](C)C1CCC1 1766416278 JIZHPTAABGHMTE-INIZCTEOSA-N 448.662 4.168 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2cscn2)cc1F 1766912130 QTJXUDZEXBNRMV-UHFFFAOYSA-N 442.589 4.277 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cccc(Br)c2O)[C@H]2CCCC[C@@H]21 2122806083 WWTZAYWLLNPKIZ-PVAVHDDUSA-N 425.367 4.422 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@H](CNC(=O)OC(C)(C)C)C2(C)C)c1O 2236054038 DITALSJWQHHVQT-WBMJQRKESA-N 443.382 4.192 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cccn1-c1cccc(C(F)(F)F)c1 2294118692 PTLJMZQIALBMSF-UHFFFAOYSA-N 443.356 4.302 10 10 IICE CCCC1=NN(c2ccc(F)cc2)C(=O)C1=CNc1cc(OC)c(OC)cc1C(=O)OC 2296740790 UBLVHNMNKQOCOW-UHFFFAOYSA-N 441.459 4.128 10 10 IICE O=C(O)CCCN1C(=O)C(=Cc2ccc(OCCc3ccccc3)cc2)SC1=S 2314761097 PPUWMZWPBKUJHX-UHFFFAOYSA-N 427.547 4.374 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(OC)c(OC)c2)SC1=S 2314769618 SWSJNZFXYVLICN-IBGZPJMESA-N 443.546 4.209 10 10 IICE CC(C)Oc1cccc(C=C2SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 2323812525 ALQCDHMXHXMVNB-GOSISDBHSA-N 443.546 4.077 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@@H](NCc1ccc(Br)cc1O)C2 2333645201 VSJKWBNERXJKBY-UNEWFSDZSA-N 425.367 4.280 10 10 IICE CC[C@H](Nc1c(I)cnn1C)c1cc(Br)ccc1O 2353671051 XGGYTEPRUCDZAQ-NSHDSACASA-N 436.091 4.056 10 10 IICE Cc1ccc(CN(C)C(=O)C(C)(C)[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2381129205 GVSIRLQMVLIPTK-CYBMUJFWSA-N 443.382 4.361 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)C2CCC2)c(O)c1Br 2381130293 WQEHQINWJWECAA-MRXNPFEDSA-N 441.366 4.115 10 10 IICE COc1ccc(N2N=C(c3ccccc3)/C(=C(/C)NCc3ccc4c(c3)OCO4)C2=O)cc1 19633748 ODJBWKUCVFPCBW-JJIBRWJFSA-N 441.487 4.239 10 10 IICE Cc1cccc(OCCOCCOc2ccc(/C=C3\SC(=S)N(C)C3=O)cc2)c1 83312762 RIZCQGMWLVLNGM-HKWRFOASSA-N 429.563 4.300 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cccc(OC(F)F)c2)C1 435756104 AUOBUKANNAOLDD-UHFFFAOYSA-N 427.495 4.326 10 10 IICE O=S(=O)(Nc1nc(-c2ccc(F)c(F)c2)cs1)c1cc2c(cc1Cl)OCCO2 727243845 FYPJFICJFMKDFS-UHFFFAOYSA-N 444.868 4.314 10 10 IICE Cc1cc(C(=O)[C@H](C)N2CCN(CC(F)F)CC2)c(C)n1-c1ccc(OC(F)F)cc1 747088573 YFSJLPIRBYTIQX-INIZCTEOSA-N 441.469 4.149 10 10 IICE O=C(Cn1c(C(F)(F)F)nc2ccccc21)Nc1c(-c2ccccn2)nc2ccccn12 751298957 FVLRLPUWAPJSNT-UHFFFAOYSA-N 436.397 4.404 10 10 IICE Cc1cc(F)ccc1N1CCC[C@H](OC(=O)c2csc(Cc3ccc(N)cc3)n2)C1=O 751930791 KOGYLDFMFRBYQP-FQEVSTJZSA-N 439.512 4.116 10 10 IICE CN1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 754857854 IMIXJEMMURQCDS-VXKWHMMOSA-N 428.939 4.100 10 10 IICE C[C@H](NC[C@@H](O)Cc1ccccc1)c1cc(Br)cc(Br)c1O 756547477 DJIABJGSHLVNCG-FZMZJTMJSA-N 429.152 4.171 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NCc1ccc(N3CCCCC3)cc1)CC2 758464237 LYFRZJWIZQMDPI-KRWDZBQOSA-N 432.490 4.215 10 10 IICE Cc1cccc(CN(Cc2cccc(C)n2)C(=O)NCCCSc2nccs2)n1 759590202 IBWNHMWHDHLBSV-UHFFFAOYSA-N 427.599 4.444 10 10 IICE CCN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1cccnc1C 798217924 DCLMTEVOBUXCSM-GHRIWEEISA-N 431.608 4.486 10 10 IICE CC(C)(C)OC(=O)Cc1ccccc1NC(=O)NCc1cc(Br)ccc1O 806322691 CPNIWVLBYBJCMB-UHFFFAOYSA-N 435.318 4.361 10 10 IICE CC[C@H]1CCCCN1C(=O)CN(CC(=O)N1CCCC[C@H]1CC)c1ccc(OC)cc1 914868056 JEFUDDVTHWCBBS-OYRHEFFESA-N 429.605 4.084 10 10 IICE CC(=O)N1CCC[C@@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc(Cl)c(Cl)c2)c1C 917243087 UDNDZYXVMCDIBG-LJQANCHMSA-N 437.323 4.138 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3c(c2)ncn3Cc2ccccc2OC)c1 1137473369 HKHUTULSWRMWSV-MRXNPFEDSA-N 431.492 4.298 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2=CCN(C(=O)OC(C)(C)C)CC2)cc1 1141518174 ICYLDWHUFBFQRH-UHFFFAOYSA-N 439.556 4.442 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 1142352143 SKHZUYFRBQCKKB-UYAOXDASSA-N 439.556 4.330 10 10 IICE Cc1cc(I)ccc1NC(=O)CN(C)c1ccc(OC(C)C)cc1 1169252904 NKDYMSMHJOKECB-UHFFFAOYSA-N 438.309 4.462 10 10 IICE CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NCc1cc(Cl)ccc1O 1225061401 GPUSTPHUXYKFII-DIFFPNOSSA-N 427.726 4.384 10 10 IICE COc1ccc(OC)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1264227361 RLANRPIHZALQRC-WOJGMQOQSA-N 446.525 4.073 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(C(F)(F)F)ccc1F 1266259282 XGVYHNLSDLIAOE-UHFFFAOYSA-N 435.465 4.307 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1276283384 FLJYRBDWURXBLA-NFCJYOSASA-N 449.595 4.157 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)NC(=O)OC(C)(C)C)cc1 1293791453 BQCFZOKUHHRDJA-LULLPPNCSA-N 437.531 4.116 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(F)ccc3NC(=O)[C@@H]3C[C@H]3C)c2)CC1 1296012089 BZULNGSPUIXONS-DYESRHJHSA-N 438.547 4.203 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@@H]1Oc1ccccc1 1296810646 BAUSHCKKMIQYSL-GPXOXTDOSA-N 436.552 4.259 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H](CCNC(=O)OC(C)(C)C)C(F)F 1298320015 ZBQAYUQLODHDEK-AWEZNQCLSA-N 427.517 4.434 10 10 IICE COc1ccc([C@H]2CCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1F 1313417037 QHCIAGYDQPKUHR-YADHBBJMSA-N 428.552 4.050 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CC[C@H](F)C3)CC2)cc1F 1315512131 JGFVWSRBKGNXRE-IRXDYDNUSA-N 433.547 4.188 10 10 IICE COc1ccc(CCCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(OC)c1 1350629675 XIRLGYFRVYRCKT-UHFFFAOYSA-N 429.472 4.441 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(Br)c(OC(F)(F)F)c2)cc1F 1357192391 JGNVDQOPKWPNIB-UHFFFAOYSA-N 435.215 4.483 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)cc1 1360068761 MBOLLVYUTHKAJP-IBGZPJMESA-N 441.400 4.115 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nc(C)ccc1Br 1445654489 NDLYWMXSVXHRKJ-UHFFFAOYSA-N 428.124 4.283 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@]3(c4ccccc4)CCC(=O)NC3)cc2Cl)C1 1459574428 FOHOXYUTZWUOBV-CJAUYULYSA-N 439.987 4.041 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCOc2ccccc2Br)N(C)C)cc1 1463284234 RAMZODCXSDOKDJ-HXUWFJFHSA-N 448.405 4.093 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1nc(C(F)F)cc1C1CC1 1467632389 TVTBFFLAEXPIIF-UHFFFAOYSA-N 448.514 4.087 10 10 IICE CCCOc1ncccc1Cn1c(-c2ccc(C)o2)nnc1N(C)Cc1ccccc1O 1515184733 DRLLNDXKNUXASM-UHFFFAOYSA-N 433.512 4.421 10 10 IICE CCCc1c(C(=O)NCc2ccc(N(C)C)c(F)c2)cnn1-c1cc(F)c(OC)cc1F 1527014107 RYUCXHXNPDELBK-UHFFFAOYSA-N 446.473 4.247 10 10 IICE C[C@H](NC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(N(C)C)cc1 1537679633 LXCVKXOJZRUXEQ-GTXQTCRKSA-N 434.367 4.456 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1 1539562002 AZVSRXMZWNOKOY-RUZDIDTESA-N 435.543 4.345 10 10 IICE CCC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(C(F)(F)F)c1 1542741755 RNOLXVIHKQPAJJ-MRXNPFEDSA-N 430.448 4.054 10 10 IICE COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)ccc1Br 1544529985 ROKYTEIQXNQPNU-LJQANCHMSA-N 447.373 4.345 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H](O)c2cc(Cl)c3c(c2)OCCO3)c1 1545522021 FSCDBDGGMACIDY-OAQYLSRUSA-N 440.927 4.291 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 1557385396 BYMNGCCXHSCRBJ-UHFFFAOYSA-N 441.658 4.376 10 10 IICE COc1ccc(N2CCN(CCCNc3ccnc(-c4cccc(Cl)c4)n3)CC2)cc1 1559056986 HSWYZWPAAYGKCO-UHFFFAOYSA-N 437.975 4.430 10 10 IICE Cc1cc(N2CCC[C@@H](NC(=O)N[C@@H](C)c3ccccc3O)C2=O)ccc1Br 1564515317 FEXYMAFLOXVWTA-KBXCAEBGSA-N 446.345 4.019 10 10 IICE Cc1cc2c(CCNC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c[nH]c2cc1F 1565146260 ATPQDJQFWWFSQG-IBGZPJMESA-N 425.504 4.254 10 10 IICE Cc1cccc([C@@H]2CN(Cc3ccccc3)C[C@H]2C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 1567467786 RKBUPGLXQZPDEO-DCEDVJGZSA-N 444.575 4.369 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccn(-c2ccccc2F)n1 1568378905 PEBGYKAVMJKRJN-UHFFFAOYSA-N 438.503 4.014 10 10 IICE CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1584894970 GUDGQKXKILJUOR-QHCPKHFHSA-N 429.524 4.255 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](C)Cc3ccc(Br)cc3)C2)cc1 1598363872 JZUYNIRLTLDRAM-AEFFLSMTSA-N 431.374 4.279 10 10 IICE Cc1cc(C(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1611128234 BFIJASISAGWQCP-AREMUKBSSA-N 444.535 4.330 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCC[C@H]3CCCCO3)CC2)cc1 1619301747 WWHKXXHERMIVDG-HSZRJFAPSA-N 441.620 4.476 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)s1 1627007022 ONYWAVWNJNJEAC-JKSUJKDBSA-N 439.585 4.210 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H](F)[C@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1627467752 QAASNZUVWPTVGM-FPOVZHCZSA-N 433.568 4.134 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC[C@@H](C2CC2)N1C(=O)OC(C)(C)C 1630181024 RENKSIZOFAYYHK-BULFRSBZSA-N 429.605 4.286 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(F)c1OC(F)(F)F 1631425415 FEBBWUCIVMLIEK-AWEZNQCLSA-N 446.828 4.478 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3CCCN3Cc3ccc(Cl)cc3)CC2)cc1 1632043985 AXXGTYKRUKHECG-HSZRJFAPSA-N 427.976 4.098 10 10 IICE CC(C)C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(C(F)(F)F)c1 1632167910 LEYINSJXGSVUKR-QGZVFWFLSA-N 444.475 4.300 10 10 IICE Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NCc3cc(Cl)ccc3O)c2)cc1F 1640920950 YEBZHXRWBPDPKO-UHFFFAOYSA-N 448.903 4.224 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](C)c4ccccc43)cc2F)C[C@@H](C)O1 1642168469 XGNOJWVTNQQILB-GUDVDZBRSA-N 425.548 4.069 10 10 IICE COC(=O)c1cccc(-c2nc(CN(C)CCN(C)c3ccc(OC)cc3)cs2)c1 1643684473 IOAJAQGXDSZEFL-UHFFFAOYSA-N 425.554 4.174 10 10 IICE CCOC(=O)c1c(NC(=O)Cn2ccnc2Br)sc(C)c1-c1ccccc1 1644244758 PTBCZQXPGYMXET-UHFFFAOYSA-N 448.342 4.498 10 10 IICE C[C@H]1Cc2cc(Cl)ccc2N1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1648207580 PEXAGQJYKRBSKL-LBPRGKRZSA-N 448.953 4.499 10 10 IICE COc1cc(N2CCCC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1655850623 PABWFTWFGCAELC-JOCHJYFZSA-N 435.521 4.230 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4cccs4)C3=O)c2C)c1 1656172899 GWWYUTFQKPYAIA-DEOSSOPVSA-N 435.549 4.422 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)Cc3cccc(F)c3)cc2Cl)C1 1680561730 FLWZLFSZPOXNKX-UZLBHIALSA-N 433.955 4.118 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)CCNC(=O)OC(C)(C)C)cc2Cl)C1 1682023433 FSEODBXTAAUYCT-MRXNPFEDSA-N 439.000 4.242 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](NC(=O)NCc3c(O)ccc4c3CCCC4)[C@H]1C2 1684800817 IRYSDLQBKFMSRU-MAODMQOUSA-N 443.588 4.248 10 10 IICE CC[C@H](C)CN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1708584342 SELNGGGDZXHHCP-IBGZPJMESA-N 439.629 4.298 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CCO1 1745341702 CDDBCKZFQSGHBN-KRWDZBQOSA-N 444.630 4.293 10 10 IICE CCCO[C@H]1CCCN(c2nnc(COCC)n2Cc2ccc(N(C)C)cc2C)CC1 1745848068 DFBFYAWQGPPFNK-QFIPXVFZSA-N 429.609 4.023 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC(F)(F)CC2)cc1 1764934058 HNGWTGFBWRIEIR-UHFFFAOYSA-N 426.515 4.470 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1)OC 1765558744 YHQNLLQMCQHATL-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1Cc1nccn1C(F)F 1767080721 MNFBBLZKTHWKLT-UHFFFAOYSA-N 443.546 4.452 10 10 IICE CN(CCOC(C)(C)C)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1768947600 BGTJTFSGTLRMNU-UHFFFAOYSA-N 432.619 4.230 10 10 IICE CCc1sc(NC(=O)[C@@H]2CCCN2)c(C(=O)OC)c1-c1ccc(Br)cc1 1866099368 BVPOXIMMFLVXOQ-ZDUSSCGKSA-N 437.359 4.217 10 10 IICE COc1ccccc1CNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CC2)C1=O 1873165766 UPDLUXLTRWXYID-UHFFFAOYSA-N 441.531 4.135 10 10 IICE CC(C)(C)OC(=O)c1nn(Cc2cccc(C(F)(F)F)c2O)c(C(F)(F)F)c1N 2079162110 BOUNIZNWMOCFCV-UHFFFAOYSA-N 425.329 4.212 10 10 IICE CCc1nn(Cc2cccc(Br)c2O)c(I)c1C1CC1 2079636569 MNUNLPUVARRKGS-UHFFFAOYSA-N 447.114 4.444 10 10 IICE COc1ccc(Br)c(CNC[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)c1O 2236053532 WJZYURPZHKNGMZ-UONOGXRCSA-N 443.382 4.146 10 10 IICE CCOc1ccc2ccc(OCC)c(C=C3C(=O)NC(=O)N(Cc4ccccc4)C3=O)c2c1 2293830039 QMOFTHDMORHREI-UHFFFAOYSA-N 444.487 4.299 10 10 IICE C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)C(=Cc2cccs2)SC1=S 2296252568 DOIQIEBTJCEUTF-CYBMUJFWSA-N 441.603 4.178 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(CCNCc3cccc(Br)c3O)CC[C@H]1C2 2338297543 OTFONJLYTVXMEW-MGPUTAFESA-N 425.367 4.424 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2[C@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380771944 KUYXCBJPQCQBNV-CZUORRHYSA-N 441.366 4.067 10 10 IICE CCC[C@@H](C(=O)N(C)Cc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2380790050 OESZOENLKHTWMG-HNNXBMFYSA-N 443.382 4.457 10 10 IICE CNC(=O)N1Cc2c(C)nn(-c3ccccc3)c2-n2cccc2[C@@H]1c1ccc(N(C)C)cc1 32977704 IPHKMGAJXGMECZ-DEOSSOPVSA-N 440.551 4.282 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2ccc(OCCc3ccccc3)cc2)SC1=S 40937938 KRNPJMZCBDVXAM-CYVLTUHYSA-N 427.547 4.072 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 205691418 VIVKIEGGOFFUAB-SFQUDFHCSA-N 427.507 4.133 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)ccc1O 210710426 YBWNRJYBCHCAIP-QGOAFFKASA-N 428.535 4.021 10 10 IICE CC(=O)Nc1cccc([C@@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435618814 VAPYEYMTRHIHHC-GOSISDBHSA-N 432.568 4.244 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCCO[C@@H]2C(C)(C)C)C1 435876947 MAZHXDNKUZEJTR-CLOONOSVSA-N 425.617 4.365 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 730137970 GFSBWXFIIWGULX-SFHVURJKSA-N 443.544 4.344 10 10 IICE COc1ccc(C[C@@H](C)NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1OC 731121266 UCHYBAHLGQWRMX-LJQANCHMSA-N 425.573 4.371 10 10 IICE Cc1oc2c(CN3CCC[C@H](C(=O)N4CCCC4)C3)c(O)ccc2c(=O)c1-c1ccccc1 732189250 CCHOHVRAEBNCEO-FQEVSTJZSA-N 446.547 4.308 10 10 IICE Cc1cc(Br)c(O)c(CNc2cccc(CS(=O)(=O)NC(C)(C)C)c2)c1 781635804 LZGCJOCNXISLLX-UHFFFAOYSA-N 441.391 4.293 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)c([N+](=O)[O-])c1 814261727 FXDSRDGDWCXVJO-VURMDHGXSA-N 445.516 4.008 10 10 IICE COc1ccc(-n2c(C)cc(/C=C3/C(=O)N(C)C(=O)N(c4ccccc4)C3=O)c2C)cc1 1084437587 ACBKTMJHLFFZLM-JCMHNJIXSA-N 429.476 4.111 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCN3C(=O)[C@H](C)Oc4ccccc43)c2C)c1 1132044827 YRBZITDIIOOYKE-FQEVSTJZSA-N 431.536 4.223 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2c(Cl)cc(F)cc2Br)N(C)C)cc1 1134882849 VWPDDPDPEVPBPX-QGZVFWFLSA-N 442.760 4.340 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(CN2C(=O)CSC2=O)cc1 1142775057 HXBZHMZBJNOPFN-UHFFFAOYSA-N 447.516 4.354 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc4c(F)c(Br)ccc4[nH]3)C2)cc1 1146948956 BOMGBLXGYBDIJX-LBPRGKRZSA-N 432.293 4.087 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Cn1nc(C(F)F)cc1C(F)F 1149901436 XZIOHKUYHHJZNB-UHFFFAOYSA-N 438.219 4.275 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2)c(C)n1-c1ccccn1 1161275547 FUJZTHRTOQFUFQ-XUVXKRRUSA-N 438.572 4.255 10 10 IICE CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)N1CCOc2cc(N(C)C)ccc21 1265456909 BJRBEYQPIQFUFH-AREMUKBSSA-N 445.563 4.015 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCCCC1 1286945893 KRTDVKWBJDIOQU-UHFFFAOYSA-N 434.588 4.259 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCO[C@@H](C(C)(C)C)C1 1289422949 FBEODPYBDBTUIR-JOCHJYFZSA-N 434.588 4.014 10 10 IICE CON(C)c1nnc(-c2cccc(OC(F)F)c2)n1CCCSc1nccs1 1302332872 XPMSWUOOTZCMGS-UHFFFAOYSA-N 427.502 4.183 10 10 IICE CCOC(=O)c1cn(C)cc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1304134676 OLQZXRYPDZPUIL-UHFFFAOYSA-N 445.317 4.019 10 10 IICE COc1ccc(N2CCN(CCCc3ccc(Br)cc3OC)CC2)c(OC)c1 1308014180 KJWNURFOCRGWDN-UHFFFAOYSA-N 449.389 4.230 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@@H](CC)C2 1348205198 JXPTVOQFXZYMHW-HUUCEWRRSA-N 432.586 4.169 10 10 IICE CC(C)n1nc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c2ccccc2c1=O 1355697871 YFOWBRXOYIVFFK-UHFFFAOYSA-N 444.535 4.479 10 10 IICE Cc1cc(N2C[C@H](C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2=O)ccc1Br 1459185487 NSAKWXYWBNVCCT-NVXWUHKLSA-N 444.373 4.054 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C\C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)o1 1466290466 XTRUBZBOBUYKLK-QXFGJRORSA-N 427.497 4.162 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCCCn2cc(Br)cn2)c1 1467776562 XMIOYXDIHBFQPY-UHFFFAOYSA-N 443.345 4.076 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCC[C@@H]3CCC(=O)OC(C)(C)C)C2)cc1 1470594987 YHTLBSARFUMHFV-PZJWPPBQSA-N 445.604 4.208 10 10 IICE CCOC(=O)c1ccccc1NC(=O)CN(Cc1ccco1)c1ccc(OC)c(F)c1 1473226254 PZTHMEXCMSVYJO-UHFFFAOYSA-N 426.444 4.249 10 10 IICE C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1478424757 LNTPJKZCLDFYCJ-CVEARBPZSA-N 439.000 4.289 10 10 IICE C[C@H](NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1)c1ccc(N(C)C)cc1 1523638146 AFDPHMUCDZUEIZ-UFYCRDLUSA-N 437.584 4.412 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CC[C@H](C(C)(C)C)C1 1542226975 OMTDHNOOMSJGFG-SFTDATJTSA-N 425.621 4.467 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc3ccccc3cc2O)c1 1543125805 NYLUGWNAPYJKMW-UHFFFAOYSA-N 425.488 4.290 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CCC(=O)NCc2ccc(N3CCCC3)cc2)COC1(C)C 1543591396 MLKDQCRKHZMJHI-HXUWFJFHSA-N 431.577 4.055 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 1544845130 KBPWYTBDTDUGHH-OAQYLSRUSA-N 448.498 4.082 10 10 IICE COc1ccc(Cl)cc1C(F)(F)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1546033673 CZZBAECGNYTBQT-INIZCTEOSA-N 425.859 4.354 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C/[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1557063792 ZOOQJGFZENGGKL-IXNXTHMNSA-N 429.605 4.312 10 10 IICE COC(=O)COc1ccc(N(C)Cc2nnc(-c3cc4ccccc4cc3OC)o2)cc1 1559742245 HPPUIWWMBZJDBR-UHFFFAOYSA-N 433.464 4.087 10 10 IICE COC(=O)C(C)(C)n1cc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cn1 1585829435 DKWWYOGNQRHLLX-UHFFFAOYSA-N 428.920 4.033 10 10 IICE C[C@]1(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1(Cl)Cl 1587670835 AWVSQSFSBDDBEF-IYCSXQJISA-N 449.450 4.430 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@@H](C)N(c3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cn1 1613456752 OHYMEWOUHHKYNX-MRXNPFEDSA-N 436.899 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCC(COC)CC2)cc1 1615382369 UXKYRHOVTZLXHH-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Cl)c(F)cc2Br)N(C)C)cc1 1616858152 IFUJZUIYQXAZJI-GOSISDBHSA-N 442.760 4.340 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3nccnc3NC(=O)C(C)(C)C)cc2Cl)C1 1617900247 HQCNFPGVFIMEEW-OAHLLOKOSA-N 443.979 4.281 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1)OC 1619593565 KODIVOLJPIWAIR-PGRDOPGGSA-N 437.588 4.250 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCC4)CC3)cc2F)C[C@@H](C)O1 1620413876 JTEAMRYSOOVFQK-WOJBJXKFSA-N 431.596 4.102 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(F)c(C(F)(F)F)c(F)c1 1623928112 FTGXTHCFXDIRRH-UHFFFAOYSA-N 437.748 4.158 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(C)n(-c3ccc(Cl)cc3)c1C)C[C@H]2O 1624208828 WZNWOPPZRCIHGR-HXUWFJFHSA-N 440.927 4.454 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)cc1C 1625938300 DGXRJKIVORFOIS-HSZRJFAPSA-N 431.536 4.263 10 10 IICE CC[C@@]1(c2ccc(NC(=O)c3sccc3-n3c(C)ccc3C)cc2)CCC(=O)NC1=O 1631042261 WNHUQBSTMNTKRJ-DEOSSOPVSA-N 435.549 4.492 10 10 IICE CC(C)(C)OC(=O)NCCOc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1 1632784574 XYHZWTUKRRQBJF-UHFFFAOYSA-N 444.509 4.468 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)cc1 1638335146 RXMHZVOFNAYKGR-IBGZPJMESA-N 448.361 4.059 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1[C@H]2c3cc(Br)ccc3C[C@H]21 1640087524 HRTVVBYMQNSMHF-VNQPRFMTSA-N 437.131 4.119 10 10 IICE COc1ccc(N(CC(=O)NCCOc2c(C)cccc2C)Cc2ccco2)cc1F 1644790622 WTXDSMGHAVHWHY-UHFFFAOYSA-N 426.488 4.246 10 10 IICE CON(Cc1ccc(C)o1)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1644990907 FBDKDNAOBKGEJF-WJDWOHSUSA-N 436.580 4.221 10 10 IICE NC(=O)Cc1cccc2c1CCN(CC(=O)Nc1ccc(N=Nc3ccccc3)cc1)C2 1648000528 HBPLYTXFGUAHHK-UHFFFAOYSA-N 427.508 4.127 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4cccc(Br)c4C3)C2)cc1 1673823399 RUCPEBDNSGPZSX-INIZCTEOSA-N 444.373 4.052 10 10 IICE C[C@H](CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(C(F)(F)F)cc1 1681444812 LDTFHJILSLNBPY-QGZVFWFLSA-N 434.506 4.060 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCCC[C@H](NC(=O)OC(C)(C)C)C1 1683425253 NEZPSZIUSQNJHK-FPOVZHCZSA-N 446.636 4.471 10 10 IICE C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684873448 HDZGJXDEODWYEP-RBUKOAKNSA-N 429.008 4.425 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cc2ccccc2s1 1686131152 NAKDRAJKBCZDKB-MRXNPFEDSA-N 436.581 4.163 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC[C@@H](C(F)(F)F)C1 1693004766 BYPUOEWKHIZTFO-QGZVFWFLSA-N 432.494 4.475 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694096436 SSANMZOKZRWGIP-NQIIRXRSSA-N 429.584 4.440 10 10 IICE C#C[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@@H](O)C1 1705478511 CRDHPJQKYXOTJN-AVCGJXAMSA-N 431.584 4.362 10 10 IICE C=CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(COC)CCOCC1 1705835697 QZJPCXYWRVSFOD-UHFFFAOYSA-N 449.599 4.418 10 10 IICE CCC[C@](C)(O)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727913173 JOLGSXHEGKTHTM-SANMLTNESA-N 448.615 4.052 10 10 IICE Cc1noc([C@@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)n1 1751965097 UFIZKUFITVSBFA-OAHLLOKOSA-N 433.607 4.116 10 10 IICE C[C@@H]1COCC[C@@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763208317 HYOAIZILOHEXFG-NVXWUHKLSA-N 427.936 4.008 10 10 IICE Cc1cccc(-c2ncc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c(O)n2)c1 1859707563 TYQYFFKJIJCEHY-UHFFFAOYSA-N 435.439 4.185 10 10 IICE COc1ccc(N2CCN(C(=O)COc3cccc4c3ccn4CCC(C)C)CC2)cc1 1860336919 PHBGYSVFMJCDFO-UHFFFAOYSA-N 435.568 4.424 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3)C(=O)/C2=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 1865678015 PAZFTRGJGVJTRW-DEDYPNTBSA-N 429.432 4.139 10 10 IICE CCN1CCc2cc([C@@H](N)[C@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044751773 FEDWSEHPXJLNJL-LADGPHEKSA-N 438.616 4.094 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C3CC3)c(C=O)c2I)cc1C 2079977537 NNJOBKNEIFQBFQ-GOSISDBHSA-N 436.293 4.499 10 10 IICE CC[C@H](N[C@@H]1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1cc(Br)ccc1O 2095041829 PPIHGAKPYUAFLV-VDNDLQMASA-N 425.367 4.451 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4ccco4)SC3=NC2=O)c(C)n1Cc1ccccc1 2296398012 MZZYHZSXZOWOGU-UHFFFAOYSA-N 429.505 4.414 10 10 IICE COc1ccccc1-n1c(C)cc(C=C2C(=N)N3N=C(c4ccco4)SC3=NC2=O)c1C 2297470610 UYOMLOSTJBWXIH-UHFFFAOYSA-N 445.504 4.363 10 10 IICE CCN(CC)c1ccc(CN(C(=O)C=Cc2ccc(C)cc2)[C@@H]2CCS(=O)(=O)C2)cc1 2314508713 XDSDLUFSFZETIT-XMMPIXPASA-N 440.609 4.070 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)N(C)C)cc1 2318684044 NYBULIJBRKYUDG-SFHVURJKSA-N 443.550 4.108 10 10 IICE CC[C@H](C)N1C(=O)/C(=C2\C(=O)N(CC)c3ccc(Br)cc32)SC1=S 2695337 LWLCPRBMYDXTQZ-IIAYEXGSSA-N 425.373 4.186 10 10 IICE CCC[C@@H](C)NC(=O)c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc2ccccc12 23331675 KTICFEHITJXTMS-LJQANCHMSA-N 432.568 4.488 10 10 IICE COc1ccc(Cl)cc1-n1cccc1/C=C1\C(=N)N2C(SC)=NSC2=NC1=O 96462610 CIJMYVNVRWKFLQ-PJPVWUKMSA-N 431.930 4.079 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCn2c(=O)oc3ccccc32)cc1 98079935 ZZWRYVDADCEQDV-UHFFFAOYSA-N 445.519 4.293 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c[nH]c2ccc([N+](=O)[O-])cc12 726625821 PXKIAMWGVGDSOZ-UHFFFAOYSA-N 430.411 4.076 10 10 IICE O=C(OCc1nc(-c2ccoc2)no1)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O 729862882 PTIYAINRJVTGOJ-UHFFFAOYSA-N 434.791 4.115 10 10 IICE COC(=O)/C=C\c1ccc(N(Cc2cccc(C)n2)Cc2cccc(C)n2)c([N+](=O)[O-])c1 751232740 JTTKRVQAODPVLS-QBFSEMIESA-N 432.480 4.395 10 10 IICE C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)N(Cc1ccccc1O)C1CCCCC1 764465782 FYYRDFFZMKDMEQ-GOSISDBHSA-N 434.540 4.035 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccc(N2CCOCC2)cc1 764691271 BVMXQXRKVCVSRL-FDDCHVKYSA-N 437.588 4.273 10 10 IICE O=C(c1cccc(O)c1O)N(Cc1ccccc1)C[C@H](O)c1cccc(OC(F)F)c1 790938311 VJDUZEFIJPCGRW-FQEVSTJZSA-N 429.419 4.075 10 10 IICE Cc1cc(C(=O)N2CC[C@H](N3CCC3)[C@@H](F)C2)c(C)n1-c1cccc(Br)c1 791256569 DTXTUIKISWQBQJ-PMACEKPBSA-N 434.353 4.115 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccccc3)c(C)s2)c(F)cc1Cl 795546600 KZMFVYAJRHCEAW-UHFFFAOYSA-N 440.905 4.498 10 10 IICE CC(C)[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc2c(c1)OCCO2 804884926 IBQIJHYJWNCODT-LJQANCHMSA-N 435.318 4.122 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@@H]1CCNC(=O)CC1 815041988 GYCRFQPPJBDJPY-HNAYVOBHSA-N 433.474 4.214 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@H](C)C2 1124130756 YMVHLCZZOYOVIB-GJZGRUSLSA-N 426.538 4.041 10 10 IICE Cc1nc(C2CCC2)sc1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1125188873 WOMWZUGOROVMOJ-HUUCEWRRSA-N 431.577 4.331 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cncc(-c2ccc(Cl)cc2)c1 1129549348 IWCSRASZAGWKKS-UHFFFAOYSA-N 443.881 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1nc([C@@H](C)OCC(C)C)no1 1136968323 JIKWZPZWJABTKI-GOSISDBHSA-N 438.528 4.295 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Oc2ccc(F)cc2)nc1 1136984490 MWQATFIHCHIWON-UHFFFAOYSA-N 439.462 4.043 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@H]2CCCC[C@H]21 1146320248 PKMUOBRDZSZAPI-VXNXHJTFSA-N 436.552 4.029 10 10 IICE CCOC(=O)[C@]1(F)CN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC12CCC2 1147036127 SNUQIIOSLOQOQI-XMMPIXPASA-N 428.504 4.000 10 10 IICE CN(C)c1ccc(CN(C[C@@H](O)COc2cc(F)cc(Br)c2)C2CC2)cc1 1190446759 OFLBIVHVPOVRBA-HXUWFJFHSA-N 437.353 4.059 10 10 IICE Cc1ccccc1CN(C)c1nnc(C(=O)NC(C)C)n1CCCSc1nccs1 1290185279 DEPQVOXFNCKRHX-UHFFFAOYSA-N 444.630 4.000 10 10 IICE COC[C@H]1CCCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C1 1301263809 NKBJTMNZQKOKSA-KRWDZBQOSA-N 429.615 4.447 10 10 IICE CCC[C@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N[C@@H](C)c1ccccc1O 1302532452 DBGLANMLQFQZTF-KSSFIOAISA-N 448.361 4.000 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(Cc2ccc(F)cc2)CC1 1312833802 OGMMEWFRPVZJIF-UHFFFAOYSA-N 447.501 4.105 10 10 IICE O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 1313152122 RSGVTVISHRQKGZ-ZNLUXHQJSA-N 448.922 4.406 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)OC 1313772418 RAZKMUKTESGAPQ-SIKLNZKXSA-N 437.588 4.393 10 10 IICE CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1351674748 YNEFLXUXHXDMDH-RUZDIDTESA-N 446.595 4.110 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)c3ccc(C(F)(F)F)cc3)cc2F)CC1 1352968933 DOAHHKZNFYCGSJ-INIZCTEOSA-N 437.481 4.406 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)C2CC2)cc1 1354143150 XALVYDQDHWXZBD-AUSIDOKSSA-N 443.950 4.256 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(=O)c3cc(Cl)cc(Cl)c3)cc2F)C[C@@H](C)O1 1356036767 ONFCSPPHWJXSHV-BETUJISGSA-N 439.314 4.245 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCSC1 1359680953 KRPVOIHBIBDVEP-FQEVSTJZSA-N 429.634 4.018 10 10 IICE COc1cc(/C=C/C(=O)NCc2ccc(N3CCCC3)cc2)cc(Br)c1O 1441191160 YOVZXGKRKJNDDY-RMKNXTFCSA-N 431.330 4.093 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(C(F)(F)F)no1 1461246801 VPTCVJYYEACWAJ-XFFZJAGNSA-N 445.419 4.063 10 10 IICE CC(C)(C)CC[C@@H](CO)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1467486691 SHLPJCCSCZZZJT-AOHITCTBSA-N 440.656 4.033 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C 1501151415 QTHXGNCXACBKCL-SFHVURJKSA-N 434.588 4.258 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1503487031 DLWYEGVWFVKCTJ-UHFFFAOYSA-N 440.598 4.265 10 10 IICE CCC[C@]1(C(=O)OCC)CCCN1C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1524832020 TZZITJOBKOZWJZ-AREMUKBSSA-N 439.600 4.132 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1(NC(=O)OC(C)(C)C)CC2(CCC2)C1 1525761948 JCJAQTUXUVRYPO-GOSISDBHSA-N 429.605 4.336 10 10 IICE Cc1cc(CC(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccc1 1529519917 WHOBCYLEJAYPKY-KDURUIRLSA-N 425.573 4.493 10 10 IICE CCC(CC)(CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)SC 1533115293 HFEPHUTXOCEVTP-VBKFSLOCSA-N 440.631 4.455 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C(C)(C)n2cc(NC(=O)OC(C)(C)C)cn2)cc1 1539308662 UAIFVVFOHKCYSA-UHFFFAOYSA-N 443.592 4.470 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)N(C)C)cc1 1539708069 WBPPWDQYFHJNMA-RUZDIDTESA-N 444.579 4.062 10 10 IICE COc1ccc(OC)c(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1540632863 UJOWGTCLNJOPPH-UHFFFAOYSA-N 444.329 4.199 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc4cc(Br)sc4[nH]3)CC2)cc1 1542171530 PWLJWUSUVGQECJ-UHFFFAOYSA-N 434.359 4.353 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](c3cccc(F)c3)N3CCOCC3)c2C)c1 1544454024 FZMCSHXXSDMVOC-VWLOTQADSA-N 435.543 4.345 10 10 IICE COc1cccc(-c2nnc(N3CCC(F)(F)C3)n2CCCSc2nccs2)c1 1555004041 LIFXRJDTINQEKH-UHFFFAOYSA-N 437.541 4.438 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc2ccccc2c1 1556091254 HWNHYUZMSMCXDW-HXUWFJFHSA-N 436.508 4.176 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3nccn3C)C2)c(C)n1-c1ccc(Br)cn1 1556421105 IYVXHOMFCGEQKS-INIZCTEOSA-N 442.361 4.005 10 10 IICE Cc1cc(C(=O)N(C)Cc2noc(C3CC3)n2)c(C)n1-c1ccccc1Br 1557010520 OACJVFVHBIOWCW-UHFFFAOYSA-N 429.318 4.389 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl 1557385679 HYHASJYTVDGPMX-UHFFFAOYSA-N 447.656 4.498 10 10 IICE COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)NCc2c(O)cccc2F)c1 1558455636 OLHQHRQTHNMBND-UHFFFAOYSA-N 447.466 4.331 10 10 IICE Cc1cc(C(=O)NCCc2cn(Cc3ccc(Cl)cc3)cn2)c(C)n1-c1ccccn1 1558835794 FDQKZBAIOMWLAL-UHFFFAOYSA-N 433.943 4.360 10 10 IICE CN(CCOc1ccccc1F)C(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1559609949 RLUVLOBUHOVXSN-UHFFFAOYSA-N 426.410 4.014 10 10 IICE C[C@@H](NC(=O)N1CCN(C(=O)OC(C)(C)C)CCC12CCC2)c1ccc(N(C)C)cc1 1564598033 XPYDKXXBZRFJLF-GOSISDBHSA-N 430.593 4.389 10 10 IICE Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1584515396 QBEFHDCSVYUXAY-KRWDZBQOSA-N 432.511 4.317 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(=O)c3ccccc3n2C)cc1 1585493136 RMLQEPQPZVWNOW-UHFFFAOYSA-N 441.531 4.460 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cnn(C(C)(C)C)c1I 1588183928 PZVDVURJSKGTIV-UHFFFAOYSA-N 441.313 4.001 10 10 IICE CCOC(=O)C[C@H](SCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C)C(=O)OCC 1613757236 RVQASNIOCLAXHY-NRFANRHFSA-N 449.544 4.342 10 10 IICE CCCCCc1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1618172866 GESPEQIQXLIUBR-FOCLMDBBSA-N 435.568 4.271 10 10 IICE CN1CCCc2cc(CNC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 1626940487 JEGBFZAZERAZKA-UHFFFAOYSA-N 436.434 4.114 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)c(C)n1-c1ccccc1 1635362560 GTZLEXRHJIHSEQ-DEOSSOPVSA-N 432.568 4.155 10 10 IICE CON(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@@H](C)c1csc(C)n1 1635809510 CCYVFHWFLPSEIV-INIZCTEOSA-N 426.586 4.324 10 10 IICE CC(C)(C)OC(=O)[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)Cc2ccccc21 1641294150 PMIVJRZMANTKMC-MRXNPFEDSA-N 425.506 4.394 10 10 IICE CCN(C)c1ccc(CN2CCC([C@@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)CC2)cc1 1646179094 TWAVKVFKBQKFHI-GMAHTHKFSA-N 431.621 4.427 10 10 IICE O=[N+]([O-])c1cnc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(Br)c1 1650729028 YYYUCLWYEJMTDY-ZDUSSCGKSA-N 441.713 4.188 10 10 IICE COc1ccc([C@H]2COCCN2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1684444167 JVBUHKQSEQIZJA-RUZDIDTESA-N 433.552 4.428 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC2(c3ccc(Br)cc3)CC2)N(C)C)cc1 1684607889 WWZYPDGVTBSKQK-FQEVSTJZSA-N 445.405 4.106 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1687217957 XSMTULBZXJQFCK-SFHVURJKSA-N 428.577 4.191 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1695112387 ICXFZVNZIFQRHU-VWLOTQADSA-N 437.588 4.130 10 10 IICE COc1ccc(CCc2nnc(N3CCCC3)n2CCCSc2nccs2)cc1 1748718603 CGCSTANBOCSRAU-UHFFFAOYSA-N 429.615 4.311 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC(=O)N1 1763807485 XKOZWMSPOLRJOH-YLJYHZDGSA-N 434.588 4.256 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1C[C@H]1CCCO[C@@H]1C(C)(C)C 1768681474 KDGVRWTZNCMJBP-SJBKTWHCSA-N 442.604 4.355 10 10 IICE O=C1/C(=C\c2cc(Cl)cc(Br)c2O)SC(=S)N1C[C@H]1CCCO1 1858587548 KZHAXKNWAJYXTK-STCRIKGOSA-N 434.764 4.188 10 10 IICE CC(C)CS(=O)(=O)c1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1859707114 IMCNDEMTDDRDFN-UHFFFAOYSA-N 447.512 4.144 10 10 IICE O=C(O)[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@H]1c1cccc(O)c1O 1951592214 MREDBZWFRKONFP-SFTDATJTSA-N 445.471 4.147 10 10 IICE C[C@@H](c1ccccc1O)N(C)C(=O)C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2060156130 CVELSKQIHZRWGZ-AZUAARDMSA-N 442.556 4.412 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C(F)F)c(N)c2I)c(O)c1 2079881974 YPVQVUVINJIWRO-AWEZNQCLSA-N 449.239 4.111 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1csc(=NCc2ccc(Br)cc2O)[nH]1 2082946122 DKLWIPAMYMTABG-SNVBAGLBSA-N 428.352 4.231 10 10 IICE OCc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(Br)c1 2130156711 HFSACMPKIGIMRQ-SFHVURJKSA-N 429.280 4.195 10 10 IICE COc1ccc(Br)c(CNC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)c1O 2236053920 BTDNCBBXNWLWFL-HZPDHXFCSA-N 433.390 4.410 10 10 IICE COc1ccc(C=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)c(OC)c1 2297311765 AWXNYLOIODYDGG-UHFFFAOYSA-N 429.432 4.447 10 10 IICE COC(=O)c1ccccc1-c1ccc(C=C2C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)o1 2297332384 UYMVUDKUMIESQC-UHFFFAOYSA-N 444.443 4.016 10 10 IICE CSC1=NSC2=NC(=O)C(=Cc3ccc(OCCOc4ccccc4)cc3)C(=N)N12 2297341107 WYXSOMZJYLIPJU-UHFFFAOYSA-N 438.534 4.084 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3cccc(C(=O)O)c3)C2=O)cc1)C(=O)O 2314927659 IWTZUMOPHWLJRA-MRXNPFEDSA-N 443.502 4.033 10 10 IICE Cc1ccc(CNC2CC3(C2)CC(NC(=O)OC(C)(C)C)C3)c(O)c1Br 2352695008 XXCUBVRLEIAHLD-UHFFFAOYSA-N 425.367 4.389 10 10 IICE O=C1/C(=C/c2c[nH]c3ccc(Br)cc23)C(O)=NC(=S)N1Cc1ccco1 1125463 NVGDGBPHTVYOLH-MKMNVTDBSA-N 430.283 4.191 10 10 IICE CCOC(=O)COc1c(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cccc1OC 3000905 OAMMMIUNTPWBCJ-LDADJPATSA-N 443.546 4.351 10 10 IICE CC1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@H](c2ccc(O)cc2O)N3)CC1 13639873 HAEWHHKKTAJPCU-XLNZFTOWSA-N 440.565 4.345 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14473547 USBAQQJDZNTAJR-GCKMJXCFSA-N 427.888 4.451 10 10 IICE CCOc1cc(/C=C2/SC(Nc3cccc(C)c3C)=NC2=O)ccc1OCC(=O)O 16916115 SSVIYVDIIFSUQJ-YBFXNURJSA-N 426.494 4.248 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1ccc(C)cc1 20236359 CSBRSVSXGRKZRO-YUIYYNKLSA-N 447.491 4.302 10 10 IICE Cc1cc(Br)c(S(=O)(=O)Nc2ccc(O)c(F)c2)cc1Br 155783637 LWZYUQAWVIMZLS-UHFFFAOYSA-N 439.100 4.166 10 10 IICE COC(=O)c1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccc(OC)cc2)cs1 727241970 OQJSXNUBANLGBE-UHFFFAOYSA-N 438.914 4.060 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(Br)cc2ccccc12 730213498 MXDOMODKKQFVSE-UHFFFAOYSA-N 425.326 4.369 10 10 IICE C[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N(C)Cc1c(F)cccc1Cl 734155522 FMJNGJYRHVHGHQ-IRXDYDNUSA-N 433.955 4.013 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C)cc1 743808567 XPWMELAGOLBWLA-FZKQIMNGSA-N 431.330 4.412 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 745318195 ZJHKCWAAZXPOIN-AWEZNQCLSA-N 444.333 4.028 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c(C)c1 761889958 HMJGMLLKFKRDKQ-FQEVSTJZSA-N 438.915 4.065 10 10 IICE O=C(NCc1cccc(Br)c1O)C1(c2ccccc2Br)CC1 765755914 JSHYBLLTOUJQLB-UHFFFAOYSA-N 425.120 4.265 10 10 IICE COc1cc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1OC(F)F 768669230 GCASRQKFMMKXKY-UHFFFAOYSA-N 431.527 4.118 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1ccc(F)cc1 800047372 KIGCGVKXWVBTBO-UHFFFAOYSA-N 442.299 4.206 10 10 IICE COCCN(Cc1scnc1C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C 809859424 SDKBCTQAIIYPNF-UHFFFAOYSA-N 436.585 4.308 10 10 IICE Cc1nc([C@@H]2CCCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 814679470 GPWLYBFKRDJICR-CTNGQTDRSA-N 443.613 4.233 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccccc2SCC(=O)N2CCCC2)C2CC2)cc1 914485309 RBAMPFDHSTVDPK-UHFFFAOYSA-N 437.609 4.272 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C/c3cc(Cl)cc(Cl)c3)cc2)CC1 1133847175 GWZGFAQVDURFAI-ZZXKWVIFSA-N 432.351 4.025 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)c(N)c([N+](=O)[O-])c1 1136335925 UCHUZDCRPIJPPE-UHFFFAOYSA-N 435.322 4.056 10 10 IICE C[C@@H](NC(=O)C1CC2(C1)C[C@H](NC(=O)OC(C)(C)C)CCS2)c1ccc(N(C)C)cc1 1138363828 RFHKQXQNLAGRDX-NMRKNHCDSA-N 447.645 4.499 10 10 IICE CCC(CC)(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(OC)c(OC)c1 1148701482 ZSJWMSLECHSGRG-UHFFFAOYSA-N 440.584 4.039 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](NC(=O)c1cc(C)n(-c3cccc(C)c3)c1C)CCS2 1158654829 YBONCXBATRBFLT-SZTYLXMGSA-N 426.582 4.350 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)N(C)C)cc1 1158717382 NVPJZEWXOHVHFY-HXUWFJFHSA-N 446.473 4.058 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(Br)c(C)ccc3[nH]2)cc1 1164597729 UADDEWOLERFUES-UHFFFAOYSA-N 430.346 4.456 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@]2(C)Cc2ccc(F)c(F)c2)N(C)C)cc1 1256237234 VFFWZYXXXDKIIM-UKILVPOCSA-N 444.570 4.440 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)[C@]4(C)CCCS4(=O)=O)n3)c2C)cc1 1264176207 QFIZRFZMKWJYEH-QFIPXVFZSA-N 443.594 4.432 10 10 IICE C[C@@H](NC(=O)c1ccc(-c2cccc(Cl)c2)nc1O)c1ccc(N2CCOCC2)cc1 1264822555 WEZBSZMTXBGOJH-MRXNPFEDSA-N 437.927 4.435 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)c1 1272211053 KOUXUNHSHXFABK-GOSISDBHSA-N 428.964 4.158 10 10 IICE Cc1c(Br)ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1N 1292045861 WTSLBYKPGPOJFF-UHFFFAOYSA-N 443.389 4.124 10 10 IICE C[C@H](NC(=O)c1ncoc1C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 1296650917 XBJZGSIETISWKR-INIZCTEOSA-N 442.560 4.346 10 10 IICE CN1CCCc2cc(Cn3c([C@@H]4CCCCO4)nnc3N(C)CCOC(C)(C)C)ccc21 1298890178 ZYLZMCLTWXASMH-QFIPXVFZSA-N 441.620 4.202 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@H](O)c1cccnc1 1302356307 JCOQFKZKAPUSOM-DNQXCXABSA-N 449.551 4.008 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2cc(F)cc(Cl)c2)CCCC1 1448826500 SCXKKVNLEOBKMM-QFIPXVFZSA-N 430.907 4.171 10 10 IICE CS(=O)(=O)c1cc(C(=O)NCc2ccc(N3CCCCC3)cc2)c(Cl)cc1Cl 1452049866 GLAQLSZAXIFWTM-UHFFFAOYSA-N 441.380 4.317 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(=O)Nc3ccccc3)cc2)N(C)C)cc1 1463279487 IMRQAXZXWQHTTE-DEOSSOPVSA-N 430.552 4.038 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCSC[C@@H]2C(F)(F)F)C1 1463349200 YBZISVUKKDISRK-HXUWFJFHSA-N 439.547 4.304 10 10 IICE COC(=O)c1ccc(/C=C/C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)o1 1465006853 PVZIAEMSLIMAOJ-JQIJEIRASA-N 434.492 4.387 10 10 IICE CCO/C=C/[C@@](O)(CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468481124 LUGAODOGKDEENJ-JBVUFVISSA-N 430.854 4.321 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1469959982 MPHXYYFOUBFNCQ-AEFFLSMTSA-N 435.996 4.450 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CCCN1C1CCCCC1 1469979750 VTGPDZRFQOUWEZ-LJQANCHMSA-N 438.410 4.483 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3C(=O)c3ccc(F)cc3)CC2)c(OC)c1 1470858629 NITKKBRHVPPBNQ-UHFFFAOYSA-N 448.494 4.036 10 10 IICE COC(=O)/C=C/c1ccc(N2CC[C@@H]3[C@H](CCCN3Cc3ccccc3)C2)c([N+](=O)[O-])c1 1472722443 SCMGBCGZJMBAAS-CZTRIHPMSA-N 435.524 4.272 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCC[C@@H](C(F)(F)F)C2)cc1F 1503392017 BIODQTVDZUTIHY-MRXNPFEDSA-N 425.474 4.263 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnccn1 1504558635 AIYBKFNPNSMLAZ-SFHVURJKSA-N 445.571 4.062 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCC(C)CC3)C2)n1Cc1ccc(N(C)C)cc1C 1513901061 RKCZDRUHFXTHSX-QFIPXVFZSA-N 438.664 4.212 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)OC)CC1 1514464864 SWGDNXRKXKEFPA-UHFFFAOYSA-N 436.560 4.041 10 10 IICE CCN(C)c1nnc(-c2cc(Br)cn2C)n1Cc1ccc(N(CC)CC)cc1 1515326711 URNWILNALUJNSN-UHFFFAOYSA-N 445.409 4.397 10 10 IICE CC(C)Oc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1517374443 XDCKVTPXHMQAJO-BOPFTXTBSA-N 445.541 4.238 10 10 IICE O=C(/C=C/c1cncc(F)c1)N1CCOc2c1cc(Br)cc2C(F)(F)F 1530622874 KUSVSDMZNANMSZ-OWOJBTEDSA-N 431.183 4.441 10 10 IICE CCCCOCCN(C(=O)/C=C/c1cnc(OC)nc1)c1cccc(Br)c1 1532256412 PEFROFMWRLGPFO-CMDGGOBGSA-N 434.334 4.111 10 10 IICE CCOc1cc(Cl)ccc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1533992277 NNQMQEHDXKSIQR-UHFFFAOYSA-N 427.976 4.201 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(F)c(C(F)(F)F)c(F)c3)cc2F)CC1 1537535257 PIUGOVSKTDTYCF-UHFFFAOYSA-N 445.407 4.195 10 10 IICE CC1CCC(N(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)CC1 1543837084 DLVJTNQXMNDZKV-UHFFFAOYSA-N 431.635 4.332 10 10 IICE FC1(F)CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C1 1555979066 MWOACZOVPYDSKE-UHFFFAOYSA-N 427.571 4.415 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)Oc1ccc(F)cc1 1556052362 IUMGALMLEBTSLN-OAQYLSRUSA-N 444.890 4.237 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1(C)C 1570018214 ZSHQOZMQSYTNIZ-WBVHZDCISA-N 435.528 4.274 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1nc2c(s1)C[C@@H](C)CC2 1603311521 SCQGPYBDHXKFON-INIZCTEOSA-N 425.602 4.448 10 10 IICE CCN1CCN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C[C@@H]1C 1615859637 RCADARBUHBYVAZ-INIZCTEOSA-N 446.621 4.254 10 10 IICE COC(=O)CN(Cc1cncc(-c2cc(F)ccc2OC)c1)Cc1cc(Cl)ccc1O 1615934883 FBKFGYJBFGHGAU-UHFFFAOYSA-N 444.890 4.431 10 10 IICE CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1621898752 WVSPAAWQLKYHBA-DOTOQJQBSA-N 440.612 4.049 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(SC(F)(F)F)nc1 1622634516 AFGAZXFOWLMUAS-OAHLLOKOSA-N 445.894 4.447 10 10 IICE Cc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)N2CCOCC2)o1 1623524124 FVWIKWYIDCDXCW-JOCHJYFZSA-N 441.959 4.452 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)c2ccccc2)c(C)n1-c1ccccc1Br 1628035526 IWQIHUCSMODMJP-QFIPXVFZSA-N 427.342 4.494 10 10 IICE CCOC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n[nH]1 1632128814 ACTYYUMAOZGNNN-UHFFFAOYSA-N 431.290 4.009 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1Cl)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1634535304 IHHHUDROOZBQSX-HXUWFJFHSA-N 425.916 4.047 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1634720398 VLIQFCWOERBIBQ-XLIONFOSSA-N 447.982 4.366 10 10 IICE Cc1cc(C(=O)N2CCC(CCCN(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1636350045 FBGMBNWEGHFCFS-UHFFFAOYSA-N 447.421 4.446 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3c(O)nnc3O)cc2)c(C)n1-c1ccc(C(C)C)cc1 1640273675 GJLHHYPOSGALRX-UHFFFAOYSA-N 431.496 4.462 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(c3ccccc3)[C@@H](C)c3ccccc3)CC2)cc1 1645224773 ZLOJOPTUTULPLG-WNCULLNHSA-N 445.607 4.446 10 10 IICE COC(=O)c1ccc([C@@H]2CCCCN2Cc2ccc(N3CCC(OC)CC3)cc2)n1C 1660646067 BKABOWLTQMQTSC-QHCPKHFHSA-N 425.573 4.154 10 10 IICE CN(Cc1cccc(Cl)c1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1681850223 UBNBCUIGZJIMAQ-UHFFFAOYSA-N 444.309 4.450 10 10 IICE C[C@@H](NC(=O)NCc1c(O)ccc2c1CCCC2)[C@@H]1C[C@H](C(=O)OC(C)(C)C)C1(C)C 1682304876 XOJMKUKLMFDVJE-UIAACRFSSA-N 430.589 4.463 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2COc3c(F)cc(F)cc3C2)cc1 1685737374 KXLJBQCFGZKULL-LJQANCHMSA-N 441.478 4.339 10 10 IICE C[C@H]1CCCN1c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1693693435 SSRMFLWJMCHKCV-YRISNDGFSA-N 429.584 4.439 10 10 IICE C=C(Br)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1705682896 OLWUUYNPUOXSJB-UHFFFAOYSA-N 434.725 4.244 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1C[C@H](C)S[C@@H](C)C1 1707305113 QJHRRCUMULFBPC-OALUTQOASA-N 436.629 4.017 10 10 IICE C[C@H]1C[C@@H](C)CN(C(C)(C)Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)C1 1707959699 OACFVEBSBUQBPQ-KDURUIRLSA-N 436.604 4.372 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cccnc1OC 1708397859 YSMJDGSQJXHOAH-LJQANCHMSA-N 434.588 4.480 10 10 IICE CCOCc1nnc(N2C[C@H](C)S[C@@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1710664510 DKCTWSDTCMMKOB-PMACEKPBSA-N 443.661 4.429 10 10 IICE CCOCc1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1710703371 UAIMPUSSQCJUDW-OAQYLSRUSA-N 443.661 4.289 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1 1728197319 AMDUXJIJFDONFR-GOSISDBHSA-N 434.588 4.115 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)C[C@H]1CCCOC1 1742141501 ILAXCVBZXJAMIX-HXUWFJFHSA-N 439.629 4.216 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)OC(C)(C)C1 1748379966 HSIMJFJUISXDJF-OALUTQOASA-N 437.588 4.391 10 10 IICE C[C@@H]1CC[C@H](Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)C1 1752074577 NVBPGTLWJCXIGL-CTNGQTDRSA-N 425.621 4.485 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCSC1 1763497760 FDFMKKLGUHBNOW-CTNGQTDRSA-N 443.661 4.408 10 10 IICE CCC[C@H](Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)OC 1765581791 SOSZNXYVCAVEFD-SFHLNBCPSA-N 430.593 4.354 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C3(C)CC3)c(N)c2I)c(O)c1 2079021729 HSIKIMXKXIUIFM-OAHLLOKOSA-N 425.314 4.381 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1csc(=NCc2ccc(Br)cc2O)[nH]1 2082941213 DKLWIPAMYMTABG-SNVBAGLBSA-N 428.352 4.231 10 10 IICE [N-]=[N+]=N[C@H]1CCCN(C(=O)CC[C@H](NC(=O)OCc2ccccc2)C(F)(F)F)CC1 2180964067 RQBBVNHIKRSLER-HOTGVXAUSA-N 427.427 4.315 10 10 IICE COc1ccc(C=C2SC(N3CCN(c4ccc(C)c(Cl)c4)CC3)=NC2=O)cc1 2293311854 RZSAILVNZYEOAA-UHFFFAOYSA-N 427.957 4.450 10 10 IICE O=C(c1cn(Cc2ccccc2)cc2c(=O)n(-c3ccccc3)nc1-2)N1CCc2ccccc21 9661642 YFWMQNJTLSVLTA-UHFFFAOYSA-N 446.510 4.390 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ncc(-c3ccccc3)cn2)C1 436036271 GEYKCJCDIXIJAR-UHFFFAOYSA-N 439.563 4.181 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)[C@@H]2OCCc3sccc32)C1 561835432 MOPBNBGWPFAYEM-GKVSMKOHSA-N 437.609 4.288 10 10 IICE CCC(C)(C)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 752222259 JYNIGGAWFSNCEK-UHFFFAOYSA-N 427.564 4.474 10 10 IICE Cc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1[C@@H](C)C1CC1 752842619 WKXDNHKAMRAJFY-BBWFWOEESA-N 429.540 4.237 10 10 IICE O=C(CCC(=O)c1ccc(F)c(F)c1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 755292394 ODXKATQGKITDGI-UHFFFAOYSA-N 438.421 4.314 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)c1O 769508651 ZYGPQLPSPPLMKK-XPGWFJOJSA-N 442.943 4.144 10 10 IICE C[C@H](N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1)c1ccc(N2CCOCC2)c(F)c1 773105033 QEAIAUHQZSKMIV-IUZBSBKLSA-N 449.929 4.077 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2ncc(Br)s2)C1 774198543 BNFPQHXSEORJJK-UHFFFAOYSA-N 448.386 4.370 10 10 IICE COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1nc(-c2cccc(Cl)c2)cs1 795604115 BLSHMEDOKYBGPP-UHFFFAOYSA-N 425.875 4.181 10 10 IICE COc1ccc(OCc2nc(CNCc3cc(Br)ccc3O)cs2)cc1 809712950 HHXHZQMHHQRBIN-UHFFFAOYSA-N 435.343 4.489 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C(F)F)nc2n1CCCC2 1126581490 GEPORKMRVGYLQR-CYBMUJFWSA-N 440.441 4.157 10 10 IICE Cc1ccc(C)c(C2=NO[C@H](C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2)c1 1126657524 JLTIFDFQRKGNCY-VGSWGCGISA-N 443.494 4.183 10 10 IICE CC(C)O[C@H]1CCCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1130762857 DJOYWNWNQJKCDL-YSKWHIJTSA-N 438.640 4.146 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1Cc2c(C)cccc2N1C(=O)OC(C)(C)C 1140198389 BNEJPBLMPXUAKW-GOSISDBHSA-N 431.529 4.169 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@]1(c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1146198593 XOGBAASZACHPIJ-SANMLTNESA-N 437.584 4.256 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(C(C)(C)C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1175397886 JBIBNRYDBOITFQ-QFIPXVFZSA-N 431.537 4.252 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4cccc(F)c4F)CCCC3)CC2)cc1F 1226270954 PJEKJJHETQBBDV-UHFFFAOYSA-N 447.501 4.456 10 10 IICE CC[C@@H](c1cccc(OC)c1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251750896 QDBWURZJXHWGLO-NRFANRHFSA-N 433.499 4.103 10 10 IICE CC[C@H](C)c1nnc(N(C)CCCc2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1291456135 KKZZJVAAEJXUEA-NRFANRHFSA-N 448.615 4.141 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(Br)ccc(C)c3[nH]2)cc1 1300279898 KZPSWJOPWARCSA-UHFFFAOYSA-N 430.346 4.456 10 10 IICE Cc1cc(C(=O)N2CCC(Cc3ncon3)CC2)c(C)n1-c1ccccc1Br 1303860505 BYBXFLRUKSOVFX-UHFFFAOYSA-N 443.345 4.335 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1316172494 LEPHISUVSSCJET-RTWAWAEBSA-N 441.620 4.133 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)c3cccc(Br)c3)cc2F)CC1 1435072871 DFGPIWNHVPXPMU-INIZCTEOSA-N 448.380 4.150 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cccn(CC(F)(F)F)c3=O)cc2Cl)C1 1459574741 HPSDMLXGYDOYGP-CQSZACIVSA-N 441.881 4.230 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C[C@H](O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1465805639 OTDHYUKKAGGQHS-XOBRGWDASA-N 442.357 4.494 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccncc3OC[C@H]3CCOC3)c2C)c1 1468628642 AHAVNYUQTIKREK-NRFANRHFSA-N 433.552 4.451 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)cc1 1470218058 RPYXDNWHANUHGO-HXOBKFHXSA-N 438.568 4.275 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CNC(=O)NCc1cc(Cl)ccc1O 1479206859 JJMSKSUPMSRRSK-IBGZPJMESA-N 445.947 4.207 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)cc1C 1502137379 KMFNHKTUJRKUKP-JOCHJYFZSA-N 439.629 4.358 10 10 IICE COC[C@@H]1CCN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)C1 1504698075 BOTOMPDSOYSNRB-GOSISDBHSA-N 443.642 4.289 10 10 IICE Cc1nnc(CCn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1511745072 CAFBCSJTVQHXDU-UHFFFAOYSA-N 439.633 4.116 10 10 IICE CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1524246249 XMZZVMPCEWYQIU-QUCCMNQESA-N 449.039 4.270 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1524704387 QHBOORMPUYWKPL-HKUYNNGSSA-N 432.008 4.374 10 10 IICE O=C(/C=C/Sc1cc(F)ccc1F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524851557 XZKSZVIEBZUSTI-FPYGCLRLSA-N 426.435 4.002 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@H](C)[C@H]2C(=O)OC(C)(C)C)CCCC1 1526122693 SNXDKTPLDGDGLY-OSPHWJPCSA-N 440.584 4.498 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ncc(F)cc2Br)CCCC1 1528639047 JPGGHLBZUWYQQL-UHFFFAOYSA-N 432.293 4.464 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCC[C@H](OC)C2)cc1 1547449406 VWMFCJMISUELSY-QFIPXVFZSA-N 439.629 4.440 10 10 IICE COc1ccc(-c2nnc(N(C)C[C@H]3CCCO3)n2CCCSc2nccs2)cc1 1554834303 HZRYZZAGPNTIGU-GOSISDBHSA-N 445.614 4.208 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1[C@H]2c3cccc(Br)c3C[C@H]21 1556481699 YUVBPNZXXWJESY-UHOFOFEASA-N 437.131 4.119 10 10 IICE Cc1cc([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)c1=O 1559388317 GTBWWUYIXKIBJR-UHFFFAOYSA-N 433.386 4.374 10 10 IICE COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1565273175 OTOSGGOTAXYVJV-RDPSFJRHSA-N 436.600 4.130 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)CC(=O)c3ccc(Cl)cc3)cc2F)CC1 1565645128 RPOHIGDUZSIDAH-QGZVFWFLSA-N 445.966 4.146 10 10 IICE O=C(NCc1cccc(O)c1O)c1ccccc1C(=O)c1ccc(Br)cc1 1593739702 TWQFKLHVORGHSD-UHFFFAOYSA-N 426.266 4.021 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCCS(=O)(=O)C[C@H]2c2ccccc2)c1C 1598117502 XDUVNWKGVDFOPV-DEOSSOPVSA-N 436.577 4.405 10 10 IICE CC(C)(O)c1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1616765197 NXLURJRTOKKKPS-LDADJPATSA-N 444.553 4.283 10 10 IICE COCCN(c1nnc(C(C)C)n1Cc1ccc2c(c1)CCCN2C)[C@@H]1CC[C@@H](C)C1 1619885343 FURNIJIHZUEHLQ-DENIHFKCSA-N 425.621 4.474 10 10 IICE Cc1nc2ccc(O)cc2cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634629 DNLRBEHWTBPFLQ-GOSISDBHSA-N 425.916 4.002 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn(-c2ccc(Br)cc2)nc1C 1627026644 RMHQSKYTFCUFLH-UHFFFAOYSA-N 435.318 4.065 10 10 IICE CCCOc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1OCCC 1630202281 RVJLVAFLZJWQKN-UHFFFAOYSA-N 430.520 4.374 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1-n1c(C)cc(C=O)c1C 1630288425 WHANDVFOSWEKNU-UHFFFAOYSA-N 445.563 4.106 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3ccccc3Cl)CC2)cc1 1631067356 HSGWJMFTMIKQEU-UHFFFAOYSA-N 449.982 4.447 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-c2cccc(Cl)c2)on1 1631531424 QYUDKIGHCISYPJ-UHFFFAOYSA-N 435.263 4.169 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CSC(c4ccccc4O)=N3)cc2Cl)C1 1635125824 HUQDKFHGIYRUAM-BEFAXECRSA-N 444.000 4.460 10 10 IICE O=C(NCCc1c[nH]c2c(Cl)cccc12)N(Cc1ccccc1O)C[C@H]1CCCO1 1637394500 OCGQZRMQJSJSKV-GOSISDBHSA-N 427.932 4.460 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@H](C(=O)NCc2cccc(Br)c2O)CC1=O 1640083611 DVUNNTOBAUMQEA-GOEBONIOSA-N 445.357 4.338 10 10 IICE CC(C)CNC(=O)c1ccccc1NC(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1642088866 AILVBUXJGCJYDX-UHFFFAOYSA-N 449.473 4.362 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4F)C3=O)c2C)cc1 1643679329 RWNZUTNVDFCTQL-VWLOTQADSA-N 433.483 4.192 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1cccc(F)c1)C1CCC1 1683018138 GEOWBNFSFPMDGS-UHFFFAOYSA-N 433.474 4.205 10 10 IICE CC(C)Cc1nnc(N2CCN(C3CCCC3)CC2)n1CCCSc1nccs1 1692221875 IEEFASBUVYNSHT-UHFFFAOYSA-N 434.679 4.180 10 10 IICE COCCC1(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)CCC1 1697946857 RHBLGNBMDPLOOE-UHFFFAOYSA-N 441.601 4.183 10 10 IICE Cc1cc(-c2nnc(N3CCC(F)(F)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1742118366 BTHANGZGUJWSGS-UHFFFAOYSA-N 429.515 4.359 10 10 IICE CC[C@H](C)c1nnc(N(C)CCc2cccs2)n1Cc1ccc(N2CCOCC2)cc1 1743582645 HBCNWVLGPNZEEE-IBGZPJMESA-N 439.629 4.417 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC(C)(F)F 1743751932 OTNLDBXNAOEJGT-OAHLLOKOSA-N 425.499 4.311 10 10 IICE Cc1nccn1CCCn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1751808229 KNEXJTHABYDVAK-UHFFFAOYSA-N 435.620 4.308 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCOc1ncccc1Cl 1762865596 PQHSYTYFNXYJHE-UHFFFAOYSA-N 440.979 4.205 10 10 IICE CCO[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1767705128 ZSXBSJNIIVKULC-NRFANRHFSA-N 443.661 4.182 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@H](O)CC3(CCCC3)C2)cc1F 1768496175 AOQBELUZVZLIFR-LJQANCHMSA-N 443.611 4.252 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1771171897 HSAQIFPEFJWZLD-ZWKOTPCHSA-N 447.599 4.128 10 10 IICE Oc1ccc(Br)cc1CN[C@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878709448 GTGVAUBNVLJYDN-IRXDYDNUSA-N 429.280 4.307 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1C[C@@H]2NCc1cc(Cl)cc(Br)c1O 1912301861 IUZCTXIIMQIOOS-ZLDLUXBVSA-N 431.758 4.296 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1O 2236055250 OVLBVEFVJKAFDC-CYBMUJFWSA-N 443.382 4.289 10 10 IICE CC(C)(C)OC(=O)Nc1cc(OCCNCc2c(O)cccc2Br)ccn1 2240557185 VNDLGCBQFWFPMG-UHFFFAOYSA-N 438.322 4.065 10 10 IICE C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)SC1=S 2297480323 OZHAEYSYUMWGOQ-QMMMGPOBSA-N 438.870 4.183 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CCCCCC(=O)OC)C2=O)cc1OCC 2314754203 MXPLSKIXLIIUCY-UHFFFAOYSA-N 437.583 4.419 10 10 IICE COC(=O)[C@H](C)N1C(=O)/C(=C/c2cn(Cc3ccccc3)c3ccccc23)SC1=S 1810228 OMVRTSWSEVCNQD-DKNZLLBESA-N 436.558 4.452 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1Cl)N2)N1CCOCC1 20700325 VPUUIAYDDUFWLK-YVHKJVDXSA-N 430.957 4.187 10 10 IICE CCCCN1C(=O)/C(=C\c2c(N(CCC)CCC)nc3ccccn3c2=O)SC1=S 34367838 DKFZRSRQVNWBNZ-BMRADRMJSA-N 444.626 4.322 10 10 IICE COC(=O)c1ccccc1N1C(=O)/C(=C/C=C\c2ccccc2[N+](=O)[O-])SC1=S 210228289 NFDLTKWKBVXEFR-CLAOVGSUSA-N 426.475 4.343 10 10 IICE O=C(C[C@@H]1CCOc2ccccc21)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 735431021 OTWJPPHOCJREDX-INIZCTEOSA-N 434.458 4.115 10 10 IICE COc1cccc(F)c1[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 741988989 MLKCYHJEONMBON-GFCCVEGCSA-N 448.406 4.009 10 10 IICE COc1ccc(N2CCCN(C(=O)CSCc3cc(-c4cccs4)on3)CC2)cc1 747124647 WHCQDGKLVSTIFJ-UHFFFAOYSA-N 443.594 4.384 10 10 IICE C[C@@H]1CC[C@@]2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)C2)C1 781796496 KXXSAVREYMHPFQ-IIBYNOLFSA-N 425.495 4.264 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1ncc(Cc2ccc(F)cc2)s1 916671247 JOZLRKNUHNQHTH-UHFFFAOYSA-N 444.507 4.170 10 10 IICE Cc1ccc(-n2ncc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2C(C)C)cc1 1134681576 ASLBQCJRVFDHHI-DEOSSOPVSA-N 433.600 4.403 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1sc(-c2ccc(OC)c(OC)c2)nc1C 1140198914 XZSRHTQPMFNZNI-UHFFFAOYSA-N 433.526 4.257 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCc3cccnc32)c(C)n1-c1ccc(Br)cn1 1143620048 KJLKJUJLGFCRKG-INIZCTEOSA-N 425.330 4.106 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1nnn(-c2cccc(F)c2)c1C(F)(F)F 1157041751 MGWXCEFTHHJXTA-UHFFFAOYSA-N 430.361 4.214 10 10 IICE COc1ccc(N(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)Cc2ccccc2)cc1OC 1177021627 CGKPZQDLKQWNMU-UHFFFAOYSA-N 447.491 4.208 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2CCCC(C)C)c(C)n1-c1ccccc1 1289353163 LULJHNZZPMZMSV-SFHVURJKSA-N 436.604 4.489 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](C)O[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1291692398 JMEJNSITAUZYHA-QRVBRYPASA-N 429.634 4.007 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)c1 1292911010 RERZHNPHPMSDHF-UHFFFAOYSA-N 447.510 4.034 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2CCC3(CCC3)CO2)NC(=O)OC(C)(C)C)cc1 1293802421 RZRXCVNVYQHDSK-SFTDATJTSA-N 445.604 4.174 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1 1296626671 XVPJTGRWMYRGMB-NHCUHLMSSA-N 439.556 4.472 10 10 IICE CC[C@H](C)c1nnc(N2CCOC(C)(C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1305551780 HRQPMUDJPJIUOD-OALUTQOASA-N 443.661 4.397 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@H]1CN(Cc2ccccc2)CCCO1 1307500259 SKHDVXLDVYBSFG-NRFANRHFSA-N 433.390 4.268 10 10 IICE Cc1cc(NC(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)n(C(C)(C)C)n1 1307529991 SOGVHSVQQMUBNO-UHFFFAOYSA-N 440.569 4.425 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1CCC1CC(OC(C)(C)C)C1 1314751272 RFXIEPUPBYCRMH-UHFFFAOYSA-N 436.560 4.061 10 10 IICE COc1cc(Br)ccc1[C@@H](C)NCc1ccc(N2CCN(C)CC2)c(F)c1 1343413153 APBKFXWMUNOZKR-OAHLLOKOSA-N 436.369 4.199 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2cc(COC(C)(C)C)on2)CCCC1 1435957135 KPYKKVPVXHQSAH-UHFFFAOYSA-N 425.529 4.148 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C(F)(F)Oc2ccc(C=O)cc2)cc1 1452604591 ANJQONBKXGVPKJ-UHFFFAOYSA-N 430.373 4.128 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@H]3CC(=O)NC(=O)N3)cc2)c(C)n1-c1ccc(Cl)cc1 1453976493 KDVLGUVKUBWAGR-HXUWFJFHSA-N 436.899 4.270 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Nc2cnccn2)c1 1464697704 QYMMOMWYHRPNMT-UHFFFAOYSA-N 439.466 4.220 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc2n[nH]cc12 1466558345 OKCWZGYHVISNRD-GIJQJNRQSA-N 440.525 4.240 10 10 IICE Cc1cc(C)cc(C2=CCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CC2)c1 1471368988 FRRIMHKZKKSTFB-UHFFFAOYSA-N 446.595 4.004 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@]2(C)CCCO)sc(C)c1-c1ccccc1 1473282975 WKWRNLGRKUIIFA-XMMPIXPASA-N 444.597 4.466 10 10 IICE CC(C)(C)Cc1nnc(N2CC[C@H]([C@@H]3CCOC3)C2)n1CCCSc1nccs1 1508556099 BWPQWBCHSANIAU-DLBZAZTESA-N 435.663 4.368 10 10 IICE Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1538429160 HBRAKIRMYSJHGL-UHFFFAOYSA-N 430.552 4.219 10 10 IICE CCN(CC(N)=O)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CCC2 1543983718 OJNZUORAVYZFHP-MNDPQUGUSA-N 442.563 4.125 10 10 IICE CCOc1nc(NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)ncc1Cl 1559184048 SLHYPBBNZSISCW-QGZVFWFLSA-N 435.956 4.273 10 10 IICE CC(C)[C@H](Cc1ccc(F)cc1)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559705114 HLJNTXFTTHIRFM-QHCPKHFHSA-N 444.506 4.397 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](CCc3ccccc3)c3ccccn3)CC2)cc1F 1565213744 XYIFNLRDCVDSOD-DEOSSOPVSA-N 448.542 4.435 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](NC(=O)OC(C)(C)C)c2ccc(F)cc2F)c1 1566374762 SRWQYMKACIDWMC-CWTRNNRKSA-N 436.455 4.122 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)N3CCc4cc(Br)ccc43)ccnc21 1566573873 YLCFKEPPRKEKIK-UHFFFAOYSA-N 444.329 4.345 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2C)cc1 1567596455 MDDUXZXZBJDWQY-RUZDIDTESA-N 447.579 4.124 10 10 IICE CCc1c(C(=O)N(C)CCN(C)c2ccc(OC)cc2)cnn1-c1ccccc1Cl 1583622810 VPTRNILWDKNZPU-UHFFFAOYSA-N 426.948 4.305 10 10 IICE CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)N[C@H](C)c3ccccc3O)cc2)cc1 1587444503 HHLIMPCOZLZOTR-MRXNPFEDSA-N 440.521 4.083 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Br)c1F 1595584479 NMJFREUPPFLIJK-AWEZNQCLSA-N 441.728 4.342 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](OC)C(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1613206824 JPKQNTVPUJRACY-RXVVDRJESA-N 443.661 4.254 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCc4cc(Cl)cc(Cl)c4[C@H]3C)nc12 1615811696 KJRMUTVGXVHPAH-LLVKDONJSA-N 435.311 4.038 10 10 IICE CCCc1ccc([C@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(C)C)cc1 1616506640 WAAMDJLIMIIJAD-AREMUKBSSA-N 441.591 4.218 10 10 IICE CCCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccccc1C 1616858014 DNPIUHNLPDIUFC-VWLOTQADSA-N 433.600 4.232 10 10 IICE COc1ccccc1N1CC[C@@H](NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1=O 1622888798 ZXTMZHMWWVAAOP-JOCHJYFZSA-N 431.536 4.255 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2CCNS(C)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1625119847 VKZMLLPBXAQRMP-OAQYLSRUSA-N 445.629 4.152 10 10 IICE CN1CCN(c2ccc(CNC(=O)C(C)(C)Cc3ccc(C(F)(F)F)cc3)cc2)CC1 1625146312 YQOMINIJPDORRS-UHFFFAOYSA-N 433.518 4.342 10 10 IICE O=C(COc1ccc(C(F)(F)F)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257205 QUQCNALJPJORNG-QGZVFWFLSA-N 442.865 4.224 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@]2(c3ccccc3)CCN(C(=O)OC(C)(C)C)C2)c1 1630365689 DCTYQYQKOXCCBE-CRICUBBOSA-N 440.540 4.157 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C/C=C(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1634161693 BYOCUCPTWOQZGU-IQIBNGDESA-N 428.360 4.310 10 10 IICE COc1ccc(CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(Br)c1 1636951132 PNPOLOZXVNPXMU-LJQANCHMSA-N 448.357 4.304 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c(N)c1F 1637239929 NSOQZNNMYARYNM-UHFFFAOYSA-N 448.542 4.034 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccncc3OCCCN(C)C)c2C)c1 1682846210 CXWUWIKVCLJFRX-UHFFFAOYSA-N 449.599 4.127 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](C)c1ccc(N2CCCOC2=O)cc1 1682890130 VCHMZDHLPZSYND-OALUTQOASA-N 438.572 4.399 10 10 IICE Cc1cc(C)cc(C2CCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CC2)c1 1684174287 CVFOXNMRFZXPGG-UHFFFAOYSA-N 448.611 4.094 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)c3cccc(F)c3)CC2)c(C)n1-c1ccccc1 1684478553 BFGGWUVREBGLKB-UHFFFAOYSA-N 448.542 4.291 10 10 IICE CC(C)Cc1nnc(N2CCS[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1706433417 VGFCBOXDOFFYHR-SFHVURJKSA-N 431.675 4.020 10 10 IICE CCC(CC)(Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1708676071 DVDAQMKUYCSEAD-UHFFFAOYSA-N 441.620 4.224 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1710596215 WWSAPZJQFLAJLU-LEWJYISDSA-N 431.600 4.370 10 10 IICE CC(C)(C)[C@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CCO1 1722925459 IKJIFVFCISJUPZ-HZPDHXFCSA-N 437.635 4.020 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCSC1 1763497761 FDFMKKLGUHBNOW-FPOVZHCZSA-N 443.661 4.408 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CC[C@H](C)[C@H]2C)cc1 1764941210 GVOIGQRXCRISRK-QRICJDHISA-N 441.620 4.131 10 10 IICE COc1ccc(C(=O)c2ccccc2NS(=O)(=O)c2cc(C)c(C)cc2OC)cc1 1858035066 ISRXOIUUVMZUNT-UHFFFAOYSA-N 425.506 4.352 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Cc3ccncc3)c3ccc(Cl)cc3)CC2)cc1 1858086244 CYHHQZZFQHQKLG-DEOSSOPVSA-N 435.955 4.419 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)cc1Br 2188882059 DIGWJFYXHGJLDC-NQIIRXRSSA-N 427.342 4.258 10 10 IICE Cn1c(C=C2C(=O)NC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)cc2ccccc21 2296033263 XVYGQSXUKIVGNV-UHFFFAOYSA-N 429.423 4.028 10 10 IICE CN(C)c1ccc(C=C2SC(N3CCN(c4ccc(Cl)cc4)CC3)=NC2=O)cc1 2296441501 ZYBFYKHJPZCCGZ-UHFFFAOYSA-N 426.973 4.199 10 10 IICE COc1cc(C=C2SC(=S)N([C@H](C)c3ccccc3)C2=O)ccc1OCC(=O)O 2314931866 INJLIPSNLTZWDJ-CYBMUJFWSA-N 429.519 4.121 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@@H]3C=CC[C@@H]32)cc1O 14457158 ZOVVGTLONBBCFS-JLHGSKIFSA-N 428.554 4.304 10 10 IICE CCOc1cc(/C=C2/SC(Nc3cccc(F)c3)=NC2=O)ccc1OCCC(=O)O 16920112 IJZRNBJHWPJPJR-WOJGMQOQSA-N 430.457 4.160 10 10 IICE O=S(=O)(c1ccccc1)N(c1ccc(F)cc1)C1CCN(Cc2ccccc2O)CC1 34683911 ANLISRYXQTUBAJ-UHFFFAOYSA-N 440.540 4.391 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 47152178 VIVKIEGGOFFUAB-ATVHPVEESA-N 427.507 4.133 10 10 IICE CC(C)(C)OC(=O)N1CCc2n[nH]c(C(=O)N(c3ccccc3)c3ccc(N)cc3)c2C1 170237914 DLJYUDBYUZLBTL-UHFFFAOYSA-N 433.512 4.264 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccccc4)nc4onc(C)c34)CC2)cc1 606673603 HPQYXNHQTZKENK-UHFFFAOYSA-N 428.492 4.169 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 725884325 XPWYOIPVWVJRMN-HXUWFJFHSA-N 431.305 4.459 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)c3ccccc3)ccc21 727309230 FWZVIRPPCZYVFR-HVCNVCAESA-N 431.580 4.159 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H](C(=O)N3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 732176195 QELVWEYHHPZLNV-IBGZPJMESA-N 427.976 4.151 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3cc4ccccc4o3)n2)cc1 753978679 SWCNOMDPMMMPQK-UHFFFAOYSA-N 441.534 4.036 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(OC)c(OC)cc1NC(=O)[C@H]1C[C@H]1C 764894383 GSTAFOUYAVQTRM-APWZRJJASA-N 439.556 4.027 10 10 IICE COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 795548873 PGKHDQNEAKUVKG-UHFFFAOYSA-N 444.321 4.099 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]([C@H](O)C(F)(F)F)C3)cc2Cl)C1 799994542 CUTPJOMXJVPAHM-ALKREAHSSA-N 447.929 4.421 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](C(=O)N4CCCC4)C3)cc2Cl)C1 800719793 NPLAQKJGAXHRFP-UYAOXDASSA-N 447.023 4.120 10 10 IICE Cc1nc([C@H]2CCCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 814679476 GPWLYBFKRDJICR-FPOVZHCZSA-N 443.613 4.233 10 10 IICE CCN(C)Cc1cc(O[C@@H]2CCN(Cc3ccc(OCc4ccccc4)cc3O)C2)ccn1 856550816 HUQCSQJTFBPFGY-AREMUKBSSA-N 447.579 4.471 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)COC(=O)c3csc(-c4ncccn4)n3)c2C)c1 920530696 HKHBVQDQUKFYFV-UHFFFAOYSA-N 432.505 4.356 10 10 IICE Cc1ccc(C(=O)c2ccccc2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1167763321 ZWRLJAYRKMKBEP-UHFFFAOYSA-N 428.532 4.117 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c[nH]nc4c3)cc2Cl)C1 1227209378 UHJMDUOMZJBUOP-INIZCTEOSA-N 425.964 4.495 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2cccnc2OCC(F)(F)F)CCCC1 1264491792 PZFBIYJTVFYLHF-UHFFFAOYSA-N 447.457 4.181 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC(OCc2ccccc2)C1 1265564072 BDDLPZYDPHJNKT-LVIWNVNYSA-N 430.495 4.368 10 10 IICE CC(C)Cc1nnc(N2CCC(Cn3cccn3)CC2)n1CCCSc1nccs1 1287412149 WQEVIDUJTQCLPY-UHFFFAOYSA-N 445.662 4.229 10 10 IICE CCCCCNC(=O)C1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1290937182 OZJIUBNFZBLMRW-UHFFFAOYSA-N 437.584 4.374 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(-n3ccnn3)c2)cc1 1293125402 KYFVGHJXQLDXMV-UHFFFAOYSA-N 427.508 4.189 10 10 IICE CC(=O)N(C)C1CCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CC1 1301638725 VRSTVMDHUCNONW-UHFFFAOYSA-N 448.662 4.022 10 10 IICE CC(C)(C)c1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1302050365 FLCPSTHZPGXOHE-HXUWFJFHSA-N 425.621 4.333 10 10 IICE Cc1cc([C@@H](CC(=O)N2Cc3cccc(O)c3C2)NC(=O)OC(C)(C)C)cc(Cl)n1 1302786313 HOZOHKFUBNCGCT-QGZVFWFLSA-N 431.920 4.247 10 10 IICE Cc1cccnc1[C@@H](C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1305303907 FWJORZIBQJWPRD-RGHBXIHOSA-N 431.608 4.310 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CCO1 1305882339 AMAZTVLJNHUNEV-CLOONOSVSA-N 437.588 4.393 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1CC 1306666231 ZJILFELPSFJYLB-UHFFFAOYSA-N 432.576 4.249 10 10 IICE COC(=O)/C=C/c1ccc(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c([N+](=O)[O-])c1 1306983327 WZGAVASGRQAMAC-QHQPLOKBSA-N 447.438 4.463 10 10 IICE COC(=O)CC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1312591563 XXAMYICJEVDOBW-QZTJIDSGSA-N 435.996 4.451 10 10 IICE CCOCc1nnc(N2Cc3ccoc3CC(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1314324426 LXCMBIFRBYNDSH-UHFFFAOYSA-N 441.551 4.250 10 10 IICE Cc1cccc([C@H](CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)N2CCOCC2)c1 1350300782 AYKNZLWPASSZEO-SANMLTNESA-N 431.580 4.135 10 10 IICE C[C@H](Cc1ccccc1F)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1351274661 IVEPQNSINZAGBQ-NFECSFHCSA-N 446.544 4.304 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(OCCCN(C)C)cc2)C1 1353093526 QTDXXXNBZJWPKB-UHFFFAOYSA-N 448.611 4.377 10 10 IICE CC(C)c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359677911 RIEBZWSAEAEHRW-UHFFFAOYSA-N 425.621 4.427 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCCOc3cc(C)ccc3C)cc2F)CC1 1435076890 SJCYCQDTZBTDTF-UHFFFAOYSA-N 441.591 4.450 10 10 IICE CC(C)(C)OC(=O)N1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1441627309 BCKCQAUDSJPSMI-HXUWFJFHSA-N 433.618 4.036 10 10 IICE CCS(=O)(=O)NCCSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 1472929550 ZNBYQPHMSAZAOC-UHFFFAOYSA-N 436.002 4.283 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](O)c2c(F)cccc2Cl)c(C)n1-c1ccccc1 1479064524 RFYJFQAXPMIODV-OAQYLSRUSA-N 429.923 4.462 10 10 IICE Cc1cccc(-c2nnc(N(C)C[C@@H]3CCCOC3)n2CCCSc2nccs2)n1 1511091534 YKMKCFYPOBCSLI-KRWDZBQOSA-N 444.630 4.150 10 10 IICE CO[C@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C1CCCC1 1530035430 FVCDHGJPRDTSAX-WISAJEAXSA-N 438.640 4.051 10 10 IICE CC[C@H](Oc1cccc(C)c1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1534123147 FVBWRZLGXJULPI-NRFANRHFSA-N 436.474 4.324 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1nccc2c(Br)cccc12 1540536566 JJJUFIPRYUMQSN-UHFFFAOYSA-N 440.341 4.106 10 10 IICE CCS(=O)(=O)Nc1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1C 1543332385 KECIUOOQDXWSQL-UHFFFAOYSA-N 439.537 4.229 10 10 IICE CCSc1ccc(Cl)cc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 1544314697 DYRUPQINXXICKD-UHFFFAOYSA-N 434.005 4.013 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(Cc2ccccc2)C[C@@]2(O)CCc3ccccc32)cc1 1546015513 CFIAHROSMFCMQM-VWLOTQADSA-N 428.492 4.325 10 10 IICE COCCN(c1nnc(-c2ccccn2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@@H](C)C1 1555537010 WWBHATSPRIHELP-XXBNENTESA-N 448.615 4.404 10 10 IICE Cc1cc(CC(=O)NC[C@H](CO)Cc2ccc(F)cc2)c(C)n1-c1ccc(Cl)cc1 1566384991 IDINLEBGBSOFEB-LJQANCHMSA-N 428.935 4.397 10 10 IICE C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1583318312 JTOXFNTUFBCNOV-RYUDHWBXSA-N 446.381 4.173 10 10 IICE C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1586054828 OTRDSFGVOZHPHA-DFBJGRDBSA-N 446.595 4.330 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cc(C(F)(F)F)no1 1586326476 SIVQFSYOZAQTCB-YFHOEESVSA-N 447.485 4.375 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Br)c1F 1595584482 NMJFREUPPFLIJK-CQSZACIVSA-N 441.728 4.342 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N(C)CCCc1ccccn1 1611963330 NFAKJOYWOQKXGF-JOCHJYFZSA-N 448.615 4.059 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3cc(Cl)ccc3Br)CC2)cc1 1623430215 VHZOUXIOVWWUAW-UHFFFAOYSA-N 437.765 4.393 10 10 IICE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(O)n1 1624955343 XQJFCPJRZDGADT-HNNXBMFYSA-N 447.535 4.490 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(F)c(N3CCOC3=O)c2)cc1 1626765920 CBGAQGSZQXUWDA-UHFFFAOYSA-N 435.455 4.184 10 10 IICE O=C(Nc1ccc(=O)n(Cc2ccccc2Cl)c1)c1cc2cc(O)c(O)cc2s1 1630855290 YPYMACOEYNFUTE-UHFFFAOYSA-N 426.881 4.428 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2c(F)cccc2F)no1 1631425907 RSRKAGWOEKMLKD-OAHLLOKOSA-N 447.869 4.373 10 10 IICE CCCO[C@@H](C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O)c1ccc(F)cc1C 1637247643 RFTZHABQCZJIIM-OAQYLSRUSA-N 437.895 4.163 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c1 1639618535 ZNADPWWBXLKDNG-SFTDATJTSA-N 439.556 4.328 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 1642997888 QTEJYFKCRFLSDT-XMSQKQJNSA-N 425.573 4.374 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CCC2(C)C)c(C)n1-c1ccccn1 1649090257 MWXGSCYGZSBCHE-UHFFFAOYSA-N 426.561 4.351 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cccc([N+](=O)[O-])c1 1653056943 SERFDGQHEOONQQ-LSDHHAIUSA-N 443.459 4.048 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](c3ccccc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1653592779 IWYWFXHJIOSQEG-RRQZXNHTSA-N 441.591 4.433 10 10 IICE Cc1cccc([C@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccn2)c1 1679703671 UFAVQRSAJKJVJK-RPBOFIJWSA-N 431.584 4.148 10 10 IICE COC(=O)[C@]12CCC[C@H]1N(C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)CC2 1682023937 MXFMTENJZYMMBT-LQNXUBFPSA-N 433.980 4.204 10 10 IICE C[C@H]1CC[C@@H](C)N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1693607259 PYLAMPQZPOHLAB-ZWKOTPCHSA-N 429.584 4.224 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1C[C@@H](C)S[C@H](C)C1 1707305114 QJHRRCUMULFBPC-RTBURBONSA-N 436.629 4.017 10 10 IICE Cc1ccc([C@]2(O)CCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)cc1 1707339708 PWJIEACTBLFYFV-QFIPXVFZSA-N 443.642 4.447 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1712726118 KPJOAJZOTLWTOR-YLJYHZDGSA-N 425.602 4.329 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](COC)C1 1728005566 BZCKWUSDXUGSDI-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC[C@@H]1CCCCO1 1760895720 OBEKLNAZWHGIJI-QHCPKHFHSA-N 441.620 4.224 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1769561517 MWLZLCOCOKAQNL-MSOLQXFVSA-N 425.602 4.329 10 10 IICE O=C(O)CCc1sc(NS(=O)(=O)c2ccc(Cl)cc2)nc1-c1cccs1 1858070661 ZUFKKPMXZKBHTI-UHFFFAOYSA-N 428.944 4.343 10 10 IICE CCCC[C@H](C(=O)O)N1C(=O)/C(=C\c2c(Cl)nc3scc(C)n23)SC1=S 1858592362 OXWCSOIXGRUGCA-VKRGWIQLSA-N 429.976 4.202 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@@H](F)CNCc2c(O)cccc2Br)CC1 2106960602 ZILWBFDENRTELN-INIZCTEOSA-N 431.346 4.230 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@]2(NCc2cccc(Br)c2O)C1 2126058764 UUSQEPMGGJIGQE-OALUTQOASA-N 429.330 4.126 10 10 IICE COc1cccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)c1 2296938743 ZAMQTVWRUPEHFR-UHFFFAOYSA-N 429.476 4.078 10 10 IICE Cc1ccc(CN[C@H]2CN(Cc3ccccc3)C[C@@H]2C(F)F)c(O)c1Br 2352952846 QCOVNILGBADWDS-IRXDYDNUSA-N 425.317 4.318 10 10 IICE Cc1ccc([C@H]2Nc3ccc(S(=O)(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@@H]32)s1 14456804 CCSWNPMIFJLQGP-JVGYHMDPSA-N 430.595 4.340 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc(Br)ccc1O)N2 14461310 AICSEQBLSFOIPN-VWKPWSFCSA-N 443.341 4.357 10 10 IICE Cc1ccc2c(c1)N[C@@H](SCC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)N2 59485260 YFJXEAIBNSSEGW-DEOSSOPVSA-N 429.501 4.263 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C/c1cccc(OCc2ccccc2)c1 107095836 QRVRBKSEELOAHB-GQBVICOWSA-N 433.504 4.117 10 10 IICE CCOC(=O)C1=C(C)NC(COCCN=[N+]=[N-])=C(C(=O)OCC)[C@@H]1c1ccccc1Cl 504242587 WGHUZAUDVHLRQX-GOSISDBHSA-N 448.907 4.008 10 10 IICE CO[C@H](C)c1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 726932472 QACUTPRZXZGEDY-CYBMUJFWSA-N 430.416 4.330 10 10 IICE CO[C@@H](C)c1noc(CN(C)C(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1 747933126 JKSBVWSHRVYGTO-AWEZNQCLSA-N 447.333 4.219 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@H]2[C@H]2CNC(=O)C2)c(C)n1-c1ccc(F)c(Cl)c1 764465944 NELXJHDNGDUPMS-IERDGZPVSA-N 431.939 4.060 10 10 IICE COC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802683861 BKXAACMKEVQRTN-JTHBVZDNSA-N 449.599 4.394 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NCc1cc(Br)ccc1O)O[C@@H](C)C2 804734485 NKBIJNZDMFPQSR-IWEFOYFVSA-N 446.341 4.297 10 10 IICE COc1ccc([C@H](NC(=O)NCc2cc(Br)ccc2O)C(F)(F)F)cc1 806434329 IMAUOKBSVJZEPR-HNNXBMFYSA-N 433.224 4.266 10 10 IICE COc1ccc(CCC(=O)N2CCN(Cc3ccc(N4CCCCC4)c(C)c3)CC2)cc1 1167244601 VTHRSYQEFJHCGQ-UHFFFAOYSA-N 435.612 4.271 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)Nc1ccccc1I 1168245058 XPVDKNCDDJTBEF-UHFFFAOYSA-N 436.293 4.081 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3C[C@H](OCc4ccccc4)C3(C)C)C2)cc1 1235188393 WYSJGZKRPIGLEI-QDSKXPNFSA-N 437.584 4.205 10 10 IICE CC(C)CSCCCNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1266261589 RTNCZOPMXVWVPR-ATVHPVEESA-N 440.631 4.313 10 10 IICE C[C@@H]1CCC[C@@H](N(C)c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1291074265 MKJUGOSADVTGRF-YZGWKJHDSA-N 429.584 4.440 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cc(Cl)ccc1O)c1c(F)cccc1F 1300396451 UEKHDZNRIKVHCJ-QGZVFWFLSA-N 426.847 4.206 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1300929618 SQHLBQQQGPVLQI-OAQYLSRUSA-N 437.588 4.250 10 10 IICE CC(C)(C)OC(=O)NCC1([C@H]2CCCCN2C(=O)/C=C\c2ccc(O)c(O)c2)CCC1 1304180617 RUXUYRVABNFMMD-YBNHLDJLSA-N 430.545 4.187 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1306274779 KNHWEJDRMCOHGS-CRAIPNDOSA-N 445.662 4.403 10 10 IICE Cc1cc(C(=O)COc2ccc([N+](=O)[O-])c(F)c2F)c(C)n1-c1ccc2c(c1)OCCO2 1307346206 YCCJHZPJPVRHMN-UHFFFAOYSA-N 444.390 4.313 10 10 IICE COC(=O)C[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1cccs1 1354574602 CJSICILTTWPHCH-SFHVURJKSA-N 426.538 4.011 10 10 IICE O=C(CCCc1c(F)cccc1F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1354783707 COEZPRLHIZYMHX-UHFFFAOYSA-N 442.428 4.459 10 10 IICE COc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)c1OC 1439565574 DQLCTCNWNOUYHI-UHFFFAOYSA-N 435.568 4.050 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1cc(Cl)cc(Cl)c1 1465532372 AVNIUEBGUWFDDC-QAPCUYQASA-N 445.293 4.413 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](CCO)c2ccco2)sc(C)c1-c1ccccc1 1473412135 GMISSPHIKCCUBM-KRWDZBQOSA-N 442.537 4.145 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(O)(CC)CC 1495642008 WKBGTYKPQWMGIO-LJQANCHMSA-N 429.609 4.068 10 10 IICE COc1cc(F)cc(C[C@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1535610104 BYLGMTTYXIZKIE-SFHVURJKSA-N 437.559 4.303 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)s2)c(F)c1 1536532498 PSXBFYUVHKQTRR-UHFFFAOYSA-N 438.572 4.248 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1F 1546149970 AQTFIBACXORKTA-UHFFFAOYSA-N 433.527 4.451 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4c3[C@H](C)CC4(C)C)CC2)cc1 1558473148 RFEAXCMKJYLIKS-SYGIOELKSA-N 447.579 4.324 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(N2CCC(C)CC2)cc1 1566848949 DRLCRGSYKQXPQO-UHFFFAOYSA-N 430.932 4.097 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3sc4cc(C)c(C)cc4c3C)CC2)cc1 1583751794 GYIBIOCAZPCLEX-UHFFFAOYSA-N 437.609 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(I)cc1F 1585263273 AGHOADIHZKQJCA-CYBMUJFWSA-N 440.300 4.166 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCn3cc(Br)cn3)cc2Cl)C1 1586081182 BJLNKCLYYUTMQP-CQSZACIVSA-N 439.785 4.242 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H](F)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1627467754 QAASNZUVWPTVGM-TZIWHRDSSA-N 433.568 4.134 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O 1627806442 ATEJRIUVNHQFKS-XMMPIXPASA-N 429.520 4.174 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@](C(=O)NCc2cc(Cl)ccc2O)(c2ccccc2)C1 1632228531 PIOXKQAXJAXWFK-RXAXNXDRSA-N 430.932 4.287 10 10 IICE CC(C)(C)OC(=O)N1c2cc(O)ccc2C[C@H]1C(=O)NCc1c(O)ccc2ccccc12 1635968466 BEODFFZVEVCLGV-NRFANRHFSA-N 434.492 4.234 10 10 IICE CC(C)CN(CCc1ccccc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635996701 JRKWRRXRMUFMCW-UHFFFAOYSA-N 431.527 4.212 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCN(c4cccc(Cl)c4C)CC3)C2)cc1 1636354129 QZISRVDDZKFOLN-IBGZPJMESA-N 442.991 4.015 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCC[C@@H]3C(C)(C)C)cc2F)C[C@@H](C)O1 1653758528 DJJAFOSOCRSQPF-GXKRZCMTSA-N 433.612 4.250 10 10 IICE CCc1ccc([C@@H](CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)N(CC)CC)cc1 1673207230 BWPNMOXGVFCRRZ-RCZVLFRGSA-N 438.616 4.219 10 10 IICE COc1ccc(CNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2cccc(F)c2)c(O)c1 1673498092 IUXAIPWSBNLIIM-BJKOFHAPSA-N 449.526 4.007 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1679155638 SRTYBFYCLFKQQC-QGZVFWFLSA-N 444.938 4.026 10 10 IICE Cc1cc(CCNC(=O)N2CCC23CN(C(=O)OC(C)(C)C)C3)c(C)n1-c1ccccc1 1683150045 VOGCFISGMOHVQV-UHFFFAOYSA-N 438.572 4.041 10 10 IICE Cc1nnc(CCn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1693447464 RPSIOEHPCUIQEQ-UHFFFAOYSA-N 425.606 4.041 10 10 IICE CN(CC1CCOCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1696767814 AUMOCWWTDWBEDC-UHFFFAOYSA-N 443.661 4.040 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCc3ccccn3)CC2)cc1 1711865248 OELXHXWOKXZRGT-UHFFFAOYSA-N 448.615 4.230 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1765288216 QYZMOIXWFIWTGN-RDPSFJRHSA-N 448.615 4.162 10 10 IICE CCN(c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1766476127 IVSQITUBGJWSPC-FQEVSTJZSA-N 429.634 4.008 10 10 IICE CCOC[C@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768037470 HETLWRUCRGLDDN-IBGZPJMESA-N 443.592 4.047 10 10 IICE COCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1770975731 PQIJVYCBOPEBKE-AREMUKBSSA-N 449.599 4.297 10 10 IICE O=C(N[C@@]1(c2cc(Cl)cc(Br)c2O)C[C@@H]1C(=O)O)OCc1ccccc1 1952821755 SBTKKBYBUNHJNT-FZKQIMNGSA-N 440.677 4.034 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@H](NCc3c(O)cccc3Br)[C@H]2C1 2092936940 OQRNBOIVJVUPIL-QRTARXTBSA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CN[C@]23CCC[C@@H]2CN(C(=O)OC(C)(C)C)C3)c1O 2236055671 QZKKRALGJBZQLQ-XCLFUZPHSA-N 441.366 4.043 10 10 IICE COc1cc(C=C2SC(=S)N([C@@H](C)C(=O)O)C2=O)ccc1OCc1ccccc1C 2293308646 OZVYHFIZDXLQOA-AWEZNQCLSA-N 443.546 4.257 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1 2297341686 RRCYDNLIQKPQRI-UHFFFAOYSA-N 443.843 4.303 10 10 IICE COC(=O)c1cccc(-c2ccc(C=C3C(=O)NN(c4ccc(C)c(Cl)c4)C3=O)o2)c1 2297458289 JQBXCDKXOMOIJS-UHFFFAOYSA-N 436.851 4.156 10 10 IICE Cc1ccc(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)C2CCC2)c(O)c1Br 2380724211 YPLQRJXVWUAAQA-HNNXBMFYSA-N 441.366 4.163 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14460110 PJQPMXCRGSUPTR-YDIMBITNSA-N 435.568 4.299 10 10 IICE C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)/C(=C/C=C/c2ccccc2)SC1=S 47152393 UZXSDVFZPWHSEK-NSGXCFGBSA-N 439.518 4.379 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCc3ccccc3)C2=O)cc([N+](=O)[O-])c1O 101568213 ULWCMAIWTWADCA-SFQUDFHCSA-N 430.507 4.143 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cccc(-c4nc(C)cc(=O)[nH]4)c3)c2C)cc1 108612091 WSPRZLFMRIDMQG-UHFFFAOYSA-N 428.492 4.414 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(O)c(OC)c1)N2 226711504 WYXNXVSMICNEOM-OHUGHZGNSA-N 435.568 4.299 10 10 IICE COc1ccc(Cn2nc(C)c(CNCc3ccc(N4CCSCC4)cc3)c2C)cc1 766413577 PYGIBDSMVVFDQF-UHFFFAOYSA-N 436.625 4.400 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)c1 769529491 CMVROKPTHWFITH-CZAAIQMYSA-N 442.943 4.144 10 10 IICE C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 776173363 RYWRBWNVQIWPAS-DYESRHJHSA-N 438.538 4.091 10 10 IICE COc1cc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc(OC)c1C(C)C 779142316 RYQUTJONWQYHNX-UHFFFAOYSA-N 445.535 4.249 10 10 IICE Cc1cc(Br)c(O)c(CNCC(=O)Nc2ccc(Br)cc2C)c1 781624621 LIOLNRNFFIVMHC-UHFFFAOYSA-N 442.151 4.262 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F 791246604 OYFYVSQQTVCTNW-QUCCMNQESA-N 430.495 4.457 10 10 IICE CC[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(C(F)(F)F)cc1O 810224343 VJLAQYYAPBZFFM-ZVDOUQERSA-N 447.501 4.051 10 10 IICE Cc1ccc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)cc1F 1124951070 DXGUSBKWOIBNFC-HXUWFJFHSA-N 449.526 4.375 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC(C)(C)C(=O)NCC2CCCCC2)CCCC1 1127075331 UCOKEEIORYJJFN-UHFFFAOYSA-N 439.600 4.120 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc4c(Cl)c(Cl)ccc4[nH]3)CC2)cc1 1136454100 KNIYDNILLVWPLK-UHFFFAOYSA-N 447.366 4.035 10 10 IICE Cc1cc(C(=O)N2CC(O)(c3ccc(F)cc3)C2)c(C)n1-c1ccc(Br)cc1 1176998062 RPBIHJQTLMPKQW-UHFFFAOYSA-N 443.316 4.339 10 10 IICE Cc1ccc2[nH]c3c(c2c1)C[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)CC3 1230852150 FMXMIXJZFJLTPE-UQBPGWFLSA-N 433.600 4.002 10 10 IICE Cn1ccnc1[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)c1ccc(F)cc1F 1256217346 KUVCCFSTGRGGJQ-MRXNPFEDSA-N 441.265 4.300 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCCN(c4ccc(C)cc4)C3=O)ccc21 1265516880 NZNDBCUJCPXVFV-QHCPKHFHSA-N 433.552 4.138 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(C)cc3O[C@H]3CCOC3)ccc21 1266122722 PRCHMFOLTBSQOQ-QFIPXVFZSA-N 436.552 4.311 10 10 IICE Cc1cc(CC(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1266756515 SOGXMYPYXHWINF-QUCCMNQESA-N 425.573 4.398 10 10 IICE CCc1nnc(N2CC=C(c3ccc(O)cc3)CC2)n1CCCSc1nccs1 1306110495 MRYZBEJVFVALTL-UHFFFAOYSA-N 427.599 4.479 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(CCc3ccccc3)Cc3ccncc3)C2)cc1 1312995077 RDDCNQJJJFFXPH-QHCPKHFHSA-N 430.552 4.123 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1359830029 CDNXSEOIBFJAAE-IBGZPJMESA-N 429.584 4.127 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@](C)(Cc3ccccc3)C(C)C)cc2F)CC1 1359920166 JWJOMOFGLVGLGL-SANMLTNESA-N 425.592 4.489 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cc(Br)cc(C)c4o3)CC2)cc1 1435579132 ZUCSHZHCKGVBFV-UHFFFAOYSA-N 429.314 4.475 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(F)c3Br)CC2)cc1 1458046213 VGHXOPPJIIHAFW-UHFFFAOYSA-N 427.701 4.213 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C(F)=C/c3ccc(C(F)(F)F)cc3)cc2)C1 1464363657 RPLHWGICMCSSSW-SYERDGIWSA-N 449.448 4.034 10 10 IICE CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)N[C@H](C)c1ccccc1O 1471193928 MUPHTMYNCHQPPV-MRXNPFEDSA-N 444.487 4.078 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCCC[C@@H]1Cc1ccccc1F 1478786069 IGSLAQPUKIPCRR-LJQANCHMSA-N 447.501 4.247 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cccc(C(F)(F)F)n1 1511777194 UWMGGXUEGYFORM-UHFFFAOYSA-N 430.478 4.285 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)no2)cc1 1516820068 VWPNLRZQPMQDRD-HOTGVXAUSA-N 439.487 4.033 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@H](C)C1 1519144612 OCRNMVNJGKQVHS-FXAWDEMLSA-N 429.584 4.125 10 10 IICE CCN1C[C@@H](CN(C)C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)Oc2ccccc21 1525085025 WEMKYOFNZBDRFI-OAQYLSRUSA-N 435.568 4.264 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cc2ccccc2nn1 1529902022 KYJFFRBLFRSRID-VBKFSLOCSA-N 440.575 4.311 10 10 IICE O=C(COc1cc(Cl)ccc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1535561186 JTCGMYSEOJHRBH-UHFFFAOYSA-N 448.394 4.221 10 10 IICE C[C@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1542412408 ZIHDYFPVJCMGOM-GOSISDBHSA-N 446.588 4.321 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H]3CCC[C@H]32)n1CCCSc1nccs1 1545892578 WPMQNPJNCSQTKA-NVXWUHKLSA-N 448.662 4.214 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC[C@@H]3CCCCO3)CC2)cc1 1554958788 GIJNVQFHXOAZMJ-QHCPKHFHSA-N 441.620 4.161 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(-n2ccc(C)n2)c1 1556426376 KBKOUQJMPZCSJJ-UHFFFAOYSA-N 434.540 4.183 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccccc1OCc1cccc(Br)c1 1557084776 OCWCLEJJCBGOHW-UHFFFAOYSA-N 428.282 4.369 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c(C)n1-c1ccc(F)cc1 1566491831 JYRBXRHVHPDGTK-IBGZPJMESA-N 428.533 4.473 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1 1567596943 RBNHENKTVFWKEK-DEOSSOPVSA-N 431.580 4.423 10 10 IICE COc1ccc(-c2nc(C)sc2CC(=O)N(C)CCN(C)c2ccc(OC)cc2)cc1 1585449282 JRWQPHXKUAXWDR-UHFFFAOYSA-N 439.581 4.273 10 10 IICE CC(C)OC1(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCC1 1611168201 SCKUYYQWOXHKRF-FOWTUZBSSA-N 438.640 4.193 10 10 IICE CCCCN(CC)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1614506109 LZWSPUOISSRSJD-UHFFFAOYSA-N 440.636 4.327 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(CCCOCC(F)(F)F)CC2)c1C 1625782394 JNOZHPUMICGXEE-UHFFFAOYSA-N 437.506 4.129 10 10 IICE CCOC(=O)N1CCCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CC1 1626088697 DHRLLCZPWDCXOF-UHFFFAOYSA-N 448.361 4.161 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1627390529 FSADHNIALRDAKF-KOSHJBKYSA-N 432.520 4.057 10 10 IICE COC(=O)CCCOc1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1629286459 XFCLHFYZIIBFDE-UHFFFAOYSA-N 448.519 4.169 10 10 IICE Cc1cc(C(=O)N(C)CCN2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1629853809 AFSQJFFLYXTKSL-UHFFFAOYSA-N 434.559 4.127 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccnc(Cl)c1Cl 1630373851 ZJTQJXBIEZHNEL-UHFFFAOYSA-N 434.245 4.174 10 10 IICE CCS(=O)(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1633144449 HOKQZQAWYABTML-UHFFFAOYSA-N 441.553 4.141 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(Cc1ccco1)Cc1cccs1 1637224131 AMHDDCWACGPNQN-UHFFFAOYSA-N 425.554 4.214 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@@H](c3cccc(F)c3)C2(C)C)N(C)C)cc1 1638918445 VHOPJRUBFWQUOB-GOTSBHOMSA-N 426.580 4.472 10 10 IICE Cc1cc(C(=O)NCc2cccc(N3CCOCC3)n2)c(C)n1-c1ccc(C(C)C)cc1 1639193438 ZQBGNLAPZGNNGL-UHFFFAOYSA-N 432.568 4.379 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 1640257120 JVXCJAVJJXPPMS-HZPDHXFCSA-N 432.517 4.198 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C[C@H]1c1ccccc1 1640423032 DSVBXAKGUCIJPS-BJKOFHAPSA-N 432.520 4.132 10 10 IICE CO[C@H](C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)[C@H]1CCOC1 1641202972 PVAJTXXSPZVLRR-DLVCFXQMSA-N 436.474 4.350 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2[C@H]1C(C)(C)[C@@H]2NC(=O)c1cc2cc(O)c(O)cc2s1 1642991216 LHNJYZCVAYIFOT-ZNOIYHFQSA-N 446.569 4.466 10 10 IICE CS(=O)(=O)c1cccc(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)c1 1643615328 GUEZIFKCEUUTKX-LJQANCHMSA-N 428.579 4.425 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(F)F)CC2)c(C)n1-c1ccccc1Br 1648600831 WFOFUPWWMQWKRP-QGZVFWFLSA-N 427.289 4.353 10 10 IICE COC(=O)/C=C\c1ccc(N(C)C2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1650893845 POAXWSPHSUYWRW-ALUXJARKSA-N 445.516 4.148 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3nnc4sc(C)c(C)c4c3=O)c2C)c1 1651887652 RMUXLMLEKCZSOC-UHFFFAOYSA-N 438.578 4.482 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)cc1 1653258842 NNVKJDOFYQNLNB-OAQYLSRUSA-N 430.520 4.107 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@H]2C(=O)Nc3ccccc32)CC1 1673744614 NVXVJJSTRPQSSV-MHECFPHRSA-N 434.584 4.150 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](NC4CCOCC4)C3)cc2Cl)C1 1682024553 UHTFVIIVACRFOK-GHTZIAJQSA-N 449.039 4.019 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C4=NCC(C)(C)S4)CC3)c2C)c1 1683302841 CAZDRPVJTDQORZ-UHFFFAOYSA-N 439.629 4.111 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCOc3ccc(Cl)c(Cl)c3)CC2)cc1 1686619468 WUGKAWVJZJVOPG-UHFFFAOYSA-N 438.355 4.303 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)CCCc2ccccn2)cc1F 1696608159 SBKQYNGCUXDWEB-UHFFFAOYSA-N 445.546 4.058 10 10 IICE COCC(C)(C)Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1697727562 IIEZZNGHMKOIKM-UHFFFAOYSA-N 441.620 4.334 10 10 IICE CC(C)C1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1 1706337926 UKVNNVQVSOXMAL-UHFFFAOYSA-N 425.621 4.333 10 10 IICE Cc1cc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)[C@H](C)CC#N)on1 1707946143 FMOAJWKDCUYKMK-QGZVFWFLSA-N 429.528 4.436 10 10 IICE Cc1ccc(N2CCN(c3nnc(C)n3CCCSc3nccs3)CC2)cc1C 1724380806 MOJXZJGUTBGORV-UHFFFAOYSA-N 428.631 4.169 10 10 IICE CS[C@@H](C)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1731043223 PGIOXRLFDRFTIX-IBGZPJMESA-N 436.629 4.252 10 10 IICE Cc1ccc(-c2nnc(N3CCOC(C)(C)[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1742205141 LYVPUPNVUWBUEH-INIZCTEOSA-N 427.524 4.104 10 10 IICE CC/C=C/Cn1c([C@H]2CCCCO2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1745095589 GBHUHBZIOOWLBS-UKKYDJSUSA-N 425.577 4.211 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccoc1 1747750544 SVTDFGUDFTXBAP-UHFFFAOYSA-N 428.290 4.019 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC(OCCOC)CC3)nnc2C(C)(C)C)cc1 1766614143 LLOOLYFEIBTBGI-UHFFFAOYSA-N 443.636 4.102 10 10 IICE COCCn1cc(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c2ccccc21 1874179522 IHZWERJLKTYDGL-UHFFFAOYSA-N 438.483 4.244 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C(F)(F)F)c(C(N)=O)c2Br)cc1C 2080033299 JOYMCWHLNXHFGU-ZDUSSCGKSA-N 432.240 4.085 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCC[C@@H]2CNC(=O)OC(C)(C)C)c1O 2236056748 XHNOWNAACCZUEP-CZUORRHYSA-N 443.382 4.336 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@@H](NCc1cc(Br)cc(F)c1O)C2 2241053530 CLTRIGBHPLJMLF-YJOCZYATSA-N 443.357 4.465 10 10 IICE COc1ccc(Br)cc1C=C1C(=O)NN(c2ccc(Cl)c(Cl)c2)C1=O 2297532889 BAPJUKPQOHMEGY-UHFFFAOYSA-N 442.096 4.226 10 10 IICE O=C1NC(=O)N(c2cccc(Br)c2)C(=O)C1=Cc1ccc(Cl)c(Cl)c1 2313561179 YGCSJYRAFFLDTJ-UHFFFAOYSA-N 440.080 4.422 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)C2=Cc2ccc(O)c(OC)c2)cc1 2332134744 FXSXIFAVGBCHEE-UHFFFAOYSA-N 432.451 4.379 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H](C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2352942222 BESIJYYOEZEFHG-CYBMUJFWSA-N 429.355 4.067 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3C[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(O)c1Br 2352943761 YEMKSQCQRHJOEU-QKPAOTATSA-N 425.367 4.245 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@@H](C)CNC(=O)OC(C)(C)C)c(O)c1Br 2380758296 IGFIBOHNRJIQFZ-CYBMUJFWSA-N 443.382 4.363 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccccc2F)SC1=S)Nc1ccc(C(=O)O)cc1 15040010 AHLKYUYHCGLQFM-ATVHPVEESA-N 444.509 4.144 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccc(C)cc3)C2=O)cc1OC 15045866 CMVOUXQDMCHHNX-VCRXTVNUSA-N 442.562 4.241 10 10 IICE CCCCN1C(=O)/C(=C\c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33467338 IMBBTEDFPOKXOI-SAPNQHFASA-N 442.610 4.440 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OC(C)C)c(OC)c2)SC1=S 40938942 RKUAEOWYWDPWBI-AQTBWJFISA-N 437.583 4.417 10 10 IICE CCCN[C@@H]1C(=O)Nc2cc(N(C)CCOCc3ccccc3)c(Br)cc21 384114370 KGWBYGFDBKPTSL-FQEVSTJZSA-N 432.362 4.095 10 10 IICE Cc1ccc(C(=O)NC2CC2)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435568198 SQMCCJDRACPASM-UHFFFAOYSA-N 444.579 4.247 10 10 IICE COC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccc1 727097735 JLYKDOIHTWMXIH-NAVNFMRLSA-N 446.619 4.233 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)c3ccccc3)ccc21 727309389 FWZVIRPPCZYVFR-VJTSUQJLSA-N 431.580 4.159 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 727995923 PIEMHDOARDXDHP-UHFFFAOYSA-N 432.480 4.296 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cnn(-c2ccccc2)c1 745411665 JPAZIARUNZQMEV-UHFFFAOYSA-N 429.318 4.072 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)c(C)n1-c1ccc(F)cc1 771410997 WHUZUYOJYOJRQH-QHCPKHFHSA-N 437.559 4.488 10 10 IICE C[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1Cl)c1ncc(Br)cn1 815634386 JTZJHJKWXYWELD-STQMWFEESA-N 425.758 4.141 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@@H](C)c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917011262 UXTGLPSSCLFWBB-KSZLIROESA-N 447.982 4.402 10 10 IICE Cc1nn(C)c(Cl)c1/C=C/C(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2 1087467991 ODRNFJSUSVQHRX-SOFGYWHQSA-N 429.929 4.461 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnc(OC2CCOCC2)c(Cl)c1 1124623633 VDBFYYATEIGWJA-UHFFFAOYSA-N 429.948 4.165 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3c(F)ccc(SCC4CC4)c3F)c2)CC1 1128039090 AWYODEBBYFUGSF-UHFFFAOYSA-N 445.535 4.388 10 10 IICE Cc1cc(C(=O)NCc2cc3c(cc2OC(F)F)OCO3)c(C)n1-c1ccc(F)cc1 1137524829 USLGZEYVDMNHOE-UHFFFAOYSA-N 432.398 4.493 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(N)=O)c2ccccc2)c(C)n1-c1ccccc1Br 1141446357 BRLLYEAQCJCAQM-IBGZPJMESA-N 440.341 4.203 10 10 IICE Cc1cc(C)nc(N2CCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CC2)n1 1192461736 WPBIQTKOMSCOJF-UHFFFAOYSA-N 429.528 4.270 10 10 IICE C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1231187178 QWNWFAKNJHWDQJ-INIZCTEOSA-N 435.399 4.176 10 10 IICE COC(=O)c1cc(C(C)=O)c(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)[nH]1 1288774635 LRMUAIGYINPJPM-UHFFFAOYSA-N 427.888 4.246 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1289601987 IDOTWDSUWLDZGL-LGPLSSKUSA-N 436.644 4.020 10 10 IICE COc1cc(CN2CC[C@H](NC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)cc(OC)c1 1294644718 FHMPXGHMCYMYHH-QFIPXVFZSA-N 447.579 4.424 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Nc4ccc(OC)cc4OC)cc3)CC2)cc1 1294756051 QCBWSJNVZJUJPA-UHFFFAOYSA-N 447.535 4.418 10 10 IICE Cc1ccc(CN2CCO[C@H](CNC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1 1302576791 XYOGPPXYPGQZBL-RUZDIDTESA-N 431.580 4.342 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@H](S(=O)(=O)c3ccccc3)C2)c(C)n1-c1cccc(Cl)c1 1302638255 ZTKOOFKENJUDNR-XGAFWQRZSA-N 442.968 4.482 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H]2OCCC[C@H]2C1 1304238206 MHDQHIGZMPFWRY-RBBKRZOGSA-N 425.621 4.295 10 10 IICE CC[C@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1306442468 OJKGKKHFNHCLRH-YKSBVNFPSA-N 448.615 4.162 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O 1312518582 KJTGRLLLWCIEKR-IBGZPJMESA-N 448.489 4.108 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H](c2ccccc2)[C@H](O)c2ccccc2)N(C)C)cc1 1313409259 BCDJRHJZYNODRR-UODIDJSMSA-N 446.595 4.129 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1315240003 QMPPNFAILSNJJI-HSZRJFAPSA-N 427.524 4.105 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)Nc3cccc(N4CCOCC4)c3)cc2C1 1338514333 XQIIQLGYSYUFSO-UHFFFAOYSA-N 437.540 4.069 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](OCC)[C@H]2CCOC2)sc(C)c1-c1ccc(F)cc1 1352684894 ZLRTWUIAVOPVJY-HNAYVOBHSA-N 435.517 4.419 10 10 IICE CC[C@H](C)Oc1ccccc1/C=C\C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1360094107 QRAJBGFGTPHDGC-ZQGDAAQZSA-N 439.575 4.475 10 10 IICE Cc1nc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(C)s1 1435570909 CJRFPAIZFDKQND-SXGWCWSVSA-N 436.555 4.234 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(Br)cc([N+](=O)[O-])c3)c2)CC1 1447321236 LSGMTTHEVLNZIB-UHFFFAOYSA-N 447.333 4.140 10 10 IICE Cc1noc([C@H]2CCCCN2C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1467883916 WICXMVLZNLVWJX-QGZVFWFLSA-N 444.333 4.310 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC(Cc4ccccc4C(F)(F)F)C3)C2)cc1 1478956468 GOIGCYKYDPKHCZ-SFHVURJKSA-N 433.474 4.177 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(c3ccc(I)cc3)CC2)cc1 1527397031 XTAFUSLLOUTDRN-UHFFFAOYSA-N 448.348 4.485 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3csc(-c4cnn(C)c4)n3)cc2Cl)C1 1530423134 AFXYXXNIQFEKDP-AWEZNQCLSA-N 429.977 4.363 10 10 IICE Cc1cc(N2CCN(C)CC2)ccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1540261817 JNKWKODGHGTRJB-UHFFFAOYSA-N 444.579 4.148 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)[C@H]2C[C@H]21 1545496223 CHPIVXBXVJRKBZ-ZGXWSNOMSA-N 426.513 4.063 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(Cl)c1 1546034198 QHCAHWNVWQCNJG-KRWDZBQOSA-N 432.904 4.435 10 10 IICE CCCN1CCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C(C)(C)C1=O 1556283573 WEMDNQWGZCYFOT-UHFFFAOYSA-N 446.389 4.330 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCS(=O)(=O)CCc3ccccc3)c2C)c1 1556351431 ZQVDHGFBXABIAX-UHFFFAOYSA-N 438.593 4.098 10 10 IICE O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1c(O)cccc1F 1558456440 XXLUPLCFOLFJSY-UHFFFAOYSA-N 446.438 4.151 10 10 IICE COC(=O)C[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CC1 1584557307 SGERSCTZKYYAGM-INIZCTEOSA-N 433.346 4.176 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)NC(=O)OC(C)(C)C)cc1 1586620239 UUBYHFOZARKVCR-CWBXHPNXSA-N 435.568 4.021 10 10 IICE C[C@@H](NC(=O)c1csc(C2CCN(C(=O)OC(C)(C)C)CC2)n1)c1ccccc1O 1587446892 BMNBORNJCLJWPK-CQSZACIVSA-N 431.558 4.454 10 10 IICE CN(C)c1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1F 1595928713 HFZFNAHGOVINMV-WOJGMQOQSA-N 447.532 4.261 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CCN2C(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1597353110 NEUSTPVZQPWNJH-FQEVSTJZSA-N 431.964 4.416 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1csc(-c2cccc(C)c2)n1 1597567581 SHYWWHLCHBSOBL-UHFFFAOYSA-N 444.940 4.222 10 10 IICE CC(C)NC(=O)c1nnc(N2CC[C@@H]3CCCC[C@H]3C2)n1CCCSc1nccs1 1608469872 RILJLZXWHSSQDF-IRXDYDNUSA-N 448.662 4.072 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C[C@@H](C)O1 1614232978 FOIXPUAQTSKGKD-SJORKVTESA-N 444.630 4.291 10 10 IICE Cc1ccc(-c2nc(C)sc2CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1618635729 MTICNMSVPYBMLF-QFIPXVFZSA-N 436.625 4.455 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 1624220629 KTMFXJNXCAMXRX-MJGOQNOKSA-N 439.556 4.282 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)cc1C 1625938322 DGXRJKIVORFOIS-QHCPKHFHSA-N 431.536 4.263 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(Cn2cc(N)c(C(F)(F)F)n2)cc1 1626885854 OPDWEUVDSLPAPX-UHFFFAOYSA-N 445.489 4.261 10 10 IICE COc1ccc(N2CCN(CCCNc3ccc(-c4ccc(Cl)s4)nn3)CC2)cc1 1639204346 JWZBOVKEUSJLAY-UHFFFAOYSA-N 444.004 4.491 10 10 IICE Cc1cc(C(=O)Cn2nnn(-c3ccccc3)c2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 1640783663 MZXVWOZGNUCWMX-UHFFFAOYSA-N 429.524 4.017 10 10 IICE Cc1cc(C(=O)NC[C@@H]2Cc3ccccc3CO2)c(C)n1-c1ccc(Br)cn1 1642271104 VTRYKZJGLDSCDW-IBGZPJMESA-N 440.341 4.123 10 10 IICE CC(C)Cc1ncnc(NCc2c(O)ccc3c2CCCC3)c1I 1650794195 HXJGFDISPUPQHO-UHFFFAOYSA-N 437.325 4.476 10 10 IICE Cc1cccc(CSCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1 1656553021 FDSYKDQGUSSAHK-UHFFFAOYSA-N 428.579 4.166 10 10 IICE CCN(C)c1ccc(CN2CCC(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)CC2)cc1 1660171298 RUVHBIVPJQYYCA-ZEQRLZLVSA-N 442.648 4.191 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(CC)C[C@H]2CCCO2)cc1 1695619088 FHIJVGJHNSDKSC-JOCHJYFZSA-N 436.604 4.183 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1[C@H]1CCC[C@@H](C(F)(F)F)C1 1707860855 RRTQSZWJBWNIDO-QUCCMNQESA-N 437.510 4.353 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H](Cc2cnn(C)c2)C1 1724235510 OVVSXBHHXDKMLS-FQEVSTJZSA-N 449.647 4.092 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1729607416 DIBLHYSDFHQNAE-UHFFFAOYSA-N 446.599 4.281 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)CC[C@H]1C 1752244927 DAGHOAIPARDXJK-IAGOWNOFSA-N 428.631 4.385 10 10 IICE C[C@@H]1CN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)CC(C)(C)C1 1752334959 JZHMAXHJYBCYFO-HNNXBMFYSA-N 429.619 4.246 10 10 IICE CCOc1ccccc1NC(=O)[C@H](C)Oc1cccnc1NC(=O)Oc1ccc(N)cc1 1858686777 DHKPALHMHZOFGY-HNNXBMFYSA-N 436.468 4.079 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(=O)c2cc(Cl)ccc2o1 1859707578 ULZBZBHTIWHVEP-UHFFFAOYSA-N 429.815 4.474 10 10 IICE COc1ccc(C(=O)N(c2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)cc1[N+](=O)[O-] 1859889286 BPTWITCDSYWATL-UHFFFAOYSA-N 444.443 4.434 10 10 IICE O=C(CNCc1ccc(C(F)(F)F)cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1860717291 FKLRJHMEMVYFFJ-UHFFFAOYSA-N 438.405 4.209 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3sc4ccc(Cl)cc4c3C)CC2)cc1 1891815826 XVTSEURNBDNZMV-UHFFFAOYSA-N 436.986 4.383 10 10 IICE CCN[C@@H](c1ccc(N(C)C)cc1)[C@@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 2044747903 JXLVWOHESYVLBL-RPWUZVMVSA-N 440.632 4.429 10 10 IICE Oc1c(Cn2ncc(I)c2C(F)(F)F)cccc1C(F)(F)F 2079124907 KBVULMINKKVFMR-UHFFFAOYSA-N 436.093 4.279 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3NCc1cc(Br)cc(F)c1O 2169561417 KVOAHMNXCUBTAE-NUKKGAITSA-N 441.341 4.027 10 10 IICE Cc1ccc(CNC[C@]2(F)CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352944584 JSLXGIQRZRJUTF-LJQANCHMSA-N 431.346 4.292 10 10 IICE CCC1(C(=O)N(C)Cc2ccc(C)c(Br)c2O)CN(C(=O)OC(C)(C)C)C1 2380788536 BWOSYLPSQPKVIF-UHFFFAOYSA-N 441.366 4.069 10 10 IICE CCOc1cccc([C@@H]2CC(c3ccc(C)cc3C)=NC3(CCN(C(C)=O)CC3)N2)c1O 65298445 LVNJRDJTCZCHKB-QHCPKHFHSA-N 435.568 4.270 10 10 IICE biogenic CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3cccc(Br)c3O)CC[C@H]2C1 401140043 VCPFGEZHRSWYSI-ARFHVFGLSA-N 425.367 4.280 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)C1 436036493 XYYMWWINKWZNCX-KDYSTLNUSA-N 431.580 4.302 10 10 IICE CCCN(C[C@H]1CCCCO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 730127127 IMJKTQZWPFKMFE-HXUWFJFHSA-N 425.520 4.248 10 10 IICE C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1ccc(N2CCOCC2)cc1 741182960 MEVDGCIIRNMSSI-BEVDRBHNSA-N 434.458 4.403 10 10 IICE O=C(NCCc1ccc2ccccc2n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743570144 UWYMUASCAKPTPA-IBGZPJMESA-N 440.494 4.347 10 10 IICE O=C(O)[C@@H](Cc1c[nH]c2ccc(Br)cc12)NCc1c(O)ccc(Cl)c1F 756331769 CFRJIHGAMTUGMZ-OAHLLOKOSA-N 441.684 4.214 10 10 IICE Oc1cc2c(cc1CN1CCC[C@H](Cc3nc(C4CCCCCC4)no3)C1)[C@@H](O)CO2 768461792 DZPDKJNAKQRQGU-IERDGZPVSA-N 427.545 4.094 10 10 IICE O=C(Cc1coc(-c2ccc(F)cc2)n1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771062526 APJUEMKFLXRAEB-LJQANCHMSA-N 443.906 4.163 10 10 IICE COCCc1nc(C)c([C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 773146341 QBLARNRTBDDXKY-SFHVURJKSA-N 428.646 4.023 10 10 IICE Cc1ccc(C(=O)C2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)cc1 918070444 GAMSCEUYDWVYQB-UHFFFAOYSA-N 437.609 4.353 10 10 IICE Cc1cc(Oc2ccccc2)ccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1125325810 QNNXBLHJQJQYHN-OAQYLSRUSA-N 443.547 4.419 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccccc1 1128474210 OISOHLFWRSNWSQ-YLSIXGBDSA-N 426.538 4.089 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H]3C(=O)Nc4c(F)cccc43)cc2Cl)C1 1128490516 UBUWFZDVQZAXCY-RHSMWYFYSA-N 429.923 4.458 10 10 IICE CN1CCN(c2ccc(CNC(=O)Cc3csc(-c4ccc(Cl)cc4)n3)cc2)CC1 1133123394 JYGGQHHJNARLDZ-UHFFFAOYSA-N 441.000 4.074 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3ncon3)C2)c(C)n1-c1ccccc1Br 1178363797 PUCWRDVKKMTGOL-OAHLLOKOSA-N 429.318 4.259 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCOc4c3ccc(Cl)c4Cl)C2)cc1 1248489890 IICQKEIUQGHMEV-ACJLOTCBSA-N 436.339 4.404 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1nc(C(F)(F)F)n2c1CCCC2 1254362013 GECYMUGRUWOQLZ-UHFFFAOYSA-N 435.494 4.180 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C(=O)/C=C/c1cnc3ccccc3n1)CCO2 1287849512 KHWCCTHHZDFJEP-PKNBQFBNSA-N 446.507 4.093 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1 1289377396 URPPRAOQIBPZBE-JLYLLQBASA-N 426.542 4.006 10 10 IICE Cc1csc(CCCCn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1290329170 NVDIGBOCEIOCFB-IBGZPJMESA-N 441.601 4.302 10 10 IICE CC1CCC(N(C)c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1291060520 IEABHMOUJFXRDP-SKINQDTJSA-N 429.584 4.440 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)C3(CCCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1294967940 ZDOUEGAVSKJTNU-UHFFFAOYSA-N 434.989 4.321 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)OCc1ccc(C)cc1 1297228588 OUVGTIIMJTYYEN-IBGZPJMESA-N 426.557 4.289 10 10 IICE Cc1cc(C(=O)N[C@@H]2[C@H](C)CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(C)n1-c1ccccn1 1297536599 AAILZWXBXQMFCJ-FQELHTAISA-N 426.561 4.253 10 10 IICE CN(C)c1ccc(Cn2c(C3CCC3)nnc2N2CCO[C@](C)(C(C)(C)C)C2)cc1F 1298056985 ZUGAOTBIROYJAK-DEOSSOPVSA-N 429.584 4.440 10 10 IICE Cc1nc2ccc(Br)cn2c1C(=O)NCc1cc(Cl)cc(Cl)c1O 1298842330 UPXYZNONGVBIEE-UHFFFAOYSA-N 429.101 4.348 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1305388029 HBOMOSUMBJHQAX-GOSISDBHSA-N 425.602 4.374 10 10 IICE CCc1ccc(-c2nnc(N3CC[C@H](OC)C3)n2CCCSc2nccs2)cc1 1305975642 SZIKFVCCZOQAEC-SFHVURJKSA-N 429.615 4.372 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnnn1-c1c(Cl)cccc1Cl 1351674453 VPBBEYSRTUVFNF-UHFFFAOYSA-N 430.339 4.447 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n(C(C)(C)C)n1 1357127987 COROVYZIGCEALC-FOWTUZBSSA-N 446.573 4.316 10 10 IICE CC(C)c1nnc(N2CCN([C@@H](C)C(F)(F)F)CC2)n1CCCSc1nccs1 1359714647 DFTSKKFNYQLGHP-AWEZNQCLSA-N 448.584 4.113 10 10 IICE COc1cc2c(c(OC)c1OC)CCN(C(=O)Cc1cc(C)n(-c3ccccc3)c1C)CC2 1457769566 ZJAZSAUJXUMQGA-UHFFFAOYSA-N 448.563 4.290 10 10 IICE CC[C@@H](C)CCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 1461441626 XDLKZMKDBJZKCN-DYTQJMLRSA-N 441.416 4.203 10 10 IICE CC[C@@H](C(=O)N1CCC(NC(=O)c2cc3cc(O)c(O)cc3s2)CC1)c1ccccc1 1464690851 BNJBVDPTJBECRI-GOSISDBHSA-N 438.549 4.227 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(-c3cccc(C)c3)nn2)cc1 1464956656 LLVRVYVWDOGHKG-UHFFFAOYSA-N 441.535 4.497 10 10 IICE COc1cccc([C@@H]2CN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CCO2)c1 1470968761 HHCVURAGULHJCK-VWLOTQADSA-N 433.552 4.428 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C[C@@H](C)S1 1494328119 LOCWJDHGZFCYDV-OWCLPIDISA-N 439.676 4.489 10 10 IICE CC(C)c1nnc(N2CCO[C@@](C)(C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1509018373 GWZCMDFBWYUXQJ-RUZDIDTESA-N 425.621 4.474 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1 1512653640 SYQUKGNGBJDPMW-CLOONOSVSA-N 437.588 4.129 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Oc3ccc(SCC(=O)OC)cc3)ccc21 1517720432 UWSYIKOUMZKMGT-UHFFFAOYSA-N 427.522 4.389 10 10 IICE CO[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC[C@@H]1C 1518623039 UKBNKOVUJUVSKE-GVDBMIGSSA-N 437.635 4.020 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccc(F)c(I)c2)C2CC2)cc1 1524793388 FFQWMJNDNNHDAJ-UHFFFAOYSA-N 438.284 4.301 10 10 IICE COc1ccc2c(c1)CN(C(=O)CCCN1C(=O)/C(=C/c3cccs3)SC1=S)C2 1530024517 MDEXPKPGLFDHFS-WQRHYEAKSA-N 444.603 4.281 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3c(F)ccc(SCC4CC4)c3F)c2)CC1 1530277212 QAHJVNWGRALDLU-UHFFFAOYSA-N 445.535 4.421 10 10 IICE COC(=O)[C@]1(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)CCCN(Cc2ccccc2)C1 1530623339 PHUCACSNUVYMOT-MHZLTWQESA-N 445.563 4.032 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc2ccc(O)cc2c1O 1541096850 FXOHNLYUSFUOJP-UHFFFAOYSA-N 446.425 4.036 10 10 IICE CCCN(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H](CC)c1ccccc1 1544179875 JPTFHSZFAXOILQ-KVACCUTFSA-N 449.595 4.290 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(O)c(O)c1)CC(C)(C)O2 1569885043 HVFNLNVVJVQDTM-KRWDZBQOSA-N 442.512 4.406 10 10 IICE C[C@@H](C1CC1)n1nccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1584821618 WBSZMXRDXYIEKH-VLURKWGBSA-N 444.557 4.223 10 10 IICE CSc1cncc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1 1585436003 RIHIDPOMBIWABB-DHDCSXOGSA-N 435.621 4.485 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C/[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 1585698407 OEBQIYGBIVFTFV-YLZCUGDYSA-N 433.568 4.491 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)CC2)c(OC)c1 1587490169 DRCLSLDGRRQBLT-DLBZAZTESA-N 435.351 4.463 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCn1c(=O)n(C)c2ccccc21 1597567399 MSPHKUTXFITBNY-LJQANCHMSA-N 429.520 4.226 10 10 IICE Cc1cc(C(=O)Nc2cc(-c3cccnc3)[nH]n2)c(C)n1-c1ccc(Br)cn1 1607710052 FUHVOLSNXLXFAK-UHFFFAOYSA-N 437.301 4.289 10 10 IICE C[C@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)N(C)C(=O)OC(C)(C)C 1611600768 FRSBMHFVTOEYGL-MRXNPFEDSA-N 431.581 4.173 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CC(C)(C)OC(C)(C)C1 1611964417 VXXMAGFPUHFRBE-UHFFFAOYSA-N 448.615 4.080 10 10 IICE COc1ccc([C@@H](OC)[C@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1624050448 GSNGPOILLIJVOV-QYBDOPJKSA-N 434.536 4.350 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCC[C@@H](C(C)(C)C)CC3)CC2)cc1 1625352963 OIJUQQUHFNCURG-LJUQSABZSA-N 441.616 4.011 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(Cc4ccccc4)CCOCC3)cc2F)C[C@@H](C)O1 1626159049 QREYUOPUGMWLTO-BGYRXZFFSA-N 440.559 4.095 10 10 IICE C[C@@H]1[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)[C@@H]1c1ccccc1 1628495577 MVTGATFTDYSXDT-DWJNZPNVSA-N 437.584 4.484 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(NC(=O)OC(C)(C)C)CC1 1630288334 OJQQIQJJPYAFCO-UHFFFAOYSA-N 425.529 4.036 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)c(C)n1-c1ccccc1Br 1633032137 OTDDGVHFTZMZPZ-GOSISDBHSA-N 448.405 4.039 10 10 IICE CCc1ccc2c(c1)[C@@H](CCNC(=O)c1cccc(-n3c(C)cc(C=O)c3C)c1)C(=O)N2 1633793057 AZZVCICYEBFIAF-JOCHJYFZSA-N 429.520 4.325 10 10 IICE O=C(c1cc(I)ccc1N1CCCCC1)N1Cc2cccc(O)c2C1 1636230786 JDYJDJLHTVGGIS-UHFFFAOYSA-N 448.304 4.143 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCNC(=O)OCc3ccccc3)c2C)c1 1639076978 KPFYGSOJVSVUSN-UHFFFAOYSA-N 434.540 4.128 10 10 IICE Cc1cc(C(=O)N[C@H](Cc2ccncc2)C(=O)OC(C)(C)C)c(C)n1-c1ccc(F)cc1 1640068756 YKZDHCPFPMGOFT-JOCHJYFZSA-N 437.515 4.311 10 10 IICE COC(=O)[C@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1ccccc1OC 1650894067 YJPJODDBXQACLC-IBGZPJMESA-N 448.475 4.278 10 10 IICE CC(C)OC(=O)CNC(=O)[C@@H](C)SCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1656631937 CKJYMZSEPLJKJJ-MRXNPFEDSA-N 442.541 4.230 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]2c2cc(F)cc(Br)c2)cc1 1658168949 MUHLTAGSPQXXQR-FQEVSTJZSA-N 434.353 4.108 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@H](C)NC(=O)OC(C)(C)C)CC1 1683421348 MMBVDVPUOURDRG-MOPGFXCFSA-N 446.636 4.327 10 10 IICE COc1ccc(C[C@@H]2CCCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)C2)cc1 1684606310 DXJGXFWPBPQCGS-SQJMNOBHSA-N 438.616 4.028 10 10 IICE C[C@@H]1CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CCc2ccc(Cl)cc21 1687807833 WIYMDEPQOCTDHK-HXOBKFHXSA-N 429.008 4.380 10 10 IICE CC(C)Cc1nnc(N(C)CC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1692085527 OSAOINUQYLJCCW-UHFFFAOYSA-N 439.648 4.360 10 10 IICE C=CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](COC(C)C)C1 1705886195 AARFAOKDFSJMQP-QFIPXVFZSA-N 435.572 4.169 10 10 IICE CC(C)Cc1nnc(N(C)C2CCC(C)CC2)n1Cc1ccc(N2CCOCC2)cc1 1741431564 BJTVUGALJHPOPG-UHFFFAOYSA-N 425.621 4.376 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCOC1 1745629039 KFBFOEURFKXRGS-RUZDIDTESA-N 437.588 4.130 10 10 IICE C[C@H]1CCC[C@](Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752088513 ZSCVIEYXPCLXAY-DFBJGRDBSA-N 434.588 4.193 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](c3nccs3)C2)n1Cc1ccc(N(C)C)cc1C 1763810970 WPCDWRPJZWLPAH-JXFKEZNVSA-N 440.617 4.249 10 10 IICE CCN(CC)Cc1ccc(/C=C2/SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1 1860085300 CFLFVQAACNGNGF-YBFXNURJSA-N 442.562 4.338 10 10 IICE CCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1-c1ccc(OC)c(C)c1 1862333940 GBDOERMMROOPDW-UHFFFAOYSA-N 448.567 4.248 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccncc3)C(=O)N(C3CCCC3)C2=O)cc1 1873164049 JQAKMDLNLPFHJZ-UHFFFAOYSA-N 440.547 4.301 10 10 IICE Oc1ccc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156277326 JIIUPOJCJFUWRQ-RBBKRZOGSA-N 431.374 4.068 10 10 IICE O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)C1=Cc1ccc(N2CCCC2)o1 2294259125 KKRHTXKERKBYCG-UHFFFAOYSA-N 436.320 4.018 10 10 IICE Cc1ccc(-c2nn(-c3ccccc3)cc2C=C2SC(=S)N(CC(=O)O)C2=O)cc1 2296536626 YHIIYOQGBHJAFL-UHFFFAOYSA-N 435.530 4.134 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=C(C)NCc2ccco2)cc1 2313682640 HWMKUGDLVJCHSB-UHFFFAOYSA-N 432.436 4.011 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)ccc1O[C@@H](C)C(=O)O 2314932126 KROOYNSYQXQTTH-NSHDSACASA-N 433.482 4.092 10 10 IICE O=C(O)c1cccc(CN2C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c1 2326973127 JAWPLJCCAJBGAO-UHFFFAOYSA-N 434.882 4.348 10 10 IICE Cc1ccc(CNCC2CC3(C2)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352948515 PYJNMZOJXQBZHX-UHFFFAOYSA-N 425.367 4.200 10 10 IICE O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(-c2cccc(C(=O)O)c2)o1 16386315 IHYWLSDTYNUGHP-XNTDXEJSSA-N 443.242 4.413 10 10 IICE Cn1c(/C=C\c2c[nH]c3ccccc23)nc2ccc(I)cc2c1=O 102894583 YYPPCLZNVSYIBT-TWGQIWQCSA-N 427.245 4.190 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2ccccc2OCc2ccc(C)cc2)SC1=S 206837187 ZJFPXZFDOMASNY-UYRXBGFRSA-N 427.547 4.338 10 10 IICE CCN(CC)C(=O)Cn1ccc2cc(NC(=O)c3c(C)oc(-n4cccc4)c3C#N)ccc21 261379711 GBKPHJCZCWIWTL-UHFFFAOYSA-N 443.507 4.326 10 10 IICE Oc1c(Br)cc(Cl)cc1CNCC[C@H]1CN(Cc2ccccc2)CCO1 708074569 CZTQNBBQPUQVGU-SFHVURJKSA-N 439.781 4.189 10 10 IICE Cc1cc(CCNC(=O)C2CCN(C(=O)OCC(C)C)CC2)c(C)n1-c1ccccc1 726156912 IGLLGAMFLCPPBC-UHFFFAOYSA-N 425.573 4.257 10 10 IICE C/C=C\c1ccc(OCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(OC)c1 726565584 DFYDNAFITNXGSZ-ARJAWSKDSA-N 446.494 4.494 10 10 IICE CC(C)(C)c1ccc(CCCC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 727308980 XKFXEZASCIBHFT-QFIPXVFZSA-N 435.612 4.325 10 10 IICE C[C@@H](c1ccccc1)N(C(=O)C(=O)Nc1nc(C(F)(F)F)cs1)c1ccc(N)cc1 793044035 YGUDZBVXESUPTI-LBPRGKRZSA-N 434.443 4.477 10 10 IICE CC1=C(c2ccco2)CN(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 802270402 KMOXGDLGHPKMMK-UHFFFAOYSA-N 434.584 4.201 10 10 IICE COC(=O)c1cc(OC)c(OC)c(OC)c1NC(=O)c1ccc(-n2c(C)ccc2C)cc1 807398852 BUQYIOROBPEXNE-UHFFFAOYSA-N 438.480 4.159 10 10 IICE C[C@@H](N[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2)c1ccc(N2CCOCC2)c(F)c1 813878121 CAAAUZSXLZEDON-DYESRHJHSA-N 433.568 4.103 10 10 IICE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1125326197 VSQCTAVESYLZPE-VMEIHUARSA-N 446.378 4.415 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cnc(-c4cccc(Cl)c4)s3)cc2)CC1 1132903197 WBNMSEJPNBQFGJ-UHFFFAOYSA-N 426.973 4.145 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1 1139975124 VGELIQPXTNMBHU-OAHLLOKOSA-N 444.112 4.271 10 10 IICE Cc1ccc(C(=O)N(C)CCCN(C)Cc2ccncc2)cc1-n1c(C)cc(C=O)c1C 1141742344 XZFQFVKRZHXBCV-UHFFFAOYSA-N 432.568 4.204 10 10 IICE CCc1cc(N2CCC[C@@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2)ncn1 1162450196 IGZXVENWCFOXBV-LJQANCHMSA-N 431.496 4.259 10 10 IICE Cc1cc(C(=O)N2Cc3cncnc3[C@@H](C)C2)c(C)n1-c1cccc(Br)c1 1175594224 NVTNNIRKBLVNAL-ZDUSSCGKSA-N 425.330 4.406 10 10 IICE COc1ccc([C@@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c2ccco2)cc1 1251937180 UQQLQSVJVNBYGR-XUZZJYLKSA-N 436.508 4.474 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC(OCc3cccc4ccccc34)C2)N(C)C)cc1 1256236716 KLPJNMWERREETO-AREMUKBSSA-N 446.595 4.119 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1265457572 OJQBGPGKCDRHAA-OAQYLSRUSA-N 437.540 4.360 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CC[C@](C)(CC)C2)cc1 1295406672 ZHGSNYCRJRZWCQ-VWLOTQADSA-N 438.620 4.035 10 10 IICE CNC(=O)CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C)CC1 1299180141 GZNWHWLUMDCNBS-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1306788096 LCGYCADFRDVAQE-NRFANRHFSA-N 426.653 4.067 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](CC(N)=O)c3cccc(Cl)c3)c2C)c1 1313134300 YRQYGKHIWQEFOC-JOCHJYFZSA-N 438.959 4.472 10 10 IICE COc1ccc(-c2nnc(N3CC[C@@H](C)C3)n2CCCSc2nccs2)c(OC)c1 1315403906 UFFVRBSGVJCAOR-OAHLLOKOSA-N 445.614 4.447 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)sc2c1CCCC2 1353914448 NYAIYVUDEVIKIC-LBPRGKRZSA-N 448.491 4.073 10 10 IICE COc1cc(C2(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)CC2)ccc1C 1357511202 FGRVTNGSQQHWGJ-UHFFFAOYSA-N 448.485 4.207 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1359794498 XRQNRBKPDCLSFN-RTBURBONSA-N 445.702 4.408 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2cccc(CS(=O)(=O)Cc3ccccc3)c2)cc1 1444115367 KISAHJISORFGIX-UHFFFAOYSA-N 436.493 4.216 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]2c2ccc(I)cc2)cc1 1447116928 XWVWECQYQAVEQO-INIZCTEOSA-N 448.264 4.431 10 10 IICE COc1ccc(CNC(=O)c2cnc(-c3cc(Br)ccc3OC)s2)c(O)c1 1448379299 HALOUHJANGFSLA-UHFFFAOYSA-N 449.326 4.225 10 10 IICE CSc1ncc(I)c(N[C@@H](C)Cc2ccc(N(C)C)cc2C)n1 1458438725 RQWKFPISLCFRKA-LBPRGKRZSA-N 442.370 4.221 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCOc1cc(C)ccc1[N+](=O)[O-] 1465849300 VRFZHRFGKUXPPH-UHFFFAOYSA-N 437.290 4.189 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)CCC(=O)NC(c2ccccc2)c2ccccc2)c1 1465991360 CDXJTKAOVGHLJN-GOSISDBHSA-N 432.520 4.264 10 10 IICE Cc1cc(C(=O)Nc2cc(-c3ccncc3)[nH]n2)c(C)n1-c1ccc(Br)cn1 1472499106 WXPNPKZMZYYULK-UHFFFAOYSA-N 437.301 4.289 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNC(=O)NCc1cc(Cl)cc(Cl)c1O 1479299010 OFWULATXJFFQDP-CHWSQXEVSA-N 446.375 4.391 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCn1cccn1)OC 1513446084 XVGJBHQQJPSQDY-QFIPXVFZSA-N 447.587 4.111 10 10 IICE COc1cccc(C[C@H](C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1516814603 KVYCIQFICGDKRJ-GBESFXJTSA-N 428.548 4.333 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(C(=O)N4CCCC4)n3)cc2Cl)C1 1519552733 ZKVZKESJQADELC-KRWDZBQOSA-N 440.975 4.137 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)[C@H]1C[C@H]2CC[C@H]1C2 1525904034 RWISMDJZZMQMKD-CTHVLPJWSA-N 432.586 4.358 10 10 IICE COc1ccc(N(C)C(=O)c2ccccc2CCN(C)C(=O)OC(C)(C)C)cc1OC 1527306458 OCBPBPMTXJBKDP-UHFFFAOYSA-N 428.529 4.390 10 10 IICE CC(=O)c1cc(F)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1535361756 LQYWIVKKLVJLOY-ZDLGFXPLSA-N 446.500 4.397 10 10 IICE COc1ccccc1Nc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 1544629808 BSWSOZXJBVRODO-UHFFFAOYSA-N 449.526 4.469 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1)OC 1555249346 KIXBQBVSIDIRAM-QFIPXVFZSA-N 437.588 4.250 10 10 IICE CCO[C@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1565797487 CSJYKWZTBFEWHS-MSOLQXFVSA-N 432.362 4.329 10 10 IICE COC(=O)[C@@](C)(NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccc(Cl)c(Cl)c1 1567725651 XFTBYHDYFBAJCR-IBGZPJMESA-N 440.304 4.438 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(F)(F)c1ncccc1Br 1584095784 QLOMADYHVZAYCK-CYBMUJFWSA-N 426.305 4.058 10 10 IICE CCCOc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(OCCC)c1 1596684738 WOIBSCLUQVILBU-UHFFFAOYSA-N 448.510 4.309 10 10 IICE COC[C@]1(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)OCCc2ccccc21 1612443916 OAQWRPOWINWPGE-VWLOTQADSA-N 432.476 4.352 10 10 IICE COC(=O)CN(C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccccc1 1618062554 ISOAYOAUBSWMPZ-UHFFFAOYSA-N 442.313 4.071 10 10 IICE CSC(C)(C)Cn1c(-c2cnn(C)c2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1620184623 RLRKDCBRIOJLSF-UHFFFAOYSA-N 439.633 4.057 10 10 IICE Cc1ccc(C(=O)N2CCN(CCc3ccccc3)CC2)cc1-n1c(C)cc(C=O)c1C 1623674298 PJJOCWYSIQIHIP-UHFFFAOYSA-N 429.564 4.216 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1Cc1ccco1 1630256934 IBODKTORHJOLGH-HXUWFJFHSA-N 441.959 4.500 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1633503949 SXWXIRNKISBDQP-XMMPIXPASA-N 434.536 4.349 10 10 IICE O=C(Nc1cc(N2CCOCC2)ccc1Br)c1cc2cc(O)c(O)cc2s1 1636568469 NAEOMRWAVFMAJV-UHFFFAOYSA-N 449.326 4.164 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC[C@@](O)(c2ccc(Br)cc2)C1 1639817303 QPBYYUQDTLYEON-FQEVSTJZSA-N 448.338 4.199 10 10 IICE CC(=O)N1CCN(c2ccc(CNc3nc4c(Br)cccc4s3)cc2)CC1 1642666460 HIVXWYKRPXGGES-UHFFFAOYSA-N 445.386 4.339 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2[C@@H](O)CC)sc(C)c1-c1ccccc1 1644679198 QNQGKCHZBJJVNU-OALUTQOASA-N 444.597 4.464 10 10 IICE COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCN(c2ccc(OC)cc2OC)CC1 1648084437 TZPSJFLSOLHKBW-HXUWFJFHSA-N 439.339 4.047 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@H]3CCNC(=O)CC3)n2)c(C)n1-c1ccc(F)cc1 1648445697 ZMOOMFUAJUOJCH-OAHLLOKOSA-N 426.517 4.212 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccc(Sc2cccc(Br)c2)n1 1651222655 LVITZALUSWZZNT-UHFFFAOYSA-N 431.311 4.337 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc(C(=O)OC)c1 1655965562 XZLVRQVBBAGPCH-UHFFFAOYSA-N 435.476 4.237 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(c4ccc(F)c(F)c4)CC3)C2)cc1 1673823609 WOUJAFHBIZPPBU-KRWDZBQOSA-N 429.511 4.389 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(c4ccc(N(C)C)cc4)CC3)C2)cc1 1683339601 AVEGACHFAZGUAL-HXUWFJFHSA-N 436.600 4.177 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2)c(C)o1 1684443623 CNFJOBRTVXMAAH-UHFFFAOYSA-N 448.567 4.014 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]21 1686827266 ZJZVINBFHGSLBW-IHDNQRHQSA-N 442.401 4.392 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1694004384 ZQVWPSVQVQFSQV-LJQANCHMSA-N 425.621 4.285 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1708574682 NMLUTBMGKHHKBR-QYBDOPJKSA-N 448.615 4.313 10 10 IICE C[C@@H]1CCC[C@H]1Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1726540203 USXAABNEWWJBDC-CTNGQTDRSA-N 425.621 4.485 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1744063993 DQZZBFPGFDUYJR-UHFFFAOYSA-N 440.636 4.246 10 10 IICE CNc1cc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)c(Nc2ccccc2)c(F)c1N 1858181518 VJCWDDXRMJXKLR-UHFFFAOYSA-N 448.546 4.197 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)n12 1858589266 UIVIMROTXQLYBM-LHHJGKSTSA-N 449.966 4.488 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccccc2C(=O)O)cc1 1865674263 WIGUAHNIPYFLMG-PXLXIMEGSA-N 428.444 4.237 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(O)nc(O)n2)sc(C)c1-c1ccc(Cl)cc1 1865981966 SAHNAXIDCUOCNZ-UHFFFAOYSA-N 433.873 4.007 10 10 IICE Oc1cccc(Br)c1CN[C@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1878709115 DGBYKTACPPLKJT-WBVHZDCISA-N 429.280 4.307 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cc(Cl)cc(Br)c3O)[C@H]2C1 1965931892 KNSKGXFSJCCLNL-CORIIIEPSA-N 431.758 4.153 10 10 IICE COc1ccc([C@H](C2CC2)n2nc(C(C)C)c(C=O)c2I)c(O)c1 2079997851 IRSQUSVJFBFASN-KRWDZBQOSA-N 440.281 4.137 10 10 IICE COc1ccc([C@@H](n2nc(C3CC3)c(N)c2I)C2(C)CC2)c(O)c1 2080011737 FGTMTZFPAQXECL-MRXNPFEDSA-N 439.297 4.051 10 10 IICE CC[C@@H](NC1CC(COC)(NC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2152880153 WUDVDWYEBVQCAW-CZDRUDQFSA-N 443.382 4.268 10 10 IICE COc1ccc(Br)c(CNC[C@H]2N(C(=O)OC(C)(C)C)CCC2(C)C)c1O 2236044619 OYCAWOADOHPUFV-MRXNPFEDSA-N 443.382 4.289 10 10 IICE COCCCN1C(=O)C(=Cc2cc(C)n(-c3cccc(Cl)c3)c2C)C(C(=O)OC)=C1C 2293270296 CIILMWMGZOMODV-UHFFFAOYSA-N 442.943 4.457 10 10 IICE CCCCCN1C(=O)C(=C2SC(=S)N(C)C2=O)c2cc(Br)ccc21 2296713457 CTSWTHUZMRWWGW-UHFFFAOYSA-N 425.373 4.187 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2352636922 HRWCAYINKKJULI-CQSZACIVSA-N 429.355 4.019 10 10 IICE CCC[C@H](CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352943228 QBJKEGUBIIMYLX-CQSZACIVSA-N 429.355 4.020 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2380752029 QTAOMXRGYQLOIL-KBPBESRZSA-N 441.366 4.019 10 10 IICE COC(=O)c1ccc(/C=C2\N=C(c3ccccc3F)N(c3ccc(OC)cc3)C2=O)cc1 6645167 DUOLCHUCYLSRJB-JCMHNJIXSA-N 430.435 4.455 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3cccs3)SC2=S)cc1 15047096 LQBDVQWVNUUXLE-IEMQHYRPSA-N 446.575 4.153 10 10 IICE O=C1OC(c2ccc(Cl)cc2Cl)=N/C1=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1 15912215 ZRTSFEMZPMDRGH-SXGWCWSVSA-N 448.262 4.083 10 10 IICE Cc1cccc(N2C(=O)N=C(O)/C(=C\c3cccc(I)c3)C2=O)c1C 59860125 HHVMPDXKLGQLSX-XNTDXEJSSA-N 446.244 4.415 10 10 IICE COc1ccc(N2CCN(c3nc4c(-c5ccccc5)nnn4c4ccccc34)CC2)cc1 67263336 TXDHKSCNLJXBSU-UHFFFAOYSA-N 436.519 4.280 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)NC1CCN(c3ccc(OC)cc3)CC1)O[C@@H](C)C2 207253413 DPGWCIFGPWUITF-CXKPLTABSA-N 436.552 4.216 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3cccc(C(C)C)c3)n2)cc1 743045865 CICDFSYPCBQAOH-UHFFFAOYSA-N 443.594 4.413 10 10 IICE O=C(CCCn1ccc2cc(Cl)ccc21)NCc1ccc(N2CCC(O)CC2)c(F)c1 760381345 HNUVRBRHTQOPJF-UHFFFAOYSA-N 443.950 4.492 10 10 IICE COc1cc(NC(=O)NCc2cc(Br)ccc2O)ccc1Br 806325748 ILKOVQMBSYAPNQ-UHFFFAOYSA-N 430.096 4.248 10 10 IICE CC(=O)Nc1ccc(F)c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c1 920598958 KIJBCMNCWUZARQ-UHFFFAOYSA-N 426.419 4.370 10 10 IICE COc1ccc2cc(/C=C3/SC(=S)N([C@@H](C(=O)O)C(C)C)C3=O)c(Cl)nc2c1 1081155521 PKTBUNATOUCKBJ-KEQVLUGWSA-N 436.942 4.207 10 10 IICE CC(C)CCCCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1125313604 XCUDAJSCTSHFBL-UHFFFAOYSA-N 427.568 4.165 10 10 IICE COC(=O)c1nnn(-c2ccccc2)c1NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1130002093 NPJHFRFIJJCXQI-UHFFFAOYSA-N 449.898 4.367 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cnc2ccccn12 1130651450 OREXYASLINHLGE-SDNWHVSQSA-N 428.564 4.016 10 10 IICE CC1(C)CO[C@H](CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1 1134542302 PLEQDPBDZTWWHL-CQSZACIVSA-N 429.318 4.303 10 10 IICE Cc1ccc(C(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1136272651 QOKARRMKKMFTFC-UHFFFAOYSA-N 439.556 4.344 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)[C@H](C)C2)cc1 1136571707 BBWQJPGLHZYIGS-GOSISDBHSA-N 449.526 4.371 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@]3(C)C[C@@H](NC(=O)OC(C)(C)C)CCO3)cc2)CC1 1136705125 BPBVETZUBBVMKW-CPJSRVTESA-N 445.604 4.002 10 10 IICE CC[C@H](CO)NC(=O)Cc1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1137440568 YGFNCNKSFDLJED-OAQYLSRUSA-N 433.552 4.084 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2COC(=O)N2CCC[C@@H](C)C2)c(C)n1-c1ccccn1 1157242976 LLERELPVUWFPTK-WIYYLYMNSA-N 438.572 4.352 10 10 IICE Cc1cc(C(=O)N2CCN(C3CC3)C[C@H](C)C2)c(C)n1-c1ccccc1Br 1160000811 ISOWKXYVMBMWHN-HNNXBMFYSA-N 430.390 4.413 10 10 IICE COc1cc(N2CCC[C@@H]([C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1186469720 FQZBGMXQJFSTOU-CVEARBPZSA-N 435.521 4.085 10 10 IICE COc1cc(N2CCC[C@@H]([C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1186469724 FQZBGMXQJFSTOU-HZPDHXFCSA-N 435.521 4.085 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c(C)n1-c1ccc(Cl)cn1 1189005453 VFGUIRNEJPCVAE-CGWBUNPUSA-N 442.947 4.072 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3Cc4ccc(C)c(Br)c4C3)C2)cc1 1230300916 MMTFXYGFCHOHBC-MRXNPFEDSA-N 444.373 4.318 10 10 IICE Cc1cc(CNC(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1254080311 UNGRSKYHPBWEHW-HXUWFJFHSA-N 440.588 4.493 10 10 IICE Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1264738061 MRMNKWQZFNBPLV-OAQYLSRUSA-N 427.548 4.294 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)C[C@H]2CC)n1Cc1ccc(N(C)C)cc1C 1292020487 HYSQEDUWJIGBBN-LAUBAEHRSA-N 440.636 4.244 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2conc2C2CCCC2)NC(=O)OC(C)(C)C)cc1 1293793079 LCEWIXIMXPBVTJ-HXUWFJFHSA-N 442.560 4.394 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](ONC(=O)OC(C)(C)C)C(C)C 1299596769 OFXAXTMWHZKIEJ-OAQYLSRUSA-N 443.544 4.117 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1302008353 MNTVFPMMVWBLKQ-GOSISDBHSA-N 447.599 4.128 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCN1C[C@H](C)C[C@@H](C)C1 1306078110 IINIWKHLMFTQOE-FGZHOGPDSA-N 438.664 4.445 10 10 IICE CC/C=C\Cn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1306490283 IDBZCEFYYMKQJL-ZLOHZDAMSA-N 441.576 4.357 10 10 IICE Cc1cc(Br)ccc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1355130765 NNHSNTIEOCTZEU-HOTGVXAUSA-N 449.364 4.369 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccco2)N(C)C)c(C)n1-c1cccc(Br)c1 1440550330 CBLWHNHQJMVVLX-IBGZPJMESA-N 430.346 4.482 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(-n2cc(C)cn2)c(F)cc1N 1445655953 RBVVWQSOGCVFKP-UHFFFAOYSA-N 447.308 4.032 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C(C)(C)Oc3cccc(Cl)c3)cc2F)CC1 1456126420 DTBWLOJIDDYCMA-UHFFFAOYSA-N 433.955 4.095 10 10 IICE COc1cc(N2CCN(C(=O)Cc3csc4cc(C)sc34)CC2)cc(OC)c1OC 1458759869 AOSCGKAYSGFZDQ-UHFFFAOYSA-N 446.594 4.188 10 10 IICE CN(C)c1ccc2c(c1)OCCN2Cc1cc(Cl)ccc1I 1459875518 LHBZCKKJGMFWJH-UHFFFAOYSA-N 428.701 4.410 10 10 IICE CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(C)n(-c2ccccn2)c1C 1466158952 AUQLRTCOYGMGOL-QFIPXVFZSA-N 432.568 4.321 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCN(c4ccc(Cl)cc4Cl)C3)C2)cc1 1470026520 PTHYDRCEZKBCGA-IAGOWNOFSA-N 449.382 4.159 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCc1ccc(Cl)s1 1499154434 RCCPMLYGHNZGHT-UHFFFAOYSA-N 449.983 4.272 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@H]1C 1502259100 IIJYZGPSPHSWFN-NHCUHLMSSA-N 438.664 4.352 10 10 IICE CNC(=O)[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC1(C)C 1503701956 BEDGZCASQRGTCR-XLIONFOSSA-N 448.615 4.217 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC(C)(C)C1 1512379771 OICUONMZBCHFKA-LJQANCHMSA-N 425.621 4.333 10 10 IICE Cc1c(Br)cncc1C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1520962934 YVINXUXHUNCDLS-UHFFFAOYSA-N 430.268 4.423 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(Cc4ccccc4)s3)cc2F)C[C@@H](C)O1 1526003681 RORGVUINPQTTCY-CALCHBBNSA-N 439.556 4.417 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@H]1Cc1ccccc1 1531792459 JMCXKAHXUJBEDY-WMXHQWKFSA-N 440.565 4.164 10 10 IICE C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N[C@H]4CCCC[C@@H]43)c2C(=O)OC(C)(C)C)C1 1539725179 QIXLXCLMCHHDMI-SRABZTEZSA-N 446.613 4.462 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541443744 BVNURTZTXOYEPC-RTWAWAEBSA-N 439.648 4.216 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccc(N4CCOCC4)cc3)n2CCC(C)(F)F)o1 1542301809 VLZFTJHSMPMDPQ-UHFFFAOYSA-N 445.514 4.365 10 10 IICE Cc1ccc(-c2nnc(N(C)CCOC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)o1 1542310619 WYQOFOXOOFTKIX-UHFFFAOYSA-N 429.540 4.351 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3c(C)nc4c(c(C)nn4C)c3C)c2C)c1 1544078742 BYBRRNPMXIIZMI-UHFFFAOYSA-N 429.568 4.468 10 10 IICE O=S1(=O)CCCN1CCSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 1559328837 ONDYQDXOGOBMAL-UHFFFAOYSA-N 448.013 4.379 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2C)cc1 1567596459 MDDUXZXZBJDWQY-VWLOTQADSA-N 447.579 4.124 10 10 IICE C=CC(=O)N1CCC(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)(c2ccccc2)CC1 1585540246 IBXUYVQSNAZOGF-UHFFFAOYSA-N 445.607 4.286 10 10 IICE C[C@H](CCC(C)(C)C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1586439741 LMUFQNIMPYTPNS-CQSZACIVSA-N 449.529 4.046 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)cc1 1587811189 VTJAUAKYGGFUJQ-VWLOTQADSA-N 444.510 4.228 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1598121716 WLDQBBJXRDCRRN-QZTJIDSGSA-N 429.521 4.243 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1615380558 CLIPFYYCPYYEAL-XZOQPEGZSA-N 441.620 4.275 10 10 IICE COC(=O)c1cn([C@H]2CCCN(C(=O)c3cc(C)n(-c4cccc(C(C)C)c4)c3C)C2)nn1 1624643632 GNJLFCHZYFGUNS-NRFANRHFSA-N 449.555 4.073 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc4c(c3)CCN(C(=O)OC(C)(C)C)CC4)ccc21 1625847856 JUTPOVZKUDPBCM-UHFFFAOYSA-N 449.595 4.335 10 10 IICE Cc1cccc(OCCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1628491886 ZWYAAVKOTBZFNR-QFIPXVFZSA-N 441.572 4.212 10 10 IICE Cn1cccc1[C@@H]1CCCN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1628950789 LDDIJABERSBDHY-OGBKAESYSA-N 443.569 4.119 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)Cc1ccccc1OC 1631147808 ATZWVQNVQWKJFA-OAQYLSRUSA-N 434.536 4.173 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Cc1ccc2c(c1)OC(F)(F)O2 1631166194 DGURRPOLFKEPQJ-UHFFFAOYSA-N 428.229 4.067 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2Cc3ccc(Cl)cc32)NC(=O)OC(C)(C)C)cc1 1634161862 DXBQGUIRKISXAK-SFTDATJTSA-N 443.975 4.428 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3cc4c(cc3OC(F)F)OCO4)c2C)cc1 1636221221 VQAOPLXVOABVIB-UHFFFAOYSA-N 444.434 4.363 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 1638348518 SXALCNCCAUKFHW-AEFFLSMTSA-N 440.540 4.464 10 10 IICE CCS[C@@H]1CCCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 1644583993 JPCPJYOQXLMBHN-SJLPKXTDSA-N 436.577 4.397 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](c3ccccc3)C3CCC3)cc2F)C[C@@H](C)O1 1644930818 VCQABFUCIFDHDA-ANSQWYIGSA-N 439.575 4.187 10 10 IICE COc1cc2c(c(OC)c1)N(Cc1noc(Cc3ccc(Br)cc3)n1)CCC2 1654741171 DPWRHTGXYNDPED-UHFFFAOYSA-N 444.329 4.393 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)c1C 1656252941 TYSAANKQXXYEGN-RUZDIDTESA-N 433.483 4.192 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1cccc(COC[C@@H]2CCCO2)c1 1673743466 FAURISSFKDBUDI-CPJSRVTESA-N 439.600 4.187 10 10 IICE C[C@@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc2c(c1)CCCC2 1681412716 GQKYXHLZLJIMFI-MRXNPFEDSA-N 429.511 4.241 10 10 IICE Cc1cccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1682025050 ZNELMNMGKSYYDW-WIYYLYMNSA-N 429.992 4.288 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H]3COc3ccc(Cl)cc3)C2)cc1 1682188007 DBZZAKLJKAFAHD-GHTZIAJQSA-N 443.975 4.428 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)N(C)C)cc1 1684890314 WCXMOXOHANAUFU-ZLNRFVROSA-N 445.007 4.228 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](c3ccc(C)cc3)c3ccccn3)C2)cc1 1686356410 YGSIZBVHUJAYFB-NBGIEHNGSA-N 430.552 4.314 10 10 IICE COCC(C)(C)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1730433104 CRPCAYYSLGHJJB-UHFFFAOYSA-N 436.604 4.193 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)cc1C 1743605964 FSMOYCGTSQVCPA-QOKNQOGYSA-N 439.526 4.370 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1occc1C 1761878908 RJBVPUDCVFBMKY-MRXNPFEDSA-N 427.524 4.216 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(Cc2ccccn2)n1CCOC(C)(C)C 1768651129 GTDWFHRXPPTUIN-UHFFFAOYSA-N 448.615 4.316 10 10 IICE CN1CCN(c2ccc(N3C(=O)/C(=C\c4c[nH]c5ccccc45)SC3=S)cc2)CC1 1860085751 XVMDLASVTHSQBL-KGENOOAVSA-N 434.590 4.326 10 10 IICE CCCCOCCCN1C(=O)C(NC(C)C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873166520 BRNVIHLTTPFPNG-UHFFFAOYSA-N 437.584 4.379 10 10 IICE Cc1nn(-c2ccccc2)c(Cl)c1C=C1CCn2c1nc1cc(C(=O)O)ccc1c2=O 2040461252 GVTJKKPVGZVFEN-UHFFFAOYSA-N 432.867 4.187 10 10 IICE COc1ccc(Br)c(CNC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C(C)C)c1O 2236054367 HPPXQFHYCOBGHV-BBRMVZONSA-N 445.398 4.438 10 10 IICE Brc1cc(CNC2CCC2)ccc1N1CC2(CN(Cc3ccccc3)C2)C1 2240022883 ZAKBEYQAFRGABN-UHFFFAOYSA-N 426.402 4.413 10 10 IICE CCN1C(=O)C(=Cc2cc(C)n(-c3ccc(OC)c(Cl)c3)c2C)C(C(=O)OC)=C1C 2294037433 DHDCBYNHJABLLN-UHFFFAOYSA-N 428.916 4.449 10 10 IICE CCOc1ccc(C=C2SC(=S)N(NC(=O)c3cccc(Cl)c3)C2=O)cc1OC 2296052889 PITCWEHHMPLGKJ-UHFFFAOYSA-N 448.953 4.294 10 10 IICE Cc1ccc(OCCOCCOc2ccccc2C=C2SC(=S)NC2=O)cc1C 2297306586 ORGGMQUEWPRJMG-UHFFFAOYSA-N 429.563 4.267 10 10 IICE O=C(O)C[C@H](C(=O)O)N1C(=O)C(=Cc2c3ccccc3cc3ccccc23)SC1=S 2314842312 NRVRHHJXLDQJFI-QGZVFWFLSA-N 437.498 4.122 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(c3ccc(O)cc3)C2=O)cc1 2321569839 BUKXYCVAZSCIEJ-UHFFFAOYSA-N 442.562 4.045 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1Cl)N2)N1CCOCC1 14466050 VPUUIAYDDUFWLK-PNLZDCPESA-N 430.957 4.187 10 10 IICE CN(C)c1ccc(CNC(=O)C2CCN(c3nccnc3Sc3ccccc3)CC2)cc1 33168638 UTWMGGPICCHWJM-UHFFFAOYSA-N 447.608 4.227 10 10 IICE COc1cc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)ccc1OC(C)C 33337794 HVQXVNPBATVIQY-LDADJPATSA-N 428.535 4.029 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1\C(=O)N(c2ccc(C)c(Cl)c2)C(=O)N=C1O 34799399 KLFPUQDSVWYCRI-AUWJEWJLSA-N 430.844 4.181 10 10 IICE CCCN1C(=O)/C(=C\c2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)SC1=S 39835672 PXQRIUQCGSENDY-FOWTUZBSSA-N 441.509 4.237 10 10 IICE COCCOC(=O)c1ccc(N[C@H](c2ccccn2)c2ccc3cccnc3c2O)cc1 54620232 RKFACNWFAIYJBQ-QHCPKHFHSA-N 429.476 4.340 10 10 IICE CCOC(=O)Cc1sc(NS(=O)(=O)c2ccc(OCC)cc2)nc1-c1ccccc1 71556436 KQKSSXYRAUDQFR-UHFFFAOYSA-N 446.550 4.115 10 10 IICE COCCN1C(=O)/C(=C/c2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)SC1=S 96935911 XURUCHCVMWGNRZ-YVLHZVERSA-N 447.607 4.292 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(OC)c(OC)c3)[C@H]2c2ccc(O)c(O)c2)cc1 526216163 HDGOVWIVJJXULH-HSZRJFAPSA-N 449.459 4.181 10 10 IICE COC(=O)/C=C/c1ccc(NC2CCN(c3ccc(OC(F)F)cc3)CC2)c([N+](=O)[O-])c1 726595185 YOTWHVVQGPZAIN-YCRREMRBSA-N 447.438 4.463 10 10 IICE NC(=O)c1ccc(N2C(=O)/C(=C\c3cccc(OCC(F)(F)F)c3)SC2=S)cc1 726627111 KCYKDNPJOSPOND-OQLLNIDSSA-N 438.452 4.132 10 10 IICE CC(=O)Nc1cccc(F)c1C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 734197097 QEBVQZWSYJZIIR-UHFFFAOYSA-N 426.419 4.370 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741216803 MSCIIJSHKCTEQC-NHCUHLMSSA-N 448.485 4.214 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1 741897931 DQPGPQPNKXFBLT-XZOQPEGZSA-N 432.520 4.449 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc([C@@H]2CCCOC2)c1 766358392 RMFKVSOMNNKWFP-HXUWFJFHSA-N 448.485 4.366 10 10 IICE COc1cc(Br)cc(CN2CCC(Oc3ccc(F)cc3F)CC2)c1O 768902220 BBCWEOBEAHSPPA-UHFFFAOYSA-N 428.273 4.485 10 10 IICE COC(=O)c1cc(NC(=O)NCc2ccc(N3CCCC3)cc2)ccc1Br 775383981 RVBNQOJTUVWXHJ-UHFFFAOYSA-N 432.318 4.158 10 10 IICE Cc1nc2c(s1)[C@@H](NC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CCC2 780821140 OTKPBQVYXDTFRS-KSMMKXTCSA-N 432.565 4.081 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)Nc1cc(F)cc(Br)c1F 786480286 VBAVXXABDJEHAW-UHFFFAOYSA-N 444.251 4.025 10 10 IICE C[C@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1ccc(Br)cc1O 797103759 NVQNHJVTOBWCFN-NSHDSACASA-N 426.742 4.092 10 10 IICE O=C1N[C@H](Cc2cccc(Cl)c2)C(=O)N1[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804174533 GLFKBORFZXCWHY-PKOBYXMFSA-N 449.885 4.073 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)/C=C\c3ccc(Br)o3)cc2F)C[C@@H](C)O1 917709422 IADAURYTEFPHDY-SJOWAIJRSA-N 437.309 4.124 10 10 IICE COC(=O)COc1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1128490149 POSMHLGDUSAWEO-MRXNPFEDSA-N 430.932 4.058 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc2ccccc12 1133626756 XJISWRJUFQFIED-UHFFFAOYSA-N 429.564 4.136 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCNC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1191581691 IHTYYGAIUJMVIL-NQIIRXRSSA-N 444.597 4.237 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@@H]3C)n2CCOC(C)(C)C)c(C)n1-c1ccccc1 1289360075 CBNITRVYBIXHCU-IBGZPJMESA-N 437.588 4.393 10 10 IICE CCOC(=O)CN(CCc1ccccc1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1292895797 AQOLGQMLMDEGKZ-UHFFFAOYSA-N 432.520 4.155 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCN(C)C(=O)OC(C)(C)C 1297228997 XPJYMWHROLXAQN-UHFFFAOYSA-N 449.592 4.022 10 10 IICE CN(Cc1ccc([S@@](C)=O)cc1)c1nnc(C2CC2)n1CCCSc1nccs1 1298322092 XUAFEQAQWHWTSS-GDLZYMKVSA-N 447.655 4.168 10 10 IICE Cc1cccc(-c2nnc(N(C)CCC(F)(F)F)n2Cc2ccc(N(C)C)cc2C)n1 1304458130 JBZBQDNQPAKLGE-UHFFFAOYSA-N 432.494 4.460 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3cc(F)c(C(F)(F)F)cc3F)CC2)cc1F 1312650754 SKQDXCSWGNPUPP-UHFFFAOYSA-N 447.379 4.163 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(I)ccc1F 1352614989 JRHZFGUXICFXAZ-UHFFFAOYSA-N 438.284 4.303 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)c(C)n1-c1ccccc1 1435798292 STFLUHOVJHESRT-QFIPXVFZSA-N 439.918 4.351 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc([C@@H]3CCCN3C)[nH]n2)cc1 1465006413 NAFSBLCEWMBGHB-DEOSSOPVSA-N 433.556 4.098 10 10 IICE COC(=O)c1coc(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1 1470685407 LTEWHFJBKLAHBS-UHFFFAOYSA-N 431.286 4.166 10 10 IICE CCOCc1nnc(N(C)[C@H]2C[C@@H](OCC)C23CCC3)n1Cc1ccc(N(C)C)cc1C 1503005786 BQGBKBPHLQAFRS-FCHUYYIVSA-N 441.620 4.021 10 10 IICE CC(=O)c1nc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)sc1C 1522445177 KYSDWWXSBGQCND-NTEUORMPSA-N 449.554 4.023 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)CCC(=O)NC(c1ccccc1)c1ccccc1 1532655921 ODMGSOBLZRDHMP-UHFFFAOYSA-N 443.547 4.164 10 10 IICE Cc1cc(CNC(=O)c2cc(Br)cnc2N(C)C)c(C)n1-c1ccccc1 1535142760 DJVLVYXCPGVQOY-UHFFFAOYSA-N 427.346 4.248 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1 1538717643 CEIKZEIEBVTTRD-UHFFFAOYSA-N 431.583 4.485 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(c4ccccc4C)CCCCC3)CC2)cc1 1542432014 OWSQABZANRKHAG-UHFFFAOYSA-N 435.612 4.144 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCO[C@@H]1CCOC1 1547083859 OACMIZOEJNWCKQ-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCOc1cc(NC2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)ncn1 1556119280 AXRFIVVOPWJJEE-UHFFFAOYSA-N 433.556 4.308 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C2)CCCC1 1557184950 WJAYRLJPVQHGQG-LAUBAEHRSA-N 440.584 4.355 10 10 IICE Cc1cccc2c(=O)n(CC(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)cnc12 1566846329 RPZCFGVBZNFEPN-LJQANCHMSA-N 427.504 4.201 10 10 IICE Cc1cc(C(=O)NC[C@H](O)COc2ccc(F)c(F)c2)c(C)n1-c1ccc(Cl)cc1 1588202328 DCKGNLSDANEYSL-KRWDZBQOSA-N 434.870 4.195 10 10 IICE CCC[C@@H](Cn1c([C@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1614395727 XBXRCHILPNKUQQ-MJGOQNOKSA-N 433.572 4.081 10 10 IICE COCc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1625485484 RLVSLQMYWPMNFH-UHFFFAOYSA-N 428.330 4.328 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2CC[C@@H](Nc3ccccn3)CC2)cc1 1627204640 DGFALNPYVSZBAY-AOHZBQACSA-N 436.600 4.326 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(Cc2cccc(Br)c2)C2CCOCC2)cc1 1632999550 SULKFTLKYIVMPV-UHFFFAOYSA-N 445.317 4.433 10 10 IICE COCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc(-n2c(C)ccc2C)cc1 1637096037 BWTRPYBHUXNGLK-JOCHJYFZSA-N 441.572 4.192 10 10 IICE C[C@@H](NC(=O)C1(Nc2ccccc2)CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O 1642824222 LXGWLQZRIUUXAQ-GOSISDBHSA-N 439.556 4.451 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCC[C@@H]3C(C)(C)C)cc2F)C[C@@H](C)O1 1653758529 DJJAFOSOCRSQPF-HROGELHOSA-N 433.612 4.250 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N(C)Cc2ccccc2O)sc2c1CC[C@@H](C)C2 1657599118 DILOAXKSVSBPOB-HUUCEWRRSA-N 430.570 4.214 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCCC[C@@H](NC(=O)OC(C)(C)C)C1 1683425254 NEZPSZIUSQNJHK-PZJWPPBQSA-N 446.636 4.471 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(CCc3ccccc3)Cc3cccnc3)C2)cc1 1683782638 RQLLQQLSKKTSEX-QHCPKHFHSA-N 430.552 4.123 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694024498 HSIZZLIPFCMVHY-HKUYNNGSSA-N 429.584 4.176 10 10 IICE CCOC1(Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CCCC1 1710491882 GURRPPMHSMWNEK-UHFFFAOYSA-N 445.583 4.225 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(COC)CC1 1726798148 ATMKOVBRMIKPCT-AREMUKBSSA-N 449.599 4.297 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](C)N(CC)CC 1726982567 BGIMTTNFWSNRAU-NHCUHLMSSA-N 442.652 4.247 10 10 IICE C[C@H]1CCCN([C@@H](C)Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1762883763 HIYLLKSRSTVHTJ-OALUTQOASA-N 439.629 4.393 10 10 IICE CCC[C@H](C)CN(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1765496179 XOWJVTFQGQQUSH-UGKGYDQZSA-N 425.621 4.475 10 10 IICE CCC[C@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765503423 GAANDIMROHYNTF-IBGZPJMESA-N 427.637 4.457 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1 1767539983 XLMLPJNJTLQHII-SFHVURJKSA-N 448.615 4.361 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCN(C(=O)C(C)C)CC1 1772876965 CBGHLNWCAJVVMM-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)c(CCC(=O)O)s2)cc1 1858035324 XIEXMPVSOFDZBB-UHFFFAOYSA-N 446.550 4.199 10 10 IICE COC(=O)c1c(NC(=O)Cc2ccc(S(C)(=O)=O)cc2)sc(C)c1-c1ccccc1 1866209030 LWRINZYGBRMGNW-UHFFFAOYSA-N 443.546 4.095 10 10 IICE COc1ccc(CNC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(C(C)C)C2=O)cc1 1873166576 RZXAVMDVLFPKEI-UHFFFAOYSA-N 443.547 4.381 10 10 IICE CC(C)(C)OC(=O)NC1(C[C@@H](N)c2ccccc2O)CCN(Cc2ccccc2)CC1 1942393370 PPEYEEYNRRLMIU-OAQYLSRUSA-N 425.573 4.342 10 10 IICE CCOC(=O)c1c(C2CC2)nn([C@H](C)c2ccc(C)cc2O)c1I 2078991637 CMSDFOAKNUGELY-LLVKDONJSA-N 440.281 4.165 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@H]3CCC[C@@H]23)c1O 2236050673 JAWQSXRGOLRCQP-MAZHCROVSA-N 441.366 4.041 10 10 IICE CSc1ncc(CNc2ncc(C(F)(F)F)cc2I)s1 2284631753 XYPBSAVBCJPPLB-UHFFFAOYSA-N 431.246 4.496 10 10 IICE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=O)N(C)C(=O)N(c3ccccc3)C2=O)o1 2313560140 KUMCXNYXDZIJAR-UHFFFAOYSA-N 431.404 4.172 10 10 IICE CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380759049 LDVLOHYERBMHDP-WBMJQRKESA-N 443.382 4.361 10 10 IICE CCc1ccc(Cc2cnc(NC(=O)CCN3C(=O)[C@H](CC)SC3=S)s2)cc1 11635824 FECBVLAMHPBFPS-INIZCTEOSA-N 433.624 4.264 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478056 AQVIQLTVKYNCGI-PNLZDCPESA-N 427.526 4.452 10 10 IICE NS(=O)(=O)c1ccc(-c2ccc(/C=C3\SC(=S)N(C4CCCCC4)C3=O)o2)cc1 33406376 MATVVGLEIFLMTC-PDGQHHTCSA-N 448.591 4.128 10 10 IICE C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1Cc1ccc(N(C)C)cc1 98080421 OPKOKADZGCMIDU-OAHLLOKOSA-N 425.514 4.025 10 10 IICE C[C@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)c1nnc(-c2cccs2)o1 745884836 ILAXJAIAMYHEIZ-NSHDSACASA-N 445.456 4.074 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(CN2CCOCC2)cn1 774091800 XTTBYQNLQVGNAC-FQEVSTJZSA-N 431.536 4.023 10 10 IICE COCc1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)co1 775074562 JVOFSVMETDFTQF-UHFFFAOYSA-N 447.285 4.031 10 10 IICE CCCN(CCC)c1ccc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)cc1 814285945 SKSLEIKQHOCFOT-UZYVYHOESA-N 447.670 4.237 10 10 IICE COCc1ccccc1COC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1127470194 NMLNMCPJKJOPHO-XDHOZWIPSA-N 445.537 4.307 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1csc(Nc2cc(F)cc(F)c2)n1 1141901915 SDGQAPSNPJESQC-UHFFFAOYSA-N 448.470 4.071 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]2C)c1 1152644579 SRKNPRZOKWWIDL-ROUUACIJSA-N 439.556 4.377 10 10 IICE CCc1nn(C)c(OC)c1CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1152664495 RZDNIVKZADPKMP-UHFFFAOYSA-N 445.361 4.091 10 10 IICE Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)n[nH]1 1155726908 NSZDFJKFZREETI-AWEZNQCLSA-N 440.979 4.247 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](CCNC(=O)OC(C)(C)C)C(F)F 1159012100 LYGUVTUDSMALOM-GOSISDBHSA-N 449.498 4.185 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1 1162539306 AASKQNGKVBHRDE-SFHVURJKSA-N 434.492 4.133 10 10 IICE CN(C)c1ccc2c(c1)OCCN2[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O 1168860308 XAJNBNKKBYYFSN-FQEVSTJZSA-N 433.474 4.161 10 10 IICE CN1CCC[C@H](c2cccc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2)C1 1182951937 NMWXTBGNWIJMJW-NZQKXSOJSA-N 442.003 4.249 10 10 IICE CCCC[C@@H]1NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1=O 1189415739 AYNIVURTCVGFLM-SFHVURJKSA-N 435.446 4.406 10 10 IICE CC(C)CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cccc(O)c1 1191304990 FACGNDQWOOEITD-UHFFFAOYSA-N 428.488 4.269 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4cc(F)cc(F)c4)CC3)C2)cc1 1230300338 DAHXCKIKLPBDCY-LJQANCHMSA-N 443.538 4.464 10 10 IICE CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1235243234 LRXILQXCEIKOHS-RPWUZVMVSA-N 439.600 4.239 10 10 IICE CCCN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1CCc2ccccc21 1251750839 PNXWPEZUXMXSEI-JOCHJYFZSA-N 429.511 4.411 10 10 IICE C[C@H](NC(=O)[C@H]1CCc2cc(Br)ccc21)c1ccc(N2CCOCC2)cc1 1264822416 QEDYRHODKRNNFX-BTYIYWSLSA-N 429.358 4.193 10 10 IICE CC(C)CN(c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1287706951 NZKKLDPFZINPQJ-NRFANRHFSA-N 443.661 4.254 10 10 IICE O=C([C@H]1CCOc2ccc(Br)cc21)N(Cc1ccccc1O)C[C@H]1CCCO1 1295406134 PIEBZKWKOWGIOR-MSOLQXFVSA-N 446.341 4.229 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)CCc2cccs2)cc1 1295414774 KVHXAPQCHRGANJ-UHFFFAOYSA-N 447.612 4.370 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CC=C(C(C)(C)C)CC2)cc1F 1298056182 MMFBIIOASSOTRQ-GOSISDBHSA-N 427.568 4.218 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1 1302669133 OXTGWEUUKLTKSE-JOCHJYFZSA-N 436.629 4.485 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@@H]3C)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1304197095 XQSAPQRUVGHWJM-ICSRJNTNSA-N 448.615 4.456 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccc(OC(F)(F)F)cc3)C2)cc1 1312903353 XVJZKSKZXFVTAM-KRWDZBQOSA-N 437.462 4.262 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CCCCC[C@H]3NC(=O)OC(C)(C)C)CC2)cc1 1355447575 YTWCIZPIJWGSPG-FCHUYYIVSA-N 445.604 4.208 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2c3ccoc3CCN2C(=O)OC(C)(C)C)cc1 1357724378 SQEUVILRQQNUIO-NRFANRHFSA-N 427.545 4.277 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1[C@@H]2CCCC[C@@H]2CCN1C(=O)OC(C)(C)C 1449119923 LJTXSGUXZYAEMN-HLIPFELVSA-N 437.577 4.310 10 10 IICE CN(C)CCCNC(=O)CSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 1458823447 IAIDTBJZGZDPGD-UHFFFAOYSA-N 443.016 4.412 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc(Cn4cc(Br)cn4)s3)ccc21 1464517491 DQGUGKDZNVTCGP-UHFFFAOYSA-N 445.386 4.068 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3[nH]c4ccccc4c3Br)CC2)cc1 1466208361 HDZJRTYCEMXQRU-UHFFFAOYSA-N 428.330 4.292 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 1478322055 FPZRQEPENKFBRX-NRFANRHFSA-N 446.954 4.271 10 10 IICE COc1ccc(N2CCC(NC(=O)C(C)(C)Oc3ccc(Br)cc3)CC2)cc1 1520518662 BOWXDUJPUWADBD-UHFFFAOYSA-N 447.373 4.400 10 10 IICE COc1cc(Br)cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1527058603 XAVYIJIPCOKADI-UHFFFAOYSA-N 436.261 4.485 10 10 IICE COCC1CCC(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 1528456055 UZGNRSVPPFQJEN-ATVHPVEESA-N 438.640 4.051 10 10 IICE C[Si](C)(C)c1ccc(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1528584062 SBJLOXQJZZRRKI-UHFFFAOYSA-N 432.587 4.161 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)oc1Br 1530288184 SMLAEZRXADEMLR-UHFFFAOYSA-N 429.261 4.351 10 10 IICE CC[C@H](Cc1cccc(Br)c1)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1531730120 QNQHCROLGATZGC-IEBWSBKVSA-N 431.374 4.422 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nc(-c2ccc(Cl)cc2)n1 1535558177 KQUBWPBJWYSLQQ-KRWDZBQOSA-N 436.943 4.433 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)CCC(F)(F)F 1542227314 YYIZSROHDZUBRI-UHFFFAOYSA-N 432.494 4.075 10 10 IICE Cc1cc(CCNC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)c(C)n1-c1ccccc1 1543594150 PHSCFSGSJVFXGM-UHFFFAOYSA-N 443.507 4.220 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN1CCC[C@@H]1C 1545504122 PCPJILMQHZSTPZ-RTWAWAEBSA-N 440.636 4.001 10 10 IICE CCOc1ccc(N2CCN(C(=O)CN(C(=O)c3ccccc3)c3ccccc3)CC2)cc1 1545931582 NJJDMMDBMIVEIG-UHFFFAOYSA-N 443.547 4.081 10 10 IICE C[C@]1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCCc2ccccc21 1546089986 ASXOABOFUBOAMN-QFIPXVFZSA-N 442.562 4.236 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCO[C@@H]1CCOC1 1547453908 VLZWLKSIZRYUEZ-JOCHJYFZSA-N 437.588 4.394 10 10 IICE C[C@H](C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(I)cc1 1597854480 DIIROCMCXMCNHH-AWEZNQCLSA-N 434.321 4.094 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)COC[C@@H]1CCCO1 1610121325 CDYNOSJPWILAME-ICSRJNTNSA-N 436.474 4.494 10 10 IICE Cc1cc(C(=O)NN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1611128235 BFIJASISAGWQCP-SANMLTNESA-N 444.535 4.330 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccc(F)cc1 1617459307 BILYRVAAGYILML-QFIPXVFZSA-N 433.527 4.197 10 10 IICE Cc1cc(C(=O)NCCc2ccccc2[N+](=O)[O-])c(C)n1-c1ccc(Br)cn1 1626592039 CUYFCJKEIUIHCV-UHFFFAOYSA-N 443.301 4.132 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)NCc3cccc(Br)c3O)CC2=O)cc1 1626821765 FGRZPYHBWYESRA-KRWDZBQOSA-N 445.357 4.167 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc3cncc(Br)c3n2)cc1F 1628770174 ZDNDCVXXIMXKME-UHFFFAOYSA-N 431.309 4.308 10 10 IICE Nc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccnc1-c1ccccc1 1630262889 RCDNMOGIORCXPG-IBGZPJMESA-N 436.943 4.084 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 1630475347 IMRGKVGHCPADCE-NRFANRHFSA-N 435.911 4.095 10 10 IICE COc1cc(CN2CC[C@H](NC(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)cc(OC)c1 1631099588 GXLNDSLMFZNUQW-QFIPXVFZSA-N 433.552 4.116 10 10 IICE Cc1ccnc(-c2n[nH]c([C@@H](C)NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)n2)c1 1634317906 YZNUZGPHYNKUTF-QGZVFWFLSA-N 442.523 4.195 10 10 IICE Cc1cc(C(=O)NC[C@H]2c3ccccc3CN2C)c(C)n1-c1ccc(Br)cn1 1635900841 BFNQZJGWSUVVGQ-FQEVSTJZSA-N 439.357 4.168 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](C)SCC(=O)Nc1ccc(F)cc1 1638239133 HRXDPNDJLGXWPI-SJORKVTESA-N 431.577 4.008 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)c2C)c1 1640867889 IRMSTYXZWPVRQZ-NHCUHLMSSA-N 429.536 4.480 10 10 IICE Cc1cc2nc(NC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)cc(N(C)C)n2n1 1641759437 ZSGOIZLRXLKVRZ-UHFFFAOYSA-N 436.947 4.346 10 10 IICE O=C(NCCN=[S@](=O)(c1ccccc1)C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1644345049 IRTZDLPGVQCDHX-LJAQVGFWSA-N 444.456 4.089 10 10 IICE CC(C)c1cccc(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1644398869 PUWGLGBATNYATI-OALUTQOASA-N 427.564 4.315 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](C)[C@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1644453082 RTQHQJSHCLZDJQ-FDTRYVBHSA-N 439.575 4.139 10 10 IICE O=C(CN1CCNC(=O)[C@H]1c1ccccc1F)Nc1ccc(N=Nc2ccccc2)cc1 1653853681 ZSKVEKLVJSNUFE-HSZRJFAPSA-N 431.471 4.353 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](CC)(C(C)C)C3=O)c2C)cc1 1656276040 DZJOPKHPGYJCKA-XMMPIXPASA-N 425.529 4.032 10 10 IICE CS[C@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1698381466 NXGGKFICTKUKBM-NRFANRHFSA-N 443.661 4.182 10 10 IICE C#CCN(CC#C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@@H]1OC 1705574475 FAEZOGQBAVBMBU-RDGATRHJSA-N 441.579 4.241 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N(C)Cc2ncc(Cl)n2C)cc1 1710026598 LNNYONFYAJVNDU-UHFFFAOYSA-N 444.027 4.394 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1Cc1cc(C(C)(C)C)no1 1711095675 UPFVMCQULOHEPG-LJQANCHMSA-N 425.533 4.196 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)C)C1 1730369713 SQCFBWRLGCGYEW-JOCHJYFZSA-N 437.588 4.393 10 10 IICE Cc1cc(-c2nnc(N(C)CCn3cccn3)n2CCOC(C)C)c(C)n1-c1ccccc1 1742120018 UGYQZKHDNZYJCC-UHFFFAOYSA-N 447.587 4.111 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC(=O)N1 1763807484 XKOZWMSPOLRJOH-FXAWDEMLSA-N 434.588 4.256 10 10 IICE CN[C@H]1C(=O)Nc2cc(N(Cc3ccccc3)C(C)(C)COC)c(Br)cc21 1915488540 XUKIZBMMHFJSBF-LJQANCHMSA-N 432.362 4.093 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C(C)C)c(N)c2I)c(O)c1 2080009271 YIRQZFDBTSNYOL-KRWDZBQOSA-N 441.313 4.297 10 10 IICE CC(C)(C)OC(=O)NC1CCC(CNCc2cc(Br)cc(F)c2O)CC1 2101516791 QOMPXOSPVPNRTJ-UHFFFAOYSA-N 431.346 4.467 10 10 IICE CC[C@@H](Nc1c(CNC(=O)OC(C)(C)C)cnn1C)c1cc(Br)ccc1O 2182887774 QJKOLKKOUKDTCM-OAHLLOKOSA-N 439.354 4.476 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3cnc4ccccc4n3)SC2=S)cc1OC 2296592299 JJOWZSVSSHIYEV-UHFFFAOYSA-N 437.546 4.091 10 10 IICE COC(=O)c1[nH]c2ccc(F)cc2c1C=C1SC(=S)N(Cc2ccccc2)C1=O 2296594480 HIJVAZTUPPBCSN-UHFFFAOYSA-N 426.494 4.495 10 10 IICE CC[C@H](C)[C@@H](C(=O)O)N1C(=O)C(=Cc2c(Cl)nc3scc(C)n23)SC1=S 2323827175 DUGHPUQGNHMQQQ-CPCISQLKSA-N 429.976 4.058 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@@H](Cc1ccccc1Br)NC(=O)OC(C)(C)C 2362981585 PQSHAGLQDSQQPR-OAHLLOKOSA-N 440.342 4.044 10 10 IICE COc1cccc(CN2C(=O)CN(C3CCCCC3)C(=O)[C@H]2c2ccc(N(C)C)cc2)c1 9490833 CPYPHJFDDQVVSS-RUZDIDTESA-N 435.568 4.006 10 10 IICE CC1(C)OC(=O)C(=CNc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)C(=O)O1 14567389 SBCDVLZKTLQTFU-UHFFFAOYSA-N 434.370 4.090 10 10 IICE CCCCOc1ccc(/C=C2\SC(Nc3ccc(O)cc3C(=O)O)=NC2=O)cc1OC 16932975 UXUGNCMSRKZKFF-ODLFYWEKSA-N 442.493 4.360 10 10 IICE COc1cc(/C=C2/SC(N)=NC2=O)ccc1Oc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 33296086 DKUJZALKSVSROU-VIZOYTHASA-N 439.371 4.344 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCCC(=O)Nc3nc(C)cs3)C2=O)c1 35625128 HVZIRDAKUXULTC-XNTDXEJSSA-N 433.580 4.080 10 10 IICE O=C(N[C@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@@H]1CC(=O)N(Cc2ccco2)C1 69260839 RWCHKSPCJPPPRZ-FQRUVTKNSA-N 440.499 4.393 10 10 IICE O=C(N[C@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@H]1CC(=O)N(Cc2ccco2)C1 69260843 RWCHKSPCJPPPRZ-RXFWQSSRSA-N 440.499 4.393 10 10 IICE CCN(CC)c1ccc(CNC2CCN(C(=O)c3ccc(OC)cc3OC)CC2)cc1F 236958126 RAJKTUGSQREMDA-UHFFFAOYSA-N 443.563 4.084 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(-c4nc(=O)cc(C)[nH]4)cc3)ccc21 483324978 MMWUXQDIYYAEHW-UHFFFAOYSA-N 430.508 4.216 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(O)nc3ccc(Br)cc23)cc1 737508149 SEXAKVVMQVYIBH-UHFFFAOYSA-N 428.330 4.479 10 10 IICE COc1cc(N(C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc(OC)c1OC 741798613 HMCOWPOAKGZAIN-UHFFFAOYSA-N 432.826 4.460 10 10 IICE C/C(=C/C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1C(F)(F)F 741915281 SKUNIORCWDXZSV-BBLCHGJFSA-N 445.485 4.127 10 10 IICE Cn1ccc([C@H](NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccc(Cl)cc2)n1 756455742 FAKVCVXGZPSHAG-HSZRJFAPSA-N 428.939 4.053 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2CCCN(c3ncccn3)C2)cc1 772065727 VKYCYDGZCYCZBP-IBGZPJMESA-N 429.528 4.357 10 10 IICE CCC(CC)[C@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 778748800 MMMAJIJMDGVYLK-ILBGXUMGSA-N 442.648 4.002 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)c3cnn(-c4ccncc4)c3C(F)F)ccc21 782622796 BMVRPOGBXQAHHA-UHFFFAOYSA-N 444.397 4.233 10 10 IICE Cc1cc(-n2cccn2)ccc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 789331778 VULPJRHBBCEEKS-UHFFFAOYSA-N 444.583 4.034 10 10 IICE O=C(CSCc1coc(-c2ccccc2)n1)NCc1cc(Br)ccc1O 804733545 SKFOGHPXDQLNQE-UHFFFAOYSA-N 433.327 4.359 10 10 IICE Cc1sc(NC(=O)COC2CCN(C)CC2)c(C(=O)OC(C)C)c1-c1ccccc1 1124859706 OEQXGBMCBMECMQ-UHFFFAOYSA-N 430.570 4.338 10 10 IICE Cc1cc(C(=O)NCCNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1Br 1136453692 RWKCUDFRQUDWEN-UHFFFAOYSA-N 436.350 4.111 10 10 IICE CCOC(=O)CN(CCc1ccccc1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1136634381 BMHHILVNWIDRMW-UHFFFAOYSA-N 446.547 4.084 10 10 IICE O=C(NC[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1)OCc1ccccc1 1139799214 SVNITRHDDIWKES-MRXNPFEDSA-N 440.521 4.091 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)C1(c2cc(Cl)cc(Br)c2)CC1 1142234638 ASIALRRHVRGRCZ-UHFFFAOYSA-N 449.776 4.287 10 10 IICE Cc1cc(C(=O)N2CC[C@@](CO)(C(F)(F)F)C2)c(C)n1-c1ccc(Br)cc1 1154488764 XXJWHIMRJPZCAR-GOSISDBHSA-N 445.279 4.244 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4cc(C)oc4C)C3=O)c2C)cc1 1165621908 UWHQQGSMPUDRDX-RUZDIDTESA-N 433.508 4.262 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](Cc3ccccc3)c3ccccn3)CC2)cc1F 1251416817 FDQQQEGFILLBKL-QHCPKHFHSA-N 434.515 4.045 10 10 IICE Cc1cc(CCNC(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)c(C)n1-c1ccccc1 1253807923 LLFLJAKXGMLQTI-QHCPKHFHSA-N 445.485 4.386 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1COCc2ccccc21 1276417836 GFZBXIRBKUQTNV-PBXDPIQXSA-N 444.603 4.117 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCCC2(F)F)n1 1290597812 KKIQLOOFAKEOEC-LJQANCHMSA-N 444.530 4.307 10 10 IICE Cn1ccc(Nc2nnc(-c3ccc(Cl)nc3)n2CCCSc2nccs2)n1 1298842954 KOGWRKRAHSSKRA-UHFFFAOYSA-N 432.966 4.110 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCC23CCOCC3)c(C)n1-c1ccc(Br)cn1 1302581363 BYNCLLTYTSECBO-INIZCTEOSA-N 432.362 4.188 10 10 IICE Cc1cccnc1[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 1307568331 JIKUTGRGIPJFFY-UZUQRXQVSA-N 441.531 4.479 10 10 IICE CO[C@H]1CCCN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)C1 1315702797 MIIRRQSQTRYDDK-IBGZPJMESA-N 443.642 4.431 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)CSc3ccc(F)cc3)cc2F)CC1 1360091043 BOUVSVKRIOLCQV-QGZVFWFLSA-N 433.568 4.151 10 10 IICE CS(C)(=O)=Nc1cccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1361063304 MMQOXFHXSXNKHA-KRWDZBQOSA-N 437.512 4.046 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1F 1443774538 UYKHCBZEECLSQB-AVRDEDQJSA-N 431.939 4.161 10 10 IICE CC[C@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1C(=O)c1ccc(C)c(O)c1O 1444317961 HBBUIHBKTYJFEC-RBUKOAKNSA-N 426.513 4.058 10 10 IICE O=C(c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1)N1Cc2cccc(O)c2C1 1471355882 YWEDFMHDBINGRN-UHFFFAOYSA-N 428.897 4.002 10 10 IICE COc1ccc([C@H](NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)c2ccco2)cc1 1478834486 VDTMIZUIHJVULD-DEOSSOPVSA-N 435.524 4.308 10 10 IICE CC(C)CCN1CCC(Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)CC1 1509324991 NKIXGIGAPGTXHN-UHFFFAOYSA-N 436.604 4.373 10 10 IICE Cc1nnc(N2CCC(C(=O)c3ccc(O)cc3)CC2)n1CCCSc1nccs1 1511812863 BLVZSOROEOGCKY-UHFFFAOYSA-N 443.598 4.030 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCCNC(=O)[C@@H]2Cc2ccccc2)c1 1523714426 SIFYGAKUGKATEB-QHCPKHFHSA-N 435.955 4.321 10 10 IICE CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1524253377 FFJCMNTUPYKMHL-INIZCTEOSA-N 449.016 4.472 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cc1F 1526015353 NBLHYYANOSWTOE-SFHVURJKSA-N 427.539 4.307 10 10 IICE C[C@@H]1CCC(F)(F)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1540141154 WMFMVOAVQKPHHM-HLVNSREUSA-N 430.567 4.376 10 10 IICE CCCN(CCC)C(=O)CCC(=O)Nc1sc2c(c1C(=O)OC(C)(C)C)COCC2 1540258078 PWCJTJAMLPGLTK-UHFFFAOYSA-N 438.590 4.143 10 10 IICE CCN(CC(=O)Nc1ccccc1OC)C(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1540620210 IGHARVINAWOVCA-UHFFFAOYSA-N 433.508 4.016 10 10 IICE CCOc1ccc(C[C@H](CNC(=O)c2ccc(-n3c(C)ccc3C)cc2)C(=O)OC)cc1 1543972997 ZCEUIUNEKTXMOX-JOCHJYFZSA-N 434.536 4.255 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1c2ccccc2C(=O)OC12CCC2 1545508725 LYJDUJDIAMYHIJ-LJQANCHMSA-N 444.325 4.380 10 10 IICE CO[C@@H](C)c1nc(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2ccccc2O)cs1 1554587771 ZNSXSMXLUAVMOM-HNNXBMFYSA-N 439.541 4.401 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H](C(=O)OCc1ccccc1)c1ccccc1 1564586446 OUIIJPUMKMGPBL-VWLOTQADSA-N 445.563 4.421 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 1565392122 CBYQKUJGGIDQHB-VQTJNVASSA-N 430.593 4.122 10 10 IICE O=C(C[C@@H]1CSc2ccccc2O1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595584392 MZUKCNWAGUBPOG-QZTJIDSGSA-N 432.973 4.070 10 10 IICE Cc1ncc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1596446814 KOJQNTLJZVQMQK-PDICVPPASA-N 435.571 4.059 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2ccc(Br)cc2)n1C 1611431287 MJNBQRCSAYWORO-CYBMUJFWSA-N 429.314 4.227 10 10 IICE CC[C@H](C)c1nnc(N2CCN(CC(C)C)CC2)n1Cc1ccc(N(CC)CC)cc1 1613327875 CEPGXDODGMMETF-NRFANRHFSA-N 426.653 4.464 10 10 IICE CCN1CCN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C[C@H]1C 1615859638 RCADARBUHBYVAZ-MRXNPFEDSA-N 446.621 4.254 10 10 IICE Cc1cc(C)cc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1616786240 FULPORZIWXNZPW-ZCNNSNEGSA-N 427.564 4.023 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N[C@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1616947300 VRVNKLMQJSYRED-QRWLVFNGSA-N 434.005 4.423 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccnn1CCc1ccccc1 1635489126 KCWCZLYOQVJWGH-UHFFFAOYSA-N 448.567 4.128 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3ncccn3)C2)c(C)n1-c1ccccc1Br 1635798646 XGOJMFZZYAUIDA-INIZCTEOSA-N 425.330 4.276 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3ccccn3)nc3ccccc23)N(C)C)cc1 1637004477 BZEIKJBBIZFHKJ-AREMUKBSSA-N 439.563 4.396 10 10 IICE C[C@@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Br)cc1 1637228456 KVGQLFXSSBUXFR-INIZCTEOSA-N 446.389 4.013 10 10 IICE COC(=O)C1([C@]2(O)CCCN(C(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)C2)CCC1 1639505050 FHDZDUGVLBSAPK-DEOSSOPVSA-N 444.959 4.058 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(Br)nn1-c1ccc(C)cc1 1640259893 IIZTZXNQNLOJFW-UHFFFAOYSA-N 435.318 4.065 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(CN(C)Cc2ccccc2)c1 1643245058 IRBPIYISNWLKTF-UHFFFAOYSA-N 446.547 4.230 10 10 IICE O=C1c2ccccc2C(=O)N1CCC1=CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC1 1651814746 KSVCPDLBKPUQEX-UHFFFAOYSA-N 445.397 4.436 10 10 IICE CCN1CCO[C@H](C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)C1 1654198165 RJFLHCQBBHLJEW-FQEVSTJZSA-N 428.533 4.016 10 10 IICE C[C@H](NC(=O)NC1(C2CCN(C(=O)OC(C)(C)C)CC2)CC1)c1ccc(N(C)C)cc1 1681551901 JFFHDWDTPQEXKS-KRWDZBQOSA-N 430.593 4.293 10 10 IICE CC[C@@]1(Cc2ccccc2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1681850263 UYPPHBZVUCBYHK-VWLOTQADSA-N 443.538 4.498 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N(CC(C)C)C(C)C)cc1 1695620730 PQKYKJWVUXLRNN-UHFFFAOYSA-N 440.636 4.279 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1695626394 UICRMJZBNUPYRV-GMAHTHKFSA-N 441.620 4.072 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](F)C1 1697735572 OQXOBFRUVXKXCA-YVHKJVDXSA-N 425.552 4.429 10 10 IICE CC[C@@H](C)c1nnc(N2CC(C)(C)OC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708421147 FGKMGUFPBIWOJU-LJQANCHMSA-N 441.620 4.070 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCC(OC(C)C)CC2)cc1 1710026982 VAELYEDTEYQTBA-NRFANRHFSA-N 441.620 4.070 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752742263 JIEBKHIBZNYLQC-RBUKOAKNSA-N 429.584 4.442 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](c3ccc4c(c3)OCCO4)C3CCCC3)CC2)cc1 1858119811 MJRXFQJHEXJYBX-VWLOTQADSA-N 436.552 4.089 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)Oc2cccnc2NC(=O)Oc2ccc(N)cc2)cc1 1858686571 AFNGGDPJHLUPGM-HNNXBMFYSA-N 436.468 4.079 10 10 IICE CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)COc1ccc(N)cc1 1860077938 FCBOFDSYFAHHJH-UHFFFAOYSA-N 449.507 4.336 10 10 IICE O=C(Cc1csc(NC(=O)C2CCCC2)n1)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1891086952 HABCFVGIMHTJRO-UWJYYQICSA-N 438.597 4.119 10 10 IICE CN[C@@H](c1ccccc1O)C1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1 1942397253 DFNINXQSLFTERE-QFIPXVFZSA-N 425.573 4.212 10 10 IICE CN(C)Cc1nn(Cc2cc(C(F)(F)F)ccc2O)c(C(F)(F)F)c1Br 2079172378 RRICIGGPDJINKM-UHFFFAOYSA-N 446.189 4.499 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2cc(Br)cc(F)c2O)C1(C)C 2105944114 FAKJCPFBZUTBEL-ZDUSSCGKSA-N 431.346 4.419 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)ccc1OC(C)C 2294100503 SGGDCHOJRZGTAV-UHFFFAOYSA-N 428.872 4.111 10 10 IICE CCOC(=O)COc1ccc(C=C2SC(=S)N(Cc3ccccc3)C2=O)cc1OC 2294746229 WJYUWCPIOWPZCW-UHFFFAOYSA-N 443.546 4.039 10 10 IICE COCCN1C(=O)C(=Cc2ccc(OCc3cccc([N+](=O)[O-])c3)cc2)SC1=S 2297349476 XBAFNMOQXNPNHL-UHFFFAOYSA-N 430.507 4.021 10 10 IICE COc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCc1cc2c(cc1Cl)OCO2 2297559573 OBGGDGFEHVFKIR-UHFFFAOYSA-N 449.937 4.487 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc([N+](=O)[O-])c(C)c3)C2=O)cc(OC)c1OC 2321742491 OBCHCSJXGRTUJS-UHFFFAOYSA-N 446.506 4.335 10 10 IICE Cc1ccc(CNC(=O)[C@]2(NC(=O)OC(C)(C)C)CCC[C@H]2C)c(O)c1Br 2381141883 FYAYIETURILUFQ-XCLFUZPHSA-N 441.366 4.163 10 10 IICE Cc1ccc(CNC(=O)O[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381142088 INXBAVCXUVWHQG-AWEZNQCLSA-N 443.338 4.089 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4nc(-c5ccccc5)no4)cc3)CC2)cc1 33278913 BEMYEAMFHRMSIX-UHFFFAOYSA-N 440.503 4.375 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)cc(Br)c1OC(C)=O 103072327 SZCXHXXYFUNKMH-CXUHLZMHSA-N 429.270 4.189 10 10 IICE Cc1noc(C)c1COc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 252013837 UMONOSDXMNMXFZ-JOCHJYFZSA-N 436.508 4.397 10 10 IICE Cc1ccc2c(c1C)OC[C@H]2NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 728310830 PFCADWCSPHRLQY-HXUWFJFHSA-N 449.473 4.092 10 10 IICE O=C(NCc1ccn(C2CCCC2)n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 770098239 JMFJKYJDLSHRSF-UHFFFAOYSA-N 433.503 4.068 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3cccc(C)c3Cl)n2)cc1 776083336 PRZDAINENBHJGX-UHFFFAOYSA-N 449.985 4.251 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)NC(=O)OC(C)(C)C)cc1 796731023 UUQDDACJADCQIB-BQFCYCMXSA-N 443.510 4.413 10 10 IICE CCO[C@@H]1C[C@]2(NC(=O)N(Cc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)C2=O)C1(C)C 804188243 KYDYUXSWMCHPFH-NFHUAXAMSA-N 433.980 4.202 10 10 IICE COC(=O)/C=C\c1ccc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c([N+](=O)[O-])c1 917087283 WNQTTZSARQSLAK-AFGDSCLASA-N 443.475 4.146 10 10 IICE CCc1ccc(-c2csc(NS(=O)(=O)c3ccc(S(=O)(=O)CC)cc3)n2)s1 917859729 WNXLDMCMSAYYIY-UHFFFAOYSA-N 442.609 4.028 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N(CC)CC)c(F)c1)n1nnc(-c2ccc(Cl)cc2)n1 1136729778 PPMVVKAPBYLHEI-IBGZPJMESA-N 444.942 4.246 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(Cl)c(N)c3Cl)cc2F)C[C@H](C)O1 1141901984 VNWHJWFYJZVAGA-RYUDHWBXSA-N 426.319 4.258 10 10 IICE Cc1ccc(N2N=C(Br)C[C@H]2C(=O)NCCCSc2nccs2)cc1 1144322582 WTGZNMHEOAZEBR-AWEZNQCLSA-N 439.404 4.037 10 10 IICE CC[C@H]1c2ccc(OC)c(OC)c2CCN1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1230859277 VMLXEXHQXCTIQI-VGSWGCGISA-N 439.556 4.010 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H](Cc1ccccc1)c1ccccn1 1256099954 XRZCRGVNKWGBKN-AREMUKBSSA-N 444.579 4.074 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@]2(C)Cc2ccc(F)c(F)c2)N(C)C)cc1 1256237235 VFFWZYXXXDKIIM-ZCYQVOJMSA-N 444.570 4.440 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1C[C@H](c2ccccc2)C1 1297207797 BNEJOHZILCEKLU-JDVBLMHDSA-N 440.565 4.479 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CC[C@H](C)N2CCCCC2)n1 1304455100 CJCGJBOELPWHAV-FQEVSTJZSA-N 434.588 4.255 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCCS(=O)(=O)c1ccc(Cl)cc1 1352614334 AMOFZZRDBNUQQL-UHFFFAOYSA-N 434.989 4.153 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)c2ccc(F)cc2O1 1437264347 AXSGDMXEANIDBO-NRFANRHFSA-N 442.874 4.467 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1nccnc1C1CC1 1439590965 ZBPCOKKSGYBQOS-SDNWHVSQSA-N 430.580 4.036 10 10 IICE CC(C)COc1ccc(C(C)(C)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1439961246 QFHYBNFZOVTBHH-DEOSSOPVSA-N 425.617 4.484 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3ccc(OC)c(Br)c3)CC2)cc1 1446415107 JPYDVJPLSSQOIW-UHFFFAOYSA-N 447.373 4.138 10 10 IICE CC1CCN(c2ccc(NC(=O)CCC(=O)NCc3ccc4cccnc4c3O)cc2)CC1 1451954633 MMEKOQSKUYGVSK-UHFFFAOYSA-N 446.551 4.212 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C(F)F)nc2ccccn12 1457101984 QWRMVPKQRYULMC-ZDUSSCGKSA-N 436.409 4.272 10 10 IICE C[C@@H]1Nc2ccnn2[C@H](C)[C@H]1CCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1465532848 RJCPJUWDFZXNST-CLWJZODNSA-N 447.530 4.041 10 10 IICE Cc1noc(C[C@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)C2)n1 1469961615 WFRUCTOAJOYTFJ-VQIMIIECSA-N 445.995 4.432 10 10 IICE C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccncc1)c1ccc(N(C)C)cc1 1523639058 JCSLAQNTSKIZRA-YMSRPXOMSA-N 428.580 4.241 10 10 IICE CCCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cccnc1 1524485125 BPOBFIXXALRAEK-QGOAFFKASA-N 429.542 4.255 10 10 IICE COc1cccc(-c2cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)on2)c1 1527481313 JAMAOJQJKJKHHO-HOTGVXAUSA-N 439.487 4.033 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H]1c1ccc(Cl)c(F)c1 1528620032 QFBQFSVVNWBXQD-AOMKIAJQSA-N 449.929 4.299 10 10 IICE CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1533066017 WSACHBOZBXEMJK-UHFFFAOYSA-N 446.595 4.426 10 10 IICE C[C@@H]1CCC[C@@](Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1543885585 LQDFULBKCUDMID-OPJGWUQDSA-N 441.620 4.372 10 10 IICE CCOC(=O)COc1ccc(CCNC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc1 1544820838 RYAHQVRYDHORLQ-UHFFFAOYSA-N 434.536 4.317 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](CN3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1545424639 FAXSMHXWLPIRJA-TZIWHRDSSA-N 442.627 4.357 10 10 IICE CCOC(=O)c1c(NC(=O)CSc2ncc(C)c(O)n2)sc(C)c1-c1ccccc1 1559415855 KPMMUNRPCXOJCH-UHFFFAOYSA-N 443.550 4.435 10 10 IICE C[C@@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1560090936 UOTJZOHWZMEXKB-SMHULIPUSA-N 442.437 4.276 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(Cc2ccccc2)[C@@H]2COC(C)(C)C2)N(C)C)cc1 1565452731 JVZQXAJCZRCUKB-BJKOFHAPSA-N 438.616 4.135 10 10 IICE CC(C)(C)Cc1nnc(N2CCC(CCCO)CC2)n1CCCSc1nccs1 1597244077 PFFKRBNJQZGNAM-UHFFFAOYSA-N 437.679 4.495 10 10 IICE CCOC(=O)c1c(C)nc(O)nc1SCC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1614902000 XILTUNLCBILNED-UHFFFAOYSA-N 439.537 4.358 10 10 IICE CCOC(=O)N[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)C1 1616012127 HBNOLULTRAWWOW-FQEVSTJZSA-N 442.608 4.011 10 10 IICE C[C@H](Sc1nc2ccccc2s1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1616858199 IUXBHQNEEAKDIY-KXBFYZLASA-N 428.627 4.262 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)c2C)cc1 1622563825 GPXYIJRFINQUOT-UHFFFAOYSA-N 437.515 4.213 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](C)[C@H]3CN(Cc4ccccc4)CCO3)c2C)c1 1628542982 QIXOBCHMSRQGIU-HFZDXXHNSA-N 431.580 4.422 10 10 IICE COc1c(N)c(C(=O)NCc2ccc(N3CCCC3)cc2)cc(Cl)c1Br 1629758630 PCTRREAASOSLDL-UHFFFAOYSA-N 438.753 4.224 10 10 IICE CC(C)(C)OC(=O)N[C@H]1Cc2ccccc2N(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1630262704 JZOLRPWQLNLFGD-HNNXBMFYSA-N 440.521 4.409 10 10 IICE C[C@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630263254 VIIYWVCXAAQMKN-FOIQADDNSA-N 432.923 4.174 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(CCNC(=O)OC(C)(C)C)cc1 1631265627 JYHPSFLJXDYXIP-UHFFFAOYSA-N 425.573 4.482 10 10 IICE Cc1ccc(N(CCC(=O)N[C@@H](C)c2ccccc2O)S(=O)(=O)c2ccccc2)cc1 1632250258 NZKGSYZFZYUQRS-IBGZPJMESA-N 438.549 4.163 10 10 IICE Cc1cc(C)cc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1633052192 DXMOHZHNHBIQKT-OAHLLOKOSA-N 430.551 4.362 10 10 IICE O=C(CCOc1cc(Cl)cc(Cl)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1634424377 XRYWXPLGXXPQPB-UHFFFAOYSA-N 441.330 4.179 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ncc(C(F)(F)F)cn3)cc2Cl)C1 1634720007 MRZGXGKTCUTAAD-ZDUSSCGKSA-N 441.885 4.385 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3ccc(C)cc3Br)CC2)cc1F 1635890582 OAWWTNGLTZYUGI-UHFFFAOYSA-N 435.337 4.187 10 10 IICE COC(=O)CC1(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CCOCC1 1640566623 OKFQIIWIRAYXHS-UHFFFAOYSA-N 426.557 4.307 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@H]1CCCC(=O)N1C 1641202397 FGMJBGHTYXRGQF-UYAOXDASSA-N 433.474 4.309 10 10 IICE COC1CCN(c2ccc(CN3CCC([C@H](C)NC(=O)OC(C)(C)C)CC3)cc2)CC1 1641742605 CJHZTFIJKBXQOE-IBGZPJMESA-N 431.621 4.427 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccc(C(=O)N=[S@@](C)(=O)N(C)C)cc1 1647826441 XKDAEDDGFJXHPD-SSEXGKCCSA-N 444.582 4.123 10 10 IICE COc1ccc(-c2csc(NC(=O)[C@H](C)N3CCOc4cc(N(C)C)ccc43)n2)cc1 1653144523 DOWDNIZEMNAOPP-HNNXBMFYSA-N 438.553 4.111 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c(O)cc(Cl)cc1Cl 1654410220 VGZIZHZFASQEGQ-CQSZACIVSA-N 429.731 4.452 10 10 IICE CCN(C)c1ccc(CN2CCC[C@H]([C@@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)C2)cc1 1659302691 ACYYTNDEBNPPOF-FUDKSRODSA-N 431.621 4.427 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)c2ccc(N3CCCCC3=O)cc2)cc1 1682824033 VNQWPKFGYNOPGG-IBGZPJMESA-N 438.572 4.051 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@H](NC(=O)OC(C)(C)C)C(C)C 1692079911 IXUYOQSVVCNWNQ-IBGZPJMESA-N 445.608 4.368 10 10 IICE CO[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC1(C)C 1730388776 KTKLNMDGUJIJIM-MRXNPFEDSA-N 433.603 4.347 10 10 IICE C[C@H]1CCCCN1CCCCn1c(-c2ccccn2)nnc1N(C)Cc1ccccc1O 1743057861 VLWCNAOOXQMHLZ-FQEVSTJZSA-N 434.588 4.337 10 10 IICE CN(Cc1ccoc1)c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1747795231 LSVBWXMLTYXUQB-UHFFFAOYSA-N 426.571 4.132 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(OC)CCCC1 1761879871 ZZZWYIVWZMIFSE-GOSISDBHSA-N 445.583 4.225 10 10 IICE CCn1cccc(Cn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)c1=O 1772880683 UWIAMOABCDRBTO-UHFFFAOYSA-N 448.615 4.042 10 10 IICE CCC(CC)C(=O)N1CCC(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1860585994 NERUCXFPPODCIE-UHFFFAOYSA-N 432.520 4.075 10 10 IICE COC(=O)c1c(NC(=O)CCCCO)sc(C)c1-c1ccc(Br)cc1 1866066685 DMRZIRUSVAWYSL-UHFFFAOYSA-N 426.332 4.374 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2cccc(Br)c2O)CC12CC2 2115366228 HVFPEJQPRZNUQI-CQSZACIVSA-N 425.367 4.424 10 10 IICE NCc1ccc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)c(Br)c1 2153349164 RPNDOAXXHVLBLA-GOTSBHOMSA-N 426.402 4.400 10 10 IICE CN(C)c1ccc(C=C(C(=O)N2CCC(Cc3ccccc3)CC2)n2ccccc2=O)cc1 2293239181 LSHIJLFALJLGCM-UHFFFAOYSA-N 441.575 4.394 10 10 IICE O=C1C(=Cc2cccs2)SC(=S)N1CC(=O)N1CCCC[C@@H]1c1cccnc1 2296557184 WHDBAOTXDSVWFQ-MRXNPFEDSA-N 429.592 4.098 10 10 IICE Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)c1C 2313548709 CNLOVHYCNLKYQX-UHFFFAOYSA-N 431.404 4.138 10 10 IICE O=C1c2ccccc2-c2onc3c(N4CCC5(CC4)OCCO5)cc(N4CCCCC4)c1c23 9641576 BSAMUMWALQJSSJ-UHFFFAOYSA-N 445.519 4.373 10 10 IICE O=C(NCCN1CCOCC1)c1ccc(-n2c(-c3ccccc3)cc3c2CCCC3)cc1 20489473 GLFDGJSSVHJMKA-UHFFFAOYSA-N 429.564 4.085 10 10 IICE CCCCOc1ccc(/C=C2\SC(=S)N(CC(=O)OCC(C)C)C2=O)cc1OC 40888437 PSNWMMULVBVLHU-WQRHYEAKSA-N 437.583 4.275 10 10 IICE C[C@@H](Cc1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742754892 RNCSEKCGQQEYKW-AVRDEDQJSA-N 425.573 4.313 10 10 IICE Cc1cc(CCNC(=O)N2CCn3c(nnc3-c3ccccc3)C2)c(C)n1-c1ccccc1 745392152 UULGRYFUDHNDMX-UHFFFAOYSA-N 440.551 4.121 10 10 IICE CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3cccc(F)c3)cs2)c1 747750306 PNQKMYOFAWYCPC-UHFFFAOYSA-N 439.921 4.105 10 10 IICE C[C@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccncc1 749470625 QJPTUBGSTZLTDC-RFRKOGIWSA-N 431.608 4.044 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cn(C)nc3C(F)(F)F)cc2Cl)C1 799959565 HDAHSIVHCNLNRB-CYBMUJFWSA-N 443.901 4.328 10 10 IICE COc1ccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C(F)(F)F)n1 801721459 WBTNLDNRWMTVMV-AWEZNQCLSA-N 425.407 4.028 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cc(Br)ccc1O)c1ccccc1 804732819 CLGAVAYPQINTLH-KRWDZBQOSA-N 435.318 4.037 10 10 IICE CCOc1cc2c(cc1OCC)CN(c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])CC2 917016650 FLIKQMIREGROKX-VQHVLOKHSA-N 426.469 4.141 10 10 IICE O=C1/C(=C\c2ccc(-c3cccs3)cc2F)SC(=S)N1CCN1CCOCC1 917643240 WQGVYFGVIJTPIN-QGOAFFKASA-N 434.583 4.088 10 10 IICE Cc1ccc([C@H]2CCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 920812504 PJCPGEVLCXYCLI-ISKFKSNPSA-N 434.584 4.052 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cccc(Cl)c1 1124424723 LBSFSPAXIRZUCI-BOPFTXTBSA-N 434.945 4.387 10 10 IICE O=C(COc1ccccc1C(F)(F)F)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657093 DIMQOAXKANUYEN-CQSZACIVSA-N 444.400 4.471 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCO[C@H](c3nccn3C)C2)c(C)n1-c1ccc(Cl)cc1 1129764484 MXUCSGRAEFRCLO-CTNGQTDRSA-N 426.948 4.060 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\c3cccc(OC4CCCC4)c3)CC2)c(OC)c1 1131806323 GDNPLYHFGBKNDO-RAXLEYEMSA-N 436.552 4.387 10 10 IICE Cc1cccnc1[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)(C)C 1176823480 GEERFXNIMAKDDI-SANMLTNESA-N 441.531 4.481 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@H](c4c(F)cccc4Cl)C3)C2)cc1 1252116125 PGAWNJPIWOKENS-IERDGZPVSA-N 447.938 4.097 10 10 IICE CC[C@H](C)c1nc(C)c(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1 1294859485 MRYDWCDCKLOGCS-MGPUTAFESA-N 445.007 4.289 10 10 IICE CC(C)Cc1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1302932148 WRRAERZMCJXQKU-NRFANRHFSA-N 439.648 4.360 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1coc(C(N)=O)c1 1306450027 HXCCNWWUKLMLAG-QGZVFWFLSA-N 431.414 4.304 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1c(F)cccc1-n1cccn1 1312710890 WYKPUWGBFDIJMC-UHFFFAOYSA-N 447.308 4.211 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2C[C@H](C)O[C@H](C)C2)cc1 1313680521 URWIVCCRAXYUSR-KDURUIRLSA-N 439.629 4.439 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CC[C@H]1c1ccc(F)cc1 1354326865 DJYFKJNWDXQVGB-VQTJNVASSA-N 436.449 4.491 10 10 IICE CC(C)CN1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1360029294 NGUAXNGDMLCEKE-UHFFFAOYSA-N 442.627 4.042 10 10 IICE CCN(CC(F)(F)F)C(=O)CN(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2 1459664459 RRPZELCPIQUJMJ-RMKNXTFCSA-N 434.458 4.388 10 10 IICE COc1cc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1OC(F)F 1463720591 HDUCIBRLWGLOQJ-UHFFFAOYSA-N 442.462 4.376 10 10 IICE Cc1cc(C(=O)N(C)CC[C@H]2CCCCN2C)c(C)n1-c1ccc(Br)cn1 1465463903 JWZJSARYDDEEQT-GOSISDBHSA-N 433.394 4.198 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](O)c2c(F)cccc2Cl)c(C)n1-c1ccccc1 1479064523 RFYJFQAXPMIODV-NRFANRHFSA-N 429.923 4.462 10 10 IICE CC(C)C1CCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1509064119 UOTLKNUDEHKZBP-HXUWFJFHSA-N 429.584 4.298 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)cc3)cc2Cl)C1 1524252680 AZRAHZQZTBUFPZ-SFHVURJKSA-N 427.976 4.343 10 10 IICE Cc1ccc(F)c(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1526177182 RCEXODSPMPGJSG-UYRXBGFRSA-N 446.544 4.223 10 10 IICE COC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1532125136 ZQLRXZIXSHTJTL-HSZRJFAPSA-N 436.939 4.417 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(-n4ccc(C(F)(F)F)n4)cc3)C2)cc1 1537108563 AEIPTLHAEXRVGM-MRXNPFEDSA-N 444.457 4.156 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1 1540337696 AIZIHIBHQVQZRY-SANMLTNESA-N 429.564 4.402 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSc2nccn2-c2ccc(OC)cc2)cc1F 1543251454 PFPMPZOFGMYTAA-UHFFFAOYSA-N 442.560 4.275 10 10 IICE Cc1cc(CCNC(=O)c2cccn(Cc3ccccc3)c2=O)c(C)n1-c1ccccc1 1543594747 ZGPMWCVKCGDYJJ-UHFFFAOYSA-N 425.532 4.277 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@@H](C)Cc1ccsc1 1559778595 WBBZYASWTRRIDI-GBESFXJTSA-N 447.620 4.070 10 10 IICE COc1cc(C(N)=O)ccc1NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1570296432 XTNKQLFDQLROHG-UHFFFAOYSA-N 442.313 4.216 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)cc1F 1585698052 IBLHQFKGUZZITB-FQEVSTJZSA-N 433.518 4.446 10 10 IICE Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1597799541 CWAACZUHUWUWBM-GGAORHGYSA-N 435.612 4.277 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2Cc2cnn(C)c2)c(C)n1-c1ccccc1 1611934630 PGFFJCRREDJAMP-UHFFFAOYSA-N 439.514 4.226 10 10 IICE Cc1ccc(-c2nnc(N3CCO[C@H](C(C)(C)C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1612046597 ZLDIDISMHKPDEJ-NRFANRHFSA-N 441.551 4.351 10 10 IICE CC1=C[C@@H]2C[C@H](C)CC[C@@H]2[C@](C)(/C(O)=C2/C(=O)NC(CO)=C2O)[C@H]1/C=C/C=C/C[C@H](C)O 1615671375 AJDLKWSYDPWRCH-UKIUQZITSA-N 443.584 4.208 10 10 IICE Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)Nc1ccc(Cl)cc1 1623940505 AQMAGRKLJVIQOM-UHFFFAOYSA-N 446.912 4.042 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3CC(O)(c4cccc(Cl)c4)C3)cc2F)C[C@@H](C)O1 1625090034 MPGPSGQZNFLHAN-BAZDSOKHSA-N 446.950 4.007 10 10 IICE Cc1cc(C(=O)N(C)CCCn2cnc3c(N)ncnc32)c(C)n1-c1ccc(C(C)C)cc1 1626814170 TXDBSKPFZVCDEQ-UHFFFAOYSA-N 445.571 4.102 10 10 IICE Cc1cc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1628218580 GLSKIUWIWIVXLO-HNNXBMFYSA-N 445.405 4.198 10 10 IICE Cc1cc(C(=O)N(C)[C@H](CO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1628297248 JKWMDEVATDVPGD-LJQANCHMSA-N 428.330 4.057 10 10 IICE Cc1ccc(CN2CCOCC2)cc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1629509504 AQUTVROQPPEANV-UHFFFAOYSA-N 431.536 4.300 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](NC(=O)CC(C)C)c1ccccc1 1629968239 BZNNLGSODIGBJE-OAQYLSRUSA-N 447.373 4.407 10 10 IICE Cc1cc(C(=O)N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)c(C)n1-c1ccc(C(C)C)cc1 1633908863 GRPTVXDFCBHIQY-GOTSBHOMSA-N 426.557 4.210 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1 1636262651 IURGXBYXXGIMKX-MHECFPHRSA-N 427.564 4.286 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@@H](c3ccc(F)cc3)C3CCCC3)CC2)cc1F 1642235604 IOHVMZXNLGHDCI-RUZDIDTESA-N 443.538 4.143 10 10 IICE C[C@H]1CC[C@@H](C(F)(F)F)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1645250608 CWZDCGOFOCVFLV-UONOGXRCSA-N 430.426 4.063 10 10 IICE COCCN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CCOCC1 1650816032 JCTCOUHIOQQNEJ-UHFFFAOYSA-N 435.362 4.124 10 10 IICE CCOc1ccc(CN(C[C@@H](C)CS(C)(=O)=O)c2ccc(OC)c(Cl)c2)cc1 1652862031 PWEIPZJVRISKSN-MRXNPFEDSA-N 425.978 4.435 10 10 IICE C[C@@H](NC(=O)N[C@H]1CCN(c2cccc(Br)c2)C1)c1ccc(N(C)C)cc1 1671851654 HSWVVQPAAXVEKD-QAPCUYQASA-N 431.378 4.154 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)c2ccc(N3CCCCC3=O)cc2)cc1 1682824035 VNQWPKFGYNOPGG-LJQANCHMSA-N 438.572 4.051 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C(=O)c4ccccc4)CC3)c2C)c1 1684474029 HHSWWSQEFYOFOU-UHFFFAOYSA-N 430.552 4.070 10 10 IICE CO[C@]1(C)CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1711600906 JJTACARIQATMDX-XMMPIXPASA-N 443.661 4.083 10 10 IICE C[C@@H]1CN2CCC[C@@H]2CN1c1nnc(CC(C)(C)C)n1CCCSc1nccs1 1726739570 CZWJBNQGGUMMAO-IAGOWNOFSA-N 434.679 4.179 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1727070077 GFYCSDKQFIZXIC-GOSISDBHSA-N 437.636 4.435 10 10 IICE CCCCCn1c(-c2cccc(C)n2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1728011245 UOZVPEJCCAMOEV-UHFFFAOYSA-N 438.551 4.313 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1743216579 ZZOGSBURTKNJCA-KRWDZBQOSA-N 431.675 4.119 10 10 IICE CCCN(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1745574696 DYWXLTGBPKJINZ-IFMALSPDSA-N 425.621 4.474 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC[C@H]3CCO[C@@H](C)C3)CC2)cc1 1748847994 OKIJYSOEEQOFJL-SFTDATJTSA-N 441.620 4.332 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752135356 NQIXWPVMLSGTRE-PZJWPPBQSA-N 441.620 4.025 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1770892503 ZQQYLEADUBCAOB-KRWDZBQOSA-N 444.630 4.232 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010390314 BPELSOIYJUJUEI-QFBILLFUSA-N 431.537 4.034 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cc(Br)ccc2O)[nH]1 2082941382 FZTHKJHVDIBWHL-JTQLQIEISA-N 428.352 4.231 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]3CC[C@H]23)c1O 2236048104 YCDHLAUOJXBAEV-DAXOMENPSA-N 441.366 4.041 10 10 IICE CC(C)COc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1 2313559786 SZAPURIJYYHXGN-UHFFFAOYSA-N 443.297 4.150 10 10 IICE COC(=O)CCCCCN1C(=O)C(=Cc2ccc(OC(C)C)c(OC)c2)SC1=S 2314753984 HTCNTDXZWQVQQI-UHFFFAOYSA-N 437.583 4.417 10 10 IICE COc1cc(C=C2C(=O)N(c3cccc(Cl)c3)N=C2C(F)(F)F)cc(OC)c1O 2332147596 MTFMWUQPSBMRRD-UHFFFAOYSA-N 426.778 4.411 10 10 IICE Cc1ccc(CNCC2CC3(CCN3C(=O)OC(C)(C)C)C2)c(O)c1Br 2352949459 FAXOVRLSVBFTGG-UHFFFAOYSA-N 425.367 4.342 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O 3243319 UNTFIFMQLBMFIN-PVJXBVBWSA-N 425.487 4.435 10 10 IICE COc1cc(/C=C2\C(=O)N(c3cc(C)ccc3C)C(=O)N=C2O)cc(Br)c1O 34234811 GAJHKMVHSRSARL-QPEQYQDCSA-N 445.269 4.287 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccc(Br)o2)SC1=S)c1cccc(Cl)c1 40940140 QLIXTXCYLNSNMA-YRNVUSSQSA-N 443.731 4.242 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526175745 HRENWSBDOIVABO-QFIPXVFZSA-N 437.423 4.311 10 10 IICE COc1cccc(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)c1 727251042 TWOFQJSEEOBBSQ-UHFFFAOYSA-N 431.358 4.444 10 10 IICE COc1ccc(-c2cc3nc(CN4CCOc5cc(N(C)C)ccc54)[nH]c(=O)c3s2)cc1 746498155 XJSYUSDXHWOOIL-UHFFFAOYSA-N 448.548 4.125 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1 749705990 LOAZBJQFADQUOK-FPOVZHCZSA-N 430.593 4.074 10 10 IICE O=C(NCCCSc1nccs1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 759549780 JGXPUPQOEDXIFK-UHFFFAOYSA-N 445.536 4.007 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCCC4)cc3)n2C[C@@H]2CCCO2)n1 802688173 DRNFPXNMVLTIEU-QHCPKHFHSA-N 446.599 4.454 10 10 IICE O=C(CSc1cccc(Br)c1)NCc1cc(Br)ccc1O 804732962 GQFWJKUMBJXAKE-UHFFFAOYSA-N 431.149 4.326 10 10 IICE C[C@@H]1CN(c2ccc(CNS(=O)(=O)Cc3ccc4ccccc4c3)cc2F)C[C@@H](C)O1 809808974 DLDIEFCYSQOTRA-QZTJIDSGSA-N 442.556 4.212 10 10 IICE O=C(Cc1cscc1Br)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835222 NNSKOFIXUPREGE-HNNXBMFYSA-N 443.794 4.193 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(SC(F)(F)F)nc3)cc2F)C[C@H](C)O1 1125188140 MIDQHAGMSXQZGU-STQMWFEESA-N 443.466 4.376 10 10 IICE C[C@H](NC(=O)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl)c1ccc(N(C)C)cc1 1128136408 RDCOONBWYAVERL-LBPRGKRZSA-N 437.853 4.497 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@](C)(C(F)(F)F)C1 1197555799 YRJOXOSXBYQOGK-DMZKTXOQSA-N 430.426 4.063 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@]2(C)Cc2ccc(F)cc2)N(C)C)cc1 1256236651 JHTJNDVBVCCJHK-UKILVPOCSA-N 426.580 4.301 10 10 IICE Cc1cc(CC(=O)Nc2ncc(F)cc2I)c(C)n1-c1ccccc1 1266162699 JOGCMLPWIFTPMU-UHFFFAOYSA-N 449.267 4.414 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CN(C)C(=O)OCc3ccccc3)cc2Cl)C1 1270438625 AJISWWRYYYGHGI-GOSISDBHSA-N 443.975 4.461 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](COC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291538145 MFUINCUEKYUMRQ-CTNGQTDRSA-N 443.661 4.256 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1COCCO1 1293898807 IIGFIXFHALQRNF-PGRDOPGGSA-N 437.588 4.393 10 10 IICE CCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1294636903 WUVUKLNZZYLOED-FGZHOGPDSA-N 441.620 4.332 10 10 IICE CC[C@@H](C)c1nc(C)c(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1 1294859486 MRYDWCDCKLOGCS-QRWLVFNGSA-N 445.007 4.289 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cnn1-c1ccc(C)cc1 1295275245 LRMQVJNKEWVUNX-UHFFFAOYSA-N 432.568 4.494 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)c1 1298731301 IRLULBKZTSDETP-SANMLTNESA-N 434.511 4.113 10 10 IICE Cn1ccc(Nc2nnc(COc3ccccc3F)n2CCCSc2nccs2)n1 1298850320 OKDUEIUGXJEIPG-UHFFFAOYSA-N 445.549 4.112 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1312883690 DZEHMOKJKSOXCH-XXBNENTESA-N 425.573 4.088 10 10 IICE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1434908143 AXNNIIFNRQJYIJ-WIYYLYMNSA-N 447.620 4.276 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1443828626 ZFGJHMOHZYZEIC-FQEVSTJZSA-N 433.499 4.221 10 10 IICE O=C1CC(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)(c2cccc(Cl)c2)C1 1444993096 YOIBFIYEYGLWCV-KRWDZBQOSA-N 448.897 4.327 10 10 IICE O=C(NCc1cccc(Br)c1O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] 1448959448 CSMKTFKFEZOIFM-UHFFFAOYSA-N 428.242 4.055 10 10 IICE CN(CCOc1cccc(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1)C(=O)OC(C)(C)C 1463750121 DKHWEYPTTPWTON-UHFFFAOYSA-N 441.572 4.271 10 10 IICE CCN(CC(=O)Nc1ccccc1OC)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1463955789 ZSPSDKWOAXMAJF-UHFFFAOYSA-N 447.535 4.324 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1OCCOc1ccccc1 1470445399 AGIFPXUMLNRWAM-UHFFFAOYSA-N 446.547 4.036 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCC[C@H]3CCC(=O)OC(C)(C)C)C2)cc1 1470594985 YHTLBSARFUMHFV-FPOVZHCZSA-N 445.604 4.208 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)c1ccsc1 1505092319 OBHXMTJMIKGOBR-HSZRJFAPSA-N 437.569 4.319 10 10 IICE CC(C)(C)CCN1CCN(c2nnc(C3CC3)n2CCCSc2nccs2)CC1 1508620075 QJTZQMHYKICMTP-UHFFFAOYSA-N 434.679 4.353 10 10 IICE CCc1[nH]c(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c(C)c1C(=O)OC 1524245936 UEUQLYJAATZIFF-CQSZACIVSA-N 431.964 4.492 10 10 IICE COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1 1525559204 SFRCMRWXZKEKNF-IBGZPJMESA-N 428.838 4.315 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1 1528925508 ZPQUOKBZEAAOKT-YKSBVNFPSA-N 437.584 4.300 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCC1SCCS1 1533948048 IMPAAJYOYYKGEN-ACCUITESSA-N 444.694 4.042 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CC3(Cn4cnnn4)CCCCC3)cc2Cl)C1 1539913907 WJAMQTPFOADWME-GOSISDBHSA-N 445.011 4.220 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ncc(F)cc2I)cc1 1544522847 RGTFUHRFRPNDHR-UHFFFAOYSA-N 435.240 4.485 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1[C@@H]2Cc3ccc(Br)cc3[C@@H]21 1565256060 KWRVONVLQOLPJU-QHAWAJNXSA-N 428.374 4.385 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1567467832 SWRCXXUGSOBIHT-DOTOQJQBSA-N 426.513 4.074 10 10 IICE CCN(CC)C(=O)OC[C@@H]1CCCCN1C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1586858241 LJZZZDMPIIPLHR-NRFANRHFSA-N 443.588 4.378 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CCc3nnc(-c4cccc(C)c4)n3C2)cc1 1587459536 AIVDONXJUHXNPG-QFIPXVFZSA-N 431.584 4.321 10 10 IICE C[C@@H](NC(=O)c1cc2c(F)c(Br)ccc2[nH]1)c1ccc(N2CCOCC2)cc1 1597914366 CIHWDHLPSKCBQH-CYBMUJFWSA-N 446.320 4.397 10 10 IICE CC(C)OC1(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCC1 1611168202 SCKUYYQWOXHKRF-VBKFSLOCSA-N 438.640 4.193 10 10 IICE C[C@H]1CCCN(CCCCn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1612803928 QUVAYPHHJFHTGG-NRFANRHFSA-N 448.615 4.118 10 10 IICE CCOc1ccccc1C(=O)NCC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1626169211 QGIHPGXWAUMHNM-KRWDZBQOSA-N 443.975 4.021 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc(Nc2nccc(C(F)(F)F)n2)c1 1636058919 WVWGVJZTIKMLSL-UHFFFAOYSA-N 437.418 4.360 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(CN3CCCS3(=O)=O)c2)c1C 1641235192 VHCOEDIORIMPKT-UHFFFAOYSA-N 437.565 4.190 10 10 IICE CCC[C@@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1=O 1643644136 NYNKKWDXRUSDQG-OAQYLSRUSA-N 446.345 4.150 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(OC(F)(F)F)cccc3[nH]2)N(C)C)cc1 1653421887 UXSMCQWSFVZUSN-LJQANCHMSA-N 434.462 4.165 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCCc2ccc(Br)cc2Cl)c1 1673182964 XIEXPTGTRFMCTE-LLVKDONJSA-N 427.726 4.420 10 10 IICE COc1ccc(C[C@H]2CCCCN2C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1673822419 AYWLGABCTPNUNQ-FYYLOGMGSA-N 437.584 4.337 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)CCc3ccccc3)cc2Cl)C1 1682023250 CLAHTRABAVQMOS-WIYYLYMNSA-N 429.992 4.369 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(CNC(=O)NCc3cccc(Cl)c3O)cccc2C1 1683260484 BZVYHJZXDGWMNK-UHFFFAOYSA-N 445.947 4.338 10 10 IICE Cc1cc(CCNC(=O)N2CCC(OCCOC(C)C)CC2)c(C)n1-c1ccccc1 1687216629 DDPYWLIZOPCVBZ-UHFFFAOYSA-N 427.589 4.252 10 10 IICE CCCN(CCC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1695331661 MCEFWZUVHNWQNS-JOCHJYFZSA-N 427.593 4.031 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H](OC)C(C)(C)C)CC2)cc1 1711865184 LTAWBAQABDORII-NRFANRHFSA-N 429.609 4.188 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1Cc1cc(Br)cs1 1768684272 RERXWWIWPODQOP-QGZVFWFLSA-N 449.374 4.344 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)sc2c1CC[C@H](C(C)(C)C)C2 1865922464 LGPIJZLURBEONH-KGLIPLIRSA-N 434.602 4.271 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4ccc(O)cc4C)cc3)CC2)cc1 1872884009 GWVOEBNYCRHXRS-UHFFFAOYSA-N 431.536 4.284 10 10 IICE O=C(CCCc1nc(O)c2ccccc2n1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179726 MLHFTRKBKRIFFI-UHFFFAOYSA-N 437.455 4.072 10 10 IICE C[C@@H](NC(=O)C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 2017518893 MLSVRBFCYPBXOB-MJGOQNOKSA-N 428.529 4.070 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C2CCC2)c(I)c1N 2079951590 UYAUYBKYZTWJTN-KRWDZBQOSA-N 425.314 4.344 10 10 IICE CC[C@H](N[C@@H]1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)c1cc(Br)ccc1O 2095041826 PPIHGAKPYUAFLV-OSMBCOQSSA-N 425.367 4.451 10 10 IICE CCN1C(=O)C(=CC=C2Sc3ccc(OC)c(NC(C)=O)c3N2CC)SC1=S 2295203857 NSQGJURHILHUKX-UHFFFAOYSA-N 435.596 4.191 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1ccc(OCc2ccccc2Cl)cc1 2297335164 FXNAPFCKFHRYII-UHFFFAOYSA-N 436.851 4.174 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)C1=Cc1cc(OC)c(OC)c(OC)c1 2313577395 NHWQCGIWQMCXFQ-UHFFFAOYSA-N 443.883 4.243 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=C(C)NCCCOC(C)C)cc1 2313683423 ZSIFBKCFEJHRML-UHFFFAOYSA-N 437.540 4.133 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3C[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(O)c1Br 2352682483 YEMKSQCQRHJOEU-FPCVCCKLSA-N 425.367 4.245 10 10 IICE Cc1cc(C)c(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c(=O)[nH]1 12826035 MCBZHVVTRANBNJ-UHFFFAOYSA-N 428.330 4.092 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1)N2)N1CCOCC1 14460318 RUTXHTQTSSBPOE-IPJJNNNSSA-N 430.957 4.187 10 10 IICE Cc1cc(/C=C2\SC(=S)N(CCN3CCOCC3)C2=O)c(C)n1C1CCCCC1 28977493 ORNIZADAZCBPEZ-HKWRFOASSA-N 433.643 4.144 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccccc4Cl)c3[N+](=O)[O-])CC2)cc1 40611192 MFZXSPLCTRQNDN-UHFFFAOYSA-N 440.891 4.117 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2=O)cc1 59270939 RTCKZRRERGEWTC-AREMUKBSSA-N 429.520 4.361 10 10 IICE COC[C@@]1(CNCc2cccc(Br)c2O)CCCCN1C(=O)OC(C)(C)C 380518503 QWWLQZWKSSTQHU-FQEVSTJZSA-N 443.382 4.051 10 10 IICE CC(C)COC1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903972 LBCRVUOPTMXPQO-KRWDZBQOSA-N 425.520 4.103 10 10 IICE Cc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)sc2nc3n(c(=O)c12)CCC3 746424465 BPPWRMAXDWPFRU-UHFFFAOYSA-N 446.576 4.093 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(-c4nc(C5CC5)no4)cc3)c2)CC1 767382358 DYOBIFSCSUWNPX-UHFFFAOYSA-N 431.540 4.397 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)c(C)n1-c1ccccc1 780817252 OMZFJCZGIIQYJQ-OAQYLSRUSA-N 432.572 4.221 10 10 IICE O=[N+]([O-])c1cc(CNC2CC(N3CCC(C(F)(F)F)CC3)C2)ccc1N1CCCCC1 793233447 TWJSDVWTEWCJMX-UHFFFAOYSA-N 440.510 4.480 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C4CC4)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802678977 GLVRPBABJPFSFW-VWNXMTODSA-N 447.583 4.147 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccccc1OC[C@H]1CCCCO1 806229539 HLIQIFLJYZDHAC-MRXNPFEDSA-N 435.318 4.424 10 10 IICE O=C(Cc1ccc(OC(F)(F)F)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472662 NNFUVUZOOZDYCE-QGZVFWFLSA-N 442.865 4.268 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(Cl)c2)cc1F 1125535248 UHNMOHBFXDCTEU-XOBRGWDASA-N 438.330 4.034 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C1CC2(C1)C[C@@H](NC(=O)OC(C)(C)C)CCS2 1135914517 ITXYZISWYNFOQQ-SZTYLXMGSA-N 447.645 4.280 10 10 IICE CC(C)n1ncc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1Br 1136480127 CNKYHFSABYPJLT-SFHVURJKSA-N 449.393 4.114 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(Cl)c(I)c1 1140198536 HQUUGURFWMKRBF-UHFFFAOYSA-N 436.673 4.066 10 10 IICE Cc1cc(C(=O)N2c3ccccc3C[C@@H]2CO)c(C)n1-c1cccc(Br)c1 1146793599 GZCWCCPTHXJWCK-LJQANCHMSA-N 425.326 4.420 10 10 IICE CC(=O)c1ccc(Br)c(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 1208484760 MCWALZKRYVJTPZ-CQSZACIVSA-N 446.345 4.371 10 10 IICE CCOC(=O)N1CCC([C@@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1 1226945342 DLYQSXCXEORMBG-GOSISDBHSA-N 426.561 4.150 10 10 IICE CCN(CCC1CCN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1)CC1CC1 1252114247 BIQNJWMMNLMPSH-HSZRJFAPSA-N 442.648 4.065 10 10 IICE Cc1cccc([C@H]2CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1C 1255508847 GOVBMFGIJFUTJI-XMMPIXPASA-N 434.584 4.052 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3csc4sc(C)cc34)cc2F)CC1 1265011933 HCKMGCHBLUOOCI-UHFFFAOYSA-N 431.602 4.411 10 10 IICE COc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc2n1 1361063857 UEMSGNMDJQTPOZ-HNNXBMFYSA-N 427.451 4.244 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(F)c(I)c1 1436852382 VUUVFQJUKCPKAK-CYBMUJFWSA-N 440.300 4.166 10 10 IICE Cc1nn(C)c(Oc2cccnc2)c1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1443194983 CHWFGZHSHAZVFR-UHFFFAOYSA-N 443.507 4.317 10 10 IICE CC(C)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NCc1cccc(Br)c1O 1448964517 RGOSFSNEUBOVQZ-INIZCTEOSA-N 443.382 4.346 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2CCCC[C@@H]2[C@@H]1C(=O)NCc1ccc2cccnc2c1O 1451957600 KCQLMQGTKPZJOT-NBHGPNQESA-N 439.556 4.372 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc([N+](=O)[O-])ccc3SCCO)c2C)c1 1454626906 TWNRNUAAHIQAGF-UHFFFAOYSA-N 439.537 4.325 10 10 IICE CCOC(=O)Cn1nc(C)cc1NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1461252783 DKPFIABMKKRRIX-UHFFFAOYSA-N 434.500 4.488 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(Cc3cccnc3)Cc3ccccc3C)C2)cc1 1470774150 WUADQFXTTPYYAX-QHCPKHFHSA-N 430.552 4.389 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cccc(-n4ccc(C(F)(F)F)n4)c3)c2)CC1 1517999056 YZAJDAHMTJXUDD-UHFFFAOYSA-N 443.473 4.285 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1521127862 AEXFQAXLLWIJQR-OAQYLSRUSA-N 442.991 4.086 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)C3CCN(CC(F)(F)F)CC3)ccc21 1525380097 WPLOKHGSQLHXEW-UHFFFAOYSA-N 425.495 4.003 10 10 IICE COc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1-c1ccccc1 1527864166 KZODTXLLFLGHCL-UHFFFAOYSA-N 438.474 4.407 10 10 IICE Cc1ccc(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1-n1c(C)cc(C=O)c1C 1538694026 FMRKGSVMKGIHPD-UHFFFAOYSA-N 442.519 4.265 10 10 IICE CCc1cnc(CN(C)c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)s1 1546344966 XQZUDFVXXOGLOR-UHFFFAOYSA-N 449.628 4.362 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCO[C@@H](c2ccncc2)C1 1564774401 LMYIOTFYYJKMJQ-IEBWSBKVSA-N 434.334 4.002 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)c1 1566298299 DZUDXWZZFPCAEL-GOSISDBHSA-N 426.900 4.455 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@H]3CCCC[C@H]32)c(C)n1-c1cccc(C(C)C)c1 1566370535 DHAGSEHQYOADOE-PKTZIBPZSA-N 428.598 4.399 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(CNC(=O)OC(C)(C)C)cc1 1585264234 PDBSZRYKDYLTBH-GOSISDBHSA-N 425.573 4.447 10 10 IICE C[C@H]1CCC[C@@H](N(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1612743092 GNTZWLSSIUTUAC-DOTOQJQBSA-N 431.635 4.332 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1613554044 RXHDWWKXLWFUNW-JXFKEZNVSA-N 444.599 4.075 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(OCCCN(C)C)cc3)c2C)cc1 1615611754 ALIMCXJIYWPSRO-UHFFFAOYSA-N 435.568 4.363 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1620752770 BDUQAYIEOSVWJT-MAUKXSAKSA-N 434.458 4.421 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](OC3CCC3)C2)c(C)n1-c1ccc(Br)cn1 1628116901 NDDBYEAKIHJYGY-SFHVURJKSA-N 432.362 4.425 10 10 IICE Nc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630261869 DSSFPAHFBWPJKJ-CYBMUJFWSA-N 428.747 4.329 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1Cc2ccccc2N(C(=O)C(F)(F)F)C1 1632317131 ZEJVFIUZKNBGIP-INIZCTEOSA-N 447.482 4.406 10 10 IICE Cc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1635540885 FFNSZXNIIYIHQC-DEOSSOPVSA-N 444.531 4.329 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C3)c2C)cc1 1636531631 JZTMAABPGRNWBV-QVKFZJNVSA-N 427.545 4.088 10 10 IICE COc1cc(NCCNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc(OC)c1 1637007019 XSTJHVBRLHLKFJ-UHFFFAOYSA-N 435.524 4.074 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@]1(F)c1ccccc1 1639654183 SYGOVPONFHSMAT-IYQILZRWSA-N 444.528 4.171 10 10 IICE CCN(CCc1cccs1)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1641602947 KBIKTROODVURNJ-MRXNPFEDSA-N 432.545 4.415 10 10 IICE COc1ccc(C)cc1CSCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1643791454 WTJIJYQSENDERS-ROUUACIJSA-N 446.588 4.306 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C4CCCCC4)C3)cc2F)C[C@@H](C)O1 1647853274 BUPQKNNGJJULLB-ZRCGQRJVSA-N 445.623 4.348 10 10 IICE CCOC(=O)C[C@H](SCC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C)C(=O)OCC 1652817008 ZCNBRZZWKWXJPF-NRFANRHFSA-N 431.554 4.203 10 10 IICE CCOC(=O)CN(Cc1nc(O)c2cc(-c3ccccc3)sc2n1)Cc1ccccc1O 1653969543 BVPUUCBNEKGGEU-UHFFFAOYSA-N 449.532 4.335 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCN3CC(F)F)cc2Cl)C1 1682024377 RIWKYWTYJGVJDH-RDJZCZTQSA-N 428.955 4.105 10 10 IICE C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1683701686 HZUSFBLCWHWUOJ-SFHVURJKSA-N 448.533 4.230 10 10 IICE COc1ccc(Cl)cc1C(C)(C)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684606068 AQGKFGTXPBGBDJ-HXUWFJFHSA-N 432.996 4.252 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@@H](c1cccs1)N(C)C 1696700489 FIUKNEZSLKNKSE-AZUAARDMSA-N 441.601 4.226 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@@H]1CC1(C)C 1711095747 XEQJFCCLZGOTDB-AWEZNQCLSA-N 430.350 4.424 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CC1 1750299908 QFOPVVFUELASJW-KRWDZBQOSA-N 439.629 4.455 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCOC(C)(C)C)CC2)cc1 1770257512 CFUKDFLHORCCQW-UHFFFAOYSA-N 429.609 4.116 10 10 IICE COc1ccc(N2CCN(C(=O)CSCc3cccc(OC(F)(F)F)c3)CC2)cc1 1860346157 GEQMAQMHLYMCHX-UHFFFAOYSA-N 440.487 4.176 10 10 IICE COCCCN1C(=O)C(N[C@@H]2CCCC[C@@H]2C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873169447 AXKVAESJGNWJAA-FDDCHVKYSA-N 449.595 4.379 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010390459 DPKVWSKHRLGYFE-YTQUADARSA-N 431.537 4.034 10 10 IICE NCc1cc(F)c(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1Br 2148931779 COCJEHATVQNEML-HKUYNNGSSA-N 432.381 4.395 10 10 IICE CC(C)CNCc1ccc(N(CC(=O)N(C)C)Cc2ccccc2)c(Br)c1 2152241454 TVOXIAGNAOFJKU-UHFFFAOYSA-N 432.406 4.290 10 10 IICE Oc1cc(Br)ccc1CN[C@@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156290341 ZJWXMKMUVWLQJK-UNMCSNQZSA-N 431.374 4.068 10 10 IICE CC[C@H](Nc1c(CNC(=O)OC(C)(C)C)cnn1C)c1cc(Br)ccc1O 2182887773 QJKOLKKOUKDTCM-HNNXBMFYSA-N 439.354 4.476 10 10 IICE CC1=NN(c2ccc(Cl)cc2)C(=O)C1=CNc1ccc(S(=O)(=O)NC(C)(C)C)cc1 2297511465 MZNNTWODNNLXLW-UHFFFAOYSA-N 446.960 4.135 10 10 IICE COc1ccc(-c2n[nH]c(=NC=C3C(=O)N(c4ccc(Cl)cc4)N=C3C)s2)cc1 2297511473 NUYZXMVLGIKMMB-UHFFFAOYSA-N 425.901 4.008 10 10 IICE CN(C[C@]1(O)CCCN(c2ccc(OCc3ccccc3)cc2)C1)C(=O)OC(C)(C)C 2299512985 SADNHBHWEUFVCN-RUZDIDTESA-N 426.557 4.464 10 10 IICE Cc1cc(C=C2SC(=S)N(c3ccc(N4CCN(C)CC4)cc3)C2=O)ccc1F 2321684714 XSLCUAFIMYBKTO-UHFFFAOYSA-N 427.570 4.292 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H]2CNCc1cc(Br)cc(F)c1O 2330515835 PHKMMXPXIYPSMM-PEYYIBSZSA-N 429.330 4.171 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@](NCc3ccc(Br)cc3O)(C2)C1 2333128635 BYQQWQIESMTIBE-JLTOFOAXSA-N 425.367 4.424 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)c2C)cc1F 8634703 DNDJUISQHNVZGF-RUZDIDTESA-N 433.483 4.192 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1Br 33326947 SVDQQYWTCOLVHL-NTEUORMPSA-N 437.315 4.134 10 10 IICE COC(=O)C1=C(C)Nc2nc(SCc3ccccc3)nn2[C@H]1c1ccc(N(C)C)cc1 54642355 BJPNSCVSQMXFMA-FQEVSTJZSA-N 435.553 4.098 10 10 IICE CCOC(=O)C1=C(C)Nc2nc(SCc3ccccc3)nn2[C@H]1c1ccc(N(C)C)cc1 54642415 RWAFMQCEDFJDBF-NRFANRHFSA-N 449.580 4.488 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3oc(-c4ccccc4)nc3CC(C)C)CC2)cc1 64612526 ISMMGGXLXHBOLY-UHFFFAOYSA-N 433.552 4.440 10 10 IICE CCOc1cc(/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)ccc1OC(F)F 104673616 BFSGZMGCRNDLAY-VZUCSPMQSA-N 432.467 4.057 10 10 IICE Cc1ccc2ncc(-c3noc(Cn4c5c(c6ccccc64)CN(C(C)C)CC5)n3)n2c1 579173440 SLJGYOSYDFBACH-UHFFFAOYSA-N 426.524 4.462 10 10 IICE CC1(C)CCCN1C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 728282064 AALQVRDQSDYBLH-UVTDQMKNSA-N 439.400 4.051 10 10 IICE O=C(Nc1ccc(N2CCCC2)nc1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743096046 GXNIEKQAOFTLPU-QGZVFWFLSA-N 431.487 4.074 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 749798159 OEEQRJHGOMNHKL-OFVILXPXSA-N 447.583 4.138 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CCCN3c3ncnc4ccccc34)cc2)CC1 750779260 UTKDRPQIADSBCA-XMMPIXPASA-N 429.568 4.151 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1ncc(Br)cc1Br 759355459 MZKQZROFOMZJSQ-UHFFFAOYSA-N 439.151 4.137 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C 764545992 CSQHYQUKZVOMPY-RXVVDRJESA-N 432.609 4.318 10 10 IICE O=C(CSc1nnc(-c2ccco2)n1-c1ccc(Cl)cc1)NCc1ccccc1O 767928959 ZUYWAEUKCWAIDW-UHFFFAOYSA-N 440.912 4.295 10 10 IICE CC(C)c1noc2ncc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc12 771063305 FEJXAOPAKAQKIB-KRWDZBQOSA-N 428.920 4.100 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3c(F)ccc(Br)c3F)CC2)cc1 799912175 QLRAQKYVFMKIQM-UHFFFAOYSA-N 439.300 4.017 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C4CC4)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802678970 GLVRPBABJPFSFW-ISKFKSNPSA-N 447.583 4.147 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](CO)c3nc(-c4ccccc4)no3)c2C)c1 804122458 DFLHVQSPSOGZIF-JOCHJYFZSA-N 430.508 4.224 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1ccccc1CN1CCCCC1 804877189 FNEZCTRWQCRGMS-UHFFFAOYSA-N 432.362 4.140 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)Nc1nc2c(s1)CCC2 917205826 IIAZAVGUICMBCK-INIZCTEOSA-N 440.594 4.405 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCC[C@@H]1c1ccccc1 920052131 ZKBHVJDVKGVKOC-GGAORHGYSA-N 425.548 4.312 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1126877279 JGKDUDKIEYZBOB-QFIPXVFZSA-N 429.564 4.305 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)O[C@H]1CCc2cccnc21 1128192890 DTKAURGKQXRPGE-WLSWZUKCSA-N 428.510 4.043 10 10 IICE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1135732919 LQQGXTADHLRCDE-VWLOTQADSA-N 447.620 4.059 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCCO3)c2C)c1 1138232137 ZALNURJEDKREJR-VWLOTQADSA-N 431.580 4.423 10 10 IICE C[C@@H](CC(=O)NCc1ccc2cccnc2c1O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1142728665 ZKMQTKBABFAHCX-QFBILLFUSA-N 427.545 4.230 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](C(=O)NCc2c(O)ccc3c2CCCC3)(C(F)(F)F)C1 1150378643 SRNQSYXKUQDMIO-OAQYLSRUSA-N 442.478 4.077 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccc(Cl)cc2)c(C)n1-c1ccc(Br)cn1 1159698069 XZYLJOCMPHMPHP-GOSISDBHSA-N 448.748 4.368 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1 1162107231 FLXILTMOWBKSGT-QUESDIRFSA-N 431.536 4.172 10 10 IICE CCOCc1nc(Cl)cc(NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1163225133 QASBQCHKXLDDJX-QGZVFWFLSA-N 449.983 4.410 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC(=O)N(C)c4ccccc4C3)cc2Cl)C1 1227207672 ICIJZYGHIFOPSG-KRWDZBQOSA-N 440.975 4.265 10 10 IICE CC(C)[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)N1Cc2ccccc2C1=O 1265001543 AKPOEOZTCDILIH-OAQYLSRUSA-N 447.501 4.324 10 10 IICE CC(C)(C)OC(=O)N[C@H]1Cc2ccccc2N(C(=O)/C=C\c2cnc3ccccc3n2)C1 1276403077 OKGANZNNXROHOX-HSNDNRACSA-N 430.508 4.126 10 10 IICE Cc1cc(C(=O)NC[C@]2(C)CCO[C@@H]2C2CC2)c(C)n1-c1ccc(Br)cn1 1296126397 QPUVUKRORLWQQD-CTNGQTDRSA-N 432.362 4.187 10 10 IICE CCc1nnc(N2CCc3cc(OC)c(C)cc3C2)n1CCCSc1nccs1 1306153373 JBFURNJCASMOBI-UHFFFAOYSA-N 429.615 4.359 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC(C)(C)c3ccc(C(F)(F)F)cc3)cc2)CC1 1313211650 IOMCRFFXCVYFOG-UHFFFAOYSA-N 434.506 4.192 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1CSC 1316105612 HISMGRBPUGCKKC-FQEVSTJZSA-N 425.602 4.331 10 10 IICE CC(C)(C)OC(=O)N(CCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C1CC1 1350629328 WBASZMYQZRSLLZ-UHFFFAOYSA-N 434.492 4.190 10 10 IICE Cc1cc(CC(=O)N(Cc2ccccc2)[C@H](C)CN2CCOCC2)c(C)n1-c1ccccc1 1352464062 IGZAIAAJRBVHAB-HSZRJFAPSA-N 445.607 4.386 10 10 IICE COc1cc(Br)c(Cl)cc1C(=O)N1CCOc2cc(N(C)C)ccc21 1435285514 GYECSYNFUUQMKX-UHFFFAOYSA-N 425.710 4.216 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nn(-c2cc(F)cc(F)c2)c2c1CCC2 1436847940 LRVPDHXUZWDNPV-INIZCTEOSA-N 438.522 4.375 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3c[nH]c4cccc(Br)c34)C2)cc1 1436969405 GPGJPPMIFVAUNF-HNNXBMFYSA-N 442.357 4.124 10 10 IICE Cc1cc(CCNC(=O)c2nc(Br)c3ccccn23)c(C)n1-c1ccccc1 1438177459 LYXNQZYENCWLRY-UHFFFAOYSA-N 437.341 4.477 10 10 IICE COCCN1[C@@H](C)CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@H]1C 1452260135 QINQCDDHUZSCMG-CALCHBBNSA-N 448.405 4.038 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@@H]2CCCCO2)c(C)n1-c1ccc(Br)cn1 1452671762 OJURNLJKMMQMBH-ICSRJNTNSA-N 432.362 4.329 10 10 IICE CO[C@H](C)c1nsc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1457823653 UMRYUWUXUPTXET-LLVKDONJSA-N 436.335 4.063 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c(C)n1-c1ccccc1Br 1465888207 UKPXEMUGJYGDQG-LEWJYISDSA-N 425.326 4.245 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCOc1ccc2c(c1)CCCC2 1469231559 WATGHYVGPKZWED-UHFFFAOYSA-N 425.525 4.022 10 10 IICE Cc1nc2ccccn2c1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1472283763 YVYMJFKFWFVIIL-UHFFFAOYSA-N 438.329 4.138 10 10 IICE CCc1nnc(N2CCC([C@@](C)(O)C(F)(F)F)CC2)n1CCCSc1nccs1 1498899715 CHTMUDUWRLBTSY-QGZVFWFLSA-N 449.568 4.009 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCSC[C@@H]2C)cc1 1501839467 SIMGBRIDDDJTSA-IBGZPJMESA-N 436.629 4.485 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC[C@@](C)(CC)O1 1503013923 HNLHGQBYBIWTIE-WIOPSUGQSA-N 441.620 4.399 10 10 IICE CCOCc1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1503028171 AONUXPDKUIYBKE-RTBURBONSA-N 429.634 4.041 10 10 IICE CN(Cc1ccccc1F)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1503486496 AVVFTMBZEWUWQK-INIZCTEOSA-N 433.578 4.196 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3(OC)CCCC3)CC2)cc1 1504292968 WLWCVKMNAZJDTD-UHFFFAOYSA-N 427.593 4.086 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)sc2c1CCCCC2 1515329044 NAFKBCYXCXSPED-GFCCVEGCSA-N 448.491 4.073 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)O1 1519283115 OWGCLQKDBBJKHS-VKPKAYIDSA-N 444.959 4.000 10 10 IICE CCSC1(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 1533715270 QZFILOWBTHEZEV-KAMYIIQDSA-N 426.654 4.131 10 10 IICE CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1544721629 UKXRHTITNKGQHC-YNJKOYDBSA-N 427.633 4.209 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(CC2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1547529069 RNRRGBBSIFGSDJ-UHFFFAOYSA-N 439.583 4.024 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(Cc4cc(F)cc(F)c4)CC3)C2)cc1 1565055431 CPTNPDMEMPXQBD-OAQYLSRUSA-N 429.511 4.216 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)cc1 1585933094 TUQHYTOTEBKXDP-RUZDIDTESA-N 443.547 4.103 10 10 IICE COc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1C 1586309549 DDDOMKWLZVLREN-LDADJPATSA-N 430.526 4.373 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(Cl)c2O)NC(=O)OC(C)(C)C)cc1 1586619969 PUOSGBRSEULWRY-SFHVURJKSA-N 433.936 4.107 10 10 IICE C[C@@H]1CN(C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)c2ccc(Br)cc2O1 1587043717 MMQMTLBXMSLNJG-DOMZBBRYSA-N 437.334 4.177 10 10 IICE Cc1cc(C(=O)NCC[C@@H](N(C)C)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1595136382 HGEGZXDXOSOOAQ-QGZVFWFLSA-N 446.311 4.469 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c[nH]nc1-c1c(F)cccc1F 1595584484 NMNGQEBNDKMBMS-HNNXBMFYSA-N 446.885 4.108 10 10 IICE Cc1cc(CN2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)ccc1N1CCCCC1 1618340523 MOINQTCICPMJBU-QHCPKHFHSA-N 442.648 4.112 10 10 IICE CSCCCN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCSCC2)cc1 1620284412 CNGYTSMUMMFKPL-UHFFFAOYSA-N 442.658 4.064 10 10 IICE CC(C)(C)c1ccc([C@@H](O)CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1626155011 SCBFXUXQVRUKIK-QHCPKHFHSA-N 428.548 4.090 10 10 IICE Cc1nc(-c2ccc(F)cc2)sc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1630283797 WRXQJRIHLIFSDL-UHFFFAOYSA-N 425.529 4.149 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccccc3N(C)c3ccccc3)CC2)cc1 1631443064 SKZGWRAJWRBECK-UHFFFAOYSA-N 444.579 4.015 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 1636058616 KBKWBYGKDGQXRK-KSZLIROESA-N 437.577 4.452 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1CCO[C@H]1c1cncc(Br)c1 1638305911 QMHPAXMLUOKSDF-CJNGLKHVSA-N 446.128 4.251 10 10 IICE CCOc1ccccc1[C@](N)(C(=O)NCc1ccc(N2CCCCC2)cc1)C(F)(F)F 1641656785 NLUKMURGKCMSEI-QFIPXVFZSA-N 435.490 4.108 10 10 IICE CCS[C@H]1CCCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 1644583991 JPCPJYOQXLMBHN-AEFFLSMTSA-N 436.577 4.397 10 10 IICE CSc1ncc(I)c(N2CC=C(c3ccc(Cl)nc3)CC2)n1 1651695854 PPYKHUQHFHVQGW-UHFFFAOYSA-N 444.729 4.145 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4cccs4)C3=O)c2C)cc1C 1651720923 WPPMYSKLFZPQDM-XMMPIXPASA-N 435.549 4.422 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@]4(CCN(C(=O)OC(C)(C)C)C4)C3)cc2)CC1 1654070679 VDMXDWIWRXABGV-RUZDIDTESA-N 429.605 4.135 10 10 IICE CCOC(=O)C1=C(CN(C)c2ccc(OCC)cc2)NC(=O)N[C@H]1c1ccc(Cl)cc1 1660054201 AHGFTAIJIBQTFE-NRFANRHFSA-N 443.931 4.046 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3ccccc3OCCC(C)C)C2)cc1 1680077801 KGAXBCBMBLZMRZ-FQEVSTJZSA-N 425.573 4.446 10 10 IICE COc1cc(N2CCN(C(=O)NCC[C@@H]3C[C@@H](C)CC(C)(C)C3)CC2)cc(OC)c1OC 1681970764 QDEAYDVLSIDQMI-RTBURBONSA-N 447.620 4.397 10 10 IICE C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C[C@@H](c2ccccc2)C1 1683300711 UHADICKTVCFEGB-IGKWTDBASA-N 448.611 4.160 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC(Cc3c(F)cccc3Cl)C2)N(C)C)cc1 1684607147 NJKYWCSKQASWSK-JOCHJYFZSA-N 432.971 4.032 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC(Cc3c(F)cccc3Cl)C2)N(C)C)cc1 1684607148 NJKYWCSKQASWSK-QFIPXVFZSA-N 432.971 4.032 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)N(C)C)cc1 1687806950 LSIRSPWMXPSJET-KNQAVFIVSA-N 435.572 4.086 10 10 IICE CC(C)c1nnc(N2CCc3ccc(Cl)nc3C2)n1Cc1ccc(N(C)C)c(F)c1 1741357736 MGFVJWZQNHCBPF-UHFFFAOYSA-N 428.943 4.266 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](N3CCCC3)C2)n1CCCSc1nccs1 1743703983 ZLIBKTQLJIFLHF-MSOLQXFVSA-N 434.679 4.495 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCSC1 1761842076 BFWFTHIXBGVRFX-MOPGFXCFSA-N 429.634 4.270 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCCC1(F)F 1762870582 ZBGPKTFKGZZZNZ-LJQANCHMSA-N 433.547 4.139 10 10 IICE CCOCc1nnc(N2CCC[C@@](C)(OC)CC2)n1Cc1ccc(N(CC)CC)cc1 1766348967 PVHIZKCVTZAQKO-XMMPIXPASA-N 429.609 4.105 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(CCc4ccccc4)n4ccccc34)CC2)cc1 1858350971 XKCLEHMSLDNCCF-UHFFFAOYSA-N 440.547 4.091 10 10 IICE CCS(=O)(=O)c1ccc(O)c(N=c2nc(-c3ccc(Cl)cc3)[nH]c3c2CCCC3)c1 1859832365 PAEPORIWOOIZHL-UHFFFAOYSA-N 443.956 4.341 10 10 IICE Cc1cc(OCC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)ccc1Cl 1865928644 LVBFFSKONPAVQM-QHCPKHFHSA-N 429.992 4.437 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](CF)(NCc2cc(Cl)cc(Br)c2O)C1 2040509322 JFZZRPJXQAMSSI-QGZVFWFLSA-N 437.737 4.247 10 10 IICE CCN(C(=O)OC(C)(C)C)C1CN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2044712722 DAUUYGDHEVZSEG-UHFFFAOYSA-N 446.592 4.008 10 10 IICE CC[C@@H](NC[C@]1(O)CCCN(Cc2ccccc2)C1)c1cc(Br)ccc1O 2157531042 ZVSVLZSCVKYJEN-IFMALSPDSA-N 433.390 4.223 10 10 IICE CCN1C(=O)C(=Cc2ccc(OC)c(COc3ccc([N+](=O)[O-])cc3)c2)SC1=S 2295452463 RGADJPKPXRAZEK-UHFFFAOYSA-N 430.507 4.404 10 10 IICE COc1cc(C=C2SC(N3CCN(c4ccc(C)c(Cl)c4)CC3)=NC2=O)ccc1O 2296133065 XKJVVZRFJQINFN-UHFFFAOYSA-N 443.956 4.155 10 10 IICE CC(C)C[C@H]1NCCc2cc(N=Nc3nncs3)c(NS(=O)(=O)C(F)(F)F)cc21 2333141271 AWPSFGIGOANSQW-GFCCVEGCSA-N 448.496 4.448 10 10 IICE COc1ccc(Br)c(CNC[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1O 2336895428 IXURDUQNTIKVQR-HNNXBMFYSA-N 431.371 4.192 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCOC)C2=O)cc(Br)c1OCC 2938572 FZVMMQQKEQTVNN-GXDHUFHOSA-N 446.388 4.094 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@@H]3C=CC[C@H]32)c1O 20694037 AFGIGDYJTCHWBK-PMAPCBKXSA-N 440.565 4.402 10 10 IICE O=C(O)c1ccc(-c2ccc(/C=C3\C(=O)N(c4cccc(F)c4)C(=S)N=C3O)o2)cc1 33331392 FLDAFNMZWFCFFP-BOPFTXTBSA-N 436.420 4.456 10 10 IICE CCCCN1C(=O)/C(=C\c2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 33351541 DVXKSNGMCGXSIR-LFIBNONCSA-N 430.599 4.072 10 10 IICE C[C@@H](NC(=O)c1c(Br)c2ccccc2n1C)c1ccc(N2CCOCC2)cc1 109190264 VSNHLMDXLHLUIU-OAHLLOKOSA-N 442.357 4.268 10 10 IICE COc1ccc(N2CCN(C(=O)CNc3ccc(C(F)(F)F)cc3Cl)CC2)cc1 248135990 MWLPBZVKSKTRGL-UHFFFAOYSA-N 427.854 4.128 10 10 IICE CCNC(=O)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)c1 435556257 KVXJTXUETVSVMV-UHFFFAOYSA-N 432.568 4.105 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc([C@@H]3COc4ccccc4O3)no2)C1 567311033 NFFJTIQLAYUBOP-QHCPKHFHSA-N 430.508 4.352 10 10 IICE C[C@@](Cc1ccc(O)c(O)c1)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 724085343 WRIYRSHCZBPMDQ-VWLOTQADSA-N 433.460 4.022 10 10 IICE COc1cc(Br)c(CN(C)c2cc(OC)c(OC)c(OC)c2)cc1OC 741795215 HQPSUBILJLXANA-UHFFFAOYSA-N 426.307 4.129 10 10 IICE CNC(=O)c1cccc(CCC(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 751949847 GGJBDFPVAWGRRG-UHFFFAOYSA-N 445.563 4.287 10 10 IICE CC(C)Cn1ncc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C(F)F 760809180 XBSZRXXBFUFNJD-UHFFFAOYSA-N 435.519 4.007 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)NC1(CCOCc2ccccc2)CC1 760820571 QORLIIDQCNDPGM-UHFFFAOYSA-N 425.598 4.179 10 10 IICE Cn1ncc(Br)c1/C=C1\SC(=S)N(c2ccc(F)c(Cl)c2)C1=O 779205338 WGYDXLVMQVOUHK-XGICHPGQSA-N 432.727 4.381 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC[C@@H]2c2nc(C(=O)OC)c(C)s2)c1O 794663473 MXKSORKBMDYKKO-GOSISDBHSA-N 440.521 4.221 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N3CCCC3)CC2)c(C)n1-c1ccc2c(c1)CCC2 800743685 NTKUZEXAHVXCEC-UHFFFAOYSA-N 433.596 4.100 10 10 IICE Cc1cc(N2CCSCC2)ccc1NC(=O)NCc1cc(Br)ccc1O 806246663 ZHRRTOLFUUREMZ-UHFFFAOYSA-N 436.375 4.338 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccccc1 1128473922 OISOHLFWRSNWSQ-BSTRVPIWSA-N 426.538 4.089 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCCN(Cc2ccccc2)C1 1137438609 OYEAVEGXIWOVKG-NZQKXSOJSA-N 442.003 4.038 10 10 IICE C[C@H](NC(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1138364798 ZCPQUHCOGDAJCF-GHTZIAJQSA-N 425.573 4.456 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)[C@@H]1SC 1163085228 OGKWRFDJHUAFKM-QRQLOZEOSA-N 437.403 4.495 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(Cl)c(F)c1 1165498070 LBLYIZYFWXOUKX-FOIQADDNSA-N 439.314 4.453 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccsc4)C3=O)c2C)cc1C 1165615735 STWVUPYWEYWHBD-DEOSSOPVSA-N 435.549 4.422 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1227036078 OKFRRUDBDBASSD-XMMPIXPASA-N 446.551 4.138 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCC3(Cc4cccc(Cl)c4)CC3)C2)cc1 1251766121 RKJUREBHBCHEJT-IBGZPJMESA-N 427.976 4.497 10 10 IICE COc1cccc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1264440165 TVIBGSHDTMFUNG-YQNUULROSA-N 444.553 4.303 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O 1290374828 OJXNUTSXMNKLMS-UHFFFAOYSA-N 444.457 4.469 10 10 IICE COc1ccc(-c2cncc(C(=O)NCc3cccc(Br)c3O)c2)c(C)c1 1297441085 SHTVDGBKUJFGDQ-UHFFFAOYSA-N 427.298 4.464 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)sc2c1CCCC2 1349326640 AOZOJBOCYKSIPF-AWEZNQCLSA-N 444.528 4.243 10 10 IICE C[C@H]1[C@@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1350627954 DPWICQYLFDLOOO-HOCLYGCPSA-N 434.492 4.046 10 10 IICE C[C@H](N[C@H](C)COCC1CCCCC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1460812716 DOHCVIOCPOGAKD-MSOLQXFVSA-N 448.563 4.364 10 10 IICE CC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@H](CC)CN1C(=O)OCc1ccccc1 1465267159 GQJQZJQBPZYXQQ-DYEAYBGSSA-N 438.524 4.149 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC3(CCOCC3)C2)cc1F 1503393798 LQAUYHMSHAWLQK-UHFFFAOYSA-N 429.584 4.127 10 10 IICE Cc1ncsc1CN(C)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1510463589 HEWBVAQTBYOIKF-UHFFFAOYSA-N 443.627 4.380 10 10 IICE C[C@@H](NC(=O)CN(Cc1ccccc1)c1ccccc1)c1ccc(N2CCOCC2)cc1 1519155496 GXIPKCKDLPRECB-JOCHJYFZSA-N 429.564 4.407 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(F)cc(N4CCOCC4)c3)cc2Cl)C1 1524702774 DUCDFEPMKVXHED-KRWDZBQOSA-N 445.966 4.482 10 10 IICE COc1ccc([C@@H](OC)[C@@H](C)NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1527126909 GKTBREGPWZKTRU-QUGAMOGWSA-N 436.552 4.430 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)c3ccc4cc(OC)ccc4c3)CC2)c(OC)c1 1530968105 JAUYJLKDRWEYTJ-SFHVURJKSA-N 434.536 4.318 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1532105666 NRFGJHPDUHSPKY-SFHVURJKSA-N 430.504 4.158 10 10 IICE Cc1cc(CCNC(=O)/C=C\c2ccc(OCCN(C)C)cc2)c(C)n1-c1ccccc1 1534548899 HLWLHZLIHPURBX-QINSGFPZSA-N 431.580 4.407 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(-c4ccc(F)cc4)s3)cc2)CC1 1537838695 DZKBORAEXWMENI-UHFFFAOYSA-N 437.540 4.186 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)cc1 1538161342 VMKUWQHBCIHJCT-UHFFFAOYSA-N 447.514 4.019 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@@H]2CCCC[C@@H]2C1 1538543665 ZRMXEPKFYANIKG-IQXDWNFHSA-N 432.586 4.456 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(c3cccc(OC(F)(F)F)c3)CC2)N(C)C)cc1 1539235013 JUYMVNQWMIIMHB-HXUWFJFHSA-N 435.490 4.102 10 10 IICE Cc1cc(I)cc(C(=O)NCc2ccc(N3CCCC3)cc2)c1C 1540729092 HQDVHFGVHMFSKH-UHFFFAOYSA-N 434.321 4.438 10 10 IICE CC(C)(C)Cn1c(O)nc2cccc(C(=O)NCc3ccc(N4CCSCC4)cc3)c21 1544409530 QFOSSVIFWGYJFX-UHFFFAOYSA-N 438.597 4.271 10 10 IICE CC1CCN(c2ccc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cn2)CC1 1545632866 XSNMZANAXXDJJK-OAQYLSRUSA-N 442.991 4.071 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@@H]4CCCOC4)n3CCCC(C)C)CC2)cc1 1554958473 BQAMYMLATIWDJO-OAQYLSRUSA-N 441.620 4.334 10 10 IICE Cc1cc(C(=O)N[C@H](C(C)C)[C@@H](CO)C(C)C)c(C)n1-c1ccc(Br)cn1 1556712891 ZJHLABHLNPCALK-AZUAARDMSA-N 436.394 4.271 10 10 IICE COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)c2ccccc2O)cc1 1560075198 WFZLKVZRNOEHTK-KOSHJBKYSA-N 429.520 4.429 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC(Cc4ccccc4C(F)(F)F)C3)C2)cc1 1564961968 ASNWHKARHLIRKN-QGZVFWFLSA-N 447.501 4.424 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H](c2ccc(F)cc2F)c2nccn2C)C2CC2)cc1 1565449848 AZOUAWHHYYUMEZ-QFIPXVFZSA-N 439.510 4.228 10 10 IICE C[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1612782903 JCVMMAMWQWJMEY-FQEVSTJZSA-N 439.648 4.459 10 10 IICE Cc1ccccc1[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)C 1616786498 JDPDZTKEEFOWJX-CUVVAGTFSA-N 441.591 4.351 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCNc3ccccn3)CC2)cc1 1619301824 ZSUMVZZEDHVHHL-UHFFFAOYSA-N 449.603 4.024 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](OC(=O)N(C)C)C2)c(C)n1-c1ccc(Br)cc1 1627947750 QLFJTAJZLQQYNX-GOSISDBHSA-N 448.361 4.159 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N(C)CCN1CCN(Cc2ccccc2)CC1 1636301216 FAMDNZTZNIOUIW-UHFFFAOYSA-N 436.625 4.045 10 10 IICE COC(=O)[C@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1cccc(F)c1 1639436864 FGNFYHBENWYFEB-SFHVURJKSA-N 436.439 4.409 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639898000 UDAHHYPGBBPOBN-LPHOPBHVSA-N 432.362 4.283 10 10 IICE CCOC(=O)[C@@H](c1cccnc1)N(C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1644580592 KMXYMXQTRKRDMC-HSZRJFAPSA-N 439.943 4.448 10 10 IICE CCN(C)c1ccc(CN(C)[C@H](C(=O)OC)c2cc(OC)ccc2Br)cc1 1654517973 UTECLDJQYLARDP-FQEVSTJZSA-N 435.362 4.260 10 10 IICE COC(=O)c1nc(Cl)n(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)n1 1656948084 QDKOJRZSAVEZEQ-UHFFFAOYSA-N 440.809 4.027 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 1679394602 JCWOKRDSFORNAT-VWLOTQADSA-N 444.620 4.465 10 10 IICE COc1ccc([C@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c2ccco2)cc1 1683392919 IRHNEYAHHZYUSG-VWNXMTODSA-N 436.556 4.046 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCCCc3cc(OC)c(OC)cc32)cc1 1684966209 DEJLXRLFFUOIAH-JOCHJYFZSA-N 441.572 4.258 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc2c(c1)CCCN2C 1712525286 MUNQEPPGHRNCKI-IBGZPJMESA-N 441.620 4.059 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCCCCC2)nnc1[C@@]1(OC(C)C)CCOC1 1724233622 AATDDMMOLZFOAL-RUZDIDTESA-N 441.620 4.122 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@](C)(OC)C1 1748382356 YTMYHMWWEYSMEF-UQBPGWFLSA-N 437.588 4.393 10 10 IICE CCOCc1nnc(N2CCC[C@H]2c2ccc(C)o2)n1Cc1ccc(N(C)C)c(F)c1 1766365909 LLIQGVMPULXVFA-FQEVSTJZSA-N 427.524 4.311 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1Cc1cc(Br)cs1 1768681909 PUEFFXBJZBUUTK-UHFFFAOYSA-N 444.358 4.488 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCOCCC(C)C)CC2)cc1 1770257532 CXZNGQRWQWVQPY-UHFFFAOYSA-N 441.620 4.334 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3cc4cc(Cl)ccc4oc3=O)cccc21 1859707347 RPIIYOHPDVRNIE-UHFFFAOYSA-N 429.815 4.474 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(COc5ccccc5)[nH]c4c3)CC2)cc1 1872798199 OMJOLSKYYZUFTO-UHFFFAOYSA-N 442.519 4.113 10 10 IICE COc1ccc2c(c1)CCc1c-2n[nH]c1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874180542 DBEVNLQUAKHTJM-UHFFFAOYSA-N 449.466 4.212 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(Br)c(F)c1 1891660982 UPLBIMBQAYCJMR-HOCLYGCPSA-N 439.350 4.055 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(NC(=O)c2ccccc2[N+](=O)[O-])C1=O 2296048004 BYMVPSWDCRIMSD-UHFFFAOYSA-N 425.491 4.087 10 10 IICE CCCOC(=O)CCCN1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2296881671 VHWOSZSHVSZVKH-UHFFFAOYSA-N 428.373 4.384 10 10 IICE CCCCN1C(=O)C(=C2SC(=S)N(CCCCCC(=O)O)C2=O)c2ccccc21 2314754579 WAQXPJCFTBQZMA-UHFFFAOYSA-N 432.567 4.050 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2cc(OC)ccc2OC)SC1=S 2314767032 CSOVBEHXOUILPM-IBGZPJMESA-N 443.546 4.209 10 10 IICE Cc1ccc(CN[C@@H]2[C@@H]3CCCCN(C(=O)OC(C)(C)C)[C@@H]32)c(O)c1Br 2352944476 INFAQYIMIVLQFG-UAGQMJEPSA-N 425.367 4.341 10 10 IICE CCN1C(=O)/C(=C\c2cc(Br)ccc2OCc2cccc(F)c2)NC1=S 6178361 QOQCLYSGPNOSPX-MHWRWJLKSA-N 435.318 4.245 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472444 NTABJDONIMPISH-DPLHUUCSSA-N 434.540 4.493 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(NC(=O)C4CCCCC4)CC3)ccc21 483574174 DEJQSMFNWHUJEH-UHFFFAOYSA-N 439.600 4.206 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(C)c3)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526322663 IAAYTYPSLRXKPU-HSZRJFAPSA-N 433.460 4.481 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc(Cl)s2)cs1 731050842 PRDLTEHHECNKPT-UHFFFAOYSA-N 431.904 4.243 10 10 IICE Cc1ccc(/C=C\C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(Br)c1 736195324 FFKAMXNAZOBRHC-TWGQIWQCSA-N 443.385 4.296 10 10 IICE C[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]1c1cccc(F)c1 746760468 XDWARJIVJCGFMP-QMHKHESXSA-N 429.511 4.219 10 10 IICE C[C@H]1CN(c2ccc(CN[C@H](C)c3cc(Br)c(F)cc3O)cn2)C[C@@H](C)O1 756419554 VMQQSZZYLJQKFU-HZSPNIEDSA-N 438.341 4.153 10 10 IICE C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc2c(cc1O)CCCC2 756769852 OMXMXVLNNOPJTO-GOSISDBHSA-N 428.598 4.047 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ncc(Br)cc1Br 759933363 VKEBHGSBBVHCEH-UHFFFAOYSA-N 428.124 4.365 10 10 IICE COc1ccc(Cl)c(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768878548 QRUTVTXIICDGNX-UHFFFAOYSA-N 428.964 4.202 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1O 779619612 HYZYXTGKTSUJTO-KRWDZBQOSA-N 436.487 4.089 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](c3ccc(F)cc3)C(F)(F)F)CC2)cc1 792496222 MIXSFECTAXTTTL-LJQANCHMSA-N 425.426 4.360 10 10 IICE COc1ccc(N(CC(=O)Nc2ccccc2F)CC(=O)Nc2ccccc2F)cc1 794248145 WGBFLUMTBBCITC-UHFFFAOYSA-N 425.435 4.057 10 10 IICE COc1cc(NS(=O)(=O)c2csc(-c3cccc(Br)c3)n2)ccc1O 797820381 VBKBUAYGVAJIQQ-UHFFFAOYSA-N 441.328 4.088 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCOC3)n2C[C@H]2CCCCO2)c(C)n1-c1ccccc1 812440491 CWCLWJTVXUTTTL-FCHUYYIVSA-N 435.572 4.147 10 10 IICE COCCN1C(=O)CCc2cc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)ccc21 1128247034 CJYQKYNFBRMORD-UHFFFAOYSA-N 431.536 4.201 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1131031312 ZEHHZGUUWDGBSC-LNYGYFNRSA-N 431.536 4.441 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(-c4ccc(C)cc4)nc3C)CC2)c(OC)c1 1132036787 YVBOYJWABDNMOX-UHFFFAOYSA-N 437.565 4.407 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(OC(F)F)cc2F)C1 1132552209 IAMUPOLMHRELSM-UHFFFAOYSA-N 445.485 4.465 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)CC2)cc1 1137658657 QQEQTMIKEDKQKK-UHFFFAOYSA-N 449.551 4.000 10 10 IICE COC(=O)c1cnc([C@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)s1 1148947895 ZIYHTXOUAYQQPE-SFHVURJKSA-N 437.565 4.286 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCCC4=O)CC3)cc2Cl)C1 1227208522 NOUXDKSDEHTCEK-UYAOXDASSA-N 447.023 4.263 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NN1CCCc2ccccc21 1296855636 JXMNCOFATDQKDH-JXAWBTAJSA-N 443.619 4.214 10 10 IICE CO[C@@H](Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C)C(C)(C)C 1299720714 YRJIRIKHIJOYER-NRFANRHFSA-N 443.636 4.110 10 10 IICE Cc1cc(C(=O)CSc2nnc(-c3ccccn3)n2C)c(C)n1-c1ccc(Cl)cn1 1307314131 HKVNEWBGUNQCMN-UHFFFAOYSA-N 438.944 4.308 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1cccc(C(=O)OC(C)(C)C)c1 1312372919 XLBDGMWBKOAHIL-GOSISDBHSA-N 425.573 4.447 10 10 IICE Cc1cc(CNC(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1313134164 YYCOJHDFQYQKTQ-OAQYLSRUSA-N 426.561 4.293 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C[C@H]2CCC3(CCOCC3)CO2)cc1 1350088249 RTXNXDAZKPJYQM-JOCHJYFZSA-N 426.557 4.240 10 10 IICE C=CS(=O)(=O)CCC(=O)Nc1nc(-c2cc(C)n(-c3ccc(C)cc3)c2C)cs1 1351050752 JAFXQHAKNXHRKW-UHFFFAOYSA-N 429.567 4.413 10 10 IICE Cc1cc(C)c(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1I 1354371223 KXPLWIJNDHRTTM-UHFFFAOYSA-N 436.293 4.013 10 10 IICE C[C@@H](NC(=O)C1(N(C(=O)OC(C)(C)C)C2CC2)CCC1)c1ccc(N2CCOCC2)cc1 1442414542 VGIWKTQVSTVUNX-GOSISDBHSA-N 443.588 4.023 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c1 1448224113 JPZDUNPPYSDNAL-QHCPKHFHSA-N 429.564 4.366 10 10 IICE COc1nc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc2ccccc12 1457095502 JQEYCRBSKMCHFE-MRXNPFEDSA-N 427.451 4.244 10 10 IICE Cc1cc(CN2CCNC(=O)[C@@H]2c2ccccc2Br)ccc1N1CCCCC1 1459897250 RUNNHCHLGFQWIG-QFIPXVFZSA-N 442.401 4.421 10 10 IICE C[C@@H](NC(=O)c1cc(OCc2ccccc2)ccc1O)c1ccc(N2CCOCC2)cc1 1464531322 UPCHCDONBZVNTJ-LJQANCHMSA-N 432.520 4.299 10 10 IICE CCOCc1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1503028167 AONUXPDKUIYBKE-OALUTQOASA-N 429.634 4.041 10 10 IICE CCCc1c(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)nnn1-c1cccc(C(C)C)c1 1528317296 FURPTKWYSILGHA-HXUWFJFHSA-N 447.583 4.361 10 10 IICE CNc1cc(-n2nc(C)cc2NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)ncn1 1538646692 GJWPCAICCQWLBA-UHFFFAOYSA-N 449.946 4.255 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1539583003 XPINNHRZEXPJII-KRWDZBQOSA-N 444.457 4.320 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)nn1-c1ccc(Br)cc1 1542389622 ITTAQHNSUUKICZ-UHFFFAOYSA-N 439.357 4.256 10 10 IICE CCOC(=O)CC1(NC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CCOCC1 1543028685 APHHMBKBSPNTCU-UHFFFAOYSA-N 438.528 4.400 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CCS(C)(=O)=O 1547020121 MPPVKWIJWYKYCQ-UHFFFAOYSA-N 443.617 4.024 10 10 IICE CCN(c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)cc1)[C@@H](C)C1CCC1 1547375548 DUSKXRMEQXLLNY-FQEVSTJZSA-N 425.621 4.376 10 10 IICE C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1558723626 SOKOUFJDRXRONB-DFBJGRDBSA-N 446.595 4.330 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCO[C@H](c2ccncc2)C1 1564774400 LMYIOTFYYJKMJQ-HKUYNNGSSA-N 434.334 4.002 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](COC)OC 1614160766 QFZMROXCEWXYKI-IFMALSPDSA-N 437.588 4.393 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1623477421 ZDHMGXPJDRJOSM-CTNGQTDRSA-N 433.568 4.230 10 10 IICE Cc1cccc2c1CCN2C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1624772562 HFSOFURATCAIHS-UYRXBGFRSA-N 426.538 4.315 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1C[C@@H]1C1CCCC1 1627953419 JRBUQPHEAUXTIH-CHISUXBFSA-N 432.586 4.360 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cnc(CNC(=O)OC(C)(C)C)s3)cc2)CC1 1628608665 JAWISIISJCOLPJ-UHFFFAOYSA-N 444.601 4.334 10 10 IICE CC(C)(C)OC(=O)N1[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)CC[C@@H]1C1CC1 1629137154 XJOHWARXFLGDKX-HZPDHXFCSA-N 429.344 4.493 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C 1629969644 YZJFGJGXHSTLGZ-XJKSGUPXSA-N 441.366 4.149 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](CC1CC1)NC(=O)OC(C)(C)C 1629971729 GDAIEUIKIXEONK-MRXNPFEDSA-N 441.366 4.197 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@@H](Oc1ccc(Br)cc1F)c1ccccc1 1633595405 UYNZNGURWGIMCI-FQEVSTJZSA-N 446.272 4.436 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1634720397 VLIQFCWOERBIBQ-PXNSSMCTSA-N 447.982 4.366 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2ccncc2Br)cc1 1637382018 DQNKLEBPFVDDOP-OAHLLOKOSA-N 440.341 4.484 10 10 IICE C[C@@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cc(Cl)cc2c1OCC2 1638652171 XBEBINGORFKFAK-BEFAXECRSA-N 430.932 4.432 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3ccc(F)cc3F)CC[C@@H]2C)c([N+](=O)[O-])c1 1640452699 GNWZOFINAFLWFC-UVCVVPOWSA-N 431.439 4.164 10 10 IICE Cc1ccc(C(=O)NCc2ccc3c(c2)OC(F)(F)O3)cc1-n1c(C)cc(C=O)c1C 1643480429 ZGLOUKGLTZBHFB-UHFFFAOYSA-N 426.419 4.467 10 10 IICE C[C@@H](NC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1)c1ccccc1O 1648887071 BNFHLUKHIVKRTN-CQSZACIVSA-N 430.913 4.337 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 1651222468 HBAOPBNZVMUDQY-UHFFFAOYSA-N 441.281 4.043 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](CC3CC3)c3ccccc3)cc2F)C[C@@H](C)O1 1658037660 HBQNEIXHPDBWRI-YDIMBITNSA-N 439.575 4.187 10 10 IICE Cc1ncc(CN(C)c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)cc2C)s1 1707778307 XJITWHHDWGCAOA-UHFFFAOYSA-N 447.612 4.088 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(N(C)C)nc1 1760994412 ZHQBUWKNMPXTRE-UHFFFAOYSA-N 447.631 4.223 10 10 IICE CCc1nc(CN(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1762780869 RBVWZVKGYZHJOY-UHFFFAOYSA-N 430.597 4.385 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763854764 LLGGWDKDMHFBBI-PGRDOPGGSA-N 445.583 4.026 10 10 IICE CC[C@H](C)NC(=O)CCn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1763933777 RRQPHRYWWGCMEK-IBGZPJMESA-N 438.620 4.087 10 10 IICE CCN(Cc1cccs1)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)cc1 1766737367 MJUVWHPLHLSMQY-UHFFFAOYSA-N 425.602 4.374 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])c(C)c3)C2=O)cc(OC)c1OC 1860087691 OBCHCSJXGRTUJS-LICLKQGHSA-N 446.506 4.335 10 10 IICE CCOc1cc(/C=C2/C(=O)N(c3ccc(OC)cc3)N=C2C)cc(Br)c1O 1865667209 KVYUIFSFUBLLDK-CXUHLZMHSA-N 431.286 4.368 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(F)c(C(F)(F)F)c1 1891654438 UKPQJCLGMNCTOS-HOCLYGCPSA-N 428.451 4.312 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cccc(Br)c3O)C[C@]2(C)C1 2116284825 IBZBAVUHEYYARK-BXTJHSDWSA-N 425.367 4.280 10 10 IICE NCc1cc(F)c(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)cc1Br 2186714445 HFLIPSUVZIGBRM-SFHVURJKSA-N 446.286 4.300 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1ccc(I)c(Br)c1 2225802095 XNTAVXYXBZRHTD-WDEREUQCSA-N 435.063 4.015 10 10 IICE Cc1c(Cl)cccc1N1C(=O)C(=Cc2cccn2-c2ccccc2F)C(=O)NC1=S 2294208490 JKAJJFDGWDGPGN-UHFFFAOYSA-N 439.899 4.410 10 10 IICE CCOc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(C4CCCCC4)C3=O)c2C)cc1 2297454248 OUZRCHDDDLSHHV-UHFFFAOYSA-N 435.524 4.287 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N([C@H](CC(C)C)C(=O)O)C1=O)C(C)=O 2314928474 WLWXDLWPFVEKKL-HZPDHXFCSA-N 435.567 4.134 10 10 IICE Cc1cc(C=CC(=O)N2CCC3(CC2)OCCO3)c(C)n1-c1ccc(C(F)(F)F)cc1 2318646620 FEFFNGOAUKKWLC-UHFFFAOYSA-N 434.458 4.492 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\C3=Cc4ccccc4OC3)SC2=S)cc1OC 33313718 CJOHYSIJRUMTIS-FYJGNVAPSA-N 439.558 4.467 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@@H](c3ccc(Br)cc3)C2)c([N+](=O)[O-])c1 63254915 RXNUWERGAYTZEB-JFKHNGDKSA-N 447.285 4.121 10 10 IICE CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C/c1cc(C)n(-c2ccccc2Cl)c1C 101652194 GNDJOTGWJMTSFX-XMHGGMMESA-N 442.943 4.457 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1CC(F)(F)F)N1CCO[C@@H]2CCCC[C@H]21 109624527 VMVGOWWTEZJVPQ-SJLPKXTDSA-N 439.503 4.375 10 10 IICE Cc1cc2c(n1-c1ccc(Br)c(I)c1)CCC[C@@H]2N 311410264 AMRMCEAUFLYNKZ-AWEZNQCLSA-N 431.115 4.489 10 10 IICE COc1cccc(CNc2ccc(Br)c(I)c2)c1O 381883970 YVAZMBUTWVVSQX-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F 444990529 QVXPASAPRFIUBN-UHFFFAOYSA-N 448.445 4.025 10 10 IICE COc1cc2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)[nH]c2cc1OC 735656467 PTSIXXPQKDNNIK-FQEVSTJZSA-N 437.540 4.073 10 10 IICE CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cccc4ccccc34)n2)s1 752192280 UPNFSMFKHOXKSL-UHFFFAOYSA-N 443.575 4.462 10 10 IICE CC(=O)N1CC[C@@H](NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c2ccccc21 757618498 ULSUYMBIYUWEDI-XMMPIXPASA-N 430.552 4.434 10 10 IICE COc1cccc(-c2nsc(NC(=O)NCc3ccc(N4CCSCC4)cc3)n2)c1 757946196 MNXNULLAZKAOPN-UHFFFAOYSA-N 441.582 4.089 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 771941809 URZAXOIEBHXUMT-IBGZPJMESA-N 434.462 4.064 10 10 IICE CC(C)[C@@H]1C[C@@H](CC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc21 782724529 DNWQHSRTILJTBB-CZSZKKDXSA-N 433.596 4.322 10 10 IICE CN(C)c1ccc(CNC(=O)c2c(Br)cccc2Br)cc1F 798412717 GFUJBESQLOABCA-UHFFFAOYSA-N 430.115 4.347 10 10 IICE COCCOc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1Cl 806225588 SETKBCJTUZKXMT-UHFFFAOYSA-N 429.698 4.155 10 10 IICE Cc1cc(CC(=O)N2CCC(c3nnc4n3CCC4)CC2)c(C)n1-c1ccc(Cl)cc1 918115756 FEDHCGYGWZAEBS-UHFFFAOYSA-N 437.975 4.234 10 10 IICE O=C1NC(=S)N(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1cccc(F)c1 1081104992 AIYGQNUKOVXCDE-XSFVSMFZSA-N 432.476 4.236 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(-c4ccccc4C(F)(F)F)on3)C2)cc1 1130826697 HHUMSZOGYIYIFQ-CQSZACIVSA-N 431.414 4.378 10 10 IICE CCN(CC)C1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1136668524 SYFWVFVDTZGHPM-UHFFFAOYSA-N 433.394 4.198 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C)[C@@H](n3ccnc3)C2)c(C)n1-c1ccc(Br)cn1 1137483960 JWOQHMOFHXJFDT-LIRRHRJNSA-N 442.361 4.171 10 10 IICE Cc1ccc(C(=O)Nc2cccc(-n3cnc(N(C)C)n3)c2)cc1-n1c(C)cc(C=O)c1C 1155146867 WQSHWPJOKLMOMJ-UHFFFAOYSA-N 442.523 4.114 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nccnc1-c1nc2ccccc2s1 1162115157 REYYTBNLWAIMQL-INIZCTEOSA-N 431.565 4.489 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)Cc3cccc(Cl)c3)[C@H](C)C2)c1O 1191279123 WAZYJPAEHURZGJ-CQSZACIVSA-N 435.351 4.177 10 10 IICE CC(C)[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c2ccccc21 1194000872 ZFWOPFYCUZRRRA-JQVVWYNYSA-N 439.575 4.315 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)CC1 1196048473 VSNANIDIDSFUTO-QHCPKHFHSA-N 443.632 4.382 10 10 IICE O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1252903108 TZRPIIZLWNGSMQ-QUCCMNQESA-N 443.975 4.263 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](OCC(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1291517168 QDLQOWCFBIQRSW-KNQAVFIVSA-N 425.621 4.474 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)cc1 1297281815 UEUIXCXZIHIRKZ-XMMPIXPASA-N 429.564 4.087 10 10 IICE CCOC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1303455295 AIUDVPYJMBMMEZ-GMAHTHKFSA-N 426.557 4.448 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H]1CCCCCN1C(=O)OC(C)(C)C 1312884395 JFIGZHGXOKITOF-UGKGYDQZSA-N 446.636 4.471 10 10 IICE CS[C@@H]1CCC[C@H](NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1435165204 IBGTVHSVPFVSBQ-GUNNMUBUSA-N 438.615 4.207 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)c1C 1441491504 GTKOCXZGBYLLGZ-QFIPXVFZSA-N 430.596 4.343 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(N3N=C(Cc4ccccc4)CC3=O)cc2)c1 1457617188 RCGXAJWWNNIZRG-QGZVFWFLSA-N 443.503 4.227 10 10 IICE COc1ccc([C@@H](CNC(=O)OC(C)(C)C)CN[C@H](C)c2cc(OC)ccc2O)cc1 1459848114 GEWVJCFZRPYHJP-SJLPKXTDSA-N 430.545 4.369 10 10 IICE Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460738345 ACTKOKFOKZKONL-QGZVFWFLSA-N 432.511 4.317 10 10 IICE COC(=O)C[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(OC)cc1 1464005651 SZRHUQYEOKXVMS-HSZRJFAPSA-N 448.519 4.258 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1(c2ccc(Cl)cc2)CCC1 1470449590 WJUSMVHNEYWFRH-UHFFFAOYSA-N 435.902 4.333 10 10 IICE CCOC(=O)c1c(C)nc(O)nc1SCC(=O)c1cc(C)n(-c2ccccc2C)c1C 1473083767 YQQIUWWIEGJSMR-UHFFFAOYSA-N 439.537 4.358 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1516400952 GOMSYECGKAVGPG-SIKLNZKXSA-N 443.661 4.398 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCCC1 1517584401 KMMHOSOMQSLNLA-UHFFFAOYSA-N 434.588 4.115 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2 1529083835 QHAGTIXEFRAOSJ-UHFFFAOYSA-N 426.923 4.458 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@@H]1C[C@H]2CC[C@H]1C2 1536315698 YUZKMUPPCUVKFJ-IPJSKRPOSA-N 432.586 4.360 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1 1539562003 AZVSRXMZWNOKOY-VWLOTQADSA-N 435.543 4.345 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)CCCC1 1556221730 KIKSOLVEYFOQHH-NYHFZMIOSA-N 438.490 4.129 10 10 IICE COC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)cn1C 1566128776 APEKIRVRKKZUJJ-UHFFFAOYSA-N 430.302 4.234 10 10 IICE Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1566846083 LTVHBXQSMRNBRB-GOSISDBHSA-N 444.535 4.329 10 10 IICE Cc1cc(C(=O)N[C@@H]2CN(c3ccccc3)C2=O)c(C)n1-c1ccc(Br)cc1 1567495562 LEEWUDDKOSJODR-HXUWFJFHSA-N 438.325 4.002 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4CCCCC4)cc3)nn2C)cc1OC 1570582189 ZCZXMCPXKISPHJ-UHFFFAOYSA-N 434.540 4.025 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C(C)(C)n1cc(C)c(C(F)(F)F)n1 1588193007 IFHNJWNOLQLRHR-UHFFFAOYSA-N 448.283 4.462 10 10 IICE CC(C)[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1603073295 ZOAOMDMWLOTZFL-NRFANRHFSA-N 443.661 4.038 10 10 IICE CN(C)c1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 1612345611 SKMZEKDDZGTJAW-GOSISDBHSA-N 445.476 4.247 10 10 IICE COC(=O)Cc1cc(=NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)c2ccccc2[nH]1 1615759357 FVHMMJOGMQRIAR-SANMLTNESA-N 446.595 4.077 10 10 IICE CC[C@H](C)n1nc(C)c(-c2cc(C(=O)NCc3cccc(Br)c3O)n[nH]2)c1C 1623363414 GOZWZBKEHKPFSL-NSHDSACASA-N 446.349 4.259 10 10 IICE CN1CCCc2cc(CNC(=O)c3c(O)cnc4c(Br)cccc34)ccc21 1626940245 DLLYTJLYZLPDIQ-UHFFFAOYSA-N 426.314 4.015 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(C(=O)N4CCOCC4)cc3)c2C)c1 1630305813 YIZJGSJGSOYUBK-UHFFFAOYSA-N 431.536 4.436 10 10 IICE Cc1ccc(C(=O)N(CCc2ccccc2)CCN(C)C)cc1-n1c(C)cc(C=O)c1C 1630473797 JPGTVDBUXGKROH-UHFFFAOYSA-N 431.580 4.462 10 10 IICE Cc1cc(C)cc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1634023045 UYMNWXFEMDRFRF-INIZCTEOSA-N 427.976 4.239 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C)n1-c1ccccc1 1634049867 QVFRYCHEBCALCE-FNZWTVRRSA-N 430.596 4.456 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](C)c4ccccc43)cc2F)C[C@@H](C)O1 1642168471 XGNOJWVTNQQILB-QRVBRYPASA-N 425.548 4.069 10 10 IICE COC(=O)/C=C/c1ccc(N(C)C2(CNC(=O)OC(C)(C)C)CCCCC2)c([N+](=O)[O-])c1 1651373235 UDIOGSZHFIWFER-ZRDIBKRKSA-N 447.532 4.445 10 10 IICE CCc1nc(N)nc(S[C@@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 1651909662 FZECXRHCNBUSSO-ZDUSSCGKSA-N 447.511 4.389 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)COc3ccc(S(=O)(=O)N(C)C)cc3)c2C)c1 1652644043 KASXUVZFBOYHPY-UHFFFAOYSA-N 440.565 4.223 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCO[C@@H](c2ccc(OC(F)F)cc2)C1 1673744942 PXLMMLUAIKODQS-VGOFRKELSA-N 447.526 4.377 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C[C@H](C(F)(F)F)O1 1686269463 PYYFWBIUFMGNHN-QWQRMKEZSA-N 433.902 4.438 10 10 IICE CC(C)CCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1692311836 VHFDUZRXGDCWAA-UHFFFAOYSA-N 448.615 4.173 10 10 IICE Cc1cccc(-c2nnc(N3CCO[C@@H](C(C)C)C3)n2CCCSc2nccs2)n1 1693199987 HHJJFLKBXVPWIG-GOSISDBHSA-N 444.630 4.149 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)C[C@H]2CCOC2)cc1 1695624836 MTHMXBYVHGUPOM-JOCHJYFZSA-N 425.621 4.378 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC)CCS1 1709323184 DUWLCAXALIJODM-HXUWFJFHSA-N 425.602 4.331 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CC=C(C)CC2)cc1 1710027508 DQXXDCNKCVDSST-GMAHTHKFSA-N 439.604 4.053 10 10 IICE CCN(CCn1c(C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(=O)OC(C)(C)C 1710146815 ZOVNVZDXQMGTQB-UHFFFAOYSA-N 442.608 4.080 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CCN1CCc2sccc2C1 1711095518 OESPPRFPGNJIDG-UHFFFAOYSA-N 425.602 4.037 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)C[C@H]3C)n2CCCC(C)C)c(C)n1-c1ccccc1 1724196361 NWPQBEVVDDLHRE-HXUWFJFHSA-N 448.615 4.456 10 10 IICE CC[C@@H](C)[C@H](Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1743533639 YWJODWXTPWRVMV-OFNKIYASSA-N 443.636 4.263 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCN(CC(C)C)CC2)cc1 1746092406 KURKNUCSHQJUBR-UHFFFAOYSA-N 426.653 4.149 10 10 IICE CC[C@H](C)c1nnc(N2CCN(C3CCC3)C[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1761886043 LDFCDRJNDNSZCX-OALUTQOASA-N 442.627 4.356 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N(C)Cc2ncc(Cl)n2C)cc1F 1768494277 GCPJEXIEWWVXDT-UHFFFAOYSA-N 445.974 4.212 10 10 IICE CN(C)c1ccc2c(c1)Oc1cc(N(C)C)ccc1C21OC(=O)c2ccc([N+](=O)[O-])cc21 1848441672 PICSEEYTMQYPOC-UHFFFAOYSA-N 431.448 4.295 10 10 IICE Cn1c2c(c3cc(Cl)ccc31)C[C@@H](C(=O)N1CCN(c3ccccc3F)CC1)CC2 1858153587 NIVNULFIMJFYQV-INIZCTEOSA-N 425.935 4.425 10 10 IICE CCOc1cc(N2CCOCC2)c(OCC)cc1NN=NC1CC(C)(C)NC(C)(C)C1 1860491699 UTYGAAQGGFUZDH-UHFFFAOYSA-N 433.597 4.409 10 10 IICE CCOc1cn(-c2ccc(F)cc2)nc1C(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1891530525 IPVXYFQTFLMZHV-AVRDEDQJSA-N 434.515 4.329 10 10 IICE CN[C@H](CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1)c1ccc(N(C)C)cc1 1999528312 ZRGVJYIHQYKTGZ-HSZRJFAPSA-N 426.605 4.040 10 10 IICE CN[C@H](C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccc2c(c1)CCN2C 2044754548 MOMUDPASGRTKCQ-XZOQPEGZSA-N 439.600 4.440 10 10 IICE Cc1cc(O)c([C@@H](C2CCC2)n2nc(C(F)(F)F)c(C(N)=O)c2Br)cc1C 2080033159 JCGYOJYMQSAOIW-CQSZACIVSA-N 446.267 4.475 10 10 IICE CC[C@@H](NC[C@@H]1[C@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2138291870 YZEGDZOJHWIRRX-WBQNTZJQSA-N 425.367 4.451 10 10 IICE CC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(Cn2cnnc2)cc1 2313681810 NVDIYYXRILVHQP-UHFFFAOYSA-N 429.509 4.045 10 10 IICE CCCN1C(=O)C(=Cc2c(NC3CCCCC3)nc3c(C)cccn3c2=O)SC1=S 2314415090 XDZUJPMYPDMPFA-UHFFFAOYSA-N 442.610 4.359 10 10 IICE COc1ccc(CN2C(=O)C(=CC3=Cc4cccc(OC)c4OC3)SC2=S)cc1 2314450785 SANYXIKKCGVCDC-UHFFFAOYSA-N 425.531 4.424 10 10 IICE Nc1ccc(CCOCc2cc(I)ccc2Br)cc1 2341783874 WHQPREPMMPUJNC-UHFFFAOYSA-N 432.099 4.395 10 10 IICE Cc1ccc(CN(C)c2ccc(I)cn2)c(O)c1Br 2352656566 LGYUPUJFLKMWCU-UHFFFAOYSA-N 433.087 4.099 10 10 IICE COCCN1C(=O)/C(=C2\C(=O)N(Cc3ccccc3Cl)c3ccccc32)SC1=S 2672159 NLQHLSJVCWZJDF-ISLYRVAYSA-N 444.965 4.105 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc2c(c1)OCO2 6241599 WDMBQTGRBRQNEH-LZYBPNLTSA-N 442.265 4.055 10 10 IICE COc1ccc(N2CCN(Cc3csc(-c4cccc(OC)c4OC)n3)CC2)cc1 7354531 ABCVZWBMBIJAPN-UHFFFAOYSA-N 425.554 4.158 10 10 IICE CN(C)c1ccc(C2(c3ccc(N(C)C)cc3)O[S@](=O)c3ccc(N(C)C)cc32)cc1 15774490 XRTRYADCPDCRGX-WJOKGBTCSA-N 435.593 4.229 10 10 IICE CCCCOc1ccc(/C=C2\SC(Nc3ccc(C(=O)O)c(O)c3)=NC2=O)cc1OC 16933205 IIZQWNBRVVEJDD-ODLFYWEKSA-N 442.493 4.360 10 10 IICE CN1C(=O)/C(=C\c2ccc(-c3ccc(Br)c(Cl)c3)o2)C(O)=NC1=S 33295574 VQBLVZVKPFANFT-YFHOEESVSA-N 425.691 4.459 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCNC(=O)CCC3CCCCC3)C2=O)c1 62059808 RPOPTOSZFRAJCF-XDJHFCHBSA-N 432.611 4.373 10 10 IICE Cc1cccc(C(=O)N2CCN(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)c1 62694524 HKXKIKNAGIHZSU-UHFFFAOYSA-N 433.527 4.182 10 10 IICE CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1ccc(-c2ccc3c(c2)C(=O)OC3)o1 101651855 DHGNXZCOIFOWLY-ODLFYWEKSA-N 428.400 4.121 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cc(COC(C)(C)C)on2)C1 436004557 DMDKUXBVQLCIPD-UHFFFAOYSA-N 438.572 4.027 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cccc1O 687809864 QZYLXWRNKPSGNS-VWLOTQADSA-N 433.460 4.326 10 10 IICE NC(=O)CN1C(=O)/C(=C\c2cccc(Oc3cccc(C(F)(F)F)c3)c2)SC1=S 727175949 JICYXOVVCRXSLN-OVCLIPMQSA-N 438.452 4.184 10 10 IICE CCOc1cccc(CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2cc(F)ccc2F)c1O 742385295 VZARCFMSFBWGSU-QFIPXVFZSA-N 447.503 4.352 10 10 IICE COc1cc(/C=C2\SC(=S)N([C@@H]3CCc4ccccc4C3)C2=O)cc2c1OCCO2 743284986 RLKHCBZGNQRYCI-SYERDGIWSA-N 439.558 4.225 10 10 IICE CC(C)N(CCc1nccs1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754640303 HAOUHMXRSKGYQQ-UHFFFAOYSA-N 438.544 4.376 10 10 IICE C[C@@H]1CN(c2ccc(CN[C@H](C)c3cc(Br)cc(F)c3O)cn2)C[C@@H](C)O1 756418311 SIPSRCXIZALDTM-MGPQQGTHSA-N 438.341 4.153 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)c1 769540314 LFYHEZYKDVCIMD-RVHYNSKXSA-N 442.943 4.144 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@]4(CCOC4)C3)n2CC(C)C)c(C)n1-c1ccccc1 802665249 JFWPTXVCWOECNX-VWLOTQADSA-N 435.572 4.004 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)cc1 1083864663 BJAAHMSVNAUBSI-HKWRFOASSA-N 444.443 4.132 10 10 IICE Cc1c(Br)cccc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127268268 WQPWIRRRNZDKLY-UHFFFAOYSA-N 442.401 4.220 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(S(=O)(=O)NC(C)(C)C)ccc2C)cc1 1135946525 VVEZUGLYGWSPSH-UHFFFAOYSA-N 445.629 4.190 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)c(C)n1-c1cccc(Br)c1 1144656696 JAVOBVLJMNOWAW-HXUWFJFHSA-N 448.405 4.039 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CC(c3ccc(Cl)cc3Cl)=NO2)cc1 1144867707 CPMRPNRNEUHDND-HXUWFJFHSA-N 436.339 4.090 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c(C)nn(-c2ccc(Br)cc2)c1C 1157101918 GAIKQCHKZSWSHL-UHFFFAOYSA-N 449.345 4.373 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)COc3cccc(N4CCCC4=O)c3)c2C)c1 1170858812 QTLNFKOVFCWGNV-UHFFFAOYSA-N 431.536 4.225 10 10 IICE CCOC(=O)CN(Cc1ccccc1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1292282297 UWKXTNZFSJTURP-UHFFFAOYSA-N 432.520 4.421 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cc(I)ccc3O)c2)CC1 1293767697 IQNFBVXZWCCESW-UHFFFAOYSA-N 436.293 4.485 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc3cnccc3c2)NC(=O)OC(C)(C)C)cc1 1293792408 GKGIGRBQGSUXMU-HSZRJFAPSA-N 448.567 4.226 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N(C)CC2COC(C)(C)OC2)cc1 1295419313 IBSYGZZEVRCVRI-UHFFFAOYSA-N 443.636 4.206 10 10 IICE CC(C)(C)OC(=O)NCC1([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2)CCC1 1304180615 RUXUYRVABNFMMD-WAEYIKQSSA-N 430.545 4.187 10 10 IICE CC(=O)c1cc(F)cc(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@H](c3ccccc3)C2)c1O 1307724061 JKAZCLUVNSTLLM-LEWJYISDSA-N 428.504 4.227 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CCc3nncn3CC2)sc(C)c1-c1ccc(F)cc1 1352683156 JQIYRDSWHUWVGG-HNNXBMFYSA-N 442.516 4.222 10 10 IICE CN(C)c1ccc(CN(C(=O)C[C@H]2C(=O)Nc3c(Br)cccc32)C2CC2)cc1 1354142808 VOTRFIHVWWHYAC-GOSISDBHSA-N 442.357 4.132 10 10 IICE CC[C@H](CC(F)(F)F)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1435818648 LIOWHHPBGHMKAQ-OZYJXZHSSA-N 434.480 4.264 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)CC4CC4)cc3)cc2)CC1 1443660616 CFCSZAZMFUXIBC-UHFFFAOYSA-N 426.582 4.037 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445886211 SIXDMZURWJFXKF-LJQANCHMSA-N 442.922 4.073 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CCCN(CC(F)(F)F)C1=O 1446807479 UWJPGLIBFLOSSS-APWZRJJASA-N 434.458 4.283 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)C)C(=O)[C@@H]2C)c(C)n1-c1cccc(Br)c1 1448075640 KCDYAGCICDQHNZ-KRWDZBQOSA-N 446.389 4.186 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C[C@@H]2CCCC[C@@H]2O)sc(C)c1-c1ccccc1 1459840658 PBJBIRYNUOBMNB-OALUTQOASA-N 444.597 4.322 10 10 IICE CC[C@H](CC(F)(F)F)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465325384 PWCOJWXLDHAGIQ-RHSMWYFYSA-N 431.499 4.413 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1C 1466592331 KTLMQSKDRVVIIM-JOCHJYFZSA-N 431.536 4.252 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4cc(C)oc4C)C3=O)c2C)c1 1472984984 UJERSENSHZUFNK-RUZDIDTESA-N 433.508 4.262 10 10 IICE COc1cc(CNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c(Br)cc1O 1478924095 RNMWADDLNBSZPU-UHFFFAOYSA-N 448.361 4.105 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1 1478957368 ORUXKRFUUYPSDT-JOCHJYFZSA-N 432.568 4.489 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](OC)C(C)(C)C1 1517763665 KTFRXUQRHVGQSO-PGRDOPGGSA-N 437.588 4.249 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@H](C)[C@H]2C(=O)OC(C)(C)C)CCCC1 1526122695 SNXDKTPLDGDGLY-XDHUDOTRSA-N 440.584 4.498 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2c3ccc(Br)cc3nn2C)cc1 1539307325 IRMBFNBNDPLDSR-UHFFFAOYSA-N 429.362 4.454 10 10 IICE CCOC(=O)N[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1540841777 BMFYDBTZZUMRJM-QGZVFWFLSA-N 448.361 4.207 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCN(c2ccccn2)CC1 1542227208 WAJAGTPHSFJTKG-UHFFFAOYSA-N 447.631 4.011 10 10 IICE O=C(N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cc2cc(O)c(O)cc2s1 1543352500 WRBDCIMWHUKOOS-OAHLLOKOSA-N 434.920 4.499 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc3c(cc2Cl)NC(=O)CO3)cc1 1543540785 HWSXVFKXWIZHJK-UHFFFAOYSA-N 439.899 4.173 10 10 IICE Cc1ccc([C@@H](CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)N(C)C)cc1 1544272595 DCSWKRAXJVUECH-AREMUKBSSA-N 432.612 4.135 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4ccccn4)n3CCC=C(C)C)CC2)cc1 1554959962 ULRGJEBWFHGXML-UHFFFAOYSA-N 446.599 4.346 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NOCc1ccc(F)cc1Br 1564944912 BIGUPINILKENRZ-AWEZNQCLSA-N 438.341 4.325 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc([Si](C)(C)C)cc1 1564997434 OCUYLUXEDGOLEA-UHFFFAOYSA-N 435.438 4.432 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c(C)n1-c1ccccc1Br 1565611580 KZIBPJNURCOAOR-GDBMZVCRSA-N 446.389 4.376 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3C[C@H]4CC[C@@H]3N4C(=O)OC(C)(C)C)cc2)CC1 1585545473 RYEODWJFPDPLKK-FSSWDIPSSA-N 427.589 4.327 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1620254332 FSMICHGEHLJCLX-HOTGVXAUSA-N 439.676 4.490 10 10 IICE CC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(C)cc1 1627559584 ZAYSMAGCDAEYAG-GOSISDBHSA-N 430.551 4.444 10 10 IICE CCCCN(C)CC1CCN(C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CC1 1628312927 PHLGPFLIDSUWDX-UHFFFAOYSA-N 438.660 4.378 10 10 IICE Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c(C)n1-c1ccccc1Br 1630335431 PAIIJINRNXQNIM-UHFFFAOYSA-N 429.314 4.240 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C 1634938250 CPRLBPUZXXUFFM-KRWDZBQOSA-N 425.566 4.358 10 10 IICE Cc1ccc(C(=O)N2CCN(C)[C@@H](Cc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1636103699 OCJYAVBEWLDYFO-VWLOTQADSA-N 429.564 4.214 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCc2nc(-c3ccccc3)ncc2C1 1636267043 LSFNJKJWGONTOO-CVDCTZTESA-N 443.595 4.306 10 10 IICE Cc1cc(CCNC(=O)N(C[C@@H](O)COc2ccccc2)C(C)C)c(C)n1-c1ccccc1 1637410511 OJMNEVHBGXCQJK-RUZDIDTESA-N 449.595 4.497 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1 1647791593 QJGHVNSDKYXBGI-LJQANCHMSA-N 426.925 4.030 10 10 IICE CCOC(=O)[C@](C)(NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1652148928 OEZBLVUBPPQXIS-AREMUKBSSA-N 432.520 4.423 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3ccccc3Br)C2)cc1 1682188090 GLGHCNUWZQDULW-MRXNPFEDSA-N 432.362 4.126 10 10 IICE Cc1noc([C@H]2CCCN(c3nnc(C(C)(C)C)n3CCCSc3nccs3)C2)n1 1693539858 UHCABLPSYCCZRZ-HNNXBMFYSA-N 447.634 4.290 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(O)CCCCC1 1694106834 AIFKPWLUPAYIFE-HXUWFJFHSA-N 441.620 4.212 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCSC)C1 1712675797 MMGHBLLZWLNYTK-FQEVSTJZSA-N 425.602 4.331 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC[C@H](O)C1 1726984367 HUNVUVWCVXFHSY-VWPQPMDRSA-N 441.620 4.068 10 10 IICE CCC1(CC)CN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1727341924 QJZCYVVWSWSZOD-GOSISDBHSA-N 447.624 4.147 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccco1)OC 1749323443 HLUKHNDYOLJCTP-JOCHJYFZSA-N 449.555 4.243 10 10 IICE C[C@@H]1SCCN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)[C@H]1C 1752460403 GDGBNNJPWHBCTC-HRCADAONSA-N 439.676 4.141 10 10 IICE CCCCCN(c1nnc([C@@H]2CCC(=O)N2)n1Cc1ccc2c(c1)CCCN2C)C(C)C 1763988031 MRHMCPHQWPNLMN-NRFANRHFSA-N 438.620 4.065 10 10 IICE CC(C)Oc1cccc(/C=C2/SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)c1 1858594136 MNFHHQDMIUFQFN-UIMCMNAESA-N 427.547 4.371 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)ccc1O 1860087894 YTUZVZLNOOMPQF-XSFVSMFZSA-N 442.562 4.033 10 10 IICE COc1ccc(N2CCN(C(=O)CCSc3ccc(OC(F)(F)F)cc3)CC2)cc1 1860346883 RAKYUQNXEBDAGI-UHFFFAOYSA-N 440.487 4.425 10 10 IICE C[C@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1c(O)cccc1[N+](=O)[O-] 1952608921 SDWQTLQRPDCICE-XMMPIXPASA-N 448.431 4.139 10 10 IICE CN[C@H](c1ccccc1O)[C@]1(COCc2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1997460415 WSXCTXCXNNSMRE-RCZVLFRGSA-N 426.557 4.497 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C3(C)CC3)c(CO)c2I)c(O)c1 2079024374 CGARVEMGNQYESR-INIZCTEOSA-N 440.325 4.291 10 10 IICE C[C@H]1C[C@@H](CNCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2115816133 BCRJUEBPSIERRG-STQMWFEESA-N 431.346 4.419 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(OC)cc4)c3C)C2=O)cc1 2296660282 SRIADOJFJFHCPC-UHFFFAOYSA-N 443.503 4.332 10 10 IICE O=C(CCN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)Nc1cccc(C(=O)O)c1 7016891 REKMQJYETOXPRJ-WRMVEDGQSA-N 438.530 4.171 10 10 IICE COC(=O)c1sc2ncnc(Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)c2c1C 19949453 KIWYDCUTRZOZFO-UHFFFAOYSA-N 429.457 4.305 10 10 IICE COc1ccc(N2CCN(c3cc(C(=O)NCC(C)(C)C)c4ccccc4n3)CC2)cc1 23331749 ROCPYMLBQOBHDK-UHFFFAOYSA-N 432.568 4.346 10 10 IICE Cc1ccc2nc(NC(=O)CN3C(=O)/C(=C/c4ccccc4)SC3=S)sc2c1 39874904 NCVJZLXORQTLNK-YBEGLDIGSA-N 425.560 4.445 10 10 IICE CCCCN1C(=O)/C(=C2\SC(=S)N(CCCCCC(=O)OC)C2=O)c2ccccc21 40927985 QSSXYXLUTCEKGO-HNENSFHCSA-N 446.594 4.138 10 10 IICE COc1cc(/C=C2\SC(=S)N(CNc3ccccc3C)C2=O)cc(OC)c1OC 59382169 VCOQCJLJPPCGMP-WQRHYEAKSA-N 430.551 4.292 10 10 IICE Cc1cc(/C=C\C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)n1Cc1ccco1 96912691 DWCOQMRSFUWIMS-FLIBITNWSA-N 433.552 4.255 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)sc2c1CC[C@H](C(C)(C)C)C2 109403453 RVRYBDABOXUCNR-NTLKJNNPSA-N 431.554 4.147 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccccc2O)SC1=S)Nc1ccccc1C(F)(F)F 210672121 BMJQUYFKVKWIBM-OQLLNIDSSA-N 438.452 4.251 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCc3c([nH]c4ccccc34)C2)C1 444320029 QYYOPGWPHHSVMJ-UHFFFAOYSA-N 426.564 4.474 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](C)[C@@H]2c2cccc(F)c2)c1 747460872 CMHLLRVKSCUDRX-MZNJEOGPSA-N 426.532 4.149 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ncccn1 753779519 LHMJGJMKXOWSGA-NHTMILBNSA-N 433.600 4.263 10 10 IICE COCCn1c(C)c(C)c2cc(-c3nc(-c4ccc(OCC(=O)N(C)C)cc4)no3)ccc21 761886610 CUOYCMBVZLQOPR-UHFFFAOYSA-N 448.523 4.089 10 10 IICE COC(=O)[C@H](C)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 797366704 FNGGVEZFMQMTIF-PJCCXHTNSA-N 443.547 4.421 10 10 IICE COc1c(C)cc(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 800926766 VCSHLTOECWFRFO-UHFFFAOYSA-N 443.550 4.121 10 10 IICE O=C(N[C@H]1CCCC[C@H]1c1ccccc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 803131968 VJWULWCOTOMDQP-GOTSBHOMSA-N 432.520 4.357 10 10 IICE CC(C)OCc1cc(NS(=O)(=O)/C=C\c2cccc(Br)c2)ccc1O 811704427 GCLLWJZTENYVHL-HJWRWDBZSA-N 426.332 4.492 10 10 IICE CCN(C)Cc1cc(O[C@H]2CCN(Cc3cc(OC)cc(C(C)(C)C)c3O)C2)ccn1 856548869 MNWLDGYMUWBRHG-NRFANRHFSA-N 427.589 4.198 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCO[C@@H](c3nccn3C)C2)c(C)n1-c1ccc(Cl)cc1 1129764486 MXUCSGRAEFRCLO-PZJWPPBQSA-N 426.948 4.060 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](NC(=O)c2ccccc2)c2ccccc2)cc1F 1144977088 AEMVKKLVOLHXKI-XMMPIXPASA-N 433.527 4.459 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C(F)(F)F)c(C)n1-c1cccc(Br)c1 1147390497 LQSPBSZFQGSLGJ-MRXNPFEDSA-N 431.252 4.260 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](CC(=O)NCc3ccc(F)cc3)C2)c(C)n1-c1ccccn1 1163211386 COWRHEFFVYXGJB-NRFANRHFSA-N 448.542 4.187 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(C(F)(F)F)cc(Cl)n3)cc2F)C[C@@H](C)O1 1182412951 KERKDDXTXDZWET-VXGBXAGGSA-N 445.844 4.437 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2=O)c(C)n1-c1ccccc1 1233974490 OQKYQPSUZJMCCA-VWLOTQADSA-N 444.579 4.079 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)cc1-n1c(C)cc(C=O)c1C 1290766202 WRKPTGMLOXLZLJ-UHFFFAOYSA-N 449.595 4.470 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291531351 AVBMZJAVMDWCAL-GOSISDBHSA-N 429.584 4.442 10 10 IICE Cc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2F)c(C)n1-c1ccc(Cl)cc1 1357496605 YMOILMVJKMBTFJ-QHCPKHFHSA-N 439.918 4.129 10 10 IICE COc1ccc(-n2cc(CNC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)nn2)cc1 1435483095 LIKMOLMERSNOET-UHFFFAOYSA-N 449.942 4.196 10 10 IICE CC(=O)N1CC[C@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c2ccccc21 1446195289 VVYJKDHFJUHPIG-QHCPKHFHSA-N 429.520 4.443 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3cc(Br)ccc3Cl)CC2)cc1 1446416576 CKHYKAKBVACWMU-UHFFFAOYSA-N 437.765 4.393 10 10 IICE Cc1nn(C)c(N2CCC2)c1NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1454279162 GNCUAPZNWCKDIA-UHFFFAOYSA-N 442.361 4.361 10 10 IICE Cc1cc(OCC(=O)Nc2c(-c3ccccn3)nc3ccccn23)ccc1Br 1457405174 DHTXDPKAYNUCNF-UHFFFAOYSA-N 437.297 4.485 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccccc1)N1CCOCC1 1458100059 QZQLRQXHJGPZLY-DEOSSOPVSA-N 431.492 4.311 10 10 IICE CCOC(=O)C(F)(F)[C@@H](NCc1ccc(N2CCC(OC)CC2)cc1)c1ccccc1 1460134444 HERMYFRKWSEXFD-QFIPXVFZSA-N 432.511 4.331 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC(=O)N(C(C)(C)C)C3)cc2Cl)C1 1478528498 OYYYRBMIYUPLSI-WMZOPIPTSA-N 435.012 4.023 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCc4cc(Cl)nnc4C3)cc2Cl)C1 1478529178 WZCVGSBWQBASCG-AWEZNQCLSA-N 434.371 4.288 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](CCO)c1cccc(C(F)(F)F)c1 1478840351 AMAPQWMRUYPIMS-IIBYNOLFSA-N 437.506 4.434 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCSC1 1495753009 OPXGOOSPPSWKPR-IAGOWNOFSA-N 433.597 4.019 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@H](CCOC)C2)cc1 1515526282 NHZSMTYTENVETB-OAQYLSRUSA-N 434.588 4.097 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CCCc3ccc4c(c3)CCCC4)CC2)cc1 1524982700 XGKLAMAUDKHAIQ-UHFFFAOYSA-N 449.639 4.225 10 10 IICE CCS[C@@H](C)c1noc(CN(C)C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)n1 1533761225 YGVYQWYUTIYDBM-HNNXBMFYSA-N 442.585 4.384 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)COc2ccc3oc4ccccc4c3c2)N(C)C)cc1 1539705628 GUIMKOSLAPMGRR-HSZRJFAPSA-N 431.536 4.450 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCOC[C@H]1OC 1545332787 OEHPDLROAIAVFQ-XKCSPQBFSA-N 441.620 4.080 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)c1cccc(Br)c1 1556344008 IXXAURXVQYSONW-NRFANRHFSA-N 441.325 4.133 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1 1556447285 HVAXITAGKSJBSQ-HDICACEKSA-N 432.524 4.168 10 10 IICE CCN(C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)[C@H]1CCN(CC(F)(F)F)C1 1557709542 XLDMCBFLGWQAFF-INIZCTEOSA-N 437.506 4.014 10 10 IICE COc1ccc(N2CCN(Cc3cc(C)nc(-c4ccc(Cl)cc4)n3)CC2)c(OC)c1 1560082362 BGZZZFHUVKLPJV-UHFFFAOYSA-N 438.959 4.445 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C(=O)OC)[C@H]4CCCC[C@@H]43)ccc21 1585636325 JJZZFOATPMAZIU-URVUXULASA-N 426.557 4.098 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2nc(C(=O)NCc3c(O)cccc3F)cs2)CC1 1596916874 OLXHFYFPEVGPHD-UHFFFAOYSA-N 435.521 4.032 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCCN1C(=O)c1cccc(C)c1 1622328382 XAQMXYGIQGXGHH-LJQANCHMSA-N 445.357 4.116 10 10 IICE COc1ccc(-n2ccc(CNC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)n2)cc1 1626731136 YDCFOGOTKXVKFE-UHFFFAOYSA-N 430.508 4.227 10 10 IICE Cc1cc(C(=O)N2CC3(CCOCC3)C[C@@H]2C)c(C)n1-c1ccc(Br)cn1 1627329354 MBUYLPYBPYAYDX-HNNXBMFYSA-N 432.362 4.283 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2cc(F)ccc2CS(C)(=O)=O)c1C 1629308100 MIFFEWVPIYXTEH-UHFFFAOYSA-N 428.529 4.016 10 10 IICE COc1ccc(N2C[C@@H](NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)CC2=O)cc1 1632492990 GWUCCJKRNCOKNG-SFHVURJKSA-N 437.927 4.291 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)C[C@H]3CCN3C(=O)OC(C)(C)C)c2C)cc1 1639246418 MDYPGGVQOUZATC-LJQANCHMSA-N 427.545 4.184 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1 1640772272 XOWYVHZLVOPGFQ-UHFFFAOYSA-N 431.536 4.464 10 10 IICE C[C@H](N[C@H](C)c1cccc(F)c1F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1642514611 OTRJEWVWJNRSGW-KGLIPLIRSA-N 434.442 4.418 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@@H](C)N(c3ccc(F)cc3)C2=O)c(C)n1-c1cccc(F)c1 1652518529 YNVIVDVMXLNQRI-MRXNPFEDSA-N 437.446 4.412 10 10 IICE CSc1ccc([C@@H](CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)N(C)C)cc1 1673025394 UJPKYRWCLMKMTA-HSZRJFAPSA-N 426.630 4.451 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H]2CC[C@]21CNC(=O)OC(C)(C)C 1673744434 LUWYGNRSXVLXQL-KHOMTPLRSA-N 444.620 4.081 10 10 IICE C[C@@H](NC(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1681779776 RLOFVRNSKAUDJL-SGLNWRHMSA-N 430.593 4.291 10 10 IICE Cc1cccnc1[C@@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)C(C)(C)C 1683195716 LPGMMKMDOCBNAG-OAQYLSRUSA-N 432.515 4.091 10 10 IICE CCOCCN(C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)[C@@H]1CCc2ccccc21 1685686443 NOSYEOGETKZHHV-RPBOFIJWSA-N 438.616 4.091 10 10 IICE CCNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CC 1710306946 OTKQIAAKDJAYNM-UHFFFAOYSA-N 436.604 4.361 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)CCCO1 1752375992 WNKRPYXOUDUZHC-MRXNPFEDSA-N 447.605 4.262 10 10 IICE Cc1occc1CN(C)c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1761624780 MOHUFAQOMWNELY-UHFFFAOYSA-N 440.598 4.441 10 10 IICE CCC[C@@H](Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1763878675 YQWRJTOJYIHIDG-QFIPXVFZSA-N 427.593 4.086 10 10 IICE CCC[C@@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1765582503 YDFQHXRJOKZTPQ-FCHUYYIVSA-N 427.593 4.181 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)CC1 1768167969 WUJSCIPQPJGYGZ-VWLOTQADSA-N 434.588 4.158 10 10 IICE O=C(Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1)c1ccccc1 1860549518 KHDYEFVXZUMQMC-UHFFFAOYSA-N 447.450 4.362 10 10 IICE CCC[C@H](NC(=O)c1cccc2ccccc12)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862239989 NLQHLPVOLKMYQW-VWLOTQADSA-N 445.563 4.096 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@@H](CNCc2ccc(Cl)cc2O)C1 2025245973 GFNZTFZRSGASRX-NRFANRHFSA-N 445.991 4.257 10 10 IICE Cc1cc(O)c([C@@H](n2nc(C)c(C(=O)O)c2I)C2(C)CC2)cc1C 2079932879 NNGXVXCDMLGQBR-OAHLLOKOSA-N 440.281 4.206 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(CCNCc2cc(Br)ccc2O)C1 2140330473 QYNAJBNMKKFTFR-FOIQADDNSA-N 425.367 4.282 10 10 IICE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccc(I)c(Br)c2)CC1 2155560744 NIUMHPNWIVMAQO-SNVBAGLBSA-N 449.090 4.359 10 10 IICE CC[C@@H](NC[C@H]1COCCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2158553304 IEVBYRXILFMCBO-RHSMWYFYSA-N 443.382 4.079 10 10 IICE COc1ccc(Br)c(CNCCC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1O 2236048858 JDEBVWIDGSOZFS-CQSZACIVSA-N 443.382 4.433 10 10 IICE Cc1ccc(C)c(N2C(=O)C(=Cc3cc(C)n(-c4ccc(O)cc4)c3C)C(=O)NC2=S)c1 2293789262 FVTNCVJVFFNCGZ-UHFFFAOYSA-N 445.544 4.248 10 10 IICE CCSC1=NN2C(=N)C(=Cc3cc(C)n(-c4cccc(OC)c4)c3C)C(=O)N=C2S1 2297470277 DTBZCKUJXNMTMD-UHFFFAOYSA-N 439.566 4.433 10 10 IICE CCCOc1ccccc1C=C1C(=O)NC(=O)N(c2ccc(Br)c(C)c2)C1=O 2313547798 CBLWCIKXFHIOOI-UHFFFAOYSA-N 443.297 4.213 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380748070 ZCBPHZYOCWMOGX-ZFWWWQNUSA-N 441.366 4.163 10 10 IICE CCc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(C)n(-c4ccccc4OC)c3C)C2=O)cc1 2224897 GHFXBPDSJHOUPS-RCCKNPSSSA-N 443.503 4.332 10 10 IICE COc1ccc(Br)cc1/C=C1\C(=O)NN(c2ccc(Cl)c(Cl)c2)C1=O 33685751 BAPJUKPQOHMEGY-KPKJPENVSA-N 442.096 4.226 10 10 IICE CC[C@@H](C)N1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33723703 LJUHYEZKISXVTC-CPZHOGDASA-N 442.610 4.439 10 10 IICE COc1ccc(N2CCN(c3ncnc(Oc4cc(C)c(Cl)c(C)c4)c3N)CC2)cc1 40727887 RHOLNGLECVQBOH-UHFFFAOYSA-N 439.947 4.457 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C3(c4ccc(Cl)cc4)CCC3)CC2)cc1 97042270 XAQSCYJCXVHASJ-UHFFFAOYSA-N 442.003 4.099 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccccc2CN2CCC[C@H]2C(N)=O)c1C 110830663 FIJKAHGTROGJEQ-DEOSSOPVSA-N 430.552 4.105 10 10 IICE CC[C@H](NCC1(O)CCN(Cc2ccccc2)CC1)c1cc(Br)ccc1O 397518945 UOFIEWMXXOVJCG-FQEVSTJZSA-N 433.390 4.223 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)C1 469352816 XBELEFYJZDHOFB-QHCPKHFHSA-N 446.595 4.432 10 10 IICE O=C(c1n[nH]c2ccc(Br)cc12)N(Cc1ccco1)Cc1ccccc1O 743428875 QECKGXNDVIPZHY-UHFFFAOYSA-N 426.270 4.467 10 10 IICE C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N[C@@H](C)c1cc2ccccc2o1 751930720 IALGOKHDTSXFNP-GJZGRUSLSA-N 449.532 4.485 10 10 IICE C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCSc2ccccc21 751936122 HQMFWEYNUUIULX-AWEZNQCLSA-N 439.562 4.000 10 10 IICE C[C@H](NCC1(N2CCCCC2)CCN(C)CC1)c1cc(Br)cc(Cl)c1O 756610885 UMICYLCYKDJFQA-HNNXBMFYSA-N 444.845 4.409 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 779533979 LRUAYFDXPUBOPH-SIKDUDHDSA-N 425.529 4.413 10 10 IICE COc1cc(NS(=O)(=O)c2cc(Br)c(Cl)cc2Cl)ccc1O 797820365 UKWCFUNIYPLPGY-UHFFFAOYSA-N 427.103 4.271 10 10 IICE CCC(C)(C)NC(=O)c1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1 806217270 HTWQAOSJBJWMDL-UHFFFAOYSA-N 434.334 4.395 10 10 IICE C[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)NCc1cc(Br)ccc1O 813783001 WONCCNVQSDEYDJ-ZDUSSCGKSA-N 444.370 4.037 10 10 IICE COc1ccc(N2CCN(Cn3nc(-c4ccc(C)cc4)c4ccccc4c3=O)CC2)cc1 915201838 DORVWAMNCNJVQS-UHFFFAOYSA-N 440.547 4.160 10 10 IICE C/C=C\c1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(OC)c1 917710589 NPIVVJLPMFKDFY-SLXDBMQSSA-N 442.531 4.176 10 10 IICE CCc1cc(N2CCC[C@@H](NC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)C2)ncn1 1125982087 DOONETJMGKXYDC-LJQANCHMSA-N 437.975 4.499 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)oc2ccc(Cl)cc12 1133626541 OKMYZVDSNWRPQG-UHFFFAOYSA-N 425.916 4.026 10 10 IICE Cc1ccc(C(=O)NC[C@@H](C)N2CCc3ccccc3C2)cc1-n1c(C)cc(C=O)c1C 1142897920 FNHRLMFTYOETDT-HXUWFJFHSA-N 429.564 4.392 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1-n1c(C)cc(C=O)c1C 1148752809 CLGYPBOVHDBHPP-QFIPXVFZSA-N 449.938 4.404 10 10 IICE Cc1ccc(C(=O)NCc2nc(-c3cccc(F)c3)no2)cc1-n1c(C)cc(C=O)c1C 1155998739 VDHGOJDTFLVJBV-UHFFFAOYSA-N 432.455 4.334 10 10 IICE CC1(C)[C@@H](C(F)(F)F)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1193430829 SHTUUKUKFZNYNJ-SFHVURJKSA-N 430.426 4.063 10 10 IICE Cc1cc(CNC(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1254080310 UNGRSKYHPBWEHW-FQEVSTJZSA-N 440.588 4.493 10 10 IICE CC(C)(C)OC(=O)NC[C@H](C(=O)NCc1ccc2cccnc2c1O)c1ccc(F)cc1 1299724723 HZDBYWNMZKPEQE-IBGZPJMESA-N 439.487 4.004 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1c(F)ccc(I)c1Cl 1300396404 RCVOBENBSOKZID-UHFFFAOYSA-N 440.039 4.373 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@@H](C)N(c3ccc(F)cc3)C2=O)c(C)n1-c1ccc(F)cc1 1307275061 ZYEMXBIFIXAENY-MRXNPFEDSA-N 437.446 4.412 10 10 IICE Cc1cccnc1[C@H](N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 1307568328 JIKUTGRGIPJFFY-GAJHUEQPSA-N 441.531 4.479 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1312741810 UOHJWEGGSWNYTA-ROUUACIJSA-N 428.577 4.238 10 10 IICE COC[C@]1(CNC(=O)NCc2cc(C)n(-c3ccccc3)c2C)OCCc2ccccc21 1312799371 YKSPCIJEVCZPMT-SANMLTNESA-N 433.552 4.008 10 10 IICE CSCCCCn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1316463796 OQOWGSIENKIUOV-FQEVSTJZSA-N 429.634 4.162 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@H](CC)C2 1348205040 JKYXPEYYWUMFHI-GJZGRUSLSA-N 444.553 4.020 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(O[C@@H](C)C(F)(F)F)nc3C)CC2)cc1 1359816373 JTCFMDYEMGNSSY-HNNXBMFYSA-N 437.462 4.127 10 10 IICE COc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc2n1 1361063858 UEMSGNMDJQTPOZ-OAHLLOKOSA-N 427.451 4.244 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(OCc2cccs2)c1 1436624014 KWZMJYQBGIBHCQ-UHFFFAOYSA-N 444.503 4.372 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ncnc(O)c1Br 1446801378 HTPFMABUINDNLH-CYBMUJFWSA-N 428.286 4.054 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C1CC2(C1)C[C@@H](NC(=O)OC(C)(C)C)CCS2 1465030841 NSNZBYCWSSXAJZ-SZTYLXMGSA-N 447.645 4.246 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)CC1 1471008885 JVDMJUCNCZVOPZ-SAABIXHNSA-N 431.577 4.154 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCCCC[C@H]3c3ccccc3)cc2)CC1 1471370536 VSQKECYPRORDKK-DEOSSOPVSA-N 434.584 4.215 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CC[C@@H](CC(C)C)C2)cc1 1501831003 RVIILDMYPCLQTN-NRFANRHFSA-N 440.636 4.183 10 10 IICE CCc1cnc(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)s1 1513714258 JXBUQZBBKDHTFP-UHFFFAOYSA-N 440.598 4.043 10 10 IICE CC[C@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1514065947 TWADUJKPCVQDIJ-IBGZPJMESA-N 429.584 4.127 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@@H](COC)C2)cc1 1515530847 GFUYLIKYABJOKV-FYYLOGMGSA-N 441.620 4.277 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@]1(C)CC1(Br)Br 1529276871 BIKGZPRFQDEATA-WBMJQRKESA-N 432.200 4.004 10 10 IICE COc1ccc([S@](C)(=O)=NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1535407492 NTUNTIOHGLIXOB-PMERELPUSA-N 426.538 4.221 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Oc3cccc(Cl)c3)C(C)C)CC2)c(OC)c1 1543633322 YUHJSOISXMTZBZ-QFIPXVFZSA-N 432.948 4.109 10 10 IICE O=C(Cc1ccc(Br)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632098 BLIBUVMSMSSIAQ-GOSISDBHSA-N 437.765 4.131 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 1564446436 SXNJDDHJENASSW-WMZOPIPTSA-N 432.971 4.363 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1Cc2ccccc2OC2(CCOCC2)C1 1564945823 GGXSZXWPYPNIPR-HXUWFJFHSA-N 437.584 4.145 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(-n2cc(Br)cn2)cc1 1584090202 XQWABJCVOLICBH-INIZCTEOSA-N 441.373 4.370 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(NC(=O)NC(C)(C)C)ccc3Cl)C2)cc1 1584230497 RTIKVBMMJIPWQR-INIZCTEOSA-N 444.963 4.277 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cnc4ccnn4c3C(F)F)cc2Cl)C1 1586083331 ZYYOAJQFKILZNK-ZDUSSCGKSA-N 433.890 4.487 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(OC)cc1 1606860831 VSJQKGQDERAASK-SIKLNZKXSA-N 444.959 4.450 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C)CC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1611935072 GDUKJRAIOGAHHS-LJQANCHMSA-N 448.615 4.457 10 10 IICE CCO[C@H](CCn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1616101336 RRGOCAZBNQZYAX-IFMALSPDSA-N 428.577 4.109 10 10 IICE Cc1ccc(C(=O)NCCCN(C)C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1625081301 QXNRCZDZZNHMHM-UHFFFAOYSA-N 427.545 4.202 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(-n3ccnc3O)c2)cc1 1628565899 SZHVJNMSDLMSQO-UHFFFAOYSA-N 442.519 4.500 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2ccc(C)cc2)cn1 1631533745 DSXHRVMBWIKOPJ-UHFFFAOYSA-N 440.883 4.357 10 10 IICE CON(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@H](C)c1csc(C)n1 1635809512 CCYVFHWFLPSEIV-MRXNPFEDSA-N 426.586 4.324 10 10 IICE Cc1cc(C(=O)Nc2ccc(F)c(NC(N)=O)c2)c(C)n1-c1ccc(Br)cn1 1637852598 UTOVRKRGXWFTEY-UHFFFAOYSA-N 446.280 4.134 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3OC[C@@H]2F)c(C)n1-c1ccc(Br)cn1 1638067474 WAERJSMBVVCTOQ-FXAWDEMLSA-N 444.304 4.453 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)CCc3ccccc3)cc2F)C[C@H](C)O1 1641707271 HTCWCKGIXHYHCT-PMACEKPBSA-N 441.591 4.057 10 10 IICE COC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)c(OCC(F)F)c1 1645804910 LRSLYMFLMNEZIT-UHFFFAOYSA-N 429.423 4.172 10 10 IICE CCN(CC(=O)NCc1ccc(COC(C)C)cc1)Cc1cc(Br)ccc1O 1652595111 GDMHAFXDJPDYMV-UHFFFAOYSA-N 449.389 4.218 10 10 IICE C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1673472609 SGQQJAIMNNYKHP-YCRPNKLZSA-N 433.474 4.233 10 10 IICE Cc1n[nH]cc1CCCn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1692914698 BRAPPALRZBIYBH-UHFFFAOYSA-N 435.620 4.378 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1([S@@](C)=O)CCC1 1693994040 ANSIHLFHXGNQNI-QPHCHLROSA-N 443.661 4.329 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC3(CCOCC3)C2)n1Cc1ccc(N(CC)CC)cc1 1694170537 YSWVOCYOJRACNJ-HXUWFJFHSA-N 441.620 4.072 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1ccc(Cl)s1 1694736299 XOZHCXVBGZAJMK-UHFFFAOYSA-N 435.956 4.078 10 10 IICE CCCC(=O)NC1CCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)CC1 1695018618 WVWVMDCJHMZJHI-UHFFFAOYSA-N 440.636 4.181 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)CC[C@@H]1C 1696998546 SIHCCZKSOKBSEH-ROUUACIJSA-N 434.588 4.114 10 10 IICE COCCN(CC(C)C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc2c(c1)CCCN2C 1698047020 DHZACBISIXHOIS-QHCPKHFHSA-N 441.620 4.059 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc2c(c1)CCCN2C 1698150068 PPFBLWZKTAIRMV-WOJBJXKFSA-N 441.620 4.059 10 10 IICE CO[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC1(C)C 1730395032 SWPGVDRLIMROKK-FQEVSTJZSA-N 443.661 4.038 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCC(=O)N1CCCCC1 1741335137 WPEYSZHOCOLJQK-UHFFFAOYSA-N 438.620 4.041 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1Cc1ccsc1 1747719875 CRRIXUNDEIQNLS-UHFFFAOYSA-N 425.602 4.158 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3C[C@@H](OC)C(C)(C)C)CC2)cc1 1748846798 APDNHCOTRMNOEJ-JOCHJYFZSA-N 441.620 4.332 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763405222 UNVNDYCLMOPZMW-QRQCRPRQSA-N 429.952 4.133 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H]3CCCS3)CC2)cc1F 1768705075 UOENXBZNTGZCFD-GOSISDBHSA-N 447.624 4.237 10 10 IICE Nc1ccc(N(CCc2c[nH]c3ccccc23)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 1857992233 ORZMIVSNBQIHLN-UHFFFAOYSA-N 436.493 4.096 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(Cc4ccc(C)cc4)n4ccccc34)CC2)cc1 1858349859 WLLHGDBERYWYJY-UHFFFAOYSA-N 440.547 4.205 10 10 IICE COc1cc(C)c(C)cc1S(=O)(=O)Nc1nc(-c2ccc3nc(O)[nH]c3c2)c(C)s1 1859574270 GXCJVHJWDFWIGO-UHFFFAOYSA-N 444.538 4.127 10 10 IICE Cc1cc2c(NCCC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)ncnc2s1 1865782665 YHMYOLSERRYEMX-UHFFFAOYSA-N 442.500 4.216 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010392242 YGEQZVDYFDMTFY-YTQUADARSA-N 431.537 4.176 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C3CC3)c(CO)c2I)cc1C 2079980368 CRXJJZBTIJBJGJ-SFHVURJKSA-N 438.309 4.179 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(CNCc2cc(Br)ccc2O)CC12CCC2 2097951453 NCFSZISUZJIHQJ-HXUWFJFHSA-N 425.367 4.329 10 10 IICE O=C1C(=Cc2cn(-c3ccccc3)nc2-c2ccncc2)SC(=S)N1C[C@@H]1CCCO1 2314457900 MZXDEUDHFSWEKN-IBGZPJMESA-N 448.573 4.315 10 10 IICE CC(C)OC(=O)c1cccc(N2C(=O)C(=Cc3ccc4c(c3)OCCO4)SC2=S)c1 2321718095 AFXKWLXOUJFWSU-UHFFFAOYSA-N 441.530 4.429 10 10 IICE CC[C@@H](C)[C@@H](C(=O)O)N1C(=O)C(=Cc2c(Cl)nc3scc(C)n23)SC1=S 2323827176 DUGHPUQGNHMQQQ-HQJQHLMTSA-N 429.976 4.058 10 10 IICE O=C1C(=Cc2cccc([N+](=O)[O-])c2)SC(=S)N1C1CCN(Cc2ccccc2)CC1 2323879557 CJHWSMYCIQINGY-UHFFFAOYSA-N 439.562 4.461 10 10 IICE CC[C@H](N[C@]12CO[C@H](C1)[C@@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2359243386 IWCCMSNPVTUPKI-COCVIAQXSA-N 441.366 4.020 10 10 IICE Cc1ccc(CN(C)[C@@]2(C(=O)O)CC[C@H]2OCc2ccccc2)c(O)c1Br 2381129525 LHWIYRLATLGCPB-UTKZUKDTSA-N 434.330 4.098 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(O)c1Br 2381146462 LSXFHZNKHBMUOB-UONOGXRCSA-N 441.366 4.115 10 10 IICE COc1cccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c1OC 8608776 GYTQYLJCKXUREF-XMMPIXPASA-N 445.563 4.304 10 10 IICE CN(C)c1ccc([C@H]2CC(c3ccc(F)cc3)=NN2C(=O)COc2ccc(C=O)cc2)cc1 72413286 SBYGXDNXCGOIBX-RUZDIDTESA-N 445.494 4.461 10 10 IICE O=C(CNC(=O)c1cccc(F)c1)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 96994830 BQTPDOFWMJZEFR-RUZDIDTESA-N 428.463 4.320 10 10 IICE CCOc1cc(/C=C2\C(=N)N3C=CSC3=NC2=O)ccc1OCc1ccc2c(c1)OCO2 103801831 DFCLZAVQQXKXJA-IEGKZMKLSA-N 449.488 4.170 10 10 IICE CO[C@@H](C)CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(C)C 740804262 WUXGZOZKADPANK-LUYJPIOASA-N 426.629 4.001 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1 741897930 DQPGPQPNKXFBLT-PKTZIBPZSA-N 432.520 4.449 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]nc1-c1ccc(F)cc1 742806250 QWUIFELIGHJKRV-INIZCTEOSA-N 430.430 4.216 10 10 IICE Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 745647073 IMFLQMZZRZHJBP-KSFYIVLOSA-N 429.536 4.371 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@]2(CC=CCC2)C1 751068283 MNFLJNCXASBWCE-OAQYLSRUSA-N 432.567 4.217 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](C)c3cc(Br)ccc3O)C2)c1 756649404 GTXYULLVHFUISI-GJZGRUSLSA-N 435.362 4.349 10 10 IICE Cc1oc(-c2ccccc2)nc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768541952 BJFZBAHCRCPWMS-UHFFFAOYSA-N 430.552 4.112 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2 768914514 YISUVQAZMHMNFX-URFUVCHWSA-N 425.592 4.143 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Nc2ccc3ccc(=O)n(C)c3c2)cc1 786015677 IZHDUYPYXBMDBK-UHFFFAOYSA-N 430.508 4.432 10 10 IICE COc1ccc(CNC(=O)C(C)(C)[C@H](O)c2ccc(OCc3ccccc3)cc2)c(O)c1 794390694 OTKZDDYIVUSZKU-XMMPIXPASA-N 435.520 4.356 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3CCN(C(=O)c4ccoc4)CC3)cc2Cl)C1 800048388 ZXBUFVKPNHGXNM-QGZVFWFLSA-N 443.975 4.338 10 10 IICE Cc1c([C@@H](C)NC(=O)NCc2cc(Br)ccc2O)cnn1-c1ccc(F)cc1 806432890 WEMOTQHYVHKADN-GFCCVEGCSA-N 447.308 4.348 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3ccc(Cl)cc3C)n2)cc1 915291125 ZNEXFLLGBRHQHZ-UHFFFAOYSA-N 449.985 4.251 10 10 IICE CCOC(=O)c1c(NC(=O)Cc2nc(C3CC3)nn2C)sc(C)c1-c1ccc(F)cc1 1124635348 VZBXGPUDPNRSSA-UHFFFAOYSA-N 442.516 4.226 10 10 IICE CCc1nc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)sc1C 1125059483 DCPBAFUJHBELEZ-XNTDXEJSSA-N 435.571 4.383 10 10 IICE C[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129548964 HSNSXAOLJWDNMK-ZDUSSCGKSA-N 426.916 4.252 10 10 IICE CCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1130179180 IKXMDVAOPDCMRB-HSZRJFAPSA-N 435.955 4.451 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2c(Cl)cc(F)cc2Br)N(C)C)cc1 1134882848 VWPDDPDPEVPBPX-KRWDZBQOSA-N 442.760 4.340 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2Cc3ccc(Br)cc3C(=O)O2)cc1 1135732983 PBABHCOASAPSGZ-HXUWFJFHSA-N 445.357 4.035 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc4ccc(C(C)C)cc4[nH]3)CC2)cc1 1135936164 VXCDWGKHUBVOPI-UHFFFAOYSA-N 434.584 4.242 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(c4ccc(Br)cc4)CC3)CC2)cc1 1137658869 ZAMBKCAFXREWBL-UHFFFAOYSA-N 429.358 4.228 10 10 IICE COCCCOc1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 1150355497 WGUMBTBMILAFJC-HXUWFJFHSA-N 446.975 4.164 10 10 IICE Cc1cc(CNC(=O)c2cc(Br)cc3nc(O)[nH]c23)c(C)n1-c1ccccc1 1151152791 DIXAMNBMQRSWNK-UHFFFAOYSA-N 439.313 4.369 10 10 IICE CCc1ccc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1157398972 XEUVAWOBFLVAHP-FQEVSTJZSA-N 442.357 4.277 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H](NC(=O)c3cc(O)cs3)c3ccccc3O2)C1 1158594025 NNABKMBNLJYUID-OPAMFIHVSA-N 430.526 4.087 10 10 IICE COC(=O)c1scc(C)c1NC(=O)[C@@H](C)N(Cc1ccc(N(C)C)c(C)c1)C(C)C 1175838747 QXFUWOCCKLZXQB-QGZVFWFLSA-N 431.602 4.455 10 10 IICE CCCCCN(CCCOC)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1268932058 DHAFIJNPMGIYTR-UHFFFAOYSA-N 438.480 4.039 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 1294859085 HYDOUWJJXLLAEM-BRWVUGGUSA-N 438.877 4.347 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](ONC(=O)OC(C)(C)C)C(C)C 1299596766 OFXAXTMWHZKIEJ-NRFANRHFSA-N 443.544 4.117 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCC(OC(C)C)CC1 1304240700 MVZWEWXTDITWKX-UHFFFAOYSA-N 448.615 4.080 10 10 IICE Cc1cc(O[C@H](C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1Cl 1356037195 UOCVBAZCFRNMSG-IXDOHACOSA-N 434.939 4.485 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cnc(C2CCN(C(=O)OC(C)(C)C)CC2)o1 1360273419 KPNCYTOCLCKWNU-UHFFFAOYSA-N 442.560 4.094 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@H](C)C3)n2CCOC(C)C)c(C)n1-c1ccccc1 1361049679 MHIVLMWZHWYIBT-HXUWFJFHSA-N 437.588 4.393 10 10 IICE Cc1cc(C)c(NC(=O)CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(C)c1 1440915474 KNWZFHRAGYXDBL-UHFFFAOYSA-N 431.536 4.129 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CN(C(=O)OC(C)(C)C)C(C)C 1448687030 RDXZRZNWBPBAKO-UHFFFAOYSA-N 449.592 4.021 10 10 IICE CCC(C)(C)OCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1451012635 YEFTUJYZSCNFAD-FYWRMAATSA-N 426.629 4.051 10 10 IICE Cc1cc(C(=O)NCC(C)(C)[C@H]2COCC23OCCO3)c(C)n1-c1ccc(C(C)C)cc1 1451242934 ZKKZSTZOWGMRFM-HSZRJFAPSA-N 440.584 4.363 10 10 IICE COC(=O)C[C@@H]1CN(C(=O)c2ccccc2CCNC(=O)OC(C)(C)C)c2ccccc21 1455097107 YLZAAYMQOLCWKV-GOSISDBHSA-N 438.524 4.061 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H]1CCc2sccc2C1=O 1467631683 OXTLWUXDAHHSBI-INIZCTEOSA-N 442.581 4.272 10 10 IICE C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1469708541 LKCNFNMCBSFCDF-KSFYIVLOSA-N 429.511 4.314 10 10 IICE O=C(CCC[S@](=O)c1ccc(Br)cc1)NCc1cc(Cl)ccc1O 1469873652 DTABTXINFRGFIW-DEOSSOPVSA-N 430.751 4.012 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Oc2ccncc2)c(Cl)c1 1470448048 RXVMRFSIQNXSJK-UHFFFAOYSA-N 437.927 4.418 10 10 IICE COc1cccc(Cn2cccc(NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)c2=O)n1 1472374303 OHODMFKYMOCPHN-UHFFFAOYSA-N 446.482 4.099 10 10 IICE CC(C)CN1CCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CC1 1509423839 BSFLXQLJLLCUQX-UHFFFAOYSA-N 434.679 4.353 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(C(=O)N(C)CC(C)(C)C)c3)C2)cc1 1529705909 BZTIXADYTNARBW-LJQANCHMSA-N 437.584 4.070 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3CCCCC[C@H]3NC(=O)OC(C)(C)C)CC2)cc1 1537033772 OAGNDMUXIDPNJX-FCHUYYIVSA-N 445.604 4.254 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)n1nnc(-c2ccccc2)n1 1538422342 UKLQZDQVPZPNKS-SJORKVTESA-N 438.963 4.107 10 10 IICE COC(=O)c1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc([N+](=O)[O-])c1 1539911678 AVJZYPZVAFNCDP-CQSZACIVSA-N 445.903 4.201 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CCN(C(C)C)C[C@H]3c3cnn(C)c3)c2C)c1 1544079326 FIYAOORLHPVTGC-UIOOFZCWSA-N 447.627 4.266 10 10 IICE O=C(c1nc(Br)sc1Cl)N(Cc1ccccc1O)C[C@H]1CCCO1 1546034239 RIXNTWIBGXWEOA-LLVKDONJSA-N 431.739 4.086 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@@H](C(F)(F)F)C2)cc1F 1552838740 YYFOJNYWOPJKSE-CRAIPNDOSA-N 441.473 4.162 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(-c2ccccc2F)on1 1556426298 HEABTHIINGHNMZ-UHFFFAOYSA-N 439.487 4.483 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@@H](C)[C@H](C(=O)OC(C)(C)C)C2)CCCC1 1557184949 WJAYRLJPVQHGQG-DYESRHJHSA-N 440.584 4.355 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC34CN(C(=O)OC(C)(C)C)C4)c2C)c1 1565193150 PYPQQSMBRGWXEN-UHFFFAOYSA-N 438.572 4.307 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1583622802 VHUNDHZSWMVTML-UHFFFAOYSA-N 433.552 4.053 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)ccc21 1585665393 RKRWOSFEIVUJHQ-HXUWFJFHSA-N 435.568 4.169 10 10 IICE Cc1ccc(-c2csc3ncn(CCC(=O)N[C@@H](C)c4ccccc4O)c(=O)c23)cc1 1587446935 CTSXMLNFKDWDBS-INIZCTEOSA-N 433.533 4.407 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CSC[C@@H]3C(=O)N[C@@H](C)C(C)C)c2C)c1 1616945444 HQAFIGWBUKGKOP-PGRDOPGGSA-N 427.614 4.387 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)c1 1631137784 VLAKGWOUDKKFLX-UHFFFAOYSA-N 430.957 4.260 10 10 IICE Cc1ccc(C(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1634548950 FDGSXFNSTIZZRJ-UHFFFAOYSA-N 449.498 4.105 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H](N3CCOCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1635245219 XHTGOKJQDUSRCN-QFIPXVFZSA-N 429.992 4.003 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCc3cc(O)ccc3C2)c(C)n1-c1ccc(Br)cn1 1635430425 YNUDRICNJOEHOM-GOSISDBHSA-N 440.341 4.245 10 10 IICE Cc1cc(C(=O)N[C@@H](C(=O)Nc2cn[nH]c2)c2ccccc2)c(C)n1-c1ccc(F)cc1 1636602728 LTDQSROLYMECFR-JOCHJYFZSA-N 431.471 4.066 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](O)[C@H]2CCc2ccccc2)cc1 1640093220 ULOOCKNTPAGRNZ-KAYWLYCHSA-N 444.575 4.434 10 10 IICE COc1nsc(CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c1Br 1641007474 PFVMBHOCQBJESH-UHFFFAOYSA-N 438.322 4.391 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](c2cnn(C)c2)C2(CO)CCC2)c1 1641310121 CAXGYLUMEHRRTK-OAQYLSRUSA-N 426.948 4.115 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1642611269 KNVXXBZWIKEEIL-REHUZNOOSA-N 439.575 4.283 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccccc1F 1643845212 DJAITWIZYAVATP-UHFFFAOYSA-N 430.479 4.452 10 10 IICE O=C(NCc1c(O)cccc1O)c1ccccc1OCc1ccc(Br)cc1 1652623650 YXRNOHZIJRDQQA-UHFFFAOYSA-N 428.282 4.369 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3ccc(Br)cc3O)CCC[C@@H]12 1653081902 MWJIXYMTFLRLKA-YLJYHZDGSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@](C)(CNC(=O)NCc2c(O)ccc3c2CCCC3)C1 1670913217 BJFYQVJIYDHGLF-XMMPIXPASA-N 431.577 4.107 10 10 IICE Cc1noc(C2CCN(c3nnc(C(C)C)n3CCCSc3nccs3)CC2)n1 1693535087 HWGVAEHUICMGBR-UHFFFAOYSA-N 433.607 4.116 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1695088127 ZCTXRCXWHBOIPR-QGZVFWFLSA-N 441.551 4.495 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2cnn(C)c2)n1Cc1ccc(N2CCC(C)CC2)cc1 1743570569 NAJDRQQBMADOJH-HXUWFJFHSA-N 435.620 4.446 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H]2CC)n1Cc1ccc(N2CCC(CO)CC2)cc1 1743713904 NDPQFTDRCPIIBF-SIKLNZKXSA-N 425.621 4.427 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746941966 NCOAFJYWTOLQHB-LEWJYISDSA-N 429.584 4.124 10 10 IICE C[C@@H]1C[C@@H]1n1c(C2CCN(C(=O)OC(C)(C)C)CC2)nnc1N(C)Cc1ccccc1O 1752055762 SELWITIFXAPDHU-APWZRJJASA-N 441.576 4.316 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC(C)(C)C1CC1 1767936461 NTIBCJMHNSZFAH-UHFFFAOYSA-N 445.583 4.115 10 10 IICE CCOC(=O)c1c(CN(C)C)n(C2CC2)c2cc(-c3cccnc3)c(O)c(CN(C)C)c12 1857624826 BIPPROCUOSWUBU-UHFFFAOYSA-N 436.556 4.044 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCc5ccccc5C4)nc(C(C)C)n3)CC2)cc1 1867950167 LEICXCDKKLHHJF-UHFFFAOYSA-N 443.595 4.498 10 10 IICE COc1ccc(CC(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1Br 1891149512 MTDIATZXSMQQTN-HKUYNNGSSA-N 429.358 4.305 10 10 IICE COCCNCc1ccc(N2CCC[C@H](OCc3ccccc3)C2)cc1Br 2186369824 AYLDKJIQITZXRT-NRFANRHFSA-N 433.390 4.371 10 10 IICE CC[C@@H](Nc1cnn(C)c1I)c1cc(Br)ccc1O 2265294189 CEZMXAUKEQXZEA-SNVBAGLBSA-N 436.091 4.056 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)C=Cc2ccc(-c3cccnc3)cc2)c2nccn2C)cc1 2330596396 WFYYUTARGZZMMR-AREMUKBSSA-N 437.547 4.467 10 10 IICE Cc1ccc(CNC[C@]23CC[C@@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352940313 DAYMHCHBWNGQIK-QRWLVFNGSA-N 425.367 4.200 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(O)c1Br 2380720424 GXUTVQYGPPMVJP-ZIAGYGMSSA-N 441.366 4.115 10 10 IICE CC[C@@H](CNC(=O)OC(C)(C)C)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135497 RCXGBYKRLXEGEO-CQSZACIVSA-N 443.382 4.363 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)Cc3ccc(-c4ccccc4)cc3)CC2)cc1 9919419 JJZPMBXEEAHQSI-UHFFFAOYSA-N 443.591 4.233 10 10 IICE O=C1NN(c2ccccc2)C(=O)/C1=C\c1cn(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12 33409728 BLXOFAJPWVBGGZ-HMAPJEAMSA-N 438.443 4.059 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3ccc(C)cc3C)nc3ccccn3c2=O)SC1=S 39835834 DBHKQIVQOYYGLN-SFQUDFHCSA-N 437.546 4.325 10 10 IICE CC(C)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1nc(C2CC2)no1 435732652 RDGLUKNPVAFOET-HSZRJFAPSA-N 435.572 4.182 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(NCc3cc(Br)cc(F)c3O)CCC[C@H]12 715745991 QBPBNXJLOGYFRO-KXBFYZLASA-N 429.330 4.316 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](c2nnc3ccccn23)C(C)C)c(C)n1-c1ccccc1 726191526 DDTMKKGHYRDCGZ-HSZRJFAPSA-N 430.556 4.376 10 10 IICE C/C(=C/C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccccc1C(F)(F)F 745274228 UQWUSEOQCBQOKF-SSZFMOIBSA-N 434.458 4.377 10 10 IICE CSc1ccc(O[C@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768532799 HNJKPNIZWRINEN-LJQANCHMSA-N 439.625 4.024 10 10 IICE CCN1CC[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1c1cc(F)c(F)c(F)c1 782537301 UDKUVMMUWVSZEN-RBBKRZOGSA-N 434.506 4.147 10 10 IICE C[C@H](NC(=O)[C@]1(NC(=O)OC(C)(C)C)[C@H]2CCCO[C@H]2C1(C)C)c1ccc(N(C)C)cc1 783718206 PNUXGBGYTJRQFR-USLSNGCWSA-N 445.604 4.028 10 10 IICE Oc1ccc(Br)cc1CNC(=S)NCc1ccc(Br)cc1 795154772 VBDUNUPJZKTSOG-UHFFFAOYSA-N 430.165 4.082 10 10 IICE C/C(=C/c1cccc(C(F)(F)F)c1)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 808389432 HGIOIGFXGQESLC-LGMDPLHJSA-N 438.515 4.133 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc(OCCOC)cc3)n2)c1C 914577995 LFMOTCLICHBHPN-UHFFFAOYSA-N 449.598 4.464 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccco2)N(C)C)c(C)n1-c1ccc(Br)cc1 1135476653 VLBOMXICZPNHPS-IBGZPJMESA-N 430.346 4.482 10 10 IICE Cc1cc(=O)oc2cc(N(C)C(=O)c3ccccc3CCNC(=O)OC(C)(C)C)ccc12 1140202967 CCDQEMZOURYROA-UHFFFAOYSA-N 436.508 4.445 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O 1142419105 NPTHEPPUKAQBRX-BEFAXECRSA-N 448.394 4.468 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4ccc(F)c(F)c4)CC3)C2)cc1 1252117055 URFCBHYXYABTSO-FQEVSTJZSA-N 443.538 4.464 10 10 IICE C[C@H](NC(=O)CCC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)c1ccccc1 1265002222 YGAFWGWSUIASEG-KRWDZBQOSA-N 435.490 4.301 10 10 IICE COc1ccccc1[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1nccn1C 1290520779 RPZLYLSPRPUJEF-DEOSSOPVSA-N 442.519 4.168 10 10 IICE CCC1(CC)CCN(c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)C1 1292390303 KQRHUTHTGRRIOG-UHFFFAOYSA-N 448.662 4.056 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2nc(C3CC3)cs2)NC(=O)OC(C)(C)C)cc1 1293793512 QCCQREWQPZRLQG-SFHVURJKSA-N 444.601 4.011 10 10 IICE CCN1C[C@@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)cc2C)C[C@@H]1C 1295977423 OOZHUHOXOUCRPE-RBUKOAKNSA-N 436.604 4.188 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)NCc3c(O)ccc4ccccc34)cc2)c1C 1304089790 LTBMUVSMADGUKA-UHFFFAOYSA-N 429.476 4.146 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2C[C@@]23CCCN(C(=O)OC(C)(C)C)C3)C2CC2)cc1 1354141215 HHJYCNJRGINSPP-PXDATVDWSA-N 427.589 4.281 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccn(-c4ccc(Cl)cc4)n3)cc2F)C[C@H](C)O1 1355131732 YNMJQZCTQZPUJG-HOTGVXAUSA-N 442.922 4.208 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@H](C)C2 1355244941 IFVIKCLDGHWCMW-LSDHHAIUSA-N 444.553 4.018 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H]3C)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1361049730 OBEGATMFQZWEKB-SFHVURJKSA-N 434.588 4.256 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]2C)CCCC1 1436494138 XSDNWTTYGCAUII-HDICACEKSA-N 439.600 4.023 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1OCc1ccc(F)cc1 1453983892 OCSPAKIVASWVCY-UHFFFAOYSA-N 434.511 4.296 10 10 IICE COc1cc(N2CCN(Cc3cc(-c4ccccc4Cl)on3)CC2)cc(OC)c1OC 1459923942 ZAAJOZDYHWBZFU-UHFFFAOYSA-N 443.931 4.343 10 10 IICE Cc1cc(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)ccc1Cl 1460357631 DGXMFWMEDMZHTM-UHFFFAOYSA-N 448.862 4.305 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCCS(=O)(=O)C[C@H]2C2CC2)cc1 1463130090 UXOAHMUWOCPSGL-QFIPXVFZSA-N 440.569 4.207 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@H]1CCC[C@H](OC)C1 1469740236 HMDUGBJNFAGKMV-NBHGPNQESA-N 432.948 4.224 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc(Cl)c1Br 1470448225 ZOMFGFPWLPZWDK-UHFFFAOYSA-N 437.765 4.302 10 10 IICE CC(C)Oc1cc(Cl)ccc1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1470905959 ZMHSUQYVOVEHDQ-UHFFFAOYSA-N 431.964 4.088 10 10 IICE COc1ccc([C@H](CO)CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1478528226 MTENUJFYQBIXJY-XLIONFOSSA-N 445.991 4.160 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(F)(F)C(F)(F)F)cc3)c2)CC1 1529144278 BQELUGYUOQPSAS-UHFFFAOYSA-N 441.400 4.262 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](C[C@H]1CCCO1)C(F)(F)F 1531503082 JPWKFUZSCBRIEN-XYPHTWIQSA-N 436.421 4.121 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@@H]3CCC[C@H](C(F)(F)F)C3)cc2F)CC1 1537536131 XPPKCTKTJFEKEW-AEFFLSMTSA-N 429.502 4.343 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1CO[C@H](CCC(=O)OC(C)(C)C)C1 1540464549 IFCFKVFUIBJCBP-RBBKRZOGSA-N 430.589 4.162 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Cl)c(Br)c(OC)c2N)cc1 1543179365 HUOIHJHMSVLNHU-UHFFFAOYSA-N 440.769 4.470 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCOC2(CCCC2)C1 1544589705 CHIUXJQBIXONCZ-XIDKLXSXSA-N 448.585 4.025 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3ccc(O)cc3O)[C@@H]2c2cccs2)cc1 1557084921 UHIKWMNRVPQFNN-AUSIDOKSSA-N 436.533 4.268 10 10 IICE O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1557140501 YFNNHAXRYIKFPD-VWLOTQADSA-N 439.531 4.044 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@@H](c2ccc(Br)cc2)C2CCC2)cc1 1559693067 YORAIZGJBMAYFB-JOCHJYFZSA-N 430.390 4.262 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC1(C)CCN(C(=O)OC(C)(C)C)CC1 1564421611 CDSQOJQWMITCNN-LJQANCHMSA-N 446.636 4.328 10 10 IICE Cc1ccc(C(=O)N2CCCN(c3ncccc3F)CC2)cc1-n1c(C)cc(C=O)c1C 1567797571 KZKYTZWAUZPYDY-UHFFFAOYSA-N 434.515 4.102 10 10 IICE Cc1cc(C2(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)CCOCC2)on1 1586081682 HAIXSUZNFZQBAT-MRXNPFEDSA-N 431.964 4.237 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC1CCC(F)CC1 1586534065 QIPGYPLUOYLKMP-LFIBNONCSA-N 426.604 4.374 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2ccccc2)c(C)n1-c1ccc(Br)cc1 1586795250 LNMBZPNBGPWZPV-IBGZPJMESA-N 441.369 4.438 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccc(F)cc1 1587345648 XUEOMYQKVCTABJ-OAQYLSRUSA-N 425.891 4.422 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1ccc(Cl)c(Cl)c1 1595436044 QVUHTQLWSLWVBA-GCJKJVERSA-N 446.378 4.429 10 10 IICE Cc1cc(C(=O)N[C@H](CCO)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1595971041 APCNBVRDYQGIFJ-LJQANCHMSA-N 434.378 4.313 10 10 IICE CC(C)Oc1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cn1 1610928434 BFINTWYSKIQDPD-OAQYLSRUSA-N 437.544 4.092 10 10 IICE CCS(=O)(=O)c1ccc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)cc1 1615477586 NGOMYSCJGFZMQC-UHFFFAOYSA-N 444.597 4.458 10 10 IICE COc1ccccc1[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1nccn1C 1624897221 QNMYASQLWASMIZ-RUZDIDTESA-N 428.536 4.285 10 10 IICE Cc1cc(C(=O)N2CC[C@@H]3[C@H](CCCN3C)C2)c(C)n1-c1cccc(Br)c1 1629819311 QQUMNWKVVCNNRU-DYESRHJHSA-N 430.390 4.413 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)CCCC1 1635938716 RVDQAFODOSQQIB-QGZVFWFLSA-N 426.557 4.109 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC(C2CCCCC2)C1 1641599656 AORJCAVAWDRIGL-UNOMPAQXSA-N 432.586 4.456 10 10 IICE Cc1cc(CN(Cc2ccccc2)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)ccc1N(C)C 1643356365 ZOEQYBNDVOCPIN-DNQXCXABSA-N 439.600 4.043 10 10 IICE Cc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1[N+](=O)[O-] 1648984229 SSKAYABLEXIINN-UHFFFAOYSA-N 443.301 4.398 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H](CNC(=O)OC(C)(C)C)[C@H](C)C3)cc2)CC1 1656339489 RZMUPVWCFNRBNG-CTNGQTDRSA-N 431.621 4.285 10 10 IICE COc1ccc(N(Cc2ccccc2)Cc2ccc(S(=O)(=O)N(C)C)s2)cc1OC 1656583823 YSTUUTPLWNBOSM-UHFFFAOYSA-N 446.594 4.222 10 10 IICE COc1ccc2c(c1)OC(C)(C)CN(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)C2 1673745775 WLDQFROKHNQQPY-SFHVURJKSA-N 425.573 4.383 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)c3ccc(Cl)c(Cl)c3)C2)cc1 1683782118 ITJMVBWCXSFOGA-MGPUTAFESA-N 438.355 4.004 10 10 IICE Cc1ccc(CN2CC[C@H](NC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2=O)cc1 1686340243 YMTKWNNDKZVYKB-VWLOTQADSA-N 444.579 4.045 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1cccnc1 1694110059 VAFVZEFBHGECRK-FQEVSTJZSA-N 434.588 4.155 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(N)=O)C1 1745372055 HVCJWVHWUFXNDM-VWLOTQADSA-N 434.588 4.245 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCO[C@@H](C)C3)CC2)cc1 1748847132 HFQYBIYTMROXDR-VQTJNVASSA-N 441.620 4.116 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@@H](c3cccnc3)C(C)C)CC2)cc1 1770259458 XKKJWJHJGOYTEQ-XMMPIXPASA-N 434.588 4.147 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@H](O)c1ccc2c(c1)CCCN2C 2044730427 OIXBSIVGNREZCO-LADGPHEKSA-N 439.600 4.128 10 10 IICE CCSC1=NSC2=NC(=O)C(=Cc3ccc(-c4ccc(C(=O)OC)cc4)o3)C(=N)N12 2297333836 ZPPKESRGSKXKCN-UHFFFAOYSA-N 440.506 4.063 10 10 IICE COc1cccc(N2C(=O)C(=Cc3c(C(=O)O)[nH]c4cc(OC)ccc34)SC2=S)c1 2297580035 IGDSIPKHUAWPGX-UHFFFAOYSA-N 440.502 4.289 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccc(N4CCN(C)CC4)cc3)C2=O)cc1 2321683405 AIIAXNDXAWHUNH-UHFFFAOYSA-N 439.606 4.243 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@H](Cc1ccccc1Br)NC(=O)OC(C)(C)C 2362981584 PQSHAGLQDSQQPR-HNNXBMFYSA-N 440.342 4.044 10 10 IICE NC(=O)C1CCN(C2=NC(=O)/C(=C/c3ccc(-c4cccc(C(F)(F)F)c4)o3)S2)CC1 1165157 YSVKVJZPIOBMKV-BOPFTXTBSA-N 449.454 4.133 10 10 IICE COc1cc(/C=C2/SC(N3CCN(c4ccc(C)c(Cl)c4)CC3)=NC2=O)ccc1O 27515467 XKJVVZRFJQINFN-UDWIEESQSA-N 443.956 4.155 10 10 IICE CCOC(=O)c1sc(N2N=C(C)/C(=C/c3ccc(N(CC)CC)cc3)C2=O)nc1C 33248693 LLFSRCYSEBKZIZ-AQTBWJFISA-N 426.542 4.281 10 10 IICE COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C/c1ccc(OCC(=O)Nc2ccccc2)cc1 33332647 NLDUHQJCATUCEO-HYARGMPZSA-N 448.519 4.033 10 10 IICE COC(=O)c1ccc(/C=C2\C(=O)N(c3ccc(Cl)cc3Cl)C(=S)N=C2O)cc1 33395094 LWGMSUKRYGYQMJ-JYRVWZFOSA-N 435.288 4.452 10 10 IICE CN(C)CCOc1ccccc1-c1csc(NS(=O)(=O)c2cccc(Cl)c2)n1 71556401 SISOMYVAKQVLIV-UHFFFAOYSA-N 437.974 4.205 10 10 IICE COc1ccc(N2CCC(N3C(=O)N[C@H](C[C@@H]4CCCc5ccccc54)C3=O)CC2)cc1 761221194 ICOBOFHQXSNPKW-YADARESESA-N 433.552 4.095 10 10 IICE CCCc1c(NC(=O)/C=C\c2ccc(O)c(O)c2)cnn1-c1cc(F)c(OC)cc1F 797766219 WVXDPPRSLIYROZ-VURMDHGXSA-N 429.423 4.175 10 10 IICE CC(C)C(=O)N1CCC(NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 799861669 KLUSOYCDLLCSIK-QGZVFWFLSA-N 435.012 4.023 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2ccoc2)n1Cc1ccccc1 802141486 RKSQMQCULOJJOW-UHFFFAOYSA-N 429.524 4.059 10 10 IICE COc1ccc(CCCCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 1125451905 QXMQLFPWVNYJIK-IBGZPJMESA-N 426.557 4.131 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2ccc(F)cc2)on1 1126583425 SUPKTLCKALRTNA-MRXNPFEDSA-N 431.414 4.481 10 10 IICE Cc1cc(CC(=O)N2[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1128232609 CWUXPSKNHXYHPG-KDURUIRLSA-N 425.573 4.493 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCOCC1CCCC1 1129620116 YQCSXVCKERLBMW-LGMDPLHJSA-N 438.640 4.053 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@H](C(=O)OC)Cc2ccccc21 1134141448 QADKOKMISNNLKB-BIGNBACZSA-N 430.504 4.415 10 10 IICE O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cc2cc(O)c(O)cc2s1 1136803665 HSXWSGBEEQEURK-HNNXBMFYSA-N 436.455 4.336 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1c[nH]nc1-c1ccc(OC)cc1 1137349608 ZYGGXDCRRCRVJM-UHFFFAOYSA-N 430.302 4.216 10 10 IICE CC(=O)c1ccc(Br)c(NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1219895168 JNLYJXWKJOJOPQ-HXUWFJFHSA-N 447.377 4.142 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1-n1cccn1 1264993034 WVVSSIWKWYAHOO-UHFFFAOYSA-N 426.467 4.181 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCCN(C(C)C)CC1 1289423471 LZJKHYSIJVZEHU-UHFFFAOYSA-N 426.653 4.210 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cccc(C(=O)N2CCSCC2)c1 1292282099 KMKQHDXNHJIKQC-UHFFFAOYSA-N 447.560 4.348 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ncccc1NCC1CCC1 1292593156 CBSYHAMYBFTYFR-UHFFFAOYSA-N 430.499 4.294 10 10 IICE COC1(OC)CC2(CN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)[C@@H]2C(C)C)C1 1300067602 XLEXXFAAJXRNCU-HSZRJFAPSA-N 438.568 4.465 10 10 IICE COc1cc(N2CC[C@@](CNC(=O)OC(C)(C)C)(C(C)(C)C)C2)c([N+](=O)[O-])cc1OC 1307193443 BFOYWCHSLPVJRA-QFIPXVFZSA-N 437.537 4.379 10 10 IICE COc1ccc([C@H]2CCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1F 1313417033 QHCIAGYDQPKUHR-FGZHOGPDSA-N 428.552 4.050 10 10 IICE CO[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1315700565 AXNWWIZSASAGRK-OAQYLSRUSA-N 443.661 4.083 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1)OC 1315795318 JVXPZIYXMWKMDO-KGVIQGDOSA-N 437.588 4.106 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 1350933694 PZOHNODMUYFLRC-IRXDYDNUSA-N 440.494 4.003 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](Cc3cccnc3)C3CCCC3)cc2F)C[C@@H](C)O1 1355131724 YLXWMEKPVBNGPH-PWHSHALESA-N 439.575 4.500 10 10 IICE CSc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1359801161 QMGWCTVVFJNRLX-XNTDXEJSSA-N 433.555 4.173 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCN(c4cccc(Cl)c4)C3=O)ccc21 1361201057 OVRPLDDSWJWTJU-NRFANRHFSA-N 439.943 4.093 10 10 IICE CCOC(=O)c1nc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)[nH]c1Cl 1439493477 BTZPLHPORVCHDQ-UHFFFAOYSA-N 435.311 4.482 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1442871049 FAHUTHFGUXPKAL-IBGZPJMESA-N 439.556 4.284 10 10 IICE COC(=O)c1cccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 1446823135 JEEWIQWTULXBDN-UHFFFAOYSA-N 443.547 4.090 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1447566097 WPUZYLJLQYMKHE-KXBFYZLASA-N 426.513 4.027 10 10 IICE COC(=O)C[C@@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccc(OC)cc1OC 1457984749 PSOFQJBIJXPBSK-JOCHJYFZSA-N 436.508 4.146 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CC[C@]3(CO[C@H](C)[C@H]3C)O2)c(C)n1-c1ccc(Cl)cc1 1462838661 HMINLPVUKQKIAT-MTHCDWKRSA-N 430.976 4.379 10 10 IICE Cc1ccc(C(=O)NC[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1469377371 ZJIONFRKNHADNG-RPBOFIJWSA-N 429.564 4.290 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC[C@@H](CCOC)C2)cc1 1501840442 GSZGDGKUPLLBEF-GMAHTHKFSA-N 441.620 4.277 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCOC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1512637181 PWNYQAQKKPYBSM-SFHVURJKSA-N 445.583 4.083 10 10 IICE CCc1nnc(Cn2c([C@H](C)CC)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1513772376 ZCFWJQKPHURITA-QGZVFWFLSA-N 439.633 4.490 10 10 IICE C[C@@H](C1CCCCC1)N(C)c1nnc([C@@H]2CCC(=O)N2)n1CCCSc1nccs1 1520602133 ODHMRYIIAMFYOQ-RDJZCZTQSA-N 448.662 4.273 10 10 IICE CCN1CCOC[C@H]1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1524646272 FQRFLCGXXDUUBF-FQEVSTJZSA-N 428.533 4.016 10 10 IICE COc1cc(C2(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CCCC2)ccc1C 1535346339 UOEOVIOLXUXPKC-UHFFFAOYSA-N 444.522 4.247 10 10 IICE CO[C@@H](C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccccc1 1538920173 QCPDMWIUFPKEIV-LJQANCHMSA-N 437.297 4.485 10 10 IICE C[C@@H]1CCCCN1CCCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1544019541 ZWISLBQDTQPFFD-IFMALSPDSA-N 441.620 4.169 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)CCS1 1546761226 RWXJOLBFGVJRSY-QGZVFWFLSA-N 446.671 4.235 10 10 IICE COCC1(C)CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1555288177 SVFIXSUPJKGPFG-UHFFFAOYSA-N 429.584 4.442 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccc(Oc4ccc(Cl)cn4)c3)cc2)CC1 1558124608 RSQONSYACZHLIY-UHFFFAOYSA-N 436.943 4.209 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCCCSc2nccs2)cs1 1565620364 PPOPLYHGSOXSOA-LLVKDONJSA-N 428.605 4.098 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)cc1F 1565688019 HBKZOQCWEANLSR-QGZVFWFLSA-N 439.597 4.031 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(-n4ccc(C(F)(F)F)n4)cc3)CC2)cc1 1566562592 KPELXFGKEBELHG-UHFFFAOYSA-N 444.457 4.252 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COC3(CCCCC3)O2)c(C)n1-c1ccc(Br)cn1 1566887951 QBJLQILICMZRTM-QGZVFWFLSA-N 448.361 4.057 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nn(C(C)C)cc1Br 1588193567 UHRNZIZMMWQURD-UHFFFAOYSA-N 445.155 4.357 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C2CC2)nc2ccc(F)cc12 1597566989 DYACQAQYAWVZCR-UHFFFAOYSA-N 442.874 4.426 10 10 IICE CCCCN(CC)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1614507754 KZWPAOHZKRGDRH-UHFFFAOYSA-N 448.615 4.224 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccsc2)cc1F 1617665381 FTVOZIMUYCCQJD-HXUWFJFHSA-N 429.565 4.471 10 10 IICE COc1ccc(-c2nnc(N3CCCC3)n2CCCSc2nccs2)cc1OC 1619202455 WLBYKIGLVCGLPS-UHFFFAOYSA-N 431.587 4.201 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1 1625008522 ALCITZYATKOCJG-XMMPIXPASA-N 431.580 4.289 10 10 IICE Cc1nn(C(C)C)cc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1627272157 VBSPLAIQBWPPTD-UHFFFAOYSA-N 439.317 4.497 10 10 IICE CC(C)COc1ccccc1[C@@H](CC(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1629462383 QBQRKGORLZFINM-HXUWFJFHSA-N 448.585 4.316 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2c(c1)CCCCC2=O 1631425507 HUQPHRWYXRXOKE-FQEVSTJZSA-N 426.944 4.349 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCCN(c3ccccc3F)C2)cc1 1632059842 RWXBROWHPQNDAG-QFIPXVFZSA-N 433.527 4.373 10 10 IICE CCOc1cc(NC2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)ncn1 1633576261 YITTYDNOELBDHP-UHFFFAOYSA-N 437.519 4.139 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccnn2C)C(C)C)c(C)n1-c1ccc(Br)cn1 1634111332 OBTPUYHFQWJXJF-GOSISDBHSA-N 444.377 4.155 10 10 IICE CC(C)N1C(=O)CN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1(C)C 1634720131 OORQCGDQFBIAFP-KRWDZBQOSA-N 435.012 4.117 10 10 IICE Cc1ccc(C(=O)N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)CC3)CC2)c(O)c1O 1645977889 NXHMJDDNNDDAHN-QGZVFWFLSA-N 432.561 4.296 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](c4ccc(Cl)cc4)C3(C)C)nc12 1648394221 KADMEPQEIOZPGD-SFHVURJKSA-N 428.920 4.033 10 10 IICE COc1cc2c(c(OC)c1)N(CC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1)CCC2 1653903753 KQWYVKYGAIIQNA-AWEZNQCLSA-N 438.446 4.232 10 10 IICE O=C(CN[C@@H](C(F)F)C1CCCCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1655117898 CBDZAUBQTQANJI-OAQYLSRUSA-N 426.463 4.204 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@H](C(F)(F)F)CC3)cc2Cl)C1 1686268239 ANDRLJYGWHABIH-KSSFIOAISA-N 433.902 4.439 10 10 IICE C[C@H]1CC[C@@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CN1C(=O)OC(C)(C)C 1687248878 ONKCJQXTXBUPRR-AZUAARDMSA-N 430.593 4.216 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1ncccc1C 1694137655 ZEJHRMQQNRGYOF-KRWDZBQOSA-N 438.551 4.018 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1695112386 ICXFZVNZIFQRHU-RUZDIDTESA-N 437.588 4.130 10 10 IICE CSC[C@H]1CCCN1c1nnc(C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1698391724 MRTBLZVMRHQPGN-HXUWFJFHSA-N 431.675 4.335 10 10 IICE CCOCCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1710826959 UXPUXEPDKATCJW-UHFFFAOYSA-N 440.979 4.267 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1726976308 NRQKKHYKSBPFFL-WIYYLYMNSA-N 429.634 4.008 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@@H](C(F)F)C2)cc1F 1768495210 YJXVDQIGWJSAKK-VQIMIIECSA-N 437.510 4.255 10 10 IICE CCN(CC)CCN1C(=O)/C(=C\c2cc(Cl)cc(Br)c2O)SC1=S 1858589538 XDNHTIIPJNIYOO-MDWZMJQESA-N 449.823 4.351 10 10 IICE O=C(NC[C@@H](NCc1cc(Br)ccc1O)C(F)(F)F)OCc1ccccc1 1942702571 XRXODZAAEBGOKR-MRXNPFEDSA-N 447.251 4.102 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@@]21CNCc1c(O)cccc1Br 2089369522 ONTTUXGFTIUDRN-VBKZILBWSA-N 425.367 4.424 10 10 IICE COC(=O)CN1C(=O)SC(=Cc2cc(C)n(-c3cccc(Br)c3)c2C)C1=O 2293976908 YSYCXBDNUDWPON-UHFFFAOYSA-N 449.326 4.066 10 10 IICE O=C1NC(=S)SC1=Cc1cc(Br)ccc1OCCOc1ccccc1 2297303154 CLZSULVOOXBMPC-UHFFFAOYSA-N 436.352 4.396 10 10 IICE COc1cccc(-n2c(C)cc(C=C3C(=N)N4C(SC)=NSC4=NC3=O)c2C)c1 2297345129 UGBPAYNABKEIDX-UHFFFAOYSA-N 425.539 4.042 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(NC(C)=O)c3)C2=O)ccc1OC 2321683258 VPYHVSDSYYVALP-UHFFFAOYSA-N 428.535 4.458 10 10 IICE COc1ccc(C=CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1OC 2325263894 LUIUARRHCVLPTP-QHCPKHFHSA-N 437.584 4.126 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3/C(=N)N4C(SC)=NSC4=NC3=O)o2)cc1 20114556 IPLBNCMLNFDBDF-OIQQPNLJSA-N 440.506 4.063 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)c3ccccc3Cl)c3ccco3)CC2)cc1 38606009 NLTKPPDKDMGKDN-JOCHJYFZSA-N 439.943 4.235 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3ccc(F)cc3)nc3c(C)cccn3c2=O)SC1=S 39835964 JTCXNXSJFGJORE-LFIBNONCSA-N 441.509 4.155 10 10 IICE Cc1nn(Cc2ccccc2)c(C)c1/C=C1/C(=O)N(CCc2ccccc2)C(=O)N=C1O 59858775 HLWKEKACUIHRKT-PXLXIMEGSA-N 428.492 4.093 10 10 IICE CCOc1cccn2c(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c(CC)nc12 71449745 WECFWPXFMBSSQY-UHFFFAOYSA-N 439.471 4.323 10 10 IICE CCN1C(=O)/C(=C\c2c(Sc3ccccc3)nc3c(C)cccn3c2=O)SC1=S 102835612 WHNBAOXMTYKNSA-FOWTUZBSSA-N 439.587 4.375 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(OC2CCCCC2)cc1 735516141 FWIAXYRCVFCQQF-UHFFFAOYSA-N 426.532 4.428 10 10 IICE C[C@@H]1C[C@H](c2noc(CCCN3C(=O)/C(=C\c4cccs4)SC3=S)n2)CCO1 762289112 NGHKFVIYOJYLFZ-ZBDODSLASA-N 435.596 4.248 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768671338 ZQOQRJGWVHIYER-UHFFFAOYSA-N 429.612 4.311 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)c(C)n1-c1ccccn1 771821961 BVECUKQNGVSGIN-QGZVFWFLSA-N 430.430 4.196 10 10 IICE CN(CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C1CCN(c2cnccn2)CC1 789367234 SFKYLNMLAJNSIO-UHFFFAOYSA-N 429.528 4.431 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(C)c(N2C(=O)/C(=C\c3ccccc3)SC2=S)c1 814289036 HYXCWWUHDSYWND-CPNJWEJPSA-N 446.619 4.431 10 10 IICE Oc1c(Br)cccc1CNC[C@H]1CN(Cc2ccccc2)CC12CCOCC2 815149149 BIMFTHXPOLNHKI-FQEVSTJZSA-N 445.401 4.173 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc1 917848032 YOKOADIKZJITHO-UHFFFAOYSA-N 442.971 4.058 10 10 IICE CCOc1ccccc1/C=C1/C(=O)NC(=O)N(c2ccc(Br)c(C)c2C)C1=O 1084375164 KOUCNODHWCJNBB-PTNGSMBKSA-N 443.297 4.131 10 10 IICE CN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1cccc(Cl)n1 1129546374 CUAZZXGHDYBCLR-QBFSEMIESA-N 437.999 4.441 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3cccc4ccccc34)C2)cc1F 1136729690 LQHGTROFNWFTIO-HXUWFJFHSA-N 433.527 4.494 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC2=CCN(C(=O)OC(C)(C)C)CC2)c1 1138668455 HPGXMAJLXFGYLN-UHFFFAOYSA-N 437.540 4.204 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3ccccc3NC2=O)c(C)n1-c1cccc(Br)c1 1151139758 KJWMYVFDABTYJM-HXUWFJFHSA-N 438.325 4.150 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1154527183 RPUZMLFJESELIB-LJQANCHMSA-N 447.963 4.113 10 10 IICE Cc1cc(C)n2nc(SCC(=O)c3cc(C)n(-c4ccc(Cl)cn4)c3C)nc2n1 1164438357 SRLHIAGZQAGABV-UHFFFAOYSA-N 426.933 4.172 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CC(C)(C)Oc4cc(F)ccc43)CC2)cc1F 1224631456 ZAMRSDCVZUHZAS-IBGZPJMESA-N 431.483 4.107 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3c[nH]c4cc(F)c(Cl)cc34)C2)cc1 1230300114 BLZBEAJRSXLFSO-HNNXBMFYSA-N 444.938 4.337 10 10 IICE CCN1CCN(C(=O)c2ccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)cc2)CC1 1264847241 HMIAQGSRHWKKPC-UHFFFAOYSA-N 444.579 4.053 10 10 IICE Cc1c(Br)c(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nn1C 1270438818 CGZZCJOQAGWNLI-GFCCVEGCSA-N 439.785 4.311 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)C[C@@H](C)S1 1291250608 VXKGSHHRAWYMGX-XHSDSOJGSA-N 439.676 4.141 10 10 IICE Cc1cc(C)cc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1293792868 KQXRFXVUCBTARF-JOCHJYFZSA-N 425.573 4.294 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(N4C[C@H](C)O[C@H](C)C4)cc3)c2)CC1 1296014166 RYKQKWHOKOIPMI-OYRHEFFESA-N 436.600 4.083 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1 1298012178 UWFTVFLMEVNEOZ-QZTJIDSGSA-N 429.520 4.003 10 10 IICE COCC1(CCn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCC1 1315835860 PNMVPKZEJHCVCU-UHFFFAOYSA-N 441.620 4.334 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cnc3scc(-c4ccccc4)n3c2=O)C2CC2)cc1 1318323834 NAXBQWSSMBQCEZ-UHFFFAOYSA-N 444.560 4.294 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1c(F)ccc2ccncc12 1354785032 RBRLHTSHLRWTJE-UHFFFAOYSA-N 433.405 4.159 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(F)c2I)cc1 1355016805 ZBWSBQBPGWQHGJ-UHFFFAOYSA-N 426.273 4.207 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)oc1Br 1357519380 QNJOIEDPMGOJCS-UHFFFAOYSA-N 447.251 4.136 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2[C@@H]2C[C@H]2C(C)C)c(C)n1-c1ccccc1 1361044820 GBYYVEHEVPYLEM-XUEUYAKLSA-N 434.588 4.270 10 10 IICE COc1ccc(N2CCC(NC(=O)C3(C(=O)OC(C)(C)C)CCCCCC3)CC2)cc1 1435024583 CLHOYJQDYVJKHY-UHFFFAOYSA-N 430.589 4.463 10 10 IICE CSc1cc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)ccc1Br 1435229343 CIFSYHFQZDVQFG-UHFFFAOYSA-N 448.386 4.125 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C(F)F)cc1 1436586608 PRNGSSGULPYGNI-LJQANCHMSA-N 433.499 4.421 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1OC 1446825105 SEYOQQAWTXVZQB-UHFFFAOYSA-N 445.563 4.321 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1449406674 HMIZNQTUXMGKOW-WZONZLPQSA-N 432.520 4.057 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(Br)c(Br)[nH]1 1451671303 QQXMAUOJGOPWPS-NSHDSACASA-N 443.183 4.275 10 10 IICE COc1cc(NC(=O)Cc2cccs2)c(C(=O)N[C@H](C)c2ccccc2O)cc1OC 1454799322 SZNZDJZRBQFILB-CQSZACIVSA-N 440.521 4.143 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2Br)cc1F 1465005490 IZNSQWJWWSIMHW-UHFFFAOYSA-N 442.260 4.412 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)Cc2cc(Br)cn2C)CCCC1 1517972217 QXPNLHUXVDYSGE-UHFFFAOYSA-N 444.373 4.288 10 10 IICE COCCN(CCc1ccccc1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1519028899 ZZSHAYJYFZJYIP-UHFFFAOYSA-N 433.596 4.126 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)sc2c1CCCCC2 1525382002 GDLURXPIGSZRFQ-GFCCVEGCSA-N 448.491 4.073 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3cc(Cl)ccc3Br)CC2)cc1 1526237461 KSPUNCPMZNSCCF-UHFFFAOYSA-N 437.765 4.393 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4ccc(F)cc4F)CCCC3)cc2F)CC1 1528701169 FWLJJZHKEFEIBN-UHFFFAOYSA-N 445.529 4.374 10 10 IICE C[C@@H](COc1ccccc1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1529037699 NTPLYRQLJPYUCS-CCNLRRDASA-N 444.553 4.001 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)/C=C/c3ccc4c(c3)NC(=O)CO4)cc2Cl)C1 1538422508 XKPPQNKOFSWZKO-FSNWXROXSA-N 439.943 4.237 10 10 IICE O=C(COc1ccc(C(F)(F)F)cc1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1539582093 OSHJFVMUUWBJDM-HNNXBMFYSA-N 444.400 4.471 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 1542431974 NIFVYVBDKLFYAB-VXKWHMMOSA-N 448.394 4.044 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2C[C@H](C)O[C@H](C)C2)cs1 1542898532 WLHIANQYZIYFRO-ALXJQNPVSA-N 441.601 4.179 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC(C)(C)C1 1544616946 UCTWFBBMOHTZBP-GOSISDBHSA-N 443.611 4.472 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC23CCN(C(=O)OCc2ccccc2)CC3)c1O 1560163396 PUMXAYMXAJJOLV-UHFFFAOYSA-N 426.488 4.111 10 10 IICE COc1cc(CN(C)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)ccc1OC(F)F 1564946010 WVZDQUZRKSDRQM-INIZCTEOSA-N 435.515 4.444 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](c3ccccc3C)C(C)(C)C)CC2)cc1 1566233170 VPBBHVDCIHYYDN-VMPOVSTKSA-N 449.595 4.112 10 10 IICE Cc1cc(C(=O)N2CCn3c(Br)cnc3C2)c(C)n1-c1cccc(Cl)c1 1567585061 ZFCCUQQCYDFYJQ-UHFFFAOYSA-N 433.737 4.363 10 10 IICE COc1cc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc(OC)c1Br 1584089846 UOHLVRLUJDYXPX-CQSZACIVSA-N 435.362 4.202 10 10 IICE Cc1ccc(F)c(N)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1597560491 DPSYFYPXRXFXCM-UHFFFAOYSA-N 432.543 4.333 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(CC(F)(F)F)CC1 1617854719 UVFGONXHXXYMGV-AWEZNQCLSA-N 444.453 4.453 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nc2ccc(Br)cn2c1F 1623549963 OGCHMWCYBYFQMZ-UHFFFAOYSA-N 431.309 4.108 10 10 IICE COc1cccc(N(CC(=O)NCc2ccc(N3CCCC3)cc2)C(=O)OC(C)(C)C)c1 1629758774 VLRCCTHUTYWLNH-UHFFFAOYSA-N 439.556 4.353 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(C)nn(-c4ccc(F)cc4)c3Cl)CC2)cc1 1630992754 VNDQXVRRJIUIGV-UHFFFAOYSA-N 442.922 4.334 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)cc2Cl)C1 1634720178 PVGRSEUAGSVIEX-KKSFZXQISA-N 447.023 4.023 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)C1CCCC1 1637561210 ICTLTGNHONSGPU-QUCCMNQESA-N 446.588 4.353 10 10 IICE CC(C)(NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(F)cc1F 1655601686 FMEUXBXKTHFSDN-UHFFFAOYSA-N 434.442 4.204 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3ccc(F)cc3F)cc2Cl)C1 1680561662 CTYSCSXXDFXMER-XOBRGWDASA-N 437.918 4.387 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@]3(C)Cc3cccc(F)c3)C2)cc1 1682188146 HUGWBKSQUKAOIC-CPJSRVTESA-N 425.548 4.467 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@](C)(OC)C3CC3)CC2)cc1 1730180515 REFBNNUIJGCRNP-VWLOTQADSA-N 441.620 4.017 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)cc1C 1743605966 FSMOYCGTSQVCPA-ZSZQSSIHSA-N 439.526 4.370 10 10 IICE CC/C=C\Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1745092556 OTDSPGXJFHFTSG-WAYWQWQTSA-N 432.572 4.088 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)C1(F)F 1750354191 GJTMEYRIUPDUTK-ZRGWGRIASA-N 437.510 4.111 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCO2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1752509122 HPBUVIQZJBLYRE-HXUWFJFHSA-N 431.556 4.040 10 10 IICE O=C(CNCc1ccccc1C(F)(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1860717867 ZQCGLTQKKGFBPY-UHFFFAOYSA-N 438.405 4.209 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2nc(C)cs2)sc(C)c1-c1ccc(C)c(C)c1 1860765098 KFUZCQYPLFOGRM-UHFFFAOYSA-N 443.550 4.469 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(NCc3cc(Cl)cc(Br)c3O)C[C@@H]2C1 2077033883 FOBLQYOWPCCBOA-KZULUSFZSA-N 431.758 4.297 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@@H](NCc1c(O)cccc1Br)C2 2232271573 SWAPBEOEILJYBN-MGBSGCIJSA-N 425.367 4.326 10 10 IICE CC1CCN(C2=NN3C(=N)C(=Cc4cc(Cl)c(O)c(Cl)c4)C(=O)N=C3S2)CC1 2297352826 ZWWMTUAEJVUMKG-UHFFFAOYSA-N 438.340 4.008 10 10 IICE Cc1ccc(CN[C@@]23CCCN(C(=O)OC(C)(C)C)C[C@@H]2C3)c(O)c1Br 2352945053 QADNWEZJNKWNGZ-MGPUTAFESA-N 425.367 4.342 10 10 IICE Cc1ccc(CN[C@@]23CCC[C@]2(F)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2380791532 AFAZWLZRUBPCGW-VQTJNVASSA-N 443.357 4.434 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551047 IPQSQFWUYLXWDV-ARESOWRYSA-N 427.526 4.498 10 10 IICE COc1ccc(Cl)cc1-n1cccc1/C=C1\C(=N)N2N=C(C(C)C)SC2=NC1=O 32964380 ARLJTUYZUTXUGK-NONNEFQTSA-N 427.917 4.414 10 10 IICE COc1cc(OC)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1F 435818266 OKSJKMNUQRYPHR-UHFFFAOYSA-N 425.504 4.203 10 10 IICE CC[C@H](NCCOCCN(C)C(=O)OC(C)(C)C)c1cc(Br)ccc1O 705970819 COEXYWIJFRVRPT-INIZCTEOSA-N 431.371 4.079 10 10 IICE CCN(C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@H](C)Cc1ccc(OC)cc1 731403567 OVMVSRFKSJXVSW-WOJBJXKFSA-N 425.573 4.256 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)c1 731972786 JSYNKQOLVJPYCU-VUUYWXRKSA-N 435.471 4.391 10 10 IICE O=S(=O)(Cc1ccc(Cl)cc1Cl)NCc1cc(Br)ccc1O 796191664 OFERCDITKMPVPP-UHFFFAOYSA-N 425.131 4.081 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cccc(-c2noc(C3CC3)n2)c1 806342422 JWLGOSMXLLRGQG-UHFFFAOYSA-N 429.274 4.404 10 10 IICE COc1ccc2c(/C=C3/SC(=S)N(c4cccc(F)c4)C3=O)c(C(=O)O)[nH]c2c1 1081156866 NQJNPAWXDMDZER-CXUHLZMHSA-N 428.466 4.420 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)c1 1137523026 NETZCXARRBTEGM-NRFANRHFSA-N 447.579 4.297 10 10 IICE COc1ccccc1CONC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1156010259 WREOTCNFERFXOZ-UHFFFAOYSA-N 430.302 4.122 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc2c(c1)nc(C)n2[C@H](C)CO 1157936450 JNWLOCGYWCHIBP-MRXNPFEDSA-N 430.508 4.370 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccc(CNC(=O)OC(C)(C)C)cc2F)c1 1230625557 YASGQKXYNAFURM-CQSZACIVSA-N 447.507 4.125 10 10 IICE O=C(c1cccc(O)c1O)N1CCN(Cc2ccc(-c3cccc(Cl)c3)s2)CC1 1290726820 WKFYHJCSZGPSHP-UHFFFAOYSA-N 428.941 4.438 10 10 IICE Cc1cc(C(=O)CSC[C@@H]2CC[C@@H]3C[C@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1307377241 OBELHTCHJDQKDF-KZNAEPCWSA-N 432.611 4.094 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCC[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 1312313028 CWABLUFSEGLBDH-JTHBVZDNSA-N 438.616 4.074 10 10 IICE COCC(C)(C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1315765478 ZGDULZHTBQOVOD-UHFFFAOYSA-N 434.588 4.249 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](CO)c2nc(-c3ccccc3)no2)c1 1322625903 DQQOSYRZXPNXQK-FQEVSTJZSA-N 436.899 4.261 10 10 IICE CCO[C@H]1C[C@](NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)(C(=O)OC)C1(C)C 1326016300 NUWRGOVXNPDFOH-CVDCTZTESA-N 432.948 4.224 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)c3ccc(C(F)(F)F)cc3)CC2)cc1 1349007040 ZKFBZCCWKOJCQN-SFHVURJKSA-N 449.517 4.146 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)c(Br)s3)cc2F)CC1 1352961825 ZEJQDXJVZZEQPO-UHFFFAOYSA-N 440.382 4.030 10 10 IICE COc1ccc(CCCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1OC 1357835659 HVDXSSUCCFCRHD-QZTJIDSGSA-N 444.547 4.096 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@@H]1C[C@@H]1CN(C(=O)/C=C/c2cccnc2)c2ccccc21 1439584655 KOLUYKQKHKAXOT-HZYCFNBMSA-N 449.551 4.251 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3=C(c4ccccc4)SCCO3)cc2F)C[C@H](C)O1 1441780416 FLAXVWSEUJYAHB-IRXDYDNUSA-N 442.556 4.188 10 10 IICE Cc1cc(CC(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1445350631 QGZKRDOSFRYAQV-OALUTQOASA-N 432.008 4.296 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1 1451662987 ABBYBEAXSIKWNJ-LJQANCHMSA-N 446.595 4.279 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)[C@@H]1CCC[C@H](OC)C1 1452752456 DMZZCNDAPFEWHK-LKUPVBHCSA-N 432.948 4.224 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)OC(C)(C)C)C[C@H]3C(C)C)cc2)CC1 1460442058 IJBWHBUXFIDASD-QHCPKHFHSA-N 431.621 4.379 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc2c(c1)CCOC2 1461635184 ZVPGFOBFYONHBA-ODLFYWEKSA-N 442.537 4.128 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1cccc(S(N)(=O)=O)c1 1467236627 HHDQYRLFPPKVQI-HSZRJFAPSA-N 439.581 4.239 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(OC)c(O)c1 1467265851 UIFVCXOJROZQRE-NRFANRHFSA-N 442.899 4.106 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCC(C)(C)C(=O)OC(C)(C)C)cc1 1469235585 MXZCPNITTGGKJR-UHFFFAOYSA-N 426.557 4.323 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccccc3)[C@@H]3COC(C)(C)C3)C2)cc1 1470594027 QLIHDAPXFYGGDD-GGAORHGYSA-N 437.584 4.301 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CCC[C@@H](c2ccccc2)C1 1478590022 QFXIBNRWNJFJQT-UXHICEINSA-N 429.511 4.327 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)[C@@H](C)C2)n1Cc1ccc(N(CC)CC)cc1 1496764709 WSGVNCUYXZPTFI-OALUTQOASA-N 440.636 4.183 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1COCCO1 1500831143 HEGRLRGMDYBLDC-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CN(CCc1ccccc1F)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1517264536 ABTUHOVAUNENPY-KRWDZBQOSA-N 447.605 4.239 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)Cc3csc4sc(C)cc34)CC2)cc1 1523442837 LLSWDTFHGHLGRQ-UHFFFAOYSA-N 443.638 4.151 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CCCC2 1525383528 XEJZZXSBFOYNAR-AWEZNQCLSA-N 444.528 4.323 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1c(F)cccc1I 1525761540 CUBUOOQTQYBRDX-CYBMUJFWSA-N 440.300 4.166 10 10 IICE COC(=O)C(C)(C)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 1526172523 GFSYVTMJDFOPJC-VLGSPTGOSA-N 443.547 4.469 10 10 IICE CCn1c(SCC(=O)NCc2cc(C)n(-c3ccccc3)c2C)nnc1-c1ccco1 1531611324 AXDDBZFMMXGTCV-UHFFFAOYSA-N 435.553 4.374 10 10 IICE CCOC(=O)C1(N(C)C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCCCC1 1532922889 OPGLVDINZFDLEC-UHFFFAOYSA-N 426.557 4.253 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1cc(Br)cnc1Br 1543805508 FCDOQDLJOUUJBM-UHFFFAOYSA-N 432.459 4.049 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1545599551 SHPTYASWSQQOFU-IBGZPJMESA-N 431.964 4.416 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@@H]1CCCO[C@H]1C(C)(C)C 1554175106 HUZCOPPBGJVWDD-XUZZJYLKSA-N 449.599 4.447 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCCNc1ccccn1 1554175373 MRHIZXUJOFBDRC-UHFFFAOYSA-N 434.569 4.170 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1555491399 ZAWHICCQWJSFRI-HXUWFJFHSA-N 425.602 4.331 10 10 IICE Cc1cc(C(=O)N(C)C2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]23)c(C)n1-c1ccc(F)cc1 1558829641 NDTMUTKWJWBHSK-WOJBJXKFSA-N 427.520 4.171 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)Nc2c(Cl)ccc3nonc23)cc1 1586677394 SKUWQBDBKOXKEG-UHFFFAOYSA-N 432.665 4.385 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)[C@@H]2CCSC2)cc1 1615381709 DUXIAVRIEGXWJO-JOCHJYFZSA-N 436.629 4.100 10 10 IICE COc1ccc2c(NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)ncnc2c1OC 1615759379 LDHVRAMTGYOQIX-OAQYLSRUSA-N 435.572 4.352 10 10 IICE CCc1ccc(N(CC)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 1615910170 LQVPRRDSEWKKAI-RTBURBONSA-N 427.564 4.144 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@]2(CO)CC[C@@H](C)C2)sc(C)c1-c1ccccc1 1617443849 POVYYLAWORCRAY-VOIUYBSRSA-N 444.597 4.322 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2ccc(O)cc2c1O 1620752857 CJNRMLHNKXKKDV-HNNXBMFYSA-N 428.435 4.251 10 10 IICE Cc1cc(C(=O)NCC2(NS(C)(=O)=O)CCCCC2)c(C)n1-c1ccc(C(C)C)cc1 1624948982 XCVAQETUBXKJLY-UHFFFAOYSA-N 445.629 4.199 10 10 IICE O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1625683979 HGFZEDWGYKWIME-HXUWFJFHSA-N 441.286 4.066 10 10 IICE CC(C)(C)OC(=O)N(C1CC1)C1(C(=O)NCc2cccc(Br)c2O)CCC1 1626822715 STCSCAYGBDVNAR-UHFFFAOYSA-N 439.350 4.093 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc3c(c2)OC(F)(F)O3)cc1 1627306017 ADGDYKHXHLOBPZ-UHFFFAOYSA-N 426.419 4.087 10 10 IICE Cc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(O)nc2ccccc12 1629055700 PRNGCQOFEQBOEJ-OAHLLOKOSA-N 427.451 4.249 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3c(F)cccc3NS(C)(=O)=O)c2C)c1 1629805201 ZFUXAVZDYRHGCA-UHFFFAOYSA-N 443.544 4.152 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 1634065242 QHQGZPIDVGVDPB-JOCHJYFZSA-N 435.911 4.095 10 10 IICE CCCn1nccc1NC(=O)CN(Cc1ccc(C)s1)c1ccc2c(c1)OCCO2 1642088949 CQEVQLAHRHEFSN-UHFFFAOYSA-N 426.542 4.080 10 10 IICE COC(=O)CN(Cc1ccc(C(F)(F)F)cc1)Cc1cc(Cl)cc(C(C)=O)c1O 1645358336 OAYSOZZQPCDSPN-UHFFFAOYSA-N 429.822 4.442 10 10 IICE CS(=O)(=O)c1ccc(CN(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)o1 1652703275 OUQBKLDDPAACIQ-VMPITWQZSA-N 425.506 4.174 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@](C)(COC)C2)sc(C)c1-c1ccccc1 1654520875 CSUSYFUHYVXCHU-QHCPKHFHSA-N 430.570 4.197 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCCc2ccc(OC(C)(C)C)cc2)N(C)C)cc1 1670818308 XISVBKKFOPDTQT-HSZRJFAPSA-N 426.605 4.075 10 10 IICE COc1cc(Br)ccc1CNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1681644242 ZNTWFQZQSJHUTH-OAHLLOKOSA-N 434.378 4.263 10 10 IICE CCOC(=O)[C@@H]1CN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CCC1(F)F 1683303916 RIBAASMFDKAKGY-FQEVSTJZSA-N 433.499 4.132 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1694451350 DLNYXCFKJQRDIZ-QHCPKHFHSA-N 427.524 4.105 10 10 IICE COCC(C)(C)CCCn1c(C2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1697720863 SFLRNDXZYOHEAW-UHFFFAOYSA-N 441.620 4.334 10 10 IICE c1ccc(OCCc2nnc(N3CCSCC3)n2CCCSc2nccs2)cc1 1705679928 FIOKEAAIFBKAEK-UHFFFAOYSA-N 447.655 4.092 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@@H]2C)n1Cc1ccc(N(CC)CC)cc1 1708724424 JMYOPTSIOBCSFW-OALUTQOASA-N 440.636 4.326 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1710027940 MRQDVFMAGVYHNR-QPPBQGQZSA-N 427.593 4.029 10 10 IICE CO[C@]1(C)CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC1 1729911814 SPHSXDHUSMPXIZ-XMMPIXPASA-N 443.661 4.398 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1(C)C)OC 1730463472 MYAVPJHMMBTNCH-OAQYLSRUSA-N 437.588 4.393 10 10 IICE CC[C@H](C)CN(CC)c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1743838362 FNBSCNQYLQVBSU-SFHVURJKSA-N 449.603 4.221 10 10 IICE COCC[C@H]1CCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1769627523 SZVPJMMBELHHPP-IAGOWNOFSA-N 437.635 4.021 10 10 IICE CC[C@H](C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858596728 ZFVZIFLKSHBZAD-YGWMAUTQSA-N 432.336 4.289 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(Br)c2O)C(F)(F)CC1 2093435782 DZURRKTWAWVEOO-CQSZACIVSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CNCc2ccc(Br)cc2O)CC12CCC2 2116698716 NLQRPDNDDOQKEN-AWEZNQCLSA-N 425.367 4.424 10 10 IICE COCCNCc1ccc(N2CCC[C@H](OCc3ccccc3)C2)c(Br)c1 2186382894 XTDCWAQBDWYIGQ-FQEVSTJZSA-N 433.390 4.371 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3cc(C)n(C4CCCC4)c3C)C(=O)NC2=S)cc1 2293239182 LWRSDBFNHULMRR-UHFFFAOYSA-N 437.565 4.450 10 10 IICE CCCCN1C(=O)C(=C2C(=O)N(CC)c3ccc(Br)cc32)SC1=S 2296711389 VPKARDAXXOERHZ-UHFFFAOYSA-N 425.373 4.187 10 10 IICE CCCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314768576 LBRHVOBVLHHRMA-SFHVURJKSA-N 442.518 4.491 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccc(Cl)cc1 2314827390 CZVJMUVKBFSPRA-UHFFFAOYSA-N 447.925 4.478 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 14544779 LIVRQJJFONDDEK-KDLAUNOPSA-N 435.549 4.015 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@@H]3C=CC[C@H]32)ccc1O 20692983 VYITUVMZDWJWNS-IECBHUPTSA-N 440.565 4.402 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(NS(=O)(=O)c2ccc(C)cc2)C1=O 33372993 KCPBIJRLUJKCAR-SXDCBDFHSA-N 430.576 4.036 10 10 IICE COc1cccc(N2C(=O)N=C(O)/C(=C/c3c[nH]c4ccc(Br)cc34)C2=O)c1 96475825 KPSTXVZYZLEHIJ-APSNUPSMSA-N 440.253 4.446 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(OCC(F)(F)F)c2ccccc2n1 540100815 ASDHYFCKIFCQQF-UHFFFAOYSA-N 431.414 4.281 10 10 IICE COc1cc(Cl)cc(CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OCc2ccccc2)C3)c1O 701087311 QKXFJNRRSSLJII-NSISKUIASA-N 430.932 4.334 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 741417300 YSVNGPYUYAXVTJ-UHFFFAOYSA-N 444.333 4.062 10 10 IICE C[C@H](NCc1cccnc1N(C)C)c1cc(Br)cc(Br)c1O 756409986 CMHOQUXRXMNQEH-JTQLQIEISA-N 429.156 4.229 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1cccc(N2CCC(C)CC2)c1 761343982 UOFNQZQPGHCKMK-UHFFFAOYSA-N 443.569 4.081 10 10 IICE Cc1cc(C(=O)NCc2nnc(C3CCC3)n2C)c(C)n1-c1ccc(Br)cc1 764349605 QYHZIHCZTPLVIU-UHFFFAOYSA-N 442.361 4.183 10 10 IICE CC(C)N1CC[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1c1ccc(F)c(F)c1 778826324 ISWMTRWBWMZVLR-XZOQPEGZSA-N 430.543 4.396 10 10 IICE CCCN(Cc1ccccc1O)C(=O)Nc1cc(F)ccc1N1CCCN(C(C)=O)CC1 790539021 LWCDVIWIVGIESM-UHFFFAOYSA-N 442.535 4.034 10 10 IICE CC(=O)C(=O)CSc1nnc(COc2ccccc2F)n1[C@@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 808010274 RDSMVRYBQAQVSC-HJWJTTGWSA-N 431.533 4.244 10 10 IICE CCCN(CCC)c1ccc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)cc1 814285944 SKSLEIKQHOCFOT-DYTRJAOYSA-N 447.670 4.237 10 10 IICE COc1cc(N2CCN(C(=O)[C@@H]3CCC[C@@H]3Cc3ccccc3)CC2)cc(OC)c1OC 1127931915 GQYHZCFKBGAEFF-IFMALSPDSA-N 438.568 4.020 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](C)Oc1ccc(F)cc1Br 1129974398 OLIDZWZZMBKWRC-GJZGRUSLSA-N 437.353 4.477 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4ccccc4Br)CC3)C2)cc1 1129993230 LTEWSMHPVSEVBV-INIZCTEOSA-N 429.358 4.132 10 10 IICE Cc1ccccc1CN(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1135248591 LKSKGNSCLQDODC-CPNJWEJPSA-N 428.554 4.384 10 10 IICE CC(=O)N1C[C@@H](C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)Oc2ccccc21 1137816970 WXUVGEQZEJAOAX-CJAUYULYSA-N 430.504 4.296 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)CCCC1 1137973483 XQPMKQZVSVEUFR-QFIPXVFZSA-N 430.907 4.171 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(OCCN(C)C)c(F)c2)cc1 1142010249 OPTYURKJCUIJRQ-UHFFFAOYSA-N 437.515 4.167 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)sc(C)c1-c1ccccc1 1194487006 AXRZCQZSDVIAMK-DQLDELGASA-N 442.581 4.242 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Oc4ccccc4)ccn3)cc2F)CC1 1265012064 MOYZAQPIILKAON-UHFFFAOYSA-N 434.515 4.085 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](C)C1 1291361691 RCRXLDQPZNIVPQ-MHPIHPPYSA-N 437.588 4.127 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1293606075 FMKNBPDTLBLQGF-DENIHFKCSA-N 443.661 4.082 10 10 IICE COc1ccc(-c2nc(NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)n[nH]2)cc1OC 1293869608 JYZXXNLXZDLDAM-UHFFFAOYSA-N 431.496 4.457 10 10 IICE Cc1ccc(O)c(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1 1301046497 CWDQUNDNKUPNBB-BOPFTXTBSA-N 432.592 4.060 10 10 IICE COC(=O)c1cnc([C@@H]2CCCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)s1 1301446549 CAIBGOXJMMXVQP-MRXNPFEDSA-N 441.528 4.496 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(Cl)nc1 1314306407 XRMRPFNDRMIKSQ-UHFFFAOYSA-N 440.979 4.148 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(-c4ccc(C)o4)s3)CC2)cc1 1352411053 WGBPPMKYQSJYQK-UHFFFAOYSA-N 439.581 4.267 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3CCOc4ccc(Br)cc43)CC2)cc1 1352536467 BOOSIEQXXONLDR-LJQANCHMSA-N 445.357 4.109 10 10 IICE Cc1cc(CC(=O)N2CSC[C@H]2C(=O)Nc2ccccc2F)c(C)n1-c1ccccc1 1359824304 KJMAUAIUUSHCGK-QFIPXVFZSA-N 437.540 4.316 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C 1440663509 QJAJRHHZKKZZJR-JOCHJYFZSA-N 439.556 4.082 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)Cc1ccccc1Cl 1441783521 LNJFODLMYKNZJU-QZTJIDSGSA-N 447.982 4.231 10 10 IICE CCc1cc2oc(=O)cc(CN3CCN(c4ccc(OC)c(F)c4)CC3)c2cc1Cl 1459750901 YZOHZQSCNNETIE-UHFFFAOYSA-N 430.907 4.479 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC(N3CCN(c4cccc(Cl)c4)CC3)CC2)c1O 1460202961 MNPSVQXMHXHWGN-UHFFFAOYSA-N 445.966 4.174 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1ccc2c(c1)OC(F)(F)O2 1469681119 AALLXQZEMHHJLR-UHFFFAOYSA-N 426.419 4.201 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1 1472970321 ATKBDTFTUBHSEF-UHFFFAOYSA-N 429.855 4.265 10 10 IICE COC1CCC(CCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CC1 1504462911 FMGPVANHXWSQFS-ZNIKRAEXSA-N 428.577 4.457 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)CCCC1 1515298354 RHLSVNOJTMXPGG-AUMHUTNHSA-N 438.593 4.486 10 10 IICE CSc1c(F)cccc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1532199209 WBNVOGFAKVUILX-UHFFFAOYSA-N 436.420 4.484 10 10 IICE C[C@@H](CC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)n1cc(Br)cn1 1533209489 GATZFOSNJQFLGF-INIZCTEOSA-N 445.361 4.485 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(COc4ccc(C)nc4)c3)C2)cc1 1537109409 OALAXGKVTWHVCJ-NRFANRHFSA-N 431.536 4.234 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)OCc2cccc(S(=O)(=O)N(C)C)c2)c1 1538728358 AQGNDLAMOAYIBW-UHFFFAOYSA-N 446.956 4.355 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCCN(C3CCCC3)CC2)nnc1C(C)(C)C 1542228522 MLHJVNKYVYDWHY-UHFFFAOYSA-N 438.664 4.453 10 10 IICE CCOC(=O)[C@]1(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CCc2ccccc21 1543916970 JBRPFUIAOGFUOV-SANMLTNESA-N 430.504 4.041 10 10 IICE Cc1ccc(C(=O)N2CCN(CC(F)(F)F)CC2(C)C)cc1-n1c(C)cc(C=O)c1C 1566922357 PQHSELVDTYPLGI-UHFFFAOYSA-N 435.490 4.314 10 10 IICE Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1570168011 DYZIYKGJSCFYBG-KRWDZBQOSA-N 431.527 4.496 10 10 IICE CC(C)(C)OC(=O)NCCCc1ccc(OCC(=O)NCc2cc(Cl)ccc2O)cc1 1583820511 DXQHDIICMAHRBS-UHFFFAOYSA-N 448.947 4.198 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(Cl)c2O)NC(=O)OC(C)(C)C)cc1 1586619968 PUOSGBRSEULWRY-GOSISDBHSA-N 433.936 4.107 10 10 IICE CS[C@@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C[C@H]1N1CCCC1 1611064582 LHWGZWLNOKHAGS-FGZHOGPDSA-N 432.033 4.328 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N2CCN(CC)[C@@H](C)C2)cc1 1615382003 JWRQJFFSOWJMKK-NRFANRHFSA-N 438.664 4.436 10 10 IICE CO[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC[C@@H]1C 1619525960 OBNDJECUIVQPCJ-PGRDOPGGSA-N 425.621 4.159 10 10 IICE COC[C@H](F)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1619624663 LFYHXSHCNVRMDR-OAQYLSRUSA-N 429.584 4.232 10 10 IICE CCC(CC)(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)cc1 1626090541 LWFGYNUSKADFFC-UHFFFAOYSA-N 442.003 4.416 10 10 IICE Cc1cc(CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)no1 1627271691 CIAIYZUOMVQACL-UHFFFAOYSA-N 426.274 4.027 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@]23CCCN(C(=O)OC(C)(C)C)C3)cc1F 1627604669 NOXGBSHFNVAXAS-KOSHJBKYSA-N 433.568 4.325 10 10 IICE CCN(CC)C[C@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1634592939 UOTCWWDMERILPI-QGZVFWFLSA-N 433.394 4.056 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCCCN2C(=O)OC(C)(C)C)cc1 1639691223 QRQFZWWYKILZFP-UHFFFAOYSA-N 425.529 4.224 10 10 IICE CCCC[C@H]1NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1=O 1641155684 NOEOGQTXZQLZJQ-GOSISDBHSA-N 446.345 4.150 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccccc1OCc1ccc(Br)cc1 1651222697 MVCIDKSLPSKDEL-UHFFFAOYSA-N 428.282 4.369 10 10 IICE C[C@H](S[C@H](C)C(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1656495334 HJHOWUZCHUWIOH-UONOGXRCSA-N 439.533 4.252 10 10 IICE COc1cccc([C@@H](C)N2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1683253212 DZDGJCLFCIDIJX-NHCUHLMSSA-N 438.616 4.089 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3ccc(N4CCCCC4)cc3)C2)cc1 1683337125 VGCSTBJCRNLBGC-JOCHJYFZSA-N 436.600 4.353 10 10 IICE CN1CC[C@@H](CNC(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(Cl)c(F)c1 1685956537 ZRINDWOVWHMQIJ-ORAYPTAESA-N 426.319 4.330 10 10 IICE COc1ccc(CN(CCCO)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1687218555 CTWZGVPCUWGUBY-UHFFFAOYSA-N 435.568 4.239 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)CC[C@H]1C 1696998545 SIHCCZKSOKBSEH-QZTJIDSGSA-N 434.588 4.114 10 10 IICE CO[C@@]1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CC(C)C)CCOC1 1697226970 ORSUOIGQZODWEH-RUZDIDTESA-N 437.588 4.250 10 10 IICE C=CCN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(CC)CC)cc1 1705845710 CVHALKANPHICTH-UHFFFAOYSA-N 429.572 4.033 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccoc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1708401298 BMNNIBWRIDXXJU-IBGZPJMESA-N 437.588 4.278 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC[C@@H](COC)C2)n1Cc1ccc2c(c1)CCCN2C 1708501150 CIMJYSXKOSFLCI-TZIWHRDSSA-N 425.621 4.475 10 10 IICE CN(C)c1ccc(Cn2c(N3CC[C@H](CN4CCCCC4)C3)nnc2C(C)(C)C)cc1F 1747577576 RPOMWRWDPVXCSO-HXUWFJFHSA-N 442.627 4.141 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1750030282 LHSHTKJJDOVINB-UHFFFAOYSA-N 432.572 4.035 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2C[C@@](C)(O)C(C)C)c(C)n1-c1ccccc1 1751411605 IMHODNWMHVQGHQ-XMMPIXPASA-N 439.629 4.313 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1CCC(C)(F)F 1768682242 UTITYMBGVDALBS-UHFFFAOYSA-N 440.292 4.423 10 10 IICE CN(C)c1ccc([C@@H](CNS(=O)(=O)Cc2ccccc2Cl)N2CCCCC2)cc1 1858074615 ODTWAMRDSQPYEE-JOCHJYFZSA-N 436.021 4.053 10 10 IICE COc1cc2cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)[nH]c2cc1OC 1874180029 WGAXKTRABVJEOH-UHFFFAOYSA-N 426.428 4.213 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)c1cc(Br)ccc1I 2163079069 MBEONVAWRYCXLG-INIZCTEOSA-N 445.142 4.429 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)CC2)c1O 2236055038 NMKXJWASGQFHPL-HDJSIYSDSA-N 443.382 4.336 10 10 IICE COc1ccc(NCc2c(O)cccc2Br)cc1I 2265719492 KLFOFDMXFBMNHS-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CCOc1cc(C=C2C(=O)NN(c3ccccc3)C2=O)ccc1OCc1ccc(C)cc1 2293568260 SPPGGXMEVZXJRK-UHFFFAOYSA-N 428.488 4.434 10 10 IICE CCOc1cc(C=C2SC(N3CCN(c4cccc(Cl)c4)CC3)=NC2=O)ccc1O 2296167095 TZRQZLBSCCZMIY-UHFFFAOYSA-N 443.956 4.237 10 10 IICE COc1cc(C=C2SC(NC(C)=O)=NC2=O)ccc1OCc1c(F)cccc1Cl 2296739269 MTHRLBJHMPNCCM-UHFFFAOYSA-N 434.876 4.173 10 10 IICE CCOc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccc(C)cc1 2297347486 ZPKIVGXGJWGBAI-UHFFFAOYSA-N 447.491 4.302 10 10 IICE CC[C@H](CNC(=O)OC(C)(C)C)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135496 RCXGBYKRLXEGEO-AWEZNQCLSA-N 443.382 4.363 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccccc3O)SC2=S)cc1 15039755 CUUWXURSHKUJJU-AQTBWJFISA-N 428.535 4.021 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccc(F)cc1)C[C@@H](c1cccc(OC)c1O)N2 65298202 GFSCHOHYTHORSQ-FQEVSTJZSA-N 441.503 4.012 10 10 IICE biogenic COC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccc1 727097737 JLYKDOIHTWMXIH-XIDKLXSXSA-N 446.619 4.233 10 10 IICE Cc1c(F)cccc1-c1ccc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)o1 734556676 XEFMQSWMWZMLQS-ZHZULCJRSA-N 446.569 4.318 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H](c2c(C)nn(C)c2C)C(F)(F)F)cc1 757884773 DDRRCIVTBHDVGK-IBGZPJMESA-N 425.499 4.328 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@@H](C)C[C@H](O)C[C@H]2C)sc(C)c1-c1ccccc1 759478544 BEMWWFMCTSQPLO-JLVBRIDZSA-N 430.570 4.072 10 10 IICE CCC1(CC)CN(C(=O)c2ccccc2SCc2occc2C(=O)OC)CC[S@@]1=O 769462469 OZBDPFPFKBJNCO-PMERELPUSA-N 449.594 4.122 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc3c(c2)nc(C(F)F)n3C)cc1 798941201 WOUIFWXEDNSSOP-LJQANCHMSA-N 442.510 4.398 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(-c2cccn2C)n1C[C@H]1CCCO1 802693632 ZMKWLGUOGRWJPI-JOCHJYFZSA-N 434.588 4.089 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC(=O)NCc1cc(Cl)cc(Cl)c1O 813807877 FJQSMGWVWBLZKH-OAHLLOKOSA-N 444.359 4.288 10 10 IICE COc1cc(C)ccc1OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1124469746 ONEPVAULOWEEQY-PDGQHHTCSA-N 431.510 4.340 10 10 IICE O=C(c1ccc(NCCc2ccccn2)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 1137727567 MMGCYKNCTYXUMQ-XMMPIXPASA-N 431.536 4.263 10 10 IICE COc1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1OC(F)F 1142712874 JHTTYWQWCRFVHH-FQEVSTJZSA-N 448.510 4.113 10 10 IICE CCOC(=O)[C@@H](CC1CC1)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1154182087 DUDYDURRZGLCOK-LJQANCHMSA-N 433.346 4.318 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](Cn3ccccc3=O)c3ccccc3)c2C)cc1 1155551821 PNZJIYPGKSMBOC-RUZDIDTESA-N 441.531 4.436 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1180178525 BVIROVSEYYVHJZ-RUZDIDTESA-N 432.568 4.005 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)NCCC1=CCCCC1 1188392607 JFDOXKKLXZKFCC-UHFFFAOYSA-N 427.570 4.440 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccccc3)noc2=O)c(C)n1-c1ccc(OC(F)F)cc1 1188684895 RKFQXQPFGARJRJ-UHFFFAOYSA-N 439.418 4.395 10 10 IICE O=C(NCc1cccc(Cl)c1O)NC[C@@H](C(=O)OCc1ccccc1)c1ccccc1 1234466105 PXQCOMGTHQAJFS-HXUWFJFHSA-N 438.911 4.372 10 10 IICE CN=[S@@](C)(=O)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1272548803 WESVBIMOBGCWFC-HKBQPEDESA-N 438.597 4.133 10 10 IICE CN(C)CCSc1nc(CC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cs1 1292259025 YFICETBTSAYSAI-UHFFFAOYSA-N 446.686 4.425 10 10 IICE CC1(C)C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c2ccccc21 1294742708 TYSQHDYMHJUDKN-SFHVURJKSA-N 442.562 4.407 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1NC(=O)CC1(C)C 1295427435 JVMWHOZNHHZPJM-NRFANRHFSA-N 434.588 4.114 10 10 IICE CCOC(=O)c1noc(CSc2ncc(-c3ccc(Br)cc3)n2CC)n1 1307273666 FDORWAJAOOKSLZ-UHFFFAOYSA-N 437.319 4.185 10 10 IICE Cc1cccc([C@@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1C 1312833218 GQLYVIZZXZHIGU-QFIPXVFZSA-N 429.511 4.465 10 10 IICE C[C@@H](C[C@H](C)NC(=O)N(Cc1ccco1)Cc1ccccc1O)NC(=O)OC(C)(C)C 1312914411 OUSJYFXEEYCBNJ-IRXDYDNUSA-N 431.533 4.389 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4cccn4C)n3CCCC(C)C)CC2)cc1F 1315512225 KRSJCFRYVKQBMG-UHFFFAOYSA-N 440.567 4.194 10 10 IICE CCS(=O)(=O)c1cccc(NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 1335156314 MECJPBCSPHPRHV-UHFFFAOYSA-N 425.554 4.252 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N(C)C)c(F)c2)cc1I 1357200907 PJKGDPCWJULIHE-UHFFFAOYSA-N 426.273 4.043 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1 1446795815 BECUDPUAWNEXSR-REWPJTCUSA-N 435.568 4.410 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(F)c(S(=O)(=O)NC(C)(C)C)c1 1448435915 ISWKPKIMHPFRPM-UHFFFAOYSA-N 436.549 4.051 10 10 IICE Cc1ccc(C(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1450032310 MCSUOBZDIGENTF-QHCPKHFHSA-N 431.536 4.164 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(C)c(S(=O)(=O)NC2CCCC2)c1 1467497854 PQGSEUXUEBNUMQ-UHFFFAOYSA-N 444.597 4.364 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c(C)n1-c1ccccc1Br 1467747971 ZKCXTDICARWTFI-GIMINZRKSA-N 447.373 4.265 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(N(CC)CC)CC2)n1Cc1ccc(N(C)C)c(F)c1 1495463667 NRRCHPRAWJHWKL-GOSISDBHSA-N 430.616 4.356 10 10 IICE CC(C)c1nnc(N(C)CC2CCCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1508917579 KVNVMJJVZKVYJV-UHFFFAOYSA-N 429.584 4.442 10 10 IICE CC(C)c1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1508936894 FJEDJZGCGADYPL-UHFFFAOYSA-N 429.584 4.298 10 10 IICE CCOc1ccc([C@]2(C(=O)N[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2(Cl)Cl)cc1 1531740754 JQDBVZIBQMJIQL-VGSWGCGISA-N 449.378 4.304 10 10 IICE C[C@@H]1COc2ccccc2N1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1532846779 FBWDGAQICDZNJU-VCRXTVNUSA-N 442.537 4.231 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(-c4ccc(F)c(F)c4)n3)CC2)c(OC)c1 1534587003 LHADQYVZGHSPEV-UHFFFAOYSA-N 445.491 4.068 10 10 IICE Cc1cc(Br)cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C 1544537964 KPDPRKQDZGYJHM-UHFFFAOYSA-N 431.374 4.205 10 10 IICE Cc1cc(CNC(=O)N[C@@H](C)c2ccccc2NS(C)(=O)=O)c(C)n1-c1ccccc1 1565193124 PJJXRSPEWVODSI-KRWDZBQOSA-N 440.569 4.026 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1C 1565817818 CIXYCWLXSHOKAT-UHFFFAOYSA-N 441.528 4.235 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(NC(=O)c4cccs4)cc3)C2)cc1 1584438487 DYWHESKMIJFSLJ-QGZVFWFLSA-N 435.549 4.265 10 10 IICE CC(C)(C)OC(=O)Nc1cccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1584515405 QLSJFMSTIIGZKM-UHFFFAOYSA-N 447.482 4.078 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)c(C)n1-c1ccccc1 1588155220 VTOOJQWDXAIYAP-UHFFFAOYSA-N 435.955 4.275 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H](CC(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1596962993 CXFQCXJVTKAFBL-NRFANRHFSA-N 433.593 4.016 10 10 IICE CCCCOCCn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1614585284 RHKGNZTULNCRTJ-UHFFFAOYSA-N 441.620 4.478 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CCSC(C)C)CC2)cc1F 1619302017 GFYZNXJIDLAPJE-UHFFFAOYSA-N 433.597 4.162 10 10 IICE CCOc1ccc(N2CCN(C(=O)CN(Cc3ccccc3)c3ccccc3)CC2)cc1 1623429586 IFMVEVNXJOYGKS-UHFFFAOYSA-N 429.564 4.441 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1 1624523565 VAVRNEVQGRPONV-QHCPKHFHSA-N 435.593 4.464 10 10 IICE Cc1ccccc1C(=O)NC1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)CC1 1624595124 JTOKBTPPNWWLIO-UHFFFAOYSA-N 443.547 4.250 10 10 IICE Cc1cc(C(=O)NCc2ccnc(N3CCN(C)CC3)c2)c(C)n1-c1ccc(C(C)C)cc1 1625736281 JISYXHLMLLQSKA-UHFFFAOYSA-N 445.611 4.294 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(I)ccc2F)cc1F 1627604487 KLVSYHCAWVLNPD-UHFFFAOYSA-N 444.263 4.346 10 10 IICE CNC(=O)c1cccc(N(C)C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1 1635288298 JUZFYUGXUUUTTI-UHFFFAOYSA-N 440.341 4.493 10 10 IICE COC(=O)c1cn(-c2cccc(NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)c2)nn1 1636413163 GVSFFLBLZWSKAD-UHFFFAOYSA-N 449.898 4.367 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)N(C)C)cc1 1638917095 DFPZOYCYSGXKDD-QHCPKHFHSA-N 436.556 4.066 10 10 IICE COC(=O)c1cc(OCc2cc3c(cc2Br)OCCCO3)ccc1N(C)C 1656826282 VBGHLCYMIFLUTP-UHFFFAOYSA-N 436.302 4.042 10 10 IICE O=C(NCC(F)(F)c1cc(F)cc(F)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 1675672142 AUILDWGJJKOPAS-GOSISDBHSA-N 426.410 4.153 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)cc1F 1683307568 KANHCIVAAZDMGU-UHFFFAOYSA-N 448.542 4.209 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1695060619 DCRCPALNYYNPBO-HXUWFJFHSA-N 434.588 4.097 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCCO1 1696411662 YDWYLJWFPNSPIV-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)CC2CC(F)(F)C2)cc1F 1696607299 JJCFYEBZMWKSOV-UHFFFAOYSA-N 430.478 4.075 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC=CCC1 1706586029 NPUKAIXWPAKVKP-HXUWFJFHSA-N 436.604 4.009 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cccn(CC)c1=O 1766389309 MBRSKGMWLOQHFT-UHFFFAOYSA-N 430.556 4.039 10 10 IICE COc1ccc(OCCCOc2c(C)n(CCCOc3ccc(N)cc3)ccc2=O)cc1 1857919274 CYLWTFUAPWGHBI-UHFFFAOYSA-N 438.524 4.065 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3cc4cc(F)ccc4nc3Cl)CC2)cc1 1858099646 GWNVYHJLBBUAHI-UHFFFAOYSA-N 427.907 4.317 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)c1O 1860086917 OXJJYKHXEHONPP-SFQUDFHCSA-N 425.535 4.111 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2cccc(OC)c2)sc(C)c1-c1ccc(C)cc1 1860749175 WHHZCGJFXQRYPS-UHFFFAOYSA-N 438.505 4.404 10 10 IICE CCN1C(=O)C(NCCc2ccc(OC)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873166231 HYWVANSSNFHNJW-UHFFFAOYSA-N 443.547 4.035 10 10 IICE Oc1ccc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878709446 GTGVAUBNVLJYDN-DLBZAZTESA-N 429.280 4.307 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cc(Br)ccc1[N+](=O)[O-] 1891430380 GSRHODCFVXGXCZ-YOEHRIQHSA-N 430.302 4.276 10 10 IICE COc1ccc(Cn2nc(C3(C)CC3)c(C(F)F)c2I)c(O)c1 2079753110 ZIZTZROGYMXQPJ-UHFFFAOYSA-N 434.224 4.239 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(CCNCc2cc(Br)ccc2O)C1 2140330476 QYNAJBNMKKFTFR-YWZLYKJASA-N 425.367 4.282 10 10 IICE COc1ccc(Br)c(CN[C@@H](C)[C@H]2CCCN2C(=O)OC(C)(C)C)c1O 2271264294 GASPOEBEUJEQQJ-SWLSCSKDSA-N 429.355 4.041 10 10 IICE CCOc1cc(C=C2C(=O)N(c3cccc(C(F)(F)F)c3)N=C2C)ccc1OCC(=O)O 2297366016 IKYIWWLGOSAVDS-UHFFFAOYSA-N 448.397 4.374 10 10 IICE COc1ccc(N2N=C(c3ccccc3)C(=C(C)NCCc3ccc(O)cc3)C2=O)cc1 2313683195 UIANXQNZZACNRP-UHFFFAOYSA-N 427.504 4.258 10 10 IICE COc1ccc([N+](=O)[O-])cc1N1C(=O)C(=Cc2cccc(OC)c2OC)SC1=S 2321635419 AZBPBTSATSATCP-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CC(=O)N1c2ccc(N/N=N/c3ccc4c(c3)N(C)[C@@H](C)CC(=O)N4)cc2NC(=O)C[C@@H]1C 8755049 BUYYLRRXTCBAKH-KBPBESRZSA-N 449.515 4.048 10 10 IICE CCOC(=O)N1CCN(c2cc(NCC(C)C)c3c4c(onc24)-c2ccccc2C3=O)CC1 9641622 NGWFUROUEKWOPH-UHFFFAOYSA-N 448.523 4.386 10 10 IICE COCCN/C=C1\C(=O)N(c2nc3ccccc3s2)N=C1CSc1ccc(C)cc1 13897045 MRTAMKYVLFQVNN-LGMDPLHJSA-N 438.578 4.220 10 10 IICE COc1ccc([C@@H]2Nc3c(C(=O)NC[C@@H]4CCCO4)cccc3[C@H]3C=CC[C@H]32)cc1OC 14479449 IHMYISQGBICZFI-RGKFVRLKSA-N 434.536 4.439 10 10 IICE COCCCn1c(SCC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)n[nH]c1=O 24902375 XHJBVTVSYUAEMP-UHFFFAOYSA-N 442.585 4.114 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C\c2ccc(OCCC(C)C)c(OC)c2)SC1=S 40938040 KGYHUVJFOWFPKO-QGOAFFKASA-N 437.583 4.275 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)c3cccc(Cl)c3)CC2)c(C)n1-c1ccccc1 62694210 HSIWELPNPLYHHQ-UHFFFAOYSA-N 435.955 4.388 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCC1 249896673 HCTRFWHLEDSEDK-IEGUWTFLSA-N 426.538 4.099 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC3(CC2)C[C@H](Oc2ncccn2)CCO3)cc1 675022549 PLCPHPATCLJNKB-HSZRJFAPSA-N 446.551 4.117 10 10 IICE Cc1cc(O)c([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)c1 687753731 WEGJWXTVSVCQMB-FQEVSTJZSA-N 433.460 4.461 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc([C@@H]4CCCOC4)c3)cc2F)C[C@@H](C)O1 766367797 PPPCVAZHGBTQGU-JBYIUTFZSA-N 426.532 4.263 10 10 IICE COc1cc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc(OC)c1OC 766884794 FRLPQKULYYHCQE-UHFFFAOYSA-N 438.524 4.039 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)c1 769753033 LNTWDEKJKABWHR-QGZVFWFLSA-N 442.459 4.150 10 10 IICE C[C@H](NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccc(N2CCOCC2)cc1 779873228 IXQBVRAQWXYGLJ-AWEZNQCLSA-N 429.492 4.416 10 10 IICE C[C@H](NC(=O)Nc1cc(F)cc(Br)c1F)c1ccc(N2CCOCC2)cc1 786485792 PYVCKQDBLZQYBK-LBPRGKRZSA-N 440.288 4.447 10 10 IICE Cc1cc(C(=O)COC(=O)[C@@H]2CCNC(=O)CC2)c(C)n1-c1cc(Cl)cc(Cl)c1 815422618 NRGIKRFDCSHVHR-AWEZNQCLSA-N 437.323 4.043 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CCc3nnc(C4CC4)n3C2)cc1 815548459 YHUIGCWILOEEDS-FQEVSTJZSA-N 445.567 4.026 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nn1C(C)(C)C 917711292 FOPRKEYZXLORDD-IAGOWNOFSA-N 430.568 4.444 10 10 IICE COc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1125857216 ZWEOUIGTHFPKHV-JOCHJYFZSA-N 435.549 4.257 10 10 IICE O=C(COc1cccc(C(F)(F)F)c1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657951 NEIAXIHEXUZANH-OAHLLOKOSA-N 444.400 4.471 10 10 IICE O=C(COc1ccc(-c2ccccc2)cc1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549970 ZTQYRCDTTPVWCH-UHFFFAOYSA-N 438.474 4.164 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cnc(-c3c(F)cccc3F)s2)N(C)C)cc1 1134686217 CURFIBGUTCPAKU-GOSISDBHSA-N 430.524 4.187 10 10 IICE CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1136446778 VDYYXWHONROQFV-UHFFFAOYSA-N 428.598 4.351 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)OC(C)(C)C)c2ccnn2C)c(C)n1-c1ccc(Cl)cc1 1164516151 MIGHCQWOJDOMMV-FQEVSTJZSA-N 442.947 4.294 10 10 IICE COC(=O)/C=C/c1ccc(N2CC(Cc3ccccc3Br)C2)c([N+](=O)[O-])c1 1187224916 WTQALVLOTIBLBP-VQHVLOKHSA-N 431.286 4.222 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H](OCC)C2)sc(C)c1-c1ccccc1 1191157308 WOBHXCJWJOJUNX-SFHVURJKSA-N 430.570 4.340 10 10 IICE Cc1cc(CN2C[C@@H]3CC[C@H](C2)N3C2CCN(C(=O)OC(C)(C)C)CC2)ccc1N(C)C 1197818382 IWGNSBXZOJJQKS-ZRZAMGCNSA-N 442.648 4.109 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1253530143 IAEWYBWKUYEIRN-KRWDZBQOSA-N 428.577 4.191 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ncsc3-c3ccccc3)cc2F)C[C@H](C)O1 1264688932 DFAVXJYHPOJQFC-HOTGVXAUSA-N 425.529 4.493 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CCO1 1292355465 HWPAKPKWVDHZNC-OAQYLSRUSA-N 444.630 4.293 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)cc1 1297499314 PREHDXVSNJKPJQ-OAHLLOKOSA-N 434.283 4.081 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)c(C)n1-c1ccc(Cl)cc1 1298534730 OSDIUOFDCNSTEM-QGZVFWFLSA-N 425.891 4.422 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C23CCC3)C2CC2)cc1 1313013886 XQTLZGOFPFOPGK-OAQYLSRUSA-N 442.604 4.359 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC3(CCOCC3)C2)cc1 1313680039 RCZPMGWXEOUIKI-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC(C)c1nnc(N2CCS[C@H](C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1359726477 MYMWGOZVMDTGRE-QZTJIDSGSA-N 431.675 4.333 10 10 IICE CCOC(=O)c1sc(N(C)C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)nc1C 1435064071 HMPHFYMYUGQTJR-UHFFFAOYSA-N 441.553 4.133 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](c3ccc(Cl)cc3)N(C)C)cc2F)C[C@@H](C)O1 1441786036 POZUSQLFMOWCNG-XCGNWRKASA-N 433.955 4.012 10 10 IICE CC[C@@](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)(C(=O)OC)c1ccccc1 1449318974 PHGGMRKCKGCRNK-SANMLTNESA-N 432.520 4.423 10 10 IICE Cc1cc(C(=O)Nc2c(C(N)=O)n[nH]c2C(C)C)c(C)n1-c1ccccc1Br 1451381641 URLROAOPLPPPFF-UHFFFAOYSA-N 444.333 4.054 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1452062521 AGNMAEXRIFKUTQ-JOCHJYFZSA-N 439.556 4.421 10 10 IICE COC1CCN(c2ccc(CN3CCO[C@@H](c4cccc(OC(F)F)c4)C3)cc2)CC1 1459873543 DDQYVEDHHJZXGS-HSZRJFAPSA-N 432.511 4.477 10 10 IICE C[C@@H]1CC[C@@H](C(F)(F)F)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1459928847 DCSCQAPXWHVKDY-ZIAGYGMSSA-N 430.426 4.063 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CSCCS2)c(C)n1-c1ccccc1Br 1465650596 OPYJCNDMYQAKTQ-CQSZACIVSA-N 425.417 4.435 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(OCC(F)(F)F)c2ccccc2n1 1467841276 VQWFNACNFHXZGH-UHFFFAOYSA-N 425.403 4.297 10 10 IICE Cc1cc(CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1469643642 ZFUHYCUXSHZNTI-OAQYLSRUSA-N 426.561 4.197 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C2CC2)cc1 1469685617 RLZKTIKUYJWENG-NRFANRHFSA-N 444.938 4.025 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2 1470555102 BBAMBRCAEMBPKG-CTIGNXTNSA-N 444.620 4.223 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3nc(-c4cc(Cl)cc(Cl)c4)no3)cc2)CC1 1472879469 YZZWLEQGFLVQKX-UHFFFAOYSA-N 446.338 4.357 10 10 IICE Cc1cccc(O[C@H](C)C(=O)N2CCN(Cc3ccc(N4CCCCC4)c(C)c3)CC2)c1 1473162898 IJCFPCAXLMCMAU-HSZRJFAPSA-N 435.612 4.405 10 10 IICE CCC(CC)N1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)CC1=O 1515518088 DAPOLPNJUDKJLS-HUUCEWRRSA-N 434.602 4.414 10 10 IICE CC[C@](C)(NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C(F)(F)F 1530428152 KQJUNLCZNMLJLY-RTGRKSDTSA-N 434.480 4.264 10 10 IICE Cc1nc(-c2cccs2)c(CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)s1 1537483123 LXNKHKHISSYMFU-GOSISDBHSA-N 428.627 4.208 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2ccc(F)cc21 1538861041 SNBIAYBNRMBLBR-WQRHYEAKSA-N 430.501 4.145 10 10 IICE CC(C)c1nnc(N2CCN(CC(F)(F)F)[C@H](C)C2)n1CCCSc1nccs1 1541365730 FOMSOQURIIEEGW-CQSZACIVSA-N 448.584 4.113 10 10 IICE Cc1ccccc1Cc1nnc(N2CCO[C@@H](C)C2)n1CCCSc1nccs1 1542756749 LCFCLNNBTVDLPN-KRWDZBQOSA-N 429.615 4.041 10 10 IICE O=C(Nc1ccccc1F)Nc1cccc2c1CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1543591429 PXKMHACCVTZSNT-UHFFFAOYSA-N 435.455 4.008 10 10 IICE CC(C)OC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1544253501 VNRFYDUQPKGVOE-QFIPXVFZSA-N 447.620 4.390 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc2c(cn1)CCCC2 1544469215 YUSPJZRZUKFJAJ-WOJGMQOQSA-N 441.553 4.330 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Nc2cnccn2)c1 1545040425 DZOXKYDLJJNNII-SFHVURJKSA-N 439.466 4.220 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1548039078 XYHFBQBLRIELEH-NJYVYQBISA-N 445.583 4.023 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3nnnc3C(C)(C)C)c2C)ccc1Br 1559363318 NOHVPQKKYZITPE-UHFFFAOYSA-N 430.350 4.332 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC2(c3c(F)cccc3F)CCC2)N(C)C)cc1 1564931947 PAMPHEOGDWETHX-NRFANRHFSA-N 430.543 4.055 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1 1586317671 OTFPUWTUOFFNNQ-NRFANRHFSA-N 425.529 4.036 10 10 IICE COc1ccc(CCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1595585013 RMULXWZKGSMYNN-HXUWFJFHSA-N 446.975 4.166 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc(Br)cc3c2NC(=O)CO3)cc1 1598008085 BFLXMUIDRBKIHP-UHFFFAOYSA-N 440.297 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)CC2CCOCC2)cc1 1615379089 CDMLTQLXULJQRO-UHFFFAOYSA-N 434.588 4.097 10 10 IICE Cc1cc(CC(=O)N2CCN(c3cc(C(F)(F)F)ccn3)CC2)c(C)n1-c1ccccc1 1617162609 FOVVFZQBCPVAIF-UHFFFAOYSA-N 442.485 4.399 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(F)c(C)c1 1620562221 ZNSDZUOEXTYTFI-ROUUACIJSA-N 431.527 4.030 10 10 IICE COc1ccc([C@H](NC(=O)Cc2ccc(O)c(O)c2)c2ccccc2Cl)c(OC)c1 1628928973 YARCSQDWNHAMTB-HSZRJFAPSA-N 427.884 4.217 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C(C)=C/c1ccc(Br)o1 1637248074 YSAKXCZHMHUEBK-YRNVUSSQSA-N 442.693 4.006 10 10 IICE Cc1noc(C[C@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ccccc2)n1 1638508272 UYEVBQGUFRMDCJ-DEOSSOPVSA-N 442.519 4.241 10 10 IICE CNC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)Cc1ccc(F)cc1C 1638952932 UPZSTFPTEYRQPM-IBGZPJMESA-N 439.506 4.015 10 10 IICE COC1CCN(c2ccc(CN3CCCC[C@@H]3CNC(=O)Nc3ccccc3)cc2)CC1 1642079893 HSPFIDJKHLVXKP-XMMPIXPASA-N 436.600 4.478 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(O[C@@H](C)c4ccccc4)nc3)C2)cc1 1643351369 SEINMPSYGVSLHY-VQTJNVASSA-N 431.536 4.487 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)O[C@H](CC)C2)sc(C)c1-c1ccccc1 1653392634 ZLVDXOBEANSHPO-CRAIPNDOSA-N 430.570 4.338 10 10 IICE CN(CC(=O)NC[C@H]1CCN(c2ccccc2)C1)c1ccc(OCc2ccccc2)cc1 1654173076 VPUJJWSAKKQARA-HSZRJFAPSA-N 429.564 4.345 10 10 IICE CC(=O)c1cc(F)cc(CN[C@@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c1O 1658788509 CBMCXBMYIJMXHU-URXFXBBRSA-N 439.458 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 1682097285 PBZFJJAOVWIPFD-RBBKRZOGSA-N 448.611 4.318 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccn(C)n1 1686035270 ANYZMUBOGCOFIY-SBUREZEXSA-N 439.991 4.468 10 10 IICE CC(C)Cc1nnc(N(C)[C@@H]2CCSC2)n1Cc1ccc(N2CCSCC2)cc1 1723265976 AXHZAOIJYJGUFM-HXUWFJFHSA-N 431.675 4.020 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728921002 DWEXEZDGXHCENO-XZOQPEGZSA-N 448.615 4.403 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@]3(CCOC3)C2)cc1 1766613517 FWKJCMMGVYDWIF-RUZDIDTESA-N 425.621 4.378 10 10 IICE COc1ccccc1Cc1nnc(N2CC[C@@H](C)C2)n1CCCSc1nccs1 1768913622 AFPSNOWQJRSHKG-MRXNPFEDSA-N 429.615 4.363 10 10 IICE CC(C)Oc1cccc(/C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)c1 1858594135 MNFHHQDMIUFQFN-DYGKOUCMSA-N 427.547 4.371 10 10 IICE CCCCc1ccc(-c2cc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)nn2C)cc1 1862333012 WRZYRUHSRIHBRG-UHFFFAOYSA-N 432.568 4.401 10 10 IICE CC(C)[C@H](C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1)N1C(=O)c2ccccc2C1=O 1865901529 GOFYHJQCHPHHLB-JOCHJYFZSA-N 429.476 4.320 10 10 IICE CCCCN1C(=O)C(NCc2ccncc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164325 WOAOFCVNAPBCEN-UHFFFAOYSA-N 428.536 4.159 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C3CCC3)c(CO)c2I)cc1C 2079986192 NMKCLWLEBNWJFP-LBPRGKRZSA-N 426.298 4.179 10 10 IICE C[C@H](NCc1cccc(Br)c1O)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116250436 GXUXWECRDQAGHZ-BLLLJJGKSA-N 425.323 4.492 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)c1O 2227749713 VPDAMPIRLPGPCB-ZDUSSCGKSA-N 429.355 4.043 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1O 2236053576 WYPADIUTVIIDJX-KBPBESRZSA-N 443.382 4.289 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)c1O 2236054237 GLKAOYHUFLWRJE-OKILXGFUSA-N 443.382 4.336 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(Cc3ccccc3)C3(CCC3)C2)c1O 2236054464 IMNOJFGPBLYGPQ-KRWDZBQOSA-N 431.374 4.450 10 10 IICE COc1ccc(C=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccc(OC)cc2)cc1 2293476737 AEGFLNASTGHBPV-UHFFFAOYSA-N 429.432 4.447 10 10 IICE CC(C)NC(=O)[C@@H](C(C)C)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2297579956 ACODGNACFTUZCN-OAHLLOKOSA-N 441.416 4.200 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=C(C)NCc2ccccc2)cc1 2313682445 CNSLSJUFKRMVAJ-UHFFFAOYSA-N 442.475 4.418 10 10 IICE O=C(COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O)Nc1ccccc1F 10732753 MDENVWNAAHTRKX-UHFFFAOYSA-N 437.810 4.050 10 10 IICE Cc1cccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)c1 47152305 PULZERKSZUACNX-MFVBVHDHSA-N 427.507 4.132 10 10 IICE CCN(CC)c1ccc(CN(C[C@@H](O)COc2cccc(C=O)c2)c2ccccn2)cc1 54120901 BLXKCORWHXLHAP-XMMPIXPASA-N 433.552 4.187 10 10 IICE C[C@H](NC(=O)c1c(Br)c2ccccc2n1C)c1ccc(N2CCOCC2)cc1 109190262 VSNHLMDXLHLUIU-HNNXBMFYSA-N 442.357 4.268 10 10 IICE O=C(COc1cccc(/C=C2/SC(=S)NC2=O)c1)Nc1ccccc1C(F)(F)F 210894191 MPBUULUCOSWGBE-OQLLNIDSSA-N 438.452 4.212 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N[C@@H](c3ccccc3)c3ccncc3)cc2F)C[C@@H](C)O1 728596166 AULHVIDEYDGJHF-RRQZXNHTSA-N 448.542 4.423 10 10 IICE CCCN(C[C@@H]1CCCCO1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 730119604 XAUKRQBBRSNANF-IBGZPJMESA-N 443.510 4.033 10 10 IICE O=C(COC(=O)c1cccc(-n2cncn2)c1)Nc1ccc(N=Nc2ccccc2)cc1 734615013 BWLWINKZIXQMRN-UHFFFAOYSA-N 426.436 4.478 10 10 IICE O=C(NCc1ccc(CN2CCOCC2)cc1)N(Cc1ccccc1O)C1CCCCC1 745338913 QUJXJUPPECXVCX-UHFFFAOYSA-N 437.584 4.269 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CSc3ccc(N)cc3Cl)cc2F)C[C@H](C)O1 767204568 PEYHDXWIKFWQFL-KBPBESRZSA-N 437.968 4.083 10 10 IICE CC(C)(C)OC(=O)NC1CCC(NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 779099991 OCHUVEGCKCZKJG-UHFFFAOYSA-N 442.648 4.144 10 10 IICE CCn1c(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)nc2cc(Br)ccc21 790760386 VXHHCSQZHCVGQV-GFCCVEGCSA-N 447.333 4.093 10 10 IICE Cc1ccc(Cc2ccccn2)cc1NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 801903246 SDRNIANEXSZIJS-UHFFFAOYSA-N 448.542 4.403 10 10 IICE O=C(N[C@H]1C[C@@H]1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)OCc1ccccc1 814177173 XXEVBKGAUNDJNA-FTJBHMTQSA-N 449.595 4.050 10 10 IICE CC(=O)Nc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1F 920600118 LXFKSUUMKLYTMU-UHFFFAOYSA-N 426.419 4.370 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(-c4noc(C(F)(F)F)n4)c3)C2)cc1 1129991591 SASDUIFBWJKGDY-CQSZACIVSA-N 446.429 4.020 10 10 IICE Cc1ccc(-n2nc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c3c2CCC3)c(C)c1 1134882874 WFMHCBWQAJIVKL-RUZDIDTESA-N 445.611 4.077 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)N(C)Cc3ccc(N4CCCC4)cc3)C2)c1 1135800949 XJOHNTGZIAYGLS-JOCHJYFZSA-N 434.584 4.498 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CN2C[C@@H](C)C[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1136379365 XVBGXLIVROBBEI-XHSDSOJGSA-N 447.421 4.348 10 10 IICE O=C(/C=C/c1ccccc1)NCCCNC(=O)N(Cc1ccccc1O)C1CCCCC1 1235763028 OCSMMVVRSXUTHK-WUKNDPDISA-N 435.568 4.456 10 10 IICE C[C@@H](NC(=O)c1cnc(-c2c(F)cccc2F)s1)c1ccc(N2CCOCC2)cc1 1264822483 SGMAOXOFSVALBD-CQSZACIVSA-N 429.492 4.416 10 10 IICE C[C@@H]1Oc2ccccc2[C@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1274765373 MQMPXBDBOFXMGM-OZYZYANWSA-N 442.537 4.055 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)COc3ccc(OCc4ccccc4)cc3)C2)cc1 1276832441 UTHISIBUYWPHOE-QFIPXVFZSA-N 446.547 4.296 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCS[C@@H](C)[C@H]1C 1289424541 XTCICKBOWRXDRW-LQWHRVPQSA-N 429.634 4.273 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1295275223 KPBOBOHLLYHYCP-UHFFFAOYSA-N 431.536 4.268 10 10 IICE Cc1cc(C(=O)N2CC(=O)Nc3ccccc3C2)c(C)n1-c1cccc(Br)c1 1299939405 UMGUTUFXBZIJKV-UHFFFAOYSA-N 438.325 4.451 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cnc(C(F)(F)F)nc3)cc2Cl)C1 1312585698 JEOAKVSIGMSSKV-CYBMUJFWSA-N 441.885 4.385 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3csc(C)n3)nnc2N2CCSCC2)cc1 1313678089 CJFWUUXNWXZXEY-UHFFFAOYSA-N 442.658 4.082 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3coc4c(F)c(F)ccc34)cc2F)C[C@@H](C)O1 1355129268 DYBZCQNJHFASJI-OKILXGFUSA-N 432.442 4.323 10 10 IICE Cc1nc(SC(F)(F)F)sc1CC(=O)NCc1cccc(Br)c1O 1448962458 NZXVNAIMNLXJRT-UHFFFAOYSA-N 441.294 4.390 10 10 IICE Cc1cc(C(=O)Cn2nnc3ccccc3c2=O)c(C)n1-c1cc(Cl)cc(Cl)c1 1458825091 BPYNHIFXRHWHGS-UHFFFAOYSA-N 427.291 4.389 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4cc(Br)sc4[nH]3)CC2)cc1 1466208512 LFLIQEYSNKQHTN-UHFFFAOYSA-N 434.359 4.353 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cscn3)[C@@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1468738259 LIILTTKTGAKQOM-HNNXBMFYSA-N 442.972 4.191 10 10 IICE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1472152384 YJKVPUHAKGHINT-UHFFFAOYSA-N 431.537 4.252 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)C2CC2)cc1 1478832500 ADIAGJQHBYZCTR-OALUTQOASA-N 430.593 4.120 10 10 IICE CCC(CC)(Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1)OC 1496515247 CVBSWDCZWDERPV-UHFFFAOYSA-N 437.588 4.394 10 10 IICE Cc1c(Br)cncc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1514714168 AOTMMPCEJQTLRH-CYBMUJFWSA-N 440.288 4.153 10 10 IICE C[C@@H](Cc1ccsc1)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1515686303 JHCWDISLGKYLOK-ZDUSSCGKSA-N 434.473 4.135 10 10 IICE COc1cccc(C[C@H](C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1516814602 KVYCIQFICGDKRJ-FHWLQOOXSA-N 428.548 4.333 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1517764133 MFRCDMGEUBKKCR-FXAWDEMLSA-N 425.602 4.329 10 10 IICE CCOC(=O)c1c(NC(=O)COc2c(C)occc2=O)sc(C)c1-c1ccc(C)cc1 1524869125 FMZPYFFTPQQEEQ-UHFFFAOYSA-N 441.505 4.488 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3nc(Br)sc3C3CC3)C2)cc1 1529705894 BQCHQLVXKLREIO-GFCCVEGCSA-N 436.375 4.048 10 10 IICE Cc1cc(CCNC(=O)[C@@H](C(C)C)n2nnc(-c3ccccc3)n2)c(C)n1-c1ccccc1 1530890255 RFSFHHYVFRNUEF-XMMPIXPASA-N 442.567 4.304 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cnc1Cl 1531909033 UHXKJUNRFWDIJR-DHDCSXOGSA-N 435.933 4.413 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCSCCC(F)(F)F)C1 1532240702 KBCXUTGBVPRXNM-UHFFFAOYSA-N 427.536 4.210 10 10 IICE CCC[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccn1 1537512724 RKSNBSZLGUXZML-GXYBQNOFSA-N 443.569 4.470 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(-c4ccc(Cl)cc4)n3)CC2)c(OC)c1 1543633320 YTPCITDOTLGSJE-UHFFFAOYSA-N 443.956 4.443 10 10 IICE CC(C)=CCOc1cccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1544721651 URJIBTKOPQHZFY-UHFFFAOYSA-N 433.596 4.494 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](O)c3cc(Cl)ccc3OC)c2C)cc1 1569027235 XMUOTECNQDKCFP-NRFANRHFSA-N 428.916 4.228 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cnc(OC2CCCCC2)c(Cl)c1 1583334354 CYKPPPRMYXOWSW-UHFFFAOYSA-N 429.948 4.213 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1 1585263701 GMVBBJATJGLNBQ-INIZCTEOSA-N 437.005 4.014 10 10 IICE O=C(CN(CCC(F)(F)F)CC1CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1615788490 DYXHDDNGPJKONY-UHFFFAOYSA-N 430.426 4.065 10 10 IICE C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1 1625848206 ZFHNMCZWIIPFRI-WOJBJXKFSA-N 449.595 4.167 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cn(-c2cccc(Cl)c2F)nn1 1628873999 UPQUDCKFYOPOGF-UHFFFAOYSA-N 427.911 4.322 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C=C(\C)c3ccc(C(F)(F)F)cc3)CC2)cc1 1631442993 PJXDLHQYDIMITQ-ISLYRVAYSA-N 447.501 4.056 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1oc2ccccc2c1Br 1633795038 ZFZJNYZVHYWQLP-UHFFFAOYSA-N 429.314 4.086 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 1635673459 PQNCWQRFAQSMSZ-UHFFFAOYSA-N 435.274 4.075 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(F)c(Br)ccc3[nH]2)N(C)C)cc1 1637004906 VQOWKPVMAWHYJH-LJQANCHMSA-N 447.352 4.168 10 10 IICE CN(C)c1ccc(CNC(=O)CN(C)[C@@H]2CCSc3ccc(Br)cc32)cc1 1641803813 XLGVLOWQCKZSNK-LJQANCHMSA-N 448.430 4.300 10 10 IICE Cc1cc(CN2CCN(c3nnc(C(F)(F)F)s3)CC2)ccc1N1CCCCC1 1645331350 LULAVTDZCRVSMU-UHFFFAOYSA-N 425.524 4.178 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1nnn(C(C)(C)C)n1 1648494186 WKKSODQUFAKVQM-KRWDZBQOSA-N 446.477 4.353 10 10 IICE OC1CCN(c2ccc(CNc3ccc(Br)c(C(F)(F)F)n3)cc2)CC1 1651274259 KQBHCGLEOWQSCG-UHFFFAOYSA-N 430.268 4.436 10 10 IICE C[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1ccc(OCc2ccc(F)cc2)cc1 1653012381 VMENTGWYQWHUPV-LJQANCHMSA-N 435.543 4.438 10 10 IICE CC[C@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1655293721 XGYFLSAKZPJCJV-ATLLOTDBSA-N 445.554 4.110 10 10 IICE CN(CC(=O)N(C)[C@]1(c2ccccc2Cl)CCCCC1=O)c1ccc2c(c1)OCO2 1657830281 QUQLIHWSKMTJCA-QHCPKHFHSA-N 428.916 4.002 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(C(=O)CC(C)(C)C)CC3)cc2Cl)C1 1680563464 XTBONQSELBLXKC-GOSISDBHSA-N 449.039 4.366 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)COC)CCO1 1694919764 JVPHSGFOASNACZ-AVRDEDQJSA-N 437.588 4.250 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1709436906 HHZONVFXMNOVOV-BWKNWUBXSA-N 437.588 4.129 10 10 IICE CC(C)c1nnc(N2CCC(CN(C)C(C)C)CC2)n1Cc1ccc2c(c1)CCCN2C 1750627936 XUIXTXYSUFKAFL-UHFFFAOYSA-N 438.664 4.389 10 10 IICE CC[C@]1(C)CC[C@@H](Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)O1 1762426336 LRGSUYCNKCPNOA-YADARESESA-N 445.583 4.224 10 10 IICE CC[C@@]1(C)CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1764339407 GUIBQOSMRLLPIQ-DEOSSOPVSA-N 429.584 4.127 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](SC)C(C)(C)C 1770179046 CWXWNGAOPAPDFA-SXLOBPIMSA-N 448.633 4.122 10 10 IICE COc1cc(N2CCC(NC(=O)c3ccc(C(C)(C)C)cc3)CC2)cc(OC)c1OC 1858043977 DWAQZVLXXUXKHX-UHFFFAOYSA-N 426.557 4.409 10 10 IICE COC(=O)c1c(NC(=O)/C=C/c2cnc(N(C)C)nc2)sc(C)c1-c1ccc(C)cc1 1866153260 USXUKGFTMZZBSM-DHZHZOJOSA-N 436.537 4.326 10 10 IICE O=C(N[C@@]1(c2c(O)cccc2F)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952772867 QITJOMIKHDDKDF-CLOONOSVSA-N 433.435 4.370 10 10 IICE O=C(N[C@]1(c2cc(Cl)cc(Br)c2O)C[C@@H]1C(=O)O)OCc1ccccc1 1952821754 SBTKKBYBUNHJNT-ACJLOTCBSA-N 440.677 4.034 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1cc(O)ccc1O 1952824082 ROIUWVQTTVQKPC-YKSBVNFPSA-N 445.471 4.495 10 10 IICE Cn1ncc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)c1Br 1964558116 LRMNUUCYGJBAGC-UHFFFAOYSA-N 435.366 4.160 10 10 IICE OCc1ccc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc1Br 2153339276 SHMIRMFGLGPDDM-DHIUTWEWSA-N 427.386 4.434 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)cc1Br 2187747524 HVSYCXXDCXXFFU-PXNSSMCTSA-N 427.342 4.258 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@](C)(F)[C@@](C)(Br)C3)ccc(N)c2C1 2205660027 AMLIGALKLTZPRH-PMACEKPBSA-N 442.373 4.264 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N[C@H]2CCC[C@@H]2N=[N+]=[N-])C1 2218743785 KHHDYAFQCVQOKV-YDHSSHFGSA-N 443.548 4.178 10 10 IICE COc1ccc(Br)c(CN[C@@H](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236053894 BMLGOOCFYGQYKL-UONOGXRCSA-N 443.382 4.289 10 10 IICE Cc1ccc(OCCCn2cccc2C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1 2293308538 GSMJWMUUFJFJTE-UHFFFAOYSA-N 447.466 4.071 10 10 IICE CCCC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)Nc1ccc(Cn2cncn2)cc1 2294474361 IITSXHCSFMFIAQ-UHFFFAOYSA-N 430.512 4.224 10 10 IICE CCN1C(=O)C(=Cc2cn(CCCOc3ccccc3C)c3ccccc23)C(=O)NC1=S 2313656690 YVDKEFBHSJVCDC-UHFFFAOYSA-N 447.560 4.065 10 10 IICE Cc1ccc(CN2N=C(C(F)(F)F)C(=Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2=O)cc1 2332141198 KUHJDAWRPYNLDI-UHFFFAOYSA-N 447.369 4.019 10 10 IICE Cc1ccc(CN(C)C(=O)CCCN(C)C(=O)OC(C)(C)C)c(O)c1Br 2352671281 ISSUGDJOANHQOS-UHFFFAOYSA-N 429.355 4.069 10 10 IICE COCCNC(=O)c1cccc2c1N[C@@H](c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC=C[C@H]21 14473358 ZALBRIVEQAUVNA-IUSZMWJPSA-N 427.888 4.451 10 10 IICE CSC1=NSC2=NC(=O)/C(=C\c3ccc(OC(=O)c4cccc(C)c4)cc3)C(=N)N12 20114636 JNCFNFKPXOHTLB-HJMKZUPFSA-N 436.518 4.154 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCc2sc(C(=O)N3CCCC3)cc2C1 96398321 OUDVSTYCLXEMQX-LJQANCHMSA-N 437.609 4.006 10 10 IICE Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 109179982 FQWRFUSRZTUENS-INIZCTEOSA-N 429.586 4.369 10 10 IICE CN(C)c1ccc(CNC[C@H]2C[C@H]3CCN2C[C@H]3c2cc(-c3cccs3)nn2C)cc1 207391926 ZNFGDKGEPAAEEW-CEMLEFRQSA-N 435.641 4.182 10 10 IICE O=C(NC[C@@H]1CCCO1)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1O)[C@H]1CC=C[C@@H]21 250225172 WAVNCFHPGJQZAM-PWDLFRTRSA-N 435.480 4.036 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3c(O)cccc3Br)C[C@H]2C1 706854149 PSUQNMGFYFPUGU-KKUMJFAQSA-N 425.367 4.280 10 10 IICE COc1ccc(O)c(CNC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)c1 734014834 FBMXDSABCKBPKZ-SFHVURJKSA-N 439.339 4.169 10 10 IICE COc1ccccc1C(=O)N1[C@H](C(=O)NCc2ccc(N(C)C)cc2C)C[C@H]2CCCC[C@H]21 734401914 GKTLDGZUXFJUFH-FOVJLYNBSA-N 449.595 4.159 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCCC[C@@H]3c3cccn3C)cc2F)C[C@@H](C)O1 746758647 NPFJWTCVPMGSSN-IEGUWTFLSA-N 428.552 4.215 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)c(F)c1 748012424 JANFZEDSTOBJBY-NSHDSACASA-N 438.477 4.024 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@@H]3CCc3ccccc3)cc2)C1 760821437 QPSOUNBAXPKKFX-ILBGXUMGSA-N 448.611 4.085 10 10 IICE Cn1c(-c2cnccn2)nn(CN2CCCc3cc(OCc4ccccc4)ccc32)c1=S 766356405 SLUSGFDHYXKOPT-UHFFFAOYSA-N 444.564 4.397 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSC2CCN(C(=O)OC(C)(C)C)CC2)cc1 777776741 KUZJZKQHYKVYJM-UHFFFAOYSA-N 435.634 4.282 10 10 IICE O=S(=O)(Cc1ccccc1)Nc1ccc(NCc2cccc(Br)c2O)nc1 793303060 BZSQOLHLMWNEGI-UHFFFAOYSA-N 448.342 4.104 10 10 IICE C[C@H]1CC(CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](C)O1 801782994 DAKITQLDAIGXGH-HOTGVXAUSA-N 425.520 4.150 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cccc2c1CN(CC(F)(F)F)C2 806439285 HTUSLCKTNAGSAJ-UHFFFAOYSA-N 444.251 4.354 10 10 IICE O=C1NC(=S)N(c2ccccc2F)C(=O)/C1=C\c1ccccc1OCc1ccccc1 1084419730 NJWOTKQJBIDUTG-JXAWBTAJSA-N 432.476 4.236 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccccc2F)c(C)n1-c1cccc(Br)c1 1149550678 BGOWTTQLVIOCAC-FQEVSTJZSA-N 431.305 4.459 10 10 IICE CCCCOc1ccc(C(=O)NCC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1151152482 BFIHNFUUQWODHR-UHFFFAOYSA-N 433.552 4.319 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4cc(C)oc4C)C3=O)c2C)cc1 1165621911 UWHQQGSMPUDRDX-VWLOTQADSA-N 433.508 4.262 10 10 IICE Cc1cc(NC(=O)CN2CCCc3cc(OC(F)F)ccc32)n(-c2ccccc2F)n1 1191655741 PLSWRPZGYOYTQI-UHFFFAOYSA-N 430.430 4.313 10 10 IICE O=C(Nc1ccc(CC(=O)N2Cc3cccc(O)c3C2)cc1)c1ccc(Br)o1 1302788076 SOYOQXSMXCQVGE-UHFFFAOYSA-N 441.281 4.085 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2CC2(C)COC2)c(C)n1-c1ccccc1 1304192102 LLXPXCCCCPQETC-UHFFFAOYSA-N 429.515 4.481 10 10 IICE CCO[C@@H](CCn1c(C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C1CCCC1 1314057653 QOHPCNYCBKRSMU-DEOSSOPVSA-N 441.620 4.045 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4csc(C)n4)s3)cc2F)CC1 1360094110 QULDIWFQCPHTER-UHFFFAOYSA-N 444.601 4.391 10 10 IICE COc1c(N)c(C(=O)N(C)Cc2ccc(N(C)C)cc2)cc(Cl)c1Br 1440665361 WJYVALUDOKFUHV-UHFFFAOYSA-N 426.742 4.032 10 10 IICE CCOC(=O)c1cccc(N(CC)C(=O)/C=C\[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1441971466 RDQSFPHHYXNGFH-SWNWVQGVSA-N 430.545 4.420 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@]3(c4ccccc4)CCC(=O)NC3)cc2Cl)C1 1459574419 FOHOXYUTZWUOBV-AVRWGWEMSA-N 439.987 4.041 10 10 IICE Cc1ccc2c(c1)CCN(C(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)C2 1461030096 LHAWEINALIQWMD-MOSHPQCFSA-N 440.565 4.310 10 10 IICE CN(C)c1cc(F)cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1461322945 YAHAPUJHNASPSJ-GIJQJNRQSA-N 447.532 4.261 10 10 IICE CC[C@H]1c2ccccc2CN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1472273875 QVOSADCZDUWOJZ-SFHVURJKSA-N 428.535 4.362 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CN(C(=O)OC(C)(C)C)CC34CC4)c2C)cc1 1472372066 VICLNDMXJSQOQY-NRFANRHFSA-N 439.556 4.232 10 10 IICE Cc1cc(CN2CCc3nc[nH]c3C23CCN(C(=O)OC(C)(C)C)CC3)ccc1N(C)C 1473600428 PKAZWDVPMWJFEZ-UHFFFAOYSA-N 439.604 4.069 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)[C@@]12CCCO2 1478409309 OFQKKKDRBIHQSM-QSABTFIQSA-N 435.996 4.102 10 10 IICE C[C@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)CC(F)(F)F 1525651369 VYKWBRSYZZZHAI-LFTLCWSBSA-N 436.546 4.434 10 10 IICE COc1ccc(NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)c(S(C)(=O)=O)c1 1526276185 VIAKYWGFJIAJRO-UHFFFAOYSA-N 432.929 4.412 10 10 IICE Cc1cccc2cc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)c(Cl)nc12 1527864963 ZSNMAPBUGCKNOM-UHFFFAOYSA-N 431.870 4.241 10 10 IICE Cc1ccc(-c2nnc(N3C[C@@H](C)S[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1542316276 CBYPYXUEMLDZAA-HZPDHXFCSA-N 429.565 4.430 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1c2ccccc2C(=O)OC12CCC2 1545508724 LYJDUJDIAMYHIJ-IBGZPJMESA-N 444.325 4.380 10 10 IICE O=C(CO[C@H]1CCCc2ccccc21)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632353 IXDUUSVLQBCPNF-OFNKIYASSA-N 428.960 4.220 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2ccc(Br)cn2)cc1 1556438688 SAIICIPIBHYCRW-HNNXBMFYSA-N 440.341 4.484 10 10 IICE COc1c(F)cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(OC)c1F 1583147241 QAIOKCBLXLXZDT-UHFFFAOYSA-N 443.494 4.342 10 10 IICE Cc1cc(F)ccc1[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1611404493 IFEQTMVGELHDQV-ZDUSSCGKSA-N 432.407 4.309 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O)C(C)C 1615201299 CNOJOCBPWJBTJP-VWLOTQADSA-N 434.588 4.066 10 10 IICE CC(C)(C)OC(=O)N1CCOc2ccccc2[C@H]1C(=O)NCCCSc1nccs1 1627198748 IWXJITKWMLHCCY-KRWDZBQOSA-N 449.598 4.112 10 10 IICE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@H](OC1CCOCC1)c1ccccc1 1632094471 WWTJWYDCDXJRNY-PEBXRYMYSA-N 427.522 4.368 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCC[C@@H]2COC(=O)N2CCCC2)c1 1636141543 HMHHYQOVCZWWSO-HSZRJFAPSA-N 437.540 4.134 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4ccc(Br)cc43)C2)cc1 1636354068 PRDKSQAYSWAVFP-OAHLLOKOSA-N 430.346 4.056 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(O)cc1 1638142471 QNUQDKCNPOZWFW-JOCHJYFZSA-N 426.900 4.026 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](Cc2ccncc2)C(=O)OC(C)(C)C)c1C 1643733309 NTYGTQPMWZIAAI-QFIPXVFZSA-N 433.552 4.480 10 10 IICE CCOC(=O)[C@](C)(NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1644930489 WMYCIBYCLIKGAA-AREMUKBSSA-N 432.520 4.044 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ccc([Si](C)(C)C)cc2)cc1 1645633924 NPPVQZADLNOARL-UHFFFAOYSA-N 432.640 4.353 10 10 IICE CC(C)C[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1653919481 ZWFDKKHAYXUQKT-REHUZNOOSA-N 441.591 4.433 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](O)c2cc(F)cc(Cl)c2)c(C)n1-c1ccccc1 1674922608 CNNPNFXKOBGBKM-JOCHJYFZSA-N 429.923 4.462 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC2(Cc3cccc(Cl)c3)CC2)N(C)C)cc1 1686735215 SHHBUJDWJMDUGZ-QFIPXVFZSA-N 429.008 4.331 10 10 IICE CC(C)CCCn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 1692314545 RDMTVLLTUUQGFI-UHFFFAOYSA-N 427.574 4.048 10 10 IICE Cc1ccccc1-c1nnc(N2CC[C@@H](C)[C@@H](O)C2)n1CCCSc1nccs1 1693249996 HYFSARVUHKWOBV-AEFFLSMTSA-N 429.615 4.100 10 10 IICE CC[C@H](C)c1nnc(N2CCCC[C@H](SC)C2)n1Cc1ccc(N2CCOCC2)cc1 1726983079 WXXXBWSCWXJKFM-UGKGYDQZSA-N 443.661 4.398 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1730853577 BYILYPALTIPHDR-RTWAWAEBSA-N 441.620 4.275 10 10 IICE CC(C)[C@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1741403596 FAIODWLYUKPUHW-WIYYLYMNSA-N 447.624 4.003 10 10 IICE C[C@H]1C[C@H]1Cn1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1762764804 KCLHHVIXOUAWLN-WDSOQIARSA-N 441.576 4.348 10 10 IICE CCc1nnc(N2CCCN(c3ccccc3)CC2)n1CCCSc1nccs1 1763070775 NFZFFGMZMNRGAY-UHFFFAOYSA-N 428.631 4.196 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1C[C@@H](C1CCCCC1)N(C)C 1767112059 OHXJQTAIPZHQJU-QFIPXVFZSA-N 436.604 4.136 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4ccc(OC)c(OC)c4)nc3C)CC2)cc1 1865779248 BDWKAFZGCNMSMM-UHFFFAOYSA-N 447.535 4.045 10 10 IICE COCC[C@]1(NCc2cccc(Br)c2O)CCCN(C(=O)OC(C)(C)C)C1 2157555123 VXOOQUUVJBPULS-HXUWFJFHSA-N 443.382 4.051 10 10 IICE CCN1C(=O)C(=Cc2cc(Br)c(OC)c(Br)c2)SC1=S 2296453265 FBJBHCOQZQLEDN-UHFFFAOYSA-N 437.178 4.441 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3SC(N4C[C@H](C)O[C@H](C)C4)=NC3=O)o2)cc1 2314433842 VFYXBXWQEYPVBT-GASCZTMLSA-N 440.521 4.203 10 10 IICE CCOc1ccc(NC(=O)CN2C(=O)C(=Cc3cc(Cl)ccc3O)SC2=S)cc1 2314828712 WFSDXFSMXBYRIS-UHFFFAOYSA-N 448.953 4.284 10 10 IICE O=C(O)CCCCCN1C(=O)C(=Cc2cc(Br)ccc2O)SC1=S 2314842176 DJRAXBIVRNHBHL-UHFFFAOYSA-N 430.345 4.001 10 10 IICE Cc1ccc(CNC[C@@]23CC[C@@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352940311 DAYMHCHBWNGQIK-FOIQADDNSA-N 425.367 4.200 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3cccc(O)c3)SC2=S)cc1 15039800 VFQSDRLXUGYDNS-AQTBWJFISA-N 428.535 4.021 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC=C[C@@H]21 20706323 ZALBRIVEQAUVNA-PXARDIRTSA-N 427.888 4.451 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@H]32)cc1OC 20715269 RDMVAJCVARHDFH-IECBHUPTSA-N 440.565 4.315 10 10 IICE COC[C@]1(CNCc2cc(Br)ccc2O)CCCCN1C(=O)OC(C)(C)C 380353463 GCCNLDDXFDVKMS-HXUWFJFHSA-N 443.382 4.051 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(F)c3)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526149867 DNDUIHFRWXJPET-QFIPXVFZSA-N 437.423 4.311 10 10 IICE CC(C)NC(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 586620438 GPVNWJPWVPXUEK-UHFFFAOYSA-N 427.460 4.244 10 10 IICE COc1ccc(-c2noc(CCCN3C(=O)/C(=C/c4cccs4)SC3=S)n2)cn1 731805330 BMYYWQOJGSSDBI-UVTDQMKNSA-N 444.563 4.036 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@@H](C)CC(O)C[C@@H]2C)sc(C)c1-c1ccccc1 759478542 BEMWWFMCTSQPLO-GJZGRUSLSA-N 430.570 4.072 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(c2cccnc2)CC1 768754131 PULRRRPEAOZPOW-QGZVFWFLSA-N 439.515 4.064 10 10 IICE CCN(Cc1ccc(N2CCOCC2)cc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 769404847 QUXGZWLCZBLULZ-UHFFFAOYSA-N 437.632 4.236 10 10 IICE Cc1cc(CCNC(=O)NC2CCC(O)(c3cccnc3)CC2)c(C)n1-c1ccccc1 771294939 HVIYBJUNTWENNG-UHFFFAOYSA-N 432.568 4.161 10 10 IICE COc1ccc(O)c(CNC(=O)NCc2cc(-c3c(OC)ccc4ccccc34)no2)c1 779350854 DOTACTFRGCKVGX-UHFFFAOYSA-N 433.464 4.217 10 10 IICE COc1cc(N2CCN(Cc3cc(Cl)nc4ccccc34)CC2)cc(OC)c1OC 782543877 ILCRAINSFHCDRX-UHFFFAOYSA-N 427.932 4.236 10 10 IICE Cc1ccc(-n2cccn2)cc1NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 789404635 HLXCGKCCZVIGRN-ROUUACIJSA-N 437.519 4.255 10 10 IICE CCN1CCc2nc3ccccc3c(C(=O)NCc3cc(Br)ccc3O)c2C1 804738668 ZCRYTLVUEDDIPM-UHFFFAOYSA-N 440.341 4.011 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC([C@H](F)c2ccccc2F)CC1 804975140 GMQSIYSUJORMAU-QHCPKHFHSA-N 429.511 4.295 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccoc4)n3Cc3ccccc3)CC2)cc1 812050570 RSZGOBQSKOBZRV-UHFFFAOYSA-N 429.524 4.312 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(-c3ccccc3)on2)n1C[C@@H]1CCCO1 812267014 IQHIKUNMNPYHRR-IBGZPJMESA-N 431.496 4.121 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCc2sc(Cl)cc21 813591862 XNMRPHMDTXIYCG-LJQANCHMSA-N 434.005 4.487 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(OCc2ccc(F)cc2)cc1 1084459874 AONZLDNVYTYTSN-BKUYFWCQSA-N 434.398 4.210 10 10 IICE Cc1cc(CC(=O)NCCOc2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccc(Cl)cc1 1125943105 CGPJZZCPGPDEEI-UHFFFAOYSA-N 427.888 4.393 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC[C@H]1[C@H](C)n2nccc2N[C@@H]1C 1137350546 PNRNADQWAWHAQO-JKIFEVAISA-N 435.366 4.171 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C[C@@H](C)c2ccccc2)[C@@H](C)CO)cc1 1141612819 MRJGZRGBHROVQI-CTNGQTDRSA-N 432.564 4.462 10 10 IICE CC1CCC(OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1 1147504000 DYADBFWEYMXZBN-FBPXKMNZSA-N 433.593 4.030 10 10 IICE Cc1cc(C(=O)Cn2nnnc2-c2ccccn2)c(C)n1-c1ccc(Cl)c(Cl)c1 1188771192 OPLUUPODXGCDRG-UHFFFAOYSA-N 427.295 4.332 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3CCC3CCCCC3)cc2)CC1 1251104269 LZIKHAPTADZDAR-XMMPIXPASA-N 440.632 4.423 10 10 IICE Cc1ccc(NC(=O)CS[C@H](C)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1 1276284147 QCPWHSDIXTWOKY-RBUKOAKNSA-N 427.614 4.177 10 10 IICE CC[C@@H](C(=O)N(C)Cc1ccc(N2CCCC2)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1290374477 LMJHAPLLZRONKM-NRFANRHFSA-N 438.963 4.203 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](CN(C)CC3CC3)C2)c(C)n1-c1ccc(Br)cn1 1294386155 URUWKLNKBSRYET-SFHVURJKSA-N 445.405 4.056 10 10 IICE CSCc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1F 1295118989 RADLMCMVGJNHRP-UHFFFAOYSA-N 427.589 4.151 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC)c2ccc(OCC)cc2)sc(C(C)=O)c1C 1307568046 WRRLCECHTSMTHJ-UHFFFAOYSA-N 432.542 4.300 10 10 IICE CCN(c1nnc(C2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1313597955 KREXCWVETXTOFX-UHFFFAOYSA-N 425.621 4.427 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(C(F)(F)F)nn(CC)c3C(F)F)CC2)cc1 1324627370 QRBCXAUPANSWSI-UHFFFAOYSA-N 446.420 4.221 10 10 IICE CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1352743782 DXTZDMCLAGIUTB-HXUWFJFHSA-N 434.005 4.413 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)c(Br)cc3OC)CC2)cc1 1356447326 RSRMZRPRCZSDTD-UHFFFAOYSA-N 439.737 4.082 10 10 IICE Cc1cn2cc(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)ccc2n1 1357170099 CWUSJRGBMDHDRP-YVLHZVERSA-N 440.525 4.012 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)oc1Br 1357836239 QLQKDYXDHJTFJO-BETUJISGSA-N 425.298 4.033 10 10 IICE CC(=O)NC1CCC(N(C)c2nnc(C3CCC3)n2CCCSc2nccs2)CC1 1359413212 SNEZGXZCJNVQGT-UHFFFAOYSA-N 448.662 4.068 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccsc2)N(C)C)c(C)n1-c1ccc(Br)cn1 1441010402 YAJZNZCODJUAJU-SFHVURJKSA-N 447.402 4.346 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1449702090 NRDNXPWCCHOVJP-HUUCEWRRSA-N 446.569 4.422 10 10 IICE COc1cc(C)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 1465324421 DSVPZJLCBVBTOP-OAQYLSRUSA-N 441.572 4.374 10 10 IICE Cc1nc(-c2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)s2)cs1 1465395001 KDQDDHHPSQLMKL-UHFFFAOYSA-N 427.595 4.319 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)N(CC)Cc3cc(Br)ccc3O)cc2C1 1465850290 FHEJWTNLFIYLTI-CYBMUJFWSA-N 433.346 4.433 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccn1 1469179289 GTINDSCHYUFDGQ-APVMCDBPSA-N 429.542 4.080 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)c3c(F)ccc(O)c3O)cc2C(F)(F)F)C[C@H](C)O1 1472501779 HDIHABWQSXYHBA-QWRGUYRKSA-N 428.382 4.122 10 10 IICE CC[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1499652729 PVVHNLCOCAJBJK-WIYYLYMNSA-N 443.661 4.181 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CCCC2(C)C)cc1 1501831041 SJIDHIDOFSXGNO-UHFFFAOYSA-N 447.587 4.199 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@@H]1CCC=CO1 1503486882 GJTIWMTUXUDGLD-INIZCTEOSA-N 444.333 4.070 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCCOCC1CC1 1517143148 WFQXTNJOWTYZPC-UHFFFAOYSA-N 427.936 4.152 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3c(Cl)cccc3C(F)(F)F)c2)CC1 1532151093 MATLCNKTYLXPJS-UHFFFAOYSA-N 425.838 4.313 10 10 IICE Cc1nc(C)c(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)s1 1537251822 UCVFIDXFYVIKCV-UHFFFAOYSA-N 442.342 4.413 10 10 IICE CCCCOCCN(C(=O)/C=C\c1cnc(OC)nc1)c1ccc(Br)cc1 1538954794 VWHHKQFWRKRARL-YHYXMXQVSA-N 434.334 4.111 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC[C@H]1CCCO1 1547325722 XZXBTYKBOIHKIA-JOCHJYFZSA-N 437.588 4.394 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1ccccc1S(=O)(=O)NC(C)(C)C 1597706301 DYCHPGNHXLKGHY-UHFFFAOYSA-N 445.610 4.162 10 10 IICE C[C@@H]1CN(C(=O)CSc2ncc(-c3ccccc3)n2Cc2ccco2)CC(C)(C)O1 1613438298 OYZOMMVINBQECS-QGZVFWFLSA-N 425.554 4.309 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C[C@H](C)O1 1614232977 FOIXPUAQTSKGKD-IRXDYDNUSA-N 444.630 4.291 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](C)C1 1615091413 QXRZSULPFQYVPL-MOPGFXCFSA-N 448.615 4.313 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3cccc(Cl)c3)cc2F)C[C@@H](C)O1 1616714081 IEDRRXZHEMYACZ-CALCHBBNSA-N 447.982 4.234 10 10 IICE COC[C@@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1619701139 DIGCAYPNZQRVLB-HXUWFJFHSA-N 439.629 4.216 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)CN1CCCC1 1620117355 AMSUZJJTZIERJP-UHFFFAOYSA-N 436.604 4.472 10 10 IICE CCO[C@@H]1C[C@](NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)(C(=O)OC)C1(C)C 1625393109 KWFPWGOEPSHNIR-BWKNWUBXSA-N 426.557 4.188 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](O)c3cccc(Br)c3)c2C)cc1 1626015699 GGWDQTVJDCWACK-NRFANRHFSA-N 443.341 4.329 10 10 IICE Cc1cc(C(=O)N2CCN(C)CC23CCCCC3)c(C)n1-c1ccc(Br)cn1 1628795939 WKWUKFDUCQZDPL-UHFFFAOYSA-N 445.405 4.342 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCOc1ccc(C)cc1Cl 1631531553 VBMWVHRVEHRRSW-UHFFFAOYSA-N 440.323 4.368 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1631683959 BTGVJACCRXCSCB-HXUWFJFHSA-N 427.976 4.340 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)oc2ccc(Br)cc12 1633789314 HGMFXMNIOXQLJE-UHFFFAOYSA-N 443.341 4.395 10 10 IICE O=C(NCc1c(O)cccc1O)c1cccnc1Sc1ccc(Br)cc1 1639289794 WQKOAZXQKPQOLZ-UHFFFAOYSA-N 431.311 4.337 10 10 IICE COC(=O)/C=C\c1ccc(N2CCCC[C@@H]2c2ncc(Br)cn2)c([N+](=O)[O-])c1 1652248685 LGLSPQWLEKGZAC-QKIRZYONSA-N 447.289 4.065 10 10 IICE CCOc1ccc(CN(C[C@H](C)CS(C)(=O)=O)c2ccc(OC)c(Cl)c2)cc1 1652862029 PWEIPZJVRISKSN-INIZCTEOSA-N 425.978 4.435 10 10 IICE COC(=O)[C@H](c1cccc(Cl)c1Cl)N1CCN(c2ccc(OC)c(F)c2)CC1 1657763463 HZTLIZIPVCERCN-IBGZPJMESA-N 427.303 4.177 10 10 IICE CC(C)CC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)(C)C 1657953495 XIJFYLRCVIBQQI-SELNLUPBSA-N 435.628 4.496 10 10 IICE COC1CCN(c2ccc(CN[C@](C)(CO)Cc3ccc(Br)cc3)cc2)CC1 1660390105 XLCJOIYJCUKOKR-QHCPKHFHSA-N 447.417 4.148 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c(C)n1-c1ccccc1 1683149631 SKEKGFTZPXNZBT-QHCPKHFHSA-N 425.960 4.193 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694803826 IYXNGEUSYILQRW-NQIIRXRSSA-N 429.584 4.125 10 10 IICE CC[C@@H](C)[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1)OC 1763437414 NFLBJHHHZNDFSF-JPYJTQIMSA-N 437.588 4.250 10 10 IICE CCCN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1764257261 PKAVJROBNDRJND-UHFFFAOYSA-N 435.620 4.271 10 10 IICE CC(C)(C)NC[C@@H](O[C@H](CNC(C)(C)C)c1ccc(O)c(O)c1)c1ccc(O)c(O)c1 1848439009 MTOMWRDVPFYJDM-FGZHOGPDSA-N 432.561 4.084 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)c1ccc(C)cc1 1857996841 JJRJEPCOWXLKHR-UHFFFAOYSA-N 429.473 4.418 10 10 IICE CCN(CC)CCn1cc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)c2ccccc21 1860826172 BUMBPHUAPYRSPT-XMHGGMMESA-N 445.610 4.049 10 10 IICE Cc1ccc2nc3c(c(C(=O)N[C@H](c4ccc(N(C)C)cc4)c4nccn4C)c2c1)CCC3 1866276014 UTVGYKLDSNJCSL-RUZDIDTESA-N 439.563 4.351 10 10 IICE O=C(NOCCCNCc1cccc(O)c1O)OCC1c2ccccc2-c2ccccc21 1928760578 QHTYPXHZPCJMIJ-UHFFFAOYSA-N 434.492 4.048 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1ccc(O)c(O)c1 1952824462 BNFPPMNSVJBPMO-RDPSFJRHSA-N 445.471 4.495 10 10 IICE Cc1cc(C=C2SC(N3CCOCC3)=NC2=O)c(C)n1-c1cccc(C(F)(F)F)c1 2040476035 TTWJFBUJJRJZQI-UHFFFAOYSA-N 435.471 4.415 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(CNCc2cc(Br)cc(F)c2O)CC1 2098265336 GZHRYNHLZGRQBE-UHFFFAOYSA-N 435.309 4.123 10 10 IICE C[C@H](O)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)c(Br)c1 2144883997 FMZXQAVBUGEMFE-SFHVURJKSA-N 433.390 4.231 10 10 IICE CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1OC)c1cc(Br)ccc1O 2146729550 XMPFRXZKUKWLNR-JZXOWHBKSA-N 443.382 4.220 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc(C)n(-c4cccc(F)c4)c3C)C(=O)NC2=S)cc1 2294235472 VXWCLHAHSSSGDM-UHFFFAOYSA-N 449.507 4.073 10 10 IICE CC1=NN(c2ccc(C(=O)O)cc2)C(=O)C1=Cc1ccc(-c2ccc3c(c2)COC3=O)o1 2297302844 ZDHXDELNGINRKE-UHFFFAOYSA-N 428.400 4.121 10 10 IICE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1cccc(Cl)c1C 2313682975 OUDZWNUKLSMRSV-UHFFFAOYSA-N 442.859 4.208 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N([C@@H]2CC(=O)N(c3cccc(C)c3)C2=O)C1=O 2314833767 VQIDPVVZENGYDS-LJQANCHMSA-N 448.569 4.475 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC(C)(C)N2C(=O)OC(C)(C)C)c(O)c1Br 2381131275 LLXQQWVSOBOTND-CQSZACIVSA-N 441.366 4.257 10 10 IICE O=C(O)c1cc(C(=O)O)cc(N2C(=O)/C(=C/c3c(F)cccc3Cl)SC2=S)c1 39861786 OKDGJXMNTAGDPI-AUWJEWJLSA-N 437.857 4.281 10 10 IICE COc1cc(/C=C2\SC(=S)N(NC(C)=O)C2=O)ccc1OCc1ccccc1Cl 40846786 HSMHVOCIRRRBMD-ZDLGFXPLSA-N 448.953 4.180 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(NC(=O)c3cccc(Cl)c3)C2=O)ccc1OC 40940154 UJTIHTFIZMNSLU-YVLHZVERSA-N 448.953 4.294 10 10 IICE CCCNC(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 586625891 YXFYREDOZGNKAD-UHFFFAOYSA-N 427.460 4.246 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@]2(NCc2cc(Br)cc(F)c2O)C1 715736264 HFSOPBPCPHTCNY-BFUOFWGJSA-N 429.330 4.173 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@H]1C[C@H]1C1CCCCC1 743554426 DTPGPBIDZQYNNA-ICSRJNTNSA-N 425.495 4.310 10 10 IICE CC[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C)nn(C)c1C 743695162 VIXRXGYCBVFUNA-APWZRJJASA-N 435.519 4.058 10 10 IICE COc1ccc(C)cc1-c1csc(NS(=O)(=O)c2ccccc2Cn2ccnc2)n1 759483131 IIBBHROLAKAEHA-UHFFFAOYSA-N 440.550 4.173 10 10 IICE COc1cc(NS(=O)(=O)c2csc(-c3ccc(Br)cc3)n2)ccc1O 797820290 PFQSTTNPKKBBRQ-UHFFFAOYSA-N 441.328 4.088 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3cc(F)cc(Br)c3)CC2)cc1 918019233 ZGNHLDIMRZKBHM-UHFFFAOYSA-N 436.325 4.019 10 10 IICE COc1ccc(Oc2ccc(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)nc2)cc1 1130185927 WNDQHKFXDKQZQZ-SFHVURJKSA-N 433.508 4.147 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc(Br)nc2O)cc1 1141518385 LRLXUGDDXJIZJV-UHFFFAOYSA-N 430.302 4.051 10 10 IICE CCOC(=O)C1(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CCCCC1 1141821509 XGYAQOJCHDUJBA-UHFFFAOYSA-N 448.361 4.247 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1162114539 NMXMFVZVURUTQR-VGOFRKELSA-N 441.572 4.236 10 10 IICE COc1ccc(N(Cc2ccccc2)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1OC 1177022621 RKPPWZJAMGYWOQ-OAQYLSRUSA-N 442.556 4.346 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)N1CCO[C@@H](c2ccc(F)cc2)C1 1191712186 SIAJIMJWICEXMG-HXUWFJFHSA-N 438.421 4.077 10 10 IICE C[C@@H]1CC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)CN1C(=O)OC(C)(C)C 1253921161 OMVZBRBXCJGHBY-MJGOQNOKSA-N 443.544 4.485 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccc(CN3CCCC3)c2)cc1 1290813499 BIWQNGAWXWIXTA-UHFFFAOYSA-N 429.564 4.361 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn3c2N[C@H](C)C[C@@H]3C(F)(F)F)cc1F 1293225495 WWXFUYRJVSMLJB-SJKOYZFVSA-N 427.446 4.106 10 10 IICE CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1295352845 NVFGMUYVFWQEBS-MRXNPFEDSA-N 433.346 4.272 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1296026063 AAIYXBJURZNCGE-QGZVFWFLSA-N 431.920 4.483 10 10 IICE Cc1cc(CC(=O)N(C[C@H](O)CC(C)(C)C)C2CCN(C)CC2)c(C)n1-c1ccccc1 1297761776 CERNWVMHCSGADP-RUZDIDTESA-N 439.644 4.357 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cccc(Oc4ccc(F)cc4)n3)C2)cc1 1312966560 GEHRFKVOGGPGOP-LJQANCHMSA-N 436.487 4.100 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCCc4c(OCC(N)=O)cccc43)c2C)c1 1449941515 PWZJTMJGIWUNFA-UHFFFAOYSA-N 431.536 4.168 10 10 IICE C[C@H]1CC[C@H](C(F)(F)F)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1459928838 DCSCQAPXWHVKDY-KBPBESRZSA-N 430.426 4.063 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cn3cnc4sc(C)c(C)c4c3=O)c2C)c1 1462084945 YQBBTXCKIPZSGT-UHFFFAOYSA-N 434.565 4.107 10 10 IICE Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc3cc(O)c(O)cc3s2)c(C)c1 1464804166 HSUYFUGVDUQJBM-OAHLLOKOSA-N 428.535 4.083 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H]1CCc2ccc(O)cc21 1470248135 FBEDUQLMJDRIBU-BOFQVRIASA-N 444.603 4.239 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@H]2CC)n1Cc1ccc(N(C)C)cc1C 1496812353 NFRWKILFSPMSDB-HTAPYJJXSA-N 440.636 4.244 10 10 IICE CCCN(C)c1nnc(C(=O)NC(CC)CC)n1Cc1ccc(N2CCC(C)CC2)cc1 1514556696 ANAQCHOXXNOFOB-UHFFFAOYSA-N 440.636 4.327 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N2CCCC[C@H](COC)C2)cc1 1515526315 GCKZUGBXXQTZHY-QFIPXVFZSA-N 425.621 4.378 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2C[C@H](C)O[C@@H](C)C2)cc1 1515532871 SYLXQXDQRCUNJR-IPJJNNNSSA-N 427.593 4.028 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3sc(-c4ccc(F)c(F)c4)nc3C)C2)cc1 1531730527 ZTSVTCKAQHFVAA-OAHLLOKOSA-N 429.492 4.414 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1csc([N+](=O)[O-])c1 1538920681 UXPUZMBMDPZYID-UHFFFAOYSA-N 444.270 4.381 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CSCc2coc(-c3ccccc3)n2)N(C)C)cc1 1539705837 HWOKYUZIYWUGRG-QFIPXVFZSA-N 438.597 4.060 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541792183 OMFDRWVAIWTQTO-WMZOPIPTSA-N 427.524 4.216 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1C[C@H](C)O[C@H](C)C1 1543645829 USEGLLXXJWEJJG-VTYHHJSWSA-N 441.620 4.078 10 10 IICE CCCN(CC)CCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1547122721 GVENGLQMOCNIDH-UHFFFAOYSA-N 442.652 4.033 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2cnn(C)c2C)cc1 1547446939 KYRDNBUJMMYPPK-UHFFFAOYSA-N 437.636 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1547449438 WUJGDUGEOKFMAS-XMMPIXPASA-N 448.615 4.020 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)cc2Cl)C1 1556369456 NWQHBBZSVZHPDJ-SZMVWBNQSA-N 435.996 4.496 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cc1 1558607676 YBEWJZYWNUTEMY-UXHICEINSA-N 447.373 4.267 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](NC(=O)c1cc(C)ccc1-n1c(C)ccc1C)CCS2 1558718109 XZUPRWBDBOJBDG-SZTYLXMGSA-N 426.582 4.350 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@@H](CC(C)(C)C)c3ccc(F)cc3)CC2)cc1F 1559642507 RZOOXYQIPMPYEE-QFIPXVFZSA-N 445.554 4.389 10 10 IICE Cc1cc(C(=O)N[C@@H]2CN(c3ccccc3)C2=O)c(C)n1-c1cccc(Br)c1 1567495883 TXMJHRONSFNLLP-HXUWFJFHSA-N 438.325 4.002 10 10 IICE CC(C)(C)[S@@](C)(=O)=NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1584721473 BQGDFQYDVPKBER-HEAKDJBOSA-N 430.642 4.152 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccc(NC(=O)c3ccc(Br)o3)cc2)c1 1584983074 BPLYSHKJFVJHIT-UHFFFAOYSA-N 429.270 4.238 10 10 IICE CCCCc1cnc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)nc1 1587292078 FGSSWIJXRCPBQH-BOPFTXTBSA-N 444.557 4.188 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)CCN2CCN(c3cccc(Cl)c3)CC2)cc1 1587459846 JLPGZTFFJLWFOK-UHFFFAOYSA-N 443.035 4.357 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CC=CCC2)CCOC1 1610362213 WVFJXMQJADSXAB-YADARESESA-N 426.561 4.017 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1614266494 MHBXROHVFIUDSY-STZQEDGTSA-N 427.593 4.028 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CCCO1 1617127512 ZLCWLADPQPJDJP-VWLOTQADSA-N 437.588 4.394 10 10 IICE Cc1cc(CN2CCC([C@@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)CC2)ccc1N(C)C 1618529677 UCRYJYZYIDIZMX-GMAHTHKFSA-N 431.621 4.345 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1623946994 DMQRXXXBHFESBC-CYFREDJKSA-N 446.547 4.365 10 10 IICE Cc1ccc(N2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)cc1C 1624538496 BZXKPUWXVNBIKX-UHFFFAOYSA-N 429.564 4.415 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(O)ncc2Br)cc1 1625344984 DVGLMQNPIFLYSJ-UHFFFAOYSA-N 430.302 4.051 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)CCCN(C)C(=O)OC(C)(C)C)ccc21 1630036289 PIAHCNZYAZIMKO-UHFFFAOYSA-N 431.577 4.234 10 10 IICE CC(C)(COCc1ccccc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630262832 PZRZEJGAHTZQSK-OAQYLSRUSA-N 430.976 4.369 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(Cl)c(Cl)c1 1644590917 VCMSJEVKYUCTJK-ACJLOTCBSA-N 427.715 4.188 10 10 IICE COC(=O)/C=C/c1ccc(N2CCCC[C@H]2CN(C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1655862183 MNGDUSRTASHDHT-JICACKBISA-N 433.505 4.007 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(OCc4ccccc4F)cc3)C2)cc1 1679863726 HDNURTVIFAMVNR-OAQYLSRUSA-N 449.526 4.491 10 10 IICE CCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1CCN([C@H](C)c2ccccc2)C1 1683944869 LORKDODGZUSYPA-BKULYWANSA-N 436.600 4.141 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@@]3(C)Cc3ccccc3Cl)cc2)CC1 1684878770 ZOEMBYMGBVRENZ-VWLOTQADSA-N 441.019 4.399 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](NC(=O)N(C)Cc1ccc(N3CCCCC3)cc1)CCS2 1687794345 BVKQMKDUVVWPHF-VIHQBZHPSA-N 445.629 4.036 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCOC(C)C)n1 1693179643 ZXMRTFUQNIJRCW-UHFFFAOYSA-N 434.588 4.310 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C(C)C)C1 1697994990 GEBNZLAGDOAUOR-QHCPKHFHSA-N 437.588 4.250 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccco3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1724199311 UKSMUVKUFWZCNR-UHFFFAOYSA-N 446.555 4.107 10 10 IICE CCc1nnc(N2CCN([C@H](C)c3ccsc3)CC2)n1Cc1ccc(N(C)C)cc1C 1727601707 KEBVIIIXMVKQHD-LJQANCHMSA-N 438.645 4.208 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1727699632 SKZIGEIGWKCBQR-DKOYFPBOSA-N 441.620 4.050 10 10 IICE CO[C@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC1(C)C 1730388773 KTKLNMDGUJIJIM-INIZCTEOSA-N 433.603 4.347 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(=O)NC)CC1 1763607037 ROMVJFVEIMSRHN-UXBLZVDNSA-N 446.599 4.281 10 10 IICE Cc1c(OCc2ccc(Br)cc2F)c(=O)ccn1CCOc1ccc(N)cc1 1857919551 LLDVSWLFLASXCD-UHFFFAOYSA-N 447.304 4.299 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2Br)N2CCCCC2)cc1 1858074118 DZWYCJBFTIXBSL-NRFANRHFSA-N 430.390 4.472 10 10 IICE Nc1ccc(Cc2ccc(NC(=O)COc3ccc4c5c(c(=O)oc4c3)CCC5)cc2)cc1 1865917646 XUQCKDHUQXHIMN-UHFFFAOYSA-N 440.499 4.472 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cccc(Br)c2O)C[C@H]1C1CC1 1895874235 LOVLOYDXEQUZJQ-RDJZCZTQSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@H](NCc2ccc(Br)cc2O)C1 1967845439 KCFNZZOVRGQXMK-QGZVFWFLSA-N 425.367 4.424 10 10 IICE CCN(CC)c1ccc(C=C2SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 2297291908 NIPRUXCQLDKAPV-UHFFFAOYSA-N 441.578 4.088 10 10 IICE O=C(O)CN1C(=O)C(=Cc2cn(Cc3ccccc3F)c3ccccc23)SC1=S 2297350875 QQLNOBPXLXWNPV-UHFFFAOYSA-N 426.494 4.115 10 10 IICE CCN1C(=O)/C(=C\c2c(NC3CCC(C)CC3)nc3ccc(C)cn3c2=O)SC1=S 33457683 PYVZFJPPTWTPRD-GZTJUZNOSA-N 442.610 4.215 10 10 IICE CCCCCN1C(=O)/C(=C/c2c(N3CCCCC3)nc3ccccn3c2=O)SC1=S 33468498 DRISZKNJQGSWKZ-ICFOKQHNSA-N 442.610 4.076 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(-n3cncn3)c2)cc1 303734277 VXRBGSZKOWPUBN-UHFFFAOYSA-N 427.508 4.189 10 10 IICE CC(=O)Nc1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1Cl 748091957 SZPZILFFHFCUNH-UHFFFAOYSA-N 425.894 4.362 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3F)cs2)c(C)cc1F 794015374 CQVFPKTZAGWNRI-UHFFFAOYSA-N 442.440 4.123 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@H]2C(=O)Nc3c(Br)cccc32)cc1 1125235851 WCYYYEAOQXGLBJ-QGZVFWFLSA-N 430.346 4.038 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)c(C)n1-c1ccccc1 1127294501 GUCZGZRKFAOEJT-GOSISDBHSA-N 439.918 4.351 10 10 IICE CC[C@@H](CSC)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1127579545 QNZFHRHOUWLXMR-KFXIKWRMSA-N 426.604 4.017 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccsc1 1132426940 UBSXZVASWCNNET-OAAAUBHFSA-N 432.567 4.151 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(CN2C(=O)CCC2=O)cc1 1137816772 QXRWOPSRRCRWLV-LJQANCHMSA-N 442.515 4.445 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1138558131 ZFHUAAIAYVVPIX-DEOSSOPVSA-N 432.520 4.153 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@@H](C)C[C@H](C(=O)OC(C)(C)C)C2)cc1 1162149130 ORKUDPWUJFNABC-UWJYYQICSA-N 438.568 4.275 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CNC(=O)c3cnc(Cl)c(Cl)c3)c2C)c1 1170857042 FPTZZNHYEFHYSW-UHFFFAOYSA-N 445.350 4.151 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCc2ccccc2CN(C)C(=O)OC(C)(C)C)c1 1230627865 CXFNEOXIJCZKBY-MRXNPFEDSA-N 443.544 4.328 10 10 IICE Cc1cc(CC(=O)N2CCN(c3ccnc(F)c3)CC2)c(C)n1-c1ccc(Cl)cc1 1273060586 WOGLCJAZMKURSR-UHFFFAOYSA-N 426.923 4.173 10 10 IICE Cc1cc(CNC(=O)[C@H]2C[C@@H](NC(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1287661500 RFSBATSMMGDWTA-DKXQDJALSA-N 431.536 4.415 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860482 UGKCCWDHTDOXAO-HNNXBMFYSA-N 435.933 4.070 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(F)cc(C(F)(F)F)c1 1356419911 DUPFGXTVOKCYGA-UHFFFAOYSA-N 435.465 4.307 10 10 IICE O=C(/C=C\c1ccccc1OC(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436624948 VKFDSLDZWYJQGN-WAYWQWQTSA-N 442.384 4.030 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(\C)c3cccc(C(F)(F)F)c3)CC2)c(OC)c1 1438186984 MLIPBAGVVHPRGA-DTQAZKPQSA-N 434.458 4.475 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2C[C@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1452525151 SVAUEFQCDRNHFV-YESZJQIVSA-N 448.405 4.084 10 10 IICE C[C@@H]1C[C@H](C(F)(F)F)n2ncc(C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)c2N1 1463784082 IWJSWLMIQTVHTI-DNVCBOLYSA-N 435.494 4.453 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c[nH]c4cccc(Br)c34)C2)cc1 1469280868 SJQLDPWFOUDTRC-CQSZACIVSA-N 428.330 4.195 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(c3cccc(Br)c3)CC2)cc1 1473422012 LAMIYOORBABTOO-UHFFFAOYSA-N 430.390 4.011 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)[C@@H](C)C2)n1Cc1ccc(N(CC)CC)cc1 1496764708 WSGVNCUYXZPTFI-KDURUIRLSA-N 440.636 4.183 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3c(Cl)cccc3Br)c2)CC1 1522407267 UFUMQFALZQOBDE-UHFFFAOYSA-N 436.737 4.023 10 10 IICE C[C@H](C1CC1)n1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1524167087 FBVABDMZVVKNQE-CCOVPTLTSA-N 444.557 4.223 10 10 IICE C[C@@H](CSC(F)(F)F)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527246183 RURMLTYZLJLVDA-NSHDSACASA-N 430.414 4.047 10 10 IICE C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NCc1ccc(N(C)C)c(F)c1 1535619149 LMMPPPKSCAXYNH-LLVKDONJSA-N 429.717 4.391 10 10 IICE CCCCNc1nc(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cs1 1542704034 MYIKOKCAIRCOMA-UHFFFAOYSA-N 438.544 4.284 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1545321716 SXKYHTLAGURVGQ-HXUWFJFHSA-N 440.636 4.037 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCc1ccco1 1547084256 ZBPSSRBGFIBPKA-UHFFFAOYSA-N 446.555 4.108 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C)nc4cc(Br)ccc34)C2)cc1 1585990152 WSHUMCFMNKCQGN-MRXNPFEDSA-N 440.341 4.323 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3sccc3-c3ccc(F)cc3)cc2)CC1 1598008846 HJYPYFNYKDEBKB-UHFFFAOYSA-N 437.540 4.186 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C[C@@H](C)O1 1614232976 FOIXPUAQTSKGKD-IAGOWNOFSA-N 444.630 4.291 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)N(C)C)cc1 1618635685 KTKCWQPDGQPQQM-DEOSSOPVSA-N 447.539 4.437 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(CC2CC2)n1Cc1ccc(N2CCSCC2)cc1 1620266795 IWKYJGIYINPGAD-GOSISDBHSA-N 445.702 4.410 10 10 IICE Brc1cc(CNCc2ncnn2-c2ccccc2)ccc1N1CCCCC1 1620921010 KDRFQZXFDQUSFZ-UHFFFAOYSA-N 426.362 4.310 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1c1cccc(Cl)c1 1625684740 YDGGSVNBNIYSFG-RHSMWYFYSA-N 427.715 4.188 10 10 IICE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NCc1ccc(N2CCSCC2)cc1 1625969510 CZVJOTLRFQHDKL-HXUWFJFHSA-N 449.661 4.432 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)c1cccc(C(=O)c2ccccc2)c1 1627013606 GZQYNJXTJWEDCK-IBGZPJMESA-N 445.515 4.319 10 10 IICE Cc1cc(CC(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1631683958 BTGVJACCRXCSCB-FQEVSTJZSA-N 427.976 4.340 10 10 IICE C[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@H]1CCNC(=O)OC(C)(C)C 1632029245 NPSOXDNFEHJWOK-HIFRSBDPSA-N 434.558 4.468 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N[C@H](C)C(C)C)c(C)n1-c1cccc(Cl)c1 1633273774 OIEDUBYMFMLWMI-QRWLVFNGSA-N 434.005 4.423 10 10 IICE COC(=O)c1cn(-c2cccc(NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)c2)nn1 1635288463 BEZOPRWAPUQBGI-UHFFFAOYSA-N 443.507 4.331 10 10 IICE O=C(NCCc1c[nH]c2c(Cl)cccc12)N(Cc1ccccc1O)C[C@@H]1CCCO1 1637394501 OCGQZRMQJSJSKV-SFHVURJKSA-N 427.932 4.460 10 10 IICE COC(=O)c1cnc(SC[C@H](CNC(=O)OC(C)(C)C)c2ccc(OC)cc2)s1 1652002186 HURNKMXTAAWQCC-AWEZNQCLSA-N 438.571 4.339 10 10 IICE CN(C)c1ccc(CN(C(=O)N2C3CCC2(CNC(=O)OC(C)(C)C)CC3)C2CC2)cc1 1675075458 XSMUNRHVBKFBON-UHFFFAOYSA-N 442.604 4.359 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1685103480 WFUQDIIOEDOPNR-VWPQPMDRSA-N 444.620 4.461 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)NCc3cc(Cl)cc(Cl)c3O)C2)cc1C 1686234572 HEEMQYCQWFLUPP-OAHLLOKOSA-N 438.311 4.008 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC([C@H]4CCOC4)CC3)nnc2C(C)(C)C)cc1F 1696611202 WDSXCEVCEPPZAE-IBGZPJMESA-N 429.584 4.082 10 10 IICE C[C@@H](Cc1cccs1)Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1761372198 JZESPXQAMRJGIO-PKOBYXMFSA-N 426.586 4.454 10 10 IICE CCCCCN1C(=O)C(NC[C@@H]2CCCO2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873166623 UABJBAMOKNDSSF-QFIPXVFZSA-N 435.568 4.133 10 10 IICE CCCc1cc(-c2nc(CC(=O)N3CCN(c4ccc(OC)cc4)CC3)cs2)ccn1 1873831679 BEKWCVJDHOPMBI-UHFFFAOYSA-N 436.581 4.058 10 10 IICE O=C(O)C[C@@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc(O)c1O 1951420565 NSTUZJDGJRUZFG-HNNXBMFYSA-N 433.460 4.195 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2CCC2)c(CO)c1I 2079005868 REDUVYCOLJTOIH-HNNXBMFYSA-N 426.298 4.261 10 10 IICE COc1ccc(O)c(Cn2nc(C(C)(C)C)c(C(F)F)c2I)c1 2079770810 AGTPNDCUAWTXTM-UHFFFAOYSA-N 436.240 4.485 10 10 IICE NCc1ccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(F)c1Br 2148937721 ZOTWUZFNMZEIRA-HKUYNNGSSA-N 432.381 4.395 10 10 IICE CCOC(=O)c1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccco3)SC2=S)cc1 2296808061 OPWGAXRLWLJCDD-UHFFFAOYSA-N 444.534 4.076 10 10 IICE CC[C@H]1CCCCN1C(=O)CCCN1C(=O)C(=Cc2cccc(OC)c2)SC1=S 2297554715 URULGDFWBHEZNU-KRWDZBQOSA-N 432.611 4.468 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(N(C)C)cc2)SC1=S 2314768907 MLZGIBLYLZVHDM-IBGZPJMESA-N 426.563 4.258 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1c[nH]c3ccccc13)N2 14545096 BMMHOFXNJOFTPA-CGSFFBPTSA-N 449.576 4.452 10 10 IICE Cc1ccc(C)c(S(=O)(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c1 17026507 NHTYOULLGQNBTG-RUZDIDTESA-N 449.620 4.452 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4cccc(C(F)(F)F)c4)c3C)CC2)cc1 105569813 BYQMREFGUQIOKO-UHFFFAOYSA-N 444.457 4.171 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccc(F)c(F)c3)CC2)c(C)n1-c1ccc(F)cc1 105904958 FAVYROFPNVVQJU-UHFFFAOYSA-N 441.453 4.110 10 10 IICE CC(C)c1cc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c2cnn(C(C)C)c2n1 109179704 XOIOIWSOQPJTIF-SFHVURJKSA-N 435.572 4.463 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526175986 NKSJAECHIYVRDV-JOCHJYFZSA-N 437.423 4.311 10 10 IICE CC[S@@](=O)CCNC(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 735108825 DLOQCVCIDJXGIS-YVGXBJCXSA-N 441.519 4.250 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)N[C@H]1CCC(=O)N(C)C1 738500550 OQQFAXWDFVCREM-LPHOPBHVSA-N 448.489 4.102 10 10 IICE CC1CCN(C(=O)c2ccc(NCc3ccc(N4CCN(CC5CC5)CC4)cc3)nc2)CC1 768527144 BGBHTDIDAQGLJS-UHFFFAOYSA-N 447.627 4.098 10 10 IICE CN1CCN(c2ccc(CN3CCC[C@@H](c4nc(-c5cccc(F)c5)no4)C3)cc2)CC1 775670183 VQUOYPYZPLFDBH-OAQYLSRUSA-N 435.547 4.007 10 10 IICE CC(C)Oc1ccc(N2C(=O)/C(=C/c3c(Br)cnn3C)SC2=S)cc1 779203855 LQAONKMMLPJVRA-NVNXTCNLSA-N 438.372 4.376 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F 792501713 OEBNYIJVDQMJLB-LJQANCHMSA-N 425.426 4.107 10 10 IICE COc1cc(Br)cc(CN2CCOC[C@@H]2Cc2c[nH]c3ccccc23)c1O 799737611 JJUUHFKIAALWRP-KRWDZBQOSA-N 431.330 4.088 10 10 IICE Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)n1C[C@H]1CCCO1 1084343187 UADVIOGNABQCIR-ZZAWEDPDSA-N 443.503 4.104 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CN(Cc3ccccc3)C[C@]23CCOC3)cc1 1135946258 LOVWJVYBRWZBLD-BDYUSTAISA-N 435.612 4.030 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc(Cn4ccc(C(F)(F)F)n4)cc3)ccc21 1136437174 YQUFSZFLMQIQLF-UHFFFAOYSA-N 428.458 4.263 10 10 IICE CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1152400874 GEOAINDMBZVSLU-WIYYLYMNSA-N 442.556 4.412 10 10 IICE C[C@H]1c2ccc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)n2CCN1C(=O)OC(C)(C)C 1154669109 RCKXBEVYOKKWPE-SJORKVTESA-N 426.561 4.357 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(Cc4ccccc4)C3=O)cc2Cl)C1 1155727402 RBDUPZGMQZCUJR-GHTZIAJQSA-N 439.987 4.241 10 10 IICE CC(C)(C)OC(=O)N1CCc2sc(C(=O)NCCCSc3nccs3)cc2C1 1292997619 OHMKHALGYLQQHW-UHFFFAOYSA-N 439.628 4.410 10 10 IICE Cc1cc(C)nc(-n2nc(C)c(CC(=O)NCc3cc(C)n(-c4ccccc4)c3C)c2C)n1 1438301297 JNUITIPNFWGXQF-UHFFFAOYSA-N 442.567 4.162 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc1)C1CCCCC1 1442451086 SESGYVOMKJPZOS-HSZRJFAPSA-N 436.512 4.173 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cc(Cl)cc(Br)c3N)c2)CC1 1448050609 AJPMLWYMCDLODW-UHFFFAOYSA-N 437.769 4.079 10 10 IICE Cc1ccc(C(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1454828890 RTWKZCBYLBPKRV-INIZCTEOSA-N 427.545 4.248 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Sc3ccccc3Cl)cc2F)CC1 1456127755 JOPKKEMWPJYXEI-INIZCTEOSA-N 435.996 4.418 10 10 IICE O=C(NCCOc1ccc(Cl)c(Cl)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 1470339274 VTHZXRIJNSFXGA-QGZVFWFLSA-N 439.339 4.469 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)OC(C)(C)C2)sc(C)c1-c1ccccc1 1473126079 BVXIGEXGZRYYKR-HNNXBMFYSA-N 430.570 4.338 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1499720537 CDXLKDXGPKFPTI-GOSISDBHSA-N 440.592 4.234 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)C[C@@H](C)C1(F)F 1505287605 OCTLPQPVENSWDB-ZNMIVQPWSA-N 443.589 4.148 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2cnc(C)s2)cc1 1515531683 KBGHCIAQXOMVGQ-IBGZPJMESA-N 440.617 4.078 10 10 IICE CC(C)(NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1 1528783929 MMGILLMAHWCQPS-JXAWBTAJSA-N 428.554 4.469 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 1536549289 CXJHLGUJDBZEJD-FCORRRHLSA-N 445.966 4.120 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(OC(F)(F)F)cc1Br 1537156017 HYQSYTHXJKZUOL-UHFFFAOYSA-N 445.235 4.437 10 10 IICE COc1cc(CN2CC[C@H](NC(=O)c3sccc3-n3c(C)ccc3C)C2)cc(OC)c1 1545471624 JITTWPUAUPHJJL-IBGZPJMESA-N 439.581 4.177 10 10 IICE Cc1c(NC(=O)c2cc3cc(O)c(O)cc3s2)cccc1C(=O)N1CCSCC1 1546252587 BMJFUKNPDPSJFD-UHFFFAOYSA-N 428.535 4.062 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CSC[C@@H]3C(=O)NCCC(C)C)c2C)c1 1585061305 VAOXDDXNRGTALO-JOCHJYFZSA-N 427.614 4.388 10 10 IICE COc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1N1CCCC1=O 1587724314 WPGZAGHLRTZSOW-UHFFFAOYSA-N 445.519 4.223 10 10 IICE C[C@@H]1CCC[C@@H](C2CN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)C1 1587787123 FFHXBCHNMIABDW-HUUCEWRRSA-N 434.583 4.153 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCCc3cc(OC)ccc32)sc2c1CCC2 1616411352 SIDOPUHJQGHJKY-UHFFFAOYSA-N 428.554 4.204 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)cc1 1616533944 LWTKPWLEBQGXEC-UHFFFAOYSA-N 433.339 4.396 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(Br)c(Cl)c2)N(C)C)cc1 1616857938 BSCCSXQAADFNOU-LJQANCHMSA-N 438.797 4.130 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1623726160 ZHTCJWZVICQHLN-REWPJTCUSA-N 445.629 4.055 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1Cc2c(F)cc(C)cc2N1C(=O)OC(C)(C)C 1627029014 TYFUYUSSRGRQDZ-SFHVURJKSA-N 449.519 4.308 10 10 IICE CCOC(=O)Cc1c(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)[nH]c2ccccc12 1628609183 XKAOEMWEJZOIFS-UHFFFAOYSA-N 433.552 4.440 10 10 IICE Cc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc(O)c2ccccc12 1630280799 RCLORYJRDPJDSD-HNNXBMFYSA-N 427.451 4.249 10 10 IICE CCO[C@@H]1C[C@](O)(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1634606697 GAHNRGHHFLQOBK-KNQAVFIVSA-N 449.389 4.153 10 10 IICE C[C@@H]1CC[C@H](C(F)(F)F)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1645250607 CWZDCGOFOCVFLV-KGLIPLIRSA-N 430.426 4.063 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 1651627743 SPZAJFGEBVURSK-WEVVVXLNSA-N 435.274 4.276 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)cc1 1654947758 PVRVKEDSCQKXJE-SANMLTNESA-N 449.620 4.299 10 10 IICE Cc1cc2nc(Cl)cc(NCc3ccc(N4CCOCC4)cc3C(F)(F)F)n2n1 1654991416 GMGIGGBGUXYJLF-UHFFFAOYSA-N 425.842 4.159 10 10 IICE CN(Cc1ccc2ccccc2c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1673472582 RHLSXEQMCBYHSI-UHFFFAOYSA-N 425.479 4.296 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](Cc3ccccc3)c3ccccn3)C2)cc1 1673825403 AUYDETUOHUODFR-SQJMNOBHSA-N 430.552 4.200 10 10 IICE C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684873449 HDZGJXDEODWYEP-RTBURBONSA-N 429.008 4.425 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@H](C(F)(F)F)CC3)cc2Cl)C1 1686268238 ANDRLJYGWHABIH-KDOFPFPSSA-N 433.902 4.439 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1694798089 ZEGCKVWWZAAUKF-DENIHFKCSA-N 438.620 4.033 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC(OC(C)C)CC2)cc1 1710027997 NXQTVDJYRUJXBT-HSZRJFAPSA-N 441.620 4.418 10 10 IICE CCCN(CCn1c(C(C)C)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1728109634 KTYJHRMHRFQIPC-UHFFFAOYSA-N 431.581 4.391 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)[C@H]2CCSC2)cc1 1766615435 XIVPFYDTNRRLMX-CTNGQTDRSA-N 429.634 4.008 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1768308410 IIWGQOJKQCCEHJ-HKBQPEDESA-N 437.613 4.278 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCCOC3CCCC3)CC2)cc1F 1770258476 OAGDNQKOKAFHFB-UHFFFAOYSA-N 445.583 4.225 10 10 IICE COc1cccc(-c2nnc(N3CCC[C@H](OC)C3)n2CCCSc2nccs2)c1 1770339277 CZKXBYBYMWRNAV-SFHVURJKSA-N 445.614 4.208 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCc1nnc(C)s1 1771311943 BKBVITGOFLRETL-UHFFFAOYSA-N 437.573 4.143 10 10 IICE COc1ccc(OC)c(/C=C2/SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)c1 1860084580 VERYRELTLZGCLY-RQZCQDPDSA-N 432.479 4.026 10 10 IICE CCCCOc1cn(CCCC)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870659496 GUPGOOBHTXMXMW-UHFFFAOYSA-N 427.589 4.158 10 10 IICE Cc1ccc(O)c(N=c2nc(N(C)Cc3ccccc3)[nH]c(N(C)Cc3ccccc3)n2)c1 1871732141 UWEWXPVWIIFQIN-UHFFFAOYSA-N 440.551 4.324 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3cccc(NC(=O)CC(C)(C)C)c3)CC2)cc1 1874726927 MHESDUZUPUVVPN-UHFFFAOYSA-N 437.584 4.465 10 10 IICE O=C(NN1C(=O)C(=CC=Cc2ccccc2)SC1=S)c1ccc(OC(F)F)cc1 2053510541 HTKCQMBJKRPSPK-UHFFFAOYSA-N 432.473 4.390 10 10 IICE CC(C)=CCc1c2c(c3occ(-c4ccc(O)c(O)c4)c(=O)c3c1O)C[C@@H](O)C(C)(C)O2 2069682065 KMIAVXXXWOJFRF-LJQANCHMSA-N 438.476 4.160 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C(F)F)c(CO)c1I 2079844897 ONUWTJDYTGMPIA-GFCCVEGCSA-N 436.240 4.239 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C2CCC2)c(N)c1I 2080043361 TUADXSVWDLVCGH-ZDUSSCGKSA-N 427.286 4.051 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](CNCc1cc(Br)cc(F)c1O)C(F)(F)F 2105247052 IMTBYIJKFQXIOD-SNVBAGLBSA-N 445.251 4.087 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N[C@@H]2CCC[C@H]2N=[N+]=[N-])C1 2218743784 KHHDYAFQCVQOKV-PWHSHALESA-N 443.548 4.178 10 10 IICE CCc1cc(C)cc(OCCOc2ccccc2C=C2C(=O)NN(c3ccccc3)C2=O)c1 2296660341 YYOQIRFWQBSHDB-UHFFFAOYSA-N 442.515 4.477 10 10 IICE COC(=O)CCCCCN1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2297306878 PCNPYVOBEAMRQT-UHFFFAOYSA-N 428.373 4.384 10 10 IICE N=C1C(=Cc2ccc(OCc3ccccc3F)cc2)C(=O)N=C2SC(N3CCCC3)=NN12 2297352871 PBWQRBIKVFZALG-UHFFFAOYSA-N 449.511 4.077 10 10 IICE CCOc1cc(C=C2SC(=S)N(C3CCCC3)C2=O)ccc1O[C@@H](CC)C(=O)O 2314935751 SBBCRTQRZOELKT-HNNXBMFYSA-N 435.567 4.471 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(c4ccccc4C(=O)O)C3=O)n12 2321709079 VQWYBBFDCCIUKY-UHFFFAOYSA-N 435.939 4.462 10 10 IICE CCOc1cc(C=C2C(=O)N(Cc3ccc(F)cc3)N=C2C)cc(Br)c1O 2332110957 UEUPCPWUNWKSLX-UHFFFAOYSA-N 433.277 4.494 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1 8608867 OIDIJGRMYFOTLP-VWLOTQADSA-N 435.593 4.143 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1 8608868 OIDIJGRMYFOTLP-RUZDIDTESA-N 435.593 4.143 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S)Nc1nccs1 15045112 NNDDUHFTKJNETJ-QINSGFPZSA-N 433.580 4.249 10 10 IICE O=C(O)CCOc1ccccc1/C=C1/SC(Nc2ccc(Br)cc2)=NC1=O 16911812 PDFXCKJENICVPM-LFIBNONCSA-N 447.310 4.385 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3c(C)nn(-c4ccc(C)c(C)c4)c3C)CC2)cc1 33140749 GYEMVTLKZGGOJQ-UHFFFAOYSA-N 432.568 4.006 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@@H](C)c3ccccc3Br)CC2)cc1 110468025 VNRSFNAFABTBKV-HNNXBMFYSA-N 432.362 4.487 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)ccc1OCC(=O)O 210457302 CPYATYBHXYAZCX-YVLHZVERSA-N 433.482 4.094 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(NC(C)=O)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526330977 GEMNVVPLJDPACL-QHCPKHFHSA-N 446.459 4.122 10 10 IICE C[C@H](NCc1cc(Br)cc(F)c1O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 715828255 OAAFXEQZTWGUSA-STQMWFEESA-N 431.346 4.419 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2Cc3ccccc3CN2C(=O)CC(C)C)cc1 727861231 CSUAHENBTGMOAZ-VWLOTQADSA-N 435.612 4.491 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1F 753737700 CAFJSPHQJDOKRO-IRXDYDNUSA-N 438.421 4.185 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NCc1ccc(N3CCC(C)CC3)cc1)CC2 758487982 VGNGIRJBDMAMNV-GOSISDBHSA-N 446.517 4.461 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1nc(-c2ccccc2)c(Br)s1 764534151 RYDCRGFIHXEEBZ-UHFFFAOYSA-N 447.767 4.069 10 10 IICE Cc1ccc(NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1N1CCNC1=O 786358300 HBZAEULPMIAGKS-UHFFFAOYSA-N 431.540 4.296 10 10 IICE C[C@@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(N2CCOCC2)c(F)c1 798935328 OAMFHQNXTJVOAY-QGZVFWFLSA-N 433.955 4.003 10 10 IICE COc1cc2c(cc1F)CC[C@@H]2NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 800997795 CCRYWVIEFMGLMI-PZPWOCDFSA-N 445.510 4.074 10 10 IICE CC(C)(C)c1cc(NC(=O)NCc2cc(Br)ccc2O)n(-c2ccccn2)n1 806412880 GSLQWYDUGJEXPU-UHFFFAOYSA-N 444.333 4.355 10 10 IICE CN(CCc1ccc(Cl)cc1)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1127647006 YBPXBVLFSYJFTO-UHFFFAOYSA-N 448.862 4.338 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nn(-c2ccccc2)cc1Br 1129974076 MSKRCMUSKUGNLV-INIZCTEOSA-N 441.373 4.370 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1noc2c1CCCC2 1134903380 HSMJGCRORJVRBS-PTNGSMBKSA-N 433.580 4.235 10 10 IICE Cc1cc(C(=O)NC[C@]2(N(C)C)CCSC2)c(C)n1-c1ccccc1Br 1137150935 BGKCVOHOPNZFTA-HXUWFJFHSA-N 436.419 4.024 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Cl)cccc3Br)CC2)cc1F 1137422646 GPQYIVCHARKDOV-UHFFFAOYSA-N 427.701 4.213 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(-n2cc(Br)cn2)cc1 1137443345 LXUODEPGDAAZRC-UHFFFAOYSA-N 426.314 4.149 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2ncccc2C)cc1 1137817864 MALJOSADZROKHV-UHFFFAOYSA-N 440.883 4.357 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1F 1150239390 GLVYVOJRYDXHQJ-AVRDEDQJSA-N 447.348 4.223 10 10 IICE Cc1cc(C(=O)N2CCOc3c(Br)cccc3C2)c(C)n1-c1ccccn1 1156567928 IPKBSZLHFMEOGC-UHFFFAOYSA-N 426.314 4.286 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 1230200884 NLGFZIVUIAJBNE-VQTJNVASSA-N 446.636 4.328 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@H]3CCCC[C@H]3c3ccccc3)cc2)CC1 1251102675 XPTPTQIBYKZAKU-NOZRDPDXSA-N 448.611 4.162 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CCS[C@H](C(C)C)C1 1289423455 LNHQFUWFEUZBIJ-IRLDBZIGSA-N 443.661 4.173 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291492009 QBLSQGNXMDLEDH-SLFFLAALSA-N 425.621 4.283 10 10 IICE CC[C@H]1CCCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1293387490 VTHBHJXPJDBPHJ-UXHICEINSA-N 441.620 4.059 10 10 IICE O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)O1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860036 PRFOEOBPNQVKMZ-BQFCYCMXSA-N 434.886 4.016 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1296922880 MDLPIAZTWISZGT-VQTJNVASSA-N 431.600 4.469 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc(Br)c2ncc(C=O)n2c1 1297006199 UWCZEZVUYGNRRS-UHFFFAOYSA-N 430.302 4.057 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nc(C(F)(F)F)n2c1CCCC2 1302576139 QQHJYDGCXFGRMU-UHFFFAOYSA-N 444.457 4.388 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 1303223251 HJZPIWLGXKJPNQ-UHFFFAOYSA-N 427.844 4.202 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3cccc(F)c3Br)CC2)cc1F 1445849048 WUHGAOKUWLKSFZ-UHFFFAOYSA-N 439.300 4.017 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1 1446795809 BECUDPUAWNEXSR-OFNKIYASSA-N 435.568 4.410 10 10 IICE COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1462080701 BCQJHYUVYVQWMY-DEOSSOPVSA-N 449.551 4.042 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](OC(=O)N(C)C)C2)c(C)n1-c1ccccc1Br 1468207264 ZIAPCQKFRPBQEG-MRXNPFEDSA-N 448.361 4.159 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1csc(NC(=O)c2cccs2)n1 1469105259 XZQOUOJRRHBYFC-HNNXBMFYSA-N 442.610 4.121 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3ncon3)C2)c(C)n1-c1ccc(Br)cc1 1471968757 YDVQTQGRWNOQGA-HNNXBMFYSA-N 429.318 4.259 10 10 IICE COc1ccc([C@@H](CO)CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1478528229 MTENUJFYQBIXJY-YLJYHZDGSA-N 445.991 4.160 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCOCC2(CCC2)C1 1510672409 ILIAKYVMXPJWJJ-UHFFFAOYSA-N 425.621 4.296 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCCN(C(C)C)CC2)cc1 1515525589 KTIWKLIOOBJMCG-UHFFFAOYSA-N 447.631 4.155 10 10 IICE CC[C@H](C)c1nnc(N2CCC(CO)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1545429304 ILWJVSGWEWJPDI-FQEVSTJZSA-N 425.621 4.285 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@]23CCCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)cc1 1557356195 MQXVGDGSLZJEBM-SQJMNOBHSA-N 445.604 4.160 10 10 IICE COc1ccc(N(C)CC(=O)N(C)[C@@]2(c3ccccc3Cl)CCCCC2=O)cc1OC 1559510405 ZHOBNVKSPMVZPA-XMMPIXPASA-N 444.959 4.290 10 10 IICE COC1CCN(c2ccc(CN3CCC(NC(=O)Nc4ccc(F)cc4)CC3)cc2)CC1 1559606471 ZVPMAFIYZDVDON-UHFFFAOYSA-N 440.563 4.227 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCN(CC)C[C@H]2CC)sc(C)c1-c1ccccc1 1559835444 KRALLIUHDVSXQL-LJQANCHMSA-N 443.613 4.255 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1564587571 JJWMHFXEABFARE-TZIWHRDSSA-N 440.588 4.459 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1ccc(OCC(F)(F)F)nc1 1567869548 ZZZZPHDIGTZUMR-UHFFFAOYSA-N 445.441 4.215 10 10 IICE CCOC[C@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1597059072 QZDQTRYEEWMKGZ-OVGFGYAMSA-N 438.640 4.147 10 10 IICE Cc1ccc(C(=O)N2CCC(C(=O)N[C@@H](C)C(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1611196582 BGNPBECZHMNMCD-IBGZPJMESA-N 437.584 4.228 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCC[C@@H]2CSC)cc1 1615380946 NLRSWWDMIYTOAY-TZIWHRDSSA-N 429.634 4.008 10 10 IICE CC(C)[C@H](Cc1ccccc1)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1616359750 UGPSYJCLXJRPNK-NRFANRHFSA-N 442.471 4.367 10 10 IICE O=C(/C=C\c1cncc(F)c1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616573323 ULDYNUMRSPITPI-DAXSKMNVSA-N 438.260 4.345 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@H]3OCCC[C@H]3C2)cc1F 1617666921 GHPFLNGDJHXFKK-RXVVDRJESA-N 429.584 4.125 10 10 IICE CO[C@]1(C)CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1619029171 NZVNMSNCJLPXCI-RUZDIDTESA-N 425.621 4.303 10 10 IICE CC(C)=CCSc1ccccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1626090728 UELJBWMOGQVAIY-UHFFFAOYSA-N 437.609 4.377 10 10 IICE COC(=O)CCN(Cc1ccncc1)C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1631520010 IRBGWCCUTVLTHP-UHFFFAOYSA-N 425.916 4.348 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3cccc(O)c3O)[C@@H]2c2cccs2)cc1 1633507384 HGAWLHSIBCPUFF-XMSQKQJNSA-N 436.533 4.268 10 10 IICE Cc1cc(CCNC(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)c(C)n1-c1ccccc1 1635362564 GTZLEXRHJIHSEQ-XMMPIXPASA-N 432.568 4.155 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1C[C@@]1(C)c1cccc(Br)c1 1638529335 MDOUNEARQBISGH-GCJKJVERSA-N 446.341 4.024 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2cnc(NC(=O)c3c(F)ccc(O)c3O)s2)CC1 1638673057 UHBOXRZEOAPTEQ-UHFFFAOYSA-N 437.493 4.060 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CCOCC1 1640373796 FNSAROVFEKAMDN-FQEVSTJZSA-N 435.362 4.028 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N(CCC4=CCCCC4)C3=O)c2C)cc1 1652513797 RPJCLLNQHCIZKT-UHFFFAOYSA-N 447.535 4.267 10 10 IICE COc1ccc(C)cc1[C@@H](C)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1654675886 RHRKDBVSLXUXGS-MRXNPFEDSA-N 428.488 4.068 10 10 IICE C[C@H](NC(=O)N1CCC[C@H]2CC[C@@]21CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1680281236 WMWABZQEHVDKGU-WVMBUTMQSA-N 430.593 4.293 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(Cl)cc3OC(C)C)CC2)c(OC)c1 1685030137 BZQCTQPTNRKLQC-UHFFFAOYSA-N 447.963 4.176 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1685281596 JUBVPFGIJAXJTN-QGZVFWFLSA-N 441.519 4.206 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cccc(C)n4)n3CCC(C)C)CC2)cc1 1697470613 LGHUPDGYSKTNHI-UHFFFAOYSA-N 434.588 4.420 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N1CCCC1 1707304751 DULVOHNAVFNNSX-UHFFFAOYSA-N 429.366 4.059 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N(C)C2CCC3(CC2)OCCO3)cc1 1710024350 SGLFQGLKAPZEOF-UHFFFAOYSA-N 441.620 4.418 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(CC)n2Cc2ccc(N(C)C)c(F)c2)C12CCCC2 1729177609 GTHDAGQZWRKLMS-LEWJYISDSA-N 429.584 4.268 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C1 1748464827 JEZKWGGFEAUZAO-VWLOTQADSA-N 437.588 4.129 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@H](C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1751412296 PROLNSZSAUWOTR-QGZVFWFLSA-N 425.602 4.065 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccc(C)o3)n2Cc2ccc(N(C)C)cc2C)n1 1751834706 KALPBCAIQCBIND-UHFFFAOYSA-N 447.587 4.100 10 10 IICE C[C@H]1CCN(c2nnc(COc3ccccc3F)n2CCCSc2nccs2)C1 1763012806 ZFFHXYNQMAGXHT-HNNXBMFYSA-N 433.578 4.481 10 10 IICE CC[C@H]1CCCN(c2nnc(C(=O)N3CCCC3)n2Cc2ccc(N(CC)CC)cc2)C1 1765106280 LQJHWTCSGBEWBT-FQEVSTJZSA-N 438.620 4.035 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1770598662 NZSZZCGKPDKDFH-SFHVURJKSA-N 425.602 4.331 10 10 IICE O=C1C(=Cc2ccc(-c3ccc(Cl)cc3)o2)SC(=S)N1CCN1CCOCC1 2040489112 HJAABNYXXPKADG-UHFFFAOYSA-N 434.970 4.133 10 10 IICE Cc1ccc([C@H](n2nc(C(F)(F)F)c(C(N)=O)c2Br)C2(C)CC2)c(O)c1 2079037577 LJJQBKGDWIMFMB-ZDUSSCGKSA-N 432.240 4.167 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C(F)(F)F)c(CO)c2Br)c(O)c1 2079873411 ORUWKNVEFQTKLZ-AWEZNQCLSA-N 435.240 4.260 10 10 IICE COc1ccc(Br)c(CNCC2CCC(NC(=O)OC(C)(C)C)CC2)c1O 2236054238 GLKAOYHUFLWRJE-UHFFFAOYSA-N 443.382 4.336 10 10 IICE O=C1C(=Cc2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1c1ccc(Br)cc1 2293109493 KWMFGBBJRPQLKQ-UHFFFAOYSA-N 437.296 4.469 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)C1=CNC1=CC=C[C@H]2C(=O)c3ccccc3C(=O)[C@H]12 2297511511 AAUDKFJWTSXTGY-QPPBQGQZSA-N 437.499 4.265 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)C(=Cc3cccc(O)c3)SC2=S)cc1 2314831897 VFQSDRLXUGYDNS-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CCc1ccc(N2C(=O)C(=Cc3ccc(OC)c(OC)c3C(=O)O)SC2=S)cc1 2314929267 KBIUAVAULQQLQX-UHFFFAOYSA-N 429.519 4.370 10 10 IICE O=C(O)CCCCCN1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323809114 XUXCZABHRHBUAM-UHFFFAOYSA-N 432.336 4.434 10 10 IICE CC(C)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323812992 MSUMLZKUNSXYGU-LBPRGKRZSA-N 432.336 4.289 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380744198 CIAMSLWEYGGCJJ-GJZGRUSLSA-N 441.366 4.163 10 10 IICE COc1ccc(C2(Nc3cc(OC)c(OC)c(OC)c3)C(=O)c3ccccc3C2=O)cc1 9561381 IUECGJUGFUSTDW-UHFFFAOYSA-N 433.460 4.108 10 10 IICE COc1ccc(O)c(C2=NN3[C@H](C2)c2cccc(OC)c2O[C@@H]3c2ccc(O)c(OC)c2)c1 20071389 WPFQZSRAWPPQMV-KBMIEXCESA-N 448.475 4.366 10 10 IICE COc1ccc(/C=C\C(=O)Oc2ccc(/C=C3\SC(=S)N(C)C3=O)cc2OC)cc1 33339367 PBBJIENWQFPQNY-PGRWIBNWSA-N 441.530 4.154 10 10 IICE COc1cc(/C=C\C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1OCC(C)C 210873287 MOTZNVAEJODVPC-KUMUZEIWSA-N 438.568 4.457 10 10 IICE COc1ccc(OC)c(/C=C2\SC(=S)N(CCCN(C)c3ccccc3)C2=O)c1 726627317 PZTHXRQNULJHIE-HKWRFOASSA-N 428.579 4.432 10 10 IICE C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(Br)cc(Cl)c1O 756561555 DXYDNCVVLHAATO-PXAZEXFGSA-N 425.754 4.158 10 10 IICE Fc1cccc(-c2noc([C@@H]3CCCN(Cc4ccc(N5CCOCC5)c(F)c4)C3)n2)c1 769234511 UAOFOUSSFIXSJH-LJQANCHMSA-N 440.494 4.231 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCCC(F)(F)F)C2=O)cc2c1OCCO2 794861006 BPFYOYVYZZNIQL-GXDHUFHOSA-N 433.473 4.400 10 10 IICE O=C(CC(F)(F)F)NC[C@H]1CCCN(Cc2ccc(OCc3ccccc3)cc2O)C1 809690427 QJVBGSRJGLNNCF-GOSISDBHSA-N 436.474 4.252 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)sc2c1CCCC2 1124198616 BNSBKNASGNQJIE-AWEZNQCLSA-N 444.528 4.243 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H](C(=O)OC(C)(C)C)C(C)(C)C)cc2F)C[C@@H](C)O1 1125256295 HILCGJZRCDIEDY-JXXFODFXSA-N 436.568 4.060 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(F)(F)c2ncccc2Br)cc1F 1144985973 RMLTXSIYGZTDPV-UHFFFAOYSA-N 430.268 4.238 10 10 IICE C[C@@H](CSC(F)(F)F)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1147505480 JXDMMOGVNPIJDB-BBRMVZONSA-N 449.539 4.324 10 10 IICE COC(=O)c1cnc([C@@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)s1 1148947894 ZIYHTXOUAYQQPE-GOSISDBHSA-N 437.565 4.286 10 10 IICE Cc1cc(C(=O)CN2C(=O)CN(/C=C/c3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 1165537309 LCXOAHFNGPKQLY-OUKQBFOZSA-N 431.467 4.351 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3F)C2=O)c(C)n1-c1ccccc1 1188635752 RTDMLSQIGCHDBU-DEOSSOPVSA-N 437.446 4.022 10 10 IICE Cc1ncccc1/C=C\C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1289102838 SSHSQMDTJJOLIT-CGQZWFTASA-N 425.504 4.273 10 10 IICE CCC1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)[C@H](C)CC(N)=O)CC1 1292411831 XRSRFGGKQHPPMO-QGZVFWFLSA-N 434.588 4.243 10 10 IICE CO[C@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1Br 1295404825 BZBBCNDTXJQEAG-UZLBHIALSA-N 434.330 4.050 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4cc(C(C)(C)C)ccc4[nH]3)cc2)CC1 1296401704 QVEFUMWFBWLDBB-UHFFFAOYSA-N 432.568 4.064 10 10 IICE COCc1nc(Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)cs1 1301213573 YTBVUXCYTJSBNE-UHFFFAOYSA-N 427.574 4.004 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCSC3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1304188301 BASMWHNIZHGMBR-RXVVDRJESA-N 438.645 4.244 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CC(F)(F)F)C3)N(C)C)cc1 1313394901 WCCZWJJIJJAHMX-SLFFLAALSA-N 426.527 4.260 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC3(CCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1316187124 LOLSBPNSOQCRSB-HXUWFJFHSA-N 441.620 4.195 10 10 IICE CCOC(=O)c1c(NC(=O)c2nc3ncc(C)cn3n2)sc(C)c1-c1ccc(C)cc1 1351290615 RSLYSSPORGOTRX-UHFFFAOYSA-N 435.509 4.207 10 10 IICE COc1ccc(-c2cncc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)c2)cc1 1357836246 QOBJVWATDPTXNH-QZTJIDSGSA-N 449.526 4.440 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(OCCCOc3ccccc3)C2)cc1 1445091017 OBYPCIDPVKUUTL-UHFFFAOYSA-N 446.547 4.146 10 10 IICE Cc1cc(C(=O)N(C)[C@H](CCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1445894158 RUGPYIRHNIXMSY-HXUWFJFHSA-N 442.357 4.447 10 10 IICE Cc1cc(CCNC(=O)[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1461971545 ZLUCYGOOKBBOHL-VWLOTQADSA-N 425.573 4.400 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4ccc(C)cc4)cn3)CC2)c(OC)c1 1461975104 BGVAGNFUSZWXRF-UHFFFAOYSA-N 433.508 4.162 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc(C(=O)OC(C)(C)C)c1 1463279717 JPQDQNUNWWGHSB-JOCHJYFZSA-N 425.573 4.049 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccnc1SC(F)(F)F 1465952291 ZPHMYEQYMDCFOS-CQSZACIVSA-N 445.894 4.447 10 10 IICE CCCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1469961890 YFIVCBDLHKCMBR-QUCCMNQESA-N 449.039 4.414 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCCc3cc(-c4ccccc4)n[nH]3)C2)cc1 1470594355 SFSQJJNSUZIXBP-FQEVSTJZSA-N 447.583 4.186 10 10 IICE CC(C)(C)OC(=O)N1c2ccccc2CC[C@H]1CCNC(=O)NCc1c(O)cccc1F 1470711896 ZBMJACKUQLRAJD-KRWDZBQOSA-N 443.519 4.477 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O 1478591120 VVQYIGYOCVOBLQ-LJQANCHMSA-N 449.382 4.396 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1500831373 ORZBDWDULQDSIB-SANMLTNESA-N 448.615 4.457 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCC1(C)C 1516568250 WSSISDMGZKURJQ-HXUWFJFHSA-N 441.620 4.366 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(OC(C)C)c1 1526002762 IMOFYPSSKRTMNY-CALCHBBNSA-N 430.520 4.165 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1oc2ccccc2c1Br 1527481281 HXWZICLAYSFSAF-UHFFFAOYSA-N 433.277 4.101 10 10 IICE CCc1nc2ccccc2c(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)c1C 1528692624 KIJBLAHJXQTWDN-UHFFFAOYSA-N 434.559 4.317 10 10 IICE CC(C)(C)c1ccc(SCC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1538131615 FGFHXOKRRMNLMC-UHFFFAOYSA-N 439.625 4.094 10 10 IICE COC(=O)COc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1538422929 ZZVHQYBDHMSEFI-MRXNPFEDSA-N 430.932 4.058 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)N(C)C)no1 1542188865 XUWKGVYKPINFBY-SFHVURJKSA-N 447.587 4.236 10 10 IICE C[C@@H](NC(=O)c1cc2cccc(C(F)(F)F)c2nc1O)c1ccc(N2CCOCC2)cc1 1544214616 BROLCWIELMSRDX-CQSZACIVSA-N 445.441 4.287 10 10 IICE Cc1cc(CC(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c(C)n1-c1ccccc1 1556612154 RDFPBFIFJOFGSZ-OAQYLSRUSA-N 432.442 4.385 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1N(C(=O)OCc2ccccc2)CC1(C)C 1557063274 JPYUZWVYTQYFBI-WMZHIEFXSA-N 437.584 4.155 10 10 IICE COc1ccc(O)c([C@@H](C)Nc2ncnc3c2cnn3-c2cccc(Br)c2)c1 1559098799 CHMWAXQKQCAEBN-GFCCVEGCSA-N 440.301 4.465 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Cn3cccc(I)c3=O)c2C)c1 1559433047 JIQUWQJWUBPFTI-UHFFFAOYSA-N 446.288 4.052 10 10 IICE COc1ccc(N2CCN(Cc3ccc(OCc4ccccc4F)nc3)CC2)cc1F 1559642060 AWXZPMIZJUDYHD-UHFFFAOYSA-N 425.479 4.270 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)N[C@H](C)c2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1564427631 JRPAZZGNZBBDNG-MPKWNAGQSA-N 433.911 4.296 10 10 IICE CC[C@@H](OC1CCCC1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1565882034 NTLRKAGVIMLYKQ-LEWJYISDSA-N 433.593 4.172 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2OCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1586619222 FPVKCRXYOREHPU-FGZHOGPDSA-N 439.556 4.096 10 10 IICE Cc1cc(C(=O)N[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c(C)n1-c1ccc(F)cc1 1587064147 RNAKAWXANMHZPN-JOCHJYFZSA-N 447.432 4.383 10 10 IICE Cc1cc(C(=O)N[C@H](CC(N)=O)C2CCCCC2)c(C)n1-c1ccc(Br)cc1 1587479096 GRXXANXNAFBTLG-HXUWFJFHSA-N 446.389 4.411 10 10 IICE Cc1cccc(OCCN(C)[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1615194909 KIUFRMSOCIIHBZ-GOSISDBHSA-N 442.515 4.108 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)Cc2ccc(C)o2)cc1 1615379576 JYDMRXMWDRDTQR-UHFFFAOYSA-N 433.560 4.111 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@@](C)(O)c1cccs1 1617939888 BCJPPAQPWFFCDC-JOCHJYFZSA-N 440.594 4.242 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(CN2CCCCC2)cc1 1622635308 XDVHRZMAOOSOBC-HSZRJFAPSA-N 442.003 4.426 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)CC2)c(OC)c1 1623759544 HMKHVMMSBFZAMG-MOPGFXCFSA-N 435.351 4.463 10 10 IICE CCNC(=O)Nc1c(C)cccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1625985843 QVHYMLYNEMKJEM-UHFFFAOYSA-N 447.583 4.496 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cc(Cl)cc(F)c2C(N)=O)CCCC1 1627124712 SWMNLTLAAWZKHW-UHFFFAOYSA-N 429.879 4.059 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@@H]2CCC[C@@H](C(F)(F)F)O2)cc1 1627204652 DNIPPQOXPMAREC-UFYCRDLUSA-N 428.495 4.150 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCc1ccc(Br)cc1 1630486445 MINGRYWAVXUYSJ-UHFFFAOYSA-N 434.330 4.069 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 1633351751 AMOREERFBDPYQD-SANMLTNESA-N 444.510 4.228 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCN3CSCCSC3)cc2Cl)C1 1634027136 PRBLRPDUWMJVOD-INIZCTEOSA-N 428.067 4.280 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(C)c(NS(C)(=O)=O)c3)c2C)c1 1635327396 TWJHCALNOMGAJU-UHFFFAOYSA-N 425.554 4.012 10 10 IICE C[C@@H](NC(=O)CSCc1nc(O)c2c3c(sc2n1)CCCC3)c1ccccc1O 1635793869 LRPBYSWNCDPPOX-GFCCVEGCSA-N 429.567 4.092 10 10 IICE CCOc1ccc(OC(C)(C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1635941275 OUXXUNKZRFKNBY-IBGZPJMESA-N 446.975 4.383 10 10 IICE C[C@H](c1ccccc1Br)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1638007444 NCBKDKNXUWTMKL-QGZVFWFLSA-N 445.405 4.104 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2cccc(COC[C@@H]3CCCO3)c2)C2CC2)cc1 1687128012 HDOXRCXADMPPMQ-VWLOTQADSA-N 437.584 4.322 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2C[C@@](C)(O)C(C)C)c(C)n1-c1ccccc1 1707272836 ZIQUQIWNPMBCMK-RUZDIDTESA-N 448.571 4.384 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC[C@@H](OCC(F)(F)F)C1 1707304223 OWHDRZZMZQOIIK-LJQANCHMSA-N 439.526 4.372 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@@H](C)CCSC)n1Cc1ccc(N2CCOCC2)cc1 1726866027 MJCYPZJGQXNDPR-OALUTQOASA-N 431.650 4.254 10 10 IICE Cc1cccc(-c2nnc(N(C)CCC(C)C)n2Cc2ccc(N3CCOCC3)cc2)n1 1742315384 VCEUMPNKBMWOEF-UHFFFAOYSA-N 434.588 4.016 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)[C@H]2CCSC2)cc1F 1747572525 VRAYQDCETVQSJC-KRWDZBQOSA-N 431.606 4.126 10 10 IICE CC1CCN(c2ccc(Cn3c(C(=O)NC(C)C)nnc3N(C)CC(C)(C)C)cc2)CC1 1752209033 WKDYKYKYZPVIBB-UHFFFAOYSA-N 440.636 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CC[C@@H](COC)C2)cc1 1766614185 MGGIXAZIFFRTLY-OAQYLSRUSA-N 439.629 4.298 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4)cs2)cc1 1859574076 OCIFDMGQNCMHJC-UHFFFAOYSA-N 443.550 4.239 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(O)C(=O)N(CCc3cn(C)c4ccccc34)C2=O)cc1 1872956292 IIRBCGRPVCIKFD-UHFFFAOYSA-N 439.515 4.466 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@@H]2NCc2c(O)cccc2Br)C1 1918963755 OHYIBIZGYVCCMH-PXNSSMCTSA-N 425.367 4.424 10 10 IICE Oc1ccc(Br)cc1CN[C@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156277320 JIIUPOJCJFUWRQ-IFMALSPDSA-N 431.374 4.068 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@H]1CCNCc1cccc(Br)c1O 2226207564 QARSBERGIOYNLA-ZDUSSCGKSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](C2CC(NCc3c(O)cccc3Br)C2)C1 2265423210 IOCOEKMCKXCNGQ-NFOMZHRRSA-N 425.367 4.280 10 10 IICE Cc1cccc(OCCCOc2ccccc2C=C2C(=O)NN(c3ccccc3)C2=O)c1 2293344041 SKDPKVWCRMRQII-UHFFFAOYSA-N 428.488 4.304 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1ccc2oc(=O)ccc2c1 2296260180 RNWJBQAOLDSFIL-UHFFFAOYSA-N 436.514 4.023 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)C(=Cc3cccc(O)c3)SC2=S)cc1 2314827429 DTTFKLPFNDAEAU-UHFFFAOYSA-N 428.535 4.021 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CC[C@@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380758059 TZKKRYKOMFUVNV-UKRRQHHQSA-N 441.366 4.115 10 10 IICE CCOC(=O)c1cccc(-c2ccc(/C=C3\C(=N)N4C(SC)=NSC4=NC3=O)o2)c1 96450628 DUGDWUDUOJPGIJ-JVDIEWMDSA-N 440.506 4.063 10 10 IICE CCN(CC)CN1C(=O)/C(=C2/SC(=S)N(c3ccc(F)cc3)C2=O)c2ccccc21 108719549 URKWZVBALHTDTR-VHEBQXMUSA-N 441.553 4.248 10 10 IICE CCCCCN1C(=O)/C(=C2/SC(=S)N(CCCCCC(=O)O)C2=O)c2ccccc21 206703048 CXMXKOYYRREUPE-VHEBQXMUSA-N 446.594 4.440 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccccc2F)SC1=S)Nc1ccc(C(=O)O)cc1 210720683 AHLKYUYHCGLQFM-SFQUDFHCSA-N 444.509 4.144 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3Cc3cccc(F)c3)cc2F)CC1 303255430 BXWWGGGFLJOUHK-JOCHJYFZSA-N 442.554 4.023 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccccc3OC)[C@@H]2c2ccc(O)c(O)c2)c1 526407904 SQUBCUZHXYFWGV-HSZRJFAPSA-N 449.459 4.181 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)C(C)(C)C1 715817237 FSFILUQCSXZRQQ-HNNXBMFYSA-N 431.346 4.419 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN(C)Cc1ccc(N2CCCCC2)cc1 738298295 HUEKSEBKUGJKIL-UHFFFAOYSA-N 445.611 4.228 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)cc1 751060328 ATCVVICAQYVKRS-OIBXWCBGSA-N 439.987 4.496 10 10 IICE Cc1cn(C2CCCCC2)nc1NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 752906574 PKAHZVQAPYLGEV-UHFFFAOYSA-N 429.540 4.119 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N[C@H]1CCSc2ccccc21 768687474 NTZKFPYPLNDFRW-QHCPKHFHSA-N 436.625 4.255 10 10 IICE COc1ccc(CNC(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)c(O)c1 797618202 BJZUESNNYJQPBZ-UHFFFAOYSA-N 448.306 4.239 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCSc3ccccc3)C2=O)cc2c1OCCO2 814267927 LYXVTOWKJNLPRI-AQTBWJFISA-N 445.587 4.460 10 10 IICE O=C(Cc1cscc1Br)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 815835223 NNSKOFIXUPREGE-OAHLLOKOSA-N 443.794 4.193 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 917707475 JEYHPMCZSZLHTE-ZDUSSCGKSA-N 427.303 4.053 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)cc1 918111530 NZXMQVLPZWZUBL-SFHVURJKSA-N 434.506 4.479 10 10 IICE Cc1ccc(C(C)C)c(OCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1127181378 HQXJGUJDTRPBPU-UHFFFAOYSA-N 435.612 4.346 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)c2C)c1 1132044776 YBFDJKPDXYJTMR-HSZRJFAPSA-N 432.480 4.120 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC1(CNC(=O)OC(C)(C)C)CC1 1149900787 UGNJDSMWLAUUPX-UHFFFAOYSA-N 441.366 4.198 10 10 IICE COc1ccc(CN(CCO)C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c(OC)c1 1153005472 GXFCGXQEFPYOOJ-UHFFFAOYSA-N 442.943 4.399 10 10 IICE Cc1cc(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)c(C)n1-c1ccc(Br)cc1 1159993392 ZYHNINADWMFRPK-OAHLLOKOSA-N 430.390 4.413 10 10 IICE Cc1cc(C(=O)CSc2ccc(C(=O)N3CCCC3)cn2)c(C)n1-c1ccc(F)cn1 1165497167 MZEKFJLXHDFKCV-UHFFFAOYSA-N 438.528 4.234 10 10 IICE Cc1cc(C(=O)NCCOC2CCSCC2)c(C)n1-c1cccc(Br)c1 1180122726 GWGPJBUOLGZWHM-UHFFFAOYSA-N 437.403 4.499 10 10 IICE Cc1ccc(Br)c(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 1251965808 QSVDKVBDKFLZRI-GOSISDBHSA-N 433.346 4.354 10 10 IICE CCCO[C@@H](C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(F)cc1C 1265011910 GKUVXJBZRWAGGJ-XMMPIXPASA-N 445.554 4.199 10 10 IICE Cc1cc(CC(=O)Nc2ccc(C(N)=O)cc2-n2ccnc2)c(C)n1-c1ccc(Cl)cc1 1273483597 KZSOILAUNODSMK-UHFFFAOYSA-N 447.926 4.213 10 10 IICE Cc1cc(CNC(=O)CCC(=O)c2ccc3c(c2)CCC(=O)N3)c(C)n1-c1ccccc1 1302268000 SINJBFCDXRJJIS-UHFFFAOYSA-N 429.520 4.258 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3cccc(N4CCOCC4)c3)c2C)c1 1312776465 UVGGSWPOQQADNW-UHFFFAOYSA-N 432.568 4.239 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(=O)NC1CC1 1313683503 DTSCXMNADCWHEH-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CC[C@H](C)C2 1349304821 JYFYWNXNIMDIEL-UONOGXRCSA-N 444.528 4.180 10 10 IICE CCOc1ccccc1C(=O)N1CCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1357469558 YIGWFHODWUMHNX-UHFFFAOYSA-N 445.563 4.020 10 10 IICE CCOc1ccc(CN(CCCn2ccnc2)C(=O)c2ccc(N=NC(N)=O)cc2)cc1 1443681014 YKGDVBZYYWCROJ-UHFFFAOYSA-N 434.500 4.177 10 10 IICE O=C(/C=C/c1nc2ccccc2s1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880106 FNKKMPLRXDZTFQ-OAGJVSPASA-N 427.957 4.449 10 10 IICE Cc1cc(C(=O)N2C[C@@H]3CC[C@H](N(C)C)C[C@H]3C2)c(C)n1-c1ccc(Br)cn1 1457145006 MHPAXNYGAHKWTJ-LNLFQRSKSA-N 445.405 4.054 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nn1-c1cccc(Cl)c1 1464262199 SDQWMNSLRLPMFY-UHFFFAOYSA-N 426.973 4.317 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1Oc1ccccc1 1469859080 ISRUMJWBVPUXRU-SCTDSRPQSA-N 425.312 4.123 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCN(C(=O)C(F)(F)F)C1 1472818347 FRVXJYKDUWROBO-CQSZACIVSA-N 435.402 4.039 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCc4cc(Cl)nnc4C3)cc2Cl)C1 1478529180 WZCVGSBWQBASCG-CQSZACIVSA-N 434.371 4.288 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(C3CCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1495651944 HWWAOQCIKRJUDE-IBGZPJMESA-N 442.627 4.500 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC1(OC)CCC1 1512804464 LCGADQYEJIDOQQ-HXUWFJFHSA-N 441.620 4.224 10 10 IICE CCOC(=O)c1c(F)cccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1520883563 UNCDCOCBNFVHRE-UHFFFAOYSA-N 437.515 4.362 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccn(-c2cccc(Br)c2)n1 1529277721 IODZHNPGLIJVIX-INIZCTEOSA-N 441.373 4.370 10 10 IICE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1537838366 AMPDXUUVSOOKIZ-SQFISAMPSA-N 446.378 4.415 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@H](C)N(C(=O)c1cc(-n3c(C)ccc3C)ccc1Cl)C2 1537957803 SKYNXGPFRMVYDR-INIZCTEOSA-N 440.931 4.165 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc([N+](=O)[O-])c1Cl 1556426643 VRXPSAHKOALVEM-UHFFFAOYSA-N 433.892 4.250 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1567294473 BSIVKMOOUZFJCP-KBMIEXCESA-N 429.564 4.465 10 10 IICE CCOC(=O)[C@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1584884556 PHKXXKHGWQXZAY-IBGZPJMESA-N 430.854 4.290 10 10 IICE Cc1ccc(F)c(-n2nc(C(=O)NCc3cccc(Br)c3O)c3c2CCC3)c1 1623364368 PVKFYXTUMCCIMM-UHFFFAOYSA-N 444.304 4.207 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc1 1624286051 FMKOGUQNTISPEP-XMMPIXPASA-N 445.535 4.224 10 10 IICE COCC[C@H](Cc1cccc(Br)c1)C(=O)NCc1ccc2c(c1)CCCN2C 1626940188 BEXGCJVLTCKZFX-HXUWFJFHSA-N 445.401 4.343 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(OCc3nccn3C)cc2)c1 1630372642 DNVHOZXTIRTKCZ-UHFFFAOYSA-N 428.492 4.471 10 10 IICE Cc1cc(CC(=O)N2CCN(C3=NCC(C)(C)S3)CC2)c(C)n1-c1ccc(Cl)cc1 1630693304 RCNIFAZOHWQMKI-UHFFFAOYSA-N 445.032 4.316 10 10 IICE COc1ccccc1N1CC[C@@H](NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1=O 1631662258 ORDGYTVTMPNCJY-HXUWFJFHSA-N 437.927 4.291 10 10 IICE COc1ccc(N2CCN(C(=O)NCCCCCc3ccc(F)cc3)CC2)c(OC)c1 1634484817 NFLZJYXIGXWAAR-UHFFFAOYSA-N 429.536 4.088 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3csc(SCCN(C)C)n3)c2C)c1 1635326759 KHDPAENCFLDBNG-UHFFFAOYSA-N 442.654 4.372 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC3(C(C)(C)c4ccc(F)cc4)CC3)C2)cc1 1636354303 WSMDGMGWLLDULE-GOSISDBHSA-N 425.548 4.470 10 10 IICE COc1cc(N2CCN(Cc3ccc(OC(C)C)c(Cl)c3)CC2)cc(OC)c1OC 1654083064 VGZFAVFKGYPMOE-UHFFFAOYSA-N 434.964 4.475 10 10 IICE Cc1cc(C(=O)COc2ccc(-n3cnnn3)cc2)c(C)n1-c1ccc(F)c(Cl)c1 1656070191 ZQADEKAZKNOYCW-UHFFFAOYSA-N 425.851 4.124 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCC[C@H]3OC)CC2)cc1 1697470144 CTFWZIQNEWWBFM-SIKLNZKXSA-N 441.620 4.116 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3[C@H]3CCC[C@H](C(F)(F)F)C3)CC2)cc1F 1697471466 BURGCRKMOAVWFH-RDJZCZTQSA-N 441.473 4.354 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1707271985 JFQSBDYBNVBNOS-GOSISDBHSA-N 434.588 4.067 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1COCCO1 1708575479 XIDQDLRAWFNCLO-XMSQKQJNSA-N 437.588 4.250 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710056100 ALWGTDYHQKSHKR-FQEVSTJZSA-N 442.627 4.357 10 10 IICE CCN1CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C[C@@H]1C 1710281851 FMFJLFVADSYOPI-QFIPXVFZSA-N 438.664 4.292 10 10 IICE CC(C)c1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1723198757 OCLOVKITITUTTD-UHFFFAOYSA-N 431.675 4.335 10 10 IICE CCc1ccc(Cn2c(CC)nnc2N2CCCN(c3ccc(OC)cc3)CC2)s1 1727403161 SLEFUGHIXGOXTJ-UHFFFAOYSA-N 425.602 4.238 10 10 IICE Cc1cc(-c2nnc(N3CCC(CCC(N)=O)CC3)n2CC(C)C)c(C)n1-c1ccccc1 1742119363 MVMYCGVHFVERQO-UHFFFAOYSA-N 448.615 4.491 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1743843416 MMWDYTJILBHKCW-SFHVURJKSA-N 436.604 4.361 10 10 IICE CCCOc1cccc(/C=C2/SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)c1 1858594067 JRVUFIJBGXUVJV-XWALVKJWSA-N 427.547 4.373 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)cc1OC 1860083861 AOJLWLQDZYEXRI-RQZCQDPDSA-N 432.479 4.026 10 10 IICE COc1ccc(N2CCN(C(=O)CCN(Cc3ccccc3)Cc3ccccc3)CC2)cc1 1866346603 LMPHQECSDMASEV-UHFFFAOYSA-N 443.591 4.436 10 10 IICE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2ccc(I)c(Br)c2)C1 1912198331 FNLKHXYDOAOECX-SECBINFHSA-N 449.090 4.216 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2ccc(Br)cc2O)C1 1952455923 IRYQXXLMEHQQAL-YOEHRIQHSA-N 434.286 4.329 10 10 IICE CC(C)(C)OC(=O)NCC1(NCc2cc(F)ccc2O)CCN(Cc2ccccc2)CC1 2067209997 IMIRAAUJHKIKJY-UHFFFAOYSA-N 443.563 4.180 10 10 IICE CN(Cc1cccc(I)c1)c1cc(Br)c(CN)cc1F 2280258655 UKVLUJSOCWAFGD-UHFFFAOYSA-N 449.105 4.288 10 10 IICE CCCOc1ccc(C=C2SC(N3CCC(C(=O)OCC)CC3)=NC2=O)cc1OCC 2296709086 RWJXVLTVPVXPLG-UHFFFAOYSA-N 446.569 4.120 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380759560 PFZDPZFPWVWFQE-OAHLLOKOSA-N 441.366 4.211 10 10 IICE CCCN1C(=O)/C(=C\c2c(NC3CCC(C)CC3)nc3ccccn3c2=O)SC1=S 33459294 GTDHXAXEQKPBEF-GHRIWEEISA-N 442.610 4.296 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CCC(c4nc5cc(Cl)ccc5o4)CC3)cc2N1 301980541 HZTBGADYUKDUQR-UHFFFAOYSA-N 428.832 4.104 10 10 IICE O=S(=O)(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1cc(F)cc(F)c1O 753015136 LDBNJVVKNZCKPZ-UHFFFAOYSA-N 426.828 4.099 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 765757709 UDFLIINBTVOUSB-OAHLLOKOSA-N 432.362 4.278 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(OCC(F)F)cc3)n2)cc1 783944987 GBIAODQTWZHMCO-UHFFFAOYSA-N 426.466 4.263 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)c(C)n1-c1ccccc1 797414007 KWCZZXOYZTYDNN-RLSLOFABSA-N 425.573 4.005 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(-c2cccnc2)n1C[C@H]1CCCO1 802694409 HOKWLWSLIOJRBW-HSZRJFAPSA-N 432.572 4.146 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)CC2 807836681 KAXPWIQNIZRESY-VIFPVBQESA-N 434.245 4.238 10 10 IICE Oc1c(Br)cccc1CNC[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 815149150 BIMFTHXPOLNHKI-HXUWFJFHSA-N 445.401 4.173 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OC)c(OC)cc2NC(=O)[C@H]2C[C@H]2C)cc1 918625369 YXQWEWPEGLMGFN-APWZRJJASA-N 439.556 4.075 10 10 IICE COc1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1OC(C)C 1125189079 ZTTXDYZICCVOIH-IRXDYDNUSA-N 430.520 4.165 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c2)n1 1137727363 HLJDTYZXUJSWOT-HXUWFJFHSA-N 448.523 4.070 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1154395933 WCGUHAHCNJMIHS-LJQANCHMSA-N 425.529 4.036 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CO[C@@H](CN(Cc3ccco3)Cc3ccccc3O)C2)C1 1167982625 FMXGMRVQNWBNTF-BWKNWUBXSA-N 442.556 4.404 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCc2cccc(C(F)(F)F)n2)CCCC1 1273772494 ULSYCEVTUGXEJE-UHFFFAOYSA-N 431.458 4.301 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCC[C@@H]2C(=O)OC(C)(C)C)C1 1288143080 IRRNBFBJIPKBJT-HSZRJFAPSA-N 439.600 4.131 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCCN2CCc3ccccc3C2)cc1 1290847138 MHTGCTXHTRFOGR-UHFFFAOYSA-N 429.564 4.014 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2ccccc2)c(C)n1-c1ccccc1Br 1293927865 JYFOJQNVEWICLK-IBGZPJMESA-N 441.369 4.438 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 1299698346 GTYOERQUYKUBFN-UHFFFAOYSA-N 438.549 4.267 10 10 IICE Cc1cc(C(=O)NCCCc2nc3ccc([N+](=O)[O-])cc3[nH]2)c(C)n1-c1ccc(F)cc1 1303528579 NGXHYBTXOMAKIN-UHFFFAOYSA-N 435.459 4.380 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC[C@H](CNC(=O)C(C)(C)C)C3)c2C)c1 1313132719 OUXIUUIYFHMAMC-OAQYLSRUSA-N 438.616 4.486 10 10 IICE CN(CC(C)(C)C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1314715691 SRODFVTTZRMNOX-UHFFFAOYSA-N 448.615 4.079 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3=Cc4ccccc4O[C@H]3C(F)F)cc2F)C[C@@H](C)O1 1357836131 NXXFIHSQVMGEOU-ZCCHDVMBSA-N 446.469 4.165 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(CCCOCc2ccccc2)CC1 1436624924 UKWXDYHWHCUEAW-UHFFFAOYSA-N 444.522 4.195 10 10 IICE Cc1cc(CCNC(=O)c2ccc3c(Br)cnn3c2)c(C)n1-c1ccccc1 1438180714 XNUBDQTXDQXPFP-UHFFFAOYSA-N 437.341 4.477 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1c(Cl)cc(F)cc1Br 1440674894 SRJOMSXBOKFCRR-UHFFFAOYSA-N 441.728 4.350 10 10 IICE CN(C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(C(F)(F)F)nn1 1459685460 ZJZHMHUDQNXSTB-UHFFFAOYSA-N 436.434 4.065 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1(C(F)F)CCCC1 1460615064 BYWRNDFGYUUMJF-KAMYIIQDSA-N 428.501 4.111 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCCc4c3ccc(=O)n4C)cc2Cl)C1 1469959564 KSNTXDDKBWDHJI-UZLBHIALSA-N 442.991 4.152 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCC[C@H]2CC)CCOC1 1516140253 DQXGFEALJQUMGL-YDIMBITNSA-N 428.577 4.099 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CC3(CC3)c3ccc(Br)cc32)C1 1533189174 FPJGDEAXLRVQAB-HNNXBMFYSA-N 433.346 4.441 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)C[C@@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1542182222 BLLUFBNIPOWDQQ-RTBURBONSA-N 448.615 4.360 10 10 IICE Cc1cc(C(=O)N(C)[C@@H]2CCN(CC(F)(F)F)C2=O)c(C)n1-c1cccc(C(C)C)c1 1543306606 OTFZEPMGYKFPJB-HXUWFJFHSA-N 435.490 4.453 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCCCC2)n1CCCSc1nccs1 1545907705 PPHDTIIRFCVVFH-UHFFFAOYSA-N 436.651 4.216 10 10 IICE Cc1cc(C(=O)NCc2cccc(N3CCOCC3)n2)c(C)n1-c1cccc(C(C)C)c1 1556301906 YMNVEIADYDKCGW-UHFFFAOYSA-N 432.568 4.379 10 10 IICE Cc1cc(C(=O)N2CC[C@]3(CCCN(C)C3)C2)c(C)n1-c1cccc(Br)c1 1556774865 POKMLBDEHAKXLA-QFIPXVFZSA-N 430.390 4.415 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](CO)c2ccccc2C(F)(F)F)cc1 1558507495 HDQOXJAGTZWQAT-QFIPXVFZSA-N 444.453 4.318 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1565789318 FVRYXRRQARCCGA-NRFANRHFSA-N 439.556 4.344 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1 1566306457 LNJRJTJNIQTEJZ-FQEVSTJZSA-N 441.366 4.150 10 10 IICE Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)nn1-c1ccccc1Br 1566359671 JQSOQDGQOWNHGA-UHFFFAOYSA-N 440.341 4.458 10 10 IICE Cc1cc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c(C)n1-c1ccc(F)cc1 1566491832 JYRBXRHVHPDGTK-LJQANCHMSA-N 428.533 4.473 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1ccc2occc2c1 1585741004 WDRGIDPTDGPMSZ-UNOMPAQXSA-N 440.521 4.480 10 10 IICE CCCCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cc1OCC 1587487308 ZFWCWOBJDLNDIJ-UHFFFAOYSA-N 442.556 4.244 10 10 IICE CCCN(CC)c1nnc(-c2noc3c2COCC3)n1Cc1ccc(N(CC)CC)cc1 1614686061 SITZAHOBEOJKIR-UHFFFAOYSA-N 438.576 4.137 10 10 IICE CCOCc1nnc(N2CC[C@H](C)[C@@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616775717 VXLVJYWORJFZFW-RXVVDRJESA-N 429.634 4.041 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1 1617879951 QEVGMXYMSSGUTN-LJQANCHMSA-N 444.597 4.255 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1(Cc2ccccc2)CCOCC1 1630262309 KLWWTZOVNYDJJV-QFIPXVFZSA-N 442.987 4.166 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c(C)n1-c1ccccc1 1634049870 QVFRYCHEBCALCE-RXFWQSSRSA-N 430.596 4.456 10 10 IICE CC[C@@H](C)c1nc([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n[nH]1 1634754526 IPGIXPRWGHXJFS-DGCLKSJQSA-N 445.365 4.374 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1 1636267044 LSFNJKJWGONTOO-WMZHIEFXSA-N 443.595 4.306 10 10 IICE Cc1c(Br)cc(C(=O)NCc2cccc(Br)c2O)cc1[N+](=O)[O-] 1640083821 IVCBKRUSHNIUIO-UHFFFAOYSA-N 444.079 4.064 10 10 IICE Ic1cc2ncnc(NCCCSc3nccs3)c2s1 1651496037 YAWFZGCHSZOBGV-UHFFFAOYSA-N 434.353 4.347 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@]3(C)Cc3cccc(F)c3)C2)cc1 1682188145 HUGWBKSQUKAOIC-CJFMBICVSA-N 425.548 4.467 10 10 IICE CC(C)(C)[C@@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c2ccccc21 1685244728 VUTVCPHURVHGMP-JOCHJYFZSA-N 434.584 4.248 10 10 IICE CC(C)OCCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1692618059 WYEFHYMEKBPUKS-JOCHJYFZSA-N 441.620 4.224 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H]2c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1694108833 SEXQCBNNPMHUPY-JXFKEZNVSA-N 425.556 4.120 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCO2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1708313024 PNMVHNPPXDWPNU-OAQYLSRUSA-N 427.593 4.291 10 10 IICE COCC1(C)CCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CC1 1712190389 RDTOSIWTMRCZIK-MRXNPFEDSA-N 437.635 4.021 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H](c1cccs1)N1CCCC1 1728983532 OXKIKXFVHJIJAE-IBGZPJMESA-N 441.601 4.055 10 10 IICE CCOCc1nnc(N2CCCC[C@@H](SC)C2)n1CCCSc1nccs1 1729051116 BFZRGRYNUNJOOS-OAHLLOKOSA-N 427.665 4.175 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(-c2ccc(F)c(F)c2)[nH]n1 1868178073 KOGGWAXORDDYST-UHFFFAOYSA-N 429.382 4.383 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(C)C)c(CO)c2I)c(O)c1 2078982877 CQERNMAODORWIJ-KRWDZBQOSA-N 426.298 4.117 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@@H]1NCc1cc(Br)ccc1O 2144145371 RMTXEHVTVILOKT-HKUYNNGSSA-N 433.346 4.435 10 10 IICE COc1ccc(C=C2SC(=S)N(CCC(=O)Nc3cccc(F)c3)C2=O)cc1OC 2296881594 QDWQONQRXRDZND-UHFFFAOYSA-N 446.525 4.073 10 10 IICE COc1ccc(OC)c(C=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)c1 2297327534 VYBUSGBNBBPGCO-UHFFFAOYSA-N 429.432 4.447 10 10 IICE COc1cc(C=C2C(=O)N(c3ccc(NC(C)=O)cc3)N=C2c2ccccc2)ccc1O 2297366070 WIJRTCUVGNJOPY-UHFFFAOYSA-N 427.460 4.194 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(OC)c1OC 2313609916 OLVQQYVIZDGFGT-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CCC1=NN(Cc2ccccc2F)C(=O)C1=Cc1cc(Br)cc(OC)c1O 2332124785 PJFQSWZCWIAHFD-UHFFFAOYSA-N 433.277 4.494 10 10 IICE O=C(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 20710273 HJGRQAURCQFWEW-JFNLIGNMSA-N 435.480 4.036 10 10 IICE C[C@H](Sc1ncc2ccccn12)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 26372404 OAVSANJHHHJXHF-AWEZNQCLSA-N 427.485 4.229 10 10 IICE COc1ccc(/C=C2\SC(=O)N(CCC(=O)Nc3cccc(C(=O)O)c3)C2=S)cc1 33682876 CSDPVALUPNPXER-BOPFTXTBSA-N 442.518 4.259 10 10 IICE O=C(NN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S)c1ccncc1 40867476 LVVXSUDJCQGHQR-ZHZULCJRSA-N 447.541 4.207 10 10 IICE CC(=O)Nc1cccc(N/C=C2/C(=O)N(c3ccc(Br)c(C)c3)N=C2C)c1 103646280 XDDWWFQKFFMNIR-WOJGMQOQSA-N 427.302 4.434 10 10 IICE CC(C)NC(=O)c1ccc(NC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 586692185 GYQBMLWQRUJJGE-UHFFFAOYSA-N 427.460 4.244 10 10 IICE CC(C)c1sc(NS(=O)(=O)c2ccccc2S(C)(=O)=O)nc1-c1ccccc1 727248605 JLFURCXUDKUVPU-UHFFFAOYSA-N 436.580 4.138 10 10 IICE Cc1c(F)cccc1-c1ccc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)o1 734556675 XEFMQSWMWZMLQS-XSFVSMFZSA-N 446.569 4.318 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741180869 DNUMCNFAAPYGAC-VQTJNVASSA-N 434.458 4.436 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741212397 OEAXJULXVFJKFW-UXHICEINSA-N 434.458 4.184 10 10 IICE C[C@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(N2CCOCC2)cc1 777811680 VPASZSRTUJIJDF-SIKLNZKXSA-N 436.600 4.207 10 10 IICE CCOC(=O)c1csc([C@H]2CCCN2Cc2cc(C)cc(Br)c2O)n1 792195665 DFKGCFKVJKJEOY-OAHLLOKOSA-N 425.348 4.433 10 10 IICE O=S(=O)(/C=C/c1ccccc1Br)NCc1cc(Br)ccc1O 796190587 JSZZFVLNITZAKG-BQYQJAHWSA-N 447.148 4.008 10 10 IICE CCO[C@@H]1C[C@]2(NC(=O)N(Cc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)C2=O)C1(C)C 804188242 KYDYUXSWMCHPFH-FCORRRHLSA-N 433.980 4.202 10 10 IICE CC(C)(C)OC(=O)N1CCc2cc(C(=O)NCc3cc(Br)ccc3O)ccc21 804736479 VNSGHFJBPIGOEB-UHFFFAOYSA-N 447.329 4.382 10 10 IICE Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(Cl)n1 919252830 NJPDKOYRZFTFJB-ZDUSSCGKSA-N 448.862 4.003 10 10 IICE Cc1cc(C(=O)OCC(=O)NC2CCN(C3CC3)CC2)c(C)n1-c1ccc(C(C)C)cc1 928988559 JXCGYPKWFJGGJL-UHFFFAOYSA-N 437.584 4.117 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)COc1cc(Cl)c(Cl)cc1Cl 1142686463 DGUQLUSKBYCKAN-UHFFFAOYSA-N 446.714 4.323 10 10 IICE O=C(NCc1ccc2cccnc2c1O)C1(c2ccc(Br)cc2)CCOCC1 1142727965 IUKIYAUVSBDSDA-UHFFFAOYSA-N 441.325 4.068 10 10 IICE CCOC(=O)C1([C@H](C)NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)CCOCC1 1157687126 SHKQWTCVIXPNQE-FQEVSTJZSA-N 426.557 4.189 10 10 IICE Cc1cc(C(=O)CN2C(=O)CN(/C=C\c3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 1165537310 LCXOAHFNGPKQLY-SEYXRHQNSA-N 431.467 4.351 10 10 IICE COC1CCN(c2ccc(CN[C@@H]3CN(Cc4ccccc4)C[C@H]3C(F)(F)F)cc2)CC1 1176137794 PDVFBNJYANYWGW-DNQXCXABSA-N 447.545 4.454 10 10 IICE Cc1cc([C@](C)(O)Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)c(C)o1 1289295786 SNNICOGOTKVBKV-RUZDIDTESA-N 438.572 4.470 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCC(OC(C)C)CC1 1289423765 PEPZJWGVNYEZOC-UHFFFAOYSA-N 448.615 4.080 10 10 IICE Cc1nnc(N2CCC(CC(F)(F)F)CC2)n1Cc1ccc(N2CCSCC2)cc1 1290783182 JNMFQWRDJGMFAT-UHFFFAOYSA-N 439.551 4.357 10 10 IICE CCN(CC(C)C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1295289099 VQOMZAPJAHRCLG-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC[C@@H](Cn1c(CC(C)C)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1305835888 MUYFTNIKBXINFI-SFHVURJKSA-N 431.581 4.122 10 10 IICE COc1ccc(N2CCCN([C@H](C)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1307424482 RXFUMBDYYCEPSY-LEWJYISDSA-N 435.612 4.352 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnc3scc(-c4ccccc4)n3c2=O)cc1 1318159739 AVEJRTHWJZLOGZ-UHFFFAOYSA-N 432.549 4.199 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C(CC)CC)C2)sc2c1CC[C@@H](CC)C2 1349974185 HXKBZIOWPZPEOB-CABCVRRESA-N 434.602 4.415 10 10 IICE COC(=O)C[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(C)cc1 1352506195 HSFAFXFOYYXAAW-QFIPXVFZSA-N 434.536 4.258 10 10 IICE CCCCS(=O)(=O)CC(=O)Nc1sc(C)c(-c2ccc(C)cc2)c1C(=O)OCC 1355889176 VVMMDNQGMJVFPL-UHFFFAOYSA-N 437.583 4.362 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncoc1CCC(F)(F)F 1361062909 IAYJYKXJVJAIPA-GFCCVEGCSA-N 433.377 4.170 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCC(=O)c2ccc3c(c2)CCC3)cc1 1442604089 UKJIYPQULPQAGW-VWLOTQADSA-N 434.580 4.412 10 10 IICE C[C@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786227 LNWNSASKSIRDPC-HTAPYJJXSA-N 429.511 4.484 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCOC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1494754470 WNZIZIOOIBZFLE-FQEVSTJZSA-N 441.620 4.334 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1514252425 HHZONVFXMNOVOV-SQJMNOBHSA-N 437.588 4.129 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1 1517428878 XGCSLUBXDDUXCU-UHFFFAOYSA-N 448.615 4.361 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)cc2Cl)C1 1524244262 BZZSYSIKOSOFQN-AWEZNQCLSA-N 445.903 4.186 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3C[C@H]3c3ccc(OC(F)(F)F)cc3)C2)cc1 1526246322 JJIOUTIAWBFBNI-ONGXBYRLSA-N 434.458 4.340 10 10 IICE CC1(C)Cc2cccc(C(=O)Nc3cccc(N(CC(N)=O)Cc4ccccc4)c3)c2O1 1528781986 UJSBHHNSQFEAAZ-UHFFFAOYSA-N 429.520 4.144 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CO[C@@H]3C[C@@H](C)CC[C@@H]3C(C)C)cc2F)CC1 1537534676 FYGUUJCYTXWEFJ-XZDHIHRUSA-N 433.612 4.061 10 10 IICE Cc1ccc(C(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1544637709 OYRMPSXZQQZGDV-QHCPKHFHSA-N 444.453 4.395 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1545617464 HMMBEQJQFOEMTI-GOSISDBHSA-N 436.604 4.313 10 10 IICE CC[C@H](c1ccccc1)N(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)C(C)C 1560021556 NRQUANHELQWSCD-AZGAKELHSA-N 425.617 4.040 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1564554501 ZEGOAKSRMXJLOX-AHWVRZQESA-N 439.575 4.341 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2CCC(O)(c3ccccc3)CC2)cc1 1567317316 JXTQGMYPKXDDME-UHFFFAOYSA-N 430.548 4.396 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1(C)C 1570018212 ZSHQOZMQSYTNIZ-NVXWUHKLSA-N 435.528 4.274 10 10 IICE COC[C@@]1(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)OCCc2ccccc21 1612443914 OAQWRPOWINWPGE-RUZDIDTESA-N 432.476 4.352 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCS1 1613295207 COIFJOWXDQLEQV-WIYYLYMNSA-N 429.634 4.413 10 10 IICE Cn1cc(C(=O)N2CCCc3cccc(CNC(=O)OC(C)(C)C)c32)c(-c2cccnc2)n1 1617952897 GGKHUUQZXNGWAR-UHFFFAOYSA-N 447.539 4.100 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC[C@H](C)C1 1618785876 JVHQWKZVIJLITO-SFHVURJKSA-N 434.588 4.115 10 10 IICE COc1cccc(-c2noc([C@H](C)NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)n2)c1 1630375779 DPFUHALPXFRMIQ-INIZCTEOSA-N 444.491 4.456 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1630698325 SNQDWVCLBSTJME-XLIONFOSSA-N 431.577 4.054 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(C)c(Oc2ccncc2)c1 1631534384 XVYPMYWNZIPYCU-UHFFFAOYSA-N 440.883 4.357 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cn2nc(C(F)F)cc2C(F)F)cc1 1631612187 JYDPNIOOYRNPHE-MRXNPFEDSA-N 442.457 4.032 10 10 IICE Cc1cc(C(=O)NCCC2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccn1 1631697187 AHBFUTUNWQGLAO-UHFFFAOYSA-N 426.561 4.256 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCC12CCN(C(=O)OC(C)(C)C)CC2 1633818091 DOBXYLQJEHBNCX-PKOBYXMFSA-N 446.588 4.353 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CCCCCC1 1634347923 PJWZHJKPEYSZDB-UHFFFAOYSA-N 444.616 4.194 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)c1 1634956200 VFXSGJVHHKBYNT-QFIPXVFZSA-N 435.911 4.095 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1C[C@H](OC(C)(C)C)[C@H]1n1cccn1 1635334219 CSQDULSPRQJWFO-VJBWXMMDSA-N 439.604 4.212 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C[C@H](O)c1ccccc1Br 1636262676 JBTXVTKZEUNBEZ-IERDGZPVSA-N 448.405 4.130 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC=C(c2ccc(Cl)cc2)CC1 1637228656 NQVICZIMHSMMHS-UHFFFAOYSA-N 425.960 4.300 10 10 IICE COc1cccc(CN2CCC(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c1 1645195690 UZJDHDQTRADCPB-UHFFFAOYSA-N 445.563 4.310 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3F)C3CCCCC3)nc12 1652937734 MDMYFNJFMRNBHH-UHFFFAOYSA-N 426.492 4.086 10 10 IICE Cc1cc(C(=O)Cn2nnc3cc(F)ccc3c2=O)c(C)n1-c1cccc(C(F)(F)F)c1 1652970445 PVNXEWAYTBSJTF-UHFFFAOYSA-N 444.388 4.240 10 10 IICE CCOC(=O)N1CCC([C@@H](C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 1672005439 CDKKMDUPBOLHPB-LJQANCHMSA-N 440.588 4.193 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCc3c[nH]c4c(Cl)cccc34)CC2)cc1 1674897479 DGQXZKVQBSJXNJ-UHFFFAOYSA-N 426.948 4.294 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C(=O)C4CCCCC4)CC3)c2C)c1 1675108256 MKJPBLHGXIMFIO-UHFFFAOYSA-N 436.600 4.337 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCN(c4ccc(Cl)cc4Cl)CC3)C2)cc1 1682647484 XVQOVSDMUAKUIB-KRWDZBQOSA-N 449.382 4.113 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 1683253588 IUOJCNDCBOIENS-JTSKRJEESA-N 447.526 4.377 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccccc3)C[C@@H](O)c3ccco3)C2)cc1 1683503913 FNFDAIVPGCLGOS-ZJSXRUAMSA-N 449.551 4.060 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC1(Cc2cccc(Cl)c2)CC1 1686734816 LSGPKXJTGGJOQY-UHFFFAOYSA-N 427.976 4.341 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)C2)cc1 1687023851 WOPMOBMVVWWCQQ-MJGOQNOKSA-N 433.474 4.492 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(CCOC)CC1 1708507545 MPFZZRKFUSMUEV-FQEVSTJZSA-N 441.620 4.334 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1710025644 IIAKJPAQJYDSGE-NRFANRHFSA-N 434.588 4.097 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N2CCC(CC)(CC)C2)cc1 1766611397 DQTXZCVNJVBGIA-NRFANRHFSA-N 438.620 4.140 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@H]1CCCS1 1767113104 JABAGWMYYCSSTQ-QWFCFKBJSA-N 430.618 4.434 10 10 IICE CON(C)c1nnc(-c2ccc(Br)s2)n1Cc1ccc(N(C)C)c(F)c1 1770234578 PNAUHYFLXOPMII-UHFFFAOYSA-N 440.342 4.020 10 10 IICE COc1cc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)c(OC)cc1Cl 1860084605 WLRQUMSDSGVOMQ-UBKPWBPPSA-N 435.910 4.492 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCC(C)C)C(=O)N(CCCOC(C)C)C2=O)cc1 1873167254 YHRDKBYGWXWPHQ-UHFFFAOYSA-N 437.584 4.235 10 10 IICE CCOc1cccc([C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c1O 1951403764 VKLYXMOCVSQJRO-QFIPXVFZSA-N 433.460 4.455 10 10 IICE COc1ccc(Br)c(CNCC2(C)CCN(C(=O)OC(C)(C)C)CC2)c1O 2236053999 CUQMJPHGLUPKEN-UHFFFAOYSA-N 443.382 4.290 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C(C)(C)C2)c1O 2236055085 OCYSSLKYGRMLPO-CYBMUJFWSA-N 443.382 4.431 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(OCC)cc2)C(=O)C1=Cc1ccc(C(=O)OC)cc1 2296656474 TZOPYLFGTGECQN-UHFFFAOYSA-N 435.476 4.139 10 10 IICE CS(=O)(=O)Oc1ccc(C=C2SC(=S)N(c3cccc(Cl)c3)C2=O)cc1 2297357178 CGUKIXDSQCVFBQ-UHFFFAOYSA-N 425.940 4.084 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)C1=CNc1ccc2c3c(cccc13)C(=O)N(C)C2=O 2297511246 WUZRJTDCYBDFKU-UHFFFAOYSA-N 438.487 4.401 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccc(C)cc3)C2=O)ccc1OCC(=O)O 2297534702 MSOKJHDGKOVRKE-UHFFFAOYSA-N 443.546 4.259 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)ccc1OCC(C)C 2313548834 GWDHSPQBKVCXPG-UHFFFAOYSA-N 428.872 4.050 10 10 IICE C[C@@H](C(=O)Nc1ccc(F)cc1)N1C(=O)C(=Cc2cc(Cl)ccc2O)SC1=S 2314837730 WAQMLBBBLCYTTH-JTQLQIEISA-N 436.917 4.413 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3cccc(O)c3)C2=O)cc1OC)C(=O)O 2314932916 PWXDVCBYTCELQB-HNNXBMFYSA-N 445.518 4.049 10 10 IICE CC[C@@H]1[C@@H](C(=O)NCc2ccc(C)c(Br)c2O)CCN1C(=O)OC(C)(C)C 2381139926 CNOPWUGHHDNGTG-LSDHHAIUSA-N 441.366 4.115 10 10 IICE C[C@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccc(Cl)cc3)s2)C1=O 11636143 XETAKLPJHDIIOL-LLVKDONJSA-N 440.015 4.355 10 10 IICE COc1ccc(N2CCn3c(nc4ccccc43)C2)cc1NC(=O)COc1ccc(C)cc1 19855492 KKCSYSYAAQDSPL-UHFFFAOYSA-N 442.519 4.391 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3ccc(Br)cc3C)CC2)cc1 68976511 XUGXPYUOOUERQJ-UHFFFAOYSA-N 435.387 4.207 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cc(F)ccc3F)[C@@H]2c2ccc(O)c(O)c2)cc1 526555704 HGEXYXCPEOTXGX-OAQYLSRUSA-N 425.387 4.442 10 10 IICE CCc1nc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cs1 730785229 DGKPGURGYSRFBR-NTEUORMPSA-N 437.637 4.065 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)c1 731972785 JSYNKQOLVJPYCU-RJNRQISESA-N 435.471 4.391 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3sc(C4CCCC4)nc3C)CC2)cc1 742491375 LLTOVQCINQGHFX-UHFFFAOYSA-N 442.629 4.060 10 10 IICE CCOc1ccc(CNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1F 743597430 GWCWRYIDDZWHAC-INIZCTEOSA-N 437.462 4.294 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H]1CCCc2cn(C3CCCC3)nc21 764683003 NHTPNIJZPRJSJJ-QFIPXVFZSA-N 439.629 4.428 10 10 IICE Cc1ncsc1/C=C/C(=O)NCc1ccc(N(C)C(=O)/C=C/c2scnc2C)cc1 765478633 ILWUXSZERYOASH-GFULKKFKSA-N 438.578 4.222 10 10 IICE CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)NCc2ccc(N3CCCC3)cc2)CC1 773791872 PNFINPJBNCMWEE-UHFFFAOYSA-N 437.531 4.185 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@]4(CCO[C@@H](C)C4)C3)n2C)c(C)n1-c1ccccc1 800747814 RASNTDMMKGLMQK-MHPIHPPYSA-N 435.572 4.052 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 810167776 NZGZYBLLFMGZGZ-OKILXGFUSA-N 435.565 4.016 10 10 IICE O=C(Cn1c(-c2cscn2)nc2ccccc21)NCc1ccc(N2CCSCC2)cc1 917383692 IPRHZZHMJZUDOK-UHFFFAOYSA-N 449.605 4.029 10 10 IICE CCCOc1ccc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2C)C1=O 1084438799 DWSYDANWMPLHKT-VBKFSLOCSA-N 443.297 4.213 10 10 IICE CCc1ccc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1S(C)(=O)=O 1142528317 RNFWCPXWUXWJQC-UHFFFAOYSA-N 428.598 4.351 10 10 IICE O=C(c1ccnc(Cl)c1Br)N(Cc1ccccc1O)C[C@H]1CCCO1 1151902675 DEAUEJKYJRCCFX-CYBMUJFWSA-N 425.710 4.025 10 10 IICE CCOC(=O)c1sc2nc(CN(Cc3ccc(N(C)C)cc3)C(C)C)nc(N)c2c1C 1167108878 VPKOVBXWQLRCMW-UHFFFAOYSA-N 441.601 4.235 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@H]1CCCOC1 1178048392 UBTYZNMEEMIXKD-QFBILLFUSA-N 435.362 4.028 10 10 IICE CCO[C@]12CCC[C@@]1(NC(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CCO2 1180087265 FUSVJWVPTUYSTK-RTWAWAEBSA-N 448.361 4.057 10 10 IICE CC1(CNC(=O)NCc2c(O)ccc3c2CCCC3)CCN(C(=O)OC(C)(C)C)CC1 1230770062 FWAWVEJIBPREKO-UHFFFAOYSA-N 431.577 4.107 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@@H](C(C)C)CC3)CC2)cc(OC)c1OC 1235062337 XYPZEYNBPOIPPR-RTBURBONSA-N 433.593 4.149 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C3(c4ccccc4C)CCCC3)CC2)cc1 1264273950 YKJFVOIWSILDDQ-UHFFFAOYSA-N 435.612 4.144 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1292235197 GEENKMGFTXCYQH-LJQANCHMSA-N 431.536 4.234 10 10 IICE CC[C@]1(C)CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1292319961 UASPSCKBFAMUBO-AREMUKBSSA-N 439.648 4.459 10 10 IICE O=C(c1cccc(S(=O)(=O)C(F)(F)F)c1)N(Cc1ccco1)Cc1ccccc1O 1294672771 WATMZSPQFSNFCS-UHFFFAOYSA-N 439.411 4.121 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)c1 1295053213 KPMKTVIAACITQP-HXUWFJFHSA-N 448.903 4.076 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCCCO2)n1CCCOC(F)F 1298315711 ZXNAZDPHGDFEPG-HXUWFJFHSA-N 449.546 4.386 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3O)C2)cc1 1299770465 RTLMUFOQLHQPOA-MRXNPFEDSA-N 441.528 4.004 10 10 IICE CSCCCN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1302786302 JEXPIFJTDXXNGW-UHFFFAOYSA-N 447.624 4.149 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1312883684 DZEHMOKJKSOXCH-AUSIDOKSSA-N 425.573 4.088 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCCOC2)n1CCCOC(F)F 1314737780 VBWCUDALDVDDME-IBGZPJMESA-N 449.546 4.038 10 10 IICE COCC1=CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1315866032 MVWLZTOLWAJOPF-UHFFFAOYSA-N 427.568 4.047 10 10 IICE CSCC[C@H](C)N(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)c(F)c1 1316450979 PQHGNOILTCFOIA-KRWDZBQOSA-N 442.608 4.095 10 10 IICE COc1cc(CN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc(OC)c1 1352727338 XTSWLSGNIRWBPC-UHFFFAOYSA-N 435.568 4.084 10 10 IICE CCCOc1ccc(Cl)cc1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1352960500 MDDXQPINXYOAAX-UHFFFAOYSA-N 433.955 4.340 10 10 IICE COC(=O)c1cc(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)n(C)n1 1353001163 WINUFVVQPJCZAV-UHFFFAOYSA-N 441.509 4.061 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(SC)cc3)C2)sc2c1CCCC2 1353964895 RNTNGECFEDLYCH-ZDUSSCGKSA-N 444.578 4.127 10 10 IICE CCOC(=O)N[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1441475002 YWDVGZAMSPOYAT-INIZCTEOSA-N 448.361 4.207 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)C1CCOCC1 1447025278 HSSYDHBJIPGRSJ-HSZRJFAPSA-N 426.557 4.306 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCNC(=O)c2ccc(C(C)(C)C)cc2)cc1F 1465005874 KSLOWUWKYYKEEU-UHFFFAOYSA-N 427.564 4.406 10 10 IICE CCO/C=C\[C@@](O)(CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468481149 LUGAODOGKDEENJ-ZBTAVZRMSA-N 430.854 4.321 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 1469518817 PGBCDHJPLBFPJA-KBMIEXCESA-N 446.636 4.328 10 10 IICE C[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccc1O 1471195022 SLOIFZSDBKRNLQ-IGWPVBGESA-N 432.592 4.313 10 10 IICE CCCCN(CC)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1500445086 HFMCXTWKMUDIQA-UHFFFAOYSA-N 439.629 4.442 10 10 IICE C[C@H]1C[C@H](Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CCO1 1512023215 WPFKHLWNTQCCOJ-JKSUJKDBSA-N 427.936 4.151 10 10 IICE CCc1nnc(N2CC[C@H](CN(CC)CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1513853084 LFFIOGQJNGFWSV-HSZRJFAPSA-N 438.664 4.293 10 10 IICE CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)Nc1ccc(C)cc1N=Nc1ccc(C)cc1 1521179005 VOZWKXSBOKXXLH-UHFFFAOYSA-N 437.544 4.467 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1(Cc2ccccc2)CC1 1523646433 SGGVQMBTHVSXFO-XMHGGMMESA-N 440.565 4.309 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCOc2ccc(Cl)cc2)C1 1524744293 WBLBSOPTEMKANE-UHFFFAOYSA-N 425.960 4.256 10 10 IICE Cc1cc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cc(C)n1 1529385031 OQHAOXOEROJWDH-GZTJUZNOSA-N 431.608 4.058 10 10 IICE C[C@H](Cc1cccs1)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1534082797 VJRGMPNVHOARCE-CYBMUJFWSA-N 434.473 4.135 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCc2ccccc2Br)N(C)C)cc1 1539236045 OHHHDGVUFBDODC-NRFANRHFSA-N 432.406 4.257 10 10 IICE Cc1cc([C@@H]2CCCN2C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)no1 1540260470 VOWVZVIKVQFKNA-KMTKGMGQSA-N 445.541 4.077 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)cc1 1547443887 GBYRNPPRTAYFBN-DFIYOIEZSA-N 441.620 4.069 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C1 1548212811 AYCKJDSQAWZQLK-OAQYLSRUSA-N 437.588 4.252 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@@H](Oc1ccc(Br)cc1)c1ccccc1 1557084918 UDOHANAMVKBTEJ-FQEVSTJZSA-N 428.282 4.297 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3cn(C)c4cc(Cl)ccc34)CC2)cc1F 1564566403 FYDAFVWYRIEPAH-UHFFFAOYSA-N 444.938 4.054 10 10 IICE C[C@@H]1CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC[C@@H]1c1ccccc1 1564895865 XNSGHHWJMCOWPS-XLIONFOSSA-N 429.511 4.137 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H](OCC1CCCC1)c1ccccc1 1565985345 BXDCCEVWPLAVMA-AREMUKBSSA-N 436.596 4.460 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC[C@]2(C1)CC2(F)F 1583444430 GIZXIQRPSMVIPH-RXEWJAMOSA-N 442.578 4.377 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(F)c(N2CCOCC2)c(F)c1 1587475663 ITBSPDBQGUHMOC-UHFFFAOYSA-N 429.511 4.064 10 10 IICE Cc1cc(CNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1587886815 VSHOKXXRDVALFR-JOCHJYFZSA-N 431.536 4.369 10 10 IICE Cc1nnc(N2CCCN(Cc3ccc(F)cc3)CC2)n1CCCSc1nccs1 1612591214 MPBWRBDLYKYCJA-UHFFFAOYSA-N 446.621 4.077 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCO[C@H]1CCCC[C@H]1C 1614012356 QZCSJEROFYYPCS-OFNKIYASSA-N 441.620 4.161 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)c1cccc(N2CCOC2=O)c1 1617877507 CQYPBKZWYKYEOD-QGZVFWFLSA-N 431.492 4.354 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(NC(C)=O)c(Cl)c1 1618427593 WDNDSWLZVLVMNP-UHFFFAOYSA-N 445.947 4.301 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1Br 1618538479 BIVGUDZITJJIQN-UHFFFAOYSA-N 431.374 4.205 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c3ccc(F)cc3F)ccc21 1626940668 LNCXYOQAOMOVHW-OAQYLSRUSA-N 445.510 4.229 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1(Cc2ccccc2)CCOCC1 1630262308 KLWWTZOVNYDJJV-JOCHJYFZSA-N 442.987 4.166 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ncsc1Nc1cccnc1 1632040375 QSOKHFGILLTXEE-UHFFFAOYSA-N 445.495 4.282 10 10 IICE C[C@@H](NC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1)c1ccccc1O 1632247334 ZJBUBTQCWODIPK-MRXNPFEDSA-N 431.521 4.004 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1CCOc2c(F)cccc21 1634385291 WIGAIENCPFUHMP-LJQANCHMSA-N 428.504 4.080 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnc2scc(-c3ccccc3)n2c1=O 1639341564 VKSAXVUFDXZLIT-KRWDZBQOSA-N 446.576 4.158 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1C[C@@H](OCC)C1(C)C 1641815480 BQMGZIYANCWYIT-FCHUYYIVSA-N 448.563 4.316 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](CC)OC[C@@H]2C)sc(C)c1-c1ccccc1 1643670860 ZAKKBUJLCCVFSB-MAUKXSAKSA-N 430.570 4.338 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cn(C(F)F)c4ccccc34)C2)cc1 1673826504 NGFLZWJVQIDUCH-MRXNPFEDSA-N 428.483 4.371 10 10 IICE CC1(C)CCc2ccccc2[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1676126590 STZJFYBCUHAWGF-DEOSSOPVSA-N 448.611 4.291 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@H](c4ccc(Cl)s4)C3)C2)cc1 1683504107 KXLWZYZTRGTMNY-QAPCUYQASA-N 435.977 4.020 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1686826454 IRFJBBQYGIJSOY-NQIIRXRSSA-N 444.620 4.223 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1([S@](C)=O)CCC1 1693994042 ANSIHLFHXGNQNI-RQZFFVEVSA-N 443.661 4.329 10 10 IICE CCN(Cc1ccccc1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1746219534 MISXBUYUTQADQT-UHFFFAOYSA-N 439.614 4.344 10 10 IICE CC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)[C@@H](C)C1 1749846287 KHKDMMHHIGSTDD-FQEVSTJZSA-N 448.615 4.456 10 10 IICE CC[C@@H]1CCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763366652 KRQTYFMDNLWQSZ-OAQYLSRUSA-N 425.621 4.211 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CCCCCC2)cc1 1766608882 SDPAZBGIVVGJMQ-UHFFFAOYSA-N 447.587 4.200 10 10 IICE CCN1CCC[C@@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1767060606 PGQLTMAMAZTQMP-KCZVDYSFSA-N 441.620 4.023 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)C1 1768361484 NPBMWJADVSEJHY-NHCUHLMSSA-N 431.675 4.298 10 10 IICE CCOC(=O)c1c(NC(=O)C2CCN(C(=O)CC)CC2)sc(C)c1-c1ccccc1 1860626207 FAGYBUGKXNEPGV-UHFFFAOYSA-N 428.554 4.487 10 10 IICE COC(=O)c1c(NC(=O)c2cnc(SC)nc2O)sc(C)c1-c1ccc(C)cc1 1866083169 OPHMQFNHNWBFHX-UHFFFAOYSA-N 429.523 4.288 10 10 IICE CC(C)(c1ccc(O)c(O)c1)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1952542445 DAJZBIUNHKXVDM-QHCPKHFHSA-N 447.487 4.367 10 10 IICE CN(C)c1ccc([C@@H](O)c2cc(I)ccc2Br)cc1 2106799071 RPHVRDKFFDHYFT-OAHLLOKOSA-N 432.099 4.201 10 10 IICE CCOc1c(Cl)cc(C=C2C(=O)NC(=S)N(c3cccc(C)c3C)C2=O)cc1OC 2294244565 ZEGDJTDYXSWTKP-UHFFFAOYSA-N 444.940 4.195 10 10 IICE CCCN1C(=O)C(=Cc2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 2314414823 NRAXMVGCJXBUNK-UHFFFAOYSA-N 428.583 4.050 10 10 IICE Cc1cccc(C(=O)NN2C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c1 2314716875 XBLVFZQKVVETBJ-UHFFFAOYSA-N 433.898 4.103 10 10 IICE Cc1ccc(CNC(=O)c2csc(NC(=O)OC(C)(C)C)n2)c(O)c1Br 2352948800 UTTNEWQBLDMEEA-UHFFFAOYSA-N 442.335 4.197 10 10 IICE CN(C)c1ccc(CN2CCC[C@H](c3ccnc(SCCN4CCCC4)n3)C2)cc1 11967025 ZJCZDCGQYLFGFF-NRFANRHFSA-N 425.646 4.110 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(c4ccc(Cl)cc4)CCCC3)CC2)cc1 56997618 WDSUSSKULMJRFR-UHFFFAOYSA-N 442.003 4.099 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(NC(=O)C3CC3)cc2N2CCCCCC2)cc1 65166057 IGPRZAHIMJAUOK-UHFFFAOYSA-N 434.584 4.412 10 10 IICE COc1ccc(/C=C2/C(=O)N(Cc3ccc(F)cc3)C(=O)N=C2O)cc1Br 83317845 ZIHHAGWQDLAOEE-RIYZIHGNSA-N 433.233 4.099 10 10 IICE Cc1cccn2cc(Cc3noc(Cn4c5c(c6ccccc64)CN(C(C)C)CC5)n3)nc12 583110329 YTUXDYXIPSQBIJ-UHFFFAOYSA-N 440.551 4.386 10 10 IICE CCCNC(=O)c1cccc(NC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 586699111 MPGUJNMNZKHHPP-UHFFFAOYSA-N 427.460 4.246 10 10 IICE COc1cc(Br)cc(CN[C@@H]2CCc3nc(-c4ccccc4)ncc3C2)c1O 725851769 XKWQGAXVMVEOCA-GOSISDBHSA-N 440.341 4.267 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)C(=O)Nc1nc2c3c(ccc2s1)CCCC3 743955425 JGYICMNVNSEIGP-UHFFFAOYSA-N 435.549 4.014 10 10 IICE COc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Br 768670971 UWHJMBDGZLKPFS-UHFFFAOYSA-N 444.417 4.280 10 10 IICE CCS[C@H](C)c1noc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n1 769663001 JEBRCFKFRDDTGE-MRXNPFEDSA-N 442.585 4.348 10 10 IICE CC(C)(C)n1cc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c(Br)n1 779979156 BWPMTJWQBMXQTE-UHFFFAOYSA-N 439.317 4.363 10 10 IICE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(-c2ccccc2)nn1CC(C)C 784028184 VQMFHIWJZKNVKW-UHFFFAOYSA-N 434.540 4.289 10 10 IICE C[C@H](N[C@@H]1CCN([C@@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cc(F)cc(F)c1O 788982830 INQSBZZAEJLWIN-VHKYSDTDSA-N 446.494 4.005 10 10 IICE O=C(CC(F)(F)F)NC[C@@H]1CCCN(Cc2ccc(OCc3ccccc3)cc2O)C1 809690428 QJVBGSRJGLNNCF-SFHVURJKSA-N 436.474 4.252 10 10 IICE O=C(NCc1cc(Br)ccc1O)N[C@H]1c2ccccc2CC12CCOCC2 811954999 JNNXHMCFBMCFNG-IBGZPJMESA-N 431.330 4.048 10 10 IICE Cc1cc(CC(=O)NCc2ccnc(-c3ccccn3)n2)c(C)n1-c1ccc(Cl)cc1 1133134617 TVHMUIVMNLGCNG-UHFFFAOYSA-N 431.927 4.458 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1 1135946496 UMDUTEKVCLSNJS-OAQYLSRUSA-N 446.016 4.360 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCCO3)c2C)c1 1138232136 ZALNURJEDKREJR-RUZDIDTESA-N 431.580 4.423 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1183705819 BAPDFNZHSVCESO-WMZHIEFXSA-N 439.600 4.244 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)NCc1ccc(OC(F)(F)F)cc1 1191654950 KPAJEPNBLXTADV-UHFFFAOYSA-N 430.373 4.256 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCc3sccc3C2)cc1 1290969677 SKXSSGBBFYAQIS-FQEVSTJZSA-N 433.537 4.440 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2COc3ccc(Cl)cc3C2)cc1 1292381716 HSGAGZPDUCGMSU-DENIHFKCSA-N 428.960 4.165 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2COc3ccc(Cl)cc3C2)cc1 1292381717 HSGAGZPDUCGMSU-KNQAVFIVSA-N 428.960 4.165 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(Br)oc1C 1297228919 WHSQTFCNAKQJQM-UHFFFAOYSA-N 437.334 4.353 10 10 IICE CCN(CC)S(=O)(=O)c1cccc(NC(=O)CSc2ncc(C(C)(C)C)s2)c1 1307315374 TYZKSUXEAGQUTO-UHFFFAOYSA-N 441.644 4.202 10 10 IICE COc1cc(N2CCN(C(=O)NC3CC(C)(C)CC(C)(C)C3)CC2)cc(OC)c1OC 1312409055 MTVRQSZDPPAVCU-UHFFFAOYSA-N 433.593 4.149 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC(C)(C)c2ccccc2Br)N(C)C)cc1 1313420886 ZZXLKNIZDPHDHN-FQEVSTJZSA-N 447.421 4.352 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1313677267 NDDPOWMCXLBSNG-IBGZPJMESA-N 434.588 4.238 10 10 IICE CCN1CCCC[C@@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1313909254 QEVMYPSUPPSSME-LJQANCHMSA-N 440.979 4.210 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)cc1 1360068762 MBOLLVYUTHKAJP-LJQANCHMSA-N 441.400 4.115 10 10 IICE COC(=O)c1cc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)n(-c2ccccc2)n1 1438314472 RZVZSGVZRGXWGK-UHFFFAOYSA-N 442.519 4.305 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCCN(c4cccc(Cl)c4C)CC3)C2)cc1 1470771123 ATFOLLNQKOFWFU-LJQANCHMSA-N 442.991 4.158 10 10 IICE Cc1ccc([C@@H]2CCCCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)o1 1471370032 OTTOUPWFIAFBDT-QFIPXVFZSA-N 438.572 4.117 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cc(I)cn3)c2C)cc1F 1472994745 ZCOMJWBJUPMWQQ-UHFFFAOYSA-N 437.256 4.226 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(N(C)C)cc1 1478325274 WNLPNGOMHZVGLC-ORAYPTAESA-N 435.355 4.225 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C(C)C 1500734681 FAUJAIPHWFJQFY-UHFFFAOYSA-N 436.604 4.361 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccc(C)o4)n3CCC(C)(F)F)CC2)cc1F 1504297416 WVSNNXXGOWHGQH-UHFFFAOYSA-N 449.477 4.366 10 10 IICE CN1CCc2ccc(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)cc21 1520155260 FXEGLKWBNSRMOS-XDHOZWIPSA-N 441.553 4.048 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CCCC2 1525377896 GMMJYQKRFLFDQQ-KRWDZBQOSA-N 440.565 4.179 10 10 IICE CCc1nc(C)c(COC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)o1 1527910640 HXKPNFICQBNTQY-XNTDXEJSSA-N 436.580 4.332 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](c3ccccc3F)N3CCOCC3)c2C)c1 1534759928 OOTZXSPYCWPXJV-VWLOTQADSA-N 435.543 4.231 10 10 IICE CCc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c2c(CC(C)(C)C)noc2n1 1536523195 BPZPIWFXZQATCH-UHFFFAOYSA-N 449.599 4.056 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)C1 1537815368 RQITYNVEYHXRBN-CCLHPLFOSA-N 432.612 4.215 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(Br)c(F)c2)cc1 1542488677 LIAGBMCALRYHFZ-IBGZPJMESA-N 449.364 4.405 10 10 IICE COCc1nc(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cs1 1555324077 ZJCRBAVBICFIAI-UHFFFAOYSA-N 440.617 4.289 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1NCC(F)(F)F 1597431355 CJLYDKSPICTPAN-UHFFFAOYSA-N 432.490 4.445 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1cccc2ccccc12 1597567324 JUQKYRUSANTGFK-OAHLLOKOSA-N 427.884 4.168 10 10 IICE CCOc1ccc(N(CC(=O)N2CCC(NC(=O)c3ccccc3C)CC2)CC2CC2)cc1 1620499283 KOURNZLJEODHEM-UHFFFAOYSA-N 449.595 4.031 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1 1624625860 FOWUEHPAYRQASR-FQEVSTJZSA-N 438.547 4.328 10 10 IICE CC[C@]1(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)OCCc2ccccc21 1629212337 UJRHLGPYWSMVEG-HHHXNRCGSA-N 430.548 4.444 10 10 IICE Cc1nc(O[C@@H](C)C(F)(F)F)ccc1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631219152 OGKMHCDURPPGCD-RDJZCZTQSA-N 438.446 4.247 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCCC2(CCCC2)CC1 1632736362 SMXSGFFDOMLQFI-UHFFFAOYSA-N 434.583 4.441 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 1638529576 RKNDLQKWWYCZHQ-UHFFFAOYSA-N 448.306 4.090 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nc(CNC(=O)OC(C)(C)C)sc1C 1639340745 DQCIWWYTAAHQBP-HNNXBMFYSA-N 446.617 4.212 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3ccnc(CSc4ccccc4)n3)cc2)CC1 1640418755 QAUNEVULPZXPCN-UHFFFAOYSA-N 433.581 4.083 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCCCC[C@H]3Cc3ccccc3Cl)nc12 1643240164 FLJXMNWXEMNXDZ-SFHVURJKSA-N 442.947 4.252 10 10 IICE C[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)(C)c1ccccc1 1653998294 UDVMIWSNGQETIX-QGZVFWFLSA-N 426.516 4.356 10 10 IICE COc1cc(N2CCCC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1655850625 PABWFTWFGCAELC-QFIPXVFZSA-N 435.521 4.230 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(CCC(F)(F)F)Cc3ccccc3)cc2)CC1 1675580530 PKNVQBMOHHACRK-UHFFFAOYSA-N 434.506 4.103 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@H]1CSCCN1Cc1ccccc1 1681538841 CMBQDHIPGQTCRM-KRWDZBQOSA-N 440.396 4.116 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1[C@@H]2Cc3c(Br)cccc3[C@@H]21 1686827265 ZJZVINBFHGSLBW-GSXQUDMHSA-N 442.401 4.392 10 10 IICE CN(Cc1ccccn1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1696702654 FOGBBSGJONGYCW-QGZVFWFLSA-N 430.603 4.190 10 10 IICE COCC1(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CCC1 1697813014 HWRLWIBNOPHYMQ-TZIWHRDSSA-N 442.604 4.355 10 10 IICE CC(C)=CCCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1706207470 FWLGHNWZAKDNFS-UHFFFAOYSA-N 432.572 4.169 10 10 IICE C[C@@H]1CCC[C@@](Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1708027833 RKHYIGYKLHDNFG-DZRGJMJISA-N 441.620 4.025 10 10 IICE CC[C@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1709258702 NAPUSUNIHIMIDY-OALUTQOASA-N 429.584 4.442 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1709839272 ATGLRASOBDIYLA-UHFFFAOYSA-N 432.572 4.035 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC3(SC)CCC3)CC2)cc1F 1711866096 PEDGHMVZUKCKRF-UHFFFAOYSA-N 433.597 4.162 10 10 IICE CC(C)C1CCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)CC1 1723219223 QWMXHSOHHCAVKH-UHFFFAOYSA-N 431.635 4.190 10 10 IICE C[C@@H](c1cccc(O)c1)N(C)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1741785153 WVKGORJAXGRNJR-RDJZCZTQSA-N 445.614 4.324 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCOC1 1748380229 IOSPYLJWABZDMH-CTNGQTDRSA-N 437.588 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N(CC)C(C)C)cc1 1766608263 LXVCHFAZYHHARR-UHFFFAOYSA-N 435.576 4.055 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CC[C@H](F)C3)CC2)cc1 1770258297 NKEJFBNDYRTCHV-OALUTQOASA-N 429.584 4.439 10 10 IICE CCOc1ccc(CC(=O)NCc2ccc(C(=O)Nc3cccc(N(C)C)c3)cc2)cc1 1859103596 VEOLNHVCIIOXKI-UHFFFAOYSA-N 431.536 4.263 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@H](NCc2c(O)cccc2Br)C1 1966034787 VGUSJHUZMFRHCU-QGZVFWFLSA-N 425.367 4.424 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C(F)F)c(CN)c2I)c(O)c1 2079062537 RCVLXZMSNIABDT-CQSZACIVSA-N 435.256 4.143 10 10 IICE Cc1cc(C=C2NC(=O)N(Cc3ccccc3F)C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1 2294046458 OYRQTKBPXDYMEK-UHFFFAOYSA-N 434.427 4.234 10 10 IICE COc1ccc(OCCCOc2c(C=C3SC(=S)N(C)C3=O)cccc2OC)cc1 2297347781 SNDPVGABKAPNLO-UHFFFAOYSA-N 445.562 4.383 10 10 IICE CCOC(=O)[C@H](C(C)C)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2297580066 KWMCGNCXTRKJAY-AWEZNQCLSA-N 428.373 4.238 10 10 IICE Cc1ccc2nc(NC3CCCCC3)c(C=C3SC(=S)N(C(C)C)C3=O)c(=O)n2c1 2314414742 KWOHKFHMINKIDL-UHFFFAOYSA-N 442.610 4.357 10 10 IICE CCCCCOc1ccc(C=C2SC(=S)N(CCCC(=O)OC)C2=O)cc1OC 2314740497 JUIIRYHLZUIIBA-UHFFFAOYSA-N 437.583 4.419 10 10 IICE CCOC(=O)c1ccc(N2N=C(C(F)(F)F)/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1 27570061 ALOWJGUVGIUFQV-AQTBWJFISA-N 431.414 4.278 10 10 IICE O=C(NN1C(=O)/C(=C/c2cccc(OCc3ccccc3)c2)SC1=S)c1ccncc1 40847082 JYNHJKZWTINCFT-ZHZULCJRSA-N 447.541 4.207 10 10 IICE COc1cc(CNC(=O)/C=C\c2ccc(N3CCOCC3)cc2)ccc1OCCC(C)C 209940018 SRCZKIUYVFVQKZ-XFFZJAGNSA-N 438.568 4.286 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc(Br)ccc1O)N2 226725095 AICSEQBLSFOIPN-ZOCZFRKYSA-N 443.341 4.357 10 10 IICE CC(=O)[C@@H](N=Nc1cc(C(F)(F)F)ccc1Cl)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 252601279 DZEAVLGCIUOLBY-OAHLLOKOSA-N 439.781 4.208 10 10 IICE CC(C)NC(=O)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 435550580 GIBJSCJVJAKUBK-UHFFFAOYSA-N 432.568 4.185 10 10 IICE CC(=O)Nc1ccc(-c2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)cc1 564220261 NKCFMDKBJJMCTA-UHFFFAOYSA-N 429.524 4.465 10 10 IICE C[C@@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccc(N2CCOCC2)cc1 727031491 CZBMFBJEICVXJT-CQSZACIVSA-N 443.454 4.394 10 10 IICE COc1cc(C)c(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1C 769699996 MZKFMGUEOIONHZ-UHFFFAOYSA-N 432.523 4.132 10 10 IICE C[C@H](Oc1ccc(Br)cc1)C(=O)NCc1cc(Br)ccc1O 804738927 JQEXKEJMTMULIU-JTQLQIEISA-N 429.108 4.001 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)CC2)cc1 1127188858 DFDZFUBYVDIYIT-UHFFFAOYSA-N 425.529 4.029 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCCN(C(=O)CC2CCCC2)CC1 1136678781 JZJXZEISCMNRAO-UHFFFAOYSA-N 435.568 4.161 10 10 IICE C[C@H](SCC(=O)c1ccccc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1189640971 KVZIFTGMRCOFDV-HNNXBMFYSA-N 429.497 4.405 10 10 IICE CC[C@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccccc1OCC(=O)N(C)C 1264673786 MJYKMLJLAMGRPX-QHCPKHFHSA-N 433.552 4.442 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](OCC3CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1287448872 GZHQBHZHNXTLTE-HXUWFJFHSA-N 429.584 4.125 10 10 IICE CCCCCNC(=O)C1CCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CC1 1290937615 VOPJJTCVGDRWSJ-UHFFFAOYSA-N 439.600 4.074 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCN(CC)[C@@H](C)C2)cc1 1295415168 OPBQNPWHYVVAQD-NRFANRHFSA-N 447.631 4.073 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1 1302671945 NQBPKPSTWWNENY-KRWDZBQOSA-N 428.581 4.249 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1 1302671946 NQBPKPSTWWNENY-QGZVFWFLSA-N 428.581 4.249 10 10 IICE CC(C)[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1302778311 JNQNPKOFCBUTLY-RTWAWAEBSA-N 447.624 4.351 10 10 IICE CC(C)(C)C[C@H]1CCN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1(C)C 1313305531 QETFKDFZUVETEN-HXUWFJFHSA-N 428.621 4.135 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(CCc2ccccc2)CCN(C)C)C1 1350361452 AWAANSNIGAPSDF-UHFFFAOYSA-N 446.639 4.041 10 10 IICE CCOC(=O)[C@@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 1361046806 MNDWJESNFAHBAJ-FDCFBWIESA-N 443.547 4.469 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc3cc(O)ccc23)c1 1443640425 JNRKTHUDAATGPO-UHFFFAOYSA-N 425.488 4.290 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCc3cc(Cl)ccc3Br)C2)cc1 1461496093 OEPOOSQNZFJFSO-INIZCTEOSA-N 437.765 4.439 10 10 IICE CC(C)(C)OC(=O)NCCC[C@H](NC(=O)NCc1c(O)cccc1F)c1ccccc1 1470371513 FJBZVSBAORIEIM-IBGZPJMESA-N 431.508 4.377 10 10 IICE COc1ccc([C@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c2ccccc2)cc1 1470905214 MQPVWISHPBYPAD-AREMUKBSSA-N 445.563 4.245 10 10 IICE Cc1ccc(OCc2nnc(N3CCCOCC3)n2CCCSc2nccs2)cc1 1492376575 BFIBWSVEFHQNFQ-UHFFFAOYSA-N 445.614 4.031 10 10 IICE CC(C)OC1CCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1509841240 POLQZMRUQYIVAG-QFIPXVFZSA-N 445.583 4.167 10 10 IICE Cc1cccc(-c2nnc(N(C)C[C@@H]3CCCCO3)n2CCCSc2nccs2)n1 1511093723 WXGZIEMCXFJZMU-KRWDZBQOSA-N 444.630 4.293 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CCC2=CCCCC2)CCOC1 1516140995 HDGAYHIXDAAEOY-XMMPIXPASA-N 426.561 4.163 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn(-c3cccc(Br)c3)c2)cc1 1516600954 YXUNTNBOGUKHMY-UHFFFAOYSA-N 427.346 4.411 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@H]1CCCCO1 1517147725 LOGJZAQHRBGHCY-SFHLNBCPSA-N 428.577 4.108 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1cc(Br)nc(Br)c1 1520358832 HJNANSGQJLSBQS-UHFFFAOYSA-N 432.459 4.049 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2 1523542961 ZCENCNXRVYZDGW-UHFFFAOYSA-N 437.540 4.085 10 10 IICE CCc1[nH]c(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c(C)c1C(=O)OC 1524245935 UEUQLYJAATZIFF-AWEZNQCLSA-N 431.964 4.492 10 10 IICE CCC(CC)(C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccc(OC)c(OC)c1 1544745328 OGDDRJHNUSIGAO-UHFFFAOYSA-N 426.557 4.119 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3sc(C4CCCCC4)nc3C)CC2)cc1 1583753251 UKTFULDVVQWSQY-UHFFFAOYSA-N 442.629 4.060 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCCO[C@@H](C)C1 1611963026 FKPYURHUYXCVKA-KRWDZBQOSA-N 440.979 4.031 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NCCCSc1nccs1 1616242126 VCUGVFNTVUHRRJ-QGZVFWFLSA-N 433.599 4.276 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3cc(F)ccc3CS(C)(=O)=O)c2C)c1 1621251975 AUQFPWKVLCACAD-UHFFFAOYSA-N 428.529 4.016 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)c(F)cc1O 1622328116 MSAQMSHYIGUNLW-UHFFFAOYSA-N 447.098 4.424 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)C[C@H](C)NC(=O)OC(C)(C)C 1627448069 JYYCIASWBPOHRY-CVEARBPZSA-N 427.545 4.328 10 10 IICE CN(C)Cc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1628453469 HGXWABMJACSZHR-UYRXBGFRSA-N 443.569 4.117 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@@H](c3cccc(Cl)c3)C(C)C)CC2)cc1 1631442679 GEWACSNTNILBGG-HSZRJFAPSA-N 429.992 4.027 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(c4cccc(Cl)c4)C3=O)c2C)cc1 1634955898 QPKVAHSTAGXSDE-QFIPXVFZSA-N 437.927 4.291 10 10 IICE CCCO[C@H](C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O)c1ccc(F)cc1C 1637247642 RFTZHABQCZJIIM-NRFANRHFSA-N 437.895 4.163 10 10 IICE CC(C)(C)OC(=O)NCCCN(Cc1ccc(N2CCOCC2)cc1)CC1CCCC1 1643034039 FCEOHGXUFQYMHW-UHFFFAOYSA-N 431.621 4.430 10 10 IICE COc1ccc(N(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)Cc2ccccc2)cc1 1653734959 ZYGCSWYABDDGDV-UHFFFAOYSA-N 449.576 4.380 10 10 IICE COC(=O)c1cnc(SC[C@@H](CNC(=O)OC(C)(C)C)c2ccc(F)cc2)s1 1656580921 QUBDICTUPCTTSC-CYBMUJFWSA-N 426.535 4.469 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)C2)cc1 1682188665 XXKYGJAYFIGPHK-ICSRJNTNSA-N 438.528 4.019 10 10 IICE CN(Cc1csc2ccccc12)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683195585 HGUINOYSLUKSEV-UHFFFAOYSA-N 431.508 4.358 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(c4ccc(N(C)C)cc4)CC3)C2)cc1 1683339600 AVEGACHFAZGUAL-FQEVSTJZSA-N 436.600 4.177 10 10 IICE COc1cccc(CN(CCN(C)C)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 1687216705 GRJGRRDESVJLLF-UHFFFAOYSA-N 448.611 4.419 10 10 IICE Cc1cc(CCNC(=O)N2CCO[C@@H](COc3ccccc3)C2)c(C)n1-c1ccccc1 1687216785 JKHBHYBWWKNSRW-RUZDIDTESA-N 433.552 4.126 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCc2cc(F)cc(NC(=O)OC(C)(C)C)c2)c1 1687475907 ALPPXHZVMGCXPV-ZDUSSCGKSA-N 433.480 4.447 10 10 IICE Cc1nnc(N2CCC[C@@H](CN3CCC(C)CC3)C2)n1CCCSc1nccs1 1707897609 KUCODQMQAJYELV-IBGZPJMESA-N 434.679 4.174 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1709219767 HXWOYKAIMCMBPT-FXAWDEMLSA-N 434.588 4.066 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(C2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709473968 HAACAZFERBYVNW-LJQANCHMSA-N 425.621 4.285 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1=CCCCC1 1723560234 KVLFSSOVPHMWNI-UHFFFAOYSA-N 436.604 4.153 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCS[C@@H](C(C)C)C1 1724237343 ZEAQAOSTNAUTKD-JOCHJYFZSA-N 438.645 4.284 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](C)N(CC)CC 1726982568 BGIMTTNFWSNRAU-RTWAWAEBSA-N 442.652 4.247 10 10 IICE CSC[C@H]1CCCN1c1nnc(-c2cccnc2)n1CCCSc1nccs1 1731093626 LVSGOFAELQBNRR-MRXNPFEDSA-N 432.644 4.311 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3Cc3ccc(C)nc3)CC2)cc1 1748848067 SDDTVKDDIOCOLU-UHFFFAOYSA-N 434.588 4.053 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1749662521 GBNPVHPNBFFLMV-UHFFFAOYSA-N 425.602 4.332 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@@H](O)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1763825437 ZFEQZORHWMIAPC-MZKRTTBSSA-N 425.621 4.283 10 10 IICE CC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 1858592010 GCRWUUDAJBPTQK-QUYZQLMHSA-N 443.546 4.339 10 10 IICE CCOc1cc(/C=C2/C(=O)N(c3ccc(C)cc3)N=C2C)ccc1OCC(=O)N(CC)CC 1865675241 VZHMRUAZVPPVPR-PXLXIMEGSA-N 449.551 4.447 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H]2NCc2c(O)cccc2Br)C1 1918963754 OHYIBIZGYVCCMH-FXAWDEMLSA-N 425.367 4.424 10 10 IICE COc1cccc([C@](C)(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c1O 1951737778 IFKXWZWZUNBRGZ-VWLOTQADSA-N 433.460 4.239 10 10 IICE CC(C)(C)OC(=O)N1CCC(C)(C)[C@@H](NCc2cc(Br)cc(F)c2O)C1 1965962195 UZKNVESUFKJYFX-HNNXBMFYSA-N 431.346 4.419 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C(F)F)c(C(=O)O)c2Br)c(O)c1 2079863709 UDZRSPKBAVGTFO-CQSZACIVSA-N 431.233 4.385 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)[C@@H]2CC[C@@H]21 2121183669 LULCLHIYIOIMOP-BPUTZDHNSA-N 429.330 4.171 10 10 IICE COc1ccc(Br)c(CNCCC2(NC(=O)OC(C)(C)C)CCC2)c1O 2227750478 JZUKGLZHMMEQOD-UHFFFAOYSA-N 429.355 4.090 10 10 IICE CCOC(=O)[C@@H]1CCCN([C@H]2CC(=O)N(c3ccc(/N=N\c4ccccc4)cc3)C2=O)C1 245298150 XMVWGUNIZDVFBX-MFQQMFPTSA-N 434.496 4.009 10 10 IICE CCCCCOc1ccc(-c2nc3sc(=Cc4ccc(N(C)C)cc4)c(=O)n3n2)cc1 254704624 NPEPWZVVNHPBSP-UHFFFAOYSA-N 434.565 4.001 10 10 IICE O=C(c1ccccc1)N1CCC(CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 738439401 IRHGDRNLTPGYHC-UHFFFAOYSA-N 436.556 4.227 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCN(c2cccc(C(F)(F)F)c2)CC1 740919596 CHRPWUXFZZNBJU-UHFFFAOYSA-N 430.474 4.113 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 741091815 CIWWTOUJVGQMCG-HXUWFJFHSA-N 447.514 4.341 10 10 IICE Cc1noc(CSc2ccccc2C(=O)NCc2cccc(Br)c2O)n1 765767960 GTQDWCLBYPDLEO-UHFFFAOYSA-N 434.315 4.068 10 10 IICE COCc1nc(C(=O)O[C@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)co1 775080593 VOLKKINCOVSYNG-CQSZACIVSA-N 448.422 4.258 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3ccc4ncsc4c3)n2)cc1[N+](=O)[O-] 775149898 HWWAKFVGBVVWPF-UHFFFAOYSA-N 432.508 4.437 10 10 IICE COc1cc(C)nc(/C=C2\SC(=S)N(C3CCN(Cc4ccccc4)CC3)C2=O)c1 776726504 KCFMAMTUFTWMPB-STZFKDTASA-N 439.606 4.264 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(Cl)s3)cs2)c(OC)c1 777665044 ANGNJBPABGELSF-UHFFFAOYSA-N 446.959 4.352 10 10 IICE O=C(O)/C=C\c1ccc(N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1 796547395 QBKLSXKTUJOTHF-UITAMQMPSA-N 449.429 4.424 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(-c2ccccn2)n1C[C@@H]1CCCO1 802696767 VVKWZUNQCQDZCY-QFIPXVFZSA-N 432.572 4.146 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(C(F)F)nc2ccccn12 1125948736 RABRSQWDXSTGCM-UHFFFAOYSA-N 436.409 4.272 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCCCN3C(=O)c4ccccc4C3=O)c2C)c1 1132043345 DXBUYXHGXPPWJZ-UHFFFAOYSA-N 443.547 4.485 10 10 IICE C[C@@H](Oc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cn1)c1ccccc1 1148701252 PSYAQVRTNXSTRX-LJQANCHMSA-N 431.536 4.113 10 10 IICE CCO/C=C\[C@@](O)(CNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)C(F)(F)F 1159754016 VYLWGMOWYONVMH-ZBTAVZRMSA-N 430.854 4.321 10 10 IICE CC(C)c1nnc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1264270408 QUDULZCSZSDUEF-LCYFTJDESA-N 436.559 4.031 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cnn(-c3ccc(Cl)cc3)n2)cc1 1264452597 VLNBUXTYSQXNFF-UHFFFAOYSA-N 435.915 4.422 10 10 IICE CC[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1nnc2n1CCCCC2 1292525479 BKPUDWDONWGAQZ-JOCHJYFZSA-N 433.556 4.035 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1293606579 FMKNBPDTLBLQGF-UGKGYDQZSA-N 443.661 4.082 10 10 IICE COCCOc1cc(C)ccc1CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1294587759 KOJJJSLIPJQWBL-UHFFFAOYSA-N 434.536 4.479 10 10 IICE CC(C)Cc1nnc(N(C)[C@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1359777253 FHSVDDYVAKCUSJ-OFNKIYASSA-N 425.621 4.376 10 10 IICE CC1(C)OC(=O)c2ccccc2[C@H]1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333612 SCPZXOVUOURZET-YWZLYKJASA-N 444.478 4.106 10 10 IICE C/C=C\COc1cccc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1445881574 IZGPDDCRBVOFGQ-AAOVIMEFSA-N 428.960 4.324 10 10 IICE COc1cccc(-n2ccnc2SCC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c1 1451643871 GSRJMYHIHCCVPS-GOSISDBHSA-N 438.597 4.095 10 10 IICE Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1453986830 ZPRVQAVNRASLSF-UHFFFAOYSA-N 443.906 4.334 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(NC(=O)Cc3cccnc3)cc2)cc1F 1465001849 FEMXHRUWGAVYDG-UHFFFAOYSA-N 434.515 4.178 10 10 IICE CCOC(=O)CS[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2C)c1C)C(F)(F)F 1471402747 OMFXBWUJSQAUKS-SFHVURJKSA-N 442.503 4.360 10 10 IICE CCc1cc2c(NCCCN3CCN(c4ccc(OC)cc4)CC3)nc(C)nc2s1 1472645087 WNXKGSLCXDQCRI-UHFFFAOYSA-N 425.602 4.195 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC3(c4ccc(Br)cc4)CC3)C2)cc1 1478958238 YLAZBKWKOHCOBF-SFHVURJKSA-N 444.373 4.067 10 10 IICE COc1cc(N2CCN(C(=O)C3=C(c4ccccc4)CCCC3)CC2)cc(OC)c1OC 1514840260 XNEXRQVNTROGLL-UHFFFAOYSA-N 436.552 4.389 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1516416599 CMRFSYKMELURRJ-FCHUYYIVSA-N 427.593 4.029 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cccc(OCC=C(C)C)c3)cc2F)CC1 1521011347 ZFZVBIOMUBXGHZ-UHFFFAOYSA-N 425.548 4.243 10 10 IICE Cc1ccc2nc(COc3cccc(C(=O)NCc4ccc(N(C)C)c(F)c4)c3)cn2c1 1528618722 CBQUASBIWKQMCZ-UHFFFAOYSA-N 432.499 4.357 10 10 IICE CC[C@@H](Cc1cccc(Br)c1)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1531730122 QNQHCROLGATZGC-PKOBYXMFSA-N 431.374 4.422 10 10 IICE CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nc1C 1538421129 LFNXCDOVAXBCBK-HNNXBMFYSA-N 429.948 4.386 10 10 IICE CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1538422014 RTTKBMLXFVYULX-HBFSDRIKSA-N 434.024 4.477 10 10 IICE COCCN1CCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C(C)(C)C1 1557329238 ADDCXTFXJWEJLK-UHFFFAOYSA-N 448.405 4.039 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)Cc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1 1566374933 ZCTWZCPSRXJNQK-MRXNPFEDSA-N 440.540 4.114 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@H](C)C(=O)c3ccc(Cl)cc3)cc2F)CC1 1585404105 SPDBQCBITRZTLA-KRWDZBQOSA-N 445.966 4.146 10 10 IICE Cc1cc(C(=O)N2CC(CC3CCOCC3)C2)c(C)n1-c1ccc(Br)cn1 1589619274 XSRUERGHPTZRLF-UHFFFAOYSA-N 432.362 4.140 10 10 IICE CCCN(CC)CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1614712100 MGSVSUZTEAXDPA-UHFFFAOYSA-N 428.968 4.067 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@H]3/C=C\c3ccccc3)CC2)cc1 1616321543 DSUUIWYPLJBFHU-HNFSMERCSA-N 449.639 4.136 10 10 IICE CCSCCCn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1617544279 CUGIXRZMLUULMD-HXUWFJFHSA-N 429.634 4.162 10 10 IICE CCOC(=O)C1([C@@H](C)NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCOCC1 1620629808 CMLMRBJMUYLTNW-GOSISDBHSA-N 438.528 4.379 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(Cn3cccn3)cc2)cc1 1623891626 DNQDFMCCYBCSLW-UHFFFAOYSA-N 426.520 4.010 10 10 IICE C[C@@H](NC(=O)Cc1cc(C(F)(F)F)cc(Cl)n1)c1ccc(N2CCOCC2)cc1 1631363642 WVPNEUHKNNRGTC-CYBMUJFWSA-N 427.854 4.010 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCC(C)(C)NC(=O)OC(C)(C)C 1633348411 AYQBMTUGEZZJEV-UHFFFAOYSA-N 427.545 4.330 10 10 IICE Cc1ccnc(-c2n[nH]c([C@H](C)NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)n2)c1 1634317905 YZNUZGPHYNKUTF-KRWDZBQOSA-N 442.523 4.195 10 10 IICE C[C@@H]1C[C@@H](CCNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC(C)(C)C1 1634872285 ZPYXFKYGZVQOSZ-UYAOXDASSA-N 428.621 4.040 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1cccc(Cl)c1 1636130910 IOIXMEGCJBAUDU-CABCVRRESA-N 440.931 4.241 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@]2(CC(=O)c3ccccc3O2)C1 1636264121 XUMAVIOTBSMJHX-SIBVEZHUSA-N 435.568 4.202 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(CC(C)C)C[C@@H](O)c3ccc(F)cc3)C2)cc1 1636353651 GBEXXNNDVQIQMY-YADARESESA-N 443.563 4.062 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCOC[C@@H]1c1ccc(Br)cc1 1640990913 WBBVGIJTPGZWIX-CQSZACIVSA-N 434.311 4.289 10 10 IICE CCc1nc(C)c([C@@H](C)N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)s1 1652550925 VLXUCTLPTXBTDK-OAHLLOKOSA-N 447.560 4.421 10 10 IICE COC(=O)CN(CCOc1cc(F)cc(Br)c1)Cc1cc(Cl)ccc1O 1653611854 OGHQFVZEQCLESQ-UHFFFAOYSA-N 446.700 4.001 10 10 IICE CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1682096843 BVEXVRWBYRSZRT-PXDATVDWSA-N 437.632 4.083 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1684731761 NXLDVBOSWGCEDX-BGYRXZFFSA-N 430.593 4.122 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](OCC3CC3)c3ccc(Cl)cc3)C2)cc1 1686425915 LZICIAZMSPFSMV-NFBKMPQASA-N 443.975 4.394 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2cc3c(nc2O)CCCC3)cc1 1687378611 IMFWVMXTXYOHBK-UHFFFAOYSA-N 434.540 4.237 10 10 IICE CCC[C@H](C)N(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1695089245 YEEHSNMTSIYMSM-IBGZPJMESA-N 435.620 4.195 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1696425042 YERBWXFIBFZTPD-GOSISDBHSA-N 425.602 4.331 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H](OC)C(C)C)CC2)cc1F 1697471573 GSXGNWHAYCFXMQ-OAQYLSRUSA-N 447.599 4.012 10 10 IICE COCCC(C)(C)Cn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1712314538 JVDWCOFZINECKH-UHFFFAOYSA-N 441.620 4.019 10 10 IICE CCCCN1CCCC[C@H]1Cn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1O 1728075374 ZHGYTPFVUTYZBB-QFIPXVFZSA-N 434.588 4.337 10 10 IICE CCC(CC)(Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1743968727 QBJMPGFZWKZCMO-UHFFFAOYSA-N 449.603 4.177 10 10 IICE CC(C)CCC(=O)N1CCC(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1860606298 UBCHPMNMFZUWPO-UHFFFAOYSA-N 432.520 4.075 10 10 IICE CN(C)c1ccc(C=C2CCc3c2nc2ccccc2c3C(=O)OCC(=O)NC2CC2)cc1 2040475140 AUKPNMNIUFRRCT-UHFFFAOYSA-N 441.531 4.223 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCC23CN(C(=O)OC(C)(C)C)C3)c1O 2236029566 BPPAFWMRSNFLPN-MRXNPFEDSA-N 441.366 4.043 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2ccccc2OCc2ccc(Br)cc2)S1 2293226922 VGIKCDFOOPOLOR-UHFFFAOYSA-N 431.311 4.135 10 10 IICE CSCC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc3cccc(Cl)c3n2)SC1=S 2296604945 LDNSTQMFGXNENZ-CYBMUJFWSA-N 438.983 4.296 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccccc3OC)C2=O)cc1 2296881343 BWCZPFZSZNXLJC-UHFFFAOYSA-N 426.563 4.488 10 10 IICE COc1cc(C=C2C(=N)N3C=C(C)SC3=NC2=O)ccc1OCc1ccc2c(c1)OCO2 2297317082 QMTFPJQVOHBRDE-UHFFFAOYSA-N 449.488 4.170 10 10 IICE COc1cc(OC)c(OC)cc1C=C1C(=O)N(Cc2cccc(F)c2)N=C1C(F)(F)F 2332141170 LLTQPUXUKHIBJR-UHFFFAOYSA-N 438.377 4.196 10 10 IICE Cc1ccc(CNC(=O)c2ccc(CNC(=O)OC(C)(C)C)o2)c(O)c1Br 2380747723 WXQDHZYVDYGIFG-UHFFFAOYSA-N 439.306 4.011 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1C 8608870 ZAHZYRLVRJWOSY-SANMLTNESA-N 449.620 4.452 10 10 IICE COc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)cc1OC 14479316 RDMVAJCVARHDFH-AXHZCLLHSA-N 440.565 4.315 10 10 IICE CCN1CCN(c2cc(C)c3cc(NC(=O)/C=C/c4ccc5c(c4)OCO5)ccc3n2)CC1 20108662 JIMBJMCDCNAGRC-WEVVVXLNSA-N 444.535 4.066 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3cc(F)ccc3F)C2=O)c(C)n1-c1ccccc1 22224361 KBZKDPOYNLBPMW-XMMPIXPASA-N 437.446 4.022 10 10 IICE Cc1cc(C)cc(N2C(=O)N=C(O)/C(=C/c3ccc(I)o3)C2=O)c1 33247509 XITBPXBCNSIDHY-JYRVWZFOSA-N 436.205 4.008 10 10 IICE O=C(CCN1C(=O)/C(=C2\OC(=O)c3ccccc32)SC1=S)Nc1ccc(Cl)cc1 33543065 GMGDDFCWDBIDBZ-WUKNDPDISA-N 444.921 4.068 10 10 IICE CCOc1ccc(-n2c(C)cc(/C=C3\SC(=O)N([C@H](C)C(=O)OC)C3=O)c2C)cc1 38200008 MGARAMHNXJNNDO-VUFYJBQKSA-N 428.510 4.091 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc3c(s2)CCN(C(=O)c2ccc(F)cc2)C3)cc1 65201610 KYISAOKSPWYMDJ-UHFFFAOYSA-N 437.540 4.082 10 10 IICE Cc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccnn1Cc1ccc(N(C)C)cc1 97001786 NWSZQKSNWMFNJH-UHFFFAOYSA-N 449.536 4.465 10 10 IICE COCCNCc1ccc(N2CC[C@H](COCc3ccccc3)C2)cc1Br 384180051 ZYHFCCWUKURFMJ-IBGZPJMESA-N 433.390 4.228 10 10 IICE COCCOc1ccc(F)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435726107 LVTVGDICNIDEKO-UHFFFAOYSA-N 439.531 4.211 10 10 IICE COC[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccc1 727097734 JLYKDOIHTWMXIH-GFWHJHDHSA-N 446.619 4.233 10 10 IICE CCCNc1ccc(CNC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 765535203 JAEAKKQLMXHZBX-UHFFFAOYSA-N 435.616 4.040 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1 769279879 FXONQHGUALTPTH-YYWHXJBOSA-N 426.944 4.478 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)c(OC)c1 777666174 VVMSNUBLPOQFDR-UHFFFAOYSA-N 438.502 4.084 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1 781902590 QHBLRSNARTWOKO-UHFFFAOYSA-N 429.358 4.264 10 10 IICE COc1ccc(CNC(=O)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c(O)c1 793042820 UNHFWWXZRPHROD-PZJWPPBQSA-N 435.927 4.217 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NCc1cc(Cl)cc(Cl)c1O 805365608 UYTRVPMXONTUCT-IAQYHMDHSA-N 432.348 4.144 10 10 IICE CC[C@@H]1CCCCN1C(=O)CN(CC(=O)N1CCCC[C@H]1CC)c1ccc(OC)cc1 914868052 JEFUDDVTHWCBBS-NHCUHLMSSA-N 429.605 4.084 10 10 IICE CCCn1ccc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1 1138192670 YUZBTBPEDYCWML-SFQUDFHCSA-N 433.624 4.257 10 10 IICE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccc(NC(=O)c2ccncc2)cc1 1146962418 HEAMBQIUIWXTJG-CYBMUJFWSA-N 433.489 4.451 10 10 IICE Cc1cc(CC(=O)NCCc2nc3c(s2)COCC3)c(C)n1-c1ccc(Cl)cc1 1157374357 DPXRHNOIHMFWCK-UHFFFAOYSA-N 429.973 4.178 10 10 IICE Cc1ccc(CN(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1C 1161808893 ARWFKCWZYLUKJQ-UHFFFAOYSA-N 430.551 4.144 10 10 IICE CCN(CCOc1ccc(/C=C\C(=O)OC)cc1)Cc1cc(Br)ccc1O 1167512756 QFHKDIQDEJQSNH-WDZFZDKYSA-N 434.330 4.242 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H](C)[C@H](CNC(=O)OC(C)(C)C)C1 1230196291 XUKWGHMLIRARSE-HFSMHLIXSA-N 446.636 4.184 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)Cc1cc2c(cc1OC(F)F)OCO2 1251981623 OAVSGADOXUVZDJ-OAHLLOKOSA-N 449.498 4.164 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(OC(F)F)cc1F 1265567686 XECHNJWTNMDDRA-GFCCVEGCSA-N 430.373 4.427 10 10 IICE Cc1cc(-c2nnc(N(C)CCCCCO)n2C[C@@H]2CC=CCO2)c(C)n1-c1ccccc1 1289356396 RLGHZFNEUNQRLO-QHCPKHFHSA-N 449.599 4.297 10 10 IICE Cc1ccc(I)c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1353910191 HKGQYVVOVYYBNW-UHFFFAOYSA-N 434.321 4.472 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 1357927275 CZHPEOJQQSNVGB-OAHLLOKOSA-N 431.920 4.236 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)c(F)c3)cc2Cl)C1 1436048775 RGKSVBGPAOVJBF-QGZVFWFLSA-N 445.966 4.482 10 10 IICE Cc1ccc(C(=O)N2CCN(Cc3ccc(-c4cccc(F)c4)s3)CC2)c(O)c1O 1441245945 HRMUSUFHPIWQQM-UHFFFAOYSA-N 426.513 4.232 10 10 IICE CN1CCN([C@@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c2ccccc2)CC1 1442444885 FXFCHINZWPEOLD-AREMUKBSSA-N 434.628 4.060 10 10 IICE Cc1cc(C(=O)CN2C(=O)c3ccccc3C(F)(F)C2=O)c(C)n1-c1cccc(F)c1 1459042685 TVTPKLLEVWXBAQ-UHFFFAOYSA-N 426.394 4.190 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2OCCO3)c(C)n1-c1ccc(Br)cn1 1466653534 FXBGMCIXLYFLRN-UHFFFAOYSA-N 428.286 4.275 10 10 IICE Cc1cccc(-c2nnc(N3C[C@H](C)OC(C)(C)C3)n2CCCSc2nccs2)n1 1492505481 BPZPNENNINGSSS-INIZCTEOSA-N 444.630 4.291 10 10 IICE Cc1ccc(-c2nnc(N3CCO[C@H](C(F)(F)F)C3)n2Cc2ccc(N(C)C)cc2C)o1 1510826478 QTTNUQSMMYODNR-IBGZPJMESA-N 449.477 4.037 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(CC)C[C@H]2CCCO2)cc1 1515532510 RANXDYWMOACBPU-FYYLOGMGSA-N 441.620 4.072 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(Cl)c2cc(Cl)ccc2n1 1527481285 ICWOAZVJJNZWNF-UHFFFAOYSA-N 434.298 4.447 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(C)nn(Cc3ccccc3)c2Cl)cc1 1527589896 XLNQXKUHOPUMFU-UHFFFAOYSA-N 426.948 4.110 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC2(CC1)CC2(F)F 1527730521 UDJWXPAZPQXBKF-KAMYIIQDSA-N 442.578 4.377 10 10 IICE Cc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)oc(=O)c2ccccc12 1531504282 QQKKAXOKZQPQLN-HNNXBMFYSA-N 428.435 4.102 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCN2CSCCSC2)cc1 1543115716 TZETYTLAJKTLFW-UHFFFAOYSA-N 445.654 4.382 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(C3CC3)[C@@H](C)c3ccccc3Cl)CC2)cc1 1559525391 LUDJCQSEZJQAGB-SIKLNZKXSA-N 444.019 4.057 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccc(N4CCCNC4=O)cc3)c2C)c1 1565140671 GEBPMAFCALFDRY-UHFFFAOYSA-N 445.567 4.322 10 10 IICE CC(C)(C)OC(=O)N1CCOc2c(cccc2C(=O)NCCCSc2nccs2)C1 1565620011 HTWIECALVGNDNH-UHFFFAOYSA-N 449.598 4.185 10 10 IICE Cc1cc(C(=O)N2CC[S@@](=O)C(C)(C)CC2)c(C)n1-c1cccc(Br)c1 1569100665 PQKNILNYORDPCH-AREMUKBSSA-N 437.403 4.230 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cc(I)ccc1F 1570027530 MLFGOPXASNFMTK-UHFFFAOYSA-N 440.039 4.373 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC(Cc2ccsc2)C1 1585587189 YAKCERVNXRMVCH-ZDLGFXPLSA-N 446.594 4.180 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(F)cc1F 1595435855 NBGJXFXRLXNZJK-NRFANRHFSA-N 445.510 4.447 10 10 IICE CCOc1c(OC)cc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1OC 1625927933 PBAZKWJVKBAGQN-UHFFFAOYSA-N 436.508 4.253 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CC(C)C)C(=O)Nc3nccs3)c2C)cc1 1632029775 CTRNZFWBBAMVNU-FQEVSTJZSA-N 440.569 4.342 10 10 IICE CCO[C@@H]1C[C@](O)(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1635726154 LZXJZTLDYZCHQW-KNQAVFIVSA-N 449.389 4.153 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(N4CCCCC4)cc3C(N)=O)c2C)cc1 1636402151 RPBMTHMGJMMNLK-UHFFFAOYSA-N 446.551 4.444 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(c3ccccc3)C3CCC3)cc2F)C[C@H](C)O1 1655309311 JRUMMQZFYHSCCJ-OALUTQOASA-N 425.548 4.115 10 10 IICE CCOc1ccc(N(CC(=O)Nc2cc(Cl)ccc2-n2cncn2)CC2CC2)cc1 1659793259 TUSSSQHCDCWKLM-UHFFFAOYSA-N 425.920 4.175 10 10 IICE COc1ccc(N2CCN(Cc3cncc(-c4cc(F)ccc4OC)c3)CC2)c(OC)c1 1659861072 KAJAMPPAOVQHCC-UHFFFAOYSA-N 437.515 4.236 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCc1cc(Cl)cc(Cl)c1F 1683018075 DIIBOKWEZRYMFJ-UHFFFAOYSA-N 448.272 4.247 10 10 IICE O=C(NCCc1cnc2c(Cl)cnn2c1)N(Cc1ccccc1O)C1CCCCC1 1686571848 GHZGDPJRQDETNK-UHFFFAOYSA-N 427.936 4.175 10 10 IICE C[C@H]1CC[C@@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1693607254 PYLAMPQZPOHLAB-MSOLQXFVSA-N 429.584 4.224 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](N3CCCCC3)C2)n1CCCSc1nccs1 1694061248 GOTSYFXTBLKQBE-ROUUACIJSA-N 434.679 4.495 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC2(C)C)n1Cc1ccc2c(c1)CCCN2C 1708742608 UABBLTORQQZUCA-UHFFFAOYSA-N 438.620 4.006 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3C[C@@H](C)SC)CC2)cc1F 1711865933 KSOYBMISQJYXAF-MRXNPFEDSA-N 433.597 4.162 10 10 IICE COC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)CCO1 1712282236 ZRHTVPKXHAPHBQ-JOCHJYFZSA-N 437.588 4.250 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@](C)(OC)C1CC1 1727000466 DIHMKNRIGIOOPT-BXKMTCNYSA-N 445.583 4.081 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(C)C)C1 1728197982 IZRRSEVCMJKBCT-OAQYLSRUSA-N 448.615 4.361 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1730849883 AQXDHKAEEYZVDY-NHCUHLMSSA-N 443.636 4.297 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)C[C@@H]1C 1741261823 IFTVYJVICACOGK-FQEVSTJZSA-N 446.599 4.376 10 10 IICE CCSc1cc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)ccn1 1747476415 IIPZSYMCICFJAJ-LJQANCHMSA-N 439.585 4.069 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(OC)nc1OC 1764709567 JKCBUIFYJYIWHW-UHFFFAOYSA-N 446.555 4.269 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCN(C(C)=O)C1 1766039449 BMPBVYXUAMVMLN-NRFANRHFSA-N 434.588 4.067 10 10 IICE CCCOc1ccc([C@H](CC(=O)O)N2C(=O)/C(=C\c3ccc[nH]3)SC2=S)cc1OC 1858588133 RLYAIZOUYKMTJV-LZNAANCOSA-N 446.550 4.229 10 10 IICE COc1cc(C)c(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 1859574473 OSSSQDBENMZCFF-UHFFFAOYSA-N 443.550 4.121 10 10 IICE COc1ccc2c(c1)/C(=C/C(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1)CC2 1865969708 XUGXGEVOXGVHFU-CWCGOZQBSA-N 433.596 4.434 10 10 IICE O=C1c2ccccc2C(=O)c2c1c(C(=O)NCCc1ccc(Cl)cc1)c1ccccn21 1873937907 NECRIADRCVUXMO-UHFFFAOYSA-N 428.875 4.341 10 10 IICE Oc1c(Br)cccc1CN[C@@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156277243 ISUFCJTYSQOJSM-UGKGYDQZSA-N 431.374 4.068 10 10 IICE O=C(C=Cc1ccc(F)cc1)NC(=S)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 2296732943 DARHCYSVIVSTDH-UHFFFAOYSA-N 430.460 4.128 10 10 IICE COc1ccccc1N1C(=O)/C(=C2\C(=O)Nc3ccc(Br)cc32)SC1=S 1748929 RCLJXRBVBORDMS-CCEZHUSRSA-N 447.335 4.186 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@@H](C)C(=O)O)C2=O)ccc1OCc1ccccc1C 33633602 OZVYHFIZDXLQOA-YRIIZNAFSA-N 443.546 4.257 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3csc(-c4ncccn4)n3)c2C)cc1 109132245 ASTQHWLXIWMJDM-UHFFFAOYSA-N 432.505 4.356 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccccc2)SC1=S)NCc1cc(-c2ccccc2)no1 206726790 SGACXPSRCKYPIH-DEDYPNTBSA-N 449.557 4.249 10 10 IICE CCN[C@H]1C(=O)Nc2cc(N(C)CCCOCc3ccccc3)c(Br)cc21 384133525 SWRGEQAGWUUJEF-HXUWFJFHSA-N 432.362 4.095 10 10 IICE [N-]=[N+]=NCc1cccc(C[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)n1 390803520 UOTAOGBEBAUCSP-JOCHJYFZSA-N 443.463 4.426 10 10 IICE CC1CCN(c2ccc(CNC(=O)N3CCC(C(=O)N[C@H](C)C(C)C)CC3)cc2)CC1 731121373 SXPYPAMDJAXSDM-HXUWFJFHSA-N 428.621 4.005 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc(CC(=O)OC)cc3)n2)c1C 733730639 BOTYBIAKBJISIE-UHFFFAOYSA-N 447.582 4.155 10 10 IICE Cc1cc(C)c2c(N)c(C(=O)OCC(=O)Nc3ccnn3CC3CCCCC3)sc2n1 744576512 USRZCDOMYKDLID-UHFFFAOYSA-N 441.557 4.068 10 10 IICE CCN(Cc1cc(F)cc(C(C)=O)c1O)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 750825471 CVSKERWQEYZWFJ-UHFFFAOYSA-N 428.552 4.447 10 10 IICE Cc1cc(C(=O)[C@H](C)OC(=O)/C=C\c2ccncn2)c(C)n1-c1ccc(OC(F)F)cc1 754921553 GUJUYYDMLNUOHF-SGNXQUTQSA-N 441.434 4.313 10 10 IICE Cc1cc(CC(=O)N[C@H](C)Cn2ncc3ccccc3c2=O)c(C)n1-c1ccc(Cl)cc1 764237395 POKZIWVXPKKQOS-MRXNPFEDSA-N 448.954 4.205 10 10 IICE C[C@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)[C@H](O)c1ccc2c(c1)OCO2 787010716 RGTVNJJGESUFFJ-KEYDSSBGSA-N 428.710 4.310 10 10 IICE Cc1oc2c(CN3CC=C(c4ccnn4C)CC3)c(O)ccc2c(=O)c1-c1ccccc1 795656077 OFFARSDYWGRFSS-UHFFFAOYSA-N 427.504 4.497 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1cc(Br)ccc1O)c1ccccc1 804734184 YVJVXHNVHALFAG-UHFFFAOYSA-N 425.282 4.337 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3cccc(Cl)c3C)n2)cc1 915291119 YVUONOKFSMASQP-UHFFFAOYSA-N 449.985 4.251 10 10 IICE Cc1cc(C(=O)NC[C@H]2COC3(CCCC3)O2)c(C)n1-c1ccc(Br)cc1 1137839346 BRJNMPPPDZFRMO-SFHVURJKSA-N 433.346 4.272 10 10 IICE COc1ccc(CN2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1141293538 WOKVPZSZWYEDSF-UHFFFAOYSA-N 431.580 4.380 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1 1141773075 YOMDXOQUSKBSHG-UHFFFAOYSA-N 425.529 4.036 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@H]2CC[C@@H](C1)S2 1147742150 YXPDYMFPOXOOKY-OVLFUESZSA-N 438.665 4.226 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2CN(C)C3=O)c(C)n1-c1ccc(Br)cn1 1161641345 RIPIXWYSGXINKT-UHFFFAOYSA-N 439.313 4.090 10 10 IICE Cc1cc(C(=O)Cn2cnc(C3CC3)cc2=O)c(C)n1-c1cccc(Br)c1 1166977403 KIHIRICVAYCRMW-UHFFFAOYSA-N 426.314 4.174 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3c(C)cc(C)cc3Cl)CC2)c(OC)c1 1175512050 GGNIXCBXQQLLIS-QGZVFWFLSA-N 431.964 4.123 10 10 IICE COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)NCc2cccc(Cl)c2O)cc1 1180409616 FIVGRNRQABYKHL-UHFFFAOYSA-N 428.847 4.376 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)c(F)c1 1192880859 KBCAEAOWRZVADU-IXFSTUDKSA-N 445.554 4.244 10 10 IICE COc1ccccc1[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1noc(C)n1 1293634982 PBGHDINGZQUPKA-QHCPKHFHSA-N 444.491 4.126 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)[C@@H](C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1295512445 KHFIRIGQQDAICV-YWZLYKJASA-N 442.357 4.146 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](OC)C(C)C 1305503229 AFGJERCDMPCSLX-UGKGYDQZSA-N 429.609 4.188 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@](C)(O)CC)CCO1 1306396653 JFXSOYKLOJCLPL-BWKNWUBXSA-N 437.588 4.129 10 10 IICE CCSc1cc(Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)ccn1 1314586116 YPMXAIUNQQOFLS-UHFFFAOYSA-N 434.569 4.181 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1sc(NC2CC2)nc1C 1448686770 OHJWEAUSYXIEKV-UHFFFAOYSA-N 430.574 4.028 10 10 IICE C[C@H]1CC[C@H](c2nc(CC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cs2)CC1 1460742299 SPWOGJYCKUXBFO-JCNLHEQBSA-N 449.567 4.411 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(Br)cc3OC(C)C)C2)cc1 1461497542 SUVSZUUETWVBRF-INIZCTEOSA-N 433.346 4.254 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-n2cccn2)c(F)c1 1467630778 DSVDCIYIZQOVBN-UHFFFAOYSA-N 438.503 4.014 10 10 IICE Cc1cc(CNC(=O)NCCCCn2cc(Br)cn2)c(C)n1-c1ccccc1 1470024784 FUHLBJMMSQNPGP-UHFFFAOYSA-N 444.377 4.333 10 10 IICE COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)NCc2c(O)ccc3ccccc23)cc1OC 1472086152 NYMVDSPTXFHGRJ-WMLDXEAASA-N 434.492 4.087 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 1520595081 LHWGGTRDHKPLIK-UHFFFAOYSA-N 439.581 4.400 10 10 IICE CCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1527481226 GOJIKNIRXQGCKZ-IRXDYDNUSA-N 430.520 4.167 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4cc(OC)cc(OC)c4)CCCC3)C2)cc1 1529411201 BAPNLXOOICSAGA-LJQANCHMSA-N 438.568 4.167 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 1532656338 RBTSGHNKCDHNRU-LMNJBCLMSA-N 443.588 4.436 10 10 IICE Cc1cc(I)cc(C(=O)NCc2ccc3c(c2)CCCN3C)c1C 1542389563 GFCZNGCEJQECFJ-UHFFFAOYSA-N 434.321 4.220 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)Oc1ccc(F)cc1 1556052360 IUMGALMLEBTSLN-NRFANRHFSA-N 444.890 4.237 10 10 IICE COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)Cc1ccc(N2CCC(OC)CC2)cc1 1559626795 XIHOWWWLEQNFDT-JOCHJYFZSA-N 436.474 4.065 10 10 IICE Oc1ccccc1CN(CCCN1CCN(c2ccc(Cl)cc2)CC1)C[C@@H]1CCCO1 1559635282 QXPYRPRJTDXKAX-DEOSSOPVSA-N 444.019 4.239 10 10 IICE COC(=O)[C@@H]1CN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C[C@H]1c1ccccc1 1565162059 KZAOAOPXNHXXFD-LOSJGSFVSA-N 445.563 4.235 10 10 IICE CCCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1583920124 WRJZEXBKTHAMEY-DENIHFKCSA-N 447.620 4.296 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc2cc(Br)cnc2n1C 1585263480 DFMBMCXNKMCMHC-CQSZACIVSA-N 429.362 4.071 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)OCc1ccc(F)cc1 1618427535 SRXCFUFJJSPSJZ-KRWDZBQOSA-N 430.520 4.119 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3ccc(OCc4ccccc4)cc3)CC2)c(OC)c1 1623764513 QATFGGSZYXIZDA-UHFFFAOYSA-N 446.547 4.174 10 10 IICE CC(C)c1cccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1625464861 ZHXANIVCRUGBNH-UHFFFAOYSA-N 430.551 4.308 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1C(F)F 1630288059 PYNKCGUFJFBQDZ-UHFFFAOYSA-N 440.494 4.009 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](c2cccc(Br)c2)N2CCCC2)c1 1630366682 VWHYDSCUOPKQDG-VBKZILBWSA-N 433.346 4.178 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Br)cc1SC 1630481577 VFKDTVCRODLDLL-UHFFFAOYSA-N 438.343 4.082 10 10 IICE Cc1cc(CC(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1632965121 UEOVWADZNYRJDV-OALUTQOASA-N 425.573 4.493 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1633194427 FYGGEMPLTSOVFJ-GMAHTHKFSA-N 430.470 4.287 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccnc1Sc1ccc(Br)cc1 1633594858 AQGCPWNUSDGFLS-UHFFFAOYSA-N 431.311 4.337 10 10 IICE COc1cc(Br)ccc1CNC(=O)NCc1cc(Cl)cc(Cl)c1O 1634520195 MJWKGXJQCVNMEA-UHFFFAOYSA-N 434.117 4.470 10 10 IICE CCc1ccccc1N1C[C@H](C(=O)N(CC)Cc2cc(Br)ccc2O)CC1=O 1635673543 RAHHWBXUQBGSQG-QGZVFWFLSA-N 445.357 4.119 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)c4cccc(C(N)=O)n4)n3)c2C)cc1 1638077661 ZJYUGSWGXGEGPW-UHFFFAOYSA-N 431.521 4.272 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)c2ccccc2Br)c(C)n1-c1ccccn1 1638083169 CBJCZVFBBNOBQD-LJQANCHMSA-N 428.330 4.057 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1oc(CNC(=O)OC(C)(C)C)cc1C 1642998066 WEMHSJDHILRZJI-KRWDZBQOSA-N 429.561 4.348 10 10 IICE CS(=O)(=O)c1ccc(OCCCN2CCCc3cc(OC(F)(F)F)ccc32)cc1 1644823766 SLFSWTZBVHMULK-UHFFFAOYSA-N 429.460 4.210 10 10 IICE Cc1cc(CNC(=O)NCC2=CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1680412759 MTBWXUOJQJXMQE-UHFFFAOYSA-N 438.572 4.461 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 1683253586 IUOJCNDCBOIENS-HTAPYJJXSA-N 447.526 4.377 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)OC(C)(C)C 1683254376 PMUOBRXBDOLYMJ-NYVOZVTQSA-N 444.620 4.175 10 10 IICE C[C@H](NC(=O)NCc1cc(Cl)cc(I)c1)c1ccccc1O 1683343405 UGNCMSPOSJPHFH-JTQLQIEISA-N 430.673 4.211 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C[C@@H](C)O1 1694950778 QEMXIBISYOEBGW-BRWVUGGUSA-N 437.635 4.162 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@]1(C)CCCS1 1696684537 ADZJRMSCOCBQRV-XMMPIXPASA-N 443.661 4.334 10 10 IICE CC(C)Cc1nnc(N2CCC(CN(C)C(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1723301340 XYEQVPGADJTILL-UHFFFAOYSA-N 444.643 4.287 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(C)(COC)CC2)n1Cc1ccc2c(c1)CCCN2C 1726925401 MDPJQZUWUQPPBG-LJQANCHMSA-N 425.621 4.475 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C(C)C)N2CCCC2)n1 1751604155 OWCNXDWWAVNQJV-QFIPXVFZSA-N 434.588 4.111 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1762728717 IKFYYTHBCLGNCD-WOJBJXKFSA-N 434.588 4.050 10 10 IICE CC(C)c1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCOC[C@@H]2C)n1 1868228022 JMCUWKNRVHJTCM-INIZCTEOSA-N 442.519 4.344 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCNCc1c(O)cccc1Br)C(F)(F)F 1913255347 GRQHODWRFCHWIO-CYBMUJFWSA-N 427.261 4.090 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC(NCc3cc(Br)cc(F)c3O)C2)C1 1917735060 DGVXHHMXCVHKJS-UHFFFAOYSA-N 429.330 4.173 10 10 IICE O=C(O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc([N+](=O)[O-])cc1O 1951375003 GZTTWVXRWLUDJP-OAQYLSRUSA-N 448.431 4.355 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2C(F)F)c1O 2236046169 USRUDHRDLYYBBT-NVXWUHKLSA-N 441.316 4.019 10 10 IICE O=C1C(=Cc2ccc(F)cc2)SC(=S)N1CC(=O)N1CCCC[C@H]1c1cccnc1 2296311797 BPOLYMDTYKKTPM-SFHVURJKSA-N 441.553 4.176 10 10 IICE O=C(Cn1cc(C=C2C(=O)Nc3cc(Cl)ccc32)c2ccccc21)NC[C@@H]1CCCO1 2297319116 PYGUOUXPSNUWBQ-KRWDZBQOSA-N 435.911 4.083 10 10 IICE CCOc1cc(N(CC)CC)ccc1C=C1C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 2313548217 PBFGQZMFKHODPI-UHFFFAOYSA-N 441.915 4.251 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2[C@H](C)CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380747960 ZAJFUECQOTVGKR-CJNGLKHVSA-N 441.366 4.115 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476161 BPZKKQIBBYQNHW-ROWOMKEUSA-N 443.525 4.204 10 10 IICE Cc1cc(Br)c(NS(=O)(=O)Cc2ccc(N)cc2)c(Br)c1 20486862 XIPHKACZOVILOP-UHFFFAOYSA-N 434.153 4.044 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@@H]1N[C@H](CC)c1cc(Br)ccc1O 380974456 WWSASLYMAMJXGM-ATLSCFEFSA-N 443.382 4.266 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1 435561440 UQRWHLWZRAEMNP-SFHVURJKSA-N 444.579 4.170 10 10 IICE Cc1ccc(-n2nc(C)c(CC(=O)N3CCOc4cc(N(C)C)ccc43)c2C)cc1Cl 437028663 ZMDJARRSHHKNQT-UHFFFAOYSA-N 438.959 4.485 10 10 IICE C[C@@H](NC(=O)C(C)(C)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 726502666 FLZKHUMNINSJIU-MRXNPFEDSA-N 431.374 4.441 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CCc3[nH]nc(C(F)(F)F)c3C2)cc1 749208727 NQRBBPDLKUMXPI-MRXNPFEDSA-N 446.473 4.421 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@@H](Cn3ccnc3)c3ccc(C)cc3C)CC2)cc1 750292787 XXMDEMGUUVHPCI-VWLOTQADSA-N 447.583 4.218 10 10 IICE C[C@@H](Oc1ccccc1)c1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 762106699 SXGSFIFIJYQXBX-CYBMUJFWSA-N 443.506 4.445 10 10 IICE O=C(N1CCN(Cc2cccc(Br)c2O)CC1)C12CC3CC(CC(C3)C1)C2 768231677 XKCPBPOOFIDDIY-UHFFFAOYSA-N 433.390 4.015 10 10 IICE CO[C@@H](C)c1nc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cs1 785019513 RXEBBXAUMQADPL-INIZCTEOSA-N 427.570 4.315 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(O)c3Br)cc2Cl)C1 800571797 NETQHEZTDROZON-GFCCVEGCSA-N 438.753 4.369 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c(C)n1-c1ccc(F)cc1 804204167 QSZNTPQZYLEXTF-MRXNPFEDSA-N 439.453 4.154 10 10 IICE C[C@@H](Oc1ccccc1Br)C(=O)NCc1cc(Br)ccc1O 804734806 ZUSMBBHQOVAZRA-SNVBAGLBSA-N 429.108 4.001 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cnn(-c4cccc(Cl)c4)c3)cc2F)C[C@@H](C)O1 917707825 BTGCLGFPPRCLHJ-HZPDHXFCSA-N 442.922 4.208 10 10 IICE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1134881690 DOESURHSZYEFSU-PXDATVDWSA-N 448.652 4.049 10 10 IICE Cc1cc(C(=O)N(Cc2ccccn2)C2CC2)c(C)n1-c1ccc(Br)cn1 1135626555 AIBTVOXILDILMD-UHFFFAOYSA-N 425.330 4.451 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2cccc(O)c2)on1 1137081627 ICUIRGAJNZASMZ-OAHLLOKOSA-N 429.423 4.047 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCCN(C(=O)c2ccccc2F)CC1 1142311066 MXGAXPIRRQQFIY-UHFFFAOYSA-N 447.510 4.034 10 10 IICE Cc1ccc(NC(=O)Nc2cccc3c2CCN(C(=O)Cc2ccc(O)c(O)c2)C3)cc1 1143956568 WJXKXVNFJSJXIM-UHFFFAOYSA-N 431.492 4.178 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)COc1cccc2c1OC(C)(C)C2 1149892989 JVTNCRVYUKGMTM-UHFFFAOYSA-N 434.330 4.296 10 10 IICE Cc1cc(C(=O)NCc2ncccc2N(C)C)c(C)n1-c1ccccc1Br 1160312330 BAWFELIQYVLCFU-UHFFFAOYSA-N 427.346 4.248 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1C[C@H](OCC)C12CCCC2 1233605519 XKIBLWPNHWOZHD-RPWUZVMVSA-N 443.632 4.307 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CN(C)C(=O)OCc3ccccc3)cc2Cl)C1 1270438626 AJISWWRYYYGHGI-SFHVURJKSA-N 443.975 4.461 10 10 IICE COc1ccc(N2CCN(C(=O)CC3(CSc4ccccc4)CC3)CC2)c(OC)c1 1287485845 ZZCOKRCWYNFWBM-UHFFFAOYSA-N 426.582 4.315 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2CCC3(CCC3)CO2)NC(=O)OC(C)(C)C)cc1 1293802419 RZRXCVNVYQHDSK-NHCUHLMSSA-N 445.604 4.174 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1 1296536457 GEYUEGREFUYSIS-NRFANRHFSA-N 439.556 4.426 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1306270279 AAFLMDZMEWKICH-IERDGZPVSA-N 439.583 4.018 10 10 IICE CC[C@H](NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1ccc(C)c(F)c1 1312407495 MNWPWWDQBJNTIA-FQEVSTJZSA-N 445.535 4.143 10 10 IICE Cc1cccc(CN(Cc2ccco2)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 1313211649 IJHOZHVYESLGSS-UHFFFAOYSA-N 432.568 4.252 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CC[C@H]1C[C@H](F)C1 1314736410 KGFJIBQUYAYKMR-MXVIHJGJSA-N 429.584 4.187 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3ccc(OC)cc3)n2CCCSc2nccs2)C1 1315910194 GECLNQDEHXRVTE-MRXNPFEDSA-N 445.614 4.065 10 10 IICE Cc1c(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cccc1[N+](=O)[O-] 1351048829 ZBQZKWUYNYLUDK-BOPFTXTBSA-N 446.481 4.239 10 10 IICE COc1ccc([C@@H](C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1460864370 JQHUHDLPTNZSOV-MRXNPFEDSA-N 428.488 4.068 10 10 IICE COc1ccc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1C 1471757367 VCJOUQDTLOCYMG-AWEZNQCLSA-N 446.550 4.063 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC[C@@H]2CC2CC2)sc(C)c1-c1ccccc1 1473822964 OEEIDMYGOBOEMR-IBGZPJMESA-N 442.581 4.340 10 10 IICE CCNC(=O)OC[C@H]1CCCCN1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1479099846 QKNYTBMUSHSNCC-JOCHJYFZSA-N 426.561 4.213 10 10 IICE Cc1csc(CN(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)c1 1492647119 FMKFALDPCWJHDN-KRWDZBQOSA-N 429.565 4.042 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H]3CC[C@@H]32)n1CCCSc1nccs1 1496999730 YZGZQWZEOKEVBI-WBVHZDCISA-N 448.662 4.214 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)CCc2cccs2)cc1 1501838123 KQILYOVDXAMIDN-UHFFFAOYSA-N 449.628 4.314 10 10 IICE CC[C@H](Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1518325973 PSNWRHIBKMSLLX-QHCPKHFHSA-N 442.003 4.346 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCCc1cccc(F)c1 1530320464 PYYPBHPLQFKURX-XMHGGMMESA-N 446.544 4.305 10 10 IICE COc1ccc(N2C[C@@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1544079354 FWOXKCUHGMUAGA-NRFANRHFSA-N 431.536 4.080 10 10 IICE COc1ccc(N2CCN(C(=O)CN(Cc3ccccc3)c3ccccc3)CC2)cc1F 1545606323 LEQNMBAASHJRQV-UHFFFAOYSA-N 433.527 4.190 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1547444918 VUFQJCXDDURNOV-WMZHIEFXSA-N 434.588 4.096 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@]3(C)COC[C@@]3(C)C2)sc(C)c1-c1ccccc1 1559982810 XGACKRASQJIBLV-PSWAGMNNSA-N 442.581 4.197 10 10 IICE COc1cccc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1 1566336700 CZEALYXNJWTDRE-NRFANRHFSA-N 443.341 4.329 10 10 IICE COc1ccccc1[C@@H](CO)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1566786842 KJTKEOCXAOHTDM-LJQANCHMSA-N 443.341 4.329 10 10 IICE COC(=O)[C@](C)(NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccc(Cl)c(Cl)c1 1567725652 XFTBYHDYFBAJCR-LJQANCHMSA-N 440.304 4.438 10 10 IICE Cc1cccc(CS(=O)(=O)CCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c1 1583700935 VXNQXTUMRTVKJT-UHFFFAOYSA-N 442.625 4.385 10 10 IICE O=C(CSc1ccc2c(c1)CCC2)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595574419 XJVXLCKNGUWDDY-HXUWFJFHSA-N 431.001 4.407 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(c4ccc(OC)c(OC)c4)CCCC3)CC2)cc1 1596733481 SLBPUGOQFFGUJA-UHFFFAOYSA-N 438.568 4.263 10 10 IICE CC[C@H](C)c1nnc(N2CCN(CC(F)F)CC2)n1Cc1ccc(N(CC)CC)cc1 1613331046 WUZNEDJABUBACD-SFHVURJKSA-N 434.579 4.073 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)cc(C(=O)OC)c2)cc1F 1616924653 LRLWYYDTFSRUIX-UHFFFAOYSA-N 437.309 4.151 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CCN4C)cc2Cl)C1 1617900149 GKXXOGQMKLQEMC-INIZCTEOSA-N 440.975 4.285 10 10 IICE Cc1ccc(-c2ocnc2C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1622634976 NLZUTFMOKVVJOL-LJQANCHMSA-N 425.916 4.403 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1624626623 UHPFQTUPUVWFSG-NRFANRHFSA-N 427.589 4.282 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)cn2)CC1 1625736969 XHACCZDQWTYQNT-UHFFFAOYSA-N 445.611 4.178 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1CCc2cc(Br)ccc21 1626822375 OETCUIACJNBICT-AWEZNQCLSA-N 425.120 4.263 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc([N+](=O)[O-])c1 1627824511 MISGXMOJFRYKOB-LICLKQGHSA-N 445.497 4.272 10 10 IICE CN(C)c1ccc(CN(C(=O)/C=C\[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc1 1629697433 HFHSYSBZLARPLJ-DQXUBXGMSA-N 427.589 4.447 10 10 IICE CCCCNc1nc(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 1630280566 NNXDKDQTUYLRTD-OAHLLOKOSA-N 438.544 4.284 10 10 IICE CSc1nc(O)cc(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1 1631271825 OXBPSQYATAIYCJ-UHFFFAOYSA-N 447.358 4.004 10 10 IICE Cc1ccc(C(=O)N(C[C@H]2CCCO2)[C@H]2CCSC2)cc1-n1c(C)cc(C=O)c1C 1632984476 JWSSBTHBAMSVHT-FCHUYYIVSA-N 426.582 4.342 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CN(Cc2ccccc2)C[C@]1(C)c1ccccc1 1633820039 ZTQLYUCDLABLRM-MUXSNRJPSA-N 444.575 4.235 10 10 IICE Cc1ccc(C2=NO[C@H](CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)cc1C 1634897177 WJRUPMQZLSLAFQ-DEOSSOPVSA-N 429.520 4.446 10 10 IICE Cc1cc(C(=O)NCCCC(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cn1 1638899891 BWBLLJWFXJRUMQ-UHFFFAOYSA-N 436.350 4.103 10 10 IICE Cc1cc(CN2CC[C@@H](c3ccc(F)cc3)[C@@H](NC(=O)C(F)(F)F)C2)ccc1N(C)C 1643780070 FZEVXCVUOZTJOK-PMACEKPBSA-N 437.481 4.237 10 10 IICE Cc1cc(C(=O)NC2(C(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1cccc(Cl)c1 1646506663 GPXRMWWCIVGCEI-UHFFFAOYSA-N 432.948 4.368 10 10 IICE Cn1cnc2c3c(ccc21)N(C(=O)c1ccccc1CCNC(=O)OC(C)(C)C)CCC3 1648855739 KZRBMTRMTBVIAC-UHFFFAOYSA-N 434.540 4.234 10 10 IICE Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)NCc4cccc(Cl)c4O)cc3C2=O)c1 1653563778 MSJNQTDRXNVVJF-UHFFFAOYSA-N 434.879 4.393 10 10 IICE COC(=O)c1cn(CC(=O)c2cc(C)n(-c3ccc(Br)c(C)c3)c2C)c(C)n1 1656392908 PXXWHERRZVIKHF-UHFFFAOYSA-N 444.329 4.339 10 10 IICE O=C(NCCc1cnc(SC2CCCC2)nc1)NCc1c(O)ccc2c1CCCC2 1686617823 OABTZLJQDOQBPQ-UHFFFAOYSA-N 426.586 4.138 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CC[C@@H](C)C(C)(C)C1 1707305379 YHEZPEFXQJBFCS-CTNGQTDRSA-N 425.621 4.467 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCN(C(C)C)C2)n1 1724477844 IVXMLHUADSJTGU-HXUWFJFHSA-N 434.588 4.111 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N(C)CCCc1ccccn1 1742139412 NSXKUTSUUBFAPW-UHFFFAOYSA-N 443.599 4.170 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(=O)OC)C1 1745077204 YOAIZCJZSQAHRL-CLOLKSBNSA-N 433.556 4.318 10 10 IICE COCCO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C1 1750064409 VEQSUFOBNMIFMK-QFIPXVFZSA-N 437.588 4.250 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1752722407 WSIPRVYLMHXRQL-IAGOWNOFSA-N 444.630 4.483 10 10 IICE CC[C@H](C)c1nnc(N(C)CC(F)(F)F)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763491626 SRCIQBYCHQPEIU-INIZCTEOSA-N 439.526 4.047 10 10 IICE CCOCC(C)(C)Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1766197456 IGSDZXBDFJCMJR-UHFFFAOYSA-N 443.636 4.265 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1nc(-c2cccs2)c(CCC(=O)O)s1 1858070043 CARCGSWPRCCYTM-UHFFFAOYSA-N 426.516 4.137 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccc(C)s4)n4ccccc34)CC2)cc1 1858348419 CZEIEHYZHBSWAD-UHFFFAOYSA-N 432.549 4.342 10 10 IICE C[C@H](C(=O)O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951904171 ZSIPUMNIWPINFS-OYHNWAKOSA-N 447.487 4.268 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C(C)C)c(CO)c2I)c(O)c1 2078984004 MNRVVUKAACXGPF-KRWDZBQOSA-N 428.314 4.363 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C2(C)CC2)c(CN)c1I 2080001471 JFSFVHCMRACJKD-HNNXBMFYSA-N 439.341 4.320 10 10 IICE Cc1cc(NS(=O)(=O)c2cc(Br)sc2Br)ccc1O 2089615621 ONPZHRXFYOFWKD-UHFFFAOYSA-N 427.139 4.088 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3NCc1cc(Br)cc(F)c1O 2169561418 KVOAHMNXCUBTAE-UJNBFMONSA-N 441.341 4.027 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCC[C@H]2CNC(=O)OC(C)(C)C)c1O 2236056743 XHNOWNAACCZUEP-BBRMVZONSA-N 443.382 4.336 10 10 IICE CCOc1ccc(N2C(=O)C(=C[C@@H]3C(=O)N(c4ccccc4)N=C3C)SC2=S)cc1 2297498100 NMGBCVZMTCOMBW-SFHVURJKSA-N 437.546 4.373 10 10 IICE Cc1cccc(-n2c(C)cc(C=C3C(=O)NC(=S)N(Cc4ccco4)C3=O)c2C)c1C 2297625042 KOSQEONECIXINJ-UHFFFAOYSA-N 433.533 4.131 10 10 IICE COc1ccc2c(c1)c(C=C1SC(=S)N(Cc3ccc(C(=O)O)cc3)C1=O)cn2C 2323852050 KYNIWCFTELQZKJ-UHFFFAOYSA-N 438.530 4.287 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)/C2=C\NCc2cccnc2)cc1 16212426 CVENUGUFIVTVBU-CYVLTUHYSA-N 441.516 4.125 10 10 IICE CN(C)c1ccc(/C=C(\NC(=O)c2ccccc2F)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 27519991 CTRXAIHBNJLVQK-HMAPJEAMSA-N 448.454 4.210 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4cc([N+](=O)[O-])ccc4c3=O)c2C)cc1C 33631999 CDRHYVGUEYPRDQ-UHFFFAOYSA-N 430.464 4.212 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1OCC 40940668 HVYLTHRPPKHYTF-UYRXBGFRSA-N 442.562 4.339 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3cccs3)[C@H]2c2ccc(O)c(O)c2)c1 526226770 KXARFPPZOPVYQC-HXUWFJFHSA-N 425.462 4.234 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](CCNCc2cc(Br)cc(F)c2O)C1 715813145 MGOPGZCXMDOELE-IUODEOHRSA-N 431.346 4.467 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cccc4ncccc34)n2)cc1[N+](=O)[O-] 727247651 HLCJQVNGVKQSJA-UHFFFAOYSA-N 426.479 4.376 10 10 IICE CN(c1ccc(CNC(=O)CCC(=O)N2CCOc3ccccc32)cc1)C1CCCCC1 730282267 CJTMBQUCENUDFQ-UHFFFAOYSA-N 435.568 4.278 10 10 IICE COc1ccc([C@H](C)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1F 743506086 KIFGKXYCLAOCHR-HOCLYGCPSA-N 437.462 4.465 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 745835063 ZTIGXRYSZYRAIM-UHFFFAOYSA-N 436.600 4.225 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(N2CCCCC2)cc1 746515307 OJOXEJUKHUPQHN-UHFFFAOYSA-N 447.501 4.462 10 10 IICE COc1ccc(Cn2nc(C)c(CN(Cc3ccccc3O)C[C@H]3CCCO3)c2C)cc1 768503959 AHKOOVAZPUNYNR-XMMPIXPASA-N 435.568 4.444 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1 770153083 DMDUGGKRACDSJX-OAHLLOKOSA-N 435.337 4.235 10 10 IICE C[C@H](NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(N2CCOCC2)c(F)c1 773082855 XCPZHNFFJLEPQK-WMZOPIPTSA-N 440.481 4.183 10 10 IICE COc1cc(Br)c(CN(C)c2cc(OC)c(OC)c(OC)c2)c(OC)c1 780773884 DAJJBPJQDWHEOX-UHFFFAOYSA-N 426.307 4.129 10 10 IICE CN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)(C)c1ccccc1 803616674 KJVJKCLVIQOFTE-UHFFFAOYSA-N 430.551 4.262 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC1(C(F)(F)F)CC1 804606645 XDMDMTSJLGHEBX-XFXZXTDPSA-N 434.530 4.188 10 10 IICE CC(=O)N[C@H](C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)s1 918740394 QAHFVQUJMMTCOD-SNVBAGLBSA-N 425.532 4.009 10 10 IICE Cc1cc(C(=O)COC(=O)C2CCN(CC(F)(F)F)CC2)c(C)n1-c1ccc(F)cc1 919166539 CRJNLRRZXITATI-UHFFFAOYSA-N 440.437 4.233 10 10 IICE CC(C)(C)C(F)(F)CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1131351913 IFQNCUSQIOBLNS-GXDHUFHOSA-N 430.517 4.215 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(N4C[C@H](C)O[C@H](C)C4)nc3)c2C)c1 1132263277 CAWPBZNBTCZKHR-BGYRXZFFSA-N 432.568 4.341 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cc(Cl)ccc2Br)N(C)C)cc1 1134681867 KQSJHEQNFNBGAC-IBGZPJMESA-N 438.797 4.130 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)NCc2c(O)ccc3c2CCCC3)cc1 1137443145 DSBWNVPKUWORSQ-UHFFFAOYSA-N 440.341 4.458 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(OC)cc1 1165498557 NYBVEPZJYGZMHN-NFBKMPQASA-N 444.959 4.450 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCCCOC(=O)[C@@H](C)O 1188366562 ZEOLWICERXDLEE-CQSZACIVSA-N 441.391 4.375 10 10 IICE C[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(F)cc1OC(F)F 1225580813 ISDGJGKZMQERLF-AUUYWEPGSA-N 438.494 4.156 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)OCc2ncsc2Br)CCCC1 1276797129 KAXPHUCWJJWUMV-UHFFFAOYSA-N 435.343 4.491 10 10 IICE CC(C)N1CCCN(c2nnc(CC(C)(C)C)n2CCCSc2nccs2)CC1 1287992586 FTOLFIZYMKHMGE-UHFFFAOYSA-N 436.695 4.426 10 10 IICE CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1289600903 UQQHJCPVSGCLFM-HXUWFJFHSA-N 430.574 4.196 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C[C@@H]1C 1291257288 IOBFTVNNYUOMBS-BGYRXZFFSA-N 439.648 4.216 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cnnn1-c1cc(Cl)ccc1Cl 1291626779 HSIDSQQKPNMXBG-UHFFFAOYSA-N 448.379 4.057 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294859767 OFWPWSCBDNEKPE-KRWDZBQOSA-N 447.988 4.158 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCN1CCCCCC1 1298363957 PNLLXHPZGMEKLQ-UHFFFAOYSA-N 440.979 4.212 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 1298407420 ODMDMQWWSYKZKZ-FQEVSTJZSA-N 431.305 4.459 10 10 IICE CC(C)Nc1cccc(F)c1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1300044816 MXXRKYCTBNPKCX-UHFFFAOYSA-N 449.529 4.466 10 10 IICE CC1=C(Br)CN(c2nnc(C3CC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1304000926 FVDZGZRIJXLTAZ-UHFFFAOYSA-N 434.357 4.288 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@H]1CCN(c2ccccc2F)C1=O 1307464576 IKNMAFPFEFWHRM-QFIPXVFZSA-N 439.531 4.409 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(c3ccc4[nH]ccc4c3)CC2)N(C)C)cc1 1313394130 JERPKKSYJFXIHF-VWLOTQADSA-N 433.600 4.426 10 10 IICE COC(=O)[C@@H]1CC[C@H](C(=O)Nc2nc(-c3cc(C)n(-c4ccc(C)cc4)c3C)cs2)O1 1351052350 ZUIZZIPURALKOS-UXHICEINSA-N 439.537 4.185 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354755457 RYGSPPHWGRCTHD-OAHLLOKOSA-N 449.523 4.405 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC(C)(C)C(C)C)CCOC1 1360324252 MZFJFTOMOFRBNB-XMMPIXPASA-N 430.593 4.343 10 10 IICE CCN(CC)c1nc2sc(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)cc2s1 1436973048 UGKBFUDNMOZYEJ-OAHLLOKOSA-N 444.626 4.469 10 10 IICE Cc1cc(CCNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(C)n1-c1ccccc1 1438179351 NLKGBAYQYLEYEE-UHFFFAOYSA-N 429.480 4.161 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(OC(F)(F)Cl)cc1 1446816246 NBAVPTCWECOKPA-UHFFFAOYSA-N 434.222 4.029 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cnnn1-c1cc(Cl)ccc1Cl 1452050305 IGFSXXXRJGGYBP-UHFFFAOYSA-N 430.339 4.494 10 10 IICE Cc1ccc2c(n1)N(C(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)CCC2 1462593319 KFUDNOZQVZUEGD-AQTBWJFISA-N 441.553 4.100 10 10 IICE CC(C)Oc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1[N+](=O)[O-] 1465951020 HKBJFCGHCFCWFD-SFHVURJKSA-N 447.919 4.135 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3c(F)cccc3F)CC2)N(C)C)cc1 1471547897 PDLYJAZFRJOOIN-XMMPIXPASA-N 444.570 4.298 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccccc3NC3CCCCC3)cc2)CC1 1471912482 OGFBLEKKJUWIRP-UHFFFAOYSA-N 434.584 4.063 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCC[C@@H]1CCCN1C(=O)OC(C)(C)C 1478656189 HHJWNKLQKKIZMD-TZIWHRDSSA-N 446.636 4.471 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC=C(COC)CC2)cc1 1501840179 ZNJHXLAXGDECTA-UHFFFAOYSA-N 432.572 4.018 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CC[C@@H](F)C1 1509131292 FDCAOIWEFUWDAS-NHCUHLMSSA-N 429.584 4.088 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@H]1CCC2(CCCC2)O1 1530756383 QFKDSHVPVWESIJ-GFWHJHDHSA-N 448.585 4.025 10 10 IICE C[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)c(Cl)c1 1535156537 IYLLCDKFJCDLSU-AWEZNQCLSA-N 434.367 4.115 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccc(OC)c(Cl)c1 1537603667 NEQSXDGQUCKJQD-QHCPKHFHSA-N 440.927 4.329 10 10 IICE CC(C)c1ccc(-c2noc(CCC(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)n2)cc1 1539235026 JVMZEHZIITULKE-QHCPKHFHSA-N 449.599 4.278 10 10 IICE Cc1cccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)nc2)c1 1544537543 FPGHBZWZHSEDFI-UHFFFAOYSA-N 431.536 4.321 10 10 IICE CC[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)[C@@H](O)c1c(F)cccc1F 1545596701 XUUXOUSRKMMVGQ-WIOPSUGQSA-N 440.490 4.356 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1 1556367091 SOHXMLYNKHWEDL-KRWDZBQOSA-N 445.357 4.337 10 10 IICE CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1564594226 WPYYRRNESWRXMM-SSKFGXFMSA-N 432.996 4.084 10 10 IICE CCOc1ccc(CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C(C)C)cc1 1565127139 KWCBJDLYYUNNOX-UHFFFAOYSA-N 425.573 4.167 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](c1ccncc1)C1CCCCC1 1566023621 YJKGBELBJCIZGA-XMMPIXPASA-N 425.548 4.162 10 10 IICE CCc1ccc(-n2nc(C(=O)N(C)CCN(C)c3ccc(OC)cc3)c3c2CCC3)cc1 1583622823 VSJPLWKBZBSRRU-UHFFFAOYSA-N 432.568 4.140 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C[C@@H](C)O1 1612969144 YGBMCQSMSYQANS-GASCZTMLSA-N 435.644 4.183 10 10 IICE Cc1ccc([C@H](C)N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)c1 1615239384 CVXDMLMXGZSCEI-ACRUOGEOSA-N 441.591 4.365 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(F)cn1 1617126350 MONQFHTXUDSTOV-UHFFFAOYSA-N 448.546 4.408 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)N3CCCCC3)CC2)c(C)n1-c1cccc(Cl)c1 1623878637 YEKNCCYZVTWQTA-UHFFFAOYSA-N 428.964 4.111 10 10 IICE Cc1ccc(C(=O)NCc2ccc(OCC(F)(F)F)nc2)cc1-n1c(C)cc(C=O)c1C 1624641239 REAZIPVXLCPOGX-UHFFFAOYSA-N 445.441 4.481 10 10 IICE Cc1cc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c(C)n1-c1ccccc1Br 1629575630 ZCNLCAVDWHHYAK-MJGOQNOKSA-N 439.300 4.401 10 10 IICE COc1ccccc1C1(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 1630257443 WLJGWHRWOQSKSN-IBGZPJMESA-N 428.960 4.257 10 10 IICE Cc1ccc(C2=NO[C@H](CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2)cc1 1635004038 UWSNWMCPPJIWJE-DEOSSOPVSA-N 429.520 4.067 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1 1635960059 VNRDXARTUNEBGZ-UHFFFAOYSA-N 447.984 4.327 10 10 IICE Cc1ccc2ccnc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)c2c1 1639445622 GECRYXARLMLETA-UHFFFAOYSA-N 439.518 4.363 10 10 IICE O=C(N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1639503273 CWJSKPMBBJPBNM-GFCCVEGCSA-N 431.819 4.448 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccc(OCC(F)(F)F)n2)cc1 1640132938 HMBJASHZDABSQX-UHFFFAOYSA-N 445.441 4.102 10 10 IICE COC(=O)/C=C\c1ccc(N2CC3(CC(OC)(OC)C3)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 1643213453 DHOLGWUUKQLROQ-MMQQXXMXSA-N 438.480 4.112 10 10 IICE C[C@@](O)(C(=O)NCc1ccc(N2CCCCC2)cc1)c1ccc(F)c(Br)c1 1643398365 OPKWAGDSTHGQNU-NRFANRHFSA-N 435.337 4.102 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2C[C@H](C)O)sc(C)c1-c1ccccc1 1645480023 LAOBPBUJLPOTPP-LPHOPBHVSA-N 444.597 4.464 10 10 IICE Cc1cc(C(=O)NCc2ccc(CCO)cc2)c(C)n1-c1ccccc1Br 1648486222 DGAPQRWLDODKFL-UHFFFAOYSA-N 427.342 4.321 10 10 IICE CCSc1nc(C)c([C@@H](CC)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)s1 1651024566 XMMZBGJNAMNBAU-LJQANCHMSA-N 432.659 4.125 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(C)(c3cccc(Br)c3)CC2)cc1 1652926254 ZLISHWNLCAUXGR-UHFFFAOYSA-N 444.417 4.185 10 10 IICE CCOC(=O)c1sc(C2CCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)nc1C 1671851009 ACDPOSUKOKGMDX-HNNXBMFYSA-N 444.601 4.344 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@H]3CC(=O)N(Cc4ccccc4)C3)c2C)c1 1681102273 RKVTZISREWJVCI-QHCPKHFHSA-N 444.579 4.250 10 10 IICE Cc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)CC2)c1 1681827850 LRNBXZBAPLLRPX-LJQANCHMSA-N 442.007 4.312 10 10 IICE CCc1nnc(N2CCO[C@@](C)(c3ccccc3)C2)n1CCCSc1nccs1 1694756790 UJECIPFVSNYTBY-OAQYLSRUSA-N 429.615 4.231 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1710026954 UKCVYTHQFANVKK-CTNGQTDRSA-N 441.620 4.070 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC3(SC)CC3)CC2)cc1 1730180777 SMOSVSATOJZUTE-UHFFFAOYSA-N 429.634 4.098 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2C[C@H]2CCOC2)c(C)n1-c1ccccc1 1751409416 BRAHBWYNNBXQEE-GOSISDBHSA-N 429.515 4.481 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@@H](C)N(CC)C[C@H]2C)cc1 1766614660 OFOLKSORSRJCNQ-NHCUHLMSSA-N 426.653 4.290 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1770515354 ZMXJYSKIISVGIQ-FXAWDEMLSA-N 433.597 4.105 10 10 IICE COCC(C)(C)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1770712567 USNPRNKFMDJRLJ-JOCHJYFZSA-N 441.620 4.429 10 10 IICE COc1ccc(/C=C2/SC(=S)N(C[C@H](c3ccc(OC)cc3)N(C)C)C2=O)cc1 1858594071 JSYPOLDYKXQNNW-CVNFFVDQSA-N 428.579 4.208 10 10 IICE CC[C@@H](C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2c(Cl)nc3scc(C)n23)SC1=S 1858595605 DUGHPUQGNHMQQQ-OTBLAKSPSA-N 429.976 4.058 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c(Br)c1 1912064241 GUFTVCVQXIEFBT-OALUTQOASA-N 427.342 4.115 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1cccc(O)c1O 1952822971 FXBSRZPUOXDWSG-REWPJTCUSA-N 445.471 4.495 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010392241 YGEQZVDYFDMTFY-WDSOQIARSA-N 431.537 4.176 10 10 IICE COC(=O)c1c(C(F)F)nn([C@@H](c2ccc(OC)cc2O)C(C)C)c1Br 2079874618 HXQPOAYABMAEAX-CQSZACIVSA-N 433.249 4.329 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)c(Br)c1 2187746833 BDSWSJXGWILEHP-OALUTQOASA-N 427.342 4.258 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1O 2236033480 RTOONQNXEHDOKL-KGLIPLIRSA-N 443.382 4.336 10 10 IICE Cc1cccc(N2C(=O)C(=Cc3ccc(-c4cccc(C(=O)O)c4)o3)C(=O)NC2=S)c1C 2293779488 QNRFBPVWLXRJCH-UHFFFAOYSA-N 446.484 4.093 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccccc4OC)c3C)C2=O)cc1 2296397898 GHFXBPDSJHOUPS-UHFFFAOYSA-N 443.503 4.332 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)C2=Cc2ccccc2C(=O)O)cc1 2332131782 DZSDHZPJFJABKK-UHFFFAOYSA-N 430.435 4.363 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(O)c1Br 2381132858 GXUTVQYGPPMVJP-KBPBESRZSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)C2(N(C)C(=O)OC(C)(C)C)CCC2)c(O)c1Br 2381135939 YHABSAORXPPTAE-UHFFFAOYSA-N 441.366 4.211 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc(OC)c1O)N2 14459711 UVOPBZDOGNPAGL-GSHUGGBRSA-N 428.554 4.258 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccccc1Cl)N2)N1CCOCC1 14466046 VPUUIAYDDUFWLK-GSHUGGBRSA-N 430.957 4.187 10 10 IICE Cc1cccc(S(=O)(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc3C2)c1 17135496 WXNUBKBLBLMUSL-AREMUKBSSA-N 449.620 4.139 10 10 IICE COc1ccc(CN2C(=O)/C(=C\c3cc(OC)c(OC)cc3[N+](=O)[O-])SC2=S)cc1 33316945 FHHHQJOOTQUNHE-GIJQJNRQSA-N 446.506 4.022 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)c3ccc(F)cc3)CC2)c(C)n1-c1ccc(F)cc1 62694542 MNXHEIRAHZGXBX-UHFFFAOYSA-N 437.490 4.013 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCc1nc2ccccc2c(=O)n1C1CC1 248048282 MYHIPWNUDGKFLR-UHFFFAOYSA-N 444.579 4.313 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2nnc(CC(F)(F)F)s2)C1 435908004 RZGMXFSVTPPAKQ-UHFFFAOYSA-N 437.491 4.003 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526382990 VMVIRCBOGFWLHQ-QHCPKHFHSA-N 433.460 4.481 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 732473173 YPCMJXNNNGGAMK-LJQANCHMSA-N 442.560 4.067 10 10 IICE CN(c1ccc(CNC(=O)N2CCC(c3nnc4n3CCC4)CC2)cc1)C1CCCCC1 746516897 ASBMTGLPTBQIGM-UHFFFAOYSA-N 436.604 4.082 10 10 IICE O=C(NCCCSc1nccs1)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1 753576597 ZAUDDKSFLYJGBL-MRXNPFEDSA-N 446.425 4.122 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(-c4ccc(Cl)s4)nn3C)CC2)cc1 786532493 CGIIOWPLDYIWII-UHFFFAOYSA-N 431.949 4.165 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c(C)c3F)CC2)cc1F 788758650 QPPKQQCHWFNNRI-UHFFFAOYSA-N 425.273 4.007 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cccc(CC(=O)OC)c3)n2)c1C 811822784 MFVFNBNUIBGEEY-UHFFFAOYSA-N 447.582 4.155 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1 812006630 WXBJBUDSENXJLY-QGZVFWFLSA-N 437.466 4.211 10 10 IICE COC(=O)/C=C/c1ccc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 918736248 UPHPBEWVISBNGZ-OIWRZFCRSA-N 426.313 4.348 10 10 IICE COc1ccc(N2CCC(NC(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 1125815832 BLOLPBWWFVAKEH-OAQYLSRUSA-N 447.620 4.356 10 10 IICE COC(=O)CSc1ccc(OC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1127037820 IJDFYIFGFOCOLB-UHFFFAOYSA-N 439.533 4.399 10 10 IICE CCC[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccn1 1136903840 NCSUTUPIYMUIAK-IFMALSPDSA-N 440.588 4.414 10 10 IICE COc1c(Br)ccc(C)c1C(=O)NCc1cccc(Br)c1O 1139974714 LALHYOWHWRMKTG-UHFFFAOYSA-N 429.108 4.164 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)c1 1140930544 SWQNGSMGWWOPOR-ZLNRFVROSA-N 434.540 4.030 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC[C@@H](C2CCC2)C1 1147998583 HRWRMNLDRCVOCR-HNMKQIAWSA-N 432.586 4.456 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-] 1162061536 BEMIMZCUGFHEPS-UHFFFAOYSA-N 443.447 4.125 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(F)F)CC2)c(C)n1-c1cccc(Br)c1 1170816596 YDWADZDJHNILQF-KRWDZBQOSA-N 427.289 4.353 10 10 IICE CC(C)CN1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)CC1 1287748244 HKGGLLJHWDUJHP-UHFFFAOYSA-N 438.664 4.464 10 10 IICE Cc1cc(-c2nnc(N(C)CCCCCO)n2CC2=CCCOC2)c(C)n1-c1ccccc1 1289355714 HXWIASFFZPKEFS-UHFFFAOYSA-N 449.599 4.298 10 10 IICE Cc1ccc(NC(=O)c2ccc(C)c(O)c2O)cc1S(=O)(=O)Nc1ccccc1Cl 1290398636 PALGBFHYPGTPTQ-UHFFFAOYSA-N 446.912 4.421 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN1CCSCC1 1294419164 OGKRAOZZNYNSCH-UHFFFAOYSA-N 438.645 4.248 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1ccnc(Cl)c1 1299330313 CUSJYFLAYPKPTB-GXDHUFHOSA-N 437.999 4.094 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3Cc3cnc(C)s3)CC2)cc1 1300247487 LWFGGQGUJBWUST-UHFFFAOYSA-N 440.617 4.114 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCOC1 1300958436 VZFJIUPHNCSTTL-RXVVDRJESA-N 437.588 4.108 10 10 IICE CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 1351110885 KVTBEIGISSXLMK-RTWAWAEBSA-N 449.595 4.301 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3N2C(=O)OC(C)(C)C)cc1F 1357200099 IMNRXCSXKDVDFZ-CUWPLCDZSA-N 433.568 4.466 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CSC[C@H]2C(=O)N[C@H](C)C(C)C)c1 1360236125 HXZZAHKBEZFXSV-UZLBHIALSA-N 434.005 4.423 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C 1445651690 CHYPWKHIAXJJLZ-MRXNPFEDSA-N 429.355 4.053 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCS(=O)(=O)C4(CCCCC4)C3)c2C)c1 1446007047 DSMWONYYDJSNDY-UHFFFAOYSA-N 428.598 4.284 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ncccc1C 1459578314 NVHLYKMJGWQMOW-LGMDPLHJSA-N 429.542 4.174 10 10 IICE COC(=O)CCCCCCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1464135003 NDMNBYYUGJPJHF-UHFFFAOYSA-N 436.350 4.105 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1CCc2cc(OC)ccc2C1 1467630670 DHKRBPBSWAVIOV-FQEVSTJZSA-N 438.568 4.189 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)c(C)n1-c1ccccc1 1470849970 NXYNEZQICZKKOL-YTFSRNRJSA-N 437.584 4.256 10 10 IICE COc1cc(N2CCC[C@@H](Nc3cccc(Br)c3)C2)c([N+](=O)[O-])cc1OC 1472774268 CAOJZLAQUZZFSY-OAHLLOKOSA-N 436.306 4.455 10 10 IICE C[C@@]1(Cc2cccc(F)c2)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1479031017 WWBWXEBFNXASPL-VWLOTQADSA-N 425.548 4.094 10 10 IICE CCCN1CCC(Cn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)CC1 1500935464 CFERCZLZLFMODN-UHFFFAOYSA-N 434.588 4.113 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CCOC(C)(C)C)CC2)cc1 1504291837 ADIPUNKWEIRRLW-UHFFFAOYSA-N 441.620 4.476 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@@](C)(O)C1CCCCC1 1517149890 WEFLWBNAIMVUQR-XUZZJYLKSA-N 428.577 4.193 10 10 IICE CC[C@H](C)NC(=O)c1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1542537390 NGCYDDWMKJXTQK-KRWDZBQOSA-N 431.536 4.365 10 10 IICE CSc1ccncc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1545205600 YSNYALQSOHVNLM-MHWRWJLKSA-N 433.555 4.173 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2c(F)cccc2-n2cccn2)cc1 1569175356 SPXKJPIIEGIBNX-UHFFFAOYSA-N 430.483 4.090 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cccc2nsnc12 1587465404 MRZSBIDTCSHFKI-GXDHUFHOSA-N 446.604 4.373 10 10 IICE COc1ccccc1Oc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)nc1 1596359228 RYWRBBDIGFCLTQ-UHFFFAOYSA-N 435.549 4.366 10 10 IICE CCOc1ccc(N2CCN(C(=O)COc3ccccc3OCc3ccccc3)CC2)cc1 1596732921 KYYOKTDGZUIAQY-UHFFFAOYSA-N 446.547 4.392 10 10 IICE CN1CCN(Cc2ccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)cc2)CC1 1597950085 HWLHXMMMSJBGHD-UHFFFAOYSA-N 434.628 4.133 10 10 IICE O=C(CSCc1ccc([N+](=O)[O-])cc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1613673624 DUNMGLHCVLABEE-UHFFFAOYSA-N 432.457 4.242 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1 1616055509 BNLFEYQZITXYHV-UHFFFAOYSA-N 445.563 4.220 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@H]1CCCC2(CCC2)O1 1616245297 LLGGKRBZTWPABX-CLEQQJOVSA-N 448.585 4.025 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CC=C(c4ccc(Cl)c(Cl)c4)CC3)nc12 1617116220 ZFYUAVCGSNTSGI-UHFFFAOYSA-N 447.322 4.208 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 1618427375 LSLPKYCLPKLULP-UHFFFAOYSA-N 439.468 4.343 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3nccn3)nc2)c(C)n1-c1cccc(Br)c1 1625071850 CCGJEFBPHWBMPX-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccccn1 1625822659 DXMGPCOIHGQSQT-QHCPKHFHSA-N 425.916 4.351 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCN2c2ncnc3sc(C)cc23)cc1F 1628769836 LNKHDNUIXUUZKP-FQEVSTJZSA-N 441.576 4.270 10 10 IICE CNC(=O)c1cc(Oc2ccccc2NC(=O)c2cc3cc(O)c(O)cc3s2)ccn1 1628978195 VQUSVWDLIUPKDH-UHFFFAOYSA-N 435.461 4.112 10 10 IICE CSc1ccc(N2C[C@H](C(=O)NCc3cc(Cl)cc(Cl)c3O)CC2=O)cc1 1629133087 VLUDUYXEURMOQC-GFCCVEGCSA-N 425.337 4.090 10 10 IICE Cc1cc(N(C)C)cc(C)c1CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1630275308 PVCFWEBVQMFJQR-GOSISDBHSA-N 431.527 4.299 10 10 IICE C[C@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1630287893 NKIFRRDSHIQEBS-FYYLOGMGSA-N 443.385 4.004 10 10 IICE Cc1ccc(C(=O)NCCNC(=O)CCCc2ccccc2)cc1-n1c(C)cc(C=O)c1C 1630468722 SCBXAJVLIOABCI-UHFFFAOYSA-N 445.563 4.084 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2Cc3ccc(Cl)cc32)NC(=O)OC(C)(C)C)cc1 1634161860 DXBQGUIRKISXAK-RTWAWAEBSA-N 443.975 4.428 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(OCCOC)cc1Cl 1635673181 LBUWAWZSJLTPNG-UHFFFAOYSA-N 442.737 4.496 10 10 IICE C/C=C/[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1638244095 RBOHNQHQCCPMKH-SWAKDPLDSA-N 429.605 4.167 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)Nc1ncc[nH]1 1652503757 VYOOHVGNLXLULZ-UHFFFAOYSA-N 434.363 4.423 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccco3)Cc3ccccc3O)C2)cc1 1673823273 NUGBAIVSYDRFKU-IBGZPJMESA-N 435.524 4.232 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O 1682824612 PNNWLNWWGPRLAG-JPYJTQIMSA-N 440.563 4.175 10 10 IICE Cc1cc(CNC(=O)N(C)[C@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccccc1 1683308362 ZEGVJGXIUWPRRM-QHCPKHFHSA-N 434.515 4.180 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(c4c(Cl)cccc4Cl)CC3)C2)cc1 1683945280 QPQBFVIEGIEZGQ-MRXNPFEDSA-N 449.382 4.113 10 10 IICE CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1687807501 TXGNDYOLAJUIAH-HXUWFJFHSA-N 438.494 4.096 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@H](C3CCOCC3)C2)cc1F 1711006208 HIYGTIVWHYGTBB-HXUWFJFHSA-N 443.611 4.373 10 10 IICE COc1ccc(N2CCN(c3nnc(CC4CCCC4)n3C[C@@H](C)SC)CC2)cc1F 1711866031 NWVQGOUILQMPJR-QGZVFWFLSA-N 447.624 4.237 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1728384123 YEDPQJPJEQATHC-WIYYLYMNSA-N 427.593 4.028 10 10 IICE COC1(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCCCC1 1748492014 RTSNJYJSBCLNFG-UHFFFAOYSA-N 441.620 4.224 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)[C@@H]1C 1752455990 KIPYNIXFNMIIQL-OWCLPIDISA-N 439.676 4.489 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1766222343 CKTQQRYDEKSKGW-UHFFFAOYSA-N 446.599 4.425 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(C4CC4)n4c3ccc3ccccc34)CC2)cc1 1858207152 BIWGYSJTFRCDBP-UHFFFAOYSA-N 426.520 4.336 10 10 IICE Cc1nnc([C@@H](CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c2ccccc2)o1 1868182135 VAOQLHWLAXIYHN-FQEVSTJZSA-N 437.455 4.314 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@@H](N)c1ccc(N2CCCC2)cc1 2044760068 HMLKLUWDGGMTNC-RPWUZVMVSA-N 438.616 4.312 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(C)C)c(CO)c2I)c(O)c1 2078982878 CQERNMAODORWIJ-QGZVFWFLSA-N 426.298 4.117 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C(F)F)c(N)c2I)cc1C 2079849459 XMTOUMCCMMGNJH-AWEZNQCLSA-N 433.240 4.329 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1C(C)(C)[C@@H]2NCc1cc(Br)ccc1O 2119292863 HDTZMWICRWJDEE-OIISXLGYSA-N 425.367 4.278 10 10 IICE O=C(O)c1cc(N2C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)ccc1O 2321681335 FLQJLPFGIQQSHP-UHFFFAOYSA-N 436.854 4.058 10 10 IICE Cc1ccc(CNC(=O)[C@H]2[C@@H](C)CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380748040 ZAJFUECQOTVGKR-XJKSGUPXSA-N 441.366 4.115 10 10 IICE CC(=O)c1ccc(N2C(=O)/C(=C\c3ccc(OCCC(=O)O)cc3)SC2=S)cc1 16907861 LGLUTUWNDKPPBF-LDADJPATSA-N 427.503 4.149 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3C)C2)sc2c1CCCC2 21347632 SDLLPMIACPRYFS-HNNXBMFYSA-N 426.538 4.104 10 10 IICE COc1ccc(N2CCN(c3cc(C(=O)N4CCC[C@@H](C)C4)c4ccccc4n3)CC2)cc1 23336695 VRVCNCSNPWKJJL-HXUWFJFHSA-N 444.579 4.442 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1/C=C1/SC(=S)N(CC(C)C)C1=O 33490818 QGOBKTIBKYIWMI-GZTJUZNOSA-N 444.626 4.462 10 10 IICE C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)/C(=C/c2cccs2)SC1=S 33581944 DOIQIEBTJCEUTF-NCUBORBFSA-N 441.603 4.178 10 10 IICE O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@@H]32)c1 226748110 UBEIWOQSWLPNQS-DXIQSLLYSA-N 425.510 4.206 10 10 IICE CC(C)NC(=O)[C@@H](C(C)C)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 606671878 ACODGNACFTUZCN-KQGZCTBQSA-N 441.416 4.200 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2cnccn2)c(C)n1-c1cccc(C(F)(F)F)c1 735937927 WESMHQYZALFCEC-SREVYHEPSA-N 429.398 4.342 10 10 IICE CC[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1nccs1 737670857 OODUWJKTROURPT-MBFWDRTGSA-N 437.637 4.454 10 10 IICE C[C@@H](NC(=O)NCc1ccc(C(=O)OC(C)(C)C)cc1)c1ccc(N2CCOCC2)cc1 743564065 COGZZMONWURYAQ-GOSISDBHSA-N 439.556 4.039 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@H]3CCCN3C(=O)C(C)C)c2C)c1 748375384 TUYKJANOPFHVJC-OAQYLSRUSA-N 442.581 4.189 10 10 IICE Cc1nc(Cl)ccc1CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 764409007 MYDDAEOGAXDHNM-IBGZPJMESA-N 446.979 4.034 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cccc2c(=O)c3ccccc3[nH]c12 770230241 MRXHXFDHQPQUGK-UHFFFAOYSA-N 429.545 4.165 10 10 IICE Cc1cc(CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc(C)c1O 786743521 HBFUYHSKWSSJDF-UHFFFAOYSA-N 433.499 4.121 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CC[C@@H](C)C2 1124129671 OIAZEMSWGKSHCN-ZIAGYGMSSA-N 444.528 4.180 10 10 IICE CC(C)[C@H](SCc1ccccc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661062 DQALYVCMZHSQRN-QFIPXVFZSA-N 434.552 4.376 10 10 IICE COCc1ccccc1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1136154812 PFQQLHIJSCUFGR-UHFFFAOYSA-N 428.330 4.328 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccc(C)o1 1148739518 AOFJGHLIYZKGOD-QGZVFWFLSA-N 432.318 4.271 10 10 IICE C[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(I)cc1 1150386532 JWGIIMHWNLOOAF-ZDUSSCGKSA-N 435.305 4.296 10 10 IICE Cc1ccc(CCC(=O)NCc2cccc(Br)c2O)c(Br)c1 1156792894 UAHHMQGGQFPNMX-UHFFFAOYSA-N 427.136 4.475 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@H]2c2nccn2C)c(C)n1-c1ccc(Br)cn1 1158741853 MRLXEVROVUENMC-GOSISDBHSA-N 442.361 4.208 10 10 IICE COC(=O)/C=C/c1ccc(N(C)CC[C@H](NC(=O)OC(C)(C)C)C(C)C)c([N+](=O)[O-])c1 1162644307 JNECDYABBNVEER-KAMXEHQASA-N 435.521 4.157 10 10 IICE COc1ccc(N(CC(=O)N[C@H]2CCOc3ccccc32)Cc2ccccc2)cc1OC 1198838122 STEQNPBRDLFKQR-QFIPXVFZSA-N 432.520 4.350 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1 1230200328 IIGADZKSXGEGLC-LPHOPBHVSA-N 432.971 4.363 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@H](NC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1233975110 WRUNDEIGICWUDF-DEOSSOPVSA-N 444.579 4.241 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCC3(Cc4cccc(Cl)c4)CC3)C2)cc1 1251766122 RKJUREBHBCHEJT-LJQANCHMSA-N 427.976 4.497 10 10 IICE CN(Cc1ccccc1O)C(=O)N1CCOc2ccc(NC(=O)OC(C)(C)C)cc2C1 1254799125 FMSQLWYLZPQPJX-UHFFFAOYSA-N 427.501 4.186 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H](c1cccnc1)C1CC1 1266792310 JXPZCIITWPINHY-YWFITGJYSA-N 441.553 4.080 10 10 IICE CC(C)c1nnc(N(C)Cc2ccsc2)n1Cc1ccc(N2CCOCC2)c(F)c1 1287180785 LCYZJMXVKVHTJY-UHFFFAOYSA-N 429.565 4.123 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CCCN(Cc3ccccc3)C2)cc1 1292382612 UTBIQERJVMVMLT-AHWVRZQESA-N 435.612 4.172 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1CCN(C(=O)OC(C)(C)C)C1CC1 1298363627 INQSOIQPNIHULT-UHFFFAOYSA-N 441.576 4.287 10 10 IICE CCOc1ccccc1[C@H](CC(=O)NCc1cc(C)ccc1O)NC(=O)OC(C)(C)C 1301047417 XDIQGVOJGOSWKB-IBGZPJMESA-N 428.529 4.372 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1cn(C)ccc1=O 1306453494 ZWLPEVJYDBFAKN-IBGZPJMESA-N 429.442 4.311 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C/c3ccc(F)c4ccccc34)cc2)C1 1351135851 VSMVRZIYMSWYEE-HKFHZZIHSA-N 431.511 4.010 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(OC)cc1 1355669210 OYZAIKDNSYNTET-RGEXLXHISA-N 444.553 4.479 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3cc4cc(Cl)ccc4[nH]3)cc2F)C[C@@H](C)O1 1357836673 ZVNCCRMNVUXWNQ-GASCZTMLSA-N 429.923 4.433 10 10 IICE Cc1cc(CNC(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1438295811 CWKCNYCXYDGDDU-NQIIRXRSSA-N 429.536 4.305 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1F 1443774543 UYKHCBZEECLSQB-XMSQKQJNSA-N 431.939 4.161 10 10 IICE CC(C)[C@@H](c1ccccc1)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1459576481 WOYURKCCXWJTJK-KYTVRQNUSA-N 441.591 4.385 10 10 IICE CCOC(=O)[C@@](C)(NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1462846821 SCQIFXOHQIFCKX-MHZLTWQESA-N 447.579 4.003 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1463805891 GOAINDJFJIWTGO-QFIPXVFZSA-N 439.556 4.373 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOc1cc(Cl)ccc1Cl 1466399201 NNXYZSFYFODLMO-UHFFFAOYSA-N 446.714 4.323 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1C[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C1 1472197327 JUBWDFNPWAQJJH-OXQOHEQNSA-N 439.556 4.139 10 10 IICE C[C@H]1CCCC[C@H]1OCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1493610958 NMWWXNUDTCWTKR-WMZHIEFXSA-N 435.572 4.201 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CC[C@@H](CCOC)C2)cc1 1501840443 GSZGDGKUPLLBEF-JTHBVZDNSA-N 441.620 4.277 10 10 IICE FC(F)(F)C1=CCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CC1 1505293917 FPASQOIJQGCDLV-CQSZACIVSA-N 445.536 4.467 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1 1519586282 OWIGMRYDUKIALK-IFMALSPDSA-N 429.358 4.084 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)on2)c1 1535558142 JZGZUEWQYGYLSA-HNNXBMFYSA-N 441.915 4.331 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccc(NC(=O)Cc3cccnc3)cc2)cc1 1540538040 VYESYFISRVNACB-UHFFFAOYSA-N 430.552 4.381 10 10 IICE Cc1ccc(CN(C)c2nnc(-c3cnccn3)n2Cc2ccc(N(C)C)cc2C)s1 1542367129 PFSNSAIBGAXRPY-UHFFFAOYSA-N 433.585 4.164 10 10 IICE CO[C@@H]1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1(C)C 1543807839 JFPYACJCEISASV-RTYFKUQISA-N 438.640 4.003 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1NC(=O)CC1(C)C 1547083184 CBCJGUVNJRHZGZ-OAQYLSRUSA-N 434.588 4.114 10 10 IICE CCN(CC(C)C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1547394232 XDLSEDBEZNLEGC-RUZDIDTESA-N 443.636 4.224 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3C[C@@H]2O)c(C)n1-c1ccc(Br)cc1 1588308932 ZLEWAQCPPYKLCF-SFTDATJTSA-N 425.326 4.245 10 10 IICE CC[C@H]1CCCN1c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1614159863 XZGOOWDIOHUMKK-OFVILXPXSA-N 441.620 4.120 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCC[C@@H]2C(C)C)cc1 1615374652 BCUBGEIBAXZHRC-JOCHJYFZSA-N 438.620 4.033 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCN(C)C2CCCCC2)NC(=O)OC(C)(C)C)cc1 1618253096 KKYWOMPWURAOFW-QFIPXVFZSA-N 446.636 4.089 10 10 IICE COc1cc(Cl)c(C)cc1NC(=O)CCNC(=O)c1cc2cc(O)c(O)cc2s1 1621087998 KFGWFXKCCHUPSC-UHFFFAOYSA-N 434.901 4.042 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccccc1O)c1ccccc1Br 1630363557 UFCWOLOPVUEAFW-KRWDZBQOSA-N 435.318 4.037 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)cc1)C1CCCCC1 1631386180 LKHZSHNHQJLCFB-OAQYLSRUSA-N 440.632 4.436 10 10 IICE CCOC(=O)c1oc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1C(F)(F)F 1639305823 LNJOTTZDLJRNLE-VXGBXAGGSA-N 445.413 4.235 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)s1 1640238489 RWPLPEFVYDCHPB-SJORKVTESA-N 439.585 4.210 10 10 IICE COc1ccc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nn1 1641202114 BENACEQHNRPOBA-KRWDZBQOSA-N 430.430 4.411 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1642997858 QATJFTXCXSNPIN-IFMALSPDSA-N 436.600 4.361 10 10 IICE Cc1ccc(C)c([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1653167435 XGXDSYCWBSTXHH-UFYCRDLUSA-N 427.564 4.023 10 10 IICE C[C@@H](CN(C)C(=O)OC(C)(C)C)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1674724502 ZNXUEJAEWIGSQF-SFHVURJKSA-N 444.576 4.313 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)c(C)n1-c1ccccc1 1683150264 ZCRSTQKIBUPDLU-DEOSSOPVSA-N 430.552 4.084 10 10 IICE CCc1nnc(N2CC[C@]3(C)[C@@H](C2)C3(Cl)Cl)n1Cc1ccc(N(C)C)c(F)c1 1694698424 UJKYRHAWCMYYGU-VQIMIIECSA-N 426.367 4.114 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743513367 BUVKWQLSHCCEKZ-OPJGWUQDSA-N 441.620 4.163 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)[C@@H]2CCSC2)cc1 1766615438 XIVPFYDTNRRLMX-TZIWHRDSSA-N 429.634 4.008 10 10 IICE C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)/C(=C/C=C\c2ccccc2)SC1=S 1772759664 UZXSDVFZPWHSEK-SLHQOVNMSA-N 439.518 4.379 10 10 IICE COc1ccc(-c2ncccc2C(=O)N[C@@H](c2ccc(N(C)C)cc2)c2nccn2C)cc1 1866165802 SQWKDMLORKGJEF-DEOSSOPVSA-N 441.535 4.076 10 10 IICE O=C(NOCCCNCc1cc(F)ccc1O)OCC1c2ccccc2-c2ccccc21 1928765088 LPWXEVFSCJBILO-UHFFFAOYSA-N 436.483 4.481 10 10 IICE C[C@@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1c(O)cccc1[N+](=O)[O-] 1952608920 SDWQTLQRPDCICE-DEOSSOPVSA-N 448.431 4.139 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(F)F)c(C(=O)O)c2I)c(O)c1 2079050399 RQXWDULBUKHQAK-ZDUSSCGKSA-N 448.207 4.137 10 10 IICE CC(C)(C)OC(=O)N1CC(COCc2ccccc2)(C(=O)N2CCC[C@H](N=[N+]=[N-])CC2)C1 2256735571 NTAXHEZLCXUVJK-IBGZPJMESA-N 443.548 4.132 10 10 IICE O=C1N=C(N2CCN(c3cccc(Cl)c3)CC2)SC1=Cc1cccc([N+](=O)[O-])c1 2293264724 QGSQMNWPOBCBOQ-UHFFFAOYSA-N 428.901 4.041 10 10 IICE Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1cccc(O)c1 2296255989 FMKPCZOSWZUVEA-UHFFFAOYSA-N 435.867 4.120 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1ccc(Sc2ccc(Cl)cc2)o1 2296551014 BOAPJJHHVFBUAM-UHFFFAOYSA-N 428.853 4.339 10 10 IICE CCSC1=NSC2=NC(=O)C(=Cc3ccc(OC(=O)c4ccccc4)cc3)C(=N)N12 2297333784 RKSLOIVHMFIKFG-UHFFFAOYSA-N 436.518 4.236 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3cccc(O)c3)C2=O)cc1 2297449491 QLUVZAPLFQGAJY-UHFFFAOYSA-N 428.535 4.021 10 10 IICE C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)C(=CC=Cc2ccccc2)SC1=S 2314837627 UZXSDVFZPWHSEK-CQSZACIVSA-N 439.518 4.379 10 10 IICE COC(=O)CCCCCN1C(=O)/C(=C/c2cccc(Br)c2)SC1=S 1768419 PCNPYVOBEAMRQT-KAMYIIQDSA-N 428.373 4.384 10 10 IICE CC[C@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)C1=O 11635645 YGRFDAVHNLPWER-CQSZACIVSA-N 440.015 4.273 10 10 IICE CN(C(=O)CCCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccccc1 96515280 BEASYQCOCYPPCD-UHFFFAOYSA-N 426.472 4.234 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2CCN(c3ccccc3)CC2)C1 435874453 KLWPRFBNDACUGD-UHFFFAOYSA-N 430.596 4.193 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)C1 549319528 PCKPPYNWBFZHTI-SFTDATJTSA-N 445.611 4.079 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)CC(F)(F)F)CC2)c(C)n1-c1cccc(Cl)c1 726948156 KKKSWYDUJDDQSH-UHFFFAOYSA-N 441.881 4.421 10 10 IICE Cc1nn(C)c(C)c1CCN[C@@H](C)c1cc(Br)cc(Br)c1O 756380062 SGSUZQCKUGRIMP-VIFPVBQESA-N 431.172 4.161 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(Br)cc2O)cc1 1136480395 LCUVTCRDHHNAHS-SFHVURJKSA-N 433.346 4.042 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(C(C)C)c1 1137228720 XHHIKEGRJXXKQS-QFIPXVFZSA-N 426.557 4.400 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1137438108 IDKHOWKFBLTYQL-IBGZPJMESA-N 442.922 4.073 10 10 IICE CC(C)c1[nH]nc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1Br 1160563409 OCQHFNIVGIUZCD-UHFFFAOYSA-N 425.290 4.258 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccccn3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1289353992 WRKFMXRLLIMUDG-UHFFFAOYSA-N 430.556 4.155 10 10 IICE CCCN(CCC)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1294560156 SDLWCCQRBIRTHQ-UHFFFAOYSA-N 436.604 4.157 10 10 IICE CN(CCC(F)(F)F)c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1298600401 DEFRSCHKSUETMO-UHFFFAOYSA-N 442.536 4.291 10 10 IICE CC1(C)CC[C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)N(C(=O)OC(C)(C)C)C1 1302454147 KSTDWAWOMICXHD-AWEZNQCLSA-N 434.558 4.468 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2CCOC(C)C)c(C)n1-c1ccccc1 1304197756 ZRXUFCRPDQPGCZ-UHFFFAOYSA-N 425.602 4.331 10 10 IICE COC(=O)[C@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@H]1CCC[C@H](OC)C1 1307891994 DUKKNMSIBPACRN-JWNTYJGQSA-N 438.528 4.377 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC[C@H]3C)nnc2[C@@]2(OC(C)C)CCOC2)cc1 1313678259 GFBHPBKHVMIVCQ-CJFMBICVSA-N 441.620 4.202 10 10 IICE CC(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1357129291 PZHXOLQKKXSTFL-AVPJRLCVSA-N 449.639 4.495 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCCc2cccnc21 1438791490 AIAUHMLCCNCKSI-JXAWBTAJSA-N 441.553 4.182 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@H]1CCC(F)(F)C1 1439996188 LSWGVKTVISWMHU-VQCBNXJZSA-N 442.528 4.359 10 10 IICE Cc1cc(C(=O)NCC2(NS(C)(=O)=O)CCCCC2)c(C)n1-c1cccc(C(C)C)c1 1440891700 GHTVUGWGIGVPSH-UHFFFAOYSA-N 445.629 4.199 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)OCC[C@H]2C)sc(C)c1-c1ccccc1 1460961624 FZMWHYKGRUMUQZ-HZPDHXFCSA-N 430.570 4.338 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 1460972485 CHQLBRKBNIPDKP-SFHVURJKSA-N 447.579 4.351 10 10 IICE CCn1cc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cn1 1515782500 NIZHZYOXXNUGHO-UHFFFAOYSA-N 435.620 4.368 10 10 IICE COC(=O)[C@H](CC1CCCCC1)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1516032270 MRGAYYODWBXHKZ-QFIPXVFZSA-N 439.600 4.036 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Oc2cc(OC)c(C(C)=O)cc2OC)CCCC1 1525306809 IIWMROKOBLTEHD-UHFFFAOYSA-N 437.492 4.354 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](CC3CCCCC3)NC(=O)OC(C)(C)C)CC2)cc1 1526035204 CPKPQSPJLSLCMG-JOCHJYFZSA-N 445.604 4.208 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)C1 1537815369 RQITYNVEYHXRBN-DCFHFQCYSA-N 432.612 4.215 10 10 IICE CCN(CC)[C@@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccccc1 1539581344 DFCNBMUEVBDEPY-SIKLNZKXSA-N 431.527 4.456 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1CO[C@@H](CCC(=O)OC(C)(C)C)C1 1540464550 IFCFKVFUIBJCBP-UNMCSNQZSA-N 430.589 4.162 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCOC2(CCCC2)C1 1544589703 CHIUXJQBIXONCZ-GFWHJHDHSA-N 448.585 4.025 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1C[C@]1(C)OCCc2sccc21 1554175442 XTGFTPHIJNJGIA-QHCPKHFHSA-N 426.586 4.467 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 1557355269 DGXOOHBJEXSGGM-LJQANCHMSA-N 447.620 4.263 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2n[nH]c(-c3ccccc3)c2Br)cc1 1557356471 OOHBXCGBSQPPOY-UHFFFAOYSA-N 443.345 4.056 10 10 IICE COC(=O)c1cc(OCC(=O)Nc2cc3oc4ccccc4c3cc2OC)ccc1N(C)C 1559456708 MCRAOWSCJWKYPY-UHFFFAOYSA-N 448.475 4.465 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@]3(Cc4ccc(Cl)cc4)CCCOC3)C2)cc1 1565055828 LQONRJBALYANEJ-RDPSFJRHSA-N 443.975 4.018 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1nc(C(F)(F)F)co1 1583750004 DZGUDLZHDKLPGR-YRNVUSSQSA-N 445.419 4.063 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1 1586155768 BFLLYXAKOKWDQJ-HHHXNRCGSA-N 431.580 4.112 10 10 IICE CCCN(C)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N2CCC(C)CC2)cc1 1614646040 USPGUGNCZUIGJT-GMAHTHKFSA-N 441.620 4.133 10 10 IICE CCOCc1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1616975098 ZQUPTRGJBFHPER-UHFFFAOYSA-N 443.661 4.431 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3ccncc3s2)NC(=O)OC(C)(C)C)cc1 1618252226 BHRCJQBCETVGCN-GOSISDBHSA-N 440.569 4.358 10 10 IICE CSc1cccnc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1628432392 DLLFBJIQOFRILR-PTNGSMBKSA-N 433.555 4.173 10 10 IICE COc1cccc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1630159010 CVRAUJMXTRENPN-UHFFFAOYSA-N 428.330 4.233 10 10 IICE COC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)cn1 1631444017 CEDHQAOBFNRNCY-UHFFFAOYSA-N 428.286 4.291 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cncc4nc(C(F)(F)F)n(C)c34)cc2)CC1 1633110520 BIUYYWMCXGPOND-UHFFFAOYSA-N 431.462 4.153 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)NCCOc1ccc(Br)cc1C(F)(F)F 1633228485 QZQQPABMLGJIAY-QHHAFSJGSA-N 446.219 4.088 10 10 IICE COC[C@@H]1CC[C@H]([C@@H]2COCCN2C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)O1 1635549811 RLMFKILLZCGFPU-ZKMPZPQNSA-N 440.584 4.253 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC(OC(=O)Nc2cccc(F)c2)C1 1638736529 JJSAQKGIDVBRHE-UHFFFAOYSA-N 435.455 4.119 10 10 IICE COc1ccc(N(CCC(C)C)C[C@H]2CC3(CN(C(=O)OC(C)(C)C)C3)C(=O)O2)cc1 1642979793 JTKGGLVCCIBDTM-HXUWFJFHSA-N 432.561 4.100 10 10 IICE Cc1cc(CN2CCC[C@H]([C@@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)C2)ccc1N(C)C 1659304095 YBFSIGKGUSRACC-FUDKSRODSA-N 431.621 4.345 10 10 IICE Cc1cc(CCNC(=O)NCc2cc(OCC(F)F)ccn2)c(C)n1-c1ccccc1 1680854997 IVCAFNSBKRSBRW-UHFFFAOYSA-N 428.483 4.175 10 10 IICE CCc1ccc(N2CCN(C(=O)N[C@H]3CCN(c4ccc(OC)cc4)C3)CC2)cc1Cl 1683944990 OJIGFGSBNBSWBZ-IBGZPJMESA-N 442.991 4.022 10 10 IICE C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCN1C(=O)OC(C)(C)C 1686310166 XIWCIRAFOIFTAP-QUCCMNQESA-N 430.593 4.216 10 10 IICE CCN(CC)[C@H](Cn1c(-c2ccccn2)nnc1N(C)Cc1ccccc1O)c1ccco1 1728377666 WMBZWBPGGXGRMW-OAQYLSRUSA-N 446.555 4.358 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3ccncc3)n2CCCSc2nccs2)o1 1751511099 FWFQBKYCWHKUFG-UHFFFAOYSA-N 440.598 4.441 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(C)C)CC1 1769320907 QPFRZILOOCFBJP-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CN1CCN(c2ccc(N3C(=O)/C(=C\c4ccc(F)cc4F)SC3=S)cc2)CC1 1860085733 WUDIKDXMFIEGJB-XDHOZWIPSA-N 431.533 4.122 10 10 IICE CCCCn1cc(OCC(=O)NC)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1871014190 MLDOWYUTFLWERO-UHFFFAOYSA-N 434.540 4.129 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cccc(Br)c2O)C[C@@H]1C1CC1 1895874233 LOVLOYDXEQUZJQ-DOTOQJQBSA-N 425.367 4.422 10 10 IICE COc1ccc([C@@H](C2CC2)n2nc(C(C)C)c(C=O)c2I)c(O)c1 2079997852 IRSQUSVJFBFASN-QGZVFWFLSA-N 440.281 4.137 10 10 IICE C[C@@H]1C[C@@H](CNCc2cc(Br)cc(F)c2O)CN(C(=O)OC(C)(C)C)C1 2115922173 GWDNWXWXELEIGB-OLZOCXBDSA-N 431.346 4.277 10 10 IICE COc1ccc(Br)c(CN[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)c1O 2227747568 CAHMTFKOJNYROE-CYBMUJFWSA-N 431.371 4.192 10 10 IICE COc1ccc(Br)c(CN[C@@]23CC[C@@H](CN(C(=O)OC(C)(C)C)C2)C3)c1O 2236045149 MYUKSLQMVVDMBQ-ZUOKHONESA-N 441.366 4.043 10 10 IICE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)o1 2297348117 JHLXBNLPGLLOHB-UHFFFAOYSA-N 449.370 4.345 10 10 IICE Cc1ccc(C(=O)NN2C(=O)C(=Cc3ccc(Br)cc3)SC2=S)cc1 2314722734 RLXOEQFCKLEDKV-UHFFFAOYSA-N 433.352 4.304 10 10 IICE CCN(CCCC(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2380786240 ILQYZXQRLGWEKO-UHFFFAOYSA-N 443.382 4.459 10 10 IICE CCN(CC(=O)NC(C)(C)C)C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 28014495 ZWLOKZLANDSENF-UHFFFAOYSA-N 434.378 4.233 10 10 IICE CCCN1C(=O)/C(=C2\SC(=S)N(CCCCCC(=O)OCC)C2=O)c2ccccc21 40928369 XMIWCBTXUKKNNM-HNENSFHCSA-N 446.594 4.138 10 10 IICE CC(C)(C)OC(=O)N1CCC(OCCCNCc2cccc(Br)c2O)CC1 312295048 QGUNTPOZFZRSBR-UHFFFAOYSA-N 443.382 4.051 10 10 IICE Cc1ccc([C@@H](C)CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 737647092 IWJFTGVVQYMOMS-HNNXBMFYSA-N 428.444 4.212 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC3CCN(C(=O)CC(F)(F)F)CC3)c2C)c1 749368301 LTGHLECDYXSQJE-UHFFFAOYSA-N 435.490 4.384 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)c1 769540312 LFYHEZYKDVCIMD-LPTQZCDUSA-N 442.943 4.144 10 10 IICE C[C@@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cc(Br)cc(Cl)c1O 790745595 CHUWSSDVNITBAF-PIGZYNQJSA-N 441.728 4.399 10 10 IICE Cc1ccc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)c(OC[C@@H]2CCOC2)c1 805191983 FSWJOVUTARXMAS-CQSZACIVSA-N 439.339 4.422 10 10 IICE Cc1cc(C(=O)COC(=O)CO[C@@H](C)c2nccn2C)c(C)n1-c1ccc(F)c(Cl)c1 805687293 TUPRZTKVERLRFN-HNNXBMFYSA-N 447.894 4.124 10 10 IICE O=S(=O)(Nc1nc(-c2ccc3c(c2)CCC3)cs1)c1c(Cl)nc2ccccn12 917873192 WFGIDNAXEMDQLW-UHFFFAOYSA-N 430.942 4.401 10 10 IICE CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2ccc(-c3ccc(C)c(C(=O)O)c3)o2)C1=O 1084036551 FBPGFZXVSHHAST-UYRXBGFRSA-N 444.443 4.182 10 10 IICE Cc1ccc(C(=O)N2CCC(C(=O)N3CCCCC3)CC2)cc1-n1c(C)cc(C=O)c1C 1135458288 JZHJDNFXHYRRLR-UHFFFAOYSA-N 435.568 4.080 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)NC(=O)c1ccccc1 1155726746 MCWRUHSFNQJGRG-MSOLQXFVSA-N 427.976 4.401 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(Cl)c(F)c1 1165498071 LBLYIZYFWXOUKX-MGPUTAFESA-N 439.314 4.453 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(F)c(Br)c1 1167762215 JULZUVTVKBMHSA-OAHLLOKOSA-N 449.364 4.359 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccncc3)CC2)c(C)n1-c1ccccc1Br 1290262860 YMAKBEDVXKYVRT-UHFFFAOYSA-N 439.357 4.214 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2sccc2C1 1352438000 CKNDNTVFLHEWQM-GZTJUZNOSA-N 432.567 4.063 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 1354768309 VKQBWCSTCRFYEX-XPGWFJOJSA-N 431.439 4.085 10 10 IICE O=C(CCOc1ccc(F)c(Cl)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1435571599 DZPRYCXNAUBIBD-UHFFFAOYSA-N 445.966 4.096 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nn(-c4ccccc4)c(C)cc3=O)c2C)c1 1438316410 ZDLZNOHHWXQHRZ-UHFFFAOYSA-N 426.520 4.187 10 10 IICE Cc1ccc2c(n1)N(C(=O)CCCN1C(=O)/C(=C\c3cccs3)SC1=S)CCC2 1439031720 GJDFROFLNFXRLH-GHRIWEEISA-N 443.619 4.412 10 10 IICE CC(C)Cc1ncc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1459739045 FRDGCRBVRPKYGY-LICLKQGHSA-N 444.557 4.044 10 10 IICE COc1ccc(O)c([C@@H](C)N[C@H]2CCCN(c3ccc(Br)c(C)c3)C2=O)c1 1459850551 NEYFFBBZFWLYMZ-KUHUBIRLSA-N 433.346 4.318 10 10 IICE Cc1ccccc1COc1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1470446964 YUOKXOBNHNVTAO-UHFFFAOYSA-N 444.575 4.394 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC)C[C@H]2CCCO2)sc(C)c1-c1ccccc1 1473140350 QOBCJEPTZYURDX-GOSISDBHSA-N 430.570 4.340 10 10 IICE CC(C)c1csc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1508891629 SCSOJCIFQGKCAP-QGZVFWFLSA-N 427.574 4.142 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H]3CCC[C@@]2(C)C3)n1Cc1ccc(N(C)C)c(F)c1 1519340937 IRHNULQJHINPEH-YJLYGGOZSA-N 445.583 4.024 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cn1c(-c2ccc(F)cc2)c(C)sc1=O 1528924798 SABYVTNILUUEKO-INIZCTEOSA-N 441.572 4.146 10 10 IICE Cc1ccc(C)c(C2=NO[C@@H](C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)C2)c1 1530288203 TXVOECQNXINILW-JOCHJYFZSA-N 443.494 4.183 10 10 IICE COC(=O)Nc1ccc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1537355204 BDUYRTHHKIXMEV-UHFFFAOYSA-N 435.524 4.330 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1S(C)(=O)=O 1539913011 NQYQVVZWQIUQIJ-OAHLLOKOSA-N 434.989 4.218 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCN(C2CCCCC2)CC1 1542227339 ZNNWSSKGJQRKEC-UHFFFAOYSA-N 438.664 4.354 10 10 IICE Cc1csc(N2CCN(c3nnc(C(C)C)n3CCCSc3nccs3)CC2)n1 1542871529 FPUICLVHTVOJES-UHFFFAOYSA-N 449.675 4.132 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](O)c3ccc(Cl)c(Cl)c3)cc2F)C[C@@H](C)O1 1543234196 YVFBHJOUKIOGFI-IZDJOXEWSA-N 441.330 4.096 10 10 IICE COc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OCC(C)C)c1 1545632636 REHKPEWPNAEIOG-IBGZPJMESA-N 446.975 4.483 10 10 IICE O=C(N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1)c1cc2cc(O)c(O)cc2s1 1570303774 IBVLWSAQZIBEDG-LSDHHAIUSA-N 436.455 4.073 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](c3ccccc3)C3(CO)CCOCC3)c2C)cc1 1570788390 MKMZSCGEERSVBJ-RUZDIDTESA-N 448.563 4.363 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3C[C@@]3(C)c3cccc(Br)c3)C2)cc1 1584444638 VERPQSYCTQFFOL-VZPUWSDOSA-N 443.385 4.378 10 10 IICE Cc1cc(C(=O)N[C@H](C)CC(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cn1 1585191833 LSGZAHLGIAOVMF-GFCCVEGCSA-N 436.350 4.102 10 10 IICE COc1ccc(CN2CC[C@H](NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2=O)cc1 1586090846 FLLPUWZHMWIEHE-VWLOTQADSA-N 445.563 4.250 10 10 IICE Cc1cc(C(=O)CSc2ccc([N+](=O)[O-])cn2)c(C)n1-c1ccc2c(c1)OCCO2 1613655050 PSOHQGXTPLIZRX-UHFFFAOYSA-N 425.466 4.144 10 10 IICE COc1ccc(N2CCCN(C(=O)C[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1626319016 PTMVAAZLBAAGNV-FQEVSTJZSA-N 447.620 4.311 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@]2(c3ccccc3)CCN(C(=O)OC(C)(C)C)C2)c1 1630365691 DCTYQYQKOXCCBE-NSYGIPOTSA-N 440.540 4.157 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1NC(=O)OC(C)(C)C 1633789919 SZQGSMDDICABDA-UHFFFAOYSA-N 439.556 4.233 10 10 IICE C[C@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Br)cc1 1637228457 KVGQLFXSSBUXFR-MRXNPFEDSA-N 446.389 4.013 10 10 IICE Cc1ccc(C(=O)N[C@H]2C[C@H](CNC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1640192537 PYRLOZMZTMFWNE-XGAFWQRZSA-N 439.556 4.248 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@@H](c2ccncc2)C1 1641886585 RXRSVGNGIYESBW-APVMCDBPSA-N 443.619 4.141 10 10 IICE CCN(C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@@H]1CCN(CC(F)(F)F)C1 1647879599 MROFRXZUKGFJQJ-GOSISDBHSA-N 425.495 4.003 10 10 IICE CCOC(=O)c1c(NC(=O)CSc2nc3cc(F)c(F)cc3[nH]2)sc(C)c1C 1656209154 MHBOKTVOJUKBJZ-UHFFFAOYSA-N 425.482 4.427 10 10 IICE C[C@H](NC(=O)N[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1)c1ccc(N(C)C)cc1 1680281241 WQMDOJLDCLLWQH-MTFMMBMASA-N 430.593 4.148 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3ccc(SC)c(OC)c3)C2)cc1 1683337129 VNESZBHBSAKZEH-GOSISDBHSA-N 429.586 4.094 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1C[C@H](C)O[C@H](C2CC2)C1 1693004868 CRRLATDDECSAMT-AVRDEDQJSA-N 425.621 4.293 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1694176780 ZFETTYCKLJINLF-QGZVFWFLSA-N 432.576 4.012 10 10 IICE CC/C=C/Cn1c(-c2cccc(C)n2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1694986346 CYCGHWSTUBJVPI-AATRIKPKSA-N 436.535 4.089 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1710026956 UKCVYTHQFANVKK-PZJWPPBQSA-N 441.620 4.070 10 10 IICE CO[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC1(C)C 1712078740 BTSXCAWWNYCNFQ-HZPDHXFCSA-N 437.635 4.020 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(C(C)C)CC1 1723559459 CICYSTGMDUXMIU-UHFFFAOYSA-N 438.620 4.089 10 10 IICE CC[C@@H](C)c1nnc(N2CCC([C@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1763603222 WLAGIJGTVAGBMV-XLIONFOSSA-N 429.584 4.298 10 10 IICE CC(C)(C)OC(=O)N1CCC(NCc2ccc(Br)cc2O)(C(F)F)CC1 2227502050 FWUBWYDXWSNIFO-UHFFFAOYSA-N 435.309 4.279 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)c1ccccc1Br 2296050430 SVDQQYWTCOLVHL-UHFFFAOYSA-N 437.315 4.134 10 10 IICE COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(C=C2C(=N)N3C(C)=CSC3=NC2=O)c1C 2296808042 NKHWFBNVGMHCNT-UHFFFAOYSA-N 437.481 4.178 10 10 IICE O=C1C(=Cc2ccc([N+](=O)[O-])cc2)SC(=S)N1C(=O)c1ccccc1Br 2297451060 OSIGQENHRJRPPB-UHFFFAOYSA-N 449.307 4.399 10 10 IICE CCCC1=NN(Cc2ccccc2F)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141118 HMMILPPYZCSETC-UHFFFAOYSA-N 425.416 4.087 10 10 IICE Cc1ccc(CNC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381133174 KZNNGXPUPMCYFY-AWEZNQCLSA-N 441.366 4.117 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3CC[C@@H]([C@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2381141524 AHCNGDHBGVHAQJ-AESZEHBQSA-N 443.357 4.431 10 10 IICE COc1ccc(-n2c(C)cc(/C=C3/C(=N)N4C(SC)=NSC4=NC3=O)c2C)cc1 4761552 ZNXFNFMCYBUQMF-QNMDCZIWSA-N 425.539 4.042 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)c1O 14459699 LVGUFMFPNVUCGP-PNLZDCPESA-N 426.538 4.012 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(F)cc3)C2=O)ccc1OCC(=O)O 16915663 CPYATYBHXYAZCX-LICLKQGHSA-N 433.482 4.094 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)Nc3ccc(F)cc3)c3ccco3)CC2)cc1 38637891 OCTVHVJDYPBDDW-QFIPXVFZSA-N 438.503 4.112 10 10 IICE COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(\C)Nc1ccc(Cl)c(F)c1 103920006 FRDSOXNSKUYFIK-UDWIEESQSA-N 431.851 4.140 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C/c3cc(C)n(-c4ccccc4OC)c3C)C(=N)N12 104372779 JWCNJCQXEJFLMN-AZAZKDLZSA-N 439.566 4.433 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3OCCOc3ccccc3)CC2)cc1 104673256 RZBSKOBFWXHHQI-UHFFFAOYSA-N 432.520 4.115 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(N(C)C)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526505774 JOHMXXKUJNDQFD-HSZRJFAPSA-N 432.476 4.230 10 10 IICE Cc1nc2c(s1)[C@@H](NC(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CCC2 780833977 IRBXZQMLPVWBEC-KDOFPFPSSA-N 436.528 4.399 10 10 IICE Cn1cc([C@H]2[C@H](c3noc(-c4ccc(-n5cccc5)cc4)n3)CC(=O)N2C(C)(C)C)cn1 797434194 PNPCIERMIROJDD-CTNGQTDRSA-N 430.512 4.117 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)CO[C@@H](C)c3nccn3C)c2C)c1 805685979 GXDBEIHEAYAIKQ-KRWDZBQOSA-N 441.553 4.053 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)N1CCO[C@H]2CCCC[C@@H]21 917205085 BYQLXDUIEJBFRK-UNMCSNQZSA-N 437.565 4.454 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)n2)cc1 917844766 GETJJYQKYYHCGA-UHFFFAOYSA-N 425.875 4.181 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)O[C@H]1CCOc2ccccc21 1127802630 ZTRSTFQLJDPQCA-UZNZLNSGSA-N 443.521 4.484 10 10 IICE Cc1cc(CCNC(=O)c2cnc(NC(=O)OC(C)(C)C)cn2)c(C)n1-c1ccccc1 1132011603 RVBFPKWXPMUTHR-UHFFFAOYSA-N 435.528 4.204 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCCCN2C[C@H](C)C[C@@H](C)C2)CCCC1 1136255174 MJEWNRQFZIEMER-WOJBJXKFSA-N 425.617 4.403 10 10 IICE CC(C)(C)OC(=O)NC[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(F)cc1 1150378803 VWRCXGXTBZXURW-FQEVSTJZSA-N 442.531 4.335 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC(CCF)CC1 1150873102 LJWHMRMQLLQHDB-SSZFMOIBSA-N 426.604 4.328 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]([C@H](O)c3ccc(Br)cc3)C2)cc1 1160290188 JRUMDCSSXYDIIW-CRAIPNDOSA-N 445.317 4.197 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc(Cl)cc(Br)c2)cc1 1251945134 YRRCEHBENJBYGF-UHFFFAOYSA-N 440.769 4.389 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 1252041099 BZBOLLDTCLAGPY-WIYYLYMNSA-N 432.609 4.461 10 10 IICE C[C@@H](NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)c1ccc(N2CCOCC2)cc1 1264822103 DSASNVXPNNUDLN-GOSISDBHSA-N 439.556 4.386 10 10 IICE Cc1nnc(N2C[C@H](C)O[C@@H](C(F)(F)F)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1290755487 PNHVJLPWJRNWPD-OXJNMPFZSA-N 437.510 4.027 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(Cc3cccc(Cl)c3)C(=O)C2)c1 1295050625 VLPNNIUHXGAHIJ-UHFFFAOYSA-N 449.938 4.045 10 10 IICE Cc1cc(C(=O)N[C@H](CO)[C@H](C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1295512442 KHFIRIGQQDAICV-FOIQADDNSA-N 442.357 4.146 10 10 IICE CCOC(=O)[C@H](C[C@H]1CCCO1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1303455294 AIUDVPYJMBMMEZ-GGAORHGYSA-N 426.557 4.448 10 10 IICE COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1307628197 CSZXFRZWWNUSDR-JKSUJKDBSA-N 428.488 4.148 10 10 IICE CCOCc1nnc(N(C)C[C@H]2CCCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1314313390 YBSFJBYKRJWOCG-HSZRJFAPSA-N 441.620 4.105 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CSCCS1 1359680176 HVCIAORPPOMZOT-FQEVSTJZSA-N 431.675 4.487 10 10 IICE Cc1nc([C@@H]2CCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1360068778 MLDWVVIHJIQZER-OAHLLOKOSA-N 427.492 4.226 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1(c2ccccc2F)CC1 1360483739 DWQJWVGISWWOTR-QGOAFFKASA-N 444.528 4.362 10 10 IICE CC1=C(C)CN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)cc2C)CC1 1360892141 MVTWWILHOKAAQK-UHFFFAOYSA-N 433.604 4.109 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1C[C@H](C)C(F)(F)[C@H](C)C1 1361097876 KGHUOVSOMSLGSZ-WSTZPKSXSA-N 447.574 4.322 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(-n3nccc3C(F)(F)F)c2)cc1 1437382219 FHZUGCMLSUTKQR-UHFFFAOYSA-N 432.446 4.108 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(O)c(O)c2)c2c[nH]c3ccccc23)cc1 1440597947 RQIJMKIMLPAGEQ-NRFANRHFSA-N 429.520 4.136 10 10 IICE CCCn1c(=O)n(CCC(=O)NCc2ccc(N3CCC(C)CC3)cc2)c2ccccc21 1443664208 MXDGDSFCKQHGCL-UHFFFAOYSA-N 434.584 4.156 10 10 IICE CSc1cc(C)ccc1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1446039647 CITFSHLXDPCKFO-UHFFFAOYSA-N 448.591 4.215 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(F)cc1 1453716779 BJYPDYLEKHABSD-WOJBJXKFSA-N 433.499 4.311 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1463805889 GOAINDJFJIWTGO-JOCHJYFZSA-N 439.556 4.373 10 10 IICE COc1ccc(Br)cc1C1(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 1464076029 ANFDLTNMFXUEIF-UHFFFAOYSA-N 429.358 4.406 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1csc(-c2ccoc2)n1 1467630614 CSQWCHRWETXWOJ-UHFFFAOYSA-N 441.553 4.334 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](C(=O)NC(C)C)C2)c(C)n1-c1ccccc1Br 1470528979 VSOIMFQYXFCZNA-KRWDZBQOSA-N 446.389 4.233 10 10 IICE CN1CCCc2cc(Cn3c(N(C)CCCc4ccccn4)nnc3C(C)(C)C)ccc21 1517412352 QRAYIXFOPAQQLA-UHFFFAOYSA-N 432.616 4.470 10 10 IICE CSC[C@@H]1CCCN1c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1520234223 HPCYCRXTRODVEV-SFHVURJKSA-N 440.592 4.234 10 10 IICE CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1529716419 XEGJUHUAHQIYHP-INIZCTEOSA-N 434.964 4.425 10 10 IICE COc1cccc(-c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)on2)c1 1531504502 RTFCWYNDBIGSJS-INIZCTEOSA-N 443.450 4.350 10 10 IICE CSc1nnc(CCCNC(=O)c2cc3cc(O)c(O)cc3s2)n1C1CCCC1 1540737874 QMKGXCDXUWOVCA-UHFFFAOYSA-N 432.571 4.104 10 10 IICE CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)C1 1544474257 IXEUFKXZBWNVKA-QFIPXVFZSA-N 437.584 4.455 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1547444916 VUFQJCXDDURNOV-AUSIDOKSSA-N 434.588 4.096 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)ccc21 1557181541 KFGVLSIQBPEENT-JKSUJKDBSA-N 431.577 4.326 10 10 IICE O=[N+]([O-])c1cccc(Br)c1NCc1cc(F)c(N2CCOCC2)c(F)c1 1559208238 ZLSAAPXQFZVGFR-UHFFFAOYSA-N 428.233 4.084 10 10 IICE CC[C@H](c1ccc(F)cc1)N1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1 1559272236 OOXYOSVUCGDASM-OZVOWOKYSA-N 427.476 4.193 10 10 IICE COc1ccc(N(C)CC(=O)N2N=C(c3ccc(C)cc3)C[C@H]2c2ccco2)c(OC)c1 1559666676 UINBNHBSIBNNSC-QFIPXVFZSA-N 433.508 4.419 10 10 IICE Cc1cc(C(=O)NCC2([C@H](C)CCO)CCC2)c(C)n1-c1ccc(Br)cn1 1566884341 JRYDAWBQLYOKHX-CQSZACIVSA-N 434.378 4.170 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N1CCSC[C@@H]1C1CC1 1583270358 NZJORSNASLSUHJ-DFSFMLJYSA-N 438.665 4.084 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ncccc1NCC1CCC1 1595584020 LIKNIRYLNFNVFU-IBGZPJMESA-N 428.964 4.047 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCCS(=O)(=O)c1ccc(Cl)cc1 1597800517 KOYPOHAAYWWESL-KRWDZBQOSA-N 437.005 4.016 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2cc(O)c(Br)cc2Br)cc1 1611252598 YIUVUHDBEQVOJE-UHFFFAOYSA-N 442.067 4.332 10 10 IICE COc1ccc(N2CC[C@@H](CNc3ncnc(C(F)(F)F)c3Br)C2)cc1 1612519128 HUOAPDIDRIYXJU-NSHDSACASA-N 431.256 4.205 10 10 IICE CCOC[C@@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1617044892 ZLFOKSBSRJXABC-HXUWFJFHSA-N 429.584 4.127 10 10 IICE Cc1cc(C(=O)N(C)Cc2nc3ccccc3[nH]2)c(C)n1-c1ccc(Br)cn1 1623968826 SSDUFMNLENCOFW-UHFFFAOYSA-N 438.329 4.400 10 10 IICE CCOC(=O)c1cnn(-c2cccc(NC(=O)c3ccc(C)c(O)c3O)c2)c1C(F)(F)F 1629782510 GBQUGDJHDVGVCK-UHFFFAOYSA-N 449.385 4.040 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(F)cc(Br)cc3F)CC2)cc1 1632153424 AHLWSGXZMXCQIC-UHFFFAOYSA-N 425.273 4.088 10 10 IICE COc1cc(/C=C/C(=O)NCc2c(O)ccc3ccccc23)cc(Br)c1O 1635965209 QSUVYNAWFRGSQW-RMKNXTFCSA-N 428.282 4.352 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1cccc(C(F)(F)F)c1 1637247678 SNVLTPORGSCAFZ-UHFFFAOYSA-N 429.822 4.199 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@@H]1CCCC(=O)N1C 1641202395 FGMJBGHTYXRGQF-ICSRJNTNSA-N 433.474 4.309 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(Cl)cc1 1658008035 AYNDMPZLLVESNX-HOIFWPIMSA-N 447.982 4.450 10 10 IICE CCCC1(CCC)CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1660030773 DEMSGDXPBOBXBA-PMACEKPBSA-N 433.612 4.490 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2ccnc(Oc3ccccc3F)c2)cc1 1672371102 LYVHVJAEYBMENM-UHFFFAOYSA-N 438.503 4.299 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C 1685239301 AUHYTENGQYLOHD-UYAOXDASSA-N 432.609 4.177 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N3CCOC[C@H]3C)cc2)CC1 1693702342 VOLDXJKQOCNQFB-HXUWFJFHSA-N 425.621 4.376 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2CCC2)n1CCCC(F)(F)F 1696685181 YJJYRFPJRBGOTG-UHFFFAOYSA-N 437.510 4.361 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3Cc3nc(C)c(C)s3)CC2)cc1 1730180803 DJZMTQSNBINLPI-UHFFFAOYSA-N 440.617 4.248 10 10 IICE CCc1nnc(N2CCN(C3CCC(C)CC3)CC2)n1Cc1ccc(N(CC)CC)cc1 1764920649 NAGPPQXBUNACDC-UHFFFAOYSA-N 438.664 4.436 10 10 IICE C[C@@H](CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1)C(=O)c1cccc(F)c1 1866036884 UVUSCEYJHJLTDK-YADARESESA-N 439.575 4.444 10 10 IICE CCCOc1cn(CCNC(C)=O)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1871108458 MSTSOKVJYYGRNE-UHFFFAOYSA-N 434.540 4.129 10 10 IICE O=C(CSC[C@@H]1CCCN2CCCC[C@H]12)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179999 VHTOUGZBEFRPQO-HTAPYJJXSA-N 448.588 4.398 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@@H](CNCc2c(O)cccc2Cl)C1 2025249954 XEYHZDPBWLWMST-IBGZPJMESA-N 445.991 4.257 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C2(C)CC2)c(I)c1CN 2079955317 ZAGOJDKOZJFDAA-KRWDZBQOSA-N 439.341 4.221 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H]4CCN(Cc5ccccc5)[C@@H]4C3)ccc(N)c2C1 2132362381 GWWHCCTXYDZEGL-NBGIEHNGSA-N 448.611 4.273 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@H]3CCC[C@H]23)c1O 2236050674 JAWQSXRGOLRCQP-WQVCFCJDSA-N 441.366 4.041 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=CNCc2ccc(F)cc2)cc1 2297349090 WXXNAQJFSCZWHF-UHFFFAOYSA-N 446.438 4.167 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(CCCCCC(=O)O)C1=O)C(C)=O 2314928037 OZHMUYZRLPFGSR-MRXNPFEDSA-N 435.567 4.279 10 10 IICE COc1ccc(OC)c(C=CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)c1 2326807173 IBQBFIVBRPVEPL-XMMPIXPASA-N 437.584 4.126 10 10 IICE O=[N+]([O-])c1cccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)c1 14471728 UBEIWOQSWLPNQS-CNNODRBYSA-N 425.510 4.206 10 10 IICE Cc1cccn2c(=O)c(/C=C3\SC(=S)N(C(C)C)C3=O)c(NC3CCCCC3)nc12 33489113 NIJNEUGDBQGUKT-ATVHPVEESA-N 442.610 4.357 10 10 IICE Cc1sc2nc(CN3CCCC3)nc(NCc3ccc(N4CCOCC4)cc3)c2c1C 64931113 FDJSXBYIMNMVQK-UHFFFAOYSA-N 437.613 4.353 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(C)c3)[C@H]2c2ccc(O)c(O)c2)cc1OC 526322665 IAAYTYPSLRXKPU-QHCPKHFHSA-N 433.460 4.481 10 10 IICE COc1ccc(O)c(CNC(=O)c2ccc(COc3ccc4c(C)cc(=O)oc4c3)cc2)c1 734017662 VFAIRLZNLBWQLK-UHFFFAOYSA-N 445.471 4.325 10 10 IICE C[C@@H]1CN(Cc2cccc(NC(=S)NCCCN(C)c3ccccc3)c2)C[C@@H](C)O1 737449822 PSZHQDZZZKCPRJ-WOJBJXKFSA-N 426.630 4.109 10 10 IICE Cc1cc(N2CCC[C@@H](N[C@@H](C)c3cc(Br)cc(Cl)c3O)C2)n(C)n1 774469026 QOFGXFPZWORFMI-GXTWGEPZSA-N 427.774 4.170 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccccc3Cl)cs2)c(OC)c1 777665659 OGXZDDWZRNSZDG-UHFFFAOYSA-N 440.930 4.290 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)N[C@H](C)c1cc(OC)ccc1O 778290672 ZZBYCEPVSXCBMI-GFCCVEGCSA-N 439.306 4.071 10 10 IICE O=S(=O)(/C=C\c1ccccc1Br)NCc1cc(Br)ccc1O 796190588 JSZZFVLNITZAKG-FPLPWBNLSA-N 447.148 4.008 10 10 IICE COc1c(C)cc(C)cc1S(=O)(=O)Nc1nc(-c2ccc(NC(C)=O)cc2F)cs1 800925917 IMGGLJRWKUQBIM-UHFFFAOYSA-N 449.529 4.334 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Cl)cc3Br)CC2)c(OC)c1 1132032268 QHYQYGRPAKDCCZ-UHFFFAOYSA-N 439.737 4.082 10 10 IICE Cc1ccc(O[C@H](C)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134682175 YYAJCTRUCYOVFA-UZLBHIALSA-N 448.405 4.010 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCCN3C(=O)COc4ccccc43)c2C)c1 1137110038 JJKNGNSZRRTARL-UHFFFAOYSA-N 431.536 4.256 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccccc1O)c1ccc(Br)cc1 1146613588 YSKYCTRRICKQCJ-QGZVFWFLSA-N 435.318 4.037 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(F)cc4)c3C(C)C)CC2)cc1F 1150240397 PVKZZEKNPPFRPZ-UHFFFAOYSA-N 440.494 4.245 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](CCO)c2ccc(Cl)cc2)CCCC1 1160209351 LAOVAFWEUOEKGT-NRFANRHFSA-N 426.944 4.422 10 10 IICE Cc1cc(C)n2nc(SCc3ccccc3C(=O)N[C@H](C)c3ccccc3O)nc2n1 1171723491 SAKGLGNWPLGSCJ-MRXNPFEDSA-N 433.537 4.230 10 10 IICE CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NCc1cc(Cl)ccc1O 1225061402 GPUSTPHUXYKFII-GTNSWQLSSA-N 427.726 4.384 10 10 IICE COc1cc(N2CCN(C(=O)NCc3ccc(C)c4ccccc34)CC2)cc(OC)c1OC 1230117829 RSGUYWULAJHZRD-UHFFFAOYSA-N 449.551 4.206 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CC(C)(C)Oc4ccc(F)cc43)C2)cc1 1252114236 BGALYQLJSYTHBD-IERDGZPVSA-N 427.520 4.262 10 10 IICE Cc1nc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)sc1Br 1292382622 UWGSAFDLHDHZJF-MRXNPFEDSA-N 438.391 4.101 10 10 IICE CC(C)(COc1ncccc1C(F)(F)F)NC(=O)c1cc2cc(O)c(O)cc2s1 1295278591 NZJXWVYWBDPIMO-UHFFFAOYSA-N 426.416 4.314 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1CC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1298830167 QUDYPQWZYKGNQP-DLBZAZTESA-N 435.528 4.418 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3NC(=O)c3ccsc3)C2)cc1 1299769670 GFLSTLWWSSQKLC-QGZVFWFLSA-N 435.549 4.265 10 10 IICE Cc1cc(C(=O)N[C@H]2CS(=O)(=O)Cc3ccccc32)c(C)n1-c1cccc(Cl)c1 1301277662 FGEDSPKYNKJWBE-NRFANRHFSA-N 428.941 4.147 10 10 IICE CC(C)(C)OC(=O)c1ccccc1OCCN(Cc1ccccc1O)C[C@H]1CCCO1 1307566766 MACMBWUOVSVBHQ-HXUWFJFHSA-N 427.541 4.408 10 10 IICE COCC1(Cn2c(CC(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCC1 1315849816 RSJGOBRVTNENKO-UHFFFAOYSA-N 441.620 4.019 10 10 IICE Cc1cc(CC(=O)OCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccc(Cl)cc1 1350347845 WRXIIQOYGAVDPD-UHFFFAOYSA-N 436.895 4.129 10 10 IICE CCOC(=O)c1c(NC(=O)/C=C/c2ccc(C(N)=O)o2)sc(C)c1-c1ccc(F)cc1 1351239098 OZLGZLHDRQMOTP-PKNBQFBNSA-N 442.468 4.383 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 1357927274 CZHPEOJQQSNVGB-HNNXBMFYSA-N 431.920 4.236 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H](C)[C@H]3CNC(=O)OC(C)(C)C)cc2)CC1 1459604868 BLSPCOJUGASNAU-WMZHIEFXSA-N 431.621 4.427 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 1469978741 JOBTZSGDLZHQSD-GHTZIAJQSA-N 434.367 4.310 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](CSc4ccccc4)C3)C2)cc1 1478859015 AGGKPGPRCQJWNI-UXHICEINSA-N 425.598 4.345 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2C[C@H](C)S[C@@H](C)C2)cc1 1501847028 ALMOZPCMJQMTSN-BBTUJRGHSA-N 429.634 4.354 10 10 IICE CN(C)c1ccc(CNC(=O)c2nc(-c3cccs3)n(-c3ccc(F)cc3)n2)cc1F 1519247567 HEAMBQCCDQJLNM-UHFFFAOYSA-N 439.491 4.270 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1c(F)cccc1I 1525761541 CUBUOOQTQYBRDX-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2cc(F)ccc2Br)N(C)C)cc1 1537482107 BHUIUVLVFPROLY-FQEVSTJZSA-N 436.369 4.006 10 10 IICE CCN(Cc1nc(O)c2ccccc2n1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1539408338 KWYVBUFPOBWBNG-UHFFFAOYSA-N 442.519 4.147 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)N(C)C)cc1 1539705052 FNYUOSCSHRMVOR-XMMPIXPASA-N 445.567 4.429 10 10 IICE COC(=O)CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)C[C@@H](C)C2 1540610200 LZFVIBWSBTYXAH-VXNZKSKFSA-N 443.547 4.327 10 10 IICE CCN(CC)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)Cc1ccc(O)c(O)c1 1542619335 HGLDGQIYEMIXAN-UHFFFAOYSA-N 425.356 4.318 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(COC)CCC1 1545504253 RQMXYAMIHQNOHE-HXUWFJFHSA-N 441.620 4.334 10 10 IICE C[C@@H]1CCCN(c2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccn2)C1 1545632483 NEZGLHQDCOFJBY-UTKZUKDTSA-N 442.991 4.071 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCC3(F)CCC3)CC2)cc1 1554959183 KQGBBBFNUPDDLP-UHFFFAOYSA-N 429.584 4.484 10 10 IICE Cc1cc(CCNC(=O)NC/C=C\CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1564856353 LWYUDHMOPFQMGO-KTKRTIGZSA-N 426.561 4.017 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(Cc3cccc(Br)c3)C3CC3)C2)cc1 1565055603 GVVAUGAHZYTPFJ-SFHVURJKSA-N 444.373 4.411 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1ccc(S(=O)(=O)N(C)C(C)C)cc1 1583155728 YILDFEZOHXEEOZ-UHFFFAOYSA-N 445.610 4.115 10 10 IICE O=C(C[C@@H]1CSc2ccccc2O1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595584398 MZUKCNWAGUBPOG-ZWKOTPCHSA-N 432.973 4.070 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2[C@H]3CCCC[C@H]3CCN2C(=O)OC(C)(C)C)c1 1595806530 NUSRYVNNJOUKOL-STHPQGGCSA-N 432.561 4.394 10 10 IICE CCOC(=O)CN(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CCC1 1611215118 ITEDINRQOVMXEW-UHFFFAOYSA-N 433.346 4.414 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnccn2)nnc1N(Cc1ccco1)C(C)C 1611963505 RXRHAUHCWZHXMW-UHFFFAOYSA-N 431.544 4.166 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C 1613364730 TVJBNTKLBVYZEG-XYJFISCASA-N 429.586 4.374 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2nccc(F)c2I)cc1 1617611735 HDCKXSKDLHVRBW-UHFFFAOYSA-N 435.240 4.485 10 10 IICE CCC(C)(C)c1ccc(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1623379069 BYFJMXMTJXQYCY-CCEZHUSRSA-N 435.568 4.226 10 10 IICE CCCCn1ncc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1C 1623512248 DBHPYRGKDBUXQG-PDGQHHTCSA-N 446.573 4.361 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1628855315 XJMARVMDSQCLNO-UHFFFAOYSA-N 431.536 4.015 10 10 IICE C[C@]1(c2cccc(Br)c2)C[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1630287896 NKIFRRDSHIQEBS-JTHBVZDNSA-N 443.385 4.004 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(O)cc(Br)c1 1632039864 HAXRXCFFTYXPCZ-UHFFFAOYSA-N 441.272 4.155 10 10 IICE Cc1cc(CC(=O)N2CCS(=O)(=O)C3(CCCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1636114354 GZWGONKHQWEMGP-UHFFFAOYSA-N 449.016 4.250 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1 1636262485 HKQQSNWORCCEOL-QAPCUYQASA-N 435.494 4.348 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCCc2c[nH]c3c(Cl)cccc23)N(C)C)cc1 1637399307 NNSXGLOIEQBTAZ-OAQYLSRUSA-N 427.980 4.032 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1637436619 UIQDLEIQYLBRLE-FQEVSTJZSA-N 431.305 4.459 10 10 IICE Cc1ccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1Br 1638160529 KGNCSROQFZPCAI-GOSISDBHSA-N 433.346 4.354 10 10 IICE CC(C)(C)OC(=O)N1CCO[C@H](CN(Cc2cccs2)c2ccc3c(c2)OCCO3)C1 1642028902 AQGHRSBBSPRHEA-SFHVURJKSA-N 446.569 4.162 10 10 IICE COC(=O)/C=C/c1ccc(N(C)Cc2cc(Br)ccc2OC)c([N+](=O)[O-])c1 1642472350 YFOIQDVOMSDKBI-WEVVVXLNSA-N 435.274 4.189 10 10 IICE CC(C)[C@@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1F 1654166647 ATXCWSBGGUNRKS-QJMRKGMQSA-N 445.554 4.182 10 10 IICE CCCN(C(=O)c1cccs1)C1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1 1655251078 XTDRFXDWNJNXMK-UHFFFAOYSA-N 433.530 4.195 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1675045926 XBIUWZVLIWCWPW-JOCHJYFZSA-N 434.584 4.178 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1 1682379881 JECFEBZTLQEFQQ-UHFFFAOYSA-N 444.620 4.465 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN([C@@H](C)c4cccnc4)CC3)c2C)c1 1683302919 DVBMHCQEEKEQQO-NRFANRHFSA-N 431.584 4.386 10 10 IICE CN(C)c1ccc(CN(C(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)C2CC2)cc1 1687008380 HPMTYDOWCLTNOP-UHFFFAOYSA-N 430.593 4.264 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(CC)C[C@@H]2CCCO2)cc1 1695619089 FHIJVGJHNSDKSC-QFIPXVFZSA-N 436.604 4.183 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1710386865 QRAOYWJLMLCLJY-OAQYLSRUSA-N 437.588 4.393 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3CCC3CC(OC(C)(C)C)C3)CC2)cc1 1711865333 RJNIICANHIDQMO-UHFFFAOYSA-N 441.620 4.296 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@H]3CCC[C@@H]32)cc1 1728379299 QEYIQKFSKOTVBI-IRLDBZIGSA-N 438.620 4.080 10 10 IICE CCC(CC)[C@@H](Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N(C)C 1743993157 HZIDMZWCHHQLKJ-IRLDBZIGSA-N 429.609 4.228 10 10 IICE CCCCOCCn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1745554547 ZEDPYBLWSLCWMI-UHFFFAOYSA-N 447.599 4.158 10 10 IICE O=C(CCn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)Nc1nccs1 1860344772 FMLXFGXJMGXTAJ-UHFFFAOYSA-N 441.516 4.060 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](NC(=O)CC3CCCCC3)c3ccccc3)CC2)cc1 1862113473 JHLYNNXMJNYHCD-SANMLTNESA-N 449.595 4.172 10 10 IICE Cc1cccc(O)c1CNC1(CNC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1 2067209042 QSOUAVJREIZFOB-UHFFFAOYSA-N 439.600 4.350 10 10 IICE COC(=O)c1c(C2CCC2)nn([C@H](C)c2ccc(C)cc2O)c1I 2079004258 OGQPXMKCNJBKQL-LLVKDONJSA-N 440.281 4.165 10 10 IICE CCc1nn(Cc2cccc(Br)c2O)c(I)c1CC 2079671217 XBIINTMRTPGQPT-UHFFFAOYSA-N 435.103 4.129 10 10 IICE CC[C@H](NCC1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)c1cc(Br)ccc1O 2087331296 ZMYHVLIPPBDIGL-ZACQAIPSSA-N 425.367 4.308 10 10 IICE OCc1ccc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)c(Br)c1 2096467751 KFGYHJCTCGIRFG-UHFFFAOYSA-N 425.317 4.289 10 10 IICE CC(C)(C)OC(=O)Nc1cncc(CNCc2cc(Br)cc(F)c2O)c1 2136925074 OGSVDPMRALPATC-UHFFFAOYSA-N 426.286 4.326 10 10 IICE COc1cc(Cl)cc(CN[C@H]2CN(C(=O)OCc3ccccc3)CC23CCC3)c1O 2145350604 FFKYATDYAYTXTR-FQEVSTJZSA-N 430.932 4.335 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)c1O 2236056771 XIWOKXYAUMSXSK-UONOGXRCSA-N 443.382 4.146 10 10 IICE Cc1cccc(NC(=O)CCCN2C(=O)C(=Cc3ccc(O)cc3O)SC2=S)c1 2314832030 YENCVQKQAZVRJH-UHFFFAOYSA-N 428.535 4.026 10 10 IICE CN(CC(=O)N1N=C(c2cccn2C)C[C@@H]1c1ccc(Cl)cc1)C(=O)CC(C)(C)C 35962132 XVWJLZORPVIPQS-HXUWFJFHSA-N 428.964 4.251 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1O 726592612 ONTIJFNABAFPGJ-UHFFFAOYSA-N 444.491 4.157 10 10 IICE COc1cccc(-c2ccc(CNC(=O)NCc3ccc(N4CCOCC4)cc3)cc2)c1 745744598 CFFMNXJKOXBFPR-UHFFFAOYSA-N 431.536 4.198 10 10 IICE O=C(NCCc1c[nH]c2cc(F)ccc12)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745785947 FMLVJLJZOOJLKM-KRWDZBQOSA-N 446.473 4.419 10 10 IICE CC(C)N1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1ccc(F)c(F)c1 778673855 GUESULVOCFQJFA-DNQXCXABSA-N 440.538 4.364 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)c(O)c1 794379879 UJGSULVGOPHTLO-LPTQZCDUSA-N 442.943 4.144 10 10 IICE CCOC(=O)c1cnn(C2CCN(Cc3cc(OC)cc(C(C)(C)C)c3O)CC2)c1C 795641885 NWLHZSGVMNPYBP-UHFFFAOYSA-N 429.561 4.217 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1cccc(NCc2cc(C)cc(Br)c2O)c1 796430561 MRCVOFKWYIWAFN-CYBMUJFWSA-N 427.364 4.152 10 10 IICE COc1cc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)c(OC)c1 800573349 QKSCIPKYZJWQJM-OAHLLOKOSA-N 435.471 4.404 10 10 IICE CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 813683848 FOYNDPLSZIRJFB-LJQANCHMSA-N 435.351 4.315 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)N1CCO[C@@H]2CCCC[C@H]21 917205082 BYQLXDUIEJBFRK-IFMALSPDSA-N 437.565 4.454 10 10 IICE O=C(O)/C=C\c1ccc(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c([N+](=O)[O-])c1 920964732 KRFQKRUAIROOOV-ALCCZGGFSA-N 435.402 4.034 10 10 IICE Cc1c(C(=O)N2CCOc3cc(N(C)C)ccc32)cnn1-c1ccc(C(F)(F)F)cc1 1126439582 ASWVKJHWEDGOBS-UHFFFAOYSA-N 430.430 4.305 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCCCN2C[C@@H](C)C[C@@H](C)C2)CCCC1 1136255172 MJEWNRQFZIEMER-BGYRXZFFSA-N 425.617 4.403 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1 1136359582 OFQMUMOJWZHSBG-UHFFFAOYSA-N 425.488 4.369 10 10 IICE C[C@@H]1Cc2cccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)c2O1 1136903949 PFXYJNYWRASGEK-IERDGZPVSA-N 439.556 4.072 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@]34CCCC[C@@H]3N(C(=O)OC(C)(C)C)CC4)ccc21 1292206955 NZZLVHNIMOQLJI-SQJMNOBHSA-N 427.589 4.255 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(NCc4ccsc4)cc3)c2)CC1 1293755352 JWZZRGOXPSGXFL-UHFFFAOYSA-N 434.565 4.314 10 10 IICE CN(Cc1ccccc1F)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1298358140 OMVZNIJXQFSXMF-UHFFFAOYSA-N 441.561 4.150 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccnn1C1CN(C(=O)OC(C)(C)C)C1 1304695945 KHMBUNVOTVWIOX-UHFFFAOYSA-N 441.557 4.396 10 10 IICE CCN(C)c1ccc(CN2CCN(C(=O)[C@@H](C)Oc3ccc(C)cc3Cl)CC2)cc1 1307491419 WWKQSIZUOHPFQE-LJQANCHMSA-N 429.992 4.216 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3cc(F)ccc3F)C3CCCC3)cc2)CC1 1313211641 IERYXWVHINNIBO-UHFFFAOYSA-N 442.554 4.371 10 10 IICE COCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C 1315963128 DHPYBOGWYGSKJM-AVRWGWEMSA-N 437.588 4.129 10 10 IICE COc1ccc(C[C@H](CO)CNC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1O 1445684768 FHWJUSHLNSCALB-NRFANRHFSA-N 436.552 4.006 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@H]2c3cccc(Br)c3CC2(C)C)cc1 1460163591 VMWNBZKRIYTDLW-NRFANRHFSA-N 430.390 4.045 10 10 IICE Cc1cc(CC(=O)NCC2(N3CCOCC3)CCCCC2)c(C)n1-c1ccc(Cl)cc1 1463661842 SSVWUBFNQRNUKL-UHFFFAOYSA-N 444.019 4.441 10 10 IICE CC(=O)c1ccc(Br)c(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 1467185253 KVHOFXNYLIBOOP-UHFFFAOYSA-N 446.345 4.152 10 10 IICE CCN(C)C(=O)OC[C@@H]1CCCCN1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1479063186 BWPKUIJIVFYVIO-QHCPKHFHSA-N 440.588 4.289 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1Nc1cnn([C@H]2CC2(F)F)c1 1510676401 XPWGMECZWKMWLJ-IBGZPJMESA-N 429.519 4.420 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1F 1517002855 BJIFROAKLULEOL-FQEVSTJZSA-N 431.600 4.371 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCCCC(=O)OC(C)(C)C)C1 1521754068 WWFXPXBWHNUTOZ-UHFFFAOYSA-N 441.616 4.426 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(C)c1I 1525762771 UGBXQIBHMSSJIY-OAHLLOKOSA-N 436.337 4.335 10 10 IICE C[C@@H](NC(=O)CCOc1cccc(I)c1)c1ccc(N(C)C)cc1 1538976554 QXKMHPCTXPWRLS-CQSZACIVSA-N 438.309 4.004 10 10 IICE C[C@H](c1cccc(O)c1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1545505025 QUWZBKXAJLRWRO-VCRXTVNUSA-N 444.553 4.342 10 10 IICE CCCCN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)c(F)c1 1546998642 YAVVFBZJAHVGQD-UHFFFAOYSA-N 443.592 4.191 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCCC(=O)OC(C)(C)C 1556426491 OSXSTCXBJDBGGC-UHFFFAOYSA-N 434.577 4.277 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2CC(=O)N1CCCN(Cc2ccccc2C)CC1 1559927050 FTZHRKMIWDYQKX-VWLOTQADSA-N 449.639 4.373 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 1566846578 YQVNEXNKQFAYIS-LVXARBLLSA-N 430.548 4.383 10 10 IICE CC(C)c1cccc(-n2cc(O)c(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)n2)c1 1597908237 MDNSMORKCKMASZ-GOSISDBHSA-N 434.540 4.029 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC2(C(=O)N3CCOCC3)CCCCC2)c1 1617333222 PSKJVTAUALBGHN-UHFFFAOYSA-N 443.975 4.039 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)N=S(C)(C)=O)c(C)n1-c1cccc(C(C)C)c1 1629390828 QRELFLYHOINMLN-NRFANRHFSA-N 429.586 4.076 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)c1 1630152152 NUJVMWJDKZQWDL-OAQYLSRUSA-N 430.426 4.389 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)c1 1631952245 YKEQSVSEJZKGJQ-QFIPXVFZSA-N 443.507 4.479 10 10 IICE O=C(Cc1csc(-c2sccc2Br)n1)NCc1c(O)cccc1F 1635367010 VQWBDJWMZFWFNR-UHFFFAOYSA-N 427.320 4.338 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccsc1Br 1635940782 JDJMIXXSTPCOSA-ZDUSSCGKSA-N 429.767 4.264 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CC[C@@H](C)N(C(=O)OC(C)(C)C)C3)ccc21 1642247096 GAUHINQBFFQDFC-OXQOHEQNSA-N 443.588 4.422 10 10 IICE Cc1cc(C(=O)N2CC(O)(c3ccc(F)cc3)C2)c(C)n1-c1ccccc1Br 1644057480 IEPISSJXBUERTO-UHFFFAOYSA-N 443.316 4.339 10 10 IICE CCOc1ccc(N(CC)CC(=O)N2c3ccccc3NC(=O)C[C@@H]2C(F)(F)F)cc1 1653718333 NPFNTTQNFZOONQ-LJQANCHMSA-N 435.446 4.218 10 10 IICE COc1cc2c(cc1CNC(=O)NCCc1cc(C)n(-c3ccccc3)c1C)O[C@@H](C)C2 1670734539 UAYIDNKVBOKIGX-SFHVURJKSA-N 433.552 4.468 10 10 IICE C[C@H]1CC[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CN1C(=O)OC(C)(C)C 1675001290 IGFXYXCOCDVLDF-PKOBYXMFSA-N 430.593 4.215 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](Cn1ccnc1)c1ccccc1 1675535438 BKGLZDZGTBZIJL-IBGZPJMESA-N 443.345 4.324 10 10 IICE COc1ccc(CN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)[C@@H](C)C2CC2)cc1 1676653831 YPNLCJZIMCWFFT-UQBPGWFLSA-N 438.616 4.374 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cccc(Cl)c3)n2CCCSc2nccs2)C1 1730973365 LTLNNKIDMYKKRT-MRXNPFEDSA-N 436.006 4.463 10 10 IICE CS[C@H](C)Cn1c(-c2ccc(C)o2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1731035513 UVWOBSOUYGBMJK-GOSISDBHSA-N 441.601 4.071 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C(F)(F)F)O[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1743605963 FSMOYCGTSQVCPA-GMBSWORKSA-N 439.526 4.370 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccc4c(c3)OCO4)C(=O)N(C(C)C)C2=O)cc1 1873423219 AATXKPQMWNPERQ-UHFFFAOYSA-N 443.503 4.423 10 10 IICE CC(C)Cc1cc(I)n(Cc2ccc(Br)cc2O)n1 2070028892 XJADPSVLMDTPDK-UHFFFAOYSA-N 435.103 4.203 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C3CC3)c(C=O)c2I)c(O)c1 2080001932 PMJZCWRFPYYTNJ-QGZVFWFLSA-N 440.281 4.137 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1O 2227750476 JZNAKZXSHAIMKU-STQMWFEESA-N 429.355 4.089 10 10 IICE CCC(NCCc1cnc[nH]1)=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 2294317206 VUXVRWYWLUCPJO-UHFFFAOYSA-N 442.548 4.267 10 10 IICE Cc1ccc(NC(=O)CN2C(=O)NC(=Cc3cc(C)n(C4CCCCC4)c3C)C2=O)cc1 2297313819 IOJWFASFEASWMA-UHFFFAOYSA-N 434.540 4.450 10 10 IICE CN(C)c1ccc([C@H](NC(=O)C=Cc2cccc(Br)c2)c2nccn2C)cc1 2329588262 FLVKGEXYKGEDHA-NRFANRHFSA-N 439.357 4.168 10 10 IICE Cc1ccc(CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C23CC3)c(O)c1Br 2352950396 RYBDJZWRDOXDCV-OAHLLOKOSA-N 425.367 4.485 10 10 IICE CC[C@@H](C)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(O)c(Br)c3)C2=O)cc1 2220977 QHTIXXPZKASWSP-HMHNVIDESA-N 443.297 4.335 10 10 IICE Nc1ccc(-n2nnc(S(=O)(=O)c3ccc(Cl)cc3)c2-c2ccc(F)cc2)cc1 11730625 JRPNRTLEKIDIKK-UHFFFAOYSA-N 428.876 4.142 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2ccc([S@](C)=O)cc2)C1 435917193 LOAZIMGHPQRXHJ-DRKIFQHWSA-N 437.609 4.023 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CNCc1c(O)cccc1Br)C2 720639120 RRNGBWXZIMHKSR-GJZGRUSLSA-N 425.367 4.422 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N[C@H]1CCCN(Cc2c(F)cccc2F)C1 732241908 RTSCKGRUPBMGFD-IBGZPJMESA-N 428.527 4.029 10 10 IICE CC(=O)N1CCCc2cc(S(=O)(=O)Nc3nc(-c4ccc(F)cc4)cs3)ccc21 748672775 HOYXUQKCKUVNFY-UHFFFAOYSA-N 431.514 4.049 10 10 IICE C[C@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cc(Br)cc(F)c1O 756592381 HVKJBAYVQBGRKL-AWEZNQCLSA-N 435.337 4.497 10 10 IICE C[C@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc(N2CCOCC2)c(F)c1 765068660 SWJWQWOMOZXUNL-FQEVSTJZSA-N 446.570 4.471 10 10 IICE Cc1noc(-c2ccccc2)c1NC(=O)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 773152460 XDENJGKMFOQMJR-UHFFFAOYSA-N 442.519 4.355 10 10 IICE CCOc1cc(O)ccc1NS(=O)(=O)c1ccc(Br)cc1C(F)(F)F 790411313 JVSXDDVAKFAQPI-UHFFFAOYSA-N 440.237 4.373 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cn(-c2ccccc2)nc1-c1cccnc1 804738644 YHKFXGKUJSQQHW-UHFFFAOYSA-N 449.308 4.332 10 10 IICE O=C(CSCC(=O)c1ccc(Cl)cc1)NCc1cc(Br)ccc1O 804738780 DGBUVRPMBKYORT-UHFFFAOYSA-N 428.735 4.040 10 10 IICE O=C(NC[C@H]1CC[C@H](c2ccccc2)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 808371348 QVZPBAUBJADSSQ-FGZHOGPDSA-N 445.510 4.476 10 10 IICE COc1ccc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1124864579 ZIXUFVWXPQTQFX-ITRAFESCSA-N 444.553 4.303 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1cc(-c2ccccc2)c(C)n1 1139584750 JSYQYENWWWSNBD-UHFFFAOYSA-N 448.567 4.247 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F 1139585898 XUEOTYNZDFQFMB-VQTJNVASSA-N 430.495 4.457 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)c2cccc(O)c2O)C1 1161351519 IEXMUVWQABOHET-SJLPKXTDSA-N 444.503 4.008 10 10 IICE Cc1cc(CCNC(=O)N2CCN(Cc3cccc(F)c3)CC2)c(C)n1-c1ccccc1 1253807399 BLVZXDYBIPEXAK-UHFFFAOYSA-N 434.559 4.303 10 10 IICE CCOc1cccc2c1OCC(C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)=C2 1292382423 RQKQQPFXVFSAOZ-QHCPKHFHSA-N 436.552 4.135 10 10 IICE CCc1nnc(N2CCC(c3cnn(CC)c3)CC2)n1CCCSc1nccs1 1292944448 XZPISRSRVSRUNJ-UHFFFAOYSA-N 431.635 4.080 10 10 IICE CC[C@H]1CCCCN1CCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1293374950 ZLJQEWYQDZHTOI-UNMCSNQZSA-N 427.593 4.126 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccn(-c3c(F)cccc3F)n2)cc1 1352927226 NTDPYLBSQQYJKW-UHFFFAOYSA-N 438.400 4.421 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1=Cc2cc(Br)ccc2OC1 1353911772 UHADYYZXFWQZNL-UHFFFAOYSA-N 427.342 4.484 10 10 IICE O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1360045352 CAISPXVGBLTRKW-IRXDYDNUSA-N 436.421 4.263 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCCNC(=O)c2cccc(F)c2)c1 1435164966 FEYNQQHCFOLJJM-UHFFFAOYSA-N 427.907 4.437 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(-c2ccc(Br)cc2)cn1 1442342710 MWUNNJKJMWCETK-UHFFFAOYSA-N 427.346 4.363 10 10 IICE CCOC(=O)c1ccc2c(c1)NC(=O)[C@H](C)N2C(=O)c1ccc(-n2c(C)ccc2C)cc1 1457185959 KMPBGMFSXNAXPY-KRWDZBQOSA-N 431.492 4.258 10 10 IICE C[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1)c1ccc(N(C)C)cc1 1459178658 OZEUAHLFVUZZKQ-SXSPYAJSSA-N 434.609 4.302 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Cl)cc(Br)c1 1460741056 KWWHXWAONNEBAF-UHFFFAOYSA-N 445.691 4.147 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCN(c4ccc(Cl)cc4Cl)C3)C2)cc1 1470026521 PTHYDRCEZKBCGA-IRXDYDNUSA-N 449.382 4.159 10 10 IICE CCc1nnc(N(C)Cc2ccc(Cl)s2)n1Cc1ccc(N2CCOCC2)c(F)c1 1498650153 KFHKXNWWMCRADY-UHFFFAOYSA-N 449.983 4.216 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)CC)C1 1499568127 IKMPNSDSQFAJLM-FQEVSTJZSA-N 434.588 4.067 10 10 IICE CC1CCN(c2ccc(Cn3c(C(C)C)nnc3N(C)Cc3ccccc3O)cn2)CC1 1512277676 SFHJAUMGMXMWEE-UHFFFAOYSA-N 434.588 4.423 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](COC)OC)C1 1514090976 RSLVUZLHYCZBCV-IRLDBZIGSA-N 437.588 4.250 10 10 IICE CCCN(CCC)C(=O)c1cccc(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)c1 1529705923 CIKHOHGQHUZMLE-HXUWFJFHSA-N 437.584 4.214 10 10 IICE CCc1ccc(N2C[C@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1530889129 HTLHLWURZRTSGV-HSZRJFAPSA-N 429.564 4.368 10 10 IICE Cc1nc(Cc2nnc(N(C)OC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1542905064 DNCMTPZFCNSJQP-UHFFFAOYSA-N 444.580 4.198 10 10 IICE Cc1cc(C(=O)N(CCN2CCOCC2)[C@H]2CCSC2)c(C)n1-c1cccc(Cl)c1 1556834886 WEFHAZKBVVLEJX-NRFANRHFSA-N 448.032 4.027 10 10 IICE COc1ccc([C@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c2ccco2)cc1 1564938241 QOWHGUAIYHDYSG-QHCPKHFHSA-N 439.487 4.057 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC3(c4cccc(OC(F)(F)F)c4)CC3)C2)cc1 1564962371 JULZUHICPVKAPY-INIZCTEOSA-N 449.473 4.409 10 10 IICE C[C@H]1c2ccc(C(=O)NCCCSc3nccs3)n2CCN1C(=O)OC(C)(C)C 1565620007 HMPHFUWZLQBPCB-AWEZNQCLSA-N 436.603 4.169 10 10 IICE CCN(CC)CCO[C@@H]1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1566250568 XXRXMWDJTOUUTR-HSZRJFAPSA-N 432.008 4.249 10 10 IICE Cc1cc(CC(=O)NC[C@@H](O)COc2cccc(Cl)c2Cl)c(C)n1-c1ccccc1 1595411164 WXONYSSOSNEIOR-LJQANCHMSA-N 447.362 4.500 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)C(C)(C)N1CCOCC1 1610122717 LRQZQSQBRCONAZ-FQEVSTJZSA-N 449.517 4.409 10 10 IICE CC(=O)c1nn(C)cc1OCC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1615072298 YMYQDJFAWRWJBO-UHFFFAOYSA-N 430.302 4.054 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(C)c3ccc(Oc4ccccc4)cc3)CC2)cc1 1616280666 RCEAUEQEVRADCB-DEOSSOPVSA-N 447.579 4.107 10 10 IICE Cc1oc(Br)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634997 NSMQOJUIBQIBDJ-AWEZNQCLSA-N 427.726 4.104 10 10 IICE O=C(c1cnnn1-c1cccc(Cl)c1Cl)N(Cc1ccccc1O)C[C@H]1CCCO1 1623641000 QRIRMYUJMLOVQM-OAHLLOKOSA-N 447.322 4.101 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(I)cc1OC 1626160983 SBMJTIDYVGNQEX-UHFFFAOYSA-N 439.293 4.448 10 10 IICE Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1626252868 CEISUUIADSDFOR-DEOSSOPVSA-N 445.519 4.077 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ncc(C(F)(F)F)s1 1626511989 VGXPOCLJORNCSJ-UHFFFAOYSA-N 429.464 4.164 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(Cl)c3)ccc21 1626941313 WZNHMKXAUFLRPZ-JTSKRJEESA-N 446.378 4.212 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)CC(=O)N(C)[C@@H](C)c2ccccc2)c1 1633674580 HIGHVKJPRPEWBI-IBGZPJMESA-N 431.536 4.198 10 10 IICE COc1ccc(C[C@H](C)CN(C)C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1636353493 CQTVMUZRKKUIPO-PZJWPPBQSA-N 425.573 4.050 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CNC3(c4ccc(C(C)(C)C)cc4)CCCC3)nc12 1653890864 KNIVFUDMLYSJEL-UHFFFAOYSA-N 436.556 4.468 10 10 IICE CC1(C)C[C@H](NC(=O)NCc2cccc(Cl)c2O)CCN(C(=O)OC(C)(C)C)C1 1675056727 XTWCMJWHAWMJGT-OAHLLOKOSA-N 425.957 4.271 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@](CO)(C(F)(F)F)C3)cc2Cl)C1 1682024388 RPGBDNORCCJSFZ-KUHUBIRLSA-N 433.902 4.033 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(-c4ccco4)cc3F)CC2)c(OC)c1 1682060367 YMVDZSBXVDHAQU-UHFFFAOYSA-N 439.487 4.135 10 10 IICE CCC1(NC(=O)OC(C)(C)C)CCN(C(=O)NCc2c(O)ccc3c2CCCC3)CC1 1684915722 FGCKGFCBIXLEOZ-UHFFFAOYSA-N 431.577 4.250 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC(C)(C)O1 1693753767 LGFIIHXSQWEMAS-SFHVURJKSA-N 443.661 4.181 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1727820872 VIISRXLYPISDTL-OAQYLSRUSA-N 443.661 4.083 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1728384121 YEDPQJPJEQATHC-GHTZIAJQSA-N 427.593 4.028 10 10 IICE CC[C@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1744932893 ZXYFXJQDPNVUMO-PMACEKPBSA-N 425.621 4.285 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCC(COC)CC2)cc1 1746092823 LYVMWTYZZVYKMS-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N3CCO[C@@H](C)C3)cc2)CC1 1762950284 QPPPEGUFUJYCKO-FQEVSTJZSA-N 425.621 4.376 10 10 IICE CN(C)c1ccc(Cn2c(N3CCO[C@@](C)(C(C)(C)C)C3)nnc2C(C)(C)C)cc1F 1768498916 SHLXSNIYVWWLQC-XMMPIXPASA-N 431.600 4.470 10 10 IICE COc1ccc(OCc2nnc(N3CCC[C@@H]3C)n2CCCSc2nccs2)cc1 1770284847 NRAGQFILNRGFHP-INIZCTEOSA-N 445.614 4.493 10 10 IICE CC(C)Cc1nnc(N2CCN(c3cccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1772843422 DWNQLZUHDJPEMX-UHFFFAOYSA-N 442.608 4.118 10 10 IICE COc1ccc(N2N=C(c3ccccc3)/C(=C/c3cc(OC)c(O)c(OC)c3)C2=O)cc1 1865677904 JSPKAMBPEHBWAF-MOSHPQCFSA-N 430.460 4.253 10 10 IICE COc1ccc(Cn2nc(C(C)(C)C)c(C(F)F)c2I)c(O)c1 2079768736 GOJYZPLIZRJAFF-UHFFFAOYSA-N 436.240 4.485 10 10 IICE CCC1=NN2C(=N)C(=Cc3cc(C)n(-c4cc([N+](=O)[O-])ccc4C)c3C)C(=O)N=C2S1 2296808012 KQRPSGFSNXUDNI-UHFFFAOYSA-N 436.497 4.340 10 10 IICE Cc1ccc(CN(C)C(=O)[C@](C)(NC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2381135591 SXIIZEAOPMGSHE-HXUWFJFHSA-N 441.366 4.115 10 10 IICE Cc1cc2c3c([nH]c2cc1S(=O)(=O)NCc1ccc(N(C)C)cc1)CC(C)(C)CC3=O 9685615 BGQYGVOPUWKLDA-UHFFFAOYSA-N 439.581 4.176 10 10 IICE COc1c([N+](=O)[O-])cc(N(C)CCOc2ccc(C)cc2)c([N+](=O)[O-])c1Br 14273858 YGVWMXJGCZVMRA-UHFFFAOYSA-N 440.250 4.098 10 10 IICE CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 24654268 IEQVDMOGBQMUOH-QHCPKHFHSA-N 443.538 4.368 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)c3ccc(C)c(C)c3)c3ccco3)CC2)cc1 38598103 BFZKLEQXSAXBLG-DEOSSOPVSA-N 433.552 4.198 10 10 IICE N=C1/C(=C/c2cccn2-c2cccc(F)c2)C(=O)N=C2SC(COc3ccccc3)=NN12 96462524 QVQQLDSZDPSTPO-QGUUBAPPSA-N 445.479 4.315 10 10 IICE Cc1cc(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)n1-c1ccccc1F 110417600 HGFNLUCSIVBECS-RTBURBONSA-N 427.564 4.195 10 10 IICE CC(C)N(C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(C)C 731988653 GFTUCZWFCVSCKO-OQLLNIDSSA-N 441.416 4.296 10 10 IICE CC(=O)c1cnc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)s1 736151925 FAINLEYBYMUWLD-WQLSENKSSA-N 437.593 4.027 10 10 IICE C[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cc2c(s1)CCC2 765282131 STEZTCKZRAZUNR-KRWDZBQOSA-N 437.588 4.343 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 765771214 VPRJRZHFYRSJPA-OLZOCXBDSA-N 430.220 4.473 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]c3cc(F)ccc23)NC(=O)OC(C)(C)C)cc1 765851795 UPNFGJCYACDGBQ-OAQYLSRUSA-N 440.519 4.369 10 10 IICE CC(C)C(=O)N1CCC(NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 799861668 KLUSOYCDLLCSIK-KRWDZBQOSA-N 435.012 4.023 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)CC1 812266231 YJKOJFZEBRNEHQ-QHCPKHFHSA-N 447.583 4.315 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CS(=O)(=O)c2ccc(Cl)cc2)cc1 914491375 IZUPQBVVEWQTFQ-UHFFFAOYSA-N 446.956 4.002 10 10 IICE CCOc1ccc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O 1084234649 LFBYLXAXYVTZIV-WJDWOHSUSA-N 443.297 4.131 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2[C@@H](NC(=O)OCc3ccccc3)[C@H]3C=C[C@H]2C3)cc1 1125165955 AENWGEFJRXJQCV-TWVZQSRDSA-N 447.579 4.266 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(CN4CCCCC4)cc3)cc2F)C[C@H](C)O1 1125258130 DWJWBBMWBFQPDF-PMACEKPBSA-N 439.575 4.355 10 10 IICE CC(C)N(CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)OC(C)(C)C 1125947969 CJRNAXNOSPLUIT-UHFFFAOYSA-N 441.519 4.019 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)cc1 1135946176 IMTQXEKOPWVCGT-HXUWFJFHSA-N 435.634 4.234 10 10 IICE Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1150593610 VTPQJPJFDSASMR-IBGZPJMESA-N 442.361 4.271 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCC(=O)c3cc(Cl)sc3Cl)cc2)CC1 1153443202 HSZJFSUNTGXZEA-UHFFFAOYSA-N 440.396 4.086 10 10 IICE COCCN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(OC)c(OC)c1 1167696421 QTKIHYMWSWUZDZ-UHFFFAOYSA-N 446.853 4.468 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C[C@H](C)O1 1293579281 QJMDTQHDBHYUJE-SIKLNZKXSA-N 434.588 4.075 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCCCCCC2)cc1 1295411788 WRXXHFFXSXPEJY-UHFFFAOYSA-N 438.620 4.179 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCN(CC(C)C)CC3)nnc2C(C)(C)C)cc1 1295420400 ZDLONBPKJKWANX-UHFFFAOYSA-N 426.653 4.248 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1n[nH]cc1[N+](=O)[O-] 1306453272 VHPLBFURCNYTLW-OAHLLOKOSA-N 433.390 4.243 10 10 IICE CCCN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1CCc2ccccc2C1 1312833460 ITJHCECLOJAFGU-OAQYLSRUSA-N 443.538 4.281 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]1c1ncc(Br)cn1 1312885479 QAPVOTGWTDIZNX-HNAYVOBHSA-N 446.393 4.091 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)N(C)C)cc1 1313419941 WGQQAPRUFHIJDD-BWKNWUBXSA-N 433.600 4.426 10 10 IICE CCOCc1nnc(N(CC)Cc2cccs2)n1Cc1ccc2c(c1)CCCN2C 1314315352 ZGFNTWHVRYVYOM-UHFFFAOYSA-N 425.602 4.333 10 10 IICE COC[C@@H]1CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C1 1315916837 HZIILRVZBZMHCU-MRXNPFEDSA-N 435.644 4.042 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Nc2cnn(C)c2)nnc1[C@@H]1CCO[C@H]1C(C)(C)C 1361098382 TWJOQIGSUJCPEM-NHCUHLMSSA-N 437.592 4.097 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1 1436853476 LMNHVYMWTYGBJX-DENIHFKCSA-N 429.564 4.315 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)N(C)C)cc1 1439959397 FBIOOVQAROEMJU-PWRODBHTSA-N 435.490 4.174 10 10 IICE COc1ccc(N2CCN([C@@H](C)c3nc(-c4ccc(Cl)cc4)no3)CC2)c(OC)c1 1460650434 IVBHJLYEBNVNKB-HNNXBMFYSA-N 428.920 4.290 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3ccco3)nc3c2cnn3C(C)C)cc1 1461344437 JPPLMINUEURDIS-UHFFFAOYSA-N 447.539 4.489 10 10 IICE COC(=O)CCCOc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1465005146 UNPPYOPOCCWURN-UHFFFAOYSA-N 448.519 4.420 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ncoc1C1CCN(C(=O)OC(C)(C)C)CC1 1465029250 JINONINHLPOMBU-UHFFFAOYSA-N 442.560 4.094 10 10 IICE Cc1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C)n1C[C@@H]1CCCOC1 1466290284 VNJAETVHPMLPAN-RBBKRZOGSA-N 426.557 4.059 10 10 IICE CCCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@@H](C)CC(=O)Nc1ccccc1 1470771302 CJKWNZIBXBFNAJ-PZJWPPBQSA-N 438.572 4.113 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(Cc3cnn(Cc4ccccc4)c3)C(C)C)C2)cc1 1470774219 YBPAMYBUSYNPNU-QHCPKHFHSA-N 447.583 4.139 10 10 IICE CSc1ccccc1CN(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473436537 OIJARFZLNLCOMK-UHFFFAOYSA-N 430.529 4.254 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 1478841291 SSIYJSVGMIFHKP-IBGZPJMESA-N 431.024 4.419 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(N)=O)C1 1508741809 PRAMZRYBPLFFJQ-AREMUKBSSA-N 446.599 4.411 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3ccc(Cl)cc3C)cc2F)CC1 1521009741 KMWIMIBWFGFOKN-KRWDZBQOSA-N 433.955 4.013 10 10 IICE CN(C)[C@@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(Cl)cc1 1533327059 ASSHHLOKHSVAMZ-FXAWDEMLSA-N 437.918 4.329 10 10 IICE Cc1cc(CNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccccc1 1535143870 QOBXJJBTMOWAJL-UHFFFAOYSA-N 429.480 4.333 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(C(=O)Nc4ccccc4)c3)C2)cc1 1537109462 OYODFKSGTSRIIV-IBGZPJMESA-N 429.520 4.204 10 10 IICE CC[C@@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1541080313 FNFFTAKIFOJSRC-YLJYHZDGSA-N 435.634 4.186 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C[C@@H]1C 1544303435 XRLMFNMYHDXRLQ-PMACEKPBSA-N 439.648 4.315 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1547102577 WKSXKULNPLZHAS-HXUWFJFHSA-N 442.627 4.357 10 10 IICE COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559698132 QKALLVIGFUUMLS-HZPDHXFCSA-N 428.488 4.148 10 10 IICE CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1568142093 MYGMBNATPMGCOV-NIZGNDASSA-N 425.960 4.370 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCO[C@@H](c3cnn(C)c3)C2)c(C)n1-c1ccc(Cl)cc1 1569688112 HCUQDGFARROOET-RBBKRZOGSA-N 426.948 4.060 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCc3c(O)ccc4c3CCCC4)cc2C1 1595615924 QDEIHKHXPFGAGC-UHFFFAOYSA-N 436.552 4.494 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(OCC(C)C)cc3)CC2)c(OC)c1 1623759352 CUKNWUUGEQXQGU-UHFFFAOYSA-N 440.584 4.365 10 10 IICE CCN1CCN(c2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc2)CC1 1624348075 VSKPHTQYECCXDC-UHFFFAOYSA-N 444.579 4.230 10 10 IICE CCc1cc2c(CC(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)csc2s1 1626095559 WFADCQHVEVMAST-UHFFFAOYSA-N 441.622 4.086 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H](O)c2cccc(C(F)(F)F)c2)cc1 1627988527 DRUDFMCFAVPQCI-QGZVFWFLSA-N 434.380 4.396 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)cc1 1630440137 MYTIOBQQLLEOIV-UHFFFAOYSA-N 444.623 4.422 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 1636262925 JWDSKYVLPADUIJ-UGKGYDQZSA-N 446.599 4.366 10 10 IICE Cc1nc(C(C)C)oc1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1636431249 VWCJMPQQUCVRKZ-YVLHZVERSA-N 447.557 4.153 10 10 IICE Cc1cc([C@@H](CC(=O)NCc2c(O)cccc2F)NC(=O)OC(C)(C)C)cc(Cl)n1 1638863677 PROQOLJYQCLGNH-MRXNPFEDSA-N 437.899 4.160 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(F)cc(F)c1O 1639451617 HYBSHSGMNVYWCV-CHHVJCJISA-N 438.452 4.040 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1c(C)cc(N(C)C)cc1C 1639827012 BKHWVEGQEQSGTP-UHFFFAOYSA-N 439.600 4.301 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(C(=O)c2ccccc2)c1 1641201469 UVSVWENZMNWOPY-HXUWFJFHSA-N 442.559 4.299 10 10 IICE C[C@H](NC(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2)c1ccccc1O 1648892319 VNTQEVLGFJFIBE-ZDUSSCGKSA-N 426.314 4.320 10 10 IICE COc1ccc(N2CCN([C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)CC2)cc1F 1657763507 JHDOSGRIJBOZOV-IBGZPJMESA-N 438.330 4.069 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@@H]3C[C@H](O)c3ccccc3)c2C)c1 1684478904 MEWRCZIRWRVJEC-UIOOFZCWSA-N 447.579 4.437 10 10 IICE C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684970394 LXJSSWPXMHXOMN-KRWDZBQOSA-N 434.506 4.360 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1686096062 DLBVBYDNIILYFM-ZCYQVOJMSA-N 427.564 4.197 10 10 IICE CC(C)[C@H]1CCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1691927411 OWHHSNWMNYQURJ-PMACEKPBSA-N 429.584 4.298 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@](C)(CC)C1 1696424321 GLJHTUOHGLHMQV-VWLOTQADSA-N 437.588 4.394 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@](C)=O)CC1)C(C)C 1709932948 CMLCRZMFUTZWJF-HKBQPEDESA-N 439.629 4.498 10 10 IICE CCN(CC)[C@H](Cn1c(C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)c1ccco1 1728374851 SZEHOMUYVSZGIS-HSZRJFAPSA-N 436.604 4.499 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1 1748357385 KKMBXNQBNPAKNB-IBGZPJMESA-N 437.588 4.393 10 10 IICE Cc1nc(C)c(CCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1751757897 WVNAAFIOGMRZOX-LJQANCHMSA-N 427.574 4.178 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC(C)(C)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1751844603 XRIVFTJQUDVQHW-UHFFFAOYSA-N 435.620 4.189 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(C(C)C)CC2)CCOC1 1761278142 XTPVWMOUWLWGEK-XMMPIXPASA-N 428.577 4.097 10 10 IICE COC[C@H]1CCN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C1 1770921686 ZDCMABDQAONRJQ-HNNXBMFYSA-N 433.578 4.196 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H]2NCc2ccc(Br)cc2O)C1 1918965350 UJOOTSFELIJUCB-FXAWDEMLSA-N 425.367 4.424 10 10 IICE C[C@@]1(NCc2ccc(Br)cc2O)CCCN(C(=O)OCc2ccccc2)C1 1940888022 PWHOSIDNDPJWJQ-OAQYLSRUSA-N 433.346 4.436 10 10 IICE O=C(N[C@@H](C(=O)O)c1cc(F)cc(F)c1O)OCC1c2ccccc2-c2ccccc21 1951519182 VUZPRAJCPOBACU-HXUWFJFHSA-N 425.387 4.335 10 10 IICE CC(C)(C)OC(=O)Nc1cc(I)cc(C(=O)NCCCN=[N+]=[N-])c1 2010390697 HJTSXACVLAKVER-UHFFFAOYSA-N 445.261 4.068 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3ccc(Br)cc3O)CCC[C@H]12 2087289477 MWJIXYMTFLRLKA-PXNSSMCTSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)ccc2O)[C@H]2CCCC[C@@H]21 2122805266 OYSGSWIRNXURCM-IKGGRYGDSA-N 425.367 4.422 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)c1O 2236051448 SVBKTBKAXZUKPT-BZSNNMDCSA-N 431.374 4.306 10 10 IICE CCOc1cc(Cl)c(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1OCC 2313560543 XFZCXMXEULUWCE-UHFFFAOYSA-N 448.903 4.108 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cccc(OC)c3OC)SC2=S)cc1[N+](=O)[O-] 2321630822 XWMMOYPJDCFAMA-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CCC1=NN(c2ccc(OC)cc2)C(=O)C1=Cc1cc(Br)c(O)c(OC)c1 2332107711 WHDKINCKUUBFQT-UHFFFAOYSA-N 431.286 4.368 10 10 IICE CCc1cc(C)cc(OCCOc2ccc(/C=C3/C(=N)N4OC(C)=CC4=NC3=O)cc2)c1 20235971 JZYNYYLOVMPVNF-DRIWLZCMSA-N 431.492 4.466 10 10 IICE Cc1ccc2nc(NCC(C)C)c(/C=C3/SC(=S)N(C4CCCC4)C3=O)c(=O)n2c1 33351726 NUAJXFAGSVMBAJ-LICLKQGHSA-N 442.610 4.215 10 10 IICE Cc1ccc2nc(NC3CCCCC3)c(/C=C3/SC(=S)N(C(C)C)C3=O)c(=O)n2c1 33489169 KWOHKFHMINKIDL-GZTJUZNOSA-N 442.610 4.357 10 10 IICE COc1ccc(OC)c(-c2c3c(nc4sc(C(=O)OC(C)C)c(N)c24)CCN(C)C3)c1 40570296 DKSZXMLLHBNTRM-UHFFFAOYSA-N 441.553 4.116 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 40846649 KMHIPZFKIDAPDZ-OQLLNIDSSA-N 433.898 4.103 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@H](c2ccco2)c2ccc3cccnc3c2O)c1 54620951 XZMVWLNGHJIQMU-NRFANRHFSA-N 432.432 4.308 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@@H](c2cccc(Cl)c2)N3)CC1 226716121 OESDAGULAZQRDM-TXTKFYIRSA-N 444.000 4.103 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(OC)cc3OC)[C@H]2c2ccc(O)c(O)c2)cc1 526328311 NHWDFNLKGCMPGP-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)[C@H]2OCCc3sccc32)C1 561835434 MOPBNBGWPFAYEM-SSOJOUAXSA-N 437.609 4.288 10 10 IICE COc1cccc(C[C@H](C)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 732998702 FHHBJECEKSCGPM-INIZCTEOSA-N 433.499 4.196 10 10 IICE CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Cl 783129043 AMVNQBDROAKXQT-UHFFFAOYSA-N 440.975 4.396 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)c(C)cc1F 794003624 YGCGGOJAWHJUGG-UHFFFAOYSA-N 442.440 4.123 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4ccc(F)c(OC)c4)CC3)c2C)cc1 1139057294 XTOYGABNKYQVCK-UHFFFAOYSA-N 437.515 4.213 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)CCCNC(=O)OC(C)(C)C 1141403050 HJBPUFDORNTAGM-INIZCTEOSA-N 427.545 4.330 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@H]2O)c(C)n1-c1ccccc1Br 1141668192 AFWSASCIFNTKCA-GHTZIAJQSA-N 441.325 4.081 10 10 IICE O=C(Cc1ccc(OCc2ccncc2)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 1151903590 OULKQFDXGAHQCF-XMMPIXPASA-N 432.520 4.117 10 10 IICE CCOc1ccc2nc(NC(=O)CN3CCCc4cc(OC)cc(OC)c43)sc2c1 1171188737 FNCPOAMHOWJYDN-UHFFFAOYSA-N 427.526 4.104 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(Cl)n1 1289850636 GXJYONIQYDANIK-GDNBJRDFSA-N 435.933 4.413 10 10 IICE COC(=O)[C@@H](C)[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1294481966 PVPRDEZMBJGHCR-MHECFPHRSA-N 432.520 4.495 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC 1295721072 GHUOLPBHZXYEBL-QFIPXVFZSA-N 437.588 4.394 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@H]1C 1301684274 UVGHHPGJPIAGTL-NQIIRXRSSA-N 437.588 4.108 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 1312527443 FRZHYBPCJRSEFJ-YSIASYRMSA-N 432.609 4.127 10 10 IICE CCOC[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1314434863 BLONLHUMDARPID-FQEVSTJZSA-N 425.621 4.160 10 10 IICE COc1ccc(-c2nnc(N3C[C@@H](C)O[C@H](C)C3)n2CCCSc2nccs2)cc1 1315401141 KEFMIJJWJGIEIH-HZPDHXFCSA-N 445.614 4.206 10 10 IICE Cc1c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)nnn1-c1ccc(F)c(Cl)c1 1349106772 RQSTZJZOENYXBC-UHFFFAOYSA-N 427.911 4.241 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3[C@@H](C)OC(C)(C)N3C(=O)OC(C)(C)C)cc2)CC1 1443669936 ZONFIYDEQDSDAA-NQIIRXRSSA-N 445.604 4.300 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2C1 1445883862 OIOPIQBYWAPVAE-BEFAXECRSA-N 443.975 4.056 10 10 IICE COCCn1c(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)nc2ccccc21 1447369150 FJMWEPDLFFYNSN-UHFFFAOYSA-N 430.508 4.084 10 10 IICE Cc1cc(C(=O)Nc2ccn(C3CCOCC3)n2)c(C)n1-c1ccc(Br)cn1 1453570515 UTPJRXHKPOEYRX-UHFFFAOYSA-N 444.333 4.052 10 10 IICE Cc1cccnc1CCCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1468008310 MKBZNMPTLUJJLU-UHFFFAOYSA-N 427.346 4.318 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(Cc1ccncc1)Cc1cccs1 1479030508 JSFBEBXLWYJGRQ-UHFFFAOYSA-N 436.581 4.016 10 10 IICE CC[C@@H](C)c1nnc(N2CCS[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1513094547 UCDKSESKQSYGTM-KNQAVFIVSA-N 443.661 4.254 10 10 IICE CCOC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)N2C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1524267945 DJWARTIAOMYPGT-GOSISDBHSA-N 445.519 4.187 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCO[C@@H](c3ccnn3C)C2)c(C)n1-c1ccc(Cl)cc1 1525878391 NKUPKDIVBDIVSD-DENIHFKCSA-N 426.948 4.060 10 10 IICE C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1526003039 KYQYHVRQGABXAP-IBGZPJMESA-N 434.511 4.413 10 10 IICE CC1CCN(C(=S)SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1527057362 IKVUCQJAKCGCEM-UHFFFAOYSA-N 438.574 4.151 10 10 IICE COc1ncc(/C=C/C(=O)N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)cn1 1530686291 KEVORWGJBXZTKH-LRELXJSQSA-N 429.476 4.016 10 10 IICE COc1ccccc1CN(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1530935107 BVLNUMWIABPEAS-UYRXBGFRSA-N 444.553 4.084 10 10 IICE Cc1ccccc1COc1cccc(CC(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 1533684283 OILAXKFLHYQMSS-UHFFFAOYSA-N 443.591 4.185 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](OCC3CCCC3)c3ccccc3)CC2)c(OC)c1 1534594868 GIGCJEXKWOGQMG-RUZDIDTESA-N 438.568 4.301 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]1(c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1540518489 QFKYPFRRNWOFQN-SANMLTNESA-N 437.584 4.290 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2C[C@H]2CNC(=O)OC(C)(C)C)cc1 1540800102 FYDRJTGJLLMUOU-RXVVDRJESA-N 427.545 4.035 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CC[C@@H](C(C)(C)C)C1 1542226973 OMTDHNOOMSJGFG-NHCUHLMSSA-N 425.621 4.467 10 10 IICE CCCN1CCC(N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1542230425 IAPWMALVVGGPMF-UHFFFAOYSA-N 433.394 4.198 10 10 IICE CCN1C[C@H](C)N(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1547644212 DWNBOZRFNNEXRC-ROUUACIJSA-N 428.600 4.108 10 10 IICE CCCCN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)c2cccc(O)c2O)c1 1556580185 BTVJWMLYPCXHLZ-UHFFFAOYSA-N 440.521 4.346 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSc3nccn3-c3ccccc3C)CC2)cc1 1566562066 BAQBDQMPDPOLSV-UHFFFAOYSA-N 436.581 4.020 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(=O)n(-c2ccccc2F)n1 1566846326 RPJGFHIKJDIMGY-GOSISDBHSA-N 443.478 4.481 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc2c(cnn2C(C)C)c1 1568379138 VCRLIRAFNVFPCQ-UHFFFAOYSA-N 437.544 4.014 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc4c(c3)N(C(=O)COC)CCC4)ccc21 1585578379 OYCWKMUWFQCPBL-UHFFFAOYSA-N 449.551 4.082 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cc(Br)c(C)c([N+](=O)[O-])c3)c2)CC1 1585588019 ZBYPSPVLGCVLFG-UHFFFAOYSA-N 447.333 4.060 10 10 IICE COc1ccc(-c2c(C(F)(F)F)oc3c(CNCCCCO)c(O)ccc3c2=O)cc1 1615247869 AGNLPWOGCYJWEP-UHFFFAOYSA-N 437.414 4.055 10 10 IICE Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)n2)n1 1626722554 ALMIXPHDMDXLPF-OAHLLOKOSA-N 425.964 4.273 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCC23CC(CN2C(=O)OC(C)(C)C)C3)cc1F 1628769807 KVFAONJMKBWCLP-UHFFFAOYSA-N 433.568 4.468 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)[C@@H]1c1ccc(Cl)c(Cl)c1 1630273298 MPLXPKDTMMYNDI-AOMKIAJQSA-N 447.362 4.414 10 10 IICE CCN(CC)[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1 1631425696 MODSQJGVPGKGML-GMAHTHKFSA-N 429.992 4.209 10 10 IICE CCNc1ccc(Cl)cc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1631879281 AKZKZVJIGYMGMB-UHFFFAOYSA-N 426.992 4.234 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1 1636771673 QYVKOSCUPKBDJR-QFIPXVFZSA-N 444.453 4.318 10 10 IICE COCCO[C@]12CCC[C@@]1(NC(=O)c1cc(C)n(-c3cc(C)cc(C)c3)c1C)CCO2 1640273354 UWNBRCYNJBOAAP-JWQCQUIFSA-N 426.557 4.143 10 10 IICE CCS[C@@H]1CCCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 1644583992 JPCPJYOQXLMBHN-FUHWJXTLSA-N 436.577 4.397 10 10 IICE CC[C@H]1CN(Cc2ccc(N3CCC(OC)CC3)cc2)CC[C@@H]1NC(=O)OC(C)(C)C 1645160971 VSDYSHHQFKUDKK-REWPJTCUSA-N 431.621 4.427 10 10 IICE NC(=O)c1ccc(CN(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1 1652703080 KHQDLQHSBIYRIZ-QPJJXVBHSA-N 445.475 4.185 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCC[C@H]3C(C)(C)C)cc2F)C[C@@H](C)O1 1653758527 DJJAFOSOCRSQPF-BAYUQKDNSA-N 433.612 4.250 10 10 IICE Cc1cc(C(=O)CN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccc(OC(F)(F)F)cc1 1656039935 GHTUBZODEWYZDU-UHFFFAOYSA-N 442.393 4.472 10 10 IICE C[C@H](NC(=O)NCc1ccc(I)cc1Cl)c1ccccc1O 1681723150 FONDZBLHZZBRTO-JTQLQIEISA-N 430.673 4.211 10 10 IICE CCCN(C)c1nnc([C@]2(OCC)CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1709682471 JAXQLTZHEKPTCJ-VWLOTQADSA-N 441.620 4.061 10 10 IICE CCN(c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1)[C@H](C)C1CCC1 1709956329 ZZISLJVCCFBITN-XLIONFOSSA-N 429.584 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2cnc(C)s2)cc1 1728383994 VUBQLZNSERDGNY-OAQYLSRUSA-N 440.617 4.425 10 10 IICE CC(C)[C@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O)c1cccnc1 1760872800 XQQPCJCVUIDSEO-NRFANRHFSA-N 430.556 4.460 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1762876627 ZUXJDNGTXIYLQG-UGKGYDQZSA-N 441.620 4.372 10 10 IICE CCc1nc(C)c(Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)o1 1764602357 BVNLWSZWNXVVOE-UHFFFAOYSA-N 438.576 4.034 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1ccc(O)cc1O 1952792512 IEFGJZIJCXSPKW-ZJSXRUAMSA-N 445.471 4.495 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(F)F)c(C=O)c2I)c(O)c1 2079061636 ZMCYVXUSRKVBHR-CQSZACIVSA-N 432.208 4.251 10 10 IICE Cc1cc(O)c([C@H](n2nc(C)c(CO)c2I)C2(C)CC2)cc1C 2079932337 CHHQFCNZNPJKOA-INIZCTEOSA-N 426.298 4.000 10 10 IICE CCOc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(Sc4ccccc4)o3)C2=O)c1 2297330731 VLMLUDYSBBWVRZ-UHFFFAOYSA-N 434.473 4.496 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCC(=O)Nc3cccc(C)c3)C2=O)ccc1O 2314827887 ONLCZLUZPJWVDW-UHFFFAOYSA-N 442.562 4.329 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCCC(=O)O 2314932151 LDHBHPNGFWCAAS-UHFFFAOYSA-N 433.482 4.094 10 10 IICE CCCN(CCC)C(=O)COc1ccc(C=C2C(=O)N(CC(C)C)N=C2CC)cc1OC 2332139365 YUAQPUINYYUVQD-UHFFFAOYSA-N 443.588 4.370 10 10 IICE Cc1ccc(CNCCc2cccc(I)c2)c(O)c1Br 2380793940 WFFFZNYOLKDNDQ-UHFFFAOYSA-N 446.126 4.400 10 10 IICE COc1cc(OC)cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c1 9526950 NDXFDUWKLSBVBN-AREMUKBSSA-N 445.563 4.304 10 10 IICE CC(C)c1ccc(OC[C@@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 40315890 PXFXXUAWMHLLQR-AHWVRZQESA-N 426.601 4.297 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CC(=O)N3CCCc4ccccc43)C2=O)cc1 103037206 UYASDLSKAHRBJN-XSFVSMFZSA-N 438.574 4.266 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(O)c(OC)c1)N2 251315361 FRKPVXNEQIVIQP-OMKFPNQOSA-N 428.554 4.304 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cc(OC)ccc3OC)[C@H]2c2ccc(O)c(O)c2)cc1 526227063 NTJLGLKEHTUWBR-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)c1cc(C)n(-c3ccccn3)c1C)O[C@H](C)C2 730780935 UVLSPEUAWMZJLZ-BUVFEPMLSA-N 431.536 4.497 10 10 IICE CCn1nc(C(=O)OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)c(=O)c2ccccc21 735727651 PRJHCJLKSNJWNW-UHFFFAOYSA-N 447.466 4.003 10 10 IICE Cc1cc(CCNC(=O)c2cc(N3CCNC3=O)ccc2Cl)c(C)n1-c1ccccc1 742041044 JCAUFRXOLRGAFN-UHFFFAOYSA-N 436.943 4.250 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cccc(N[C@H](C)C(C)C)c3C)CC2)cc1 743408151 CGBWLOTWMPEGLE-OAQYLSRUSA-N 438.616 4.012 10 10 IICE Cc1cc(CCNC(=O)c2cc(S(=O)(=O)C(C)C)ccc2F)c(C)n1-c1ccccc1 746105751 DZSGKQPQWGMKNT-UHFFFAOYSA-N 442.556 4.388 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccc(F)cc2F)cc1 749473919 XUTOPMUAOTTWGB-IMRHEYAYSA-N 441.522 4.121 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CSc3ccc(N)cc3Cl)cc2F)C[C@@H](C)O1 767204569 PEYHDXWIKFWQFL-OKILXGFUSA-N 437.968 4.083 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2ccccc2Br)n1C 773751729 VBKSJNZYLRMWAR-ZDUSSCGKSA-N 429.314 4.227 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H]1c1ccc(I)cc1 779525627 MJUMVVBSWTYHLF-IGKXFLDPSA-N 435.261 4.079 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)c3ccc(C(=O)C(C)C)cc3)cc2F)CC1 801671028 WALPFYVZOJCRBV-LJQANCHMSA-N 439.575 4.226 10 10 IICE Cc1cc(-c2nnc(N3CCC(F)(F)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802694668 LXXZHZPTROEUMR-LJQANCHMSA-N 427.499 4.377 10 10 IICE COc1ccc(-c2nsc(NC(=O)NCc3cc(Br)ccc3O)n2)cc1 809929458 VYCNGKZOIRGLNC-UHFFFAOYSA-N 435.303 4.004 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@H](C(=O)OC)Cc2ccccc21 1134141450 QADKOKMISNNLKB-JNCYCUAHSA-N 430.504 4.415 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)c1ccc(N2CCOC2=O)cc1 1142389484 GOCBSRQPLAFVSI-KRWDZBQOSA-N 431.492 4.354 10 10 IICE COC(=O)[C@@]12CCCC[C@@H]1CN(C(=O)Cc1cc(C)n(-c3ccc(Cl)cc3)c1C)C2 1163978654 UIXRHBJAWLPXIO-NTKDMRAZSA-N 428.960 4.482 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1225137494 RPIQQAFNMRPVRB-FQEVSTJZSA-N 449.382 4.396 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3F)C2)C2CC2)cc1 1234160309 WFYITSAPBOYYJA-GOSISDBHSA-N 430.955 4.498 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCc3cccc(Br)c3)C2)cc1 1252114274 BTQXEDKKXWCNTD-SFHVURJKSA-N 446.389 4.168 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2ccc(Br)cc2C)cc1 1278288194 HDJDPLMBIXQZJB-UHFFFAOYSA-N 437.403 4.453 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc3c(c2)C[C@@H](c2ccccc2)OC3=O)cc1 1278288995 SRHWRCSSPHRKAU-VWLOTQADSA-N 444.531 4.358 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N=[S@](C)(=O)c2ccc(F)cc2)C1 1289028224 RAMIPMKNDYRMOY-SSEXGKCCSA-N 427.545 4.230 10 10 IICE Cc1ccc(CN(C)c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)o1 1289642735 CQYWAMBFRUYPOP-INIZCTEOSA-N 433.603 4.349 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)CCO1 1305882343 AMAZTVLJNHUNEV-UQBPGWFLSA-N 437.588 4.393 10 10 IICE Cc1cc2c(c(Cl)n1)C(=O)N(CC(=O)c1cc(C)n(-c3ccc(F)cc3)c1C)C2=O 1307341611 HPZKDFYDFJZUOH-UHFFFAOYSA-N 425.847 4.069 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)[C@@H](CCc3ccccc3)C(F)F)C2)cc1 1312901400 GGCVWJUHXNQKBK-UGKGYDQZSA-N 431.527 4.429 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1 1350087473 LVFAPRLBFLOSFJ-XMMPIXPASA-N 434.536 4.285 10 10 IICE CC(C)CCOCCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1359963858 DGJBYUYRKFEGBK-UHFFFAOYSA-N 429.952 4.398 10 10 IICE CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1435037877 AJTMRTLCGMMSNV-UHFFFAOYSA-N 447.579 4.279 10 10 IICE COc1cc(N2CCN(C(=O)[C@H](C)c3cccc(CC(C)C)c3)CC2)cc(OC)c1OC 1435841892 PXQHCOALNMTGPY-LJQANCHMSA-N 440.584 4.363 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@H](c1ccccc1)N1CCOCC1 1458100063 QZQLRQXHJGPZLY-XMMPIXPASA-N 431.492 4.311 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2C)cc1F 1458832834 FULPHKLCXDBCMS-UHFFFAOYSA-N 444.484 4.415 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c(C)n1-c1cccc(Br)c1 1464901589 YLMWVJNZVXBOCQ-GDBMZVCRSA-N 446.389 4.376 10 10 IICE COc1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)ccc1Cl 1465325713 XTYWEQYNYCLTEZ-LJQANCHMSA-N 447.963 4.410 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@H]1CN(C)C(=O)OC(C)(C)C 1470556421 USYXYZXNAROLTM-UGKGYDQZSA-N 446.636 4.423 10 10 IICE O=C(CN(Cc1cccs1)c1ccc2c(c1)OCCO2)NCCc1c(F)cccc1F 1473224667 DPMSEPUHADHHPK-UHFFFAOYSA-N 444.503 4.163 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1505211204 QUXGEJAEZXYMES-LJQANCHMSA-N 440.592 4.315 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1nccs1 1516727573 NBEVZAIVBPEQHO-UHFFFAOYSA-N 436.585 4.482 10 10 IICE CCOc1ccc(NC(=O)CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1518104384 DURXQLYSQMIGCH-UHFFFAOYSA-N 439.943 4.444 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(I)c(Cl)c2)cc1F 1519247022 BDBMOABHRXJXAB-UHFFFAOYSA-N 432.664 4.080 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 1528925542 ZUNASISGOBGLOJ-HNNXBMFYSA-N 431.462 4.022 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(Br)c(SC)c3)C2)cc1 1537108989 IAZYFIAKDSOAGR-CQSZACIVSA-N 435.387 4.436 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@@H](C)Cc1ccsc1 1559778594 WBBZYASWTRRIDI-FHWLQOOXSA-N 447.620 4.070 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(-n3ccnn3)ccc2F)cc1 1585493756 ZIJAKNUJSUDGJH-UHFFFAOYSA-N 445.498 4.328 10 10 IICE Cc1cc(C(=O)NCC[C@H](N(C)C)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1595137943 UKWPTULKWRHICT-KRWDZBQOSA-N 446.311 4.469 10 10 IICE Cc1cccc(C(=O)NC2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1595713319 YBEQZZRLRIPUQD-UHFFFAOYSA-N 429.564 4.366 10 10 IICE Cn1c(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)nc2ccccc21 1597275545 WKCXETXDOOUUJC-VBKFSLOCSA-N 442.591 4.255 10 10 IICE COc1ccc(OC)c(CN2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)c1 1624082300 DRSRYFWIRLHAAL-UHFFFAOYSA-N 447.579 4.378 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCNc2ncccc2C(F)(F)F)c1 1624980023 IZRLINXCYLJRGO-UHFFFAOYSA-N 430.430 4.162 10 10 IICE Cc1cc(C(=O)N[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c(C)n1-c1ccc(Cl)cc1 1625277085 HVPZANKGHDUNPC-PMOLBWCYSA-N 429.948 4.343 10 10 IICE C/C=C\[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1625689068 PUCXWTFEHVEWHJ-QTBQOWTLSA-N 429.344 4.374 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c1C 1629008397 TYIOMPKUPIDWBO-VWLOTQADSA-N 435.543 4.345 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(OC)c3c(c2)OCCO3)cc1 1633065956 FWJJEGKOGIPSIE-UHFFFAOYSA-N 448.519 4.388 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(Cl)cn1 1633110216 ZGULBOQPEQTTLV-YXHQGMJNSA-N 449.960 4.343 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1CCOc2c(F)cccc21 1634385290 WIGAIENCPFUHMP-IBGZPJMESA-N 428.504 4.080 10 10 IICE CN(Cc1ccccc1O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1cccc(F)c1 1636024353 XIZNLLLAJYBTPZ-BJKOFHAPSA-N 433.527 4.341 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1638573034 GTLZWYQHESQYAE-CDDKBXLESA-N 449.938 4.305 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1642107460 SPAAEVRCYIYERZ-LPHOPBHVSA-N 426.561 4.112 10 10 IICE CCOc1ccc(N2CCN(CCCN3CCN(c4ccc(Cl)cc4)CC3)CC2)cc1 1642354290 LMHSOIVRVVYDCA-UHFFFAOYSA-N 443.035 4.073 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccc(N3Cc4cccc(O)c4C3)c([N+](=O)[O-])c2)c(C)c1 1651352797 FVHPIHPPWDAUOO-UHFFFAOYSA-N 439.493 4.238 10 10 IICE COC(=O)c1cnc(S[C@@H](C)C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)s1 1652002998 ZWGGUOGKPQWSJA-LBPRGKRZSA-N 434.539 4.481 10 10 IICE CCN(C)c1ccc(CN2CC[C@@H](c3cccc(F)c3)[C@@H](NC(=O)C(F)(F)F)C2)cc1 1659344753 UODZMPRSTKFVOM-SFTDATJTSA-N 437.481 4.318 10 10 IICE COc1ccc(C[C@@H](C)CNC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1OC 1679670717 UZKKJPIFUYRNLE-GFCCVEGCSA-N 427.328 4.394 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H](C)C#N)n2CCCn2cccn2)c(C)n1-c1ccccc1 1707251929 IVDFMPAZUABNII-LJQANCHMSA-N 442.571 4.235 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1744820446 YGJWRVVXRIRWDV-KNQAVFIVSA-N 425.621 4.283 10 10 IICE CC/C=C/Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1745092555 OTDSPGXJFHFTSG-AATRIKPKSA-N 432.572 4.088 10 10 IICE CC(C)N(C)CCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750885164 USVBHDDIMQOPDZ-QHCPKHFHSA-N 440.636 4.097 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCO)no1 1761678735 YQXNMYUZKUYVSS-UHFFFAOYSA-N 448.571 4.448 10 10 IICE Cc1ccc(-c2nnc(N3CC(C)(C)OC[C@@H]3C)n2CCCSc2nccs2)o1 1761745241 ZRVLRKGYGNKFQR-AWEZNQCLSA-N 433.603 4.489 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1)OC 1763857928 NZPCAQSQVIRKMP-FCHUYYIVSA-N 437.588 4.393 10 10 IICE CCO[C@]1(c2nnc(N3CC[C@@H](C)[C@H]3C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1765869136 KAXMEVVTLGWWNV-UMEGOILYSA-N 441.620 4.059 10 10 IICE CCOCc1nnc(N(C)Cc2ccsc2)n1Cc1ccc(N2CCSCC2)cc1 1767776383 XDVHUMNDBZOADR-UHFFFAOYSA-N 443.642 4.114 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3Cc3ccsc3)CC2)cc1 1770257688 GJHZXARADWKPNE-UHFFFAOYSA-N 425.602 4.312 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](C)c1ccccc1O 2060114830 GZOUKNYHEFYYBB-NPPFBWRTSA-N 442.556 4.410 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2CCC2)c(C(=O)O)c1I 2079003357 AKGFTQHIMOKLQX-CYBMUJFWSA-N 440.281 4.467 10 10 IICE COc1c(Cl)cc(C=C2C(=O)NC(=S)N(c3ccc(Cl)cc3)C2=O)cc1Cl 2294204782 AHJBFKNSUPJHGF-UHFFFAOYSA-N 441.723 4.487 10 10 IICE Cc1ccc2nc(NC(=O)CN3C(=O)C(=Cc4ccccc4)SC3=S)sc2c1 2314563166 NCVJZLXORQTLNK-UHFFFAOYSA-N 425.560 4.445 10 10 IICE CCCOC(=O)CCCN1C(=O)C(=Cc2ccc(O)c(Br)c2)SC1=S 2314759884 GEZDZQFZZXYVGD-UHFFFAOYSA-N 444.372 4.089 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2cccc(O)c2)SC1=S)NCc1ccccc1 2314836836 KXVBVKISIBYQGC-UHFFFAOYSA-N 440.590 4.470 10 10 IICE CCCOc1cccc(C=C2SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)c1 2323866029 JRVUFIJBGXUVJV-GOSISDBHSA-N 427.547 4.373 10 10 IICE N=C1/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)C(=O)N=C2SC(c3ccco3)=NN12 3005373 RSVGHNGWYBBQRI-JFDGEBKMSA-N 433.405 4.115 10 10 IICE COc1ccc(OC)c(NC=C2C(=O)N(c3ccccc3)C(=O)N(c3ccccc3)C2=O)c1 40869631 OAHBBXQEWMSJSA-UHFFFAOYSA-N 443.459 4.200 10 10 IICE CN(C)CC(C)(C)CN1C(=O)/C(=C/c2cccc(OCC(F)(F)F)c2)SC1=S 727177026 VLKQSBWTXCGFTA-DHDCSXOGSA-N 432.533 4.417 10 10 IICE COc1cc2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)[nH]c2cc1OC 742800268 PYWCKFGGMUSBFR-HNNXBMFYSA-N 445.466 4.185 10 10 IICE CCCCCCOc1cccc(/C=C2/SC(=S)N(CCN3CCOCC3)C2=O)c1 747041918 VNBQCNYZFIXNTO-LVZFUZTISA-N 434.627 4.179 10 10 IICE CN1C(=O)C[C@H](NCc2cccc(Br)c2O)[C@H]1c1ccc(Cl)c(F)c1 754832666 JRTQIGDEIXGHBU-DOTOQJQBSA-N 427.701 4.009 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](N3CCC3)[C@@H](F)C2)c(C)n1-c1cccc(Br)c1 791256571 DTXTUIKISWQBQJ-VQTJNVASSA-N 434.353 4.115 10 10 IICE CCCc1c(NCc2cc(OC)c(OC)cc2O)cnn1-c1cc(F)c(OC)cc1F 796041958 BKBMQVPHDVUVOB-UHFFFAOYSA-N 433.455 4.447 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCc2cc(Cl)ccc2N2CCOCC2)cc1 798376304 SCLFJDZHDAXTMF-UHFFFAOYSA-N 430.980 4.022 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H]1CCOc2c(Br)cccc21 799933453 ONGFWEVRFVIBQJ-LJQANCHMSA-N 428.330 4.148 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCCN2Cc2ccc(N3CCOCC3)cc2)C1 816658544 OOFLJVKVBUJMIK-GGAORHGYSA-N 429.605 4.135 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccc(F)cc2F)cc1F 1136454210 PAGZILYPSWHSGO-IBGZPJMESA-N 437.462 4.052 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CSc1nncn1-c1cccc(Cl)c1 1162106767 ADMXHYJPNVCBTJ-MRXNPFEDSA-N 444.004 4.135 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](CC(C)C)c3ccc(Cl)cc3)CC2)cc1 1168623699 XKJZLRZPNMBPPO-ZCYQVOJMSA-N 446.035 4.209 10 10 IICE Cc1cc(C)c(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c(C)c1Br 1265349568 QCSHNWMJVIAWSG-UHFFFAOYSA-N 444.373 4.328 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H](NC(=O)NCc2ccc(F)cc2)C(C)C)cc1 1290323670 FICZYDHCZHOYDA-HSZRJFAPSA-N 442.579 4.154 10 10 IICE Cc1cc(C(=O)N2C[C@H](O)Cc3ccccc32)c(C)n1-c1ccccc1Br 1297179638 PCJPUJLAQFUZNJ-QGZVFWFLSA-N 425.326 4.420 10 10 IICE CCOc1ccccc1[C@H](CC(=O)N1Cc2cccc(O)c2C1)NC(=O)OC(C)(C)C 1302789465 WJWGTTUMSAUZRJ-IBGZPJMESA-N 426.513 4.289 10 10 IICE C[C@]1(CCc2ccccc2)CCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1312833482 JRYGBVQOQSTHFI-VWLOTQADSA-N 443.538 4.356 10 10 IICE O=C(NCCc1cccc(-c2ccccc2)c1)NCc1ccc(N2CCC(O)CC2)cc1 1313064226 KELQNUISYCZMEP-UHFFFAOYSA-N 429.564 4.357 10 10 IICE CCOCc1nnc(N2CCOC3(CCCCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1314413911 QFOWDJVZYZUJSD-UHFFFAOYSA-N 441.620 4.167 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCCN2C(=O)COc3ccccc32)c1 1323134771 CLEAKKBQWXIUMG-UHFFFAOYSA-N 437.927 4.293 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3CCc4cc(Br)ccc43)CC2)cc1 1356398113 XYGSCYYDCRVRLH-OAQYLSRUSA-N 429.358 4.226 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCCc2ccc(OC)c(OC)c2)CCCC1 1357673586 UYNFUHWWCDWHEJ-UHFFFAOYSA-N 436.552 4.295 10 10 IICE COC(=O)[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1cc(C)cc(C)c1 1436018164 IFRNUBIIXWVOEL-VWLOTQADSA-N 434.536 4.176 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc(-c4ccc(C)cc4)n3)CC2)c(OC)c1 1438185868 FNZLQFXLYRWQTQ-UHFFFAOYSA-N 437.565 4.027 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3c(O)cccc3O)[C@@H]2c2cccs2)cc1 1456235806 OHDLEHYTWOQMMJ-UZUQRXQVSA-N 436.533 4.268 10 10 IICE CSc1cc(F)ccc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1461128286 QVRBTCPBIQZUSC-UHFFFAOYSA-N 436.420 4.484 10 10 IICE O=C(Nc1ccc(F)cc1I)c1cc2cc(O)c(O)cc2s1 1465642524 JOSXAFUKDIVTLC-UHFFFAOYSA-N 429.210 4.309 10 10 IICE Cc1cc(CC(=O)NCc2nn(C)cc2Br)c(C)n1-c1ccc(Cl)cc1 1526440115 FDHPHDLSTUBDFM-UHFFFAOYSA-N 435.753 4.102 10 10 IICE Cc1cc(CC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)c(C)n1-c1ccc(Cl)cc1 1527334263 HFDDZBZJQPHANU-HSZRJFAPSA-N 435.955 4.380 10 10 IICE CCc1cc2c(CC(=O)N3CCN(c4ccc(OC)cc4OC)CC3)csc2s1 1543631849 GOJHAEYQHXEKEV-UHFFFAOYSA-N 430.595 4.434 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCCNc1ccc([N+](=O)[O-])cc1 1545508642 JCDJPXPOCNTHEE-UHFFFAOYSA-N 436.306 4.304 10 10 IICE CCc1nnc(N2CCN(c3cc(C)ccc3C)CC2)n1CCCSc1nccs1 1546528642 WMAYNDWDBORUJW-UHFFFAOYSA-N 442.658 4.423 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H](O)COc2ccc(F)cc2)cc1 1566333224 CHUGEIWDROOUJB-FQEVSTJZSA-N 436.487 4.477 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc3cccnc3c2)NC(=O)OC(C)(C)C)cc1 1586619122 CGBRDSAPTRGVEI-HSZRJFAPSA-N 448.567 4.226 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCc2cccc(S(=O)(=O)C(F)(F)F)c2)cc1 1586680555 QJRVCDZTTKVFRI-UHFFFAOYSA-N 436.455 4.318 10 10 IICE CCc1ccc(C)nc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1587210527 RTQBABMQJAEHLP-SFQUDFHCSA-N 429.542 4.322 10 10 IICE CCOC(C)(C)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1616050450 ORKWMGGAYMSJRT-UHFFFAOYSA-N 436.604 4.335 10 10 IICE CCOCCN(CC)c1nnc(C2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1617159717 IEUQAXFJVCCFLS-UHFFFAOYSA-N 443.661 4.400 10 10 IICE Cc1cc(C(=O)NC[C@H](C)CC2(C)OCCO2)c(C)n1-c1ccccc1Br 1618546825 YHVHQEIUWLAWFM-CQSZACIVSA-N 435.362 4.376 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)CSc2nccn2-c2ccc(OC)cc2)cc1 1624541170 KEONXNGHTGGPLB-UHFFFAOYSA-N 438.597 4.478 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC2CCN(Cc3ccccc3)CC2)cc1 1625491283 JKVNOGIGJOCCAU-UHFFFAOYSA-N 443.591 4.478 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)NCc2ccc(N3CCSCC3)cc2)C1 1625970295 YEIFFJJZHYPSNL-NHHWLVAYSA-N 445.629 4.059 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl 1629758931 XXWJUBDFEZGHLE-UHFFFAOYSA-N 449.864 4.470 10 10 IICE CC(=O)c1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)ccc1C 1631306410 ROYNYAOGAAYKHK-UHFFFAOYSA-N 430.507 4.018 10 10 IICE COc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)ccc1Br 1632290869 SGTWBSVMCFWOID-UHFFFAOYSA-N 432.362 4.240 10 10 IICE CCOC(=O)CN(CCc1ccccc1)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1632636593 JUZRXJRUXFABFL-UHFFFAOYSA-N 434.536 4.351 10 10 IICE COCc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc(C(=O)OC)c1 1641371063 IDYOVETZYMOOOT-UHFFFAOYSA-N 434.492 4.021 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3cc(Br)ccc3F)C2)cc1 1674327007 OAJHPDCVYGGUTI-MRXNPFEDSA-N 436.325 4.017 10 10 IICE Cc1cc(CNC(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1675115503 MYRPBMOJCNSYMX-DYESRHJHSA-N 440.588 4.396 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC([C@H](O)c4ccc(Cl)cc4)CC3)C2)cc1 1682646598 UPZHSPFAYAHCRL-NZQKXSOJSA-N 443.975 4.083 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(Cc4cccc(F)c4)C(=O)C3)c2C)c1 1683303005 HFJUQSOUPZUBLO-UHFFFAOYSA-N 448.542 4.096 10 10 IICE Cc1occc1CN(C)c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1692927511 OLSWMNBLALGMTL-KRWDZBQOSA-N 433.603 4.349 10 10 IICE C=CCCCCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1705803904 HQSRDPPCWOQKRD-UHFFFAOYSA-N 434.588 4.113 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@@H]2CCCOC2)n1CCOC(C)(C)C 1711080138 GYAHNMUZOMGREH-OAQYLSRUSA-N 441.620 4.224 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)CCO1 1727821393 RHDBDVGJSHFTEX-HSZRJFAPSA-N 425.621 4.376 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1CCOc1cccc(C(F)(F)F)n1 1729420209 JPWAQILFHRLZMK-UHFFFAOYSA-N 447.461 4.380 10 10 IICE O=C(O)[C@H](Cc1ccc(O)cc1)N1C(=O)/C(=C\c2cccc3ccccc23)SC1=S 1858592560 SNCOKPNDGYYCHC-XAJRUKRBSA-N 435.526 4.443 10 10 IICE Cc1ccnc(NC(=O)CCn2c3c(c4ccccc42)CCn2c-3nc3ccccc3c2=O)c1 1860344722 AZXFHOKXMHGCHO-UHFFFAOYSA-N 449.514 4.307 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C3CC3)c(CN)c2I)cc1C 2079979066 KRAZCUOBBOWVRQ-GOSISDBHSA-N 437.325 4.146 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(F)C[C@H](CNCc2cc(Br)cc(F)c2O)C1 2111957398 HBDFZPIHUDTZJU-CKSWESSHSA-N 435.309 4.026 10 10 IICE Cc1cccc(OCCOc2ccc([N+](=O)[O-])cc2C=C2SC(=S)N(C)C2=O)c1 2293700608 NHLAUUSKXKFTNB-UHFFFAOYSA-N 430.507 4.192 10 10 IICE O=C(COc1ccc(Cl)cc1C=C1SC(=S)NC1=O)Nc1ccccc1Cl 2314487847 SSXQUUWWQPPFAH-UHFFFAOYSA-N 439.345 4.500 10 10 IICE CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352637783 MDFSGXNGIXVSGB-ABAIWWIYSA-N 429.355 4.019 10 10 IICE Cc1ccc(CNCC2(N(C)Cc3ccccc3)CCOCC2)c(O)c1Br 2380816100 UGNUAYHYANNYPA-UHFFFAOYSA-N 433.390 4.234 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@@H]3C=CC[C@@H]32)c1O 226712350 AFGIGDYJTCHWBK-IEGUWTFLSA-N 440.565 4.402 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3cccnc3-n3cccn3)no2)C1 577983792 PMLOQFXZDZNESL-UHFFFAOYSA-N 439.523 4.087 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CCN(c4cccc(OC)c4)C3)c2C)cc1 726563476 NQPQPXICIMZSKJ-FQEVSTJZSA-N 433.552 4.368 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1cccn(C)c1=O 729522870 WGFJQCGTEKFQMS-IBGZPJMESA-N 429.442 4.311 10 10 IICE CN(C)c1ccc([C@@H]2C[C@H]2C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 730541927 ULPKEVMJAKWSBA-FCHUYYIVSA-N 429.511 4.243 10 10 IICE Cc1nn(CC(F)(F)F)c(C)c1CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 763995970 KTJPBQOWCWXYNR-UHFFFAOYSA-N 432.490 4.371 10 10 IICE CCS[C@@H](C)c1noc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n1 769663000 JEBRCFKFRDDTGE-INIZCTEOSA-N 442.585 4.348 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 781957229 HXCNWSRUCZKJIZ-GOSISDBHSA-N 449.454 4.084 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3N3CCCC3)CC2)cc1 794763642 HYPHNNCTCKXTKQ-UHFFFAOYSA-N 433.474 4.277 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H](c1ccccn1)C1CC1 1133947816 ZCBTYRIHRIBMAP-BLMOFCDVSA-N 443.619 4.392 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)c1 1136769505 NQCLUYZVLKZZCH-UHFFFAOYSA-N 444.535 4.248 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCCN(Cc2ccccc2)C1 1137438608 OYEAVEGXIWOVKG-NFBKMPQASA-N 442.003 4.038 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@H](O)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1137700520 RQFUXIBDIVUDON-IRXDYDNUSA-N 445.279 4.384 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cc(Br)c2nccnc2c1 1141737649 CLPKLXYMOBBPTG-UHFFFAOYSA-N 427.085 4.335 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc(Cl)c(I)c3)ccc21 1142465291 GEIDHVZJMNPLGP-UHFFFAOYSA-N 440.712 4.257 10 10 IICE COC1([C@H](C)NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCOCC1 1142471310 KHPDYICSUJYJOS-INIZCTEOSA-N 435.362 4.171 10 10 IICE COc1ccccc1Oc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)nc1 1147837756 MSQYUVKCLGJNNY-UHFFFAOYSA-N 447.535 4.021 10 10 IICE CCN1CCN(C(=O)c2ccc(NC(=O)c3ccc(-n4c(C)ccc4C)cc3)cc2)CC1 1264847304 KPDDRZYONNULCT-UHFFFAOYSA-N 430.552 4.124 10 10 IICE C[C@@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1264849986 RYNOOIFAOIKYFS-RVAQLADHSA-N 429.542 4.032 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N(CC1CCC1)CC1CC1 1270363152 WWUYJAHGSPSLLQ-UNOMPAQXSA-N 432.586 4.456 10 10 IICE CC[C@H](Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1292214847 AGVJZWJBBSSCLI-OAQYLSRUSA-N 427.593 4.086 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(SC)CCC1 1297056005 HCYNRYWTDDPPDJ-UHFFFAOYSA-N 429.634 4.337 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CC[C@@H](F)C3)CC2)cc1F 1315512129 JGFVWSRBKGNXRE-IAGOWNOFSA-N 433.547 4.188 10 10 IICE O=C(CCc1nc2ccccc2s1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1319695105 NTTWOHNETDVLSP-UHFFFAOYSA-N 434.609 4.077 10 10 IICE COc1ccc2cccc(CC(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)c2c1 1355129599 HIHGBVGODWYNQF-ROUUACIJSA-N 436.527 4.460 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4ccc(C(F)(F)F)cc4nc3O)CC2)cc1F 1445850647 JZOSLSLPIXZAGM-UHFFFAOYSA-N 449.404 4.069 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1CCOc2ccc(Br)cc21 1467764377 QICDIHUQGBNSAW-LBPRGKRZSA-N 441.119 4.100 10 10 IICE COc1ccccc1[C@H]1CCCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786709 SWZGCCPSPNRJJW-OAQYLSRUSA-N 445.510 4.247 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C)n1-c1ccccc1 1479063181 BVNMGZIDIWLDGR-UHFFFAOYSA-N 447.539 4.077 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@H](O)COc3c(C)cccc3C)c2C)c1 1479099291 DRTKRCZLRDVXMX-DEOSSOPVSA-N 435.568 4.259 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2c(C)nn(C)c2C)n1Cc1ccc(N(C)C)c(F)c1 1495088679 IKUHNSPAQBTODJ-OAHLLOKOSA-N 427.572 4.032 10 10 IICE COc1cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccc1Br 1515925644 MLCIRIMFOYPWPI-UHFFFAOYSA-N 436.261 4.485 10 10 IICE CN1CCc2ccc(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)cc21 1520155258 FXEGLKWBNSRMOS-UNOMPAQXSA-N 441.553 4.048 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@H](OC(C)(C)C)[C@@H]3n3cccn3)ccc21 1521747033 CZTBXYCJHDIWFR-AKIFATBCSA-N 438.572 4.028 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@@H]1C[C@H]2C=C[C@H]1C2 1530531271 HPKNBQFIIFZGLU-IBPFFVFCSA-N 430.570 4.136 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3sc4cccc(F)c4c3Cl)CC2)cc1 1542431757 GQVKPBQXIMABOU-UHFFFAOYSA-N 447.963 4.254 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(OC(F)(F)F)c(Cl)c1 1544538633 STPAPDQWUFOVOT-UHFFFAOYSA-N 442.865 4.377 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(Cc2ccccc2)[C@H]2COC(C)(C)C2)N(C)C)cc1 1565452733 JVZQXAJCZRCUKB-RPWUZVMVSA-N 438.616 4.135 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1 1570463089 GODYHFMBHVFJGG-XZOQPEGZSA-N 436.939 4.283 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CC(C)C)CC2CCN(C)CC2)CCCC1 1583096345 VJBKOVGRMVBUDU-UHFFFAOYSA-N 425.617 4.355 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](OC)c2ccc(Br)s2)cc1F 1585698668 VAAHXQLFDZJYLT-KRWDZBQOSA-N 429.355 4.500 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(=O)n(-c4ccccc4F)n3)c2C)c1 1596481294 ATSOHJZSCMWUFY-UHFFFAOYSA-N 430.483 4.018 10 10 IICE CSc1ccc(N2C[C@@H](C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2=O)cc1 1616687148 QQKQOJOLMFXINF-FQEVSTJZSA-N 437.609 4.314 10 10 IICE Cc1ccc(C(=O)N2CCC(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1626700901 WPBFGDJEGXICPP-UHFFFAOYSA-N 443.547 4.250 10 10 IICE Cc1c(C(=O)NCc2ccc3cccnc3c2O)cnn1-c1ccc(C(F)(F)F)cc1 1627073194 LRPVCKIDDYBFCH-UHFFFAOYSA-N 426.398 4.383 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(C(F)(F)F)c(O)c1 1634753398 KQDOEOUIPXGGIB-ZDUSSCGKSA-N 430.373 4.411 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OCC(F)(F)F)cc1 1635941315 QAGSUFFXAPWUJM-QGZVFWFLSA-N 442.865 4.381 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC3(c4cccc(OC(F)(F)F)c4)CC3)C2)cc1 1636854076 RPYAHNQVLNKGIJ-MRXNPFEDSA-N 435.446 4.161 10 10 IICE CC(=O)c1ccc(O)c(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1637578781 KOGUCLCNLLGIJQ-UHFFFAOYSA-N 428.286 4.412 10 10 IICE Cc1cc(C(=O)NCC(=O)c2c(F)cccc2F)c(C)n1-c1ccc(Br)cn1 1638565354 UYPGNQQCQDHPNG-UHFFFAOYSA-N 448.267 4.143 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 1640257119 JVXCJAVJJXPPMS-HOTGVXAUSA-N 432.517 4.198 10 10 IICE Cc1cc(CCNC(=O)NCc2nc(-c3cccc(F)c3)no2)c(C)n1-c1ccccc1 1682083098 HPFIUTLPVHBQCP-UHFFFAOYSA-N 433.487 4.325 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)N(C)C)cc1 1687806944 LSIRSPWMXPSJET-DENIHFKCSA-N 435.572 4.086 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1692100442 IBAFOPAKTIJLSP-IBGZPJMESA-N 443.611 4.373 10 10 IICE CC(C)Cc1nnc(N2CC=C(C(F)(F)F)CC2)n1Cc1ccc(N2CCOCC2)cc1 1723281706 GPZLTZUFHFVBJB-UHFFFAOYSA-N 449.521 4.060 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)S[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726909343 QLPNOMXHRLRCDX-BZSNNMDCSA-N 447.624 4.146 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@@H](C)O[C@]3(CCCOC3)C2)cc1 1746087585 ZWSTUZHNYRFBMG-CJFMBICVSA-N 441.620 4.070 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCC(=O)N3)nnc2N(CC)[C@H](C)C2CCC2)cc1 1746090311 UGMIGHUOBOBVLN-XMSQKQJNSA-N 438.620 4.139 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1750733754 UJCADKVAJZTWRX-QGZVFWFLSA-N 444.630 4.168 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCOc3ccc(OC)cc3)C2=O)ccc1OC 1858587004 MQTPEELHORESGE-XSFVSMFZSA-N 445.562 4.383 10 10 IICE CCCN(CCC)C(=O)COc1ccc(/C=C2/C(=O)N(CCC)N=C2CC)cc1OC 1865675329 BIWFGPOHGKVZLL-XDJHFCHBSA-N 429.561 4.124 10 10 IICE CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1sc2c(c1C(=O)OC)CC[C@H](C(C)(C)C)C2 1866192040 FAMLBHZRVKNFDE-ZNMIVQPWSA-N 434.602 4.177 10 10 IICE CC[C@H](N[C@@H]1CCO[C@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2154211691 LLAUWAQHBZMPJF-VYDXJSESSA-N 443.382 4.268 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@H](NCc1cc(Br)ccc1O)C2 2226142885 BYPHLRYZZDBAPD-GRDNDAEWSA-N 425.367 4.280 10 10 IICE Cc1ccc(C=C2SC(=S)N(CCCC(=O)N(CCO)c3ccccc3)C2=O)cc1 2296882521 XXPHCFWUPCCCRH-UHFFFAOYSA-N 440.590 4.002 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)c(O)c1Br 2352947303 RFELEVNRMAJEKF-ARFHVFGLSA-N 425.367 4.198 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CC[C@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2381136476 GSQUWSSWMKHZBU-UXHICEINSA-N 441.366 4.163 10 10 IICE COc1cc(/C=C2\C(=O)NN(c3cccc(Cl)c3)C2=O)ccc1OCc1ccccc1 842308 FUVXINPWYXHASM-UDWIEESQSA-N 434.879 4.389 10 10 IICE Cc1cc(C(=O)CSc2nc(O)cc(=O)n2CC(C)C)c(C)n1-c1ccc(F)cc1 13063197 FKPLECBYLKNJJP-UHFFFAOYSA-N 429.517 4.127 10 10 IICE COc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)cc1OC 14479314 RDMVAJCVARHDFH-XLNZFTOWSA-N 440.565 4.315 10 10 IICE O=C1N=C(N2CCN(c3cccc(Cl)c3)CC2)S/C1=C\c1cccc([N+](=O)[O-])c1 35085467 QGSQMNWPOBCBOQ-PDGQHHTCSA-N 428.901 4.041 10 10 IICE CCOC(=O)c1ccccc1NCN1C(=O)S/C(=C/c2ccc(N(C)C)cc2)C1=O 59377446 PXNKQVAXQJEAQB-CPNJWEJPSA-N 425.510 4.035 10 10 IICE CCN(CC)CN1C(=O)/C(=C2/SC(=S)N(c3cccc(C)c3)C2=O)c2ccccc21 108997255 VQXQIAHIIFZESG-FMQUCBEESA-N 437.590 4.417 10 10 IICE CCOc1cc(/C=C/C(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1OC(F)F 110361404 GCVOWDBALKWKPQ-VZUCSPMQSA-N 446.494 4.494 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2C[C@H](C)C(=O)Nc3ccccc32)C1 435867589 OEEGBNGMHCLNQS-SFHVURJKSA-N 430.552 4.029 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cc1 729110627 UDFHKEMXXWPHIS-UHFFFAOYSA-N 442.440 4.123 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1C[C@@H]1c1cc(F)ccc1F 741542522 RJCDKNDQHAPSQY-SJLPKXTDSA-N 440.412 4.240 10 10 IICE CCOc1cc([N+](=O)[O-])c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1OC 746424321 LDYVBPDNJXMYFI-UHFFFAOYSA-N 437.496 4.382 10 10 IICE Cn1cc(NCc2cc(Br)cc(Br)c2O)c(-c2ccccn2)n1 753567373 DZMNOERBQWLFQF-UHFFFAOYSA-N 438.123 4.325 10 10 IICE C[C@@H](N[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cc([N+](=O)[O-])ccc1O 756646237 KAQUSHFCIPJBOL-PWSUYJOCSA-N 430.814 4.297 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cc1C(F)(F)F 768913712 QMPNBNFAHZFWRD-UHFFFAOYSA-N 435.465 4.307 10 10 IICE CC(=O)N/C(=C/c1ccccc1)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 776715827 AZPIYCXHNBNIQN-OEAKJJBVSA-N 434.467 4.136 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 791247525 GCYMRCHYOSPSGB-UHFFFAOYSA-N 438.484 4.078 10 10 IICE CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C[C@]2(CCOC2)O1 799995237 VMSHSRZWVMGQCR-GWJPWWOOSA-N 435.996 4.056 10 10 IICE Cc1cc(CSc2ncccc2C(=O)NCc2cc(Br)ccc2O)no1 804734154 XMOGSOPFAUZEKZ-UHFFFAOYSA-N 434.315 4.068 10 10 IICE C[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)c1nnc(-c2ccccc2)o1 913224452 XGAYGBRIZPDPCR-CYBMUJFWSA-N 439.427 4.012 10 10 IICE C[C@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)c1nc(-c2cccs2)no1 914617088 ITOKGUBRSDUYDT-NSHDSACASA-N 445.456 4.074 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F)cc1 1130245021 NWTVBVVSZQUJDI-QGZVFWFLSA-N 425.451 4.280 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cncc(Br)c1C 1139585814 WCRPYXXSWSFIOO-UHFFFAOYSA-N 448.361 4.155 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccn2cc(C(F)(F)F)nc12 1149899303 COKXZGROGLQHDI-UHFFFAOYSA-N 442.235 4.484 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)c1cnn(CC2CCC2)c1 1256298729 PLKHBFVZXCEFOE-AWEZNQCLSA-N 435.366 4.444 10 10 IICE CCN1CCN(CC(C)(C)NC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CC1 1276247889 PLLSIQMLRYPWNW-UHFFFAOYSA-N 436.604 4.314 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccccc4)oc3C(C)C)CC2)c(OC)c1 1287478816 WUYCHQIQYMXYER-UHFFFAOYSA-N 435.524 4.445 10 10 IICE CCC(CC)(Cn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccccc1O)SC 1291942136 CBABWOLFJSUDOI-UHFFFAOYSA-N 442.633 4.404 10 10 IICE COC(=O)C1([C@]2(O)CCCN(C(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)CCC1 1304136935 APJYJDOSHJUGBJ-DEOSSOPVSA-N 444.959 4.058 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCc2ccccc21 1348739062 HSNIOXCAADUMON-XMHGGMMESA-N 426.538 4.396 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCO[C@H]2c2ccnn2-c2ccccc2OC)cc1 1355015478 OCRJXPIAQXUQKV-PXDATVDWSA-N 448.567 4.121 10 10 IICE Cc1cc(CC(=O)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)c(C)n1-c1ccccc1 1357577574 ZLFHXAWJQJHMBB-LJQANCHMSA-N 445.563 4.171 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2CCN(C)C(C)C)c(C)n1-c1ccccc1 1361051879 DUGDNAURBURMRV-UHFFFAOYSA-N 438.645 4.246 10 10 IICE CN(C)c1ccc(CN(C(=O)Cc2ccc(Br)c([N+](=O)[O-])c2)C2CC2)cc1 1441126897 FBTHMLBYYXNKMH-UHFFFAOYSA-N 432.318 4.157 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(c2)CCS3(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1445747818 OECQUJMLNHUCOJ-UHFFFAOYSA-N 436.577 4.477 10 10 IICE COC(=O)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1456840238 MHQUFBPMISDVAP-HSZRJFAPSA-N 432.520 4.119 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H](CCNC(=O)OC(C)(C)C)C3)cc2)CC1 1460020798 WNIRMJHZFHPASU-HXUWFJFHSA-N 431.621 4.429 10 10 IICE Cc1cc(C(=O)N2CCCN(C(C)(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1464535382 HEKFOHLVOWDRMA-UHFFFAOYSA-N 433.394 4.198 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2nc(-c3ccccn3)cs2)cc1 1464882402 WNJXRKQWWKELAG-UHFFFAOYSA-N 444.560 4.327 10 10 IICE C[C@H](NC(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1478470989 LLOKHSDKBGDOLE-KNXBSLHKSA-N 438.572 4.304 10 10 IICE Cc1cc(N2CCC[C@H](NC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)n(C)n1 1530830475 PJJNIPGKWRKFTD-NRFANRHFSA-N 439.991 4.117 10 10 IICE CCS[C@@H]1CCC[C@@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1532501290 FSMYYSHAHHWEEP-IGPFEKLESA-N 438.615 4.207 10 10 IICE COC(=O)C(C)(C)CN(CC(C)C)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1536824704 MTRLXNPTGCAZQI-UHFFFAOYSA-N 428.573 4.213 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 1540744378 WIKCOFJCOCQYEG-INIZCTEOSA-N 434.283 4.399 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3CCCC[C@@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1542171740 YWPBSEIGAJIWFN-SQJMNOBHSA-N 445.604 4.208 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H](C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1545578329 ZEBDZDCBBMNGHM-PGRDOPGGSA-N 425.621 4.474 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCCC[C@H]3c3cccc(C)c3)CC2)cc1 1559553541 FYDMLIKHDINBKG-VPUSJEBWSA-N 437.628 4.104 10 10 IICE COC1CCN(c2ccc(CN3CCN(c4cccc(Br)c4)CC3)cc2)CC1 1559828295 LXXOMVRRJWFHJW-UHFFFAOYSA-N 444.417 4.387 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](C)CN3CCN(c4ccccn4)CC3)c2C)c1 1565853660 VWYWFOCVQZZXGP-NRFANRHFSA-N 445.611 4.046 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1nccnc1SCc1ccccc1 1596358408 BARSYBCSUXYRRR-UHFFFAOYSA-N 436.606 4.252 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCc4cc(Cl)cc(Cl)c4[C@@H]3C)nc12 1615811697 KJRMUTVGXVHPAH-NSHDSACASA-N 435.311 4.038 10 10 IICE Cn1cccc1-c1nnc(N2CCC[C@H](C(F)F)C2)n1CCCSc1nccs1 1618442683 DPHMVRNUNVOVLB-AWEZNQCLSA-N 438.573 4.404 10 10 IICE COCCN(CC(C)C)c1nnc(C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1619894278 RHSLUPSCRBHNGG-UHFFFAOYSA-N 431.650 4.112 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(C(=O)OC(C)(C)C)CCCCC3)cc2F)C[C@H](C)O1 1625090666 XEPCEIJKIRZVTQ-ROUUACIJSA-N 448.579 4.348 10 10 IICE C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1631531145 IZYVOMFEMWXBEZ-ZWKOTPCHSA-N 442.519 4.177 10 10 IICE Cc1ccccc1C(C)(C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1632030989 BTBCXRSDCGUBPF-UHFFFAOYSA-N 444.578 4.271 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc(Cl)ccc2Br)cc1 1636424092 ODSGINNMFVZUSJ-UHFFFAOYSA-N 440.769 4.389 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1 1638024030 QIYZFPIMBOTCOI-OAQYLSRUSA-N 439.556 4.424 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)C[C@@H]1CCC(=O)NC1 1638241818 XHSOBWCISQIYLM-HNAYVOBHSA-N 433.474 4.214 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1c(O)cccc1F)c1ccccc1C(F)(F)F 1646034880 NINFQSBCNXLAOP-KRWDZBQOSA-N 442.409 4.432 10 10 IICE Cc1cc(CC(=O)N[C@@](C)(CO)c2cccc(Br)c2)c(C)n1-c1ccccc1 1647008621 IZSPUWYTAAATFH-QHCPKHFHSA-N 441.369 4.423 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](c4ccc(Cl)cc4)C3(C)C)nc12 1648394220 KADMEPQEIOZPGD-GOSISDBHSA-N 428.920 4.033 10 10 IICE C[C@@H](NC(=O)NC[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 1671845123 WNRJGZLNBGNVHL-GUDVDZBRSA-N 432.609 4.444 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@H](Sc4cccc(Cl)c4)C3)cc2)CC1 1675581003 YKYXNTGRPQSMHS-QFIPXVFZSA-N 445.032 4.168 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](Cn3ccnc3)c3ccc(C)cc3C)C2)cc1 1680875448 ANDLEZBPVXJZNV-SQJMNOBHSA-N 447.583 4.076 10 10 IICE Cc1cc(CCNC(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)c(C)n1-c1ccccc1 1680923720 DITYKNKCDDRWDY-UHFFFAOYSA-N 440.588 4.383 10 10 IICE C[C@H](NC(=O)NC[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)c1ccccc1O 1683807983 UAYUNLMWFCUNKW-QFBILLFUSA-N 425.529 4.114 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(c2ccc(Cl)cc2)CC1 1687155156 HAUPJDNTWAJIFJ-UHFFFAOYSA-N 427.976 4.390 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1691930655 JJOXOTMDKYVYEI-NRFANRHFSA-N 436.579 4.390 10 10 IICE CCOCCN(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1696417631 RWFYYJQTVJJONU-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1710596216 WWSAPZJQFLAJLU-NHCUHLMSSA-N 431.600 4.370 10 10 IICE CC(C)OC1CCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CC1 1751034352 LWURDBATZWGUBB-UHFFFAOYSA-N 444.630 4.373 10 10 IICE Cc1ccc(-c2nnc(N3CC(C)(C)OC[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1751479157 VGMQTCGEVAECBU-HNNXBMFYSA-N 427.524 4.104 10 10 IICE CCC(CC)c1cc(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2ccccc2O)on1 1762176619 DTOBCTAFDBRKOT-SFHVURJKSA-N 425.533 4.064 10 10 IICE COCC1CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC1 1769469270 FFNYXGNRXBXOOW-UHFFFAOYSA-N 449.671 4.432 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cn2cccc(Br)c2n1 1865763779 DUDASWISGGKDCY-UHFFFAOYSA-N 446.260 4.125 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@]1(CN)CC[C@H]1OCc1ccccc1 2018785597 FAKPVRXSDHLTBM-RCZVLFRGSA-N 425.573 4.224 10 10 IICE COCCN1C(=O)C(=Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)SC1=S 2040496943 XURUCHCVMWGNRZ-UHFFFAOYSA-N 447.607 4.292 10 10 IICE CCCN1C(=O)C(=Cc2c(Oc3ccccc3)nc3c(C)cccn3c2=O)SC1=S 2296710631 HHJOIGMYQVFLLH-UHFFFAOYSA-N 437.546 4.406 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc(-c3ccccc3)o2)SC1=S)Nc1nccs1 2314485881 FZIKUIGCBTUAKT-UHFFFAOYSA-N 427.532 4.243 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N([C@@H](C(=O)O)[C@@H](C)CC)C1=O)C(C)=O 2314927363 DNRRYXQCQNBQPB-XLWVJDPXSA-N 435.567 4.134 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccc(O)cc3)C2=O)cc1OC)C(=O)O 2314930934 BCFBJBFWSYSAGU-HNNXBMFYSA-N 445.518 4.049 10 10 IICE CCCCCN1C(=O)/C(=C/c2c(NCCC)nc3c(C)cccn3c2=O)SC1=S 33468520 WDLXUWRAPXGTOF-SSZFMOIBSA-N 430.599 4.216 10 10 IICE Cc1cc2c(n1-c1ccc(I)c(Br)c1)CCC[C@@H]2N 311771978 WUMVOHUPNVXBLK-AWEZNQCLSA-N 431.115 4.489 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC3(CC2)OCc2ccccc23)C1 683446473 CQHDLMXRRLOJTA-UHFFFAOYSA-N 443.591 4.456 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(CNC(=O)OC(C)(C)C)cc3)CC2)cc1 726560618 JADPPWPKNKNYBM-UHFFFAOYSA-N 439.556 4.119 10 10 IICE C[C@H](NC[C@@H](CO)c1ccccc1)c1cc(Br)cc(Br)c1O 756636910 XSQJNGXOIWNPEF-AAEUAGOBSA-N 429.152 4.344 10 10 IICE COC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802683859 BKXAACMKEVQRTN-GGAORHGYSA-N 449.599 4.394 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802695085 QNIUWUKBLRHXNL-FYYLOGMGSA-N 449.599 4.394 10 10 IICE O=S(=O)(Nc1nc(-c2cccnc2)cs1)c1cccc(Br)c1Cl 811823584 VUNXPQLEAXQNTN-UHFFFAOYSA-N 430.736 4.422 10 10 IICE O=C(CN1CCN(Cc2ccc3ccccc3c2O)CC1)Nc1ccccc1C(F)(F)F 816482492 HWNLIUBOXBXAPQ-UHFFFAOYSA-N 443.469 4.321 10 10 IICE Cc1ccc(C(=O)CCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1C 918141300 ULDHMVMARGPKST-RTBURBONSA-N 426.532 4.335 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])CC2)cc1 1125250113 RKXNRFSILHFYHJ-UHFFFAOYSA-N 432.480 4.018 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](C)Cc3ccc(OC(F)(F)F)cc3)C2)cc1 1129992964 CSXGJTNGJDRPHL-AEFFLSMTSA-N 436.474 4.415 10 10 IICE O=C(NC[C@@H]1CCCCN1C(=O)c1cc2cc(O)c(O)cc2s1)Nc1ccccc1 1141436685 ANPVPZQVZVSCEP-INIZCTEOSA-N 425.510 4.129 10 10 IICE Cc1ccc(C(=O)N2CCC(CO)(c3ccccc3)CC2)cc1-n1c(C)cc(C=O)c1C 1141560211 VOTIRODNNIOHBD-UHFFFAOYSA-N 430.548 4.381 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(CN3CCC[C@@H](C(N)=O)C3)cc2)c1 1143167837 PMWBISNNPZLMLF-JOCHJYFZSA-N 444.579 4.352 10 10 IICE Nc1ccc(C(F)(F)F)cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1148444876 WLNVTNFZDKBXOY-ZDUSSCGKSA-N 429.389 4.288 10 10 IICE C[C@H](NC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)c1ccccc1O 1151892736 YDHSPOJVENGZGE-ZDUSSCGKSA-N 435.480 4.010 10 10 IICE C[C@H](CN1CCN(c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1162592005 RVVFYTLGJCWIGL-HXUWFJFHSA-N 444.535 4.448 10 10 IICE CCOc1ccc(N2CCN([C@H]3CCN(c4ccc(Cl)cc4Cl)C3=O)CC2)cc1 1168331679 ODLFFIXOSNNUTM-NRFANRHFSA-N 434.367 4.320 10 10 IICE CN(Cc1cc(Cl)cc(Cl)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229779848 BGJOVHBVAFWSNJ-UHFFFAOYSA-N 444.309 4.450 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4cc(F)ccc4F)CC3)C2)cc1 1252116458 RWOIEOQYKPGXMP-LJQANCHMSA-N 443.538 4.464 10 10 IICE Cc1ccc(CC[C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1265461060 PXYYNTGDUFTBSD-QIQQCEGHSA-N 446.569 4.456 10 10 IICE COC[C@H](Cc1ccccc1)N(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1271596330 OFEHGVLJPMQWRY-QFIPXVFZSA-N 433.596 4.124 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCC(F)F)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291453098 BIWUNVYCXHFQLL-QGZVFWFLSA-N 435.563 4.140 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)cc2C1 1292382882 WMDCAFHFWGQIQW-XMSQKQJNSA-N 437.584 4.190 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCSc3ncnc4[nH]cnc34)cc2Cl)C1 1297011333 XLWAFTWEYBYKJX-AWEZNQCLSA-N 444.992 4.041 10 10 IICE O=C(NCCOc1c(Cl)cc(Br)cc1Cl)NCc1ccccc1O 1312422476 MOGLBFPTNZNFOF-UHFFFAOYSA-N 434.117 4.340 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)C1CCC(NC(=O)OC(C)(C)C)CC1 1312886350 UITCBDBWSPZHHO-PELRDEGISA-N 446.636 4.469 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCc2cc(F)ccc21 1434874056 VIXWWRUSWUVZLR-FUDBJYBQSA-N 444.528 4.360 10 10 IICE CC1(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC(F)(F)C1 1438939971 PFFXOVAFZAOAAH-MDWZMJQESA-N 430.567 4.281 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c(C)n1-c1ccc(Br)cc1 1448920772 JOPOBNSJAUVDNI-GIMINZRKSA-N 447.373 4.265 10 10 IICE Cc1ccc(NC(=O)NC[C@@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)cc1 1464699109 YUEJRMZZZDQQET-HNNXBMFYSA-N 439.537 4.295 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C 1465224343 PHTPFUIPKVPIKW-INIZCTEOSA-N 427.545 4.139 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](Cn2ccccc2=O)c2ccccc2)c1 1467462834 DEUUFFWTSPJUIJ-RUZDIDTESA-N 439.515 4.240 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CO)c2ccccc2C(F)(F)F)c1 1472031815 UUFVKJDFDVQDKN-OAQYLSRUSA-N 430.426 4.389 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1504820057 PNIGAXISAMGMBL-SFHVURJKSA-N 425.602 4.331 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1516378937 IPRJRIISCBITQC-SFTDATJTSA-N 429.584 4.439 10 10 IICE CCN(CC)c1ccc(CNC(=O)COc2ccc(Br)cc2C(C)=O)cc1 1525919275 YHGNVIYDWGHJIS-UHFFFAOYSA-N 433.346 4.193 10 10 IICE CC[C@@H](Oc1ccccc1C(C)C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261471 MIGMFZDBIOJQMO-OAQYLSRUSA-N 432.511 4.399 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 1528924702 QNFSTZUMWJWMDH-WMZHIEFXSA-N 439.600 4.417 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](c1c(F)cccc1Cl)N1CCCCC1 1532657194 VSYGZJRSTOTYTB-QFIPXVFZSA-N 431.939 4.498 10 10 IICE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1537483497 OJGBFRHWYRBCOX-DGWAXEAPSA-N 435.490 4.474 10 10 IICE COc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1OC1CCCC1 1539236545 USURIBSYRDMRGI-QFIPXVFZSA-N 425.573 4.115 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H]1c1ccc(OC)cc1 1544165008 SRZQVWMNJYGTJP-OZXSUGGESA-N 449.595 4.084 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 1545632404 KPQCEXONAFGYRJ-IBGZPJMESA-N 443.931 4.156 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1546864967 CKBTZEKMYUZIOO-GOSISDBHSA-N 436.604 4.361 10 10 IICE Cc1cc(C(=O)Nc2nc3c(s2)C(=O)CCC3)c(C)n1-c1ccc(Br)cn1 1558922906 ZHMJXOQTOUTVNF-UHFFFAOYSA-N 445.342 4.479 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCCN(C(=O)Cc3cccc(F)c3)CC2)c1C 1566260304 AOQBSLNKAXCLKH-UHFFFAOYSA-N 447.554 4.459 10 10 IICE CCO[C@@H]1CN(C(=O)c2sccc2-n2c(C)ccc2C)C[C@H]1CNC(=O)OC(C)(C)C 1583681578 CNYUUESPJFZTCR-IEBWSBKVSA-N 447.601 4.157 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CSCN3C(=O)OC(C)(C)C)c2C)c1 1587020739 DZUFPOFOXFQPLI-HXUWFJFHSA-N 429.586 4.329 10 10 IICE Cc1ccc(CN(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)s1 1612059696 ZAATVMKWNVNYSI-UHFFFAOYSA-N 425.602 4.293 10 10 IICE Cn1c(CCNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)nnc1-c1ccccc1 1612237731 WSADHFUSGNGZNU-UHFFFAOYSA-N 427.464 4.276 10 10 IICE COc1ccc(N2C[C@@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)CC2=O)cc1 1612591697 BXLAZYIYNSEFFG-KRWDZBQOSA-N 431.448 4.052 10 10 IICE Cc1cc(C)cc([C@@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1616786238 FULPORZIWXNZPW-HSALFYBXSA-N 427.564 4.023 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](O)c3cc(Cl)c4c(c3)OCCO4)c2C)c1 1622371027 OZXXJHKPVHYKHE-NRFANRHFSA-N 440.927 4.291 10 10 IICE C[C@H](NC(=O)Cc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 1625543606 IXZQGFPXJQKLOX-SFHVURJKSA-N 437.584 4.466 10 10 IICE CCn1cnnc1-c1ccccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1625770038 CVICKVFUQXEFDE-UHFFFAOYSA-N 427.508 4.366 10 10 IICE CC(C)Cc1ncc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)s1 1628495583 MXXVALCCJOCDSV-GOSISDBHSA-N 446.617 4.403 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(OCCC)c1 1633794094 MBWFCTRTFKSPGY-UHFFFAOYSA-N 426.557 4.155 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c(C)n1-c1ccccc1 1634049869 QVFRYCHEBCALCE-IBVKSMDESA-N 430.596 4.456 10 10 IICE COc1cc(N2CCN(Cc3ccc(CN4CCCCC4)cc3)CC2)cc(OC)c1OC 1658172190 HQCCDXXZYGKKIA-UHFFFAOYSA-N 439.600 4.021 10 10 IICE COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1680941073 AFDWXODUEDOLPQ-HNNXBMFYSA-N 446.935 4.493 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@@H](c4ccnn4C)C3)cc2Cl)C1 1681828610 VOAAPUXDQINLRH-TVTNDZMWSA-N 445.995 4.029 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)C[C@@H](C)C3)n2CCCSc2nccs2)n1 1693422863 IOJIRVUUOKSFIK-IYBDPMFKSA-N 445.662 4.261 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(OC(C)(C)C)nc1 1693460960 KTRRFJSEZWFNHH-UHFFFAOYSA-N 434.588 4.444 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)C[C@H]4CCOC4)nnc3C(C)(C)C)cc2)CC1 1693699759 KDMIVORGSBJVAM-OAQYLSRUSA-N 425.621 4.333 10 10 IICE CSCCCN(C)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1698427964 CAEWLRVFLXYTJJ-UHFFFAOYSA-N 448.637 4.077 10 10 IICE C=CCN(CCOC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1OCC[C@H]1C 1705881549 SHWVIFSSFWSLGD-NTKDMRAZSA-N 449.599 4.416 10 10 IICE CCC[C@H](C)N(C)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1709478605 KMPXOUCPNMJSJO-FQEVSTJZSA-N 440.636 4.326 10 10 IICE Cc1cccc(-c2nnc(N(C)CCC(F)F)n2Cc2ccc3c(c2)CCCN3C)n1 1724485554 ZPMVGVSBLNJYQZ-UHFFFAOYSA-N 426.515 4.171 10 10 IICE Cc1cccc(-c2nnc(N3CCOC(C)(C)[C@@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1724507671 ZQQNCFWNPTWSCP-IBGZPJMESA-N 434.588 4.075 10 10 IICE Cc1nnc(N(Cc2ccccc2)C[C@@H]2CCCO2)n1CCCSc1nccs1 1726365843 YJSWKSVYWMQVQY-IBGZPJMESA-N 429.615 4.411 10 10 IICE CCSCCCn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1747512712 FCPCLXMDFCDQFP-UHFFFAOYSA-N 437.617 4.115 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2cc(C)on2)cc1 1764939424 UKJUGOPILKLCDE-QFIPXVFZSA-N 438.576 4.347 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@H](C)[C@@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 1858588400 DABHEVGAQJTHJY-PRDLHCJTSA-N 434.539 4.335 10 10 IICE COc1ccc(O)c(CNCCCONC(=O)OCC2c3ccccc3-c3ccccc32)c1 1937209577 KTLBEHYDXQZZFX-UHFFFAOYSA-N 448.519 4.351 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3cc(Br)cc(F)c3O)C(C)(C)[C@H]21 2175899878 CQMWMAMDFGECCH-COXVUDFISA-N 443.357 4.417 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3CCOc3ccc(C)cc3)C2=O)cc1 2293485553 AGMFPKZQNRUFSU-UHFFFAOYSA-N 443.503 4.104 10 10 IICE COC(=O)c1ccc(N2NC(=O)C(=Cc3ccc(-c4cccc(Cl)c4C)o3)C2=O)cc1 2294956776 BMMVEZSEQWYQQE-UHFFFAOYSA-N 436.851 4.156 10 10 IICE CC1=CC2=NC(=O)C(=Cc3ccc(OCc4ccccc4)c(Br)c3)C(=N)N2O1 2297347650 QPPQGVVRQHYRIS-UHFFFAOYSA-N 438.281 4.478 10 10 IICE CC(C)[C@@H](C(=O)O)N1C(=O)C(=CC(Cl)=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2297449413 PRYFAIRNMBRKEO-AWEZNQCLSA-N 426.903 4.028 10 10 IICE O=C(O)c1cccc(N2C(=O)C(=Cc3ccc(O)c(Br)c3)SC2=S)c1 2314732735 VNVSWRHGZQVIGY-UHFFFAOYSA-N 436.308 4.259 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2[N+](=O)[O-])SC1=S 2314769548 RUJKSDAELJNXIB-QGZVFWFLSA-N 428.491 4.100 10 10 IICE O=C(COc1ccc(C=C2SC(=S)NC2=O)cc1)Nc1ccc(Cl)c(Cl)c1 2314835308 DNTACUVDXKKRRO-UHFFFAOYSA-N 439.345 4.500 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1)C(=O)O 2314930207 ZDSSTFZZRDGJEL-HNNXBMFYSA-N 443.502 4.063 10 10 IICE CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352645707 MDFSGXNGIXVSGB-XHDPSFHLSA-N 429.355 4.019 10 10 IICE Cc1ccc(CN[C@H]2CN(Cc3ccccc3)C[C@H]2C(F)F)c(O)c1Br 2352952847 QCOVNILGBADWDS-SJORKVTESA-N 425.317 4.318 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381133480 PHKVCIOBXYZQHR-FQEVSTJZSA-N 441.366 4.117 10 10 IICE CS(=O)(=O)Oc1ccc(Cl)cc1/C=C1/SC(=S)N(c2ccc(F)cc2)C1=O 3003633 WRHXHYFZXRUOTE-OQLLNIDSSA-N 443.930 4.223 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C\c3cc(C)n(-c4ccc(OC)cc4)c3C)C(=N)N12 4761585 QSFUEAGTOPHCNP-JMCWYTMQSA-N 439.566 4.433 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(F)cc2)N2CCc3ccccc3C2)cc1 16914131 FTCFXIJHWYZGIV-AREMUKBSSA-N 431.555 4.350 10 10 IICE CCOc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccccc1C 20235960 HOGVJIHUYLOYBN-DEOMXOCUSA-N 447.491 4.302 10 10 IICE CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc(OC)c(OC)c2)cs1 727243126 QYPLRAJIQHUFRK-UHFFFAOYSA-N 449.510 4.099 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2cccc(N3CCOCC3)n2)cc1 775919327 MAHNBEPKTSDVMO-UHFFFAOYSA-N 444.539 4.330 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(CNC(=O)OC(C)(C)C)cc3)CC2)cc1 779502029 DYYHPHAFSVHLBO-UHFFFAOYSA-N 440.544 4.074 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(CCN(C(=O)NCc3ccc(N4CCCC4)cc3)C2)C1 801745679 QJXYCDGHZNBUOW-VWLOTQADSA-N 442.604 4.219 10 10 IICE O=C(CCc1ccc(-c2ccccc2)o1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661392 LSNAOCGJPQMMKN-UHFFFAOYSA-N 426.463 4.310 10 10 IICE CC(C)CN(CC1CCN(C)CC1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1132878443 CCYKZNYNBIGYFQ-UHFFFAOYSA-N 438.660 4.234 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1cc(Br)ccc1OCc1ccccc1 1137464961 YAPXDUPQKHWZRB-UHFFFAOYSA-N 442.309 4.412 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC2(c3ccccc3)CCOCC2)cc1 1141597021 FYYIGSYIFXHZMA-UHFFFAOYSA-N 430.548 4.314 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@H]2CCCC[C@@H]21 1146320247 PKMUOBRDZSZAPI-SMIHKQSGSA-N 436.552 4.029 10 10 IICE Cc1noc(C[C@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c2ccccc2)n1 1154185043 ALHYODXPQAGCNV-QHCPKHFHSA-N 428.492 4.312 10 10 IICE CCC[C@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1198632887 MXQJNZVEWHDATB-UNVFRBQDSA-N 441.591 4.361 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCOC12CCCCC2 1289485783 MTLOXNZVDIKQDE-HGLWPWQMSA-N 448.585 4.025 10 10 IICE CCCCCN(c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1294112138 AGDXEUAOALWBIF-JOCHJYFZSA-N 441.620 4.072 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cc2Cl)C1 1297010869 UOWQHVPMSBDZFN-IBGZPJMESA-N 434.024 4.228 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)[C@@H](O)c3cc(Cl)cc(Cl)c3)C2)cc1 1300632692 BRVOUWRVBRCYER-PXNSSMCTSA-N 437.367 4.457 10 10 IICE COCCN(Cc1ccc(C)o1)c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1 1301779565 GHOXEWUZJMXJHC-UHFFFAOYSA-N 441.551 4.353 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2cccc(NS(=O)(=O)C3CC3)c2)c1C 1304885550 WQXPUJWXDCICQK-UHFFFAOYSA-N 437.565 4.237 10 10 IICE CN1CCCc2cc(Cn3c(N4CCCN(C(C)(C)C)CC4)nnc3C(C)(C)C)ccc21 1314924381 MHQVBGYEAATGJX-UHFFFAOYSA-N 438.664 4.317 10 10 IICE CC(C)(C)OC(=O)Nc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1F 1453983106 LXGOGFUCUYOGBQ-UHFFFAOYSA-N 443.519 4.064 10 10 IICE COc1cc([C@H](C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)ccc1S(C)(=O)=O 1457264386 AOMNURXUNJQWFN-KRWDZBQOSA-N 440.565 4.306 10 10 IICE CCc1nc2ccccc2n1CCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1464598036 SLKXGTGCMRRXCZ-QFIPXVFZSA-N 434.584 4.263 10 10 IICE Cc1cn2ccc(NC(=O)CCCN3C(=O)/C(=C/c4cccs4)SC3=S)cc2n1 1470448671 RUYMRJNHTPZTFU-WJDWOHSUSA-N 442.591 4.324 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1 1470465476 GSNGGOVTFMRQNA-DFQSSKMNSA-N 431.577 4.349 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3c(F)cccc3F)CC2)c(C)n1-c1ccccc1 1470969084 PTAPNWDVGBTCAA-UHFFFAOYSA-N 438.522 4.447 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccccc3OCc3ccccc3)nc12 1473345762 KJUDAZURHUZJCU-KRWDZBQOSA-N 446.507 4.041 10 10 IICE CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1478471044 MRQSYWQFTLIMOB-WMZOPIPTSA-N 442.526 4.036 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1514015128 LCBUDKPXDSZEKF-WIYYLYMNSA-N 448.615 4.456 10 10 IICE C[C@H](NC(=O)c1cc(F)c(Br)cc1F)c1ccc(N2CCOCC2)cc1 1528554991 RDFMLEITFUAPKN-LBPRGKRZSA-N 425.273 4.055 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](c1c(F)cccc1Cl)N1CCCCC1 1532657193 VSYGZJRSTOTYTB-JOCHJYFZSA-N 431.939 4.498 10 10 IICE Cc1nc2ccc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)cc2s1 1538535153 WTDHWUXDJBPIRM-UHFFFAOYSA-N 445.547 4.425 10 10 IICE CC(C)Cn1nccc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1538920327 ROHGKDOJQPVSBZ-UHFFFAOYSA-N 439.317 4.264 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1C[C@@H](Oc2ccccc2)C1(C)C 1565127650 ZBXJGZUJRJIIDQ-DNQXCXABSA-N 437.584 4.035 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1SC(F)(F)F 1565455506 AWCMZESSTPZAKW-UHFFFAOYSA-N 439.503 4.477 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c1 1586317672 OTFPUWTUOFFNNQ-OAQYLSRUSA-N 425.529 4.036 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C[C@H]1C(=O)Nc2c(Br)cccc21 1617879755 MPXHWGJVFOLYDR-MRXNPFEDSA-N 431.330 4.409 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCc3cc(F)ccc32)NC(=O)OC(C)(C)C)cc1 1618253957 UXXPBNXKQFYPKG-FGZHOGPDSA-N 441.547 4.304 10 10 IICE CCN(C)C(=O)OC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1626997772 BBXIZJFRGAESHR-FQEVSTJZSA-N 427.545 4.186 10 10 IICE COc1ccc(C[C@@](C)(O)CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1OC 1628948784 ZCWPHWFHLUTGOM-AREMUKBSSA-N 436.552 4.143 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCC2CCN(CC(F)(F)F)CC2)c1 1629452435 WJLFPRIIAAVPJU-UHFFFAOYSA-N 435.490 4.301 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-c2ccc(F)cc2)n1C 1631531066 GBKHOEWGQLUCIN-UHFFFAOYSA-N 430.863 4.006 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@@H](C)C3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1 1632612024 QXSPTOZDAYMJOD-UYAOXDASSA-N 445.604 4.063 10 10 IICE COC(=O)C1([C@@]2(O)CCCN(C(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)C2)CCC1 1639505051 FHDZDUGVLBSAPK-XMMPIXPASA-N 444.959 4.058 10 10 IICE CCn1cc(C(=O)C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cn1 1650744337 WJKHHUFBKXNOQS-IBGZPJMESA-N 444.457 4.397 10 10 IICE COc1ccc(N(CC(=O)N(C)CCOc2ccccc2F)Cc2ccco2)cc1F 1657567214 VDOXDACRZJQSKY-UHFFFAOYSA-N 430.451 4.110 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C[C@H](O)c1cccc(Br)c1 1673745227 RKQMQXCSGORJBG-IERDGZPVSA-N 448.405 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)[C@H](C)C1 1683426072 UUAPJDVMVRLXIJ-DYXWJJEUSA-N 446.636 4.184 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(Cc4ccccc4Cl)CC3)cc2)CC1 1684973278 NHFIMZCHTMXELR-UHFFFAOYSA-N 441.019 4.256 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H]1c1ccc(F)cc1F 1686725599 OUMSDMAYWJYHGK-FQEVSTJZSA-N 437.437 4.126 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1C[C@@H]1C 1694301944 BMZXZGFJDONDCW-ICSRJNTNSA-N 438.620 4.089 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCC(C)C 1698233219 UUDNUNXRKYGPMF-GMAHTHKFSA-N 441.620 4.285 10 10 IICE Cc1cnn([C@H]2CCCN(c3nnc(CC(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)c1 1707703166 UYQBBWZUOXVODR-FQEVSTJZSA-N 439.583 4.076 10 10 IICE C[C@@H]1CCCN1c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)c(F)c1 1726579741 LTFXTWOGYTWXBR-CYBMUJFWSA-N 447.356 4.278 10 10 IICE CC1CCN(c2ccc(Cn3c(N4CCCO[C@H](C)C4)nnc3C(C)(C)C)cc2)CC1 1726598220 QFIADYMOIKQHQZ-HXUWFJFHSA-N 425.621 4.475 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(C)OC[C@@H]1C 1749709604 TYPOMOBXLCCHNV-IBGZPJMESA-N 437.588 4.393 10 10 IICE Cc1nnc(N2CCN([C@@H](C)c3ccsc3)CC2)n1CCCSc1nccs1 1751929082 WPGMMHIGOSJRCS-HNNXBMFYSA-N 434.660 4.170 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1C[C@@H](C)O[C@H](C)C1 1767771773 PKHJLEKAOBWGGI-WOJBJXKFSA-N 441.620 4.255 10 10 IICE CN(CCC1CCOCC1)c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1768873822 GYLXCBWGSHFOPA-QGZVFWFLSA-N 437.635 4.021 10 10 IICE O=C(Cc1ccc(Br)s1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1858765122 LTHHOMWLARCFPF-UHFFFAOYSA-N 426.291 4.467 10 10 IICE CN1N=C(c2ccccc2)/C(=C/c2cc(Br)cc(Br)c2O)C1=O 1865672990 PKXZNYFQRGONES-JYRVWZFOSA-N 436.103 4.177 10 10 IICE CC(C)(C)OC(=O)NCC1(NCc2c(O)cccc2F)CCN(Cc2ccccc2)CC1 2067208895 OOQJRCYSKRNLMT-UHFFFAOYSA-N 443.563 4.180 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](NCc2ccc(Br)cc2O)(C(F)(F)F)C1 2103576285 UENZXACJTIHRPT-MRXNPFEDSA-N 439.272 4.186 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H]4[C@H](CCN4Cc4ccccc4)C3)ccc(N)c2C1 2132362379 GWWHCCTXYDZEGL-CJFMBICVSA-N 448.611 4.273 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)c(C)n1-c1ccc(F)cc1 2294229459 VVQVKFMTCSQANO-UHFFFAOYSA-N 437.471 4.204 10 10 IICE CC(NCCCn1ccnc1)=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 2297317639 HXDRKJHNSIWPDI-UHFFFAOYSA-N 442.548 4.198 10 10 IICE COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)C2=C(C)NCCc2ccc(O)cc2)cc1 2297471471 YZFUTKLBRRKFMK-UHFFFAOYSA-N 445.494 4.397 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=CNCc2ccccc2)cc1 2297624721 HDEPBXLQEAZCMT-UHFFFAOYSA-N 428.448 4.028 10 10 IICE CCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)c(C)c3C)C2=O)cc1 2313549277 ROPZTQIZFYHCQV-UHFFFAOYSA-N 443.297 4.131 10 10 IICE Cc1ccc(NC(=O)COc2ccc(Cl)cc2C=C2SC(=S)NC2=O)cc1C 2314485868 FQKWTNWVBBAYKK-UHFFFAOYSA-N 432.954 4.463 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(N(C)c2ccccc2C(=O)O)=NC1=O)C(C)=O 2314927978 OGHYNCWWPLZQTP-GOSISDBHSA-N 438.505 4.238 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@@H]3[C@H]2CCN3C(=O)OC(C)(C)C)c(O)c1Br 2352690259 RFELEVNRMAJEKF-HRCADAONSA-N 425.367 4.198 10 10 IICE CCOC(=O)c1cccc(-n2c(C)cc(/C=C3\NC(=O)N(c4ccccc4)C3=O)c2C)c1 33332214 PEYUYMUUTNCNAG-JCMHNJIXSA-N 429.476 4.368 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)NCc4ccc(C)c(C)c4)cs3)CC2)cc1 65211542 HHJGTWHGWXOGRS-UHFFFAOYSA-N 436.581 4.025 10 10 IICE CC(=O)N1CCC[C@H]1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 115151942 XVWOERNUMYHEHN-FQEVSTJZSA-N 426.517 4.306 10 10 IICE CCN(CC)C(=O)C1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 746853906 URVKPRWRYXKZAE-UHFFFAOYSA-N 429.992 4.397 10 10 IICE COc1ccc(-c2cc3nc(CN(C)c4ccc(OC)cc4OC)[nH]c(=O)c3s2)cc1 752111819 NCPIDCMFOWWUTQ-UHFFFAOYSA-N 437.521 4.314 10 10 IICE CN1CC[C@@H](NC(=O)NCCCSc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 755083241 JEQBQSLZLHBSEF-HZPDHXFCSA-N 428.986 4.162 10 10 IICE CC(C)(C)OC(=O)c1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 775363432 QAMFHFSWIMCILP-UHFFFAOYSA-N 443.519 4.064 10 10 IICE C[C@@H](NC(=O)Nc1cc(F)cc(Br)c1F)c1ccc(N2CCOCC2)cc1 786485791 PYVCKQDBLZQYBK-GFCCVEGCSA-N 440.288 4.447 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 798085841 CISUDTCCRVGKGG-LADGPHEKSA-N 433.527 4.295 10 10 IICE CCOc1cccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1125052513 FUUIRPKUHKEJKK-CPNJWEJPSA-N 444.553 4.132 10 10 IICE CC[C@H](C)Oc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccn1 1125196486 MDGCKYHZRJOKHA-HNNXBMFYSA-N 437.462 4.044 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnc(Cc4ccc(F)cc4)s3)C2)cc1 1129991329 ONZZZMLQMNGSNT-KRWDZBQOSA-N 425.529 4.138 10 10 IICE CC(C)(C)n1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1134751290 WQIZHIXXHSLVDI-UHFFFAOYSA-N 439.317 4.363 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1nn(-c2cc(Cl)ccc2F)c2c1CCC2 1135690161 RHFRTIDNCXXZQT-UHFFFAOYSA-N 426.923 4.492 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@]1(c2ccccc2)CCC(=O)NC1 1137816628 MVKVIWBZMKXQPS-NFQMXDRXSA-N 428.532 4.330 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1F 1144979136 ZUMSSXJHUXFLGJ-RUZDIDTESA-N 441.547 4.337 10 10 IICE COc1ccc(C(=O)N2CCC[C@H](C(=O)N[C@H](C)c3ccccc3O)C2)c2ccccc12 1151885929 NVYWFGLWPIOZAW-MSOLQXFVSA-N 432.520 4.284 10 10 IICE Cc1ccc(-c2nc(O)n[nH]2)cc1NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1155260028 FRJXBPAHTOVMMJ-UHFFFAOYSA-N 429.480 4.266 10 10 IICE Cc1nc(SC(F)(F)F)sc1CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1158716319 AMDLKCPYYDFAGI-HNNXBMFYSA-N 446.564 4.091 10 10 IICE COc1ccccc1N1CCCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CC1 1159250020 CJTMZUNPMQXSRS-UHFFFAOYSA-N 431.536 4.268 10 10 IICE CN(CCOc1cccc(C(=O)NCc2cc(Cl)ccc2O)c1)C(=O)OC(C)(C)C 1165508191 NGORWLSNNOKZSP-UHFFFAOYSA-N 434.920 4.221 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccnc2OCC(F)(F)F)cc1 1290825948 GXIAFCZESISPPA-UHFFFAOYSA-N 445.441 4.102 10 10 IICE CN(C(=O)OC(C)(C)C)[C@@H](CC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1297440781 QFBMIGLMFBSSAR-HNNXBMFYSA-N 443.382 4.443 10 10 IICE COC(=O)C[C@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CC1 1300812893 ZRUSBHHACFXUDR-MRXNPFEDSA-N 433.346 4.176 10 10 IICE COCCC(C)(C)Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1315959380 PKYLIGVVSNCXEL-UHFFFAOYSA-N 449.603 4.034 10 10 IICE Cc1cccc(CN(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1350006427 NAFAYTMCOVNNRF-CPNJWEJPSA-N 428.554 4.384 10 10 IICE CCOC(=O)c1c(NC(=O)Cc2nc(C3CC3)nn2C)sc(C)c1-c1ccc(C)cc1 1353525660 DJLWUESELILFKD-UHFFFAOYSA-N 438.553 4.396 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)S[C@H](C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1361049022 PZDYPVYSFRMCNX-HDICACEKSA-N 439.629 4.454 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)Cc2ccccc21 1444697046 GMTZFJOMFVQKBZ-HXUWFJFHSA-N 437.540 4.013 10 10 IICE CCc1ccc(N(CC(C)C)C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1448961727 AAQRKGDMKCVHII-PFONDFGASA-N 449.595 4.152 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 1449124709 RQSIEQMUTJYYLA-UHFFFAOYSA-N 443.500 4.256 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@H]2CCCCO2)c(C)n1-c1ccc(Br)cn1 1452671774 OJURNLJKMMQMBH-UYAOXDASSA-N 432.362 4.329 10 10 IICE Cc1ccc(C(=O)NCCNC(=O)c2ccccc2Cl)cc1-n1c(C)cc(C=O)c1C 1464131988 WVUXHVNFEHOLIY-UHFFFAOYSA-N 437.927 4.028 10 10 IICE COc1cc(CCNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc(OC)c1 1471599826 FEPWGJJYFXGOOU-UHFFFAOYSA-N 437.540 4.317 10 10 IICE CC[C@@H]1c2ccccc2CCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1473168152 ORCJMOXDJQUIQF-AXHZCLLHSA-N 439.575 4.065 10 10 IICE CCN(Cc1cc(Br)ccc1O)CC1(O)CCC(C(=O)OC(C)(C)C)CC1 1473190899 HYDHQXUHSMEVJO-UHFFFAOYSA-N 442.394 4.240 10 10 IICE COCCCOc1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1C 1527482289 XMTDMJXQSDDJSC-HDICACEKSA-N 444.547 4.093 10 10 IICE CN(C)C(=O)[C@@](C)(NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1)C(F)(F)F 1528150066 UDWKEBLPJKFYET-HXUWFJFHSA-N 435.450 4.307 10 10 IICE Cc1cc(CCNC(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)c(C)n1-c1ccccc1 1530890248 RFSFHHYVFRNUEF-DEOSSOPVSA-N 442.567 4.304 10 10 IICE COc1ccc2c(c1)CN(C(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CC2 1542629508 QXBUJLCNWOKXRF-UHFFFAOYSA-N 440.341 4.459 10 10 IICE CCOCc1nnc(N(CC)[C@@H](C)C2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1548094089 XBFJZQXRLBKWCR-IBGZPJMESA-N 443.661 4.431 10 10 IICE Cc1cc(CC(=O)NC[C@@H](c2ccccc2)c2nc[nH]n2)c(C)n1-c1ccc(Cl)cc1 1556594232 UMDSWWWRJKGQCV-QFIPXVFZSA-N 433.943 4.356 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)c2ncc([N+](=O)[O-])cc2Br)cc1 1559156700 HKSOYPQQSFUNAP-QGZVFWFLSA-N 435.322 4.004 10 10 IICE CC1(C)CC[C@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)N(C(=O)OC(C)(C)C)C1 1565210179 VYPOUAZJDDJZHF-GOSISDBHSA-N 445.604 4.496 10 10 IICE CCCN(Cc1ccccc1O)C(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OC(C)(C)C)C1 1566305298 PNAVBENGEMWXGY-OAQYLSRUSA-N 437.540 4.107 10 10 IICE Cc1cc(C(=O)Nc2cccc(-n3cnnn3)c2)c(C)n1-c1cccc(Br)c1 1587522301 NRUVHVJTVZIYPE-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c(F)c3C)CC2)cc1F 1595483128 SJWBMBPLVOZXLA-UHFFFAOYSA-N 425.273 4.007 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(-n4ccc(C(F)(F)F)n4)c3)C2)cc1 1598364348 QSRZRUHCJKCMNK-INIZCTEOSA-N 444.457 4.156 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCCC[C@@H]3C)C2)n1Cc1ccc(N(C)C)cc1C 1613997734 FEVKYCMUYJFMPQ-VXKWHMMOSA-N 438.664 4.354 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCCCCC2)n1CCCSc1nccs1 1620106506 NPKOTCIKVVYSEC-IRXDYDNUSA-N 437.635 4.021 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2cccc(F)c2)c(C)n1-c1ccccc1Br 1623814946 WCDBZJARWFQWAR-IBGZPJMESA-N 431.305 4.459 10 10 IICE Cc1cc(F)cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1N 1623924947 LZNIODBLAMXVIN-UHFFFAOYSA-N 432.543 4.333 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccccc3Oc3cccc(C)c3)CC2)cc1 1627050116 ISFUWTZSNNTXKW-UHFFFAOYSA-N 445.563 4.348 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(Br)ccc1O 1629056114 ZVNPPSLUHOUNOO-ZDUSSCGKSA-N 441.272 4.155 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C2CC2)CC[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1629137155 XJOHWARXFLGDKX-JKSUJKDBSA-N 429.344 4.493 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](c1cccc(Cl)c1)N(C)C 1629969232 RSEZJVCHDNGQCM-SFHVURJKSA-N 425.754 4.460 10 10 IICE COc1cc(CN(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)ccc1O 1631146624 CNHCGXADXKOQOF-UHFFFAOYSA-N 444.329 4.238 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cccc(C(F)(F)F)c1=O 1631530974 COCXHPFUNHNNNO-INIZCTEOSA-N 430.426 4.363 10 10 IICE CC[C@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)n1nnc(-c2ccc(Cl)cc2)n1 1641997475 PQROSAQYSZKQJE-OAHLLOKOSA-N 440.718 4.273 10 10 IICE CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1Cc1ccc(N2CCC(OC)CC2)cc1 1642712708 NGWWAKOXSLJNGE-MHZLTWQESA-N 436.596 4.442 10 10 IICE C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1644766401 APTIFLMMVVACLT-ZWKOTPCHSA-N 447.982 4.056 10 10 IICE O=C(NCCOCc1ccc(Cl)cc1Cl)NCc1cccc(Br)c1O 1680935824 MFTYBXRWGXKHBX-UHFFFAOYSA-N 448.144 4.478 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](c1ccc(OC)nc1)C1CC1 1683158234 XSOAEANRSIGBAQ-IBGZPJMESA-N 434.334 4.241 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1C[C@H]2CC[C@@H]([C@H]1C)N2C(=O)OC(C)(C)C 1687270509 FRYKVFWEEMELAY-XGARDCMYSA-N 444.620 4.461 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)C[C@H]1C 1693899292 YGDKLFCGCXJIPB-LJQANCHMSA-N 448.615 4.456 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCSC1 1695627897 AXRNJDQIWTZADH-QHCPKHFHSA-N 425.602 4.067 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc2c(c1)CCCN2C 1698150067 PPFBLWZKTAIRMV-VQTJNVASSA-N 441.620 4.059 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1 1698221676 JHLWQTUHEPZXPP-KDURUIRLSA-N 437.588 4.108 10 10 IICE CS[C@@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1712774421 FEVJFMFWOIEWQW-LJQANCHMSA-N 447.624 4.147 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(OC)c3)n2CCCSc2nccs2)CCO1 1744983725 ZIKGDXMNJHUZRY-QGZVFWFLSA-N 445.614 4.208 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC1(OC)CCC1 1761877721 KDFAFVNPKFWPDE-GOSISDBHSA-N 445.583 4.225 10 10 IICE COCCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C 1770143407 MMYDTWZGIBXNHG-LJQANCHMSA-N 437.588 4.394 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1770211178 ZYOIOOIENRNPNX-JZWVFAODSA-N 441.620 4.051 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)Oc2ccc(N)cc2)sc(C(=O)OCC(C)C)c1C 1860083596 SFXMQYQDQZKFCE-CQSZACIVSA-N 448.541 4.034 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccccc3)C(=O)N(C[C@H]3CCCO3)C2=O)cc1 1873419978 SRRRYWIETBATMQ-HSZRJFAPSA-N 441.531 4.465 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2c(O)cccc2Br)C(F)(F)CC1 1966027493 IFSCGRYOQIDBOF-HNNXBMFYSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@](C)(Br)[C@](C)(F)C3)ccc(N)c2C1 2205660029 AMLIGALKLTZPRH-VQTJNVASSA-N 442.373 4.264 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4C)o3)C2=O)c1 2294133693 AKDYDVBHSLOTJB-UHFFFAOYSA-N 445.431 4.446 10 10 IICE CCOc1ccc(C=C2SC(=S)N([C@@H](C(=O)O)c3ccccc3)C2=O)cc1OC 2295982127 ITDPGNMDEFQEJZ-GOSISDBHSA-N 429.519 4.121 10 10 IICE COc1cccc(C=C2SC(=S)N(NC(=O)c3ccccc3Br)C2=O)c1 2296879938 LUHZVYHTXXUWRM-UHFFFAOYSA-N 449.351 4.004 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C2=O)cc1 2297348270 ZYIHBJYMAVOXSA-UHFFFAOYSA-N 445.431 4.392 10 10 IICE Cc1ccc(CNC(=O)[C@]2(NC(=O)OC(C)(C)C)CC[C@@H](C)C2)c(O)c1Br 2380754044 MMJQEBYTBCMAGC-ODXCJYRJSA-N 441.366 4.163 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccc(C)cc3)C2=O)ccc1O 15045875 WWQGSXDXEFRNCE-YQNUULROSA-N 442.562 4.328 10 10 IICE O=C(COc1ccc(Cl)cc1/C=C1\SC(=S)NC1=O)Nc1ccccc1Cl 39793927 SSXQUUWWQPPFAH-NVNXTCNLSA-N 439.345 4.500 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 727471937 RZOLRHVFGCDXOU-OAQYLSRUSA-N 426.948 4.064 10 10 IICE CC(C)CC(=O)NCCc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)s1 769667770 SHJNNIKBSVVOBQ-UHFFFAOYSA-N 449.623 4.377 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2CCC23CCOCC3)sc(C)c1-c1ccccc1 769891602 DMLCGLAXTJKPID-UHFFFAOYSA-N 442.581 4.484 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3cccc(F)c3F)C(F)(F)F)CC2)cc1F 776020008 LZXVDCGWYYWBIN-GOSISDBHSA-N 447.379 4.248 10 10 IICE O=C(NCc1ccnc(OCc2ccccc2)c1)NCc1cc(Br)ccc1O 804916119 YAUGLIOPBBEXFF-UHFFFAOYSA-N 442.313 4.128 10 10 IICE C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1 806221022 WSEQVRCVLGFSAO-CQSZACIVSA-N 446.345 4.491 10 10 IICE COc1ccc(CCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Br)c1 1125518450 GGZDERDOQIAGSB-MRXNPFEDSA-N 447.373 4.104 10 10 IICE CCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2c(CC(C)(C)C)noc2n1 1127189333 JIUZXJRPJPSLLG-UHFFFAOYSA-N 436.556 4.345 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2C[C@]2(C)c2cccc(Br)c2)cc1 1130547522 KZCSMYDVFMOLGK-IFMALSPDSA-N 431.374 4.330 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1N(C(=O)OC(C)(C)C)CC1(C)C 1137349267 MJCWAQRNADXHPB-MRXNPFEDSA-N 441.366 4.149 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1137595926 WTXWALSMQCUQSO-AWEZNQCLSA-N 431.920 4.483 10 10 IICE Cc1cc(C(=O)N(C)C(C)(C)CN2CCOCC2)c(C)n1-c1ccccc1Br 1142067498 WZILDKGOYSPMJF-UHFFFAOYSA-N 448.405 4.039 10 10 IICE CC(C)(C)OC(=O)NCC[C@H]1Cc2ccccc2N(C(=O)/C=C/c2ccc(O)c(O)c2)C1 1156511720 LLNHVIYNJCOFJD-CKDFRHGISA-N 438.524 4.231 10 10 IICE Cn1cc(-c2ncccc2C(=O)N2C[C@H](CCNC(=O)OC(C)(C)C)c3ccccc32)cn1 1156931586 FTRGMXGWDINBJU-KRWDZBQOSA-N 447.539 4.141 10 10 IICE Cc1cc(C(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c(C)n1-c1ccc(Cl)cn1 1189005455 VFGUIRNEJPCVAE-ZIAGYGMSSA-N 442.947 4.072 10 10 IICE Cc1cc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)c(C)n1-c1ccc(Br)cn1 1295169177 QUZBPQDXUDXOPK-HNNXBMFYSA-N 433.394 4.054 10 10 IICE O=C(Cc1cc(Br)ccc1Cl)NCc1cccc(Br)c1O 1297438737 CHWDPNJKEKOHAE-UHFFFAOYSA-N 433.527 4.430 10 10 IICE COCC1(CCn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)CCCC1 1301115896 BIWDVUBDGZPVDF-UHFFFAOYSA-N 435.572 4.203 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N3CCCOCC3)cc2)CC1 1305065120 GBJGGBQBUKVZRE-UHFFFAOYSA-N 425.621 4.378 10 10 IICE C[C@@H]1CCc2nc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)sc2C1 1306228435 JRLOLUGPIOYGCZ-LLVKDONJSA-N 449.579 4.088 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1313100038 GVQCCNVWPNGPEW-LJQANCHMSA-N 440.588 4.287 10 10 IICE CO[C@@H]1CCCN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)C1 1315702799 MIIRRQSQTRYDDK-LJQANCHMSA-N 443.642 4.431 10 10 IICE CCOC(=O)c1c(NC(=O)c2cn(C)nc2COC)sc(C)c1-c1ccc(F)cc1 1351732597 DMLRKOSJBQSCDS-UHFFFAOYSA-N 431.489 4.172 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1csc(CNC(=O)OC(C)(C)C)n1 1356266081 JDVQETKYXBYYPR-UHFFFAOYSA-N 430.574 4.040 10 10 IICE COc1ccc(CCCCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1436623775 JDKRQLCKENPOLL-UHFFFAOYSA-N 432.511 4.229 10 10 IICE Cc1cc(CCNC(=O)c2cnc3c(c2)c(C(F)(F)F)nn3C)c(C)n1-c1ccccc1 1438176231 CJDWQJWDAPMLSO-UHFFFAOYSA-N 441.457 4.367 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCSCc1nc(O)c2ccccc2n1 1440711410 ASSVUZNOFFBFAQ-UHFFFAOYSA-N 436.581 4.218 10 10 IICE C[C@H]1c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)n2CCN1C(=O)OC(C)(C)C 1464517905 HCLSJDNLIWPGPZ-KRWDZBQOSA-N 438.572 4.112 10 10 IICE COc1ccc(OC)c([C@@H](O)CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1465901935 OLTBCLXWUITJHM-NRFANRHFSA-N 428.916 4.228 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@@H](Oc3ncccc3F)C2)cc1 1501834115 HUMGVRLKCYVKBJ-OAQYLSRUSA-N 438.551 4.063 10 10 IICE COc1cccc(CO[C@H]2CCN(c3nnc(C)n3CCCSc3nccs3)C2)c1 1504357775 BLSKGXUSJAPGQS-IBGZPJMESA-N 445.614 4.030 10 10 IICE CO[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CC[C@H]1C 1504516094 JVUSXABLCNMXNI-JPYJTQIMSA-N 425.621 4.295 10 10 IICE CC[C@@H](Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1518325972 PSNWRHIBKMSLLX-HSZRJFAPSA-N 442.003 4.346 10 10 IICE CO[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC[C@H]1C 1518623040 UKBNKOVUJUVSKE-IXDOHACOSA-N 437.635 4.020 10 10 IICE CCn1c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc2ccccc21 1527246789 YNMQMDCGNHOKDL-UHFFFAOYSA-N 431.458 4.447 10 10 IICE C[C@@H](c1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1)C(F)(F)F 1528261043 CSKHMRMXSDMFBD-ZDUSSCGKSA-N 428.401 4.397 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sc(C4CCCC4)nc3C)cc2F)CC1 1537534743 ICNIQSFQKRNMGM-UHFFFAOYSA-N 430.593 4.320 10 10 IICE C[C@@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)[C@@H]1CCCO1 1538920455 TWFAVMJSGSCPST-BBRMVZONSA-N 429.318 4.303 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCc2ccccc2Br)N(C)C)cc1 1539236046 OHHHDGVUFBDODC-OAQYLSRUSA-N 432.406 4.257 10 10 IICE O=C(/C=C\c1cnc2ccccc2n1)N1CCOc2cc(Br)c(Cl)cc21 1539901305 QTHGFYIGLKJFJL-WAYWQWQTSA-N 430.689 4.485 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)nc1C 1540166861 QDLOKQSOYFEGBO-FOWTUZBSSA-N 447.607 4.470 10 10 IICE CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc(O)cs3)ccc2C)cc1 1540466456 MEYFIXGRLKWBRN-UHFFFAOYSA-N 432.523 4.214 10 10 IICE CC[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)[C@H](O)c1c(F)cccc1F 1545596700 XUUXOUSRKMMVGQ-RDGATRHJSA-N 440.490 4.356 10 10 IICE CCc1nnc(N2CCC(CN(C)C(C)C)CC2)n1Cc1ccc(N(CC)CC)cc1 1546472112 LBWXOPOPUHYJPR-UHFFFAOYSA-N 426.653 4.292 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2ccc(Br)cn2)cc1 1556438689 SAIICIPIBHYCRW-OAHLLOKOSA-N 440.341 4.484 10 10 IICE CC1(CC(F)(F)F)CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1557005081 FYHOGZBFSIGJHP-RIYZIHGNSA-N 446.491 4.218 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1566386563 LKUVAVOIRQMTSK-GOSISDBHSA-N 427.342 4.363 10 10 IICE Cc1ccc(C(=O)N2CCN(Cc3ccc(-c4ccccc4F)s3)CC2)c(O)c1O 1587496598 MXGSYGXQWJQPIE-UHFFFAOYSA-N 426.513 4.232 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](C[C@H](C)CC)NC(=O)OC(C)(C)C)CC2)cc1 1596732704 GDYGBPMNHAQHJS-WIYYLYMNSA-N 433.593 4.063 10 10 IICE CCC[C@H](Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1614402591 GJIJPGFXOXLHLA-HSZRJFAPSA-N 434.588 4.392 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)cc1C 1615567133 HZMNAGFNEGEJOZ-QFIPXVFZSA-N 434.588 4.077 10 10 IICE CC(C)c1ccccc1N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1618309580 YXGFHNYXUWYUSU-KDURUIRLSA-N 427.564 4.315 10 10 IICE COc1cc(N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)ccc1F 1626097712 ZLKYFGRQQVQQJE-UHFFFAOYSA-N 435.499 4.017 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(NC(=O)c4ccc(F)cc4)c3)CC2)cc1 1630992745 VBWPUJJIUKJZNY-UHFFFAOYSA-N 447.510 4.439 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1 1632356806 VUIFYQSTFGKCKS-QFIPXVFZSA-N 447.531 4.333 10 10 IICE Cc1cc(C(=O)NCCn2ccnc2C(C)C)c(C)n1-c1ccc(Br)cn1 1633015861 DNTLMBKSDJFGPQ-UHFFFAOYSA-N 430.350 4.002 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@H]2CCCC2=O)c(C)n1-c1ccc(Br)cn1 1633205789 JRPPFXYCSWAWCD-SJLPKXTDSA-N 430.346 4.225 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](Cc3ccccc3)[C@@H](O)C(F)(F)F)c2C)cc1 1636710740 SGHOMOMPQUCYJA-FGZHOGPDSA-N 446.469 4.367 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(F)c(Br)ccc3[nH]2)N(C)C)cc1 1637004905 VQOWKPVMAWHYJH-IBGZPJMESA-N 447.352 4.168 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3cc(Br)c(F)cc3C2)c([N+](=O)[O-])c1 1643259542 BPULGSMYWMSRPN-HWKANZROSA-N 435.249 4.245 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC/C=C\c1ccc(Br)cc1 1682622691 JRIQVDNGGPRATO-IHWYPQMZSA-N 444.373 4.141 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1684537913 NXEDMPIXUJJBAI-HSZRJFAPSA-N 448.611 4.208 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1695088126 ZCTXRCXWHBOIPR-KRWDZBQOSA-N 441.551 4.495 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1C[C@@H](C)CC(C)(C)C1 1724235111 HWJAUVHUGNRNGS-GHTZIAJQSA-N 425.621 4.467 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC[C@@H]3CCO[C@H](C)C3)CC2)cc1F 1748849376 NKUHSMLDRZMTLX-RTBURBONSA-N 445.583 4.081 10 10 IICE C[C@@H](CN1CCCCC1)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O 1761432898 AVUFPIVSPJWHME-FQEVSTJZSA-N 425.621 4.475 10 10 IICE CN(c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1)C1CCC1 1768564627 WWUVLZJXDJKODH-UHFFFAOYSA-N 425.621 4.112 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)CCc2cccc(Br)c2)c2nccn2C)cc1 1866123926 JORZADBTHMUNKM-OAQYLSRUSA-N 441.373 4.087 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)N3CCN(Cc4ccc5c(c4)OCO5)CC3)c2C)cc1 1873839036 SBBWUMOPEIFZDO-UHFFFAOYSA-N 431.536 4.089 10 10 IICE COc1ccc(Br)c(CN[C@]23CCCN(C(=O)OC(C)(C)C)C[C@@H]2C3)c1O 2236056532 WFZWOFPJXYSIES-RBZFPXEDSA-N 441.366 4.043 10 10 IICE CCOc1cc(C=C2C(=O)NN(c3ccccc3)C2=O)ccc1OCCOc1ccccc1 2293449771 YVHOPZIRPXJDOR-UHFFFAOYSA-N 444.487 4.005 10 10 IICE CCCOC(=O)CCN1C(=O)C(=Cc2ccc(OC(C)C)c(OCC)c2)SC1=S 2314759303 AUEFQHIAVOZTKZ-UHFFFAOYSA-N 437.583 4.417 10 10 IICE CC[C@@H](C)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323829835 ZFVZIFLKSHBZAD-OQPBUACISA-N 432.336 4.289 10 10 IICE CC[C@@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2380756525 LXKRRRVTPJBCNX-IUODEOHRSA-N 443.382 4.409 10 10 IICE O=C(CCN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccc(Cl)cc1 15037557 CZVJMUVKBFSPRA-WJDWOHSUSA-N 447.925 4.478 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1c[nH]c3ccccc13)N2 250520844 BMMHOFXNJOFTPA-RZJWPFCGSA-N 449.576 4.452 10 10 IICE CCCN[C@H]1C(=O)Nc2cc(N(C)CCOCc3ccccc3)c(Br)cc21 384114398 KGWBYGFDBKPTSL-HXUWFJFHSA-N 432.362 4.095 10 10 IICE COc1ccccc1[C@@H](O)CN[C@H](C)c1cc(Br)cc(Br)c1O 756458164 KCMGNMUANOVCPY-BMIGLBTASA-N 445.151 4.310 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1c(F)cccc1F 768697854 YHEDPPRQELZXET-QGZVFWFLSA-N 428.527 4.057 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 771941810 URZAXOIEBHXUMT-LJQANCHMSA-N 434.462 4.064 10 10 IICE Cc1cc(Br)c(O)c(CNc2cccc(C(=O)N3CCCC[C@H]3CCO)c2)c1 781634455 AIRFESJRBQGVSR-IBGZPJMESA-N 447.373 4.452 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3cnc(C(=O)OC(C)(C)C)cn3)c2C)cc1 801894553 AZZVAGZGXDJQBK-UHFFFAOYSA-N 449.507 4.188 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc([C@@H]3COCCO3)n2CCc2ccccc2)cc1 802303326 DQVWAPXCFHFKHM-DEOSSOPVSA-N 449.599 4.091 10 10 IICE CC(C)Cn1c([C@@H]2Cc3ccccc3O2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802662372 OMWXIDZCIHZSMH-DEOSSOPVSA-N 447.583 4.083 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCOC3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802683044 CTECZVJJODPXAS-IRLDBZIGSA-N 435.572 4.004 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(C(F)(F)F)c2)n1C[C@H]1CCOC1 812409330 YBTZQOYTYWYOHU-OAHLLOKOSA-N 432.446 4.342 10 10 IICE C[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)c1nc(-c2cccs2)no1 914617079 ITOKGUBRSDUYDT-LLVKDONJSA-N 445.456 4.074 10 10 IICE COc1ccc2nc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)ccc2c1 918613576 VLKDJYRQWDEXIF-UHFFFAOYSA-N 445.441 4.029 10 10 IICE CC1(C)COc2c(C(=O)Nc3cccc(N(CC(N)=O)Cc4ccccc4)c3)cccc21 1125925183 LTALRMOBUMOYEI-UHFFFAOYSA-N 429.520 4.101 10 10 IICE O=C(CCCc1ccc(F)c(F)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127181958 QMHWMJALWLLINF-UHFFFAOYSA-N 427.539 4.136 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)COc1ccc(C(=O)c2ccccc2)cc1 1129815371 XAVQIJNCTGRVQL-HXUWFJFHSA-N 430.548 4.418 10 10 IICE O=C(CCC(=O)c1c(F)cccc1F)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137439879 IBJVLSKYASVJHB-MRXNPFEDSA-N 436.886 4.068 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(OCCC(C)C)c(OC)c3)CC2)cc1 1137658704 SOZBTHSVOORILH-UHFFFAOYSA-N 426.557 4.481 10 10 IICE COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc2cc(O)c(O)cc2s1 1138094961 GTQRFHURXUGKOZ-WMLDXEAASA-N 425.506 4.094 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)COc1cccc(I)c1 1139123005 AHHPYKFUEAWKJW-UHFFFAOYSA-N 439.293 4.205 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150347056 DLHHSZQTWVVEMU-QGZVFWFLSA-N 438.902 4.317 10 10 IICE Cc1cc(C(=O)N(C)CCCNC(=O)C2CCC2)c(C)n1-c1ccccc1Br 1154165560 GYVWNSXEVHGEQC-UHFFFAOYSA-N 446.389 4.235 10 10 IICE CO[C@@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1227208222 LVTGVANCURWKDO-KUHUBIRLSA-N 433.902 4.439 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3cccc(Br)c3C)C2)cc1 1252115936 NURDCXMGAPGOCF-KRWDZBQOSA-N 446.389 4.134 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3cccs3)Cc3cccs3)cc2)CC1 1254716627 QQUNBEKKNSYPBH-UHFFFAOYSA-N 440.638 4.473 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCCN(c4ccc(C)cc4)C3=O)ccc21 1265516879 NZNDBCUJCPXVFV-HSZRJFAPSA-N 433.552 4.138 10 10 IICE CCCN(CC)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)c(F)c1 1294500812 RXRVXIGEGRPPLF-UHFFFAOYSA-N 443.592 4.191 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCSC3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1304188297 BASMWHNIZHGMBR-GHTZIAJQSA-N 438.645 4.244 10 10 IICE CSc1ccc([C@H](CNC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)N(C)C)cc1 1312753595 OBIOXEALIBBONF-MBSDFSHPSA-N 428.646 4.316 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2ccsc2)cc1 1313681692 WBKBVFVDRZXSGJ-HXUWFJFHSA-N 425.602 4.374 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1C 1316261989 CSPAIJLNECSKBW-UYAOXDASSA-N 437.588 4.250 10 10 IICE O=C(CSc1ccccc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1356420367 GLTCKGUGJRADGI-UHFFFAOYSA-N 430.017 4.281 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C1C[C@@H]2CCC[C@H](C1)C2NC(=O)OC(C)(C)C 1360075379 AIFSGDDBCOATGR-UUVDZOIZSA-N 429.605 4.397 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N(Cc1ccoc1)C1CC1 1439650953 BJLHGAUKPSYIAW-WQRHYEAKSA-N 430.526 4.201 10 10 IICE O=C(C[C@H](c1ccccc1)c1ncc[nH]1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444983475 FETGHSSPEYFUAV-GHTZIAJQSA-N 440.494 4.318 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1 1445652072 HVXHWUKUNUGGCF-QGZVFWFLSA-N 445.357 4.255 10 10 IICE COc1ccc(N2CCN(C(=O)[C@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)CC2)cc1 1458044574 PVMRANXWNUDAQE-QHCPKHFHSA-N 448.485 4.012 10 10 IICE CC[C@](C)(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)cc1 1473708236 ZSTHRLREBHOQQY-SANMLTNESA-N 430.479 4.455 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@@H]1COC(=O)NC1CCCC1 1478841078 OYKHSCAMJPLPTM-AUSIDOKSSA-N 444.620 4.225 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3csc(COc4ccccc4)n3)CC2)cc1 1517328337 PJPQJNLTFIIHTC-UHFFFAOYSA-N 437.565 4.012 10 10 IICE Cn1cc(Nc2nnc(Cc3ccccc3F)n2CCCSc2nccs2)cn1 1517387991 OBIUVLGBPRENBD-UHFFFAOYSA-N 429.550 4.124 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]2C2CCC2)n1Cc1ccc(N(C)C)c(F)c1 1519297120 IQSACFNYOOBYQB-UTKZUKDTSA-N 445.583 4.024 10 10 IICE COc1cc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1C 1530398066 OBCDJEXUNXPVRO-UNOMPAQXSA-N 445.537 4.477 10 10 IICE COC(=O)C[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1cccc(C)c1 1532996945 ZHQGGRDVFUKUEH-QFIPXVFZSA-N 434.536 4.258 10 10 IICE Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)c1cc2cc(O)c(O)cc2s1 1542644703 OSMZWPAZKZKDRY-UHFFFAOYSA-N 428.535 4.062 10 10 IICE CC(C)c1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543756494 CBMOZTWKGZYZGF-UXHICEINSA-N 425.621 4.283 10 10 IICE CCOC(=O)[C@H](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)Cc1ccccc1 1544099885 PMDVYFCQCFQHPZ-QFIPXVFZSA-N 432.520 4.058 10 10 IICE COc1ccc([C@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C2CCC2)cc1 1564895777 ULJMCPUKCAOJTR-JOCHJYFZSA-N 445.510 4.151 10 10 IICE O=C(CSc1ccccc1Br)NCc1ccc(N2CCC(CO)CC2)cc1 1565986181 UANYYROEUPGFDP-UHFFFAOYSA-N 449.414 4.066 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Cl)ccc1Br 1566849579 MXCPMFPTPQMNQY-UHFFFAOYSA-N 447.112 4.277 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)c3ccccc3C2)c(C)n1-c1ccc(Cl)cc1 1567886509 JDYRZTUYNRIDEH-UHFFFAOYSA-N 428.941 4.177 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2nnc(-c3cccc(Br)c3)s2)cc1 1610888173 GPNNTQLDLKVTQM-UHFFFAOYSA-N 431.275 4.382 10 10 IICE COCc1ncsc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1618368418 GGEAHRQKCYAONR-UHFFFAOYSA-N 444.314 4.014 10 10 IICE C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1625146041 VJTLXIKNXQTJCI-QFIPXVFZSA-N 443.591 4.113 10 10 IICE CC(C)COc1ccc(C2(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)CCC2)cc1 1633789557 MSNRXKFIYHOEPU-UHFFFAOYSA-N 436.596 4.421 10 10 IICE CO[C@@](C)(CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1)COCc1ccccc1 1636813532 ALEIPCJQHWLPKI-VWLOTQADSA-N 425.573 4.050 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(C2SCCCS2)cc1 1638528952 BWWUTQYPMNWVML-UHFFFAOYSA-N 431.579 4.466 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1 1639341198 PKZROXZBBCYCJQ-SFHVURJKSA-N 441.531 4.223 10 10 IICE Cc1cc(C(=O)NCc2c(C3CC3)cnn2C)c(C)n1-c1ccc(Br)cc1 1640694802 ROHWLNQZFNLZPT-UHFFFAOYSA-N 427.346 4.398 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N(C)[C@H]1CCCC[C@H]1C 1640759334 PXCPHBYNXWFMPC-AEFFLSMTSA-N 429.586 4.470 10 10 IICE O=C(NCc1ccc(OCCOc2ccc(Cl)cc2)cc1)c1c(F)ccc(O)c1O 1648519041 YKNXLUYIODKHOS-UHFFFAOYSA-N 431.847 4.278 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C 1679890925 SNPNOIOEEITLBR-UZLBHIALSA-N 446.389 4.207 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3c(F)cccc3F)cc2Cl)C1 1680561293 BGURJWSLVAUAJM-VLIAUNLRSA-N 437.918 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1 1680689975 QDOSAUQDBQHNKL-BJLQDIEVSA-N 432.609 4.079 10 10 IICE CC[C@@H]1[C@@H](NC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CCN1C(=O)OC(C)(C)C 1682101505 RZINZFCEPBYZBT-DZFGPLHGSA-N 432.609 4.079 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2COc3cccc(Br)c3C2)C2CC2)cc1 1684911586 RRVMLEOHDOUEOA-INIZCTEOSA-N 444.373 4.193 10 10 IICE C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684970395 LXJSSWPXMHXOMN-QGZVFWFLSA-N 434.506 4.360 10 10 IICE CC[C@H](C)[C@H](Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1693970943 MYLONTYCGMIUCX-CVDCTZTESA-N 449.603 4.033 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCC[C@@H](C(F)F)C2)cc1 1710026325 DISTWABMHLOANR-MOPGFXCFSA-N 433.547 4.158 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@H]3C)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1751408809 OFWLYBQZGOEAER-IEBWSBKVSA-N 434.588 4.112 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@H](C)N(CC)C[C@H]2C)cc1 1766614659 OFOLKSORSRJCNQ-LEWJYISDSA-N 426.653 4.290 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CC1([S@@](C)=O)CC1 1768651473 OOGLYUIWFLIPRD-WJOKGBTCSA-N 443.661 4.014 10 10 IICE COC1(C)CN(c2nnc(-c3ccccc3Cl)n2CCCSc2nccs2)C1 1769739587 NRQJBDPPBVGLJX-UHFFFAOYSA-N 436.006 4.463 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@@H]2CCC[C@@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1769957224 WYPQZRKUYLCFFA-QWFCFKBJSA-N 447.599 4.270 10 10 IICE CN1CCN(c2ccc(N3C(=O)/C(=C\c4cc(Cl)ccc4O)SC3=S)cc2)CC1 1860085269 ADMSAJBTQRTTQS-CPNJWEJPSA-N 445.997 4.203 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3c(C)cccc3CC)C2)sc2c1CCC2 1865921281 AKILWVAFMSHVQN-MRXNPFEDSA-N 440.565 4.276 10 10 IICE CN(C)Cc1nn(Cc2cccc(C(F)(F)F)c2O)c(C(F)(F)F)c1Br 2079171845 DTFHNKDCQWYJLQ-UHFFFAOYSA-N 446.189 4.499 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@]2(NCc2ccc(Br)cc2O)C1 2126045738 GJMOXUNVQAAFTO-OALUTQOASA-N 429.330 4.126 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1ccc(Br)cc1I 2225793212 UIXRDEUJRPEICS-MNOVXSKESA-N 435.063 4.015 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H](C)C2)c1O 2236053844 ATEVMFXMJRFDRM-KBPBESRZSA-N 443.382 4.289 10 10 IICE COc1ccc(-n2cccc2C=C2C(=N)N3N=C(Cc4ccccc4)SC3=NC2=O)cc1 2297346830 KTLZIVWTJLVAPU-UHFFFAOYSA-N 441.516 4.348 10 10 IICE Cc1ccc(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2352636919 HRWCAYINKKJULI-AWEZNQCLSA-N 429.355 4.019 10 10 IICE CCOc1ccc(/C=C2\SC(=S)NC2=O)cc1OC(=O)c1ccc([N+](=O)[O-])c(C)c1 8445685 UEFWKPHBFXCLGQ-YVLHZVERSA-N 444.490 4.010 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc(Br)ccc1O)[C@H]1CC=C[C@H]21 14461214 NBWONPMIJBUYLO-ZJTDPSCFSA-N 443.341 4.357 10 10 IICE O=C(CN1C(=O)/C(=C/c2cccc(O)c2)SC1=S)Nc1ccccc1C(F)(F)F 15035696 RPFUIWYLPPIPOZ-DHDCSXOGSA-N 438.452 4.251 10 10 IICE CC(C)CN1C(=O)/C(=C\c2c(Oc3ccccc3)nc3ccccn3c2=O)SC1=S 33776476 KQIKEVGDVGWTQJ-SFQUDFHCSA-N 437.546 4.344 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2cccc(O)c2)SC1=S)Nc1ccc(O)cc1 210744242 CCNHAZBMFGWBGJ-XMHGGMMESA-N 442.562 4.498 10 10 IICE CCCNS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(OC)c(OC)c1)N2 226859807 GTEMQVYYVWFXHU-IEGUWTFLSA-N 428.554 4.219 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cnc(-c3cccc(O)c3)nc2)C1 444822884 NDCHVINWSCNTQC-UHFFFAOYSA-N 441.535 4.209 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc(F)c(CN(C)C)c1 745825268 FUJHZSVDFSUEIR-UHFFFAOYSA-N 438.341 4.087 10 10 IICE COc1cc(N2CCN(C(=O)[C@@H](Sc3ccccc3)C(C)C)CC2)cc(OC)c1OC 759221221 QANUOFRAWZBHDO-QHCPKHFHSA-N 444.597 4.178 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCc1ccc(C(F)F)cc1)c2[N+](=O)[O-] 765337195 OGHGIDYUIMRWRQ-UHFFFAOYSA-N 436.370 4.238 10 10 IICE CC(C)n1cc2cc(NC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)ccc2n1 768896176 YRMWMZSUARZGFV-UHFFFAOYSA-N 446.599 4.471 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCC[C@@H](Nc2ccccc2)C1 769032915 FWEWADSYVYGIGR-RUZDIDTESA-N 447.627 4.005 10 10 IICE Cc1cncc(/C=C\C(=O)N[C@H](C)CN(C(=O)/C=C\c2cncc(C)c2)c2ccccc2)c1 772127597 UPFJAMXEESRNNH-SVNORZHTSA-N 440.547 4.358 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 780326300 MOOBYDRWTUMYOZ-UHFFFAOYSA-N 429.492 4.197 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)c(C)n1-c1ccccc1 780817251 OMZFJCZGIIQYJQ-NRFANRHFSA-N 432.572 4.221 10 10 IICE CCOc1cc(CNC(=O)NCc2cc(Br)ccc2O)ccc1OC(F)F 804924989 YAMQVPRDXLOXRK-UHFFFAOYSA-N 445.260 4.154 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(C(=O)NC2CCCC2)cc1 806216269 WCSYVURIRVTHGD-UHFFFAOYSA-N 432.318 4.149 10 10 IICE C[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1cccc(C(=O)c2ccccc2)c1 1133123661 VIWKIPXNBDXTKM-NRFANRHFSA-N 441.575 4.089 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(NC(=O)C3CCCCC3)c2)N(C)C)cc1 1134882805 UZBVUXSRSLTJEV-XMMPIXPASA-N 436.600 4.304 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1136546788 XFPRPHQYENGJNW-UHFFFAOYSA-N 431.536 4.314 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082119 PLEAUEYTXOQFDG-RHSMWYFYSA-N 438.906 4.312 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 1144322312 OAPJNRADITYYIG-QZTJIDSGSA-N 444.651 4.114 10 10 IICE CCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)c1cc2ccccc2o1 1190528849 NBRSWAAEHZGUIW-NZQKXSOJSA-N 437.584 4.007 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCO[C@](C)(C(C)(C)C)C1 1289422571 AHIJFDPJLRYJIL-SANMLTNESA-N 448.615 4.404 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(CNC(=O)OC(C)(C)C)n(C)c1C 1292180882 RYVVARVMRHHUON-UHFFFAOYSA-N 428.577 4.087 10 10 IICE COc1cc(OC)c(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1C=O 1297010396 OLFFNLDHOHKIDE-OAHLLOKOSA-N 430.932 4.336 10 10 IICE CCOCc1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1297230187 SJJVIMBHZWCJBJ-NRFANRHFSA-N 429.634 4.041 10 10 IICE CCOC[C@@H]1CCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1297416822 YCIUHXLMQIRJKU-GGAORHGYSA-N 441.620 4.277 10 10 IICE CS(=O)(=O)N1CCC(SC2=NC(=O)/C(=C\c3csc4ccccc34)S2)CC1 1307351310 UBXSFHLNDATADJ-MHWRWJLKSA-N 438.621 4.029 10 10 IICE C[C@@H](Cc1ccccc1F)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1351274659 IVEPQNSINZAGBQ-ITRAFESCSA-N 446.544 4.304 10 10 IICE CC(C)Cc1nnc(N(C)[C@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1359777254 FHSVDDYVAKCUSJ-REWPJTCUSA-N 425.621 4.376 10 10 IICE O=C(COc1ccc2c(c1)CCCC2)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1435064278 JPGNLWQXUVWULK-UHFFFAOYSA-N 430.495 4.331 10 10 IICE COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1446862407 ANAGOSRGIUHGMV-UWJYYQICSA-N 448.361 4.103 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1459588879 SZLLSOJMJUYCHF-HKUYNNGSSA-N 425.960 4.246 10 10 IICE Cc1cc(CNC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)cc2)c(C)n1-c1ccccc1 1462080610 AOBXMQHGPPEFOG-UHFFFAOYSA-N 439.581 4.101 10 10 IICE CCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1469273653 PBIVREUEBSKZRO-RUZDIDTESA-N 429.564 4.414 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H](OC)c1cccc(OC)c1 1479024450 BKHIHYSMXJYMCT-IBGZPJMESA-N 437.334 4.083 10 10 IICE Cc1nnc(N2CCC(N(C)c3ccccc3)CC2)n1CCCSc1nccs1 1492806095 FGNXQYXPCQSQIQ-UHFFFAOYSA-N 428.631 4.331 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCS[C@@H](C)[C@@H]1C 1510684021 WGPYYSRARMUJGN-OALUTQOASA-N 436.629 4.017 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)CCS1 1514160044 AHBJHBFUWVPHHL-HZPDHXFCSA-N 439.676 4.143 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ncc(C(F)(F)F)cc3Cl)cc2F)C[C@@H](C)O1 1516811406 CJUMRGFQWLQZGU-VXGBXAGGSA-N 445.844 4.437 10 10 IICE Cc1ccccc1O[C@H](C)C(=O)N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 1521579288 MAVUVTKQVLIHCL-JOCHJYFZSA-N 445.563 4.154 10 10 IICE C[C@@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)CC(F)(F)F 1525651368 VYKWBRSYZZZHAI-KAQJVSAMSA-N 436.546 4.434 10 10 IICE Cn1cc(-c2ccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)cn1 1531502353 GLJFKJKRMGFKHN-LJQANCHMSA-N 426.467 4.087 10 10 IICE Cc1cc(CCNC(=O)CCCN2CCN(c3ccccc3)CC2)c(C)n1-c1ccccc1 1534241461 DPEOGDUXTAYSIS-UHFFFAOYSA-N 444.623 4.355 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](N3CCCCC3)C2)n1CCCSc1nccs1 1541449661 DBCQZWRSTUTYLP-SFHVURJKSA-N 434.679 4.180 10 10 IICE CCOc1ccc(Cl)cc1CCNC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1564381383 RBWSPLWOKIILOX-KRWDZBQOSA-N 431.964 4.116 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@H](COc4ccccc4Cl)C3)C2)cc1 1565055635 HSAHMMABFJJNFS-OALUTQOASA-N 443.975 4.428 10 10 IICE COc1ccc2ccccc2c1CCNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1565329685 YMARYYDVBZQFFN-XMMPIXPASA-N 434.584 4.059 10 10 IICE COc1cc2c(cc1NC(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)NC(=O)CC2 1567361761 MEDHXTDLCHNFEL-UHFFFAOYSA-N 431.492 4.361 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1 1619655928 BFJRGCLLZGKLSB-UHFFFAOYSA-N 429.870 4.374 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1620266091 WJPOLTXFEOOBRZ-GOSISDBHSA-N 449.640 4.078 10 10 IICE CCS[C@@H]1CCCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1621898753 WVSPAAWQLKYHBA-NVXWUHKLSA-N 440.612 4.049 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-n2cnc3ccccc32)cc1 1623928935 SGAFMFMSHLTDMG-UHFFFAOYSA-N 449.894 4.200 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c1 1624771890 QBMIDEDWGZSQIX-UHFFFAOYSA-N 443.503 4.198 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc4cc(Cl)ccc4s3)CC2)cc1 1625951728 MOVUKTODAUYIAU-UHFFFAOYSA-N 429.973 4.115 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1627073484 PEXMUQVEFWIGMA-JOCHJYFZSA-N 430.426 4.225 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(C2CCCC2)[nH]n1 1628620495 HOAHYOVGKINQDO-BOPFTXTBSA-N 444.557 4.436 10 10 IICE CN(C)c1ccc(CNC(=O)c2csc(C3CCN(C(=O)OC(C)(C)C)CC3)n2)cc1 1628708603 OTEBGMRGOSLOHP-UHFFFAOYSA-N 444.601 4.254 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCOC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1632484255 DUNCTYZCDYVHAV-UHFFFAOYSA-N 431.492 4.102 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)cc1 1634967317 PFINZYUCYHYFLO-VWLOTQADSA-N 438.568 4.026 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)NCc1cccc(Br)c1O 1637517191 ZQIMGBYEUZUZAS-MRXNPFEDSA-N 430.346 4.467 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@H]3[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]43)c2C)cc1 1648124386 SMAPZYOQIWHZLB-ZBYYUNFXSA-N 439.556 4.040 10 10 IICE COC(=O)c1cnc(S[C@H](C)C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)s1 1652002997 ZWGGUOGKPQWSJA-GFCCVEGCSA-N 434.539 4.481 10 10 IICE COc1ccccc1-n1nnnc1SCC(=O)c1cc(C)n(-c2ccccc2C)c1C 1652485408 GLWXUKVKXYMHSH-UHFFFAOYSA-N 433.537 4.362 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3cc(F)ccc3F)cc2Cl)C1 1672137998 ZYYKKOCTJSFSRP-JLTOFOAXSA-N 437.918 4.387 10 10 IICE C[C@@H]1CC[C@@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CN1C(=O)OC(C)(C)C 1687248881 ONKCJQXTXBUPRR-UYAOXDASSA-N 430.593 4.216 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1692445944 WDISPWZBEVFCSY-QFIPXVFZSA-N 443.661 4.254 10 10 IICE CC/C=C\Cn1c(-c2cccc(C)n2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1694986359 CYCGHWSTUBJVPI-WAYWQWQTSA-N 436.535 4.089 10 10 IICE CCC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1695156004 POFPMTVVCQDSQA-SJORKVTESA-N 437.635 4.164 10 10 IICE COCCN(CC(C)C)c1nnc([C@H]2CCCCO2)n1Cc1ccc2c(c1)CCCN2C 1698047019 DHZACBISIXHOIS-HSZRJFAPSA-N 441.620 4.059 10 10 IICE CSCCCN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc2c(c1)CCCN2C 1698426232 GJNHWLZEIUDEPE-NRFANRHFSA-N 429.634 4.140 10 10 IICE COCCO[C@H](C)c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1712508370 NNWJFSJKAMMVKF-QGZVFWFLSA-N 433.572 4.024 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@@H](C)N(CC)C[C@H]2C)cc1 1746089806 HQWBOGGNHAFOAP-NHCUHLMSSA-N 447.631 4.154 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)[C@@H](C)c2ccco2)cc1 1746089890 IWFUZIBJFIKBHO-SFHVURJKSA-N 433.560 4.364 10 10 IICE CC(C)CN1CCC[C@@H](Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1761116836 OQCJRWSUBIBAFF-OFNKIYASSA-N 441.620 4.230 10 10 IICE CCc1ccc(-c2nnc(N3CCOC[C@@H]3C)n2CCCSc2nccs2)cc1 1762607273 RKINSBIVQICYOT-INIZCTEOSA-N 429.615 4.372 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1763957379 JRKYZTGESXLSFY-JOCHJYFZSA-N 434.588 4.240 10 10 IICE CCC(=O)N1CCC[C@H](C(=O)Nc2sc(C)c(-c3ccc(C)cc3)c2C(=O)OC)C1 1860646870 UHLDJCGEMJONDA-KRWDZBQOSA-N 428.554 4.406 10 10 IICE CCCCOCCCNC(=O)C(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OCC 1860759916 LQGPDDGSDVHAJN-UHFFFAOYSA-N 446.569 4.162 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CCCN2)sc(C)c1-c1ccc(Br)cc1 1866099559 UOFPIYLFGTUSGU-AWEZNQCLSA-N 437.359 4.353 10 10 IICE Cc1ccc2oc(=O)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc2c1 1866291538 DXFXAKVIVXHGRT-HSZRJFAPSA-N 433.552 4.124 10 10 IICE COc1cccc(Cn2nc(C(C)(C)C)c(C(F)F)c2I)c1O 2079770488 SJHWDVRXQMDKFJ-UHFFFAOYSA-N 436.240 4.485 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H](NCc3cc(Br)cc(F)c3O)[C@H]1CC2 2229835681 HYKDVYMRHKWYJP-CWRNSKLLSA-N 429.330 4.314 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]3CC[C@H]32)c1O 2236048105 YCDHLAUOJXBAEV-MAZHCROVSA-N 441.366 4.041 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(N(C)C)cc4)c3C)C2=O)cc1 2294130780 HFALODXCRSOKPJ-UHFFFAOYSA-N 442.519 4.135 10 10 IICE NC(=O)C1CCN(C2=NC(=O)C(=Cc3ccc(-c4cccc(C(F)(F)F)c4)o3)S2)CC1 2296706838 YSVKVJZPIOBMKV-UHFFFAOYSA-N 449.454 4.133 10 10 IICE CCCN1C(=O)C(=C2SC(=S)N(C(C)C)C2=O)c2cc(Br)ccc21 2296711399 WRSRNZPGHFNNOW-UHFFFAOYSA-N 425.373 4.186 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1cccc(Br)c1 2297338442 DUFCNBNKLMOAST-UHFFFAOYSA-N 440.080 4.422 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(c2ccccc2OC)C1=O)C(=O)O 2314931904 JBWSXMHFBLOBMQ-HNNXBMFYSA-N 429.519 4.343 10 10 IICE CCN(CC)Cc1ccc(C=C2SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1 2321683148 CFLFVQAACNGNGF-UHFFFAOYSA-N 442.562 4.338 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccc(OC)cc3)SC2=S)cc1 15047386 JLQXZZVZEAANIF-RMENWYJGSA-N 442.562 4.322 10 10 IICE CCN1C(=O)/C(=C2/SC(N(C)c3ccc(Cl)cc3)=NC2=O)c2cc([N+](=O)[O-])ccc21 96557079 GXNNCQUHUOPEIN-WUKNDPDISA-N 442.884 4.092 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccc(O)cc3C)=NC2=O)ccc1OCCC(=O)O 210469627 WLPFKQIXHQLAQU-UNOMPAQXSA-N 442.493 4.035 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 226738778 NBKUNXBYLPWQOX-WOIUINJBSA-N 427.526 4.452 10 10 IICE CC(C)NS(=O)(=O)c1cc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)n(C)c1 254737132 ZXTMLJYOAZFNOM-UHFFFAOYSA-N 425.514 4.380 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CCNCc1cc(Br)cc(F)c1O 721107019 XTGAWQOYVAHKRR-OLZOCXBDSA-N 431.346 4.277 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 743718650 IMRYTWYBWYNRLI-MRXNPFEDSA-N 433.474 4.218 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2cn(C)nc2C(F)(F)F)cc1 749223332 QQHDZBSLEDKTGV-UHFFFAOYSA-N 435.450 4.010 10 10 IICE C[C@H](Cc1ccc(O)cc1)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754643900 YVAILXYCFZCKTN-MRXNPFEDSA-N 433.499 4.235 10 10 IICE O=S(=O)(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(F)cccc1Cl 766481634 HTMPQYPTNKWKGP-UHFFFAOYSA-N 434.867 4.028 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1 770153081 DMDUGGKRACDSJX-HNNXBMFYSA-N 435.337 4.235 10 10 IICE COc1ccc([C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1NC(C)=O 773145557 JTGXKSUBAREIMM-LJQANCHMSA-N 436.600 4.036 10 10 IICE COc1ccc(N2CCC(NC(=O)C3(c4ccccc4Br)CC3)CC2)cc1 788785230 XVNGQAZKBKWHRV-UHFFFAOYSA-N 429.358 4.275 10 10 IICE CCn1c(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nc2cc(Br)ccc21 790501931 KYMBRMVPOWUMIL-AWEZNQCLSA-N 444.377 4.445 10 10 IICE O=C(Cc1c[nH]c2cc(Br)ccc12)NCc1cc(Br)ccc1O 804736957 GNBOXCGGHHNLDX-UHFFFAOYSA-N 438.119 4.257 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)nc1 1125877799 NGLRGODMSTVLDX-UHFFFAOYSA-N 447.482 4.037 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3oc4ccccc4c3Br)C2)cc1 1129992889 AKMOZFCLLRQGSZ-CQSZACIVSA-N 429.314 4.460 10 10 IICE COc1ccc(N2CCN(C(=O)CCCn3ccc4cc(Cl)ccc43)CC2)c(OC)c1 1131804471 LEMXEALGBNOWQC-UHFFFAOYSA-N 441.959 4.441 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(OC)cc1 1165498559 NYBVEPZJYGZMHN-OFNKIYASSA-N 444.959 4.450 10 10 IICE Cc1cc2nnc(SCC(=O)c3cc(C)n(-c4ccc(Cl)cn4)c3C)n2c(C)n1 1188620124 CYFNLBSRKCTCPV-UHFFFAOYSA-N 426.933 4.172 10 10 IICE CCC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1192858455 LFLSOUIPUGYPHD-YYDVJCTNSA-N 427.564 4.187 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@@H]3CCCC[C@@H]3c3ccccc3)cc2)CC1 1251102676 XPTPTQIBYKZAKU-UKILVPOCSA-N 448.611 4.162 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C(=O)/C=C\c1cnc3ccccc3n1)CCO2 1287849511 KHWCCTHHZDFJEP-LUAWRHEFSA-N 446.507 4.093 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)[C@@H](C)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1289356718 WUXFGZSTKDPPPY-FQEVSTJZSA-N 448.615 4.456 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCCN(C(C)C)CC1 1289426576 NUPHTMAMKMQAIE-UHFFFAOYSA-N 438.664 4.354 10 10 IICE CCCc1ccc(C(=O)CCC(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1 1295591192 WXQFRWRKGPTDKZ-UHFFFAOYSA-N 431.916 4.163 10 10 IICE Cc1cc(C(=O)N2CCN3C(=O)N(CC(C)C)C[C@H]3C2)c(C)n1-c1ccc(C(C)C)cc1 1297400330 IUKJHPNSSDKTJH-HSZRJFAPSA-N 436.600 4.436 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1312741740 UOHJWEGGSWNYTA-MSOLQXFVSA-N 428.577 4.238 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 1312883992 GAPCTJIJFUIEQU-YLJYHZDGSA-N 441.538 4.383 10 10 IICE Cc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(C)c1 1349962500 REPHYBBPBZGWCZ-UNOMPAQXSA-N 428.554 4.350 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CC[C@@H](OCC(C)C)C1 1361096216 XGGAGXUWNZXPRY-HSZRJFAPSA-N 434.588 4.014 10 10 IICE O=C(CO[C@@H]1CCCc2ccccc21)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333544 RRDCQIXEDFSUFW-XMSQKQJNSA-N 430.495 4.467 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(C)n1-c1ccccc1 1438180116 UZKPOUSFWIGRHE-UGKGYDQZSA-N 425.573 4.398 10 10 IICE O=C(Nc1ccc(Cl)c(F)c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1441567100 XTCCHDSDBFJRHN-UHFFFAOYSA-N 426.878 4.299 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1 1449114953 APKYTQCXUKCGRY-LJQANCHMSA-N 447.531 4.118 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2(C3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 1452840608 WCWZADIEGYZIOI-UHFFFAOYSA-N 445.604 4.017 10 10 IICE Cc1cc(C(=O)N2c3ccccc3C[C@H]2CO)c(C)n1-c1ccc(Br)cc1 1453133878 QQVZHAMYKLHBKB-IBGZPJMESA-N 425.326 4.420 10 10 IICE CCC1(CC)C(=O)N(C)C(=O)N(CC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1=O 1459099823 KRJWQPRPSWZSIM-UHFFFAOYSA-N 437.540 4.121 10 10 IICE CC(C)Cc1ncc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1459739046 FRDGCRBVRPKYGY-YVLHZVERSA-N 444.557 4.044 10 10 IICE CCN(CC)C(=O)OC[C@H]1CCCCN1C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1459855686 MAEZKAHIPNLWKK-HSZRJFAPSA-N 425.573 4.496 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](O)c1ccc(C(F)(F)F)cc1 1465850116 AWCJPLWBHUXCDB-INIZCTEOSA-N 432.236 4.256 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C/C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)o1 1466290467 XTRUBZBOBUYKLK-XSSIKURBSA-N 427.497 4.162 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1 1517165420 DNKDPJQLGVZSHX-HSZRJFAPSA-N 437.490 4.293 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCc3cccnc3)CC2)cc1 1518307789 HNVPVRGKKGOSFY-UHFFFAOYSA-N 448.615 4.230 10 10 IICE Cc1cc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C3CC3)cc2)c(C)n1-c1ccccc1 1528912532 HNAUZUVAZIBWBV-UHFFFAOYSA-N 437.565 4.058 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@H]1CCC2(CCCC2)O1 1530756382 QFKDSHVPVWESIJ-CLEQQJOVSA-N 448.585 4.025 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)N(C)C)cc1 1537482294 CTUABMDBSWEDHS-LJQANCHMSA-N 430.524 4.187 10 10 IICE Cc1ncsc1CN(C)c1nnc(-c2ccc[nH]2)n1CCCSc1nccs1 1542081321 LZCUOQGWVMXPCA-UHFFFAOYSA-N 431.616 4.313 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cc(Cl)c3O)cc2F)C[C@@H](C)O1 1542113300 UEILTRZNJZYFIR-VXGBXAGGSA-N 427.303 4.382 10 10 IICE Cc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccc(Br)cn1 1543358996 RKIFERONXANFML-UHFFFAOYSA-N 429.274 4.090 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1547444188 LKMRDGFBBWSCJO-AUSIDOKSSA-N 436.604 4.039 10 10 IICE Cc1cc(C(=O)Nc2ccc(OCCO)cc2)c(C)n1-c1cccc(Br)c1 1566355610 DGMGHTJEDSTHHC-UHFFFAOYSA-N 429.314 4.480 10 10 IICE COC(=O)[C@@H](Cc1cncs1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1583832249 NRHMIQGOJAYASJ-HXUWFJFHSA-N 437.525 4.139 10 10 IICE Cc1cc(C(=O)N2CCN(C)C[C@H]2CC(C)C)c(C)n1-c1ccc(Br)cn1 1597372273 QNSZKJBKOZDQBQ-GOSISDBHSA-N 433.394 4.054 10 10 IICE COc1cccc(-c2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)n(C)n2)c1 1624346134 WKPXDHRBNAASRU-UHFFFAOYSA-N 442.519 4.497 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](c2ccccc2F)c2nccn2C)cc1 1624936720 BYQLPAGFXNNZPM-VWLOTQADSA-N 444.510 4.228 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc2c(c1)OCCN(C(=O)OC(C)(C)C)C2 1627688584 DSSGKUUENFNTLI-UHFFFAOYSA-N 439.556 4.121 10 10 IICE CN(C)c1ccc(CN(C(=O)/C=C/[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc1 1629697435 HFHSYSBZLARPLJ-XATQLNLPSA-N 427.589 4.447 10 10 IICE Cc1sc(=O)n(CC(=O)N(Cc2ccco2)Cc2ccccc2O)c1-c1ccccc1 1629943582 GXMQRJCYTMWSAY-UHFFFAOYSA-N 434.517 4.413 10 10 IICE O=C(NCc1ccc(O)c(O)c1)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1 1631434450 SNERUQJICIDJIH-UHFFFAOYSA-N 442.397 4.023 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nc(-c3ccncc3)cs2)cc1 1632107546 KXKUYPOTCDKBMO-UHFFFAOYSA-N 430.533 4.284 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(c4cccc(Cl)c4)C3=O)c2C)cc1 1634955897 QPKVAHSTAGXSDE-JOCHJYFZSA-N 437.927 4.291 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCOc2ncccc2C(F)(F)F)cc1 1636623842 RITFKRHWUUWNMH-UHFFFAOYSA-N 445.441 4.058 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCO[C@H](C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1637018437 VAEBHYDFBCEELH-LPHOPBHVSA-N 434.378 4.433 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)CSc1ccc(F)cc1 1637247935 VWDZRDFLZYKFLK-CYBMUJFWSA-N 425.909 4.115 10 10 IICE CCC[C@H](C)C(=O)NCCNC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1641225115 ALXMMODBKBMAKV-AWEZNQCLSA-N 434.378 4.139 10 10 IICE COc1ccc(N2CCN(CCCN3CCC(Cc4ccccc4)CC3)CC2)cc1F 1644919601 TUHVMCKTNKGYDP-UHFFFAOYSA-N 425.592 4.301 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@H](c3cccs3)n3cccc3)cc2F)CC1 1648544765 BQWDIQFLQKVGEQ-JOCHJYFZSA-N 440.588 4.127 10 10 IICE Cc1sc(CNC(=O)OC(C)(C)C)nc1C(=O)NCc1c(O)ccc2ccccc12 1652708802 NILMGIRIZMUKLA-UHFFFAOYSA-N 427.526 4.265 10 10 IICE CC(C)C[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1653919482 ZWFDKKHAYXUQKT-ROKPMTFOSA-N 441.591 4.433 10 10 IICE Cc1cc(CNC(=O)N[C@H](CO)c2ccc(Br)cc2)c(C)n1-c1ccccc1 1675116060 YEINROCERFHBPZ-OAQYLSRUSA-N 442.357 4.389 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)n1 1684478523 ACCNGSBZVCMICR-OAQYLSRUSA-N 445.567 4.358 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(F)F 1696509775 SJHYUNXPWVZQJM-HKBQPEDESA-N 449.571 4.213 10 10 IICE CCOC(C)(C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1710392269 XVIODEQISWUFBA-UHFFFAOYSA-N 441.620 4.224 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCN(C(C)=O)C1 1728270622 GXDKHMGTLPXELP-NRFANRHFSA-N 434.588 4.067 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2cc(C)on2)cc1 1746094182 SANUHIZECGEDON-UHFFFAOYSA-N 445.571 4.091 10 10 IICE CN(CC1CCOCC1)c1nnc(-c2ccccc2)n1CCCSc1nccs1 1747867965 PNCISWABRWODCT-UHFFFAOYSA-N 429.615 4.447 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@@H]3CCCCS3)CC2)cc1F 1748849435 QFGNKRJRMZJXAM-SFHVURJKSA-N 433.597 4.162 10 10 IICE COCCC(C)(C)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1749587791 BBTLOHSSDDPROR-UHFFFAOYSA-N 429.952 4.398 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1(N2CCSCC2)CCCC1 1763507546 SLILWTYJACDISL-IBGZPJMESA-N 443.661 4.495 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCCCCCO)CC2)cc1 1770257542 DECKCVKCYTUPKG-UHFFFAOYSA-N 443.636 4.145 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(-c5cccc(OC)c5)[nH]c4c3)CC2)cc1 1861868079 OYFWLAIPJDJERZ-UHFFFAOYSA-N 442.519 4.210 10 10 IICE Nc1ccc(Cc2ccc(NC(=O)c3nn(-c4ccc(Cl)cc4)c(=O)cc3O)cc2)cc1 1866269534 PQDJIWGERBZZSS-UHFFFAOYSA-N 446.894 4.017 10 10 IICE CN(Cc1ccccc1I)c1ccc(CN)cc1Br 2265607282 KBGSRCWRYDFQJR-UHFFFAOYSA-N 431.115 4.149 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2ccc(OCc3ccc(F)cc3)c(Br)c2)S1 2293618319 KODFSBJCSWBVOF-UHFFFAOYSA-N 449.301 4.274 10 10 IICE COc1ccc(CN2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)cc1 2296169354 HFIQDXJJSSSJSU-UHFFFAOYSA-N 443.503 4.073 10 10 IICE NCCc1cnc(Sc2cc(I)ccc2Br)s1 2300841121 BKSJWDXSTYFCBG-UHFFFAOYSA-N 441.157 4.163 10 10 IICE CCNc1cc(N2CCN(C(=O)c3ccco3)CC2)c2noc3c2c1C(=O)c1ccccc1-3 9641853 YIDLIHSGDDJNEP-UHFFFAOYSA-N 442.475 4.026 10 10 IICE Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C)C3=O)c(N[C@H](C)c3ccccc3)nc12 33721260 ZMLFJDIBEMEMGQ-RFRKOGIWSA-N 436.562 4.007 10 10 IICE OCCN1CCN([C@@H]2Cc3ccc(F)cc3Sc3ccc(C(F)(F)F)cc32)CC1 33874627 JRWBLUYTPUBWAF-GOSISDBHSA-N 426.479 4.203 10 10 IICE CCOC(=O)c1ccc2c(c1)N(CC)/C(=C/C=C1\SC(=S)N(CC)C1=O)N2CC 101481978 YROPMQKTDXTVGR-MJZABRMRSA-N 431.583 4.135 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(C(C)=O)c3)[C@H]2c2ccc(O)c(O)c2)cc1 526432820 HCDSGGBPSPRHEJ-QHCPKHFHSA-N 431.444 4.366 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)c2sccc2-n2c(C)ccc2C)C1 742137467 BYOYGPZOWAUMNO-INIZCTEOSA-N 441.519 4.419 10 10 IICE CCOCCOc1ccccc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742797791 GQMOWWGNVPHAPC-QGZVFWFLSA-N 434.483 4.102 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 753102586 GHADIBRGLJUUAE-OAQYLSRUSA-N 430.556 4.161 10 10 IICE O=C(Cc1coc(-c2ccc(F)cc2)n1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 754551603 IZUYNILYZPXMCG-UHFFFAOYSA-N 426.403 4.437 10 10 IICE C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(Br)ccc1O 756476188 OOBJERIYZZDTKS-MRXNPFEDSA-N 431.374 4.429 10 10 IICE Cc1cc(Cl)cc(CN2CCN(CC(=O)Nc3ccccc3C(F)(F)F)CC2)c1O 775646751 NUFQIKMXLZCQPM-UHFFFAOYSA-N 441.881 4.129 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3c(F)cccc3F)C(F)(F)F)CC2)cc1 776016130 DLHZHXFTGWPGAE-GOSISDBHSA-N 429.389 4.109 10 10 IICE CCOc1cccc(CNC(=O)NCc2cc(Br)ccc2O)c1OC(F)F 805196792 NGYRJYWGYPUVHT-UHFFFAOYSA-N 445.260 4.154 10 10 IICE CN(C)c1ccc(CNc2ccc(S(=O)(=O)NC(C)(C)C)cc2)c(C(F)(F)F)c1 864015500 FJSFQIKJDPBGIR-UHFFFAOYSA-N 429.508 4.460 10 10 IICE CCN1C(=O)/C(=C\c2cn(Cc3c(F)cccc3Cl)c3ccccc23)C(=O)NC1=S 1084100440 IBZQJWVXJDTTOY-GDNBJRDFSA-N 441.915 4.129 10 10 IICE CCN(Cc1ccc(OC)cc1OC)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1124958979 SWCPNEKKEMBRHN-UHFFFAOYSA-N 449.595 4.474 10 10 IICE C=Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1129246112 LDZQGTFRXLEWMW-HKWRFOASSA-N 440.565 4.419 10 10 IICE C[C@@H](SCC(=O)c1ccccc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1189640972 KVZIFTGMRCOFDV-OAHLLOKOSA-N 429.497 4.405 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(=O)N(C)c4ccccc4C3)cc2Cl)C1 1227207677 ICIJZYGHIFOPSG-QGZVFWFLSA-N 440.975 4.265 10 10 IICE Cc1cc(CNC(=O)N2CC[C@H](N(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1234325398 DHEUFJCWKYBHED-NRFANRHFSA-N 426.561 4.245 10 10 IICE COc1ccccc1COC1CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251981457 MIPPMPMYYWEAEY-HXUWFJFHSA-N 439.600 4.391 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3c(-c4c(F)cccc4Cl)noc3C)C2)cc1 1278861796 OGGFWFSUTUYUPT-AWEZNQCLSA-N 429.879 4.460 10 10 IICE CCc1nnc(N2CCC(Oc3cc(C)ccn3)CC2)n1Cc1ccc(N(C)C)cc1C 1292989911 KXEJSZHVPSGXJM-UHFFFAOYSA-N 434.588 4.014 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cnn(Cc2ccccc2)c1Br 1294869868 OQSJUMNKPLWHFX-UHFFFAOYSA-N 440.341 4.208 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCC[C@](C)(OC)C2)cc1 1295414826 LNDRVGLNQYJSCN-BWKNWUBXSA-N 441.620 4.072 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCC[C@H](COC)C2)cc1 1295418175 BMXPHBWGENQGNF-QHCPKHFHSA-N 448.615 4.021 10 10 IICE CC1(c2ccccc2)CC(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1297176737 FVRAUFIBNMODNM-UHFFFAOYSA-N 442.562 4.105 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1CCCCCN1CCCCC1 1298364175 UPRRXVHXDCYCCO-UHFFFAOYSA-N 434.588 4.338 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CC(C)(C)OC)CC2)cc1 1300247784 PPDURCGUTDNZJL-UHFFFAOYSA-N 429.609 4.017 10 10 IICE C[C@@H](c1cccs1)N(C)c1nnc([C@H]2CCC(=O)N2)n1CCCSc1nccs1 1303623447 VXNLFQQTKLELCL-UONOGXRCSA-N 448.643 4.127 10 10 IICE CC(=O)NCCN(Cc1ccc(Cl)cc1Cl)Cc1cc(F)cc(C(C)=O)c1O 1307721646 LVAZZZYNBMGNAT-UHFFFAOYSA-N 427.303 4.179 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CCCC(F)(F)F)CC2)cc1F 1315512046 HHPGXYNPWITZMN-UHFFFAOYSA-N 443.489 4.293 10 10 IICE C[C@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1357836535 XDAXIMZSNUJVBW-XMSQKQJNSA-N 447.348 4.019 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C(N)=O)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1361049565 IVZVYXZOWMSPEJ-NRFANRHFSA-N 448.615 4.491 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCSC3(CCOCC3)C2)nnc1C(C)(C)C 1361098085 NMGHIANOFBPNDD-UHFFFAOYSA-N 443.661 4.101 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(-c3ccc(C=O)o3)cc2O)cc1 1442612222 JZUKZIFBFGHOMT-OAQYLSRUSA-N 448.519 4.352 10 10 IICE Cc1ccc(C(=O)N2CCN([C@@H](C)c3cccnc3)CC2)cc1-n1c(C)cc(C=O)c1C 1465311080 FSFXOVOHKGBOSC-FQEVSTJZSA-N 430.552 4.129 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)cc1 1466932559 XVILKNUDMNKTKP-UGKGYDQZSA-N 436.474 4.049 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CC[C@@H](N3CCN(C)CC3)CC2)c1 1467345016 WFGOVMQSZXTKDV-BGYRXZFFSA-N 429.008 4.036 10 10 IICE CCOC(=O)c1n[nH]c([C@H](CC(C)C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)n1 1467593812 FXNHPMPAGRGGDO-IBGZPJMESA-N 437.544 4.215 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1467945317 MEHAENMEUCVVFC-IBGZPJMESA-N 428.964 4.158 10 10 IICE CCOc1ccc(N2C(=O)c3ccc(C(=O)N[C@H](C)c4ccccc4O)cc3C2=O)cc1 1471194124 OQDLCOUJHRLZMU-OAHLLOKOSA-N 430.460 4.083 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)C2CCC(C)CC2)cc1 1501831506 XGVVEYYPKDLNSG-UHFFFAOYSA-N 440.636 4.326 10 10 IICE Cc1cc(F)ccc1CCNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1517250723 MQMCAHYNWPLIGY-UYRXBGFRSA-N 446.544 4.223 10 10 IICE CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1524246252 XMZZVMPCEWYQIU-UYAOXDASSA-N 449.039 4.270 10 10 IICE CC(C)(C)OC(=O)c1cccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1526015243 JXUJYTIKMRNCGD-UHFFFAOYSA-N 449.595 4.104 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H]1c1ccc(Cl)c(F)c1 1528620036 QFBQFSVVNWBXQD-OPAMFIHVSA-N 449.929 4.299 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 1529082757 FLNGJARMFVLZMJ-DHIUTWEWSA-N 434.609 4.050 10 10 IICE CSc1cccc(N2C[C@@H](C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CC2=O)c1 1539336454 JUSAMSZJHDNOJV-FQEVSTJZSA-N 437.609 4.410 10 10 IICE CC(C)c1csc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)n1 1541316128 RBEAKUULUHXEFL-UHFFFAOYSA-N 434.569 4.234 10 10 IICE CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1544346918 ARDCGIDBEBIBOH-KRWDZBQOSA-N 431.536 4.365 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)CCCC1 1556221732 KIKSOLVEYFOQHH-QRQCRPRQSA-N 438.490 4.129 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC3(c4cccc(F)c4F)CCCC3)C2)cc1 1564559220 MIASBYGXOHEZKP-QGZVFWFLSA-N 429.511 4.363 10 10 IICE Cc1cc(CCNC(=O)NC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)c(C)n1-c1ccccc1 1565162095 LSHJDDCQJDBXNL-AOYPEHQESA-N 435.543 4.241 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1565426793 FAASQPZAKVMJKR-KDURUIRLSA-N 442.560 4.113 10 10 IICE CC[C@@H](O)CN(Cc1ccccc1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1566545476 HYAUKDQZWKUQTD-JOCHJYFZSA-N 433.596 4.208 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1595435979 OBDWRCDGMBFTJV-INIZCTEOSA-N 432.351 4.263 10 10 IICE CC[C@@H](C)CN(CC)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1613397328 TYLRXSFMOGBSCI-TZIWHRDSSA-N 443.661 4.256 10 10 IICE Brc1cncc(Br)c1CNCc1ccc(N2CCCC2)cc1 1620943244 OWYUWFZEFIHFJJ-UHFFFAOYSA-N 425.168 4.497 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H](C(C)C)n3nnc(-c4ccccc4)n3)cc2)CC1 1627468652 ZIRFEQJFIUYPLW-HSZRJFAPSA-N 432.572 4.090 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1 1629244509 BVFBDSGGAGHXPX-QHCPKHFHSA-N 449.938 4.024 10 10 IICE O=C(CCc1ccc(F)c2c1CCCC2)NCc1ccc(N2CCC(O)CC2)c(F)c1 1629963834 QPPBTUPTCQAWPR-UHFFFAOYSA-N 428.523 4.054 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c(C)n1-c1ccc(F)cc1 1631736601 IXNGUYCNQCFTJQ-JOCHJYFZSA-N 433.527 4.197 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1 1634624628 MEYGTSSGMCOMOS-XMMPIXPASA-N 446.551 4.404 10 10 IICE CCN(C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)[C@H](C)Cc1ccc(OC)cc1 1636353625 FJZXPTZPLADYMB-TZIWHRDSSA-N 425.573 4.193 10 10 IICE Cc1cc(CN2Cc3ccccc3C[C@@H]2C(=O)NCCc2ccc(F)cc2)ccc1N(C)C 1644337766 BHCAXTLCSLFYRQ-HHHXNRCGSA-N 445.582 4.486 10 10 IICE Cc1cc(C(=O)NC2CC3(COC(C)(C)C3)C2)c(C)n1-c1ccc(Br)cn1 1646436816 MKFNZSWIRMQYPT-UHFFFAOYSA-N 432.362 4.329 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)CNC(=O)c4ccccn4)n3)c2C)cc1 1650661367 VSQICHRDGFUQRW-UHFFFAOYSA-N 445.548 4.290 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NC(C)C)c1ccc(OC)cc1 1654370001 RJAFFXXALSFHGF-FQEVSTJZSA-N 435.362 4.251 10 10 IICE C[C@@H](CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(C(F)(F)F)cc1 1681444811 LDTFHJILSLNBPY-KRWDZBQOSA-N 434.506 4.060 10 10 IICE C[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cc(Cl)cc2c1OCC2 1684345149 LNSXKLPVPWUNIP-INIZCTEOSA-N 429.948 4.014 10 10 IICE CC1CCN(C(=O)OC[C@H]2CCCCN2C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 1686173177 DDBLZOGZGBKEPX-SIKLNZKXSA-N 430.593 4.246 10 10 IICE CC(C)Cc1nnc(N(C)C[C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1692089407 ZHJISUKUWKCIPU-QFIPXVFZSA-N 443.661 4.083 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCO[C@@H](C)C1 1693995501 HSHKWJXQQCIZRC-ONTIZHBOSA-N 441.620 4.080 10 10 IICE CN(Cc1ccon1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1696730959 KWXMLTJYOPBZOT-UHFFFAOYSA-N 440.617 4.093 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709484706 IDDBYOZBBFLXTN-HXUWFJFHSA-N 448.615 4.222 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2c(C)noc2C)cc1 1710026174 ZWZAOBZRXXVOOU-UHFFFAOYSA-N 433.560 4.409 10 10 IICE COC[C@H]1CCCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1730547509 UIIYKIBCILDONV-NZQKXSOJSA-N 441.620 4.195 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1N(C)CCCC1(C)C 1730963579 BQAHQJKHPFYOIV-QFIPXVFZSA-N 436.604 4.471 10 10 IICE CCC(CC)[C@H](Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N(C)C 1743993159 HZIDMZWCHHQLKJ-UNMCSNQZSA-N 429.609 4.228 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cccnc1OCC(F)(F)F 1760897002 SILSLGVNEGZDRO-UHFFFAOYSA-N 435.450 4.128 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 1765237241 KQPAYSJTUBHPDQ-SJLPKXTDSA-N 427.524 4.104 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1765523424 MMVPSCZRUVCWNI-DENIHFKCSA-N 427.593 4.029 10 10 IICE CN(C[C@H]1CCCCO1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1767218301 VNEBZGKVSYVUOJ-OAQYLSRUSA-N 443.661 4.182 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1771446856 YYXHFGBNGDBWSL-JKSUJKDBSA-N 439.676 4.143 10 10 IICE CC(C)(C)OC(=O)NCc1csc(=NCc2cc(Cl)cc(Br)c2O)[nH]1 2082101632 NITAILKIQLAODI-UHFFFAOYSA-N 448.770 4.323 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H](C)C2)c1O 2236053846 ATEVMFXMJRFDRM-UONOGXRCSA-N 443.382 4.289 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)C1=Cc1cccc([N+](=O)[O-])c1 2294034028 HROTVLITXNAXOI-UHFFFAOYSA-N 428.828 4.134 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc(C(=O)O)ccc4C)o3)C2=O)cc1C 2294131108 ZWBKKOXXNQKGDN-UHFFFAOYSA-N 444.443 4.236 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(Cc3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 2296938403 KFXLQBWFONMQJW-UHFFFAOYSA-N 433.508 4.060 10 10 IICE CC(=O)c1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)c2C)cc1 2297364879 LGVLOCAESARYJX-UHFFFAOYSA-N 441.487 4.272 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccccc3)C2=O)o1 2313553190 QHOKYWCCLUQJNZ-UHFFFAOYSA-N 431.404 4.084 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC[C@@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380727025 TZKKRYKOMFUVNV-HIFRSBDPSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2381135464 QSJCSSAULOIMAV-HUUCEWRRSA-N 441.366 4.115 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N(CCC)C1=O 33457853 IGIDYTAIRQICNT-VBKFSLOCSA-N 430.599 4.216 10 10 IICE CCN(CC)c1ccc(CN(C(=O)/C=C/c2ccc(C)cc2)[C@@H]2CCS(=O)(=O)C2)cc1 54310829 XDSDLUFSFZETIT-AIIPKAINSA-N 440.609 4.070 10 10 IICE COc1cc(/C=C2/C(=O)N(c3cccc4ccccc34)C(=O)N=C2O)cc(OC)c1OC 59862390 PKXJBIIKQULZTI-GZTJUZNOSA-N 432.432 4.372 10 10 IICE Cc1ccc(C2=NC3(CCN(C)CC3)N[C@H](c3cc(Br)ccc3O)C2)cc1 65298084 IEYMMXJTHXCUSN-FQEVSTJZSA-N 428.374 4.409 10 10 IICE biogenic O=C(/C=C\c1cccc2cccnc12)N1CCCc2cc(S(=O)(=O)N3CCCC3)ccc21 207175518 VZTVSQGQOIYHHD-RAXLEYEMSA-N 447.560 4.012 10 10 IICE Cc1ccc(C(=O)O)c(NC(=O)CN2C(=O)/C(=C/C=C\c3ccccc3)SC2=S)c1 210493530 QDFVOGKJWJBKSX-ULMKDNCXSA-N 438.530 4.089 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccccc3C)[C@@H]2c2ccc(O)c(O)c2)c1 526495966 KUJPIJFLTXAROU-HSZRJFAPSA-N 433.460 4.481 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc3ncccc23)NC(=O)OC(C)(C)C)cc1 742753574 KFMDGHLZYQJHKG-JOCHJYFZSA-N 434.540 4.297 10 10 IICE CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cccc(C(C)C)c3)n2)s1 743045943 GZAZBQDMWYWYTN-UHFFFAOYSA-N 435.596 4.432 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(NC(=O)c4ccco4)c(C)c3)CC2)cc1 748984645 BNFSICVFAUPZFV-UHFFFAOYSA-N 434.496 4.203 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nc(-c3ccc(F)cc3)no2)C1 766895361 SLTMHQNMFVQPEO-UHFFFAOYSA-N 448.498 4.340 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCn2c(cc3ccccc32)C1 813059178 UJPOPASSVQRSSW-UHFFFAOYSA-N 440.494 4.437 10 10 IICE O=C1C[C@H](Nc2ccc3nc(O)[nH]c3c2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 917633360 BAHAXVAORRAUBL-FQEVSTJZSA-N 426.436 4.428 10 10 IICE COc1ccc(N2CCCN(C(=O)COc3ccc(OCc4ccccc4)cc3)CC2)cc1 1125249766 OKIFSUOMLUCJBK-UHFFFAOYSA-N 446.547 4.392 10 10 IICE C[C@@H](NC(=O)[C@@H](Cc1ccccc1)N1Cc2ccccc2C1=O)c1ccc(N(C)C)cc1 1128135265 AFKCWODOODEBAY-KBMIEXCESA-N 427.548 4.197 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccsc3)cc2Cl)C1 1128487687 HHIYMRFWYKKFPA-MRXNPFEDSA-N 434.005 4.464 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1-c1ccccn1 1137438274 JXLKHEGIHFBFMJ-HXUWFJFHSA-N 438.959 4.243 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC(Nc3cccc(Br)c3)CC2)cc1 1156102465 SQVSZOCCMRBHRX-UHFFFAOYSA-N 430.306 4.328 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2CC2CC(C)(C)C2)c(C)n1-c1ccccc1 1289352357 FALHKZZTMFTSCY-KRWDZBQOSA-N 448.615 4.489 10 10 IICE C[C@@H](C[C@@H](C)NC(=O)N(Cc1ccco1)Cc1ccccc1O)NC(=O)OC(C)(C)C 1312914412 OUSJYFXEEYCBNJ-SJORKVTESA-N 431.533 4.389 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCC(OC(C)(C)C)CC2)cc1F 1314659280 UQTJJMUWGYVRGN-UHFFFAOYSA-N 429.584 4.268 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC(C(F)(F)F)CC1 1360981389 NELPUQSTQDSSPA-PTNGSMBKSA-N 446.491 4.218 10 10 IICE COC(=O)COc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c2cccnc12 1435526594 QKYAIWGMZHMYEA-UHFFFAOYSA-N 443.503 4.375 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H](CNC(=O)OC(C)(C)C)c3ccc(F)cc3)ccc21 1442387038 OKNDALWLLMBTKK-NRFANRHFSA-N 441.547 4.133 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](O)c3ccccc3Br)c2C)cc1 1451414916 RSBPXNNYGUAOHS-OAQYLSRUSA-N 443.341 4.329 10 10 IICE Cc1cc(C(=O)Nc2ncc(C(F)(F)F)[nH]2)c(C)n1-c1ccc(Br)cn1 1457824858 XDTWIXQGSDBSHI-UHFFFAOYSA-N 428.212 4.246 10 10 IICE COC(=O)CN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CCCC1 1465968953 GNXCHZRAUXUNJN-UHFFFAOYSA-N 433.346 4.414 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1467320737 AHJXQJWJSQFWFN-VWLOTQADSA-N 446.547 4.082 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@@H]3c3cccc(Cl)c3)CC2)cc1 1473431062 YGLVITQYUMDISJ-ILBGXUMGSA-N 444.019 4.059 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1499724747 FFTGVZHLLGTJLV-HZPDHXFCSA-N 439.676 4.490 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@@H]1CCCSC1 1503488373 UYKMOLJHFGVOPJ-HNNXBMFYSA-N 429.977 4.479 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)CN1CCCCC1 1505089093 AEUFMXWDCNSCCD-LJQANCHMSA-N 436.604 4.472 10 10 IICE Cc1noc(C)c1[C@H](C)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1511923002 NSPOXYJETLRUCU-FOIQADDNSA-N 425.533 4.270 10 10 IICE CC(C)c1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512386987 RALVLDQYORBMOI-GOSISDBHSA-N 429.584 4.298 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC1CC1 1517427382 JIKWMKSWDNLBRL-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(Cl)nc1 1519912610 HVKSMXNECIPDOJ-GDNBJRDFSA-N 435.933 4.128 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@@H]32)sc2c1CCCC2 1522411120 PVIWKUGSIPOFPW-FVQBIDKESA-N 432.586 4.216 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CCCCC2 1525460869 WFEDAUMAVDDXCC-HNNXBMFYSA-N 426.538 4.185 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CC(C)(C)NC(=O)OCc1ccccc1 1536550754 UJANUKBEBOUTFQ-LJQANCHMSA-N 425.573 4.203 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3Cl)cc2)CC1 1537840076 UUQLKTHVFPXGKN-WOJBJXKFSA-N 446.378 4.115 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(Sc3ccccc3Cl)nn2)cc1 1538160703 QPCQSFCHNJBFQE-UHFFFAOYSA-N 442.972 4.498 10 10 IICE CC(C)(Oc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCSCC2)cc1 1544409673 RSHOHXDWUXABBQ-UHFFFAOYSA-N 449.414 4.476 10 10 IICE CCc1nnc(N2CCC(CN3CCCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1546473799 KMEJOKQTEHCNIM-UHFFFAOYSA-N 442.627 4.186 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](CC(=O)O[C@@H]1CCOC1)CC(C)C 1557239570 CVBZHDMLNCVHTB-RBUKOAKNSA-N 432.586 4.270 10 10 IICE Cc1cc(C(=O)N[C@@H]2C[C@@H](N(C)C)C23CCC3)c(C)n1-c1cccc(Br)c1 1557693394 GVXULLDCWXIWRP-WOJBJXKFSA-N 430.390 4.459 10 10 IICE CC(C)(C)OC(=O)NCCN(CCc1ccccc1)Cc1ccc(N2CCOCC2)cc1 1559833096 MFJFSKUNLWQQCX-UHFFFAOYSA-N 439.600 4.093 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](C(=O)NCC4CC4)C3)cc2Cl)C1 1564650451 XAQWQUAZKPVRIZ-XLIONFOSSA-N 447.023 4.024 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(Br)cc3)CC2)cc1F 1566346497 BDAOLQVRTXFIFV-UHFFFAOYSA-N 435.337 4.223 10 10 IICE CCCCCn1c(Cc2ccccn2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1614473248 JNFMCXIBIQKGAI-UHFFFAOYSA-N 434.588 4.179 10 10 IICE Cc1cccc(OCCN(C)[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1615194911 KIUFRMSOCIIHBZ-SFHVURJKSA-N 442.515 4.108 10 10 IICE CN(C)c1ccc(CNC[C@@H]2C[C@H]3CCN2C[C@@H]3c2cc(-c3cccs3)nn2C)cc1 1616156614 ZNFGDKGEPAAEEW-HJNYFJLDSA-N 435.641 4.182 10 10 IICE CCCCN(Cc1ccccc1O)[C@H](C)C(=O)N1CC(=O)Nc2cc(C(F)(F)F)ccc21 1617538586 FSZQXQNPTQBROL-OAHLLOKOSA-N 449.473 4.387 10 10 IICE CCC(C)(C)c1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1623379070 BYFJMXMTJXQYCY-PFONDFGASA-N 435.568 4.226 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(F)ccc(Br)c3F)CC2)cc1 1623429585 IFMIRCFRRSHDLM-UHFFFAOYSA-N 425.273 4.088 10 10 IICE Nc1c(Cl)cc(Cl)cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1625991919 YZGCVJLJGBGBEP-UHFFFAOYSA-N 448.272 4.361 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cc(Br)cn(C)c3=O)c2C)c1 1629412123 BLJCCISTHVTEBY-UHFFFAOYSA-N 428.330 4.424 10 10 IICE Cc1cc(C(=O)Nc2ccc(OC3COC3)cc2)c(C)n1-c1ccc(Br)cn1 1634125306 XAQZRWGLYODLFX-UHFFFAOYSA-N 442.313 4.282 10 10 IICE Cc1ccccc1[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1634725205 RUFBUCYZHWCJJD-KRWDZBQOSA-N 449.345 4.345 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)N3CSCCSC3)cc2Cl)C1 1635126503 MFNCZZBQCLARNP-HZPDHXFCSA-N 428.067 4.278 10 10 IICE Cc1cc(CC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)c(C)n1-c1ccc(Cl)cc1 1636280431 DGCCLYDLTVZZCL-DEOSSOPVSA-N 437.971 4.495 10 10 IICE CC(C)Oc1ccc(N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1642709963 CVUZVCHGQGRWSJ-UHFFFAOYSA-N 428.488 4.324 10 10 IICE Cc1cc(C(=O)Cn2cnc3ccc(F)cc3c2=O)c(C)n1-c1ccc(OC(F)F)cc1 1651774471 JIAQFSNBMBGKNP-UHFFFAOYSA-N 441.409 4.427 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4cccs4)C3=O)c2C)c1 1656172900 GWWYUTFQKPYAIA-XMMPIXPASA-N 435.549 4.422 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3c(F)cccc3F)cc2Cl)C1 1680561292 BGURJWSLVAUAJM-VBKZILBWSA-N 437.918 4.387 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(CCN(C)C)Cc3ccco3)cc2Cl)C1 1680561701 DRSIAZVTHMOZIA-GOSISDBHSA-N 432.996 4.443 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)n1-c1ccccc1 1684318510 DYXAIMCQLIVHHY-UHFFFAOYSA-N 447.539 4.077 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCCc1nccs1 1696699645 GQANQKABVCNQOH-UHFFFAOYSA-N 440.960 4.425 10 10 IICE Cc1nnc(Cn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)s1 1707852662 YKDYHDRNNVXXGI-UHFFFAOYSA-N 425.606 4.020 10 10 IICE Cc1cc(-c2nnc(N3CC(C)(C)OC[C@@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1724195929 KCJSVCKPUBRTJS-SFHVURJKSA-N 437.588 4.127 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H](C)C(=O)NC 1727847333 GZTSHEZBMIXXFQ-QCSXQHJISA-N 434.588 4.137 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1728381509 HRKZFYFTMNKLFH-DENIHFKCSA-N 441.620 4.418 10 10 IICE CSCCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1731134842 KAKULMHXTVFLAV-UHFFFAOYSA-N 436.629 4.254 10 10 IICE CN1CCCc2cc(Cn3c(Cc4ccncc4)nnc3N(C)CCC(F)(F)F)ccc21 1748060324 SKANCSBSAVASLZ-UHFFFAOYSA-N 444.505 4.083 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)cc1C 1752742038 HUDOQIDPJQJWGK-OXJNMPFZSA-N 437.592 4.290 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@@H]3CCCO[C@H]3C(C)(C)C)CC2)cc1 1768703468 OTRRSGLXEMFPAZ-NZQKXSOJSA-N 441.620 4.153 10 10 IICE COC[C@H]1CCCCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1770892273 PBXHMQHYDAJPOU-NRFANRHFSA-N 425.621 4.160 10 10 IICE O=C(Nc1ccc(Cl)cc1C(=O)O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O 1857566654 HQKXFUXLHREWPD-UHFFFAOYSA-N 434.835 4.087 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@H]2NCc2ccc(Br)cc2O)C1 1918965352 UJOOTSFELIJUCB-XLIONFOSSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2060638752 AMIXSIAQKXPPCH-XXBNENTESA-N 443.548 4.132 10 10 IICE CCc1nn([C@@H](CC)c2cc(C)c(C)cc2O)c(I)c1C(=O)OC 2079955209 XLFWGHCJSSHRJI-AWEZNQCLSA-N 442.297 4.159 10 10 IICE CCOC(=O)c1cccc(N2C(=O)C(=Cc3cc(OC)ccc3OC)SC2=S)c1 2297361779 VBRQOLDSEXXEPI-UHFFFAOYSA-N 429.519 4.286 10 10 IICE Cc1cc(NC(=O)COc2ccc(C=C3SC(=S)N(C)C3=O)cc2)ccc1Cl 2297560794 VWYKUTYUUZSVNA-UHFFFAOYSA-N 432.954 4.497 10 10 IICE Cc1ccc(CNC[C@@H]2CC2(Br)Br)c(O)c1Br 2307472259 DGORUXICADTQJZ-VIFPVBQESA-N 427.962 4.059 10 10 IICE Cc1ccc(CNC[C@@H](CC(F)(F)F)NC(=O)OC(C)(C)C)c(O)c1Br 2352941041 LONHFEKKWIWACJ-GFCCVEGCSA-N 441.288 4.398 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352953012 RINHQHWHPHJZQP-GJZGRUSLSA-N 427.383 4.492 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471790 NUAVGBMVFGHSST-UEXGIBASSA-N 427.526 4.498 10 10 IICE COc1ccc2nc(N/C=C3/C(=O)N(c4ccc(Cl)cc4)C(=O)N=C3O)sc2c1 100366912 YKRXEXODLQMPBL-UKTHLTGXSA-N 428.857 4.377 10 10 IICE Cc1cc(C(=O)NCc2nc(-c3ccncc3)cs2)c(C)n1-c1ccc2c(c1)OCCO2 110537860 OHTIOMBWAFZPIO-UHFFFAOYSA-N 446.532 4.314 10 10 IICE CN1C(=O)/C(=C(\Cc2ccccc2)C(=O)Nc2nc3ccccc3s2)SC1=S 211945922 UBXOUUHSDNKYCL-SSZFMOIBSA-N 425.560 4.222 10 10 IICE O=C(Nc1ccc([S@@](=O)C(F)(F)F)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 750615415 CHNGWEGEKWOZLM-BEIWTESXSA-N 442.459 4.233 10 10 IICE CC(C)N(CCc1nccs1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754660309 GIYXWCXAUKDOLE-MRXNPFEDSA-N 438.544 4.376 10 10 IICE Cc1nc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)nc2ccccc12 769664839 MCOYCQKNPQGHMC-UHFFFAOYSA-N 428.536 4.403 10 10 IICE C[C@@H](CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(Br)cc1 770256785 YWHBDNWDZPYXJV-KRWDZBQOSA-N 431.374 4.438 10 10 IICE Fc1cccc(Cn2cnc(CNCc3ccc4c(c3)CCN4Cc3ccccc3)n2)c1 796358563 NYUKJHKHBUNTOW-UHFFFAOYSA-N 427.527 4.318 10 10 IICE CCOC(=O)[C@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccnc1 1128828277 DLRYZWPCMGCITP-XMMPIXPASA-N 439.943 4.280 10 10 IICE CCN(Cc1cccc(NC(=O)c2cc3cc(O)c(O)cc3s2)c1)C(=O)C(F)(F)F 1136584508 LXSUGJMFOCYRMZ-UHFFFAOYSA-N 438.427 4.476 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4Cl)C3)cc2)CC1 1136705327 IUFPFEFUTBIBGS-LJQANCHMSA-N 425.960 4.246 10 10 IICE Cc1cc(C(=O)NC(C)(C)[C@@H](O)C(F)(F)F)c(C)n1-c1ccccc1Br 1152629684 MDXZCKFYTZKYGY-MRXNPFEDSA-N 433.268 4.288 10 10 IICE COC1CCN(c2ccc(CN(CCO)Cc3ccc(Br)s3)cc2)CC1 1169971522 SLWOFFZEHSETBQ-UHFFFAOYSA-N 439.419 4.120 10 10 IICE CCN(Cc1ccccc1Br)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1252924081 PFTJCUHWDKTXPR-KRWDZBQOSA-N 432.362 4.268 10 10 IICE CO[C@H]1CCC[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1 1289511109 ZDKCBWPUYXFZQC-HIFRSBDPSA-N 429.318 4.303 10 10 IICE Cc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1-c1cnn(C)c1 1292382628 UYLZMLRCIKXTJM-DEOSSOPVSA-N 432.568 4.283 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)CC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1292439759 KCCYWLNVINIIQH-UHFFFAOYSA-N 433.980 4.093 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc(I)ccc1O 1297005667 MDCFNJBTKDMBBH-UHFFFAOYSA-N 425.266 4.145 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1c2ccccc2CCN1C(=O)OC(C)(C)C 1297563116 XHKXJZOONRPBCR-HXUWFJFHSA-N 431.529 4.029 10 10 IICE O=C(C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F)NCc1ccc2cccnc2c1O 1299721462 LKTBLEIIQGFJPM-HXUWFJFHSA-N 447.438 4.007 10 10 IICE CSc1ccc([C@@H](CNC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)N(C)C)cc1 1312753596 OBIOXEALIBBONF-WZONZLPQSA-N 428.646 4.316 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC(C)(C)c3cc(Cl)ccc3OC)C2)cc1 1312902998 RXBFVCUNTLBWKT-MRXNPFEDSA-N 431.964 4.418 10 10 IICE CC(C)CCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1359907259 BDARFUOJHFHRIP-JOCHJYFZSA-N 441.620 4.081 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(Cc4cccc(F)c4)C(=O)C3)c2C)c1 1444274519 XJGBUVIJEVTTQS-UHFFFAOYSA-N 433.527 4.335 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cccc(Cl)c1 1459836894 CERPKJHKXYHBDA-HOIFWPIMSA-N 447.982 4.450 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)c2C)c1 1466711996 FXZHOHWEMHSJJG-UHFFFAOYSA-N 436.531 4.012 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC(c2ccc(F)cc2)C1 1468361972 XSHHTQQCTHLLBV-WOJGMQOQSA-N 446.594 4.495 10 10 IICE CCCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H](C)CC(=O)Nc1ccccc1 1470771303 CJKWNZIBXBFNAJ-TZIWHRDSSA-N 438.572 4.113 10 10 IICE CC1=CCN(c2nnc([C@]3(OC(C)C)CCOC3)n2CCCSc2nccs2)CC1 1492615128 AVYMFFKZHRGQDV-NRFANRHFSA-N 449.646 4.114 10 10 IICE CCCCN(CC)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1500438016 AZJHRRRWIKZIHD-UHFFFAOYSA-N 425.621 4.429 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)[C@@H]1C 1504891943 KPVXTDYVXIBIKG-PKOBYXMFSA-N 425.602 4.329 10 10 IICE CCCCn1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1514480257 MUWVHOLZNSUYNM-SFHVURJKSA-N 429.565 4.492 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3Cc3nccs3)CC2)cc1 1518310572 ZFAAFHFQOOMVCN-UHFFFAOYSA-N 440.617 4.097 10 10 IICE COc1cc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc(NC(C)=O)c1OC 1531611289 ADXJIYXEWWQDHO-UHFFFAOYSA-N 435.524 4.308 10 10 IICE COc1cc(F)cc(C[C@@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1535610103 BYLGMTTYXIZKIE-GOSISDBHSA-N 437.559 4.303 10 10 IICE C[C@@H](NC(=O)c1ccccc1OCCN(C)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1538977196 XCTBDSOGVRYENI-GOSISDBHSA-N 441.572 4.489 10 10 IICE C[C@@H](Oc1ccccc1F)c1nnc(N2CCOCC2)n1CCCSc1nccs1 1541987138 UACXVAPRWHRAEY-OAHLLOKOSA-N 449.577 4.033 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cc(F)c(OC)c(F)c2OC)CCCC1 1543761335 NKRIXPIQAWYVDW-UHFFFAOYSA-N 430.451 4.463 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1544529783 MHFZWMFWOKAVNO-IBGZPJMESA-N 429.542 4.204 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(N)=O)C2CCCCC2)c(C)n1-c1cccc(Br)c1 1545212277 NAORDSBSPAUOQY-FQEVSTJZSA-N 446.389 4.411 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1cc(Br)c(F)cc1O 1556879538 QWVPPNFGMFAXJT-UHFFFAOYSA-N 427.233 4.256 10 10 IICE CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1564594228 WPYYRRNESWRXMM-XGRCMKMKSA-N 432.996 4.084 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H](c2nccn2C)C(F)(F)F)cc1 1565491876 UOMIVJNTRTWVHC-SFHVURJKSA-N 435.450 4.095 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc2ccc(Br)cc2c(=O)o1 1585264603 UYCOMQCOURFDPP-CQSZACIVSA-N 443.341 4.291 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cnc(C(=O)OC(C)(C)C)cn3)cc2Cl)C1 1586083103 WFNPLCUENAZIBO-HNNXBMFYSA-N 444.963 4.252 10 10 IICE CO[C@](C)(C1CC1)[C@H](C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1597434268 SSJTVBGKIXGZPN-DHUDADTASA-N 438.640 4.049 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(=O)c2ccc(Cl)cc2o1 1622635041 OYJKNXQJVJYTME-INIZCTEOSA-N 447.318 4.200 10 10 IICE COc1ccc(-n2ccnc2SCC(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1 1623549694 IISXBTSBTXUWSS-UHFFFAOYSA-N 436.581 4.232 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(c2cccc(Br)c2)CC(=O)C1 1626723326 ZQOPXNQNSQEDJB-INIZCTEOSA-N 443.385 4.172 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)c1 1627137088 QUQSRKSBEKKQFX-HXUWFJFHSA-N 444.940 4.131 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(NC(=O)OC(C)(C)C)n(C)n1 1628873478 AKUCWNYIEAYDFB-UHFFFAOYSA-N 427.549 4.030 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cc(Br)c(=O)n(C)c3)c2C)c1 1629808207 DZIVBRPJSBLQMT-UHFFFAOYSA-N 428.330 4.424 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(c4cc(OC)cc(OC)c4)C3)c2C)cc1 1630488444 WYMJTDCVUGGKCT-IBGZPJMESA-N 449.551 4.129 10 10 IICE CCS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)c(N)c1 1631531103 HHLGBDMIAMXZFA-QGZVFWFLSA-N 438.549 4.172 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 1631531117 HVQFYISAOVQTEO-KRWDZBQOSA-N 434.448 4.282 10 10 IICE Cc1cc(C(=O)N2CC(Oc3ccncc3)C2)c(C)n1-c1ccc(Br)cc1 1632673682 IDQQMFIARYAWNO-UHFFFAOYSA-N 426.314 4.155 10 10 IICE COC(=O)CC[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1633716683 IJGDDTFZVDSXKL-MRXNPFEDSA-N 448.361 4.057 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@@]1(C)CCNC(=O)C1 1638240762 GWVYFJNPBHWMCR-AVRDEDQJSA-N 433.474 4.214 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1640260163 SZLLECWKLJFFTH-IRXDYDNUSA-N 425.566 4.167 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccccc1F 1647778847 XROVTXCWKXKLLK-UHFFFAOYSA-N 430.479 4.452 10 10 IICE CCc1cnc(CN(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)s1 1649614872 RIWPHHXVOSDSSM-LJQANCHMSA-N 444.580 4.038 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCCN([C@H](C)c2ccccc2F)C1=O 1672983620 HCSYEWJZPOISQY-DYESRHJHSA-N 427.520 4.205 10 10 IICE COC(=O)[C@]12CCC[C@H]1N(C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)CC2 1682023940 MXFMTENJZYMMBT-YBVWCTEOSA-N 433.980 4.204 10 10 IICE CC(C)CCN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1692328546 ZULIIGZAMRQTDD-JOCHJYFZSA-N 445.583 4.026 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1n[nH]c(C)n1 1745591570 UXEUBHYAHXOYFH-UHFFFAOYSA-N 432.576 4.258 10 10 IICE CCN(CC1CC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1746258968 WWQKWISSNGMOJE-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)c1O 1860084360 MCJDPLLYGNBTLZ-CXUHLZMHSA-N 432.479 4.114 10 10 IICE C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1866014596 GDDAZZQJOLLFIY-JLTOFOAXSA-N 447.366 4.466 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C1(C)C 2127901020 YBFADBIKEYDNNL-DOMZBBRYSA-N 431.346 4.323 10 10 IICE COc1ccc(N2C(=O)C(=Cc3ccc(-c4ccc(Cl)cc4)o3)C(=O)NC2=S)cc1 2294253443 UJGLZKOHYJQTRS-UHFFFAOYSA-N 438.892 4.440 10 10 IICE CC[C@@H]1CCCCN1C(=O)CCCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S 2297349699 JEMUTZMUJIQXJD-MRXNPFEDSA-N 446.594 4.188 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(Cl)cc2Cl)SC1=S)c1ccc(O)cc1 2314926605 NCSZWSYNENTXIX-UHFFFAOYSA-N 425.318 4.245 10 10 IICE COc1ccc(OC)c(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)c1 2321635480 UVMJUMGBOXLKNP-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CCOc1cccc(C=C2SC(=S)N(c3ccc(N4CCN(C)CC4)cc3)C2=O)c1 2321684718 YZCGWMHOAODZDJ-UHFFFAOYSA-N 439.606 4.243 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)/C1=C\c1ccc(-c2cc(C(=O)O)ccc2Cl)o1 9259595 NITZCLZBZVGGMH-WJDWOHSUSA-N 442.855 4.093 10 10 IICE CCN(CC)c1ccc(/C=c2/sc3nc(/C=C/c4ccc(Cl)cc4)nn3c2=O)cc1 33168229 BKXLPZAXJPWXBT-IFIIVODNSA-N 436.968 4.369 10 10 IICE COc1ccc(/C=C\C(=O)Oc2ccc(/C=C3/SC(=S)N(C)C3=O)cc2OC)cc1 33339365 PBBJIENWQFPQNY-BPLVKSTGSA-N 441.530 4.154 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)CCc3cccs3)CC2)c(C)n1-c1ccccc1 62694293 KJMUTLRRLKSFCO-UHFFFAOYSA-N 435.593 4.115 10 10 IICE O=C1/C(=C\c2ccc(Cl)cc2Cl)SC(=S)N1N1C(=O)[C@@H]2CCCC[C@H]2C1=O 150199685 FBHINWQNCQTZNB-CDXFXEMCSA-N 441.361 4.285 10 10 IICE CCCCCCN1C(=O)/C(=C2/SC(=S)N(CCCC(=O)OC)C2=O)c2ccccc21 206857497 HXOUHBMZQWUZQM-VHEBQXMUSA-N 446.594 4.138 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3ccc(OC)cc3OC)[C@H]2c2ccc(O)c(O)c2)c1 526145553 UETOYBQOXQNYDC-HSZRJFAPSA-N 449.459 4.181 10 10 IICE CN(C)c1ccc(CN(C2CC2)S(=O)(=O)/C=C\c2cccc(Br)c2)cc1 727448606 LSQBICNEKVJJAP-SEYXRHQNSA-N 435.387 4.480 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(-c4cscn4)c3)cc2F)C[C@@H](C)O1 742557370 UXHPLPRANOGLOQ-HZPDHXFCSA-N 425.529 4.493 10 10 IICE COc1cccc(CNC(=O)NC(Cc2ccccc2F)Cc2ccccc2F)c1O 747444174 MPRXZUCJLJNVMV-UHFFFAOYSA-N 426.463 4.332 10 10 IICE Cc1cncc(/C=C/C(=O)N[C@H](C)CN(C(=O)/C=C/c2cncc(C)c2)c2ccccc2)c1 772126803 UPFJAMXEESRNNH-RXGWLMQDSA-N 440.547 4.358 10 10 IICE CCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C(C)C)c(OC)cc2C)cc1 788480090 MOKGSQNEGRHIKN-UHFFFAOYSA-N 440.587 4.080 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC)C[C@]2(CCOC2)O1 801947557 YUIAUPAQYHDAQC-OFVILXPXSA-N 435.572 4.147 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)nc3)c2C)cc1 918579290 RGHASHSJYBYEMA-RTBURBONSA-N 448.567 4.041 10 10 IICE CC(C)(C)OC(=O)Nc1cc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)ccn1 1126783716 OSTFFPJBHUSPNG-UHFFFAOYSA-N 430.468 4.391 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccnn1CCc1ccccc1 1137350746 TVIMWVKPBQDCBS-UHFFFAOYSA-N 428.330 4.256 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(Nc3cnccn3)c2)cc1 1142712963 LLNBWQPKJDHXFC-HSZRJFAPSA-N 431.540 4.108 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c1 1144185046 HVEYCMFXRPIZHO-QHCPKHFHSA-N 436.625 4.183 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(-c2cccc(O)c2)on1 1156287976 TYRBRAWEMALSAI-UHFFFAOYSA-N 437.496 4.049 10 10 IICE CCOC(=O)C1([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)CCOCC1 1157687383 UQHILLDHFRAGJK-QGZVFWFLSA-N 432.948 4.226 10 10 IICE COc1ccc(N(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1278359076 RSYQGAQOXYVTPP-AQTBWJFISA-N 430.526 4.089 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCC34CCC4)ccc21 1292206606 HMBGLBJPOAOJOJ-FQEVSTJZSA-N 427.589 4.113 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1 1299438838 GHRYHCKHARONKF-WIYYLYMNSA-N 439.556 4.330 10 10 IICE COc1ccc(CNC(=O)NCC[C@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)c(O)c1 1313151147 WWAFJTVOVTZKDG-KRWDZBQOSA-N 441.528 4.129 10 10 IICE Cc1cc(CC(=O)N2CSC[C@H]2C(=O)NC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1359998352 GPAFEONOOBQLAM-IBGZPJMESA-N 434.005 4.106 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccc(F)cc1 1436067555 BNUSWJVJPDEGQI-FHIITYSISA-N 444.528 4.228 10 10 IICE COc1ccc(N2CCCN(CC(=O)N[C@H](c3ccc(F)cc3)C3CCCC3)CC2)cc1 1459349986 LLYRHNQRDVZLHO-SANMLTNESA-N 439.575 4.394 10 10 IICE CC[C@H](C(=O)N1CCC(NC(=O)c2cc3cc(O)c(O)cc3s2)CC1)c1ccccc1 1464690858 BNJBVDPTJBECRI-SFHVURJKSA-N 438.549 4.227 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)cc1 1473295140 CCAIHUIEKSHLFG-MRXNPFEDSA-N 436.383 4.392 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)[C@@H]1C 1500312146 INLYRHLGLQGQPW-FQEVSTJZSA-N 434.588 4.210 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N2CCO[C@@H](C(F)(F)F)C2)cc1 1515533279 VKAYDFCFFWSQJG-LJQANCHMSA-N 437.510 4.208 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(C(=O)N(C)CC(C)(C)C)c3)C2)cc1 1529705908 BZTIXADYTNARBW-IBGZPJMESA-N 437.584 4.070 10 10 IICE CN(C)c1ccc(CN(C(=O)C2=Cc3cc(Br)ccc3OC2)C2CC2)cc1 1532934652 GZSZHPAKDNBZQP-UHFFFAOYSA-N 427.342 4.482 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1540440321 CTYVJZZFVADVDV-UWJYYQICSA-N 434.367 4.237 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1 1557063416 NYCPNLILVAGSHY-HNNXBMFYSA-N 428.483 4.414 10 10 IICE Cc1ccc(S(=O)(=O)C2(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CCCC2)cc1 1584095477 NMZBRRUCOOGSIY-FQEVSTJZSA-N 442.625 4.203 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3c[nH]c4ccc(Br)cc34)CC2)cc1 1584361664 WVIANCPHMDFECX-UHFFFAOYSA-N 442.357 4.267 10 10 IICE O=C(c1ccc(Cn2cc(Cl)cn2)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1597089863 JEGVSLBNWSCUSF-NRFANRHFSA-N 425.916 4.112 10 10 IICE CCCNS(=O)(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc1 1625164267 VXSODJHXNJJELK-UHFFFAOYSA-N 425.554 4.343 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccc(I)cc1F 1629136696 IUHDOWHWAOBRQD-UHFFFAOYSA-N 440.039 4.373 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)c3ccc(C(C)(C)C)cc3)cc2F)C[C@@H](C)O1 1641568790 FPCTURMQGCKEEK-KDURUIRLSA-N 441.591 4.489 10 10 IICE COc1ccc(C(=O)N[C@@H](C)c2ccccc2O)cc1S(=O)(=O)Nc1ccc(C)cc1 1643742028 KVDSDGWMBPMQML-INIZCTEOSA-N 440.521 4.001 10 10 IICE Cc1cc([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1=O 1652730347 PRYPZAGTQGIGJT-UHFFFAOYSA-N 444.285 4.118 10 10 IICE COc1cc(N2CCN(C[C@@H]3CCC[C@H](c4ccccc4)O3)CC2)cc(OC)c1OC 1653225673 CYISIEWCQFNCAT-FCHUYYIVSA-N 426.557 4.145 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@@H]1CCN(c2c(F)cccc2F)C1=O 1657432330 WTGWSBDMZNUNKZ-MRXNPFEDSA-N 425.273 4.060 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)C2(CCCCC2)C1 1657635489 DTDBNZVPSFBFNA-UHFFFAOYSA-N 429.605 4.279 10 10 IICE C[C@H](NC(=O)NCc1c(O)ccc2c1CCCC2)[C@@H]1C[C@H](C(=O)OC(C)(C)C)C1(C)C 1682304874 XOJMKUKLMFDVJE-RYGJVYDSSA-N 430.589 4.463 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1C(C)C 1683253173 DMFJLXUOJDUJSL-KNQAVFIVSA-N 446.636 4.279 10 10 IICE COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1686826691 NKECAWLXVFOCCS-UQBPGWFLSA-N 439.600 4.156 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(CCc3ccc(C)cc3)C[C@H]3CCCO3)C2)cc1 1687022867 IIJJAWRBWDLVBM-RCZVLFRGSA-N 437.584 4.016 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2cccc(COC[C@H]3CCCO3)c2)C2CC2)cc1 1687128011 HDOXRCXADMPPMQ-RUZDIDTESA-N 437.584 4.322 10 10 IICE CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1687441192 DHOMTJGANHQOHW-UHFFFAOYSA-N 448.533 4.231 10 10 IICE COCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CC1 1730568657 UMLKHIJHHVTZOM-LJQANCHMSA-N 437.588 4.250 10 10 IICE CCc1nnc(N2CCC(C(=O)c3cccs3)CC2)n1Cc1ccc(N(C)C)cc1C 1744601297 AIHLXZZYBLVKGH-UHFFFAOYSA-N 437.613 4.424 10 10 IICE CCN1C[C@H](C)N(c2nnc(C3CCCC3)n2CCCSc2nccs2)C[C@H]1C 1746379899 OYBLQRWBGFAUIL-SJORKVTESA-N 434.679 4.494 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2C[C@H](C)S[C@H](C)C2)cc1 1766614404 LUQOXLWNWADWMP-SVFBPWRDSA-N 443.661 4.397 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1770889023 JBSNZXLPUXYRLM-OAQYLSRUSA-N 448.615 4.324 10 10 IICE CCN[C@@H]1C(=O)Nc2cc(N(CCN(C)Cc3ccccc3)Cc3ccccc3)ccc21 2034743291 JGPMENZUOFFVPD-SANMLTNESA-N 428.580 4.428 10 10 IICE CC[C@H](NC[C@]12C[C@@H]1CN(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2092532394 SLQYMFKAPQZWLO-PSGMQZRDSA-N 425.367 4.452 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)[C@@H]1NCc1cc(Br)cc(F)c1O 2103912741 WRMXMUQLARPANN-ATCWAGBWSA-N 431.346 4.275 10 10 IICE CC[C@H](NC[C@H]1CO[C@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2159115559 XCGDBCWRNCSNRZ-QRTARXTBSA-N 443.382 4.125 10 10 IICE COc1ccc2c(C=C3SC(=S)N(c4ccccc4F)C3=O)c(C(=O)O)[nH]c2c1 2297579972 CFLYAXMXIKOPBK-UHFFFAOYSA-N 428.466 4.420 10 10 IICE CCOc1cc(N(CC)CC)ccc1C=C1C(=O)NC(=O)N(c2cccc(C)c2C)C1=O 2313547741 AUDCFYRBUGDYEK-UHFFFAOYSA-N 435.524 4.215 10 10 IICE COc1cc(C=C2SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1cccc(C)c1 2314766515 AFBKMMWASUHTSA-UHFFFAOYSA-N 443.546 4.259 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(CCc2ccccc2)C1=O)C(=O)O 2314932103 KMFSWERPYREJSK-KRWDZBQOSA-N 427.547 4.373 10 10 IICE CC(=O)N1C(=O)/C(=C2/SC(Nc3ccccc3C(F)(F)F)=NC2=O)c2ccccc21 33341812 VOMFEXHYONXCOL-FOCLMDBBSA-N 431.395 4.051 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc(OC3CCCC3)nc2)c(C)n1-c1ccccc1 727033339 QQVUPQPZAMTEEQ-UHFFFAOYSA-N 446.551 4.108 10 10 IICE CCN1CCN(c2ccc(CN[C@@H](C)c3ccc(N4CCCCC4)c(F)c3)cn2)CC1 764996486 WLFWYRRNPIPBLS-FQEVSTJZSA-N 425.596 4.204 10 10 IICE COc1ccc(C)cc1C1(CN[C@H](C)c2ccc(N3CCOCC3)c(F)c2)CCOCC1 765310895 QQMFDFBADTWGMQ-HXUWFJFHSA-N 442.575 4.378 10 10 IICE Cc1cc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c(C)n1-c1ccc(Cl)cc1 765745741 RCXDUCKOVHUILF-UHFFFAOYSA-N 442.922 4.048 10 10 IICE Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 766595706 KEGDICXWNWQUPJ-ZACQAIPSSA-N 445.583 4.260 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(c2cccnc2)CC1 768755221 JAKQKIZGAJTAOR-QGZVFWFLSA-N 439.515 4.064 10 10 IICE C[C@@H](NC(=O)N1CC=C(c2ccc(Cl)nc2)CC1)c1ccc(N2CCOCC2)cc1 773505883 MRKKOGIVBVZIQS-QGZVFWFLSA-N 426.948 4.132 10 10 IICE COCc1nnc(-c2cccc(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2)o1 776703055 RNDMGPAGHOBYDO-UHFFFAOYSA-N 430.508 4.263 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc([C@@H]4CCCOC4)cc3)cc2F)C[C@@H](C)O1 779857985 STPXDFOICMBCFB-JBYIUTFZSA-N 426.532 4.263 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCCC[C@@H]3c3nnc(C4CCC4)o3)CC2)cc1 812024810 TUMGOCLPVHXCSW-OAQYLSRUSA-N 439.560 4.251 10 10 IICE COc1cc(Cl)cc(CNC[C@H]2CN(Cc3ccccc3)CC23CCOCC3)c1O 816644036 ZUMOCVSTMNBTRD-FQEVSTJZSA-N 430.976 4.073 10 10 IICE CCOc1ccc([C@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 918200106 XIURMZFHQMXBTC-KSZLIROESA-N 429.536 4.398 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(N4C[C@H](C)O[C@@H](C)C4)nc3)c2C)c1 1132263278 CAWPBZNBTCZKHR-PMACEKPBSA-N 432.568 4.341 10 10 IICE O=C(CCCCc1cccc(O)c1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1141815407 IWYGNSULVLMLSS-UHFFFAOYSA-N 436.474 4.277 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2nc(-c3ccncc3)cs2)c1 1142977003 KOPZCNAWPVDHQF-UHFFFAOYSA-N 430.533 4.398 10 10 IICE COC(=O)/C=C\c1ccc(N(C)CC[C@H](NC(=O)OC(C)(C)C)C(C)C)c([N+](=O)[O-])c1 1162644305 JNECDYABBNVEER-CCCPALQASA-N 435.521 4.157 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccncc3)noc2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 1165626299 FMEGKEBLTXNAKH-UHFFFAOYSA-N 430.508 4.486 10 10 IICE O=C(CN1CCS(=O)(=O)C2(CCCCC2)C1)Nc1ccc(N=Nc2ccccc2)cc1 1168156395 UQHAZVWLSHEHGJ-UHFFFAOYSA-N 440.569 4.474 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CC[C@H](NC(=O)OC(C)(C)C)CC2)C2CC2)cc1 1233830835 SNTDPBCQDRXZCU-WGSAOQKQSA-N 430.593 4.263 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC1([C@H]2CCCCO2)CCC1 1253711395 WXOUPWXHRKPWIA-GOSISDBHSA-N 425.367 4.426 10 10 IICE Cc1cc(C(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)c(C)n1-c1ccc(Cl)cc1 1298534727 OSDIUOFDCNSTEM-KRWDZBQOSA-N 425.891 4.422 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)N(C)C)cc1 1312342144 MJBSYXGHONINBB-RTWAWAEBSA-N 428.552 4.096 10 10 IICE CN(CC1CCC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1314790746 MTDFWPDKFWEYFB-UHFFFAOYSA-N 429.584 4.127 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(C(F)F)nc1 1440239340 SQNCVXWUDFBNHY-DHDCSXOGSA-N 437.468 4.388 10 10 IICE Cc1cc(C(=O)N2CC(=O)N(C(C)C)C(C)(C)C2)c(C)n1-c1ccccc1Br 1444954603 IDGBTGKBMORWII-UHFFFAOYSA-N 446.389 4.328 10 10 IICE COc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2=O)cc1 1458181373 IJPCVZDXHONMQP-QHCPKHFHSA-N 445.475 4.047 10 10 IICE COC(=O)[C@@H](C)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1460871949 FIINUTPUGILIFE-SFHVURJKSA-N 433.552 4.323 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CC(=O)N(C)[C@@H]3c3ccc(F)cc3)c2C)c1 1462084710 LACNYOXBNTWHJQ-UKILVPOCSA-N 433.527 4.377 10 10 IICE CNC(=O)c1cc(C)ccc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1465382209 WJCJJVLVVRSCIR-UHFFFAOYSA-N 441.329 4.172 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(Oc2ccc(Cl)cn2)CC1 1478840365 AYUQCEDEJFIJRA-QGZVFWFLSA-N 430.980 4.293 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@@H](COC)C2)cc1 1501837082 AVOJOMNFGNFFIR-OAQYLSRUSA-N 434.588 4.097 10 10 IICE Cc1ccccc1Cc1nnc(N2C[C@H](C)O[C@@H](C)C2)n1CCCSc1nccs1 1511298369 LYSMXHJYEQJHOS-ROUUACIJSA-N 443.642 4.430 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3cccc(C(C)(C)C)c3)cc2F)CC1 1521010810 UPBVQNBAIKPDLX-LJQANCHMSA-N 441.591 4.349 10 10 IICE COc1nc(C)cc(C)c1CN(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1533957203 XPPJUFUSYXEXBC-UHFFFAOYSA-N 434.584 4.087 10 10 IICE COC(=O)[C@H](C)[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1534151037 LORZEDUEEAKKEO-CRICUBBOSA-N 434.536 4.195 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@H]21 1556481477 ULXKRDAGDZDTBY-NUEKZKHPSA-N 437.131 4.119 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)[C@H](O)c2c(F)cccc2Cl)cc1 1566342412 RYYDHNWRKVZGDM-MYYSRTQBSA-N 442.918 4.480 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3sc(SC(F)(F)F)nc3C)CC2)cc1 1566563208 WVUJYJNQQNJXFQ-UHFFFAOYSA-N 445.532 4.353 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@H]3CNC(=O)OC(C)(C)C)cc2Cl)C1 1568141707 CNOBCLWKESMNJB-NJAFHUGGSA-N 435.996 4.353 10 10 IICE CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1583919365 PWSNLYWZXKTIOW-QPPBQGQZSA-N 439.556 4.437 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Cl)c(Br)cc2OC)cc1 1585449001 CXIHMQHYWSTWIZ-UHFFFAOYSA-N 441.753 4.328 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)c2cccc(N3CCOC3=O)c2)c1 1586396708 CYOBRGPGPWDHHN-KRWDZBQOSA-N 431.492 4.354 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(c2)CCS3(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1588285802 YROWKXMEFYFZKT-UHFFFAOYSA-N 436.577 4.477 10 10 IICE COc1ccccc1OC[C@@H](C)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1596598343 XXVKOEJNKMCGNO-FQEVSTJZSA-N 449.595 4.248 10 10 IICE COc1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1SC 1596896268 GEVZAVJUTMPAPN-UHFFFAOYSA-N 448.456 4.353 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1614651668 KCRHCRHWUAZWOF-NRFANRHFSA-N 440.680 4.458 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1615770685 AZXIILMVDXODRP-MOPGFXCFSA-N 442.627 4.183 10 10 IICE COCCN(c1nnc(C(C)C)n1Cc1ccc2c(c1)CCCN2C)[C@H]1CC[C@@H](C)C1 1619885344 FURNIJIHZUEHLQ-KNQAVFIVSA-N 425.621 4.474 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1c1cccc(Cl)c1 1625684739 YDGGSVNBNIYSFG-PBHICJAKSA-N 427.715 4.188 10 10 IICE Cc1ccc(C(=O)NCc2cccc(CN3CCCC3=O)c2)cc1-n1c(C)cc(C=O)c1C 1626999679 HXNHKPXEJOIZSX-UHFFFAOYSA-N 443.547 4.267 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 1627013434 DRTYFZDBDQWZMP-UHFFFAOYSA-N 446.475 4.084 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H](NC(=O)OC(C)(C)C)C3(C)C)cc2)CC1 1628608494 FEFCKFBYUCPXMM-SFTDATJTSA-N 429.605 4.479 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c(C)n1-c1ccccc1 1628627325 SDGTTYGAAXGACZ-JTSKRJEESA-N 425.573 4.398 10 10 IICE CC(C)(C)OC(=O)CC[C@@H]1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)CO1 1629944022 ZCXBYKFFSSHHNV-RTBURBONSA-N 429.513 4.041 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1630480786 HJKMSYHXRTWAGG-UHFFFAOYSA-N 448.519 4.126 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1630698324 SNQDWVCLBSTJME-PXNSSMCTSA-N 431.577 4.054 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)COc2ccc(C(F)(F)F)cc2)cc1 1631607758 GGKYRGMOROSRGQ-OAQYLSRUSA-N 436.474 4.358 10 10 IICE Cc1cc(CNC(=O)CCC(=O)Nc2nnc(C(C)C)s2)c(C)n1-c1ccccc1 1631793918 LLZHUIASGZMCPL-UHFFFAOYSA-N 425.558 4.104 10 10 IICE CC(C)(C)OC(=O)N1c2cc(O)ccc2C[C@@H]1C(=O)NCc1c(O)ccc2ccccc12 1635968467 BEODFFZVEVCLGV-OAQYLSRUSA-N 434.492 4.234 10 10 IICE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)NCc1ccc(N2CCCCC2)cc1 1638694286 UDSWHFMHMRMOPK-KRWDZBQOSA-N 436.581 4.264 10 10 IICE Cc1cc(C(=O)N2CCN(c3cccc(Br)c3)CC2)c(C)n1-c1ccccn1 1640457208 SOVOLCHEGOAWFV-UHFFFAOYSA-N 439.357 4.214 10 10 IICE Cc1cc(C(=O)N2CCC3(CCCC3=O)CC2)c(C)n1-c1ccc(Br)cn1 1641426607 QMQHUVFPKWYDJN-UHFFFAOYSA-N 430.346 4.227 10 10 IICE Cc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(C)n1Cc1ccccc1 1642297778 PMUYPDXBGXJURK-UHFFFAOYSA-N 439.506 4.198 10 10 IICE COc1ccc(N2CCN(Cc3cc(Cl)ccc3Br)CC2)c(OC)c1 1644225433 LCVQIIBISGANCT-UHFFFAOYSA-N 425.754 4.442 10 10 IICE CCCCNC(=O)OC[C@H]1CCCCN1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1682101219 MYQKTULANLQKOM-SIKLNZKXSA-N 432.609 4.082 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@H]1COC(=O)N1CCCCC1 1686826377 GZINCSPCNFMNOW-OFNKIYASSA-N 444.620 4.179 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1cccc(Br)n1 1696699880 MBYFZVPGULAUHD-UHFFFAOYSA-N 430.350 4.123 10 10 IICE CO[C@@H](Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 1697173623 OSLLPFOSPNDEBY-QFIPXVFZSA-N 443.636 4.011 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1698335716 YZKYPZJKWKAGBE-ROUUACIJSA-N 425.602 4.329 10 10 IICE Cc1cnn([C@H]2CCCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)c1 1707701025 AXVDQEOOUGUKFS-IBGZPJMESA-N 439.583 4.175 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnn(C)c2)nnc1N1CC=C(C(C)(C)C)CC1 1724236827 WSIXOHMHQDGZGT-UHFFFAOYSA-N 433.604 4.284 10 10 IICE CCc1cnc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)s1 1727437633 HTCXAFOHJIFPNS-UHFFFAOYSA-N 440.960 4.403 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC4(CCOCC4)C3)nnc2C(C)(C)C)cc1 1728383628 QPAJTMMMDBAFHW-UHFFFAOYSA-N 425.621 4.477 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1731034606 NDDZITLFQALNMN-ZWKOTPCHSA-N 425.602 4.329 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1765510998 KLJXNICQJBSZMQ-QGZVFWFLSA-N 432.576 4.154 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CC[C@H](F)C3)CC2)cc1F 1768704581 KCKSNADEJJUOFZ-MSOLQXFVSA-N 433.547 4.089 10 10 IICE CN(CCC(F)(F)F)c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1768831240 PXYRRUUCCVNTTE-CYBMUJFWSA-N 435.541 4.200 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc3c(c2)C(=O)N(CCCc2ccccc2)C3=O)c1 1873894713 WELCCLAFDIRQIM-UHFFFAOYSA-N 427.504 4.234 10 10 IICE COCCNCc1ccc(N(C)C2CC(OCc3ccccc3)C2)c(Br)c1 2156436944 NEGGVXIWZFVTFY-UHFFFAOYSA-N 433.390 4.369 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc2c(c1)CCCN2Cc1ccccc1 2296193983 YPCXQYSJFAIFCG-UHFFFAOYSA-N 443.547 4.434 10 10 IICE O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1ccc(-c2ccc(Br)cc2)o1 2297559939 WZOYVIZKGZTZMW-UHFFFAOYSA-N 437.249 4.376 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OC(=O)c1ccc([N+](=O)[O-])c(C)c1 2313517618 WABFJNSEFIDWTL-UHFFFAOYSA-N 444.490 4.010 10 10 IICE Cc1ccc(CN(C)C(=O)CCCCNC(=O)OC(C)(C)C)c(O)c1Br 2352672392 NCOMTZRMARJFIV-UHFFFAOYSA-N 429.355 4.117 10 10 IICE Cc1ccc(CNC(=O)[C@H]2C[C@@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380747859 YBGNRYJHLWHYJR-SWLSCSKDSA-N 441.366 4.115 10 10 IICE Cc1cc(/C=C2\SC(=S)N(CCCN3CCOCC3)C2=O)c(C)n1-c1ccccc1 28964252 WZYBHPQCOVKBDE-PGMHBOJBSA-N 441.622 4.018 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3ccc(OCc4ccccn4)cc3)CC2)cc1 110360022 FRKUBKPIXFLYMB-VGOFMYFVSA-N 443.547 4.468 10 10 IICE CCCN[C@@H]1C(=O)Nc2cc(N(CCOC)Cc3ccccc3)c(Br)cc21 384361168 MWTNDRDTOICZBV-FQEVSTJZSA-N 432.362 4.095 10 10 IICE O=C(Nc1ccc(Br)cc1)C1CCN(Cc2cc3c(cc2O)CCC3)CC1 738116977 KNNCKABJYOAPJP-UHFFFAOYSA-N 429.358 4.494 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cc4c5c(c3)CCC(=O)N5CCC4)n2)cc1 758384200 LGSNSALNVNLCLC-UHFFFAOYSA-N 439.562 4.145 10 10 IICE Cc1ccc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)cc1C(=O)N1CCOCC1 786120052 FZMQMHAPTJPRJA-UHFFFAOYSA-N 449.507 4.000 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC12CCC(C(F)(F)F)(CC1)CC2 787000836 REUNTXVVHVLUQN-UHFFFAOYSA-N 443.485 4.241 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H](c1cc(F)ccc1F)C(F)F 788755446 LAUJELOHFXFNOS-GOSISDBHSA-N 427.467 4.324 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1nnc(Cc2ccccc2F)s1 806263655 SRVYABJGOPHWND-UHFFFAOYSA-N 437.294 4.058 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3CCN(c4ccccc4Cl)C3)cc2F)C[C@@H](C)O1 1125187540 GIPWMPBZHUHJTG-ZHALLVOQSA-N 445.966 4.235 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(Cn2cc(Br)cn2)s1 1126082355 KWDIJNVDPRQLQW-UHFFFAOYSA-N 433.375 4.060 10 10 IICE COC(=O)Nc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)c1 1126583769 UGRIWWVMEUQLCK-INIZCTEOSA-N 433.455 4.174 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(Br)cn1 1135495772 UAROYMOLKOGGQK-UHFFFAOYSA-N 439.357 4.214 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CSCc2cccs2)NC(=O)OC(C)(C)C)cc1 1136903853 NMSISBCPAWCVCS-LJQANCHMSA-N 449.642 4.430 10 10 IICE CCOc1ccc(NC(=O)c2ccc(NC(=O)CN[C@@H](C)c3ccccc3O)cc2)cc1 1175418605 MBCXBBYGKIUZDF-KRWDZBQOSA-N 433.508 4.333 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)c(C)o1 1234325758 GNZYTXCJDVPJLE-UHFFFAOYSA-N 448.567 4.408 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H]3CC[C@H]2C3)n1Cc1ccc(N(CC)CC)cc1 1292030165 NHOLZKJNYBYZQJ-UGKGYDQZSA-N 438.620 4.080 10 10 IICE O=C(NCCCSc1nccs1)c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1 1292997779 QFBNSNRCSKGLDH-UHFFFAOYSA-N 439.541 4.442 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3cc(C(F)(F)F)cc(Cl)n3)CC2)cc1 1295275177 JDRAQKDIWJDLBZ-UHFFFAOYSA-N 427.854 4.044 10 10 IICE COc1ccc(C(=O)N2CCC(C(=O)N[C@@H](C)c3ccccc3O)CC2)c2ccccc12 1302532973 XMEYRSIUJIRBDX-KRWDZBQOSA-N 432.520 4.284 10 10 IICE CC(C)c1nnc(N2CCC(C(=O)C(F)(F)F)CC2)n1Cc1ccc(N(C)C)c(F)c1 1302606281 AJRBTJADADDUHH-UHFFFAOYSA-N 441.473 4.003 10 10 IICE CC(C)CCN(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1303050969 YDHOKHXKQBRALQ-UHFFFAOYSA-N 427.637 4.216 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCCN(CC(C)C)C1 1306078455 VIFSBUJUBCYEFZ-HSZRJFAPSA-N 438.664 4.445 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C[C@@H](C)O1 1306397388 MLWFEHFXJZMOFP-NQIIRXRSSA-N 437.588 4.127 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1 1315775689 NLKKPPDHQQSGHI-UYAOXDASSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)CC2)cc1 1356445532 JUWRCHUDMSVEOI-UHFFFAOYSA-N 446.507 4.178 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(F)c(F)cc3Br)CC2)cc1 1446418581 XWWFOZRXOYUFIA-UHFFFAOYSA-N 425.273 4.088 10 10 IICE CC[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)/C=C\c1cncc(C(=O)NC)c1 1458252721 LZZQJKNJYVTPHI-RYGYDFEPSA-N 432.568 4.203 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cnn1-c1cccc(C)c1 1461976026 DVPHECOFIPUGPM-UHFFFAOYSA-N 448.567 4.113 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](CCNC(=O)OC(C)(C)C)C1 1470556558 XILSXNPMRMMVCV-PMACEKPBSA-N 446.636 4.328 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4cc(Br)cc(F)c43)C2)cc1 1470594100 RJEOBCSXGSUAMT-AWEZNQCLSA-N 448.336 4.195 10 10 IICE C[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1O 1471193403 DRZMPOPEGYBXAV-CYBMUJFWSA-N 437.418 4.413 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)C12CCC2 1474210365 XYAMFPHGDPESGU-HNNXBMFYSA-N 429.330 4.316 10 10 IICE COCC[C@H](Cc1cccc(Br)c1)C(=O)Nc1c(Cl)ccc2nonc12 1520358417 BYMQUVKEGIFCRP-GFCCVEGCSA-N 438.709 4.473 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CN3Cc4ccccc4OC3=O)cc2Cl)C1 1524703466 LVIIRROPGIMDSL-INIZCTEOSA-N 427.932 4.207 10 10 IICE CN(C)c1ccc(CNC(=O)c2nc(-c3cccs3)n(-c3cccc(F)c3)n2)cc1F 1528620120 RJOWUMDEGFWENV-UHFFFAOYSA-N 439.491 4.270 10 10 IICE COc1ccc(F)cc1CN1CCN(C(=O)c2sccc2-n2c(C)ccc2C)CC1 1539075120 FEAJAVWSDZEPFT-UHFFFAOYSA-N 427.545 4.261 10 10 IICE O=C(N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cc2cc(O)c(O)cc2s1 1543352499 WRBDCIMWHUKOOS-HNNXBMFYSA-N 434.920 4.499 10 10 IICE CNC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(C)c1 1544057600 YIIWJJLLDUZOJB-UHFFFAOYSA-N 441.329 4.172 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3c[nH]c4cccc(Br)c34)CC2)cc1 1545931391 HGEQIHASGVEWDX-UHFFFAOYSA-N 442.357 4.220 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 1557084812 PFIUDTKUOWFARN-UHFFFAOYSA-N 445.319 4.251 10 10 IICE Cc1ccc(-n2cnc(=O)n2CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)cc1Cl 1559421619 QRQNGULBGBOYKD-UHFFFAOYSA-N 438.890 4.425 10 10 IICE Cc1cc(C(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c(C)n1-c1ccc(F)cc1 1565604965 DOGIKARLJRIEDJ-JOCHJYFZSA-N 440.588 4.013 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cn4cc(Br)ncc4n3)c2C)cc1 1567877786 RMCSXYWSIODPSU-UHFFFAOYSA-N 440.301 4.160 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCCN(C(=O)OC(C)(C)C)C3CC3)ccc21 1570654302 KCXZWKIXQHSJPT-UHFFFAOYSA-N 443.588 4.424 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Cl)c(Br)cc2F)cc1 1585448822 AVIHWTJOVOIYPC-UHFFFAOYSA-N 429.717 4.459 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccc(Cl)cc4)cn3)cc2)CC1 1598277784 YETFLVOQIUUIGL-UHFFFAOYSA-N 436.943 4.209 10 10 IICE Cc1cc2c[nH]nc2cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1611505666 ZISXTAKNDQAJNT-GIJQJNRQSA-N 440.525 4.240 10 10 IICE Cc1cc(C)n([C@H]2CCCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)cc3C)C2)n1 1612472636 ASMDBULJMFSSGR-QHCPKHFHSA-N 435.620 4.479 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCOC[C@H]1C 1613295983 TWCILCXKWXNUKH-HBMCJLEFSA-N 441.620 4.190 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1613390501 UOHJOGHDLHTQLE-GOSISDBHSA-N 446.603 4.402 10 10 IICE CC(C)Oc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)ccc1Br 1618643746 NPDZPQVRGVUCOK-FQEVSTJZSA-N 448.405 4.335 10 10 IICE Cc1ccc(CN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC(C)C)c(C)c1 1618760524 HMTRHDVZTGJYKY-UHFFFAOYSA-N 441.591 4.054 10 10 IICE CO[C@@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)Cc1ccccc1 1624529641 JVBNKAARVYKORX-LJQANCHMSA-N 442.357 4.239 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](c2ccccc2)c2cnn(C)c2)cc1 1625045022 WBQMGPFAMFGKAU-AREMUKBSSA-N 426.520 4.088 10 10 IICE CN(c1ccc(CNC(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc1)C1CCCCC1 1625905693 ZKMIWQARMAXYON-DEOSSOPVSA-N 433.568 4.421 10 10 IICE CCC[C@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 1625951449 BHYBWFUUVXVGTF-QHCPKHFHSA-N 429.992 4.171 10 10 IICE CCOC(=O)COc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1631482894 KBYWTKAHWBQHLR-UHFFFAOYSA-N 434.492 4.409 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2NC(=O)CO3)c(C)n1-c1cccc(Br)c1 1643342944 QKSXZVPVQQEKLK-UHFFFAOYSA-N 440.297 4.440 10 10 IICE CCc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1O 1645936979 IAAHTTCNNSIKER-SFQUDFHCSA-N 430.526 4.324 10 10 IICE Cc1cc(CNC(=O)N[C@H](Cn2ccccc2=O)c2ccccc2)c(C)n1-c1ccccc1 1680556518 MYCIBNYYEAMCOE-RUZDIDTESA-N 440.547 4.497 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)C[C@H](O)Cc3ccccc3)cc2Cl)C1 1682023110 ALRYTMYCWBEFHR-WIYYLYMNSA-N 429.992 4.321 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@H](C)c3ccc(Br)cc3)CC2)cc1 1685448061 VVMZYRTYYITOOG-KRWDZBQOSA-N 446.389 4.483 10 10 IICE C[C@H](NC(=O)NC[C@@](O)(c1ccc(Cl)cc1)C(F)(F)F)c1ccc(N(C)C)cc1 1686174085 WSKOTEHTRABRQO-ORAYPTAESA-N 429.870 4.216 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](OCC3CC3)c3ccc(Cl)cc3)C2)cc1 1686425916 LZICIAZMSPFSMV-NZQKXSOJSA-N 443.975 4.394 10 10 IICE COc1ccc([C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C2CCC2)cc1 1687757846 ZCRFQQODGRYMJX-RUZDIDTESA-N 437.584 4.245 10 10 IICE Cc1nnc(N(C)C2CCN(Cc3ccccc3)CC2)n1CCCSc1nccs1 1693455628 MHVNRKYZBNKOKC-UHFFFAOYSA-N 442.658 4.326 10 10 IICE CCO[C@@H](CCn1c(CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1)C(C)C 1696017323 NBHIRRSEQVMGCK-QFIPXVFZSA-N 429.609 4.017 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)CC[C@@H]1C 1705895559 LAOXBRIRIFSWQK-MOPGFXCFSA-N 446.599 4.280 10 10 IICE CCN(CC)C1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)cc2C)CC1 1710041008 PUMZXJDIBHMPDN-UHFFFAOYSA-N 426.653 4.309 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC1CC1 1764561158 RQRNUSGQRIKIMI-UHFFFAOYSA-N 434.588 4.115 10 10 IICE O=C(Nc1nnc(C2=S=CC=C2)s1)c1c2c(nc3ccc(Cl)cc13)CCCC2 1859656734 ZCUSHUAWPMZDDD-UHFFFAOYSA-N 426.954 4.497 10 10 IICE CCCOc1cccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCC(=O)N4C)C2=O)c1 1860087737 QUVWNMSCLJGJBP-YBFXNURJSA-N 440.546 4.236 10 10 IICE COc1cc(/C=C/C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(OC)c1OC 1861863487 SJTKHYYZWMAAGT-VAWYXSNFSA-N 443.455 4.140 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(-c5ccccc5OC)[nH]c4c3)CC2)cc1 1861868236 RVJYKTISGGDILH-UHFFFAOYSA-N 442.519 4.210 10 10 IICE CCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccccn2)C1=O 1873164550 HCKFVCNCDHNDIA-UHFFFAOYSA-N 428.536 4.159 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](C)c1ccccc1O 2060114831 GZOUKNYHEFYYBB-SPEDKVCISA-N 442.556 4.410 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C2CC2)c(CN)c1I 2079978508 BGQHWWCJSWNDLM-OAHLLOKOSA-N 425.314 4.146 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)cc(Cl)c1OC(=O)c1ccccc1 2297347521 DJXQZCQXYUXKAZ-UHFFFAOYSA-N 437.839 4.018 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(CCc3ccc(O)cc3)C2=O)c1)C(=O)O 2314930495 FCFCUUWRSTWRKE-SFHVURJKSA-N 443.546 4.078 10 10 IICE CCOc1cc(C=C2C(=O)N(c3ccc(C)cc3)N=C2C)ccc1OCC(=O)N(CC)CC 2332139818 VZHMRUAZVPPVPR-UHFFFAOYSA-N 449.551 4.447 10 10 IICE CCc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)cc1 2224090 VTVILJKIRYYLAQ-CPNJWEJPSA-N 431.404 4.084 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478427 XQUBCKFRSLPEOD-KHCICDEESA-N 434.540 4.493 10 10 IICE C[C@H](Oc1ccc(-c2cnc3ccccc3n2)cc1)C(=O)NCc1ccc(N(C)C)cc1 65031768 QZBITLQQIIHFBI-SFHVURJKSA-N 426.520 4.447 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3c(C)nn(-c4ccccc4)c3C)CC2)cc1 108431259 CGJXTRLXBIRMIV-CCEZHUSRSA-N 430.552 4.250 10 10 IICE Cc1ccc(N=Nc2cc(C)ccc2NC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 255379761 FJWWOGGCKSBMAG-BSWISCRUSA-N 428.492 4.464 10 10 IICE O=C(O)/C=C\c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c(Br)c1 705929621 GUFTVCVQXIEFBT-HTYVVJRYSA-N 427.342 4.115 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 758179068 OJQQVZLYGWEKSV-FCHUYYIVSA-N 445.604 4.003 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCN(C)[C@@H]3c3ccc(Cl)cc3)CC2)cc1 760368195 DJNMHCGILOZRIY-DHIUTWEWSA-N 442.991 4.062 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)Cc2ccc(CN(C)C)cc2)C1 769921714 SYVVDVFIGSCSQG-UHFFFAOYSA-N 432.612 4.128 10 10 IICE Cc1ccc(Oc2ccc(NC(=O)NCc3cc(Br)ccc3O)cc2)nn1 806302842 MMUFNGNHHCZNQE-UHFFFAOYSA-N 429.274 4.367 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CSc3ccc(Br)cc3C)C2)cc1 1130826711 HPOITSTWKBURKF-MRXNPFEDSA-N 435.387 4.253 10 10 IICE CC(C)Cn1ncc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1-c1ccccc1 1134686117 ASYWXOWFRCKWPR-XMMPIXPASA-N 433.600 4.305 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@@H](CC(C)C)c3ccc(Cl)cc3)CC2)cc1 1136454389 WDZRIGMIRSWQSK-DEOSSOPVSA-N 444.019 4.417 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(C)CCCN3C(=O)c4ccccc4C3=O)c2C)c1 1142789703 JYMPALDNZCQCQW-UHFFFAOYSA-N 429.520 4.161 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1180410831 RIIHEYVKYTZWIJ-VSRDTVRMSA-N 433.335 4.410 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)c2csnn2)sc(C)c1-c1ccccc1 1195241838 OMKOFLXJGDAJLB-GFCCVEGCSA-N 430.555 4.041 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H]4[C@H]3CCN4C(=O)OC(C)(C)C)cc2)CC1 1197146308 PXPCKGUPGIURAJ-PKTZIBPZSA-N 429.605 4.276 10 10 IICE CC(C)Oc1ccc([C@@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)N(C)C)cc1 1229503504 MGHVZMFZCNOGBG-HSZRJFAPSA-N 425.573 4.160 10 10 IICE C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229782674 YNIOKQHIGZMLJF-JTSKRJEESA-N 429.511 4.279 10 10 IICE O=C(NCc1cccc(Br)c1O)NC[C@@H]1CCN(c2ccccc2Cl)C1 1252900941 LHIVKFAKNLXOGH-ZDUSSCGKSA-N 438.753 4.134 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCO[C@@H]2C(C)C)cs1 1290392774 QQTKQVFHWJYDBT-XMSQKQJNSA-N 441.601 4.037 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2nccn2-c2cc(C)cc(C)c2)cc1 1300280181 MEKDZOMCQPEZIK-UHFFFAOYSA-N 438.597 4.185 10 10 IICE Cc1cc(-c2nnc(N3CCN(C)C(=O)[C@H]3C)n2CCCC(C)C)c(C)n1-c1ccccc1 1304195251 AQLNXKZFPLPGBC-OAQYLSRUSA-N 448.615 4.456 10 10 IICE CC[C@H](C)c1nnc(N2CCOC(C)(C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1305551783 HRQPMUDJPJIUOD-RBUKOAKNSA-N 443.661 4.397 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)NCCOc1cccc(Cl)c1 1307541985 XMVKRGPAYQXWPM-UHFFFAOYSA-N 428.838 4.186 10 10 IICE CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1312524448 GHSSSUODOZLADV-QUCCMNQESA-N 426.561 4.150 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4ccn(C)n4)CC3)cc2Cl)C1 1312590228 JFRPNXYKZMCPNM-QGZVFWFLSA-N 429.996 4.399 10 10 IICE FC(F)[C@H]1CCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1316516170 IPDXOTFUSYNJSY-HNNXBMFYSA-N 436.557 4.461 10 10 IICE CC(C)CCN1CCC(Cn2c(CC3CC3)nnc2N(C)Cc2ccccc2O)CC1 1359947991 GWAQLCFPWJVWEJ-UHFFFAOYSA-N 425.621 4.331 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc3c(s2)CN(C(=O)OC(C)(C)C)CC3)cc1F 1442476312 UVUAZWLCJQSLPD-UHFFFAOYSA-N 433.549 4.176 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCCc2cc(N)n(-c3ccccc3)n2)c1 1444438357 XMWYSRWNTVTRNG-UHFFFAOYSA-N 441.535 4.037 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1[C@H]2CCCC[C@H]2CCN1C(=O)OC(C)(C)C 1449119942 LJTXSGUXZYAEMN-ZWOKBUDYSA-N 437.577 4.310 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)Cc3ccccc3Cl)CC2)c(C)n1-c1ccccc1 1464498918 PGDVXZIUFHDXAT-UHFFFAOYSA-N 449.982 4.204 10 10 IICE O=C(CCC[S@@](=O)c1ccc(Br)cc1)NCc1cc(Cl)ccc1O 1469873653 DTABTXINFRGFIW-XMMPIXPASA-N 430.751 4.012 10 10 IICE COc1cccc(CNC(=O)N[C@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)c1O 1478969194 DTZGELSJUXSNQX-SFHVURJKSA-N 427.501 4.235 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N(C)CCc2nccs2)cc1F 1503393648 OEVILBPGTXZKIV-UHFFFAOYSA-N 428.581 4.325 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc(C)o4)n3CC(F)(F)F)CC2)cc1 1518308949 NHGBIJFXCZNEDY-UHFFFAOYSA-N 435.450 4.134 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)cc2Cl)C1 1519551820 PUFGHTXYLJSIHX-HNNXBMFYSA-N 430.936 4.481 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@@H]32)sc2c1CC[C@H](CC)C2 1523797599 UQDZFMKBHZCSQT-XOSAIJSUSA-N 432.586 4.073 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H](CCC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1529803980 LZDDNCGGEKSPNF-NRFANRHFSA-N 433.593 4.110 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3F)C2=O)cc1 1531594378 KTRJXHDXXOFXCG-FQEVSTJZSA-N 425.891 4.422 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)/C(=C\c1ccccc1)C(F)(F)F 1535346759 ZAVOGGNLDCRNFE-MHWRWJLKSA-N 426.385 4.064 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4cccs4)s3)CC2)cc1 1542431906 LLDZLYRYMZFDOI-UHFFFAOYSA-N 427.595 4.037 10 10 IICE CCC(C)(C)C1CCC(NC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 1543158632 FAGWYTPYCCIXAS-CCEZHUSRSA-N 441.616 4.011 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1CC(CC)(CC)NC(=O)OC(C)(C)C 1546420776 GOAFAHRSNAKMFH-UHFFFAOYSA-N 431.581 4.266 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1546872409 QOGZMGFPCAFZPT-GOSISDBHSA-N 429.584 4.442 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@H](C)Cc1ccsc1 1559778596 WBBZYASWTRRIDI-QRVBRYPASA-N 447.620 4.070 10 10 IICE O=C(NCc1ccc(OCc2ccccc2)cc1)NCc1ccc(N2CCC(O)CC2)cc1 1565126837 DJXINIXNJGOHBM-UHFFFAOYSA-N 445.563 4.226 10 10 IICE Nc1c(I)cc(F)cc1C(=O)Nc1cccc(N2CCCCC2)c1 1583412388 DWFNHCHKIWUABX-UHFFFAOYSA-N 439.272 4.255 10 10 IICE CN(c1ccc(CNC(=O)c2nn3c(c2Br)CCC3)cc1)C1CCCCC1 1583704714 RDIMOUXSHNBTDD-UHFFFAOYSA-N 431.378 4.291 10 10 IICE CCc1c(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)nnn1-c1ccc(OC(C)C)cc1 1585264529 TUPLDBUPCKYGRO-LJQANCHMSA-N 449.599 4.352 10 10 IICE Nc1c(Br)cc(Cl)cc1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1597088798 AYOLTFXSMVBNIX-AWEZNQCLSA-N 439.737 4.212 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CC1([S@](C)=O)CCC1 1617893152 IKVCOBIGYBBGEG-HKBQPEDESA-N 443.661 4.113 10 10 IICE CC(=O)N1CCc2cc(NCc3cc(Br)cc(Br)c3O)ccc21 1620733674 OZYVRJZWBCXPOP-UHFFFAOYSA-N 440.135 4.438 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)Cc3ccccc32)cc1F 1625952329 XVASSKRMMPUEED-LJQANCHMSA-N 427.520 4.042 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cn3c(SC(F)F)nc4ccccc43)C2)cc1 1630614156 JHHCRGSZTNOSPL-HNNXBMFYSA-N 446.523 4.002 10 10 IICE Cc1nc(O[C@H](C)C(F)(F)F)ccc1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631219153 OGKMHCDURPPGCD-WBVHZDCISA-N 438.446 4.247 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](Cc3ccccc3)[C@H](O)C(F)(F)F)ccc21 1633190436 YQMDFWSXWJUUEF-UNMCSNQZSA-N 448.485 4.169 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(-c2cnn(C)c2)c1 1634380680 BJHAPIPYOYHFRU-UHFFFAOYSA-N 434.540 4.089 10 10 IICE Cc1cc(C(=O)NCCCN2C(=O)COc3ccccc32)c(C)n1-c1ccc(Cl)cc1 1634851299 IZMVNJBCXLVIET-UHFFFAOYSA-N 437.927 4.293 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cc(C(F)(F)F)cc(Cl)n3)C2)cc1 1636354316 XEGRNYQHWXSJMI-CYBMUJFWSA-N 442.869 4.088 10 10 IICE CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1637133680 HGTGTZBHDUBSPD-KRWDZBQOSA-N 425.312 4.266 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3ccccc3F)CC2)N(C)C)cc1 1638917580 ISLOPYIRTWYWRO-DEOSSOPVSA-N 426.580 4.159 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCCCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)C1 1644796021 OKZYICUKUIRICR-JOCHJYFZSA-N 429.521 4.102 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@@H](CC(C)C)C(N)=O 1648494034 RHXMBSYXTPTVAD-OALUTQOASA-N 435.490 4.446 10 10 IICE NC(=O)[C@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1ccccc1Cl 1655149869 ZCNKLCUMKCKDTF-KRWDZBQOSA-N 437.883 4.235 10 10 IICE CCOC(=O)c1sc2nc(C)cc(C)c2c1NC(=O)CN(C)c1ccc(OC)c(F)c1 1657676051 QSIQCPUIMLJXOW-UHFFFAOYSA-N 445.516 4.312 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc(F)c(F)cc2Br)cc1 1682363256 NHDGTECOGKOEBC-UHFFFAOYSA-N 442.304 4.014 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCc1c[nH]c2c(Cl)cccc12 1683134070 CSOSOGSLZTVSMZ-UHFFFAOYSA-N 426.948 4.042 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@](C)(OC)C2)cc1 1710026244 BIFLEMAOGRVWCA-DHLKQENFSA-N 441.620 4.420 10 10 IICE CC[C@H](C)c1nnc(N2CCC(CNC(C)=O)CC2)n1Cc1ccc(N(CC)CC)cc1 1726934496 BHAGKSAZXUZIEL-IBGZPJMESA-N 440.636 4.039 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1727046109 RBUBLKGJIUZHOQ-HOYKHHGWSA-N 447.599 4.054 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)CC2CC(F)C2)cc1F 1768494637 KQXIWOCDUJWOOU-UHFFFAOYSA-N 446.933 4.431 10 10 IICE O=C1C(=Cc2cc3ccccc3nc2N2CCOCC2)SC(=S)N1C1CCCC1 2040503244 REQYYYMLFQTBLZ-UHFFFAOYSA-N 425.579 4.215 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C(C)(C)C)c(I)c1CN 2079953762 YTOSHXYKTBJTSY-KRWDZBQOSA-N 441.357 4.467 10 10 IICE CC(C)(C)OC(=O)NCC[C@H]1CC[C@H](NCc2cc(Br)cc(F)c2O)C1 2098526362 WISGEQKAQXHWGE-DOMZBBRYSA-N 431.346 4.467 10 10 IICE Cc1cccn2c(=O)c(C=C3SC(=S)N(CCc4ccccc4)C3=O)c(Cl)nc12 2295927427 IEAZILZEGJBHQJ-UHFFFAOYSA-N 441.965 4.100 10 10 IICE CCN1C(=O)C(=C2SC(=S)N(Cc3ccco3)C2=O)c2cc(Br)ccc21 2296711269 ILLGGPXKVAGYKF-UHFFFAOYSA-N 449.351 4.180 10 10 IICE COc1ccccc1-n1c(C)cc(C=C2C(=N)N3N=C(SC)SC3=NC2=O)c1C 2297470067 XUUCBDBMKQEFQN-UHFFFAOYSA-N 425.539 4.042 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)N(C)C)cc1 2318684043 NYBULIJBRKYUDG-GOSISDBHSA-N 443.550 4.108 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)[C@](C)(NCc2cc(Br)cc(F)c2O)C1 2336508026 JBJZGILRVXDPAV-MRXNPFEDSA-N 439.272 4.028 10 10 IICE Cc1ccc(CNC(=O)CC(C)(C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2352932854 SAWJYQWYUINYOV-UHFFFAOYSA-N 429.355 4.115 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@H](c2ccc(Cl)cc2)N3)CC1 14465080 NTFMATRYGUUETK-QTEQDKRBSA-N 444.000 4.103 10 10 IICE COc1ccc(C(=O)Nc2cc(N3CCn4c(nc5ccccc54)C3)ccc2OC)cc1 19855473 XWUFHNXKZNVABV-UHFFFAOYSA-N 428.492 4.326 10 10 IICE CCOC(=O)c1cccc(-c2ccc(/C=C3/C(=N)N4C(SC)=NSC4=NC3=O)o2)c1 20154840 DUGDWUDUOJPGIJ-OIQQPNLJSA-N 440.506 4.063 10 10 IICE CCOc1ccc(/C=C2\C(=O)N(c3cccc(Cl)c3C)C(=O)N=C2O)cc1C(=O)O 33493087 OHFQISFDNRAWOW-UVTDQMKNSA-N 428.828 4.252 10 10 IICE O=C1N=C(N2CCC(Cc3ccccc3)CC2)S/C1=C\c1ccc(N2CCOCC2)o1 38704491 PEONMFWHQBXNMQ-FXBPSFAMSA-N 437.565 4.041 10 10 IICE CN(C)c1ccc([C@@H]2Nc3ccc(Cl)cc3C(=O)N2NC(=O)c2ccc(O)cc2)cc1 39919432 PQWOKJZQRVWPLR-OAQYLSRUSA-N 436.899 4.023 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1ccccc1SC[C@@H]1CCCO1 108192655 FJPNVXFSFBYLJH-FQEVSTJZSA-N 428.623 4.441 10 10 IICE Cc1cc2c(n1-c1cc(Br)ccc1I)CCC[C@H]2N 311559704 NZTBAAXDVFAMJT-CYBMUJFWSA-N 431.115 4.489 10 10 IICE COCc1cccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c1 729112781 JJZOMMAMFSVZNQ-UHFFFAOYSA-N 428.457 4.483 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1ccc(N3CCCC3)cc1)O[C@H](C)C2 730823762 OVMWXJHUOWXADB-FRGLQRNOSA-N 435.568 4.364 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2scnc2C2CC2)NC(=O)OC(C)(C)C)cc1 760624772 HYVQHRJXIAYEKZ-QGZVFWFLSA-N 430.574 4.082 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(n3cc(Br)cn3)CC2)c1 781908880 BAFAOPXJAVOCPP-UHFFFAOYSA-N 429.156 4.259 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](c3cnn(C)c3)C(F)(F)F)cc2Cl)C1 800565216 IMYMCOPJOHLGNE-ACJLOTCBSA-N 443.901 4.413 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1c1ccc(F)cc1 917642427 NIHONRYQPCRNBQ-YRNVUSSQSA-N 431.251 4.429 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCCSCc3ccccc3)cc2F)C[C@@H](C)O1 918187041 QHKNAXRWCRDYAL-HDICACEKSA-N 431.577 4.172 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2cccc(OC)c2)cc1 1125235078 JPHDNBLNJSFTIM-QFIPXVFZSA-N 441.572 4.424 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CSc3ccc(C(C)C)cc3)cc2F)CC1 1125907053 FTVSQIAYLMYNTB-UHFFFAOYSA-N 429.605 4.500 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccncc1 1126373568 FJTVEQBRGPPXRB-XIDKLXSXSA-N 429.542 4.080 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cn(-c3ccccc3)nc2C(C)(C)C)N(C)C)cc1 1134681872 KSNXSARMFABGDS-HSZRJFAPSA-N 433.600 4.269 10 10 IICE COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)C1 1136418341 FIYXOSDNNADCFR-GCJKJVERSA-N 439.600 4.221 10 10 IICE O=C1[C@@H](N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)CCN1CC(F)(F)F 1167680606 IBIFAKKDJHLMBP-QTWIXLPOSA-N 432.442 4.141 10 10 IICE Cc1ccc(-c2nnc(N3CCC(NC(C)C)CC3)n2Cc2ccc(N(C)C)cc2C)o1 1304314582 GMZWWEFEGCIPDU-UHFFFAOYSA-N 436.604 4.236 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1ccccc1)Cc1ccco1 1312834428 YMOZZSBYPKQALK-UHFFFAOYSA-N 441.478 4.306 10 10 IICE Cc1nc(N2CCCCC2)sc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 1324725071 OKLVMQQWCACZOU-UHFFFAOYSA-N 439.673 4.264 10 10 IICE C[C@H](NC(=O)CCCc1ccc(Br)cc1)c1ccc(N2CCOCC2)cc1 1357128305 LBQCLUFKZFFBJE-KRWDZBQOSA-N 431.374 4.486 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ncc(Cl)s1 1443963245 NYYDMHLRZAOKOE-YRNVUSSQSA-N 427.935 4.166 10 10 IICE COc1ccccc1NC(=O)c1ccc(NC(=O)CCN[C@H](C)c2ccccc2O)cc1 1460638942 QEUFASVLYXLPDK-QGZVFWFLSA-N 433.508 4.333 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1 1464505990 LNJBOSBJIHCMDT-HSZRJFAPSA-N 425.573 4.442 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2Cc3c(F)cc(C)cc3N2C(=O)OC(C)(C)C)c1 1465991298 AGMJUJUUCKIPPG-VBKZILBWSA-N 444.503 4.392 10 10 IICE O=C(CCC(=O)c1cc(Cl)sc1Cl)NCc1ccc(N2CCC(O)CC2)cc1 1470447299 FPMAGMDTQPITQA-UHFFFAOYSA-N 441.380 4.295 10 10 IICE CCO[C@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1502979518 ONNLOKUBGKWWPW-FQEVSTJZSA-N 429.584 4.270 10 10 IICE CN(CC1CCCCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1503540070 YQDPNDIOZIKWPP-UHFFFAOYSA-N 425.621 4.477 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1517899583 SIOLHAIQUVAMOA-QHCPKHFHSA-N 443.592 4.189 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCc3ccc(N(C)C)c(F)c3)cc2[N+](=O)[O-])C1 1519249831 UHMUJKUYDDNYIT-HZPDHXFCSA-N 428.508 4.212 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1 1520327391 NSBGLLDHZAHGSY-NRFANRHFSA-N 425.891 4.422 10 10 IICE C[C@@H](Cc1cccc(F)c1)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1528421591 WNXHAAICCDOPSE-AWEZNQCLSA-N 446.434 4.213 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(Cl)c(-n4cccc4)cc3OC)C2)cc1 1529404756 ZCFFYDSXZCPREV-KRWDZBQOSA-N 439.943 4.404 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cn2c(-c3ccccc3)nc3ccccc32)cc1 1530905177 KGEXXCVPASZDRW-UHFFFAOYSA-N 428.536 4.307 10 10 IICE CC(C)(C)Cc1nnc(N2CCO[C@H](C(F)(F)F)C2)n1CCCSc1nccs1 1541187833 WFRRIYMIPHNLAX-ZDUSSCGKSA-N 449.568 4.273 10 10 IICE Cc1ccccc1Cc1nnc(N2CCO[C@H](C)C2)n1CCCSc1nccs1 1542756750 LCFCLNNBTVDLPN-QGZVFWFLSA-N 429.615 4.041 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CC1 1564945417 AZYDKUAFVNXKFI-SFHLNBCPSA-N 446.636 4.375 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c(C)nc(C(C)(C)C)nc3SC)C2)cc1 1585665935 XBZJUFUKAICHCI-INIZCTEOSA-N 428.602 4.069 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCCS(=O)(=O)C[C@@H]2c2ccccc2)c1C 1598117504 XDUVNWKGVDFOPV-XMMPIXPASA-N 436.577 4.405 10 10 IICE Cc1ccc(C)c(C(=O)CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1622634814 JIQSGAIMZMGNHN-FQEVSTJZSA-N 428.960 4.406 10 10 IICE CCc1ccc(-c2cc(C(=O)N(CC(=O)OC)Cc3cc(Cl)ccc3O)no2)cc1 1623928018 BHWJGAMHAYFWFE-UHFFFAOYSA-N 428.872 4.078 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H]3CN(C(=O)OC(C)(C)C)CCCO3)c2C)c1 1623964422 OPGABDPNWQHRTF-NRFANRHFSA-N 441.572 4.158 10 10 IICE Cc1cc(C(=O)N2CCCc3c(cnn3C)C2)c(C)n1-c1ccccc1Br 1626436745 UYZBKOVNKUYNTJ-UHFFFAOYSA-N 427.346 4.179 10 10 IICE Cc1ccc(C(=O)N(C)[C@@H]2CCN(c3ccccc3F)C2=O)cc1-n1c(C)cc(C=O)c1C 1627689762 PMFNIWGMYUTFNA-HSZRJFAPSA-N 447.510 4.232 10 10 IICE Cc1cc(CC(=O)N[C@H]([C@@H]2CCCO2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1631196089 TWXYVAXCIWJQQN-JTHBVZDNSA-N 430.976 4.116 10 10 IICE Nc1cc(F)c(F)cc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1632697528 QNGHQXJNMBLADY-UHFFFAOYSA-N 436.506 4.164 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2ccncc2Cl)c(C)n1-c1cccc(Cl)c1 1635602471 RQXZPZZLHSYEOF-INIZCTEOSA-N 432.351 4.377 10 10 IICE O=C([C@@H]1CC(c2cccc(Cl)c2F)=NO1)N(Cc1ccco1)Cc1ccccc1O 1635647507 KWQQOWYZMKWBRR-FQEVSTJZSA-N 428.847 4.500 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C3(C)OCCO3)C2)c(C)n1-c1ccc(Br)cc1 1637040518 WSKXYNBMJYDNOV-QGZVFWFLSA-N 447.373 4.472 10 10 IICE Cc1ccc(NC(=O)C2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)nc1 1637582333 TWIAAEBTOWCGNI-UHFFFAOYSA-N 445.567 4.358 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](CO)Cc3cc(F)c(F)c(F)c3)c2C)cc1 1639748966 ZDMGJKZMNPKWRO-KRWDZBQOSA-N 446.469 4.101 10 10 IICE COCCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1640450768 JTXDBSFPNVFMFK-FQEVSTJZSA-N 426.479 4.229 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@H](O)COc1ccc(SC)cc1 1641892753 OWKDKLBJGREHDY-INIZCTEOSA-N 426.376 4.138 10 10 IICE Cc1ccc(CNC(=O)c2nnc(CN3CCCc4cc(OC(F)F)ccc43)s2)cc1 1642061025 JZCYKXTUQQJHLL-UHFFFAOYSA-N 444.507 4.331 10 10 IICE COC(=O)[C@H](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)CC1CCCC1 1653439634 BTQQHJBOFGJPMD-SFHVURJKSA-N 426.557 4.014 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC(C)(C)Cc3cccc(Br)c3)C2)cc1 1674326413 IZQFGUXKPFAWRB-GOSISDBHSA-N 446.389 4.357 10 10 IICE CN(Cc1ccccc1O)C(=O)NCc1ccc(Br)c(Br)c1 1676343757 YMCQLJKWAWQXTF-UHFFFAOYSA-N 428.124 4.259 10 10 IICE C[C@H](NC(=O)N[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1)c1ccc(N(C)C)cc1 1680281239 WQMDOJLDCLLWQH-FRYIKTPZSA-N 430.593 4.148 10 10 IICE Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1683195820 PGNDOTIQTDDASO-MJGOQNOKSA-N 429.511 4.197 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCN(c4c(Cl)cccc4Cl)CC3)C2)cc1 1683945279 QPQBFVIEGIEZGQ-INIZCTEOSA-N 449.382 4.113 10 10 IICE Cc1cc(CCNC(=O)N[C@H](CC(N)=O)c2ccccc2Cl)c(C)n1-c1ccccc1 1684318965 VBMGOAITARZAQE-JOCHJYFZSA-N 438.959 4.206 10 10 IICE Cc1ccccc1CN(Cc1cccnc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684607954 XVPDECFAYJUPIW-SANMLTNESA-N 445.611 4.471 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC2(c3cccc(Cl)c3)CCC2)N(C)C)cc1 1684768397 AGBJUBWSRILTPZ-QFIPXVFZSA-N 429.008 4.430 10 10 IICE CC(C)Cc1nnc(N2CCC=C(Br)C2)n1Cc1ccc2c(c1)CCCN2C 1692168993 VMDYIKLKGNEMET-UHFFFAOYSA-N 444.421 4.396 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCOC(C)C 1694129473 DJPDUKXJONBFEV-SFHVURJKSA-N 433.572 4.081 10 10 IICE CCCCN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1695192517 IRLSGHLBSPSODW-UHFFFAOYSA-N 427.637 4.360 10 10 IICE CCOCc1nnc(N2CCS[C@@H](C(C)C)C2)n1Cc1ccc(N(CC)CC)cc1 1696349684 BTAREBPEPFXODR-OAQYLSRUSA-N 431.650 4.287 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)C[C@H]1C(F)(F)F 1698448130 WVRYVELWROQOJG-MGPQQGTHSA-N 447.552 4.056 10 10 IICE CC(C)[C@@](C)(O)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706252018 RPBDFYSLXYNXDK-DHLKQENFSA-N 441.620 4.163 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CC(C)(C)OC(C)(C)C2)cc1 1710026544 KRIJUPCJIXEGGT-FQEVSTJZSA-N 441.620 4.070 10 10 IICE COCC(C)(C)Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1749282694 FLFQKYFDSRXNDN-UHFFFAOYSA-N 443.636 4.265 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OCCOC)C1 1765770693 XBFMSJQDHANCNR-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@@](=O)C(C)(C)C 1766389642 VBFCEOUIHFMTLD-SSEXGKCCSA-N 427.618 4.356 10 10 IICE CCOCc1nnc(N2C[C@@H](F)[C@@H](c3ccccc3)C2)n1CCCSc1nccs1 1766450001 LNDGAQLADDYTCG-QZTJIDSGSA-N 447.605 4.395 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)c1ccc(F)cc1 1857996905 NFYWFZNINQKNEN-UHFFFAOYSA-N 433.436 4.249 10 10 IICE C[C@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccccc1O 2025252383 SQEQCJIEUYFVEA-PZJWPPBQSA-N 425.573 4.164 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C(C)C)c(N)c2I)c(O)c1 2080005229 DLNWDQRHIBBAAO-INIZCTEOSA-N 429.302 4.153 10 10 IICE CC1=NN(c2ccc(I)cc2)C(=O)C1=Cc1ccc(N(C)C)cc1 2294746013 LFEZBFXYVDAKDJ-UHFFFAOYSA-N 431.277 4.163 10 10 IICE COc1ccc(OCCCOc2ccc(C=C3SC(=S)NC3=O)cc2OC)cc1 2297347310 BFVFLPOINKNCNW-UHFFFAOYSA-N 431.535 4.041 10 10 IICE COc1ccc(NC=C2C(=O)N(c3ccc(Br)cc3)N=C2C)c([N+](=O)[O-])c1 2297451622 IYXJUEVSNLRCKA-UHFFFAOYSA-N 431.246 4.084 10 10 IICE CC[C@@H](C)Oc1ccccc1C=C1SC(=S)N(NC(=O)c2ccc(OC)cc2)C1=O 2297561681 SMZFDYCPGXNEMF-CQSZACIVSA-N 442.562 4.419 10 10 IICE COc1cc(C=C2SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)ccc1O 2314828995 YBWNRJYBCHCAIP-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CCCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc4c(c3)OCCO4)SC2=S)cc1 2321591137 KZJBHABWURONCL-UHFFFAOYSA-N 441.530 4.430 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380737575 OZLIMUURGKRCDK-XOBRGWDASA-N 441.366 4.163 10 10 IICE CCOC(=O)[C@@H]1CCCN(c2cc(N3CCCC3)c3noc4c3c2C(=O)c2ccccc2-4)C1 9642139 QQFXHJOCYHWPFO-MRXNPFEDSA-N 445.519 4.419 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3C)C2)sc2c1CCCC2 15466102 ISAJAZGLEPZARZ-INIZCTEOSA-N 440.565 4.412 10 10 IICE CC(=O)N(C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)c1ccc(N)cc1 244159882 UXHXYQJEZKUEEN-UHFFFAOYSA-N 428.536 4.149 10 10 IICE COC[C@@]1(CNCc2cc(Br)ccc2O)CCCCN1C(=O)OC(C)(C)C 380353456 GCCNLDDXFDVKMS-FQEVSTJZSA-N 443.382 4.051 10 10 IICE O=[N+]([O-])[C@@H]1CCc2c(c(S(=O)(=O)O)cc(O)c2/N=N/c2c(O)ccc3ccccc23)C1 390822314 FEHJAXFOIHYSTA-AFRFTAIISA-N 443.437 4.047 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)CC(C)C)cc1F 731347147 MTQJUYZRAQYUBQ-DEOSSOPVSA-N 439.575 4.288 10 10 IICE CN1CCCC[C@H]1CN1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 731842348 CHZSQFMXESUAPU-DEOSSOPVSA-N 434.588 4.142 10 10 IICE COc1ccc(Nc2nc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cs2)cc1 743339701 VIRNMPLGWKGCIK-IBGZPJMESA-N 439.537 4.422 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)cc1 763565616 CLYANRGQSFFIJF-GHTZIAJQSA-N 432.609 4.320 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 764754875 BSBNGLOLYOTZPC-HSZRJFAPSA-N 437.588 4.054 10 10 IICE COc1ccc(Cn2nc(C)c(CNCc3ccc(N4CCC(CO)CC4)cc3)c2C)cc1 766417218 ZEJKRJLAEKPYTQ-UHFFFAOYSA-N 448.611 4.055 10 10 IICE C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 776417907 QTYJZDJNQSLRQT-MEDUHNTESA-N 446.381 4.173 10 10 IICE CCN1CCN(c2ccccc2N[C@H](C)c2ccc(N3CCOCC3)cc2Cl)CC1 777289510 DKVWSNWKOFRPBH-LJQANCHMSA-N 429.008 4.492 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc(C(F)(F)F)c1F 785598674 QJJQQBHONUUIKQ-UHFFFAOYSA-N 428.401 4.183 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccc(F)cc2)c1 792238329 PPVZQBKJBUYSGF-KUHUBIRLSA-N 432.492 4.026 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1C[C@H]1c1ccccc1 797784153 RRVGPNDSIOBSGK-TYUUCJPQSA-N 428.604 4.402 10 10 IICE Cc1cc(CC(=O)Nc2cnccc2N2CCN(C)CC2)c(C)n1-c1ccc(Cl)cc1 1125355071 HYHTYJCEQJXUOG-UHFFFAOYSA-N 437.975 4.076 10 10 IICE CC(C)(C)OC(=O)[C@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)(C)C 1125948372 LFLJENIWRCQPTB-SFHVURJKSA-N 440.531 4.377 10 10 IICE C[C@H](NC(=O)c1cc(Br)ncc1Br)c1ccc(N(C)C)cc1 1128135525 FNXCOPTVFHCSDL-JTQLQIEISA-N 427.140 4.164 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)c1 1135978611 RZFVPPZJKAAKMN-QHCPKHFHSA-N 430.483 4.299 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)c(C)n1-c1ccccc1 1136509391 MQYIWDSNIOCNFK-UHFFFAOYSA-N 435.955 4.275 10 10 IICE Cc1ccc(Nc2scnc2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 1136984967 VGUVFRRXOXWHTP-UHFFFAOYSA-N 440.544 4.225 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C 1140906099 KBTDSZFXOHDJGO-MSOLQXFVSA-N 429.520 4.003 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2cccc(OC(F)F)c2)cc1 1142713661 YHAIYWLOOXTABX-JOCHJYFZSA-N 432.511 4.494 10 10 IICE Cc1cc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C)n1-c1ccccc1 1147838431 WHKGZMJLVFBWSK-UHFFFAOYSA-N 431.580 4.162 10 10 IICE COC(=O)[C@](C)(NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1cccc([N+](=O)[O-])c1 1150780159 BCVISYWDEMUXEL-RUZDIDTESA-N 449.507 4.437 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(SC(F)(F)F)c1 1152401099 KKCGFPQOXUDPAZ-UHFFFAOYSA-N 433.835 4.473 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(-c2ccc(F)cc2)on1 1156288572 YQODASJUWXGILZ-UHFFFAOYSA-N 439.487 4.483 10 10 IICE CN(C)c1ccc2c(c1)OCCN2Cc1ccc(I)c(Cl)c1 1168858970 HZZATXLBHGKHIA-UHFFFAOYSA-N 428.701 4.410 10 10 IICE C[C@H](Cn1ncc2ccccc2c1=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1185839052 XOCISVLRUWHWCR-MRXNPFEDSA-N 428.448 4.036 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)cc1 1230857930 FXWONPVRNOHTOH-OAQYLSRUSA-N 448.567 4.345 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](COC)C1)OC 1292174885 OUJAFEVHLJQVPB-IFMALSPDSA-N 437.588 4.250 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1 1293284806 XZBACXMUOKEGEL-JOCHJYFZSA-N 441.572 4.115 10 10 IICE C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NCc2c(O)ccc3ccccc23)c1 1304089953 SIYNBSGRAWBMJX-KRWDZBQOSA-N 438.549 4.039 10 10 IICE Cc1ccccc1Cc1nnc(N2CCSCC2)n1CCCSc1nccs1 1304559662 JLLASIVJOHMNSA-UHFFFAOYSA-N 431.656 4.369 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N(C)C)cc1C 1316169738 IZVWQAAISLGKOU-HXUWFJFHSA-N 443.636 4.297 10 10 IICE CC(C)(C)OC(=O)c1ccccc1CC(=O)NCc1ccc(N2CCSCC2)cc1 1441628777 DOPMHJAXEOBYKJ-UHFFFAOYSA-N 426.582 4.054 10 10 IICE Cc1ccccc1Nc1scnc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1444853857 QTSKYHOVWFQEQE-UHFFFAOYSA-N 440.544 4.225 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CN(c2ccc(Br)cc2)C1=O 1450759403 CWKXICFJVKLZMK-INIZCTEOSA-N 444.354 4.063 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1451666069 HEFDCIMBDFJOET-QFBILLFUSA-N 439.547 4.001 10 10 IICE CCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1452001990 PWXBMKSSAAMVCH-HSZRJFAPSA-N 435.955 4.451 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1 1469838443 IYJRMBJYQBQRDV-RBUKOAKNSA-N 431.577 4.494 10 10 IICE COC[C@H](CNC(=O)NCc1cccc(Br)c1O)c1ccc(Cl)cc1 1478659906 HLDXABXACHKMBX-AWEZNQCLSA-N 427.726 4.038 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ccsc1 1512804372 KRPFWTLWVCZNEO-SFHVURJKSA-N 425.602 4.374 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cccn(CC)c1=O 1515531219 BMLAYCHQQYAPLY-UHFFFAOYSA-N 444.583 4.429 10 10 IICE CCCOc1cc(OC)ccc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1524058511 NGFMRNYRKXGYOY-MRXNPFEDSA-N 434.483 4.484 10 10 IICE CC(C)(COCc1ccccc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015530 TWZDYAJICJCIEO-UHFFFAOYSA-N 435.612 4.078 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(I)ccc1F 1528924122 JLHBLHXQTUNNNY-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)cc1 1539597851 LHNGWDHCSLIONS-UHFFFAOYSA-N 430.596 4.032 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1c(Cl)cc(F)cc1Br 1543809918 SBFZZNUSQNSZPX-UHFFFAOYSA-N 427.701 4.008 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@](C)(CC)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1545406210 WYBVJRKGSIDFAE-KOSHJBKYSA-N 429.584 4.442 10 10 IICE Nc1c(Cl)cc(Cl)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632276 HFAFHYXFKRORDF-AWEZNQCLSA-N 428.747 4.329 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1547482836 DAUMYKYEQPDBQS-HXUWFJFHSA-N 444.643 4.288 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C1 1548046869 LVYNRBWHVHLOCO-OAQYLSRUSA-N 437.588 4.129 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CC(N)=O)c3ccccc3Cl)c2C)cc1 1587425354 GQSYIRMFHLOMQQ-NRFANRHFSA-N 425.916 4.103 10 10 IICE O=C(N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)c1cc2cc(O)c(O)cc2s1 1595573262 QPHHFENVLXJLNB-KRWDZBQOSA-N 425.506 4.139 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1597774729 OKAHTBOZIQBMTK-OZXSUGGESA-N 435.568 4.150 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(NC(=O)OC(C)(C)C)c3)C2)cc1 1598362632 ATSLHBNVORJWSR-KRWDZBQOSA-N 425.529 4.299 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1 1624625861 FOWUEHPAYRQASR-HXUWFJFHSA-N 438.547 4.328 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)[C@@H]1Oc1ccccc1 1625824290 YXTAEPGYSFHJAW-GVAUOCQISA-N 432.520 4.261 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(CC(F)F)nc2C)cc1 1627425741 OPKZLCYJYZJKKR-UHFFFAOYSA-N 428.483 4.378 10 10 IICE Cc1cc(C(=O)N(Cc2cccnc2)C2CC2)c(C)n1-c1ccc(Br)cn1 1629428731 XOUQUKUBMDAZQF-UHFFFAOYSA-N 425.330 4.451 10 10 IICE C[C@H]1c2ccc(C(=O)NCc3ccc(N4CCCC4)cc3)n2CCN1C(=O)OC(C)(C)C 1629758971 ZLCSITKRKGJYDO-SFHVURJKSA-N 438.572 4.330 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 1635284203 KXZVRLWFEGTZHM-MJGOQNOKSA-N 436.961 4.263 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2cccc(O)c2)c(C)n1-c1cccc(C(C)C)c1 1636061604 SNKFDRVOMJZFOG-UHFFFAOYSA-N 433.552 4.473 10 10 IICE COC(=O)[C@](C)(Cn1cnc2ccccc21)NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1636116555 LVFAHYQFJNOWPN-SANMLTNESA-N 444.535 4.114 10 10 IICE COc1ccc(C[C@@H](C)CN(C)C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1636353494 CQTVMUZRKKUIPO-TZIWHRDSSA-N 425.573 4.050 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(N)c(OC(F)(F)F)c2)cc1 1639415368 SKSPJEBEPIYQCO-UHFFFAOYSA-N 435.368 4.438 10 10 IICE CSc1cccc(N2C[C@@H](C(=O)NCc3cc(Cl)cc(Cl)c3O)CC2=O)c1 1641997588 RVRYFEXWASFGKC-LBPRGKRZSA-N 425.337 4.090 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1653281444 NENMBCFKDMOSDA-UZKOGDIHSA-N 437.540 4.177 10 10 IICE CCOC(=O)c1sc2nc(C)cc(C)c2c1NC(=O)CN[C@@H](C)c1ccccc1O 1659815835 WCSYNFQELQZNBN-AWEZNQCLSA-N 427.526 4.085 10 10 IICE CCC(CC)(CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccc(F)cc1 1674702397 WHAGNRRMOWXFTB-UHFFFAOYSA-N 443.563 4.433 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 1676765258 BWYDLNAMCWIROA-LJQANCHMSA-N 432.609 4.321 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCCOCc3ccc(Cl)cc3Cl)C2)cc1 1680936024 OOFBIDCVHJHTJG-QGZVFWFLSA-N 438.355 4.097 10 10 IICE COc1ccc([N+](=O)[O-])cc1CNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1680941074 AFDWXODUEDOLPQ-OAHLLOKOSA-N 446.935 4.493 10 10 IICE COc1cc(CCCNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc(OC)c1O 1684232465 PMIIXZOEESYEHI-UHFFFAOYSA-N 441.572 4.174 10 10 IICE Cc1ccccc1C[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1686268228 ADXGGEDPGDNZSR-DYESRHJHSA-N 429.992 4.288 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1C[C@H](C2CC2)O[C@H](C)C1 1693004875 CRRLATDDECSAMT-XMSQKQJNSA-N 425.621 4.293 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1695619673 KNYBZALRMKWCJR-LJQANCHMSA-N 436.604 4.182 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC3(SC)CC3)CC2)cc1 1697470805 NXBSAVPRNSYEAJ-UHFFFAOYSA-N 429.634 4.197 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1nccs1 1708508469 HHQWQUYXRKXGLO-GOSISDBHSA-N 440.617 4.216 10 10 IICE CCOCc1nnc(N2C[C@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1729007894 ZOLSZBFVSKZXNB-FQEVSTJZSA-N 441.620 4.103 10 10 IICE CC(C)N1CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC1 1750905765 MUVAPMRHQLCOBY-UHFFFAOYSA-N 448.687 4.100 10 10 IICE Cc1cccc(CC2(O)CCN(c3nnc(C)n3CCCSc3nccs3)CC2)c1 1751628035 ITSHEAHQASVBGD-UHFFFAOYSA-N 443.642 4.108 10 10 IICE Cc1csc(CCCCn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)n1 1751744943 BJJMBOZHFWCQLS-UHFFFAOYSA-N 448.596 4.394 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCc2ccc(C)cc2)sc(C)c1-c1ccccc1 1860760193 VMWRAETWUMXZON-UHFFFAOYSA-N 436.533 4.464 10 10 IICE COc1ccc(C2=NN(CC(C)C)C(=O)/C2=C/c2cc(Br)ccc2O)cc1 1865672109 LKOLUUMOIHQDFI-WOJGMQOQSA-N 429.314 4.449 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](N)CC)sc(C)c1-c1ccc(Br)cc1 1865951269 LMEISYROGNDOOQ-ZDUSSCGKSA-N 425.348 4.339 10 10 IICE O=C(O)[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@@H]1c1cccc(O)c1O 1894492829 MREDBZWFRKONFP-NHCUHLMSSA-N 445.471 4.147 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(CCNCc2c(O)cccc2Br)C1 2140328796 IGERNQWZVGFKDO-VBKZILBWSA-N 425.367 4.282 10 10 IICE COc1ccc(Br)c(CNCc2ccc(NC(=O)OC(C)(C)C)nc2)c1O 2236055855 RYTHFDDROVWRHB-UHFFFAOYSA-N 438.322 4.195 10 10 IICE CC[C@@H](C)NCc1ccc(N(C)C[C@@H](O)COCc2ccccc2)c(Br)c1 2239998887 IIYVCRKNQZDOTM-YLJYHZDGSA-N 435.406 4.351 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2381136115 AVSFAIGMDSLOAT-UKRRQHHQSA-N 441.366 4.163 10 10 IICE C[C@H](C(=O)Nc1ccc(F)cc1)N1C(=O)/C(=C/c2cc(Cl)ccc2O)SC1=S 15046356 WAQMLBBBLCYTTH-MQHRVFIMSA-N 436.917 4.413 10 10 IICE Cc1cccc(N2C(=O)/C(=C\c3cn(CC(=O)O)c4ccccc34)C(O)=NC2=S)c1C 33572851 IULTZIQLDPEFIU-YVLHZVERSA-N 433.489 4.014 10 10 IICE COc1ccc(/C=C2\SC(=O)N(CCC(=O)Nc3ccc(C(=O)O)cc3)C2=S)cc1 33615525 LHRHGXUZCIVCHT-ATVHPVEESA-N 442.518 4.259 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(-c4cccc(Cl)c4)c3O)C2=O)cc1 38177843 GDCCYEHQAZIXEE-WQRHYEAKSA-N 436.855 4.355 10 10 IICE COc1ccc2[nH]cc(/C=C3/SC(=S)N([C@H](Cc4ccccc4)C(=O)O)C3=O)c2c1 97513876 UEEILFGJBHVNAT-HRYJJRBTSA-N 438.530 4.074 10 10 IICE CC1=NN(c2ccccc2Cl)C(=O)/C1=C\c1cc(Br)ccc1OCC(=O)O 100147717 HSQMRMPIMORJGD-ZROIWOOFSA-N 449.688 4.372 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCCO[C@H]2C(C)(C)C)C1 435876949 MAZHXDNKUZEJTR-KBMIEXCESA-N 425.617 4.365 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)c(Br)c1 705850453 WVHSIMNWRXTZQZ-JBPLPALLSA-N 427.386 4.288 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 741216802 MSCIIJSHKCTEQC-LEWJYISDSA-N 448.485 4.214 10 10 IICE COc1cc(N(C)CC(=O)Nc2ncc(Cc3cccc(C)c3)s2)cc(OC)c1OC 744404581 BXAYRZUILUQWLC-UHFFFAOYSA-N 441.553 4.143 10 10 IICE C[C@@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccncc1 749470629 QJPTUBGSTZLTDC-VMOJBDSFSA-N 431.608 4.044 10 10 IICE C[C@H]1CN(c2ccc(CN[C@H](C)c3ccc(N4CCOCC4)cc3Cl)cn2)C[C@@H](C)O1 764945575 IVPHLIQTOTZZBB-CEXWTWQISA-N 445.007 4.036 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2cc(Cl)ccc2N2CCOCC2)C2CC2)cc1 798490109 NOGGLLNMSRVPMU-UHFFFAOYSA-N 442.991 4.117 10 10 IICE COc1cc(/C=C2/C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)ccc1OCCC(C)C 1083973336 UDRCXCPAJDDVRU-UYRXBGFRSA-N 436.508 4.403 10 10 IICE O=C(COc1cccc(Br)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1125155248 CDYALPJFKBYNMP-UHFFFAOYSA-N 436.261 4.242 10 10 IICE COc1ccc(N(C)C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c(OC)c1 1127319242 PESAWWIBNHSGJU-UHFFFAOYSA-N 426.513 4.274 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](C)Oc1ccc(F)cc1Br 1129974400 OLIDZWZZMBKWRC-HUUCEWRRSA-N 437.353 4.477 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](CC(C)C)NC(=O)c2ccccc2C)cc1F 1144977614 JSDWGNIQQKNENM-QFIPXVFZSA-N 427.564 4.441 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cc2ccc(I)cc2)cc1F 1144978576 RQCFYIVJZCKTIR-UHFFFAOYSA-N 440.300 4.135 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@]3(C(=O)OC(C)(C)C)CCCO3)cc2Cl)C1 1155727485 SYSHPJYDBKNEQI-WAIKUNEKSA-N 436.980 4.083 10 10 IICE COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1F 1192625993 HTEJFEUNFFFDHZ-LSDHHAIUSA-N 446.478 4.288 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](n3cccn3)C(F)(F)F)cc2Cl)C1 1235835861 XCZAJDYJZPFMNQ-KDOFPFPSSA-N 443.901 4.376 10 10 IICE C[C@@H]1CC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)CN1C(=O)OC(C)(C)C 1253921160 OMVZBRBXCJGHBY-IEBWSBKVSA-N 443.544 4.485 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NCc2cccc(Br)c2O)c1 1297442270 YZBLKAMYYCAFEL-UHFFFAOYSA-N 427.682 4.307 10 10 IICE COC1([C@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCOCC1 1299523804 JJUMTODPWSDWIM-INIZCTEOSA-N 435.362 4.171 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C[C@@H](C)O1 1305152627 RIGCAKLUHGCBKT-HUUCEWRRSA-N 433.578 4.337 10 10 IICE Cc1cc(C(=O)Nc2cc(C(F)(F)F)cc3c2OCC(=O)N3)c(C)n1-c1ccccn1 1306679959 RMLNPPQOCSUPQX-UHFFFAOYSA-N 430.386 4.091 10 10 IICE CCOc1ccc(C2=CCN(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2)cc1 1312901747 HHPLHOBHMGXQSY-FQEVSTJZSA-N 435.568 4.419 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCC(Nc2ccccc2)CC1 1319700899 SQRCEIGRLFZWRA-UHFFFAOYSA-N 447.627 4.005 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C(CC)CC)C2)sc2c1CC[C@@H](CC)C2 1349974187 HXKBZIOWPZPEOB-HUUCEWRRSA-N 434.602 4.415 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1ccc2c(c1)CCC2 1350595661 ZSUHZWJCQACUAJ-DEDYPNTBSA-N 440.565 4.222 10 10 IICE CSc1ccccc1NC(=O)CN(C)C(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1440928157 ZGKCGSLWEYXQJH-UHFFFAOYSA-N 435.549 4.339 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)cc1 1450295436 USUWQRLDYJVWDE-KNQAVFIVSA-N 448.454 4.169 10 10 IICE COc1ccc(N2CCN(C(=O)CCSc3ccc(Br)cc3)CC2)cc1 1458036932 BHFYVYDROASVNY-UHFFFAOYSA-N 435.387 4.289 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc2cncc(Br)c2n1 1460980099 CXVIDIHROHSGEM-CQSZACIVSA-N 427.346 4.128 10 10 IICE C[C@@H](Nc1ccc(C(=O)NCc2cc(Cl)ccc2O)cc1[N+](=O)[O-])c1ccccn1 1469875471 ZUMYFBDAPKZSQY-CYBMUJFWSA-N 426.860 4.452 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3Cc3ccnn3C)cc2Cl)C1 1469958488 DQIFVJFDKLHZMZ-XLIONFOSSA-N 429.996 4.227 10 10 IICE Cc1cc(-c2csc(NC(=O)c3cc([N+](=O)[O-])n[nH]3)n2)c(C)n1-c1ccc(F)cc1 1472486704 VNICPKISUCEOKL-UHFFFAOYSA-N 426.433 4.240 10 10 IICE CCN(CC)c1ccc(Cn2c(N(Cc3ccnn3C)C3CC3)nnc2C(C)(C)C)cc1 1515528715 IZZJSWWHEWCUOI-UHFFFAOYSA-N 435.620 4.373 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2ccc(F)cc2)no1 1524057728 AIVYLABAPFKDMY-INIZCTEOSA-N 431.414 4.481 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CSc3cccc(Br)c3)C2)cc1 1526247307 VUIGLYYRJFYUSD-HNNXBMFYSA-N 435.387 4.193 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](Oc1ccccc1)c1ccccc1 1527864538 SIIOPGXMCPWUCA-XMMPIXPASA-N 438.474 4.238 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@H]2CCOC[C@@H]2OC)sc(C)c1-c1ccc(F)cc1 1531749822 NVLAHPQGFZBKBM-WBVHZDCISA-N 435.517 4.419 10 10 IICE Cc1nc(-c2ccn(C)n2)sc1CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1534248016 ZQNAINSQYBFVRT-UHFFFAOYSA-N 433.581 4.161 10 10 IICE COc1ccc(O[C@@H](C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1539633455 BFPURQBDDFTZNK-IBGZPJMESA-N 435.568 4.000 10 10 IICE COc1cc2c(cc1OC)CN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)CC2 1540682354 GWZFLXYYHHLUNX-UHFFFAOYSA-N 432.520 4.431 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cc(Cl)c3O)cc2F)C[C@H](C)O1 1542113298 UEILTRZNJZYFIR-RYUDHWBXSA-N 427.303 4.382 10 10 IICE CCc1ccc(CN2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)s1 1544051718 OMEVMDOMKFTQQM-UHFFFAOYSA-N 435.593 4.489 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1C[C@H]1CCN(CC(F)(F)F)C1 1554175895 ZUKONKMZVVOHSP-INIZCTEOSA-N 437.510 4.162 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3cscn3)n2)c(C)n1-c1cc(Cl)cc(Cl)c1 1559470741 LABHLLBNSMJXHP-UHFFFAOYSA-N 433.324 4.394 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCN(Cc2ccc(F)cc2)CC1 1564944987 CUIRJQZZYFZRIU-FQEVSTJZSA-N 426.580 4.049 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3cc(Br)cs3)C2)cc1 1564962080 FFQCPCJYQMSKCD-AWEZNQCLSA-N 438.391 4.187 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H](Cc3ccccc3)c3ccccn3)C2)cc1 1564962598 MQLXFARWWGEMCZ-DHIUTWEWSA-N 444.579 4.242 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(C(F)(F)F)c(O)c1 1566356952 SIRUIASSLQNDMH-HNNXBMFYSA-N 428.838 4.164 10 10 IICE CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1566730547 BCDBPHOWDIGBJO-IBGZPJMESA-N 428.529 4.216 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(NC(=O)c3cccs3)cc2)N(C)C)cc1 1586054406 HWIIKITZJLMWRV-OAQYLSRUSA-N 436.581 4.099 10 10 IICE C[C@@H](CCC(C)(C)C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1586439740 LMUFQNIMPYTPNS-AWEZNQCLSA-N 449.529 4.046 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCOC2)nnc1N1CCC(Cl)=C(Cl)C1 1611963745 ZDQHPSZEJXZSDW-INIZCTEOSA-N 436.387 4.104 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3C2=O)c(C)n1-c1ccc(Br)cc1 1631826911 PIJQFOARQOJDJR-IBGZPJMESA-N 439.309 4.230 10 10 IICE Cc1cc(CC(=O)N(C)Cc2nnc3n2CCC[C@H]3C(F)(F)F)c(C)n1-c1ccccc1 1634467683 NTOIEGHULUPPQG-LJQANCHMSA-N 445.489 4.326 10 10 IICE COCCNC(=O)c1cccc(NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1635238250 SAPDOXPSLWPFDJ-UHFFFAOYSA-N 425.916 4.376 10 10 IICE C[C@H](S[C@@H](C)C(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1656495332 HJHOWUZCHUWIOH-KBPBESRZSA-N 439.533 4.252 10 10 IICE COc1cccc(N2CCN(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2)c1 1683302965 GDQRTKYDBWPGLM-UHFFFAOYSA-N 432.568 4.443 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(Cc3cccc(C(N)=O)c3)C3CC3)c2C)c1 1684478562 BJKYVAJUGYLSKW-UHFFFAOYSA-N 430.552 4.376 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)C2CC2)cc1 1684759476 DFNOYERLXBKPPU-LJQANCHMSA-N 444.620 4.464 10 10 IICE Cc1ccccc1C[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1686268230 ADXGGEDPGDNZSR-UTKZUKDTSA-N 429.992 4.288 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCO[C@H]1C 1728026848 JOGGHDNVCQRQRD-CPJSRVTESA-N 437.588 4.129 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CCc1cc(C(F)(F)F)ccn1 1729420818 WWZIOBVKSIQQGW-LJQANCHMSA-N 447.461 4.128 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC[C@H](OCC3CC3)C2)nnc1C(C)(C)C 1742142039 RIPZYGNQUWOHBK-QFIPXVFZSA-N 425.621 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCC(=O)N3)nnc2N(CC)[C@@H](C)C2CCC2)cc1 1746090310 UGMIGHUOBOBVLN-PGRDOPGGSA-N 438.620 4.139 10 10 IICE CCN(CC)C1CCN(c2nnc(CC(C)C)n2Cc2ccc(N(C)C)cc2C)CC1 1746132997 ZXTCREGMTGIXDY-UHFFFAOYSA-N 426.653 4.210 10 10 IICE C[C@@H]1C[C@@H]1Cn1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1762764799 KCLHHVIXOUAWLN-QRQLOZEOSA-N 441.576 4.348 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CC=C(C(F)(F)F)CC2)cc1 1764938433 MHRRLGLOYBIMHD-SFHVURJKSA-N 449.521 4.375 10 10 IICE CCCCCn1cc(Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)c(C)n1 1765695967 UVQBUAJFBDIZIO-UHFFFAOYSA-N 447.587 4.369 10 10 IICE CN(Cc1ncc(Cl)n1C)c1nnc(C2CCC2)n1CCCSc1nccs1 1768730504 LALAFJJRMMBLSQ-UHFFFAOYSA-N 438.026 4.208 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(OC)C1CC1 1771066083 LLYGJOCHOTYIJO-RUZDIDTESA-N 437.588 4.250 10 10 IICE CCCCOCCCNC(=O)C(=O)Nc1sc(C)c(-c2ccc(C)cc2)c1C(=O)OC 1860761549 YELMCFSSKXWNFH-UHFFFAOYSA-N 446.569 4.080 10 10 IICE COc1ccc(O)c(Cn2nc(C3(C)CC3)c(C(F)F)c2I)c1 2079753433 GVKSCBPKBOYTIX-UHFFFAOYSA-N 434.224 4.239 10 10 IICE [N-]=[N+]=NCC1CCN(C(=O)c2ccc(Br)cc2I)CC1 2207275845 PNYWMKLQIJMAFK-UHFFFAOYSA-N 449.090 4.216 10 10 IICE O=C1NC(=S)N(c2ccccc2)C(=O)C1=Cc1cccc(OCc2cccc(F)c2)c1 2297350533 XVEFAHOJFHNJSZ-UHFFFAOYSA-N 432.476 4.236 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(O)c(OCC)c2)SC1=S 2314767757 ICCYCZDTPUKTLG-IBGZPJMESA-N 443.546 4.297 10 10 IICE COc1ccc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccc(C)cc3)C2=O)cc1OC 2314836299 CMVOUXQDMCHHNX-CQSZACIVSA-N 442.562 4.241 10 10 IICE COC(=O)c1ccc(C=C2C(=O)N(Cc3cccc(F)c3)N=C2c2ccc(OC)cc2)cc1 2332139172 CWQSRIGDALEVRO-UHFFFAOYSA-N 444.462 4.451 10 10 IICE COc1cc(C=C2C(=O)N(Cc3ccccc3Cl)N=C2C(F)(F)F)cc(OC)c1O 2332147819 ZNANPGOCBHUTKW-UHFFFAOYSA-N 440.805 4.407 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3C[C@H]2C[C@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352949592 GPVRGWGQPLIABY-ZJIFWQFVSA-N 425.367 4.245 10 10 IICE CCOC(=O)c1ccccc1N1C(=O)C(O)=C(c2ccc(F)cc2)[C@H]1c1ccc(O)c(O)c1 526524679 DJMHWDOIQXVJOX-JOCHJYFZSA-N 449.434 4.471 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 731123626 HEHAZHQKTKRIDC-IBGZPJMESA-N 432.609 4.321 10 10 IICE COC(=O)[C@H]1CC12CCN([C@H]1CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C1=O)CC2 733797714 FAEKPIGVMHGBLG-RTWAWAEBSA-N 446.507 4.009 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC(C(=O)c3c(F)cc(F)cc3F)CC2)c([N+](=O)[O-])c1 734141683 JDDWSPNYNNTDKJ-HYXAFXHYSA-N 448.397 4.298 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCO[C@@H]2c2ccnn2-c2ccccc2C)cc1 752827577 SRYBSPZEQIBUFR-DHLKQENFSA-N 432.568 4.421 10 10 IICE CN1CCN(c2ccc(CN3CCC([C@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2)CC1 775678137 AMOJWBRBDXGUTL-XMMPIXPASA-N 439.003 4.040 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2nc(O)c3sccc3n2)c(C)n1-c1ccccc1 776106118 CAKMGRBXMKDQAG-UHFFFAOYSA-N 435.553 4.189 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)[C@@H]2CCCOCC2)sc(C)c1-c1ccccc1 787106998 MOLJGUCENUXBBS-QGZVFWFLSA-N 445.537 4.199 10 10 IICE Cc1cccc2c1OCC[C@H]2NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 788744564 TUALVBWZJCOUGL-XGHQBKJUSA-N 427.520 4.071 10 10 IICE CCOC(=O)[C@@H]1CC[C@H](N[C@@H](C)c2cc(Br)cc(Br)c2O)C1 798002483 IMTRJHUGGQDSDT-UMNHJUIQSA-N 435.156 4.300 10 10 IICE CC(=O)Nc1cccc2c1CCN(CC(=O)c1cc(C)n(-c3ccc4c(c3)OCO4)c1C)C2 917418121 WHMUUBDSPWKKHF-UHFFFAOYSA-N 445.519 4.022 10 10 IICE CCOC(=O)Cc1csc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 1124715391 ITBLEHNKNKJSEZ-UHFFFAOYSA-N 431.945 4.491 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3ccc(Cl)c(C)c3)cc2F)CC1 1125976319 VOLMUNAPTXCOHW-QGZVFWFLSA-N 433.955 4.013 10 10 IICE CS[C@@H]1CC[C@H](N(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1126591624 VDBIWCYXGLPNOD-BESUYIBZSA-N 438.615 4.160 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H](NC(C)=O)c2cccc(Br)c2)cc1 1135946406 QUFBXAXZGJJFLQ-OAQYLSRUSA-N 446.389 4.131 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1 1141433859 CGIVCMVGJCDANM-UHFFFAOYSA-N 447.510 4.034 10 10 IICE Cc1nc(-c2ccccc2)ncc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348358 PRJPOGAQWWIOET-FQEVSTJZSA-N 436.943 4.205 10 10 IICE CCNS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)cc1 1152394651 ICRCLJKUZWJVJZ-GOSISDBHSA-N 438.549 4.094 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@@H]3c3ccc(Cl)cc3)CC2)cc1 1194348962 TUABJLGMUGNHJH-ILBGXUMGSA-N 444.019 4.059 10 10 IICE Cc1ccc(CN(C)c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)o1 1289644601 QTAHOTQCNWAKIV-OAQYLSRUSA-N 427.524 4.311 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCO[C@H]2C(C)C)n1 1289919686 RJZIAOZCOFGPSP-REWPJTCUSA-N 435.572 4.442 10 10 IICE O=C(N[C@@H]1C[C@H]1c1cccc(Cl)c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1297115488 YJPDKAXVGWJRDW-DOTOQJQBSA-N 448.953 4.194 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2C)c1 1299292152 IKSQIQSKDHRMAE-UHFFFAOYSA-N 425.554 4.214 10 10 IICE CC1CCN(c2ccc(Cn3c(N4C[C@H](C)O[C@@H](C)C4)nnc3C(C)(C)C)cc2)CC1 1305065200 GQUYUMVFHVQGSY-PMACEKPBSA-N 425.621 4.474 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN[C@@H](C)c1ccc(N2CCOCC2)cc1 1307642900 QGKRUOZXGIOHKQ-AWEZNQCLSA-N 426.435 4.163 10 10 IICE CN(CCOC(C)(C)C)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1314876708 XMWRFBYQSDWVDT-UHFFFAOYSA-N 432.619 4.230 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCOC4)n3CCCC(C)(C)C)CC2)cc1F 1315513676 ZFRCXZJLAXULOR-SFHVURJKSA-N 445.583 4.083 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(F)cn1 1316055278 XUMLMOZMYBTPSU-UHFFFAOYSA-N 434.519 4.018 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2ccc(N(C)C)cc2)[C@H]1c1ccc(Cl)c(F)c1 1355878934 OSTOHBLIDKTZMH-PGRDOPGGSA-N 431.939 4.160 10 10 IICE C[C@H](NC(=O)c1cc2c(Br)cncc2s1)c1ccc(N2CCOCC2)cc1 1357929062 SPMKTGOBGVYAMN-ZDUSSCGKSA-N 446.370 4.386 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1csc(-c2ccc(OCC)cc2)n1 1451921567 ULNYPSAOURMYTB-UHFFFAOYSA-N 440.521 4.120 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(OC)c1 1453467104 CAJGCWMQGHSPRJ-NRFANRHFSA-N 426.900 4.400 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1(CCCOCc2ccccc2)CC1 1465422899 MLMAYRNBRHQQGB-UHFFFAOYSA-N 440.559 4.180 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1(c2ccc(Br)cc2)CCC1 1470446224 MOXPKNNJSRIMQD-UHFFFAOYSA-N 443.385 4.148 10 10 IICE C[C@@H]1COCCN1c1nnc(-c2cccc(Cl)c2)n1CCCSc1nccs1 1512536334 SCPCOBMQPVHWST-CQSZACIVSA-N 436.006 4.463 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4c(Br)cccc4cn3)CC2)cc1 1529804301 NPMOTAUNYBARCM-UHFFFAOYSA-N 440.341 4.405 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(O[C@@H]2CC2(F)F)cc1 1533330053 VDGMJPCEOMXEEY-HNAYVOBHSA-N 438.421 4.473 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(Br)c1 1534309877 YNVUFPXPJLFEAV-HOTGVXAUSA-N 449.364 4.369 10 10 IICE CCCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)c(OCCC)c1 1534586622 FYHIBQHVXQREKC-UHFFFAOYSA-N 442.556 4.244 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(-c4ccc(F)c(F)c4)s3)CC2)c(OC)c1 1534586990 KQPMEFRWAFUSSW-UHFFFAOYSA-N 445.491 4.068 10 10 IICE C[C@]1(c2ccccc2)C[C@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1539522154 UTARUZSRNHJJKL-BZIRVADKSA-N 440.565 4.263 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1[C@H]1CCC[C@H](C(F)(F)F)C1 1541639194 ZANWSWYRTNEJAZ-HOTGVXAUSA-N 439.482 4.052 10 10 IICE Cc1cc(CC(=O)NC[C@@H](CO)Cc2ccc(F)cc2)c(C)n1-c1ccc(Cl)cc1 1566384990 IDINLEBGBSOFEB-IBGZPJMESA-N 428.935 4.397 10 10 IICE CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1586471268 JFVVUFVDZCQERS-UHFFFAOYSA-N 439.537 4.311 10 10 IICE COC(=O)C[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@H]1C 1596384026 KNJKGEZPBFWBLJ-CZUORRHYSA-N 433.346 4.128 10 10 IICE Cc1csc(CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1616573378 VIJAOXICZOGMIP-UHFFFAOYSA-N 442.342 4.495 10 10 IICE Cc1ccc([C@@H](C)CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1617949575 AFWFYZGCPKHYMU-HNNXBMFYSA-N 430.551 4.096 10 10 IICE COCCCCCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1619814513 GCECKYRNMSSQMZ-UHFFFAOYSA-N 429.609 4.118 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(C4CCCCC4)nc3C)CC2)c(OC)c1 1623764963 YUBGUDIICFUGJJ-UHFFFAOYSA-N 429.586 4.479 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c(C)n1-c1ccc(Br)cn1 1629844831 YUAKKRBEVVQQAG-UHFFFAOYSA-N 439.313 4.389 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1 1631533913 LUNLOQGHNBLNLB-CYBMUJFWSA-N 443.849 4.445 10 10 IICE Cc1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)c(C)n1-c1cccc(Cl)c1 1632393271 MLPFUUUDVMJOFK-UHFFFAOYSA-N 425.891 4.376 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@@H](c2nccs2)C1 1633225747 LAPGXFXDNSEFPA-WDGDVPDHSA-N 449.648 4.202 10 10 IICE COc1cccc(-c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)n[nH]2)c1 1634753453 LTDGYZBBDMDDLT-INIZCTEOSA-N 442.466 4.086 10 10 IICE Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1638918006 POGNAMQDHRNPQW-FCHUYYIVSA-N 426.609 4.022 10 10 IICE CCS(=O)(=O)Cc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1642928338 MNKNPIAESWFGIA-UHFFFAOYSA-N 438.549 4.023 10 10 IICE CN(CC(=O)Nc1ccc(I)cc1)c1ccc(-c2nccs2)cc1 1643359746 BJAWCHFKLOLQBB-UHFFFAOYSA-N 449.317 4.490 10 10 IICE COc1ccc(N(CC(=O)NC(=O)Nc2ccc(C)cc2C)Cc2ccco2)cc1F 1644790087 RKINORQIQKDRSJ-UHFFFAOYSA-N 425.460 4.399 10 10 IICE COc1cc(N[C@H]2CCCN(Cc3ccc(N4CCC(OC)CC4)cc3)C2)cc(OC)c1 1644830767 UXMLILIIFVOFSX-NRFANRHFSA-N 439.600 4.396 10 10 IICE COc1cn(C)nc1[C@H](C)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1652635274 SCTJGKWJSVNLCW-ZDUSSCGKSA-N 431.334 4.090 10 10 IICE COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N[C@H](C)c2ccccc2O)cc1 1655349022 AFDHRCQRYDWBHO-IAGOWNOFSA-N 433.508 4.331 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC(Cc3nc4c(s3)CCC4)CC2)c([N+](=O)[O-])c1 1655917089 AGQOKDNVNURUOG-SOFGYWHQSA-N 427.526 4.185 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O)c1ccc(N(C)C)cc1 1681780224 ZEVZEUXHZFSEJZ-JKSBSHDWSA-N 426.536 4.004 10 10 IICE COc1ccc(N2C[C@@H](NC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1682608518 UTUFGXGJWQBBNG-NRFANRHFSA-N 446.551 4.016 10 10 IICE COc1ccc([C@@H](NC(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c2ccco2)cc1 1683222028 ZIZAJHPJQPMSPS-MHECFPHRSA-N 435.524 4.212 10 10 IICE Cc1ccc(-c2nnc(N3CCOC(C)(C)[C@H]3C)n2CCCSc2nccs2)o1 1724324258 HIXUNOKHZXYMCL-OAHLLOKOSA-N 433.603 4.489 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1728384273 MLKRCESABOGFKW-QFIPXVFZSA-N 448.615 4.021 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCSC[C@H]2C)cc1 1766614681 OJONLEXZTYVIQQ-LJQANCHMSA-N 436.629 4.100 10 10 IICE Cc1cc(C)c(-c2csc(NS(=O)(=O)c3ccc4c(c3)CC(=O)N4C)n2)c(C)c1 1858032264 SFVXBIXZIPYXMB-UHFFFAOYSA-N 427.551 4.055 10 10 IICE COc1ccc(N2CCN(C=O)CC2)cc1NC(=O)CC(c1ccccc1)c1ccccc1 1858038759 FDLRSMNYQPBTJZ-UHFFFAOYSA-N 443.547 4.134 10 10 IICE O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)SC(=S)N1C1CCN(Cc2ccccc2)CC1 1858593899 CNSUNNZVKZWPHV-XSFVSMFZSA-N 439.562 4.461 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4C)c(C)s2)cc1 1859570321 CILINVRZFDPPBL-UHFFFAOYSA-N 441.578 4.482 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)c1 1860087604 JNRXCBRMJJWXLB-HMMYKYKNSA-N 426.563 4.328 10 10 IICE CCCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCOC[C@@H]2C)n1 1868386901 LBPDYHHDVLDKPH-INIZCTEOSA-N 442.519 4.173 10 10 IICE COCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CCCCC2)C1=O 1873165474 KQBOUXJDEWZAJM-UHFFFAOYSA-N 435.568 4.133 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](CNCc2cccc(Br)c2O)(C2CC2)C1 2093192867 LZEHBQNXGQWQPX-FQEVSTJZSA-N 425.367 4.282 10 10 IICE CC(C)c1ccc(C=C2SC(=S)N(CCC(=O)N3CCCC[C@@H]3CCO)C2=O)cc1 2296551079 QEUNXIXALCYEBK-LJQANCHMSA-N 446.638 4.165 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)c1ccc(Br)cc1 2296879958 NDKWUEPTXMSQSJ-UHFFFAOYSA-N 437.315 4.134 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccccc3O[C@H](C)C(=O)O)SC2=S)cc1 2314931453 ONTAQYWZHQHFHS-CYBMUJFWSA-N 429.519 4.343 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(O)cc3)C2=O)ccc1O[C@H](C)C(=O)O 2314934238 GNLFRBDKGJGWCT-GFCCVEGCSA-N 445.518 4.049 10 10 IICE C[C@@H](C(=O)Nc1ccc(F)cc1)N1C(=O)/C(=C/c2cc(Cl)ccc2O)SC1=S 15046352 WAQMLBBBLCYTTH-XBTXGSBDSA-N 436.917 4.413 10 10 IICE CC[C@H](C)N1C(=O)/C(=C\c2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 33752411 DOVJPOZRRSIXKI-FSEGOYHTSA-N 430.599 4.071 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CCN(C(=O)N(C)Cc2ccccc2)CC1 727375605 ICKOBTOIAXYXJO-UHFFFAOYSA-N 436.600 4.065 10 10 IICE Cc1noc(C)c1[C@@H](C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 754288953 PVLNWERSYYQJHG-ZDUSSCGKSA-N 438.480 4.347 10 10 IICE O=C(CCc1cc2ccccc2nc1O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 767615993 KVPMNJAHTYSSEC-SFHVURJKSA-N 441.478 4.260 10 10 IICE Cc1cc(Br)cc([C@@H](C)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1O 779001805 BSRWSKRBQSCZBJ-OWCLPIDISA-N 434.378 4.323 10 10 IICE Cc1ccc(NCc2ccc(N3CCC(CO)CC3)cc2)c([N+](=O)[O-])c1Br 787897594 PEDTUTQJYISLBX-UHFFFAOYSA-N 434.334 4.487 10 10 IICE COc1ccc(CNC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)c(O)c1 796350425 MORQMWUTYLOPOO-SFHVURJKSA-N 439.339 4.169 10 10 IICE Cc1cc(C(=O)COC(=O)CO[C@H](C)c2nccn2C)c(C)n1-c1ccc(F)c(Cl)c1 805687294 TUPRZTKVERLRFN-OAHLLOKOSA-N 447.894 4.124 10 10 IICE CC[C@@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125130944 CNBXAOWWJMKPDY-UZLBHIALSA-N 428.495 4.144 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3csc(Cc4cccc(F)c4)n3)C2)cc1 1129991714 WDGUJXWAOCGGFM-KRWDZBQOSA-N 425.529 4.138 10 10 IICE COC(=O)[C@@](C)(NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1cccc([N+](=O)[O-])c1 1150780160 BCVISYWDEMUXEL-VWLOTQADSA-N 449.507 4.437 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Cn2cc(Br)cc([N+](=O)[O-])c2=O)c1C 1165840485 GUMXAFRUDZJKAV-UHFFFAOYSA-N 444.285 4.118 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@H]3CCO[C@H]3C2(C)C)sc(C)c1-c1ccccc1 1194487017 AXRZCQZSDVIAMK-MAODMQOUSA-N 442.581 4.242 10 10 IICE CSc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1269555696 CCJOGEXOZXYGSM-PDGQHHTCSA-N 446.594 4.455 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 1291851040 VRSXQXYSUUYGRI-UHFFFAOYSA-N 434.334 4.403 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2cccnc2Cl)NC(=O)OC(C)(C)C)cc1 1293793259 NAFPCTNTWBIQJA-LJQANCHMSA-N 446.979 4.116 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC3(C(C)C)CC3)CC2)cc1F 1300246434 AUUHJQBMRNMKAP-UHFFFAOYSA-N 429.584 4.486 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)N[C@@H](C)c1ccccc1O 1302532400 AXEIPLDEKUUDDI-HNNXBMFYSA-N 428.485 4.132 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CC[C@@H](C)C2)CCOC1 1304971745 IWOIDYMHNCWSOI-IMWIBFENSA-N 428.577 4.097 10 10 IICE CC(C)(C)OC(=O)c1ccccc1OCCN(Cc1ccccc1O)C[C@@H]1CCCO1 1307566765 MACMBWUOVSVBHQ-FQEVSTJZSA-N 427.541 4.408 10 10 IICE COc1ccc(N(CCCON2C(=O)c3ccccc3C2=O)Cc2ccccc2)cc1OC 1308174540 UFQHYOXXSOCGQF-UHFFFAOYSA-N 446.503 4.328 10 10 IICE COc1ccc(N2CCC(NC(=O)C3(c4cccc(OC(F)(F)F)c4)CC3)CC2)cc1 1435025719 JIIYUOYCLIBMRJ-UHFFFAOYSA-N 434.458 4.411 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(S(C)(=O)=O)s2)cc1 1443631872 GXQDSZNCOPOIMX-UHFFFAOYSA-N 444.578 4.073 10 10 IICE CC/C(=C\C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OC)cc1 1458015201 CXYNCPGJYHFCJK-PTGBLXJZSA-N 433.596 4.337 10 10 IICE Cc1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c(C)n1-c1ccccc1Br 1463832072 XPGHERUQVCRIDL-UHFFFAOYSA-N 437.301 4.289 10 10 IICE Cc1cc([C@@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c(C)o1 1478527924 JAIZZHVEAUYJCG-CMJOXMDJSA-N 433.980 4.493 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2C[C@@H](C)[C@H](C)C2)cc1 1501844317 OMEXGZTXFYJLIC-RTBURBONSA-N 435.620 4.126 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1CC1CC1 1503489281 OBSWVUYVLZZGJC-SFHVURJKSA-N 427.549 4.102 10 10 IICE COc1ccccc1OCc1nnc(N2CCCC2)n1CCCSc1nccs1 1504437743 NTJUSJSHYSLDCR-UHFFFAOYSA-N 431.587 4.105 10 10 IICE CSCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)N(C)C 1505252694 QCIHEHMIMHSHSQ-LJQANCHMSA-N 440.661 4.492 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1-c1cnn(C)c1 1527480795 AMOMIVCKJQTEBM-ROUUACIJSA-N 436.531 4.078 10 10 IICE Cc1cc(CC(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)[C@@H](C)C2)c(C)n1-c1ccccc1 1529519918 WHOBCYLEJAYPKY-OALUTQOASA-N 425.573 4.493 10 10 IICE CSCc1c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)oc2ccccc12 1535345594 GBSGIGNEPHCZSB-UHFFFAOYSA-N 432.492 4.341 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@@H]1c1ccccc1 1540812606 NOWWZBVWZGFMPV-GXYBQNOFSA-N 426.538 4.391 10 10 IICE Cc1cc(C(=O)N2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)c(C)n1-c1ccc(Cl)cc1 1546245859 JGXWXOSDXSZURO-KDURUIRLSA-N 443.035 4.378 10 10 IICE COCCO[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCCC1(F)F 1555615737 UBNMVPMGDGRSAM-SJLPKXTDSA-N 438.519 4.170 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3cccc(F)c3)C(=O)C2)c(C)n1-c1cccc(Cl)c1 1586401727 IOUKAQHNRYFSEO-UHFFFAOYSA-N 439.918 4.371 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(Br)c(C)cc3OC)C2)cc1 1598362628 ARULIXPHFRKVOM-HNNXBMFYSA-N 433.346 4.031 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N[C@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1616947291 VRVNKLMQJSYRED-FOIQADDNSA-N 434.005 4.423 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1 1617409435 OOZBGIWAOYLFTB-HKBQPEDESA-N 439.629 4.358 10 10 IICE COc1ccc(-c2cc(C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)n[nH]2)c(OC)c1 1628874050 WZWBREMVNARDQZ-UHFFFAOYSA-N 434.540 4.356 10 10 IICE CC(C)C[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N(C)C(=O)OC(C)(C)C 1630351631 WXALLPNNNRCELL-FQEVSTJZSA-N 435.634 4.138 10 10 IICE C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccc(N(C)C)cc1 1634434723 FXRVLOQBNUOREB-KRWDZBQOSA-N 447.421 4.350 10 10 IICE CCc1cccc2c(CC(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c[nH]c12 1635941866 XZSMVZXNRODWKC-FQEVSTJZSA-N 425.960 4.413 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N(C)[C@@H]1CCCC[C@H]1C 1640759336 PXCPHBYNXWFMPC-SJLPKXTDSA-N 429.586 4.470 10 10 IICE CCOC(=O)CN(CC(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OCC)C(C)C 1641650180 UEOBNKVRTFECBJ-UHFFFAOYSA-N 446.569 4.112 10 10 IICE COc1ccc(N(CCCON2C(=O)c3ccccc3C2=O)CCc2ccccc2)cc1 1642153398 MUTBZSPCCBNNSV-UHFFFAOYSA-N 430.504 4.362 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2cc(C(=O)NCc3cc(Cl)ccc3O)on2)CC1 1644590915 VASAABQWTPOPMQ-UHFFFAOYSA-N 435.908 4.078 10 10 IICE COc1ccc(Cl)c(N2CCN(Cc3ccc(N4CCC(OC)CC4)cc3)CC2)c1 1646601158 DPPOAZOYQLSCBE-UHFFFAOYSA-N 429.992 4.286 10 10 IICE CCc1cc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(Cl)cn4)c3C)cnc2s1 1656179935 FSLUXFDIOZUARN-UHFFFAOYSA-N 426.929 4.359 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3nc(-c4ccccc4F)cs3)C2)cc1 1672316574 HLSYDNSIKWTOPN-OAHLLOKOSA-N 426.517 4.036 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1672931749 LGSQDAKRFWMIOA-SFHVURJKSA-N 440.494 4.471 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1708574991 OQBTZDGXXMXXTD-DFBJGRDBSA-N 443.636 4.224 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccoc2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1726875456 MFWIWPVMJMSFFH-KRWDZBQOSA-N 441.551 4.353 10 10 IICE C[C@H](c1cccc(O)c1)N(C)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1741785154 WVKGORJAXGRNJR-WBVHZDCISA-N 445.614 4.324 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CCCC(F)(F)F)CCOC1 1751010367 SNVDSLOVMHFTNS-HXUWFJFHSA-N 442.482 4.003 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1761348604 FLVJEAYPVHFPPX-KRWDZBQOSA-N 441.551 4.390 10 10 IICE C[C@@H]1SCCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)[C@@H]1C 1763290148 JOQPCWTUHMOWMT-CVEARBPZSA-N 446.671 4.233 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1763291171 RWQNADLGOGVUPO-CRAIPNDOSA-N 445.662 4.403 10 10 IICE CCOC[C@H]1CCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1766489215 GMGRGVMGTSSXHE-DLBZAZTESA-N 437.635 4.021 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2cnccn2)n1CCCC(F)(F)F 1767081420 ZTEOTPAIFRSQLT-UHFFFAOYSA-N 445.493 4.314 10 10 IICE CN(C[C@@H]1CCCOC1)c1nnc(Cc2ccsc2)n1CCCSc1nccs1 1768800175 VASXLZPZMUXAJN-KRWDZBQOSA-N 449.671 4.432 10 10 IICE CCOC(=O)c1c(-c2cccc([N+](=O)[O-])c2)csc1NC(=O)COc1ccc(N)cc1 1860083488 PMWSISXZNVVSEY-UHFFFAOYSA-N 441.465 4.100 10 10 IICE C[C@H](NC(=O)C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 2017516789 MLSVRBFCYPBXOB-PKOBYXMFSA-N 428.529 4.070 10 10 IICE Cc1ccc([C@@H](n2nc(C(F)(F)F)c(C(N)=O)c2Br)C2(C)CC2)c(O)c1 2079037576 LJJQBKGDWIMFMB-CYBMUJFWSA-N 432.240 4.167 10 10 IICE COc1ccc([C@H](C2CC2)n2nc(C(C)(C)C)c(N)c2I)c(O)c1 2079849355 VZCWSIJWYWNCQG-HNNXBMFYSA-N 441.313 4.081 10 10 IICE N[C@@H]1C(=O)Nc2cc(N(CCC(F)(F)F)Cc3ccccc3)c(Br)cc21 2095859537 JBJHFTSYYGNQAD-INIZCTEOSA-N 428.252 4.360 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@H](NC(=O)OC(C)(C)C)C23CCC3)c1O 2236048302 AOPIECZCEANEAA-HOTGVXAUSA-N 441.366 4.089 10 10 IICE Cc1ccc(-c2ccc(C=C3SC(=S)N([C@H](CCC(=O)O)C(=O)O)C3=O)o2)cc1C 2314650498 KGIFCIDCBGUBSG-OAHLLOKOSA-N 445.518 4.083 10 10 IICE CCOc1ccc(NC(=O)CN2C(=O)C(=Cc3c[nH]c4ccccc34)SC2=S)cc1 2314827831 NEOFOOFFRMCWRM-UHFFFAOYSA-N 437.546 4.407 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3cccc(OC)c3)C2=O)cc1)C(=O)O 2314929606 PBOIEBDWZUPSRK-KRWDZBQOSA-N 429.519 4.343 10 10 IICE CC[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352634969 AAIHKFQVQOYVBN-IBGZPJMESA-N 429.355 4.020 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459366 FRKPVXNEQIVIQP-JOJBRYAWSA-N 428.554 4.304 10 10 IICE COc1ccc(N2CCN(c3ncccc3-c3nc(-c4cccc(C)c4)no3)CC2)cc1 15669972 RTKKROONUSRMCF-UHFFFAOYSA-N 427.508 4.442 10 10 IICE O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(O)cc1O)N2 20681868 QTLAHGOYFLVJGI-FHAGJXEFSA-N 448.544 4.403 10 10 IICE O=C1/C(=C/c2cccc([N+](=O)[O-])c2)N=C(c2ccccc2)N1c1nc2ncccc2s1 33303556 BKJWHNJIRYQMSX-LGMDPLHJSA-N 427.445 4.434 10 10 IICE COc1cc(/C=C2\SC(=S)N(NC(=O)c3ccccc3C)C2=O)ccc1OC(C)C 40940667 NUCKUWUEYFQYCF-UNOMPAQXSA-N 442.562 4.337 10 10 IICE Cc1cccc(N2C(=O)/C(=C\c3cccn3-c3cccc(C(=O)O)c3)C(O)=NC2=S)c1C 96469965 GNQPCQHGYGUYFN-UYRXBGFRSA-N 445.500 4.464 10 10 IICE COC(=O)C1=C(C)N(C)C(=O)/C1=C/c1cc(C)n(-c2cccc(Br)c2)c1C 96822612 NPGGAKOJVGBFGE-VCHYOVAHSA-N 429.314 4.159 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@]2(C)OCCc3sccc32)C1 574845512 CQZAXYXLTFSUMZ-VWLOTQADSA-N 437.609 4.074 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc3c(cnn3C(C)C)c2)c(C)n1-c1ccccc1 737080761 GMAMZTFVWMMENJ-UHFFFAOYSA-N 443.551 4.322 10 10 IICE O=C(Nc1ncn(C2CCCCC2)n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 758161237 BIMDTZJNUWZZCV-HNNXBMFYSA-N 434.491 4.175 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2c[nH]c3cc(F)ccc23)NC(=O)OC(C)(C)C)cc1 765851793 UPNFGJCYACDGBQ-NRFANRHFSA-N 440.519 4.369 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCc2ccc(F)c(F)c2C1 769094942 MMLGKADWJHJYPG-UHFFFAOYSA-N 437.437 4.303 10 10 IICE O=[N+]([O-])c1cc(NS(=O)(=O)c2cc(Br)c(Cl)cc2Cl)ccc1O 775285815 CZSAYALJHBVTOV-UHFFFAOYSA-N 442.074 4.171 10 10 IICE CCOC(=O)c1c(NC(=O)CCN[C@@H](C)c2cn[nH]c2)sc(C)c1-c1ccccc1 778141876 MZFHICYLHCQAIM-AWEZNQCLSA-N 426.542 4.303 10 10 IICE C[C@H]1CN(Cc2ccccc2NC(=O)NCc2cc(Br)ccc2O)C[C@@H](C)O1 806212897 FQTOSXJXGWQJEA-GASCZTMLSA-N 448.361 4.086 10 10 IICE O=[N+]([O-])c1cccc(N=NN(c2cccc([N+](=O)[O-])c2)S(=O)(=O)c2ccccc2)c1 1084353019 LRHUUIRALZXRNL-UHFFFAOYSA-N 427.398 4.397 10 10 IICE CCc1ccccc1-n1c(C)cc(/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c1C 1084402848 WAUHVZGCWYYGKY-STZFKDTASA-N 431.467 4.462 10 10 IICE COC(=O)c1sc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1C 1124590182 GGKSBHSAXIAZJE-UHFFFAOYSA-N 425.554 4.203 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCCc2occc21 1126246957 XCERBITZQDPACG-YAJBTMAUSA-N 430.526 4.204 10 10 IICE CCCOc1c(Cl)cc(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1OC 1129991142 LKDYFYPASMMZTQ-INIZCTEOSA-N 432.948 4.402 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cc(C)ccc3C(C)C)CC2)c(OC)c1 1132032466 YLVNMQBEOBUAJA-LJQANCHMSA-N 426.557 4.252 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccccc3CCc3ccccc3)cc2)CC1 1133626356 IFZLGHMWERCTMQ-UHFFFAOYSA-N 441.575 4.104 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC(C)(C)N3CCc4ccccc4C3)ccc21 1136423087 SSBXKLVUDXSNNG-UHFFFAOYSA-N 433.596 4.471 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(CN2C(=O)c3ccccc3C2=O)c(C)o1 1137346696 IRBPAOKVSZKORJ-UHFFFAOYSA-N 432.476 4.142 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCC(F)(F)[C@H]2O)c(C)n1-c1ccccc1Br 1142107852 BLILSBMVZNZROZ-WBVHZDCISA-N 427.289 4.135 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCSc3cccc(Cl)c3)cc2F)CC1 1265011823 CSNQXPFJIOIQPS-UHFFFAOYSA-N 435.996 4.420 10 10 IICE Cc1cc(CC(=O)NCc2ccc(OCCN3CCCC3)cc2)c(C)n1-c1ccccc1 1293341275 ODHLLBYLGFUNIA-UHFFFAOYSA-N 431.580 4.428 10 10 IICE CCN1C[C@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)cc2C)C[C@@H]1C 1295977422 OOZHUHOXOUCRPE-OALUTQOASA-N 436.604 4.188 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1)C(C)C 1299642873 JFLLLHZAPONUEJ-JTHBVZDNSA-N 437.588 4.249 10 10 IICE Cc1nn(C2CCOCC2)c(C)c1C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1354388471 LGTDTSPUVWNQRJ-UHFFFAOYSA-N 436.556 4.353 10 10 IICE Cc1ccc(N(C)C(C)C)c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1356422678 UTULIAXVEQXXSF-UHFFFAOYSA-N 434.628 4.302 10 10 IICE Cc1cc(CC(=O)Nc2nc(CN3C[C@H](C)O[C@H](C)C3)cs2)c(C)n1-c1ccccc1 1357327500 OLOOUYODWBFWDF-HDICACEKSA-N 438.597 4.341 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1csc(N2CCCCC2)n1 1435335040 XQIZXCCLDJYGEL-OAHLLOKOSA-N 436.528 4.134 10 10 IICE COc1ccc2cc([C@H](C)C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)ccc2c1 1436623390 DITZLXVQZCNFTL-INIZCTEOSA-N 440.490 4.383 10 10 IICE COC[C@@H](CC(C)(C)C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1437139981 BPSZMQQJYUCSEJ-VQCBNXJZSA-N 440.656 4.297 10 10 IICE CC(=O)c1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OC(C)C 1445882194 KNSRWCNFFCBVCC-FQEVSTJZSA-N 444.959 4.430 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1 1448835768 CKDIZXLDFZYQNK-IERDGZPVSA-N 439.556 4.424 10 10 IICE CCCN(CC(=O)Nc1ccc(Cl)cc1)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1458277391 QCTCDTSBXHLSIO-WZUFQYTHSA-N 431.876 4.290 10 10 IICE Cc1cc(C(=O)COc2cc3c(cc2[N+](=O)[O-])OCCO3)c(C)n1-c1cccc(F)c1 1459286940 DQSFQAHTLGCQJW-UHFFFAOYSA-N 426.400 4.174 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)COc3ccc(C4SCCCS4)cc3)C2)cc1 1461491905 DUQTXCXWUBOMQC-SFHVURJKSA-N 444.622 4.338 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)Oc2ccccc2Br)c(C)n1-c1ccccn1 1465681610 XQSNQJYZKLVMPJ-OAHLLOKOSA-N 428.330 4.449 10 10 IICE CCC[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1500279495 QEWGEDOQMDPGHN-FQEVSTJZSA-N 429.584 4.270 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1CCc2ccccc21 1521696653 XPQDNBHNDUGDOR-NNIWKIFQSA-N 440.565 4.263 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4cc(OC)cc(OC)c4)CCCC3)C2)cc1 1529411200 BAPNLXOOICSAGA-IBGZPJMESA-N 438.568 4.167 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](Cc3ccccc3)c3nccn3C)ccc21 1531178701 XBKVPMIFULRACI-QHCPKHFHSA-N 430.552 4.352 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(Cl)c(I)c1 1540811797 ITPYHNPLUFJQIN-UHFFFAOYSA-N 440.712 4.475 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)CCCc1ccccn1 1542226593 CXHMXALNIFNZCR-UHFFFAOYSA-N 441.583 4.227 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)c(Br)[nH]2)cc1F 1543251013 CVZJBXRRPUBTJG-UHFFFAOYSA-N 447.146 4.455 10 10 IICE Cc1cc(CCNC(=O)c2cncc(I)c2)c(C)n1-c1ccccc1 1543593622 JCVXPYJARPCFSY-UHFFFAOYSA-N 445.304 4.066 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3ccc(O)cc3O)[C@H]2c2cccs2)cc1 1557084924 UHIKWMNRVPQFNN-XXBNENTESA-N 436.533 4.268 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@H]3c3cccc(C)c3)CC2)cc1 1559553540 FYDMLIKHDINBKG-BDYUSTAISA-N 437.628 4.104 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)cc1F 1559642138 DUKXJXAPZWKTMH-UHFFFAOYSA-N 435.499 4.387 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](C)CN3CCN(c4ccccn4)CC3)c2C)c1 1565853663 VWYWFOCVQZZXGP-OAQYLSRUSA-N 445.611 4.046 10 10 IICE COc1ccc(CNC(=O)c2ccc([C@H]3CCCCN3C(=O)OC(C)(C)C)n2C)c(O)c1 1568097314 DYOOSQWKQQMZKA-LJQANCHMSA-N 443.544 4.131 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c2[nH]ncc12 1583707565 CXXDDPVEWNBUSA-YVLHZVERSA-N 440.525 4.240 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(CC(C)C)c3-c3ccccc3)CC2)cc1F 1595481760 GLFQFVCNSXGHHC-UHFFFAOYSA-N 436.531 4.316 10 10 IICE CCc1ccccc1O[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccccc1 1596523035 FHWWHSVEXDTTBK-MHZLTWQESA-N 443.591 4.437 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)OCc4ccccc4)CC3)c2C)c1 1596787827 LGNLPCCWLSTXQU-UHFFFAOYSA-N 431.536 4.497 10 10 IICE Cc1cc(CC(=O)N[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(C)n1-c1ccccc1 1611280636 LMTHGHVELZSNFK-SFHVURJKSA-N 439.478 4.208 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1614108829 LCKAFKCJSWFHFJ-FBBABVLZSA-N 429.609 4.050 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(OC)CCOC1 1614485673 GXNFGSQVDKKTPJ-RUZDIDTESA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCCN(CC(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)cc1 1615219419 JMGLUJOTPCAFKY-INIZCTEOSA-N 436.383 4.392 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)c1C 1618183021 LRISRLVHZPAVLN-DEOSSOPVSA-N 431.580 4.076 10 10 IICE CCCCNS(=O)(=O)c1cccc(NC(=O)c2sccc2-n2c(C)ccc2C)c1 1623399787 BFDSTINEAAFJCW-UHFFFAOYSA-N 431.583 4.486 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCCN(c3ccccc3F)C2)cc1 1632059841 RWXBROWHPQNDAG-JOCHJYFZSA-N 433.527 4.373 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](C)N(C(=O)OC(C)(C)C)C1CC1 1635673699 XNKFTTNYXGQZGW-CYBMUJFWSA-N 441.366 4.291 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1cccc(F)c1 1638749481 OFOIJUMTRDHVGG-DBAOIIQJSA-N 432.495 4.035 10 10 IICE Cc1nc2ccc(Br)cn2c1C(=O)NCc1ccc(N2CCCCC2)cc1 1639734929 JXAGFDKHDXIXBP-UHFFFAOYSA-N 427.346 4.326 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)c2ccc(O)cc2)c(C)n1-c1ccc(Br)cc1 1640103604 BSSMKNBBTSZFGO-JOCHJYFZSA-N 443.341 4.200 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(Cl)c(Cl)c1 1644590918 VCMSJEVKYUCTJK-FZKQIMNGSA-N 427.715 4.188 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCNC(=O)NCc1cc(Cl)ccc1O)Cc1ccccc1 1687328278 GVBZHNCZTBWIDG-LJQANCHMSA-N 447.963 4.371 10 10 IICE FC(F)(F)[C@H]1CCCN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)C1 1712858036 PPDYURFPMHLYLO-KBPBESRZSA-N 447.552 4.200 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1728381513 HRKZFYFTMNKLFH-SIKLNZKXSA-N 441.620 4.418 10 10 IICE CCN1CCC(CCn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)OC)CC1 1746390403 PFIBKRVBLWNCLR-UHFFFAOYSA-N 436.604 4.472 10 10 IICE C[C@H]1SCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)[C@@H]1C 1763284605 WPNXFMKGMRNCTG-HUUCEWRRSA-N 434.660 4.253 10 10 IICE CC/C=C/Cn1c(-c2cccc(C)n2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1763620586 GKMJKNSCQDJETR-AATRIKPKSA-N 432.572 4.340 10 10 IICE CCC[C@@](C)(O)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1765462554 XYFSHDSNMVTTRS-AREMUKBSSA-N 448.615 4.052 10 10 IICE O=C(OCC1c2ccccc2-c2ccccc21)N1CC[C@](C(=O)O)(c2ccc(O)c(O)c2)C1 1951734376 MPHSNDHAVKTKTF-AREMUKBSSA-N 445.471 4.075 10 10 IICE Cc1cc(O)c([C@@H](C(C)C)n2nc(C(F)F)c(CN)c2I)cc1C 2079856335 SSOOCEAGACLISL-OAHLLOKOSA-N 449.283 4.452 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(c3cccc(C(=O)O)c3)C2=O)c1)C(=O)O 2314927671 IZTOIGFGJAPGID-MRXNPFEDSA-N 443.502 4.033 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2CC(=O)Nc3ccccc32)cc1 97023921 VHGDKQWYCJSXLB-HSZRJFAPSA-N 429.520 4.420 10 10 IICE C[C@@H](NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(C)(C)C 303473690 RHWAJCMHJSJNLB-RLIURORJSA-N 441.416 4.201 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(F)c(NC(=O)OC(C)(C)C)c3)CC2)cc1 730447499 BKZFIFNNRBBFJN-UHFFFAOYSA-N 429.492 4.144 10 10 IICE COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)NCc1ccc(N(C)C)cc1C 734651276 JSRBNEJWUYLJAN-UHFFFAOYSA-N 438.572 4.408 10 10 IICE CC[S@](=O)CCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 739581053 ZOMSEYJJUUKNKC-BTNQKDBJSA-N 447.604 4.286 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(N3CCCC3=O)ccc2F)cc1 741532755 DEYXZHDLTAQYEM-UHFFFAOYSA-N 435.499 4.454 10 10 IICE CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)cc1 760359617 FKZKXAYGDQPBQK-UHFFFAOYSA-N 434.942 4.130 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1nnc(SCc2ccc(F)cc2)s1 797607959 VPQSFKPBBNZWIR-LLVKDONJSA-N 434.518 4.133 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)c1ccc(N2CCOCC2)cc1 812015490 QXGJXDFMUJPORU-DYESRHJHSA-N 439.560 4.172 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N1CCOc2ccccc21 915149699 ZXRJHCNZFFFNSD-GHRIWEEISA-N 430.576 4.155 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccnc(F)c1F 1131428821 JZTYQJVJHQOOLQ-XFXZXTDPSA-N 425.507 4.041 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)cc1 1137658748 UTOMFDTZCQNJKJ-UHFFFAOYSA-N 445.563 4.197 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3sc(-c4c(C)noc4C)nc3C)CC2)cc1 1151503377 RSFGPGNPHDTOSF-UHFFFAOYSA-N 426.542 4.084 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3F)C2)C2CC2)cc1 1234160312 WFYITSAPBOYYJA-SFHVURJKSA-N 430.955 4.498 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c2C)c1 1253531912 NEMGGOHDDZFCFY-QGZVFWFLSA-N 428.577 4.457 10 10 IICE Cc1ccc(C(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1-n1c(C)cc(C=O)c1C 1297557752 PLCCNPOLXNGQDB-UHFFFAOYSA-N 437.883 4.452 10 10 IICE CSC[C@@H]1CCCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCSCC2)cc1 1316438815 JILMCXUVRSFGAC-NRFANRHFSA-N 445.702 4.410 10 10 IICE CC1(C)Cc2ccc(C(=O)Nc3cccc(N(CC(N)=O)Cc4ccccc4)c3)cc2O1 1360124989 UCSZFTBXWYKNDB-UHFFFAOYSA-N 429.520 4.144 10 10 IICE CC1=C(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)NC(C)C)CC1 1360882938 FFEIQZRUHXFQFI-UHFFFAOYSA-N 446.599 4.424 10 10 IICE CCN(C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1439253141 VAQUXHCCTRXTHR-HXUWFJFHSA-N 443.588 4.376 10 10 IICE Cc1ccc([C@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCOCC2)cc1 1441919790 VKCWCZZNQGIBDE-SANMLTNESA-N 445.563 4.018 10 10 IICE C[C@@H]1CN(C(=O)c2cccc3c2CCN3C(=O)OC(C)(C)C)c2ccccc2N(C)C1=O 1445035477 SZUDVVOCEZURTA-MRXNPFEDSA-N 435.524 4.244 10 10 IICE CC(=O)c1cccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1450170115 PCDORLFMTVCYRL-UHFFFAOYSA-N 426.314 4.384 10 10 IICE COc1ccc(N2C[C@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)cc1 1464544805 ZUZRAQNAEYCGOE-HXUWFJFHSA-N 435.568 4.133 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N(C)CCN2CCN(c3ccccc3)CC2)c1 1465387055 RQXQZKXDTDTLOS-UHFFFAOYSA-N 430.596 4.297 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1 1470465477 GSNGGOVTFMRQNA-MISYRCLQSA-N 431.577 4.349 10 10 IICE Cc1cnn(CC2CCN(c3nnc(CC(C)C)n3Cc3ccc(N(C)C)cc3C)CC2)c1 1492622237 IXBZPNGKRGKBDP-UHFFFAOYSA-N 449.647 4.321 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@@H]2CCCOC2)n1CCC(C)(F)F 1517122668 ZJKXRQSRJJWDLE-LJQANCHMSA-N 433.547 4.454 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(S(=O)(=O)c3ccccc3)CCCCC2)cc1 1525918577 NHPKPDCPDIACNR-UHFFFAOYSA-N 428.598 4.326 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc2ccccc12 1526260385 XUPPKDRUPBGSAS-OAQYLSRUSA-N 429.564 4.136 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1545257433 MDDUWNRGYPWACN-IBVKSMDESA-N 448.615 4.374 10 10 IICE CC[C@]1(C)CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CCO1 1546097807 QAYCDAOMVOPALO-RUZDIDTESA-N 425.621 4.439 10 10 IICE CCCN1CCC(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)OC)CC1 1547168916 QOQKPKVMVIMURL-UHFFFAOYSA-N 436.604 4.472 10 10 IICE CN(CCC(F)(F)F)[C@@H](CNC(=O)Cc1ccc(O)c(O)c1)c1ccc(Cl)cc1 1568970034 MHGJOWIRDLFRAX-INIZCTEOSA-N 430.854 4.035 10 10 IICE O=C(Nc1ccc2c(c1)CCCC2=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1570651646 IQVABRRLJNHPDT-UHFFFAOYSA-N 442.518 4.026 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(I)ccc1C 1584088992 JCOWRNFGQGGQMT-HNNXBMFYSA-N 436.337 4.335 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1615768706 MUPYZXKXXWZUEB-ROUUACIJSA-N 430.616 4.039 10 10 IICE CN(C)c1nccc2c1N(C(=O)c1cccc3c1CCN(C(=O)OC(C)(C)C)C3)CCC2 1616281744 FCLHGQPVKILOHB-UHFFFAOYSA-N 436.556 4.034 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)CC(=O)N(C)[C@H](C)c1ccccc1 1617372336 BZVIPGOVHRLMQP-LJQANCHMSA-N 431.536 4.198 10 10 IICE CCc1ccccc1OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1618253063 JDVVDBXNBVGCPR-OAQYLSRUSA-N 441.572 4.076 10 10 IICE CC(C)C[C@@H](CC(=O)NCc1ccc(N2CCSCC2)cc1)NC(=O)OC(C)(C)C 1624893473 XJZHCDNOWWOAHO-IBGZPJMESA-N 435.634 4.186 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc(S(=O)(=O)N(C)C)c3)c2C)c1 1628378662 PZFSPMVWJFSHJO-UHFFFAOYSA-N 425.554 4.214 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1 1632158201 VFYRSUYJTDIXFU-GGAORHGYSA-N 443.385 4.474 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cccc4c3CCN(CC(C)(C)O)C4)c2C)cc1 1632706756 YKSAQFISDYSADW-UHFFFAOYSA-N 447.579 4.484 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3cc(O)ccc3C2)c(C)n1-c1ccc(Br)cn1 1635430426 YNUDRICNJOEHOM-SFHVURJKSA-N 440.341 4.245 10 10 IICE Cc1cc(C(=O)N2CCN3C(=O)N(CC(C)C)C[C@H]3C2)c(C)n1-c1cccc(C(C)C)c1 1635788518 DYKZVZRUBBXFGQ-HSZRJFAPSA-N 436.600 4.436 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C[C@@H]2c3ccccc3CN2C(=O)OC(C)(C)C)c1 1636061837 YVFVFMYWNSUMCE-MGPUTAFESA-N 426.513 4.460 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1nc2ccccc2o1 1637987014 YJRNDQWEKCAYMJ-WJDWOHSUSA-N 443.575 4.187 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1643933443 VSPJJPZADIFSBA-YESZJQIVSA-N 448.405 4.084 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2Cc1nnc(-c2ccccc2O)o1 1653349609 UCXCICXGTLMLTC-UHFFFAOYSA-N 436.512 4.420 10 10 IICE O=C(CN[C@H](C(F)F)C1CCCCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1655117897 CBDZAUBQTQANJI-NRFANRHFSA-N 426.463 4.204 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NCc3ccc(N4CCOCC4)cc3)C(C)(C)[C@@H]21 1655916516 WOWRKDJJBTWOGA-BHIFYINESA-N 429.605 4.037 10 10 IICE CCN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](C)c1cccc(OC)c1 1683196039 XQSXILJOBJCGNL-INIZCTEOSA-N 433.499 4.103 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(CCc3ccc(F)cc3)C3CCCC3)cc2)CC1 1683701741 KBBYLQCLPWBNOQ-UHFFFAOYSA-N 438.591 4.274 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C[C@@H](C)S1 1693824030 PGQFUEZWVMGFKR-IYBDPMFKSA-N 446.671 4.233 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCSC1 1695187039 ANVQMNZMXRJNTB-DEOSSOPVSA-N 439.629 4.457 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1706434921 KBSVCXNUHVZQTB-KRWDZBQOSA-N 448.662 4.025 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCC(=O)NC2CCCCC2)o1 1707346099 SAWDOIKTGMBKOO-UHFFFAOYSA-N 437.544 4.028 10 10 IICE CCc1nnc(N2CCS[C@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1709165295 MNCFCIODEMGZHK-FQEVSTJZSA-N 431.675 4.020 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1709467936 JBLSEFJZEDSVMP-GOSISDBHSA-N 431.600 4.472 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CC(C)C)C(=O)C1 1709743081 DAEIHEZAIQEBNS-UHFFFAOYSA-N 434.588 4.067 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCN(C2CCCC2)CC1 1724233942 DVJQIYJYADYJSY-UHFFFAOYSA-N 438.664 4.354 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)CCC(F)(F)F 1724236031 PXNDRQDEOPASAN-GOSISDBHSA-N 425.499 4.331 10 10 IICE COCC1(C)CCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1749389632 VEHBTITTZHYYKO-OAQYLSRUSA-N 445.583 4.026 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC(C)(C)c2ccccn2)cs1 1762265875 CZFQSRWOTAJTKC-UHFFFAOYSA-N 448.596 4.349 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)C[C@H]2CCCCO2)cc1F 1766912271 SGDHQODQUJYEBM-LJQANCHMSA-N 443.592 4.189 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1768311641 XTKKFKMNAOFPKC-HKBQPEDESA-N 437.613 4.278 10 10 IICE COCC1(C)CCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)CC1 1770810749 ASUIIWFDHLJOJI-UHFFFAOYSA-N 446.646 4.175 10 10 IICE COc1ccc([C@@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@@H]2C(=O)O)c(O)c1 1952762782 MQKDKURUMGSHGH-GJZUVCINSA-N 445.471 4.239 10 10 IICE O=C(N[C@@H]1CC[C@@H]1NCc1cc(Cl)cc(Br)c1O)OCc1ccccc1 1977132691 VMQZLKDBVLSBAX-DLBZAZTESA-N 439.737 4.355 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C3(C)CC3)c(C=O)c2I)c(O)c1 2079022018 BVRWKUUVTYXQFW-INIZCTEOSA-N 436.293 4.365 10 10 IICE C[C@H](NCc1ccc(Br)cc1O)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116257366 SSLNKSHOPDGWJS-SJCJKPOMSA-N 425.323 4.492 10 10 IICE CN(C[C@@H](O)COCc1ccccc1)c1ccc(CNC2CCC2)cc1Br 2240053670 NKAFFADKWIIMIU-HXUWFJFHSA-N 433.390 4.105 10 10 IICE COc1ccc(N2CCN(c3ncc4c(n3)C[C@@H](C=Cc3ccccc3)CC4=O)CC2)cc1 2294812029 KVJGRERCXFIDDO-OAQYLSRUSA-N 440.547 4.270 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3ccc4c(c3)C[C@H](C)O4)SC2=S)cc1OC 2296175744 ONHGQNYKHDSLIU-AWEZNQCLSA-N 441.574 4.471 10 10 IICE O=C1C(=Cc2ccccc2)SC(=S)N1CCCCCC(=O)N1CCCC[C@H]1CCO 2296567509 DNOHGBBVRNMVBK-IBGZPJMESA-N 446.638 4.212 10 10 IICE Cc1ccc(CNC(=O)[C@](C)(NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2352643600 QIESEFUIYNRSTP-LJQANCHMSA-N 429.355 4.019 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CC[C@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380758057 TZKKRYKOMFUVNV-DZGCQCFKSA-N 441.366 4.115 10 10 IICE CC(/C=C1\SC(=S)N([C@@H]2CC(=O)N(c3ccc(C)cc3)C2=O)C1=O)=C\c1ccccc1 14903947 MHYXYOUEGHKRLY-XPGSPABTSA-N 448.569 4.475 10 10 IICE O=C1/C(=C2/SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)c2ccccc2N1CO 33482912 VEVAPMXYQOWRPK-CCEZHUSRSA-N 437.329 4.066 10 10 IICE CC(C)c1ccc(OC[C@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 40315888 PXFXXUAWMHLLQR-RSXGOPAZSA-N 426.601 4.297 10 10 IICE C[C@@H](NC(=O)/C=C/c1ccc(OCc2ccccn2)cc1)c1ccc(N2CCOCC2)cc1 109181217 MNVIQJKPDDGQRP-NPZXAABXSA-N 443.547 4.388 10 10 IICE O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(S(=O)(=O)N3CCCC3)cc2[C@@H]2C=CC[C@@H]21 226834314 OTHDFLUDLDVQNY-HYFFOGBASA-N 425.510 4.206 10 10 IICE Cc1sc(NS(=O)(=O)c2cc(C(=O)N(C)C)ccc2Cl)nc1-c1ccccc1 747751981 UPHQOZDVMNQQCG-UHFFFAOYSA-N 435.958 4.275 10 10 IICE CN1CCCc2cc(/C=C3/NC(=S)N(c4ccc(OC(F)(F)F)cc4)C3=O)ccc21 748033337 IFQVPTGRKCAQGQ-SFQUDFHCSA-N 433.455 4.230 10 10 IICE Cc1cc(C)n(Cc2ccc(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)cc2)n1 767383780 UKCPIDPFWXXERV-UHFFFAOYSA-N 431.584 4.331 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@@H](c1ccccc1)[C@@H]1CCOC1 772458961 GNINDRHMZQLQOL-GCJKJVERSA-N 445.510 4.334 10 10 IICE COc1cc(SC)ccc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 772638611 ARHMAVFNGSZZEM-UHFFFAOYSA-N 440.613 4.271 10 10 IICE O=S(=O)(Nc1nc(-c2ccc3c(c2)OCCO3)cs1)c1c(F)cccc1Cl 780703110 AJXKNEKUWNBCSH-UHFFFAOYSA-N 426.878 4.175 10 10 IICE COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 795604128 BOPDHVHCAQHLSW-UHFFFAOYSA-N 431.495 4.016 10 10 IICE COc1cccc([C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 1128247109 MPXOISSRVSNVJP-KKSFZXQISA-N 427.545 4.204 10 10 IICE O=C(/C=C\c1cnc2ccccc2n1)N(C[C@H]1CCCO1)c1ccc(Br)cn1 1130008421 KHHAWNFNPSKAKE-SECOEOQKSA-N 439.313 4.013 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Br)sc(C)c3C)CC2)c(OC)c1 1132031884 AKEVTUHWMBQJAQ-UHFFFAOYSA-N 439.375 4.107 10 10 IICE Cc1cc(C(=O)NC[C@]2(N(C)C)CCSC2)c(C)n1-c1ccc(Br)cc1 1137151029 DAMKBVXWYCYASQ-HXUWFJFHSA-N 436.419 4.024 10 10 IICE CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1169565241 BBHLSMNBUPGZDB-ZGNKEGEESA-N 448.563 4.362 10 10 IICE C[C@H](CCc1ccc(I)cc1)NC(=O)N[C@H](C)c1ccccc1O 1248383907 GEVSIEFPRJOIMB-ZIAGYGMSSA-N 438.309 4.378 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCOc1ccc(Cl)c(Cl)c1 1251495184 MAWFWBVPFAFCOE-UHFFFAOYSA-N 438.355 4.050 10 10 IICE CC1(C)C[C@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2cc(F)ccc2O1 1251751094 VVAMZWUPTABFPF-IBGZPJMESA-N 449.473 4.042 10 10 IICE COC(=O)COc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1Cl 1266385206 KODSFEFMZWKWGD-UHFFFAOYSA-N 426.900 4.481 10 10 IICE Cc1cc(CNC(=O)[C@H]2C[C@@H](F)CN2C(=O)OCc2ccccc2)c(C)n1-c1ccccc1 1287661072 MZAMXZFCTFJTOA-ISKFKSNPSA-N 449.526 4.460 10 10 IICE CCOc1ccccc1[C@H](CC(=O)NCc1ccc(N(C)C)cc1)NC(=O)OC(C)(C)C 1290253249 SGNNZQMIVBTZHQ-NRFANRHFSA-N 441.572 4.424 10 10 IICE C[C@@H]1CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C[C@@H](C)S1 1291232527 NXVUTMOGDWGTPU-HUUCEWRRSA-N 432.644 4.309 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(C[C@@H]4CC(=O)NC4=O)cc3)c2C)c1 1293733883 JYVFMLXNTLGJLL-HXUWFJFHSA-N 429.520 4.168 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(C(=O)OC(C)(C)C)nn1C 1295590855 QLUMTYLBTVAQLB-KRWDZBQOSA-N 435.524 4.485 10 10 IICE CCO[C@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1296987596 OKBPSGRCEWOJPN-QHCPKHFHSA-N 425.621 4.439 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC1(CN2CCOCC2)CCCCC1 1302579910 UVJFHYQBCNYLMK-UHFFFAOYSA-N 441.620 4.026 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](CC(N)=O)C1 1306701081 QWFOTFZCANZBRA-FQEVSTJZSA-N 434.588 4.245 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F 1351162379 FVTSLBJSCQUZKK-UHFFFAOYSA-N 447.436 4.298 10 10 IICE CN(C)c1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)nc2ccccc12 1352892772 UDKNLKLEKZOUQC-UHFFFAOYSA-N 440.494 4.301 10 10 IICE Cc1cc(-c2nnc(N(C)C3CC3)n2CCNC(=O)C(C)(C)C)c(C)n1-c1ccccc1 1361045030 LKHMRWCUOUDGJM-UHFFFAOYSA-N 434.588 4.114 10 10 IICE Cc1ccc(C(=O)N2CCCN(C(=O)c3ccccc3)CC2)cc1-n1c(C)cc(C=O)c1C 1464022661 BREMMQJYEOSDFP-UHFFFAOYSA-N 443.547 4.203 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccccc1CCNC(=O)OC(C)(C)C 1464505753 JPEPSCJTAQALID-UHFFFAOYSA-N 425.573 4.482 10 10 IICE Cc1nc(C)n(Cc2cccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)c2)n1 1465624520 XIUISARUUFPWMC-UHFFFAOYSA-N 441.535 4.344 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1469433882 ISMZSMJNDAOSEF-LLVKDONJSA-N 446.693 4.096 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nc(CN(C)C)cs3)cc2Cl)C1 1469958467 CZVCBKWTFQJFSO-OAHLLOKOSA-N 436.025 4.094 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1503155516 QIXRAWBTNYTABA-INIZCTEOSA-N 433.603 4.348 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccc2c(n1)CCC2 1521773747 WSJGUZKDIJSCRO-FOWTUZBSSA-N 429.592 4.252 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccnc(OC4CCCCC4)c3)cc2F)C[C@@H](C)O1 1526002964 KBXIQLRPSRPSHE-QZTJIDSGSA-N 441.547 4.476 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)sc1-c1ccccc1 1527735527 VKHISKKRDJTOJC-HXUWFJFHSA-N 433.577 4.355 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)N(C)C)cc1 1537482293 CTUABMDBSWEDHS-IBGZPJMESA-N 430.524 4.187 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)CN(C)Cc2ccccc2)C1 1544940203 XDJGBWIUVUQFDB-OAQYLSRUSA-N 432.612 4.045 10 10 IICE CCC(CC)[C@H](CCn1c(C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1545798866 SNZCTOUDTWKOPB-QHCPKHFHSA-N 429.609 4.153 10 10 IICE COc1ccccc1N1CC[C@@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)C1 1546198621 CNKJRGZHIIAVQN-FQEVSTJZSA-N 431.536 4.172 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(C)C)cc1 1557357653 XDOQDTOCEIOJOF-HXUWFJFHSA-N 435.609 4.165 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC3(c4cccc(F)c4F)CCCC3)C2)cc1 1564559219 MIASBYGXOHEZKP-KRWDZBQOSA-N 429.511 4.363 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1Cc2ccccc2OC2(CCOCC2)C1 1564945820 GGXSZXWPYPNIPR-FQEVSTJZSA-N 437.584 4.145 10 10 IICE Cc1cc2ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)cn2c1 1565882479 ZKBRCWZESPARQT-QFIPXVFZSA-N 436.556 4.310 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1 1567596944 RBNHENKTVFWKEK-XMMPIXPASA-N 431.580 4.423 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)ccc21 1584446626 UJPXNWWJSDYQFK-UHFFFAOYSA-N 431.577 4.280 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)c2C)cc1 1585076108 WQOSDDFXNCPAHR-NHCUHLMSSA-N 445.535 4.180 10 10 IICE CC(F)(F)C(C)(C)CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1595321885 XGJDAJZGKLGKJI-GXDHUFHOSA-N 430.517 4.215 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CCCC[C@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1596733440 RTEQXALHTDRLDO-BWKNWUBXSA-N 445.604 4.208 10 10 IICE COC(=O)c1cc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c2ncccc2c1 1597608035 XWVAOGCPOKNNNM-UHFFFAOYSA-N 427.460 4.494 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCO[C@@H]1C(C)C 1614012329 QUCNYNDCLFUFHG-HYBUGGRVSA-N 441.620 4.017 10 10 IICE Cc1cc(C(=O)N[C@@H](CCNC(=O)OC(C)(C)C)C(F)(F)F)c(C)n1-c1ccccn1 1626670766 NHBASQDOZINFCH-INIZCTEOSA-N 440.466 4.065 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1 1628468574 DNCCZYVNNAYBJX-UHFFFAOYSA-N 433.593 4.017 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1 1629940762 LJCWTJUBAOJASK-UHFFFAOYSA-N 436.943 4.244 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(N2CCC(C)CC2)nc1 1630338814 ZLZUBESSQSTVAY-UHFFFAOYSA-N 430.552 4.468 10 10 IICE Cc1cc(N2CCC[C@H](NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)C2)n(C)n1 1634321933 STCVBKHEGIMSNG-IBGZPJMESA-N 425.964 4.188 10 10 IICE CCOC(Cn1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cn1)OCC 1635126830 PDQHMHMBNMETPY-KRWDZBQOSA-N 448.995 4.102 10 10 IICE Cc1cc(C(=O)N(CCO)CCNC(=O)OC(C)(C)C)c(C)n1-c1cccc(C(C)C)c1 1650932283 PQQTUZIOURBJHS-UHFFFAOYSA-N 443.588 4.177 10 10 IICE Cc1cc(C)cc(N(CC(=O)NCc2ccc(N(C)C)cc2)CC(=O)Nc2ccccc2)c1 1657703684 ZQUAINNHLACJBX-UHFFFAOYSA-N 444.579 4.131 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3ccc(C)c(Br)c3)C2)cc1 1683340821 ZDPPYYWUUAFQNM-KRWDZBQOSA-N 432.362 4.092 10 10 IICE COc1ccc(C[C@H]2CCCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1687806962 LVXVSTISHYQYNR-NOZRDPDXSA-N 438.616 4.171 10 10 IICE CC(C)CN(c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)c(F)c1)C1CCCC1 1692409455 HLKCAPWYIBAPBW-UHFFFAOYSA-N 437.567 4.394 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(N)=O)C1 1694984785 XIESQACAZHLGPX-FMSOUQGNSA-N 432.572 4.021 10 10 IICE CC(C)c1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1706303033 GPCAIWMLFCYLIS-FQEVSTJZSA-N 429.584 4.298 10 10 IICE CCN(c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H](C)C1CCC1 1709956328 ZZISLJVCCFBITN-PXNSSMCTSA-N 429.584 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H]3OCCC[C@H]3C2)cc1 1710026988 VCEVOZNNCGRBFQ-GMAHTHKFSA-N 425.621 4.376 10 10 IICE Cc1ccc(-c2nnc(N3CCO[C@H](C(C)C)C3)n2CCCSc2nccs2)o1 1724326378 VKNCKXPMVUTXSI-KRWDZBQOSA-N 433.603 4.347 10 10 IICE CC[C@@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1727275975 NVBQPCPYNJMYIO-FQEVSTJZSA-N 425.602 4.147 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)CCO1 1727322806 RHFKZEVCRYJOMO-VWLOTQADSA-N 437.588 4.394 10 10 IICE Cc1ccc2oc(=O)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc2c1 1866291540 DXFXAKVIVXHGRT-QHCPKHFHSA-N 433.552 4.124 10 10 IICE CC[C@](C)(O)CN(Cc1ccccc1)c1ccc(CNCCOC)c(Br)c1 1915216268 HKUGHCXCPFTMQD-QFIPXVFZSA-N 435.406 4.353 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(C)(C)C)c(CN)c2I)c(O)c1 2079039563 DBLGCOLBACBUCG-INIZCTEOSA-N 439.341 4.257 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2(C)C)c1O 2236038518 ACRQTFLZYWGQDB-INIZCTEOSA-N 443.382 4.431 10 10 IICE Cc1ccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(O)cc4)c3C)C(=O)NC2=S)c(C)c1 2293763520 BJFFEUDGQTXOBE-UHFFFAOYSA-N 445.544 4.248 10 10 IICE CN1C(=O)/C(=C(/Cc2ccccc2)C(=O)Nc2nc3ccccc3s2)SC1=S 39793741 UBXOUUHSDNKYCL-DTQAZKPQSA-N 425.560 4.222 10 10 IICE CN(C)c1ccc(/C=C\[C@@]23NC(=O)CN2c2ccc(Br)cc2C3(C)C)cc1 143206348 KGZUVUNFFZRBDN-SSSWZJSRSA-N 426.358 4.152 10 10 IICE CC(C)(C)OC(=O)N1CCC(OCCCNCc2cc(Br)ccc2O)CC1 312186173 LZVXDZCXEOQFOH-UHFFFAOYSA-N 443.382 4.051 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@H]1N[C@@H](CC)c1cc(Br)ccc1O 380974467 WWSASLYMAMJXGM-CWLKWCNXSA-N 443.382 4.266 10 10 IICE Oc1c(Br)cc(Br)cc1[C@H](c1cccs1)N1CCOCC1 575276228 PQSJFTBXXSQWLI-CQSZACIVSA-N 433.165 4.400 10 10 IICE O=C(O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(C(=O)O)cc1O 687755766 IOWHXBOYFUHMLO-NRFANRHFSA-N 447.443 4.145 10 10 IICE CC(C)(C)OC(=O)c1ccc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 745904677 MJIPXQGCLATPMK-OAQYLSRUSA-N 440.540 4.238 10 10 IICE Cc1ccc(/C=C\C(=O)N[C@H](C)CN(C(=O)/C=C/c2ccc(C)nc2)c2ccccc2)cn1 754259227 GXCPMOHRTRBMEO-ZQVSWXSJSA-N 440.547 4.358 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccccc2N2CCOC2=O)C1 766578597 XSIRHJJJSKYSHD-UHFFFAOYSA-N 432.524 4.003 10 10 IICE COc1ccc(Cl)c(NC(=S)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768297219 VKTQYCGFKGLGKX-UHFFFAOYSA-N 445.032 4.367 10 10 IICE COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1 777741655 TYELLYNFSDBKQE-CTNGQTDRSA-N 435.927 4.217 10 10 IICE O=C(c1cc(Br)cc2nc[nH]c12)N(Cc1ccco1)Cc1ccccc1O 800514347 HQQBWELSQLGLCY-UHFFFAOYSA-N 426.270 4.467 10 10 IICE Cc1cc(-c2nnc(N3CCC(C(=O)N[C@H](C)C(C)C)CC3)n2C)c(C)n1-c1ccccc1 800747597 MIHHHZREBPZSKX-LJQANCHMSA-N 448.615 4.267 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(Cc2ccccn2)n1C[C@H]1CCCO1 802689048 JGLSTXKHZFCZSD-XMMPIXPASA-N 446.599 4.070 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1csc(C(F)(F)F)n1 819519633 ZJNZCXVWMCFUIH-UHFFFAOYSA-N 429.464 4.164 10 10 IICE CCOc1ccccc1CN(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918219923 QYOLUJLFQQNYGV-ROUUACIJSA-N 429.536 4.180 10 10 IICE CCOCCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)cs2)cc1 920351243 WQMLSYQESLCWTL-UHFFFAOYSA-N 434.539 4.035 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccc3nc(O)n(CC(F)(F)F)c3c2)cc1 1135735449 OVZBBKGEQIOHLO-UHFFFAOYSA-N 434.462 4.423 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCc3c(O)cccc32)c(C)n1-c1ccc(Br)cn1 1146792331 WNSKAVMJMPNVOE-GOSISDBHSA-N 426.314 4.375 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccc(OC)cc1 1159345633 OKEPKLXQGFEIFF-NRFANRHFSA-N 426.900 4.400 10 10 IICE Fc1cc(CNc2ncncc2-c2ccc(Br)cc2)ccc1N1CCOCC1 1184938707 ZKKMDNPZRCCVBR-UHFFFAOYSA-N 443.320 4.494 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC(Cc4c(F)cccc4Cl)C3)C2)cc1 1230300059 AYPNXLJTZPRQTD-MRXNPFEDSA-N 431.939 4.198 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1255015892 HDADWIYNXLDSHB-ZVDOUQERSA-N 430.593 4.072 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3ccc(F)cc3)CC2)N(C)C)cc1 1256232880 WKNBHQYFTDWANQ-DEOSSOPVSA-N 426.580 4.159 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1296026062 AAIYXBJURZNCGE-KRWDZBQOSA-N 431.920 4.483 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 1297296958 GUVZPDJMRMVCHF-HDICACEKSA-N 432.524 4.168 10 10 IICE CN1CCCc2cc(Cn3c(CC4CCCC4)nnc3N(C)CCCCCO)ccc21 1298889190 RLEYOOLRTPIMDP-UHFFFAOYSA-N 425.621 4.040 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CC[C@H](CC(C)C)C1 1304238874 YAGUPPZFYMMDTG-IFMALSPDSA-N 425.621 4.467 10 10 IICE C[C@H](C[C@@H](C)NC(=O)N(Cc1ccco1)Cc1ccccc1O)NC(=O)OC(C)(C)C 1312914410 OUSJYFXEEYCBNJ-IAGOWNOFSA-N 431.533 4.389 10 10 IICE Cc1ccc2nc([C@H]3CCCN3C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)[nH]c2c1 1313419934 WDXBYNBJFAENLF-DHIUTWEWSA-N 434.588 4.087 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C1 1314271275 DJCBFRIDMROZTM-GGAORHGYSA-N 441.620 4.072 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]3[C@@H]2CCCN3C)sc(C)c1-c1ccccc1 1460731259 QUHSMZRCXHXHJE-MOPGFXCFSA-N 441.597 4.007 10 10 IICE Cc1cccc(C)c1OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324743 HXDIIMPEJKGLNA-OAQYLSRUSA-N 441.572 4.130 10 10 IICE Cc1cc(C)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)n1 1465324945 KLYYFIHZOIOUNK-HXUWFJFHSA-N 426.561 4.069 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](CO)c3ccccc3C(F)(F)F)ccc21 1472031254 MRFNDTUEUYFZOR-HXUWFJFHSA-N 434.458 4.387 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3c(C)noc3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1511083901 YLFUANDYMHVBMH-UHFFFAOYSA-N 449.534 4.143 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2CC(F)(F)C2)n1Cc1ccc(N2CCOCC2)cc1 1512813881 IUGVJPCXXQOOKM-KRWDZBQOSA-N 433.547 4.158 10 10 IICE C[C@H](NC(=O)CSc1ccccc1Br)c1ccc(N2CCOCC2)cc1 1519155640 HOULYAYBQXSKRI-HNNXBMFYSA-N 435.387 4.255 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2ccc(F)cc2C1 1526380368 PTWQBHJQKGQQIB-YBFXNURJSA-N 444.528 4.141 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cn2c(-c3scnc3C)nc3ccccc32)cc1 1530897839 TYMBREWWYXEMBQ-UHFFFAOYSA-N 449.580 4.072 10 10 IICE Cc1cncc(N(Cc2ncc[nH]2)C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1 1544415583 NMINHNOREFKFTK-UHFFFAOYSA-N 447.539 4.253 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CC[S@@](=O)C(C)(C)C 1554160223 RZNYZJWCUOFCII-WJOKGBTCSA-N 445.677 4.359 10 10 IICE O=C(NCc1cc(Cl)ccc1O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1 1564658471 WVHKLSZAXRQNHJ-UHFFFAOYSA-N 440.931 4.164 10 10 IICE Cc1cc(CCNC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1565162318 SEDYHPFOVPKVAD-VWLOTQADSA-N 440.588 4.335 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2nc(C)cc2C(F)F)cc1 1565655968 JMLKMXPSDYPEDN-UHFFFAOYSA-N 428.483 4.437 10 10 IICE CCN1C[C@H](CN(C)C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)Oc2ccccc21 1587534990 GYYXXBFWQGJYCJ-QFIPXVFZSA-N 433.552 4.462 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CCCC[C@@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1596733444 RTEQXALHTDRLDO-PXDATVDWSA-N 445.604 4.208 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](C)Sc3nc4ccccc4s3)C2)cc1 1598364172 OACQHMALBASBLO-CVEARBPZSA-N 427.595 4.428 10 10 IICE C/C=C/C[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C(=O)OCC 1611354223 RTJIPZDOJRHWGJ-SUQGKYDKSA-N 433.346 4.484 10 10 IICE COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)NCc2ccc3c(c2)CCCN3C)cc1 1625847853 JRLXBXOFZXLADD-UHFFFAOYSA-N 447.510 4.399 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C(C)C)cc(C(C)C)c3O)cc2)CC1 1632944588 CYZWJZPFPMURPJ-UHFFFAOYSA-N 437.584 4.238 10 10 IICE O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)N1Cc2cccc(O)c2C1 1636231175 UQDRGIQWXMTDSW-UHFFFAOYSA-N 434.926 4.064 10 10 IICE C[C@H]1CCc2ccccc2[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1637301322 WBBGTCJLFPEPTG-QKKBWIMNSA-N 442.562 4.308 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1640260164 SZLLECWKLJFFTH-SJORKVTESA-N 425.566 4.167 10 10 IICE Cc1ccc([N+](=O)[O-])c(OCCC(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)c1 1640367337 AGISGTYHZMFEPG-UHFFFAOYSA-N 439.434 4.329 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C[C@@H](NC(=O)OC(C)(C)C)C2CC2)cc1 1644031381 VRNPQLBKVOPMGT-GOSISDBHSA-N 443.510 4.337 10 10 IICE CC(C)(C)OC(=O)NCC[C@@H]1CN(C(=O)c2c[nH]nc2-c2cccnc2)c2ccccc21 1647736507 IVXJHAQRLDMPAL-QGZVFWFLSA-N 433.512 4.131 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)[C@@H](c2ccccc2)C1 1653819273 GFBVWUXIHLXOFJ-XMMPIXPASA-N 437.584 4.317 10 10 IICE COc1ccc(N2CCN(c3ccnc(-c4ccc(Br)cc4)n3)CC2)cc1F 1655258305 NQUOEVYRVZCJHZ-UHFFFAOYSA-N 443.320 4.380 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1 1657675782 GDQLLPFZJLEEGB-UHFFFAOYSA-N 435.480 4.300 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1(Cc2cccc(Cl)c2)CC1 1673472190 CCAKYFUGLLAKOS-UHFFFAOYSA-N 435.902 4.029 10 10 IICE CCOC(=O)CC[C@@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1674924268 NRVSSHWSFVOMEI-NRFANRHFSA-N 425.573 4.402 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCCC[C@H]3c3c(C)n[nH]c3C)C2)cc1 1686854944 KXLRBGSKTPPEPL-KNQAVFIVSA-N 425.577 4.188 10 10 IICE COC(=O)C1CC2(C1)C[C@H](NC(=O)N(C)Cc1ccc(N3CCCCC3)cc1)CCS2 1687794344 BVKQMKDUVVWPHF-ITGJCUMNSA-N 445.629 4.036 10 10 IICE Cc1cc(-c2nnc(N(C)C3CCCCC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1707254493 YLWXIUQLDZPQMT-UHFFFAOYSA-N 434.588 4.210 10 10 IICE COc1ccc(N2CCN(c3nnc(CC4CC4)n3CCCC(F)(F)F)CC2)cc1F 1711866347 WMEXSAYDXFFRMF-UHFFFAOYSA-N 441.473 4.047 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1726842999 JIYSARJTAXNEHM-DFBJGRDBSA-N 443.636 4.098 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCSC1 1726877436 MXBKTLDHZHZEPW-QUCCMNQESA-N 429.634 4.018 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nccc(C(F)F)n1 1750609760 FLLPRDQFUVSDKL-UHFFFAOYSA-N 441.530 4.414 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)[C@@H]1C 1752460409 GDGBNNJPWHBCTC-PMPSAXMXSA-N 439.676 4.141 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H](OC)[C@@H](C)CC 1763748657 RZADWVFNWIFVEZ-SPEDKVCISA-N 447.599 4.327 10 10 IICE Cc1c(OCC(=O)OC2CCC(C(C)(C)C)CC2)c(=O)ccn1Cc1ccc(N)cc1 1857920306 YCGKYJCGXGYIRX-UHFFFAOYSA-N 426.557 4.314 10 10 IICE CCN1C(=O)CCc2cc(-c3nc(NS(=O)(=O)c4ccc(F)cc4)sc3C)ccc21 1859571463 IVXXTLDOXKUCIZ-UHFFFAOYSA-N 445.541 4.358 10 10 IICE CCc1nn([C@H](c2ccc(C)cc2O)C(C)C)c(I)c1C(=O)O 2079125290 NFZXFRLETWQYQW-HNNXBMFYSA-N 428.270 4.008 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](CNCc1ccc(Br)cc1O)C2 2103449306 GIFPDRZLYMJGGD-FFGGFLGDSA-N 425.367 4.422 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccccc3[N+](=O)[O-])C2=O)cc1 2296881694 WGJPMUMDXMSQQA-UHFFFAOYSA-N 441.534 4.387 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3c(OC)ccc4ccccc34)C(=O)NC2=S)cc1 2297307935 SRRSBDBYRDQEMR-UHFFFAOYSA-N 432.501 4.078 10 10 IICE COc1ccc(OCCn2cc(C=C3C(=N)N4OC(C)=CC4=NC3=O)c3ccccc32)cc1 2297347484 YEMARCRLLMFTOX-UHFFFAOYSA-N 442.475 4.179 10 10 IICE Cc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C2/SC(=S)N(C)C2=O)c(C)c1 39836104 RAQNBVPVQGWKOU-GZTJUZNOSA-N 437.546 4.243 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1)N2)N1CCOCC1 250261893 UVHIHJSTROXJTD-DXIQSLLYSA-N 430.957 4.187 10 10 IICE CNC(=O)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1Cl 435562541 GXKRAWNDGSEELY-UHFFFAOYSA-N 438.959 4.060 10 10 IICE CC(C)[C@H](CNCc1cc(Cl)cc(Br)c1O)ONC(=O)OC(C)(C)C 708133927 OLYGOSLPTPGWEV-AWEZNQCLSA-N 437.762 4.379 10 10 IICE CC(C)(C)OC(=O)N1CC2CC1(CNCc1cc(Cl)cc(Br)c1O)C2 708189740 GVCNIERNDPXHMY-UHFFFAOYSA-N 431.758 4.297 10 10 IICE Cc1cc(C(=O)COC(=O)c2oc3ccccc3c2CO)c(C)n1-c1ccc2c(c1)OCO2 726015891 PWMKCOVSLGCQBN-UHFFFAOYSA-N 447.443 4.101 10 10 IICE Cc1cc(NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)ccc1N1C(=O)CCC1=O 733035727 SCACUZHGYMYOFS-UHFFFAOYSA-N 444.535 4.420 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 734688116 HWZNTHIZCVSAOZ-IBGZPJMESA-N 437.519 4.339 10 10 IICE Oc1cc(OCc2ccccc2)ccc1CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 753569228 GWOLCSRQAGRRBD-JOCHJYFZSA-N 444.510 4.473 10 10 IICE O=S1(=O)CCN(c2ccc(CN[C@H]3CC4(CCCCC4)Oc4ccccc43)cc2)CC1 753947586 QCZSPCOKUKCZHM-QHCPKHFHSA-N 440.609 4.238 10 10 IICE COCc1ccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cc1 774708329 SVIBJUAFUJHBHM-UHFFFAOYSA-N 428.457 4.483 10 10 IICE Nc1ccc(Cc2nc(C(=O)OCc3nc4ccc(Br)cc4[nH]3)cs2)cc1 789084872 OTKSCMLSYGSWPZ-UHFFFAOYSA-N 443.326 4.312 10 10 IICE Cc1ccncc1CN(C)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 794207867 XKZMBYGCRVHFAT-GZTJUZNOSA-N 431.608 4.092 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N1CCCC[C@H]1C(F)F 800209055 PXOKKWIEXJPLGL-UQRISPGASA-N 430.567 4.376 10 10 IICE C[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1ccc(-n2cncn2)cc1 919655706 XIRQUEADRWVBKL-LJQANCHMSA-N 444.539 4.399 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Br)cc1 1136984146 JBKXDYHOJURBOF-LJQANCHMSA-N 449.364 4.359 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c(C)n1-c1ccc(Br)cn1 1141695482 ZFFVUDVQPMERLK-GOEBONIOSA-N 433.394 4.244 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)CS(=O)(=O)c3ccc(C)cc3)c2C)cc1 1154721933 BVUMPLXLYYKXJX-KRWDZBQOSA-N 440.565 4.003 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)Cc2cccnc2)sc(C)c1-c1ccccc1 1176864307 HOMPZWKCRQGMGK-INIZCTEOSA-N 437.565 4.455 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@@H](c3ccccc3)c3ccc(F)cc3)nc12 1192003867 DBUJNUCSOIXVJV-QHCPKHFHSA-N 448.498 4.362 10 10 IICE CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1235188713 XUPDIHHQJCQXLQ-JRFVFWCSSA-N 438.568 4.467 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CSc4ccc(Br)cc43)C2)cc1 1248182856 HNRZRLODSMOAMZ-KBXCAEBGSA-N 448.386 4.183 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc3c(c2)C[C@H](c2ccccc2)OC3=O)cc1 1278288994 SRHWRCSSPHRKAU-RUZDIDTESA-N 444.531 4.358 10 10 IICE Cc1ccc(C(=O)NCc2ccc(NC(=O)C3CC3)cc2)cc1-n1c(C)cc(C=O)c1C 1290452669 SJUZWSVLRCQWCV-UHFFFAOYSA-N 429.520 4.494 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2c(Br)nc3n2CCC3)cc1 1290757874 UFFKMJQXGQTFAS-UHFFFAOYSA-N 443.345 4.093 10 10 IICE CN(c1ccc(CNC(=O)c2cc3ncc(Br)cn3n2)cc1)C1CCCCC1 1292256165 AKDUVWINWAZHDH-UHFFFAOYSA-N 442.361 4.191 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCN2C(=O)COc3ccccc32)cc1 1292422471 LKDTXMVPHPLVRH-UHFFFAOYSA-N 443.507 4.323 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O 1296609009 ITGPTWKNHSTROE-IBGZPJMESA-N 443.519 4.355 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCOC[C@H]2c2cc(F)cc(F)c2)cc1 1300860453 KRWPVEAGTGTJJB-DEOSSOPVSA-N 438.474 4.327 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1301235862 KYTKAEWCLXHMIJ-QGZVFWFLSA-N 444.630 4.232 10 10 IICE COC(=O)c1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ncccc2c1 1304060140 MQVJDTWGJASFGL-UHFFFAOYSA-N 441.487 4.423 10 10 IICE Cc1cccc(CN(CCN(C)C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1358282137 WEGAPNIYUYRGIA-UHFFFAOYSA-N 446.639 4.307 10 10 IICE CN(C)c1ccc(N(Cc2ccccn2)C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1435961436 BJMCZYLEJSPZHT-LJQANCHMSA-N 436.556 4.294 10 10 IICE COC(=O)CCc1csc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)n1 1445941350 WCNRWDLBMOGIHP-UHFFFAOYSA-N 425.510 4.029 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@H](O)C(F)(F)F 1447072279 MEYYRNZLALZKNV-CVEARBPZSA-N 433.268 4.288 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cscn3)[C@@H](C)C2)c(C)n1-c1cccc(Cl)c1 1450908760 TZSGSTQZXTWFQT-HNNXBMFYSA-N 442.972 4.191 10 10 IICE COc1ccccc1[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1noc(C)n1 1456530506 XUZZWONLPSVCMK-DEOSSOPVSA-N 430.508 4.242 10 10 IICE COCCCOc1cccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 1457106489 YGSWYDZEKUFBHF-SFHVURJKSA-N 448.510 4.411 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](c3c(F)cccc3Cl)N3CCCCC3)CC2)cc1 1458037154 CXKLJZCTTWEZHW-HSZRJFAPSA-N 445.966 4.364 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(Br)c3F)CC2)cc1F 1465930270 LFVVJBFKUVDUHM-UHFFFAOYSA-N 445.691 4.352 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C(F)(F)c1ccccc1OC(C)C 1466398791 TZXFNXNPUVUANB-UHFFFAOYSA-N 441.858 4.126 10 10 IICE CC(C)CCN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1509286300 UQBASGXJQYAQCU-UHFFFAOYSA-N 436.604 4.013 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1516400954 GOMSYECGKAVGPG-UGKGYDQZSA-N 443.661 4.398 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](C[C@H]1CCCO1)C(F)(F)F 1531503080 JPWKFUZSCBRIEN-KBRIMQKVSA-N 436.421 4.121 10 10 IICE CCOC(=O)[C@](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)(C1CCC1)C(F)(F)F 1531986721 TWMLYUHSHFYPDT-JOCHJYFZSA-N 436.474 4.417 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccccc1F 1535415183 WIPQJGKVARSLDM-FYNPWXODSA-N 444.528 4.228 10 10 IICE CCN(CC)C(=O)COc1cccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1540734623 QIEXVISSMGLWSN-UHFFFAOYSA-N 447.535 4.406 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(OC)c1 1540785390 PEDYYYPNIZEAMB-UHFFFAOYSA-N 444.329 4.199 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CC[C@H](SCC)C2)n1Cc1ccc(N(C)C)c(F)c1 1548076069 QGNALXKSJGAWHT-MSOLQXFVSA-N 435.613 4.178 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H](c1ccccc1)c1ncc[nH]1 1556426204 BCGJNHOQJSBNRZ-JOCHJYFZSA-N 448.567 4.320 10 10 IICE C[C@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1560090935 UOTJZOHWZMEXKB-CJMONDIMSA-N 442.437 4.276 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(N(C)C(=O)OC(C)(C)C)CC1 1564946015 WYPAEBRUQPYWAW-GOSISDBHSA-N 432.609 4.033 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H](Cc1ccccc1)c1ccccn1 1565436974 YPWOHPQTNAAGFS-IBGZPJMESA-N 426.314 4.333 10 10 IICE COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)C1 1583504273 DOJGRDZNSMYWOG-PGRDOPGGSA-N 439.600 4.221 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1 1583569279 GPXIRRWTARQKLF-OAQYLSRUSA-N 443.510 4.291 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1nn(-c2ccccc2)cc1Br 1597781763 VFWRPNUQPALEHY-UHFFFAOYSA-N 427.346 4.363 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CC(F)(F)Br)o1 1612015347 HSQAILBQEOEEPO-UHFFFAOYSA-N 427.249 4.176 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H](O)C(Cl)(Cl)Cl)cc2Cl)C1 1617900950 NIJHSXDZSKBURS-IAQYHMDHSA-N 428.187 4.314 10 10 IICE COc1ccc([C@@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCCC2)cc1 1618057421 BHUUBEPLNVZCIH-AREMUKBSSA-N 445.563 4.482 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CC[C@@H](C)C3)CC2)cc1F 1619302479 RGQIXFOWHNIJRC-QZTJIDSGSA-N 429.584 4.486 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1nc(S(C)(=O)=O)ccc1Cl 1623924516 INPKLBTWCBAIBG-OAHLLOKOSA-N 444.940 4.248 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cc1 1623957151 CMTGCUBDFYPQDM-UHFFFAOYSA-N 449.982 4.447 10 10 IICE CC(C)(C)OC(=O)Nc1ncc(CCC(=O)NCCCSc2nccs2)s1 1628326742 YZCDYCYKMYAKFF-UHFFFAOYSA-N 428.605 4.178 10 10 IICE CN(C)c1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc2n1 1630263060 SPKDJTOLDAPQTJ-SFHVURJKSA-N 438.959 4.054 10 10 IICE C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCc2ccc3cccnc3c2O)cc1 1630526012 ASPVZFJYUQEYKK-QZTJIDSGSA-N 447.535 4.039 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H]3COC(=O)NC3CCCCC3)cc2)CC1 1654386143 MJNONRIHFYNVMO-QHCPKHFHSA-N 429.605 4.325 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1csc2ccccc12 1676130330 FJCDDOJNCOIHQR-INIZCTEOSA-N 436.581 4.163 10 10 IICE COc1ccc([C@@H]2COCCN2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1684444168 JVBUHKQSEQIZJA-VWLOTQADSA-N 433.552 4.428 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1OCCC1(C)C 1694110078 VGMHNNYXXJFTAC-UGKGYDQZSA-N 441.620 4.332 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C)OC 1695112813 MBIMWRBKWWZBHV-KNQAVFIVSA-N 437.588 4.393 10 10 IICE CC[C@H](C)[C@@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1708380293 ACADNIFFBHSIFR-WWPVKYPJSA-N 441.620 4.427 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CC[C@H](SCC)C2)n1Cc1ccc2c(c1)CCCN2C 1710641439 XGKTYCPHLYJSLC-RTWAWAEBSA-N 443.661 4.356 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2cccnc2)n1Cc1ccc2c(c1)CCCN2C 1712797837 UFKIVULDJGAFBP-GOSISDBHSA-N 436.629 4.349 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](NC(=O)OC(C)(C)C)C(C)C 1723145011 XJFLGGLMHBYEMJ-GOSISDBHSA-N 431.581 4.293 10 10 IICE Cc1ccccc1Cc1nnc(N2CC[C@@H](C)[C@@H](O)C2)n1CCCSc1nccs1 1724694564 OIUVGLDKTXFJDY-MJGOQNOKSA-N 443.642 4.023 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C[C@H](C)S1 1726706813 LHUWSENFSNPDGV-HOTGVXAUSA-N 446.671 4.233 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1727660694 DPDYOPSEKKOVIG-VGOFRKELSA-N 434.588 4.114 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1727904703 ZCXJVJIPGDNPKI-DFBJGRDBSA-N 437.588 4.129 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C 1743166574 NPFVLHBSJGWWBL-PMACEKPBSA-N 425.621 4.234 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1746094590 WGRYMMMBKDCQRT-HSZRJFAPSA-N 448.615 4.020 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC([C@H]3CCOC3)CC2)cc1F 1747572192 QLRBBWRTVZUUKB-FQEVSTJZSA-N 443.611 4.373 10 10 IICE CC(C)c1nnc(N2CC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1760908807 XEBDNTWOIMIRAX-JOCHJYFZSA-N 425.621 4.141 10 10 IICE C[C@H](Cc1cccs1)Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1761372197 JZESPXQAMRJGIO-MJGOQNOKSA-N 426.586 4.454 10 10 IICE CCOc1cc(N2CCOCC2)c(OCC)cc1/N=N/N1CCN(c2ccccc2)CC1 1860484327 HZGUJZXYBLDQOJ-OCEACIFDSA-N 439.560 4.142 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCc2ccccc2)sc(C)c1-c1ccc(F)cc1 1860758930 NTIHLFMIDRULEG-UHFFFAOYSA-N 440.496 4.294 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCC[C@@H](C)C4)nc(-c4cccnc4)n3)CC2)cc1 1868003689 SFPJDPQAMVFEFQ-HXUWFJFHSA-N 444.583 4.110 10 10 IICE O=C(N[C@@H]1CC12CC(NCc1cc(Br)cc(F)c1O)C2)OCc1ccccc1 2086047290 MEJGVABQMNGERK-NCYVPVAZSA-N 449.320 4.231 10 10 IICE CC(C)(C)OC(=O)NCC1(CNCc2cc(Br)cc(F)c2O)CCCC1 2098631123 FWPUSBSLMYOITB-UHFFFAOYSA-N 431.346 4.469 10 10 IICE COc1ccccc1N1C(=O)C(=C2C(=O)Nc3ccc(Br)cc32)SC1=S 2297315359 RCLJXRBVBORDMS-UHFFFAOYSA-N 447.335 4.186 10 10 IICE Cc1cccc(N2C(=O)C(=Cc3ccc(OS(C)(=O)=O)c(Cl)c3)SC2=S)c1 2297364342 XMWQFNQAICFFBD-UHFFFAOYSA-N 439.967 4.393 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H]2CNCc1cc(Br)cc(F)c1O 2330513998 PHKMMXPXIYPSMM-PEYYIBSZSA-N 429.330 4.171 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCC1 13639854 HCTRFWHLEDSEDK-IXFSTUDKSA-N 426.538 4.099 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccc(Cl)cc4)c3[N+](=O)[O-])CC2)cc1 40611200 SOBIZTHFLVBHQO-UHFFFAOYSA-N 440.891 4.117 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCNCc2cc(Br)cc(F)c2O)C1 715811434 FHPLPPOBMRCANR-ZDUSSCGKSA-N 431.346 4.421 10 10 IICE O=C(NCc1ccc(N2CCCCC2=O)cc1)N(Cc1ccco1)Cc1ccccc1O 726238237 CGALVSPTYOWAEF-UHFFFAOYSA-N 433.508 4.414 10 10 IICE Cc1ccc(C)n1C1CCN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 726706397 JZNLFUYEGVBQKT-WOJBJXKFSA-N 442.579 4.404 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCC(Oc4ccc(F)cc4F)CC3)CC2)cc1 726713314 MJIWCQYWORTGIQ-UHFFFAOYSA-N 445.510 4.195 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 733974872 NRYNLONQQRTPFD-FHWLQOOXSA-N 429.611 4.215 10 10 IICE C[C@@H](NC(=O)N1CCc2cccc(Br)c2C1)c1ccc(N2CCOCC2)cc1 735681093 LMUDLBWNKZYDEW-MRXNPFEDSA-N 444.373 4.115 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCC[C@]3(CC=CCC3)C1)c2[N+](=O)[O-] 744364844 FOHBBWWAZZDYRC-RUZDIDTESA-N 430.460 4.333 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(-c2cccnc2)cc1 747495748 NLOBBFJUMPNMHU-SFHVURJKSA-N 434.515 4.285 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@@H](c2ccsc2)C1 758815551 REJSYBYXTPVRJU-VQIMIIECSA-N 437.512 4.101 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)n1 771271345 CDCSVNDDDQQCLL-OAHLLOKOSA-N 430.555 4.494 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H]1c1ccc(I)cc1 779525625 MJUMVVBSWTYHLF-AGHZKPIHSA-N 435.261 4.079 10 10 IICE CCN(CC)c1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)N[C@H](C)C(N)=O)cc1 914718456 ONFMPGWCMWEXGA-FDCFBWIESA-N 442.563 4.171 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nn1-c1ccc(F)cc1 1125187339 DEGFROMXMPAIGH-IAGOWNOFSA-N 440.494 4.003 10 10 IICE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1125519530 XMWNNLZHHYSYST-UQBPGWFLSA-N 447.620 4.278 10 10 IICE CC(C)(C)OC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 1126583790 UGWUYDZELOJHND-GVDBMIGSSA-N 438.515 4.131 10 10 IICE Cc1ccc(C[C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(C)c1 1136767143 KHHVTYAQTQXXPR-INIZCTEOSA-N 444.578 4.232 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cccc(Nc3nccc(C(F)(F)F)n3)c2)c1 1137473310 FPSBEYLVTWGUKI-LBPRGKRZSA-N 432.402 4.444 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 1138333036 XPNRZVSDHXIOAU-PMACEKPBSA-N 439.556 4.472 10 10 IICE Cc1cc(C(=O)NCc2ccc(C(C)(C)O)cc2)c(C)n1-c1ccc(Br)cn1 1138409344 RFNSUWVNFMJUGI-UHFFFAOYSA-N 442.357 4.409 10 10 IICE Cc1cc(COc2ccc(C(=O)N3Cc4cccc(O)c4C3)cc2Br)no1 1152574396 VKFBFKDWQCVFPY-UHFFFAOYSA-N 429.270 4.186 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCC[C@@H](N(C)C)C(F)(F)F)cc2Cl)C1 1227209811 WRODJFQCWUNMFR-KBXCAEBGSA-N 434.934 4.258 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3csc(NC4(C)CCCC4)n3)CC2)cc1 1291856044 JWMSAGCBXIQCLX-UHFFFAOYSA-N 428.602 4.178 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2CCCN(CC(F)F)C2)cc1 1293125929 VKNOLYGJLFEVCZ-LJQANCHMSA-N 431.527 4.272 10 10 IICE CCOc1ccc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 1293794301 ZEUWXQCNHPPGEG-QFIPXVFZSA-N 441.572 4.076 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CC1CCN(c2ccncc2)CC1 1298359362 MUPDZWIFUSYPNH-UHFFFAOYSA-N 434.588 4.229 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CCCCC3)C3CC3)cc2F)C[C@H](C)O1 1307423036 WTXKJQKIWYOZLJ-OALUTQOASA-N 431.596 4.100 10 10 IICE Cc1ccc(-c2nc(CC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cs2)cc1 1436624535 PUAMMKMAZOMBMZ-UHFFFAOYSA-N 443.519 4.092 10 10 IICE CCOC(=O)[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1444846597 POINLJBCAROODF-QHCPKHFHSA-N 432.520 4.292 10 10 IICE Cc1ccc(O)c(CNC(=O)c2nn(-c3cccc(Br)c3)c3c2CCCC3)c1 1453646956 FAEJHLPGJMUQCV-UHFFFAOYSA-N 440.341 4.458 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](C(=O)NC(C)C)C2)c(C)n1-c1cccc(Br)c1 1454117547 LGTOLQKHJFFBGS-KRWDZBQOSA-N 446.389 4.233 10 10 IICE C[C@H]1CCN(c2nnc(-c3cc(Br)c[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1 1512289590 TYYRANBUBUMTIP-ZDUSSCGKSA-N 447.356 4.135 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1 1515281070 ZTQICNUHODYBOL-SFHVURJKSA-N 434.588 4.067 10 10 IICE CN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccc(F)cc1Cl 1531417815 DCTSGYQAGZCHAD-UHFFFAOYSA-N 438.798 4.439 10 10 IICE COC(=O)c1cnc(Cl)c(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1535205486 YERYSDPROFKKJE-UHFFFAOYSA-N 427.888 4.002 10 10 IICE Cc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1NC(=O)CCN(C)C 1537878041 VSLXLSUYQXKKOY-UHFFFAOYSA-N 432.568 4.474 10 10 IICE Cc1cc(CCNC(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1543592923 BGWLQVDERLSSQV-IFMALSPDSA-N 443.563 4.348 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(Cc4ccc(C)cc4)n3)CC2)c(OC)c1 1543633347 ZNJYEXVTFUFDEW-UHFFFAOYSA-N 437.565 4.022 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nnn(-c4cccc([N+](=O)[O-])c4)c3C)c2C)c1 1544078691 BIXVATJETVAPSL-UHFFFAOYSA-N 444.495 4.130 10 10 IICE CSCCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1555934057 OANOMLGEELPTOZ-HXUWFJFHSA-N 429.634 4.162 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1sccc1S(=O)(=O)NC1CCCCCC1 1557386354 RVBRYBSVQMJKHC-UHFFFAOYSA-N 442.990 4.038 10 10 IICE C[C@@H](NC(=O)N1CCN(c2cccc(Br)c2)CC1)c1ccc(N(C)C)cc1 1564596960 HYZDIXIXSHPFAC-MRXNPFEDSA-N 431.378 4.108 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CCCc4ccc(Cl)cc43)CC2)c(OC)c1 1565202668 WFJPSUQZRDKWNO-FQEVSTJZSA-N 429.948 4.266 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(C)cc4ccccc34)CC2)cc1 1569275157 NCQPGLZFNSTGND-VAWYXSNFSA-N 429.520 4.000 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C=C(\c3ccc(Cl)cc3)C(F)(F)F)cc2)CC1 1583475671 KVDYQSVMPGQBFF-XSFVSMFZSA-N 437.893 4.354 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(OCCC(C)C)c(OC)c3)C2)cc1 1585665399 RMPAANWYQCCBJJ-LJQANCHMSA-N 426.557 4.385 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1613201882 JMEJNSITAUZYHA-FHWLQOOXSA-N 429.634 4.007 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cccnc2-n2cc(Br)cn2)cc1 1623452171 UHGDZYAWRVKFIY-UHFFFAOYSA-N 442.361 4.148 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1c1cccc(Cl)c1 1625684742 YDGGSVNBNIYSFG-YOEHRIQHSA-N 427.715 4.188 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(C(F)(F)F)c3O)cc2F)C[C@@H](C)O1 1626159315 VWZJVEMEKWMGBW-BETUJISGSA-N 426.410 4.094 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(C)nc3c2cnn3C)cc1 1627421286 NHUIKRZJPSXLMN-UHFFFAOYSA-N 429.524 4.198 10 10 IICE O=C(c1c(F)cc(F)cc1F)C1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1629398859 FIMISRJYEKXGST-UHFFFAOYSA-N 435.423 4.465 10 10 IICE Cc1cc(C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)c(C)n1-c1cccc(Br)c1 1634343895 COVAARVUWQXUGI-OAHLLOKOSA-N 434.378 4.232 10 10 IICE CC(C)Oc1ccccc1C(F)(F)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1634346925 APBLNKRXRBEYLN-UHFFFAOYSA-N 432.511 4.091 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1nc(-c2ccc(Cl)cc2)n[nH]1 1640385899 DHDKMAFNPKUWQR-UHFFFAOYSA-N 447.926 4.318 10 10 IICE O=C(CC[C@H](NC(=O)OCc1ccccc1)C(F)(F)F)NCc1cc(Cl)ccc1O 1644590560 FEVSXKCTNFTNCQ-KRWDZBQOSA-N 444.837 4.299 10 10 IICE Cc1cc(C(=O)NCc2cc(O)nc(C3CC3)n2)c(C)n1-c1ccc(Br)cc1 1645195711 CEIWSGIWNCGPHZ-UHFFFAOYSA-N 441.329 4.160 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@H](c4ccc(Cl)s4)C3)C2)cc1 1683504108 KXLWZYZTRGTMNY-YJBOKZPZSA-N 435.977 4.020 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(Cc4ccc(F)c(F)c4)CC3)C2)cc1 1683946035 YWJBZIINNBJEFL-IBGZPJMESA-N 429.511 4.216 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](C[C@@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1692175138 GLLTUQQXNOMDND-CTNGQTDRSA-N 443.611 4.373 10 10 IICE COCC[C@@H]1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C1 1697954790 NBVJGRZOTQJHSC-KRWDZBQOSA-N 429.615 4.447 10 10 IICE C[C@H]1CCc2sc(-c3nnc(N(C)Cc4ccccc4O)n3CC(C)(C)O)cc2C1 1708022661 AGGKWKKYGMNNBP-HNNXBMFYSA-N 426.586 4.244 10 10 IICE COC[C@H]1CCCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C1 1730559844 JWBUCMSXNJQHEY-KRWDZBQOSA-N 449.671 4.432 10 10 IICE CC(C)[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1741403595 FAIODWLYUKPUHW-RXVVDRJESA-N 447.624 4.003 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1750303494 JMDRLJLWQLFCGV-AEFFLSMTSA-N 435.613 4.003 10 10 IICE COCC1(C)CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC1 1770807728 KSZPDMLWMYKWJJ-UHFFFAOYSA-N 443.661 4.256 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1771171895 HSAQIFPEFJWZLD-QZTJIDSGSA-N 447.599 4.128 10 10 IICE CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)COc1ccc(N)cc1 1860082999 AONCVRBFBHQEMZ-UHFFFAOYSA-N 426.494 4.200 10 10 IICE CCC1=NN(Cc2ccc(Cl)cc2)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679636 XOGCSNMSEBHCBM-CXUHLZMHSA-N 427.844 4.211 10 10 IICE O=C(N[C@@H](CCc1ccc(O)c(O)c1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1951401637 HULJLWREOFVPTF-NRFANRHFSA-N 433.460 4.022 10 10 IICE CC1(c2nn(Cc3cccc(F)c3O)c(I)c2C2(C)CC2)CC1 2079763841 UCZVJUFAQKHUCS-UHFFFAOYSA-N 426.273 4.484 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3[C@H](CCN3Cc3ccccc3)C2)cc1Br 2188882061 DIGWJFYXHGJLDC-WIYYLYMNSA-N 427.342 4.258 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(OCC)cc2)C(=O)C1=Cc1cc(OC)ccc1OC 2294082223 UDSZVXQPMAYZIE-UHFFFAOYSA-N 437.492 4.370 10 10 IICE CCCCN1C(=O)C(=C2SC(=S)N(CCCC(=O)OCCC)C2=O)c2ccccc21 2314759597 DDBSWMLMQMBGJX-UHFFFAOYSA-N 446.594 4.138 10 10 IICE COc1ccc(OC)c(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)c1 2321663925 RSOWJGDBSMHZPE-UHFFFAOYSA-N 431.564 4.436 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(NC(=O)c2cccc([N+](=O)[O-])c2)C1=O 1452249 BBFSIEPNQMJCNX-HLXADAOKSA-N 425.491 4.087 10 10 IICE C[C@@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3ccc(Cl)cc3Cl)s2)C1=O 11635476 FCBVCRIDFRGOMM-QMMMGPOBSA-N 446.406 4.228 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C\c1cc(C)n(-c2cc(C(=O)O)cc(C(=O)O)c2)c1C 59302553 ZSDWVLAYJQNGGW-XKZIYDEJSA-N 443.459 4.297 10 10 IICE CCCCN1C(=O)/C(=C\c2cc3cccc(C)c3nc2N2CCOCC2)SC1=S 208278752 OQEOXTDNNAZQNY-NBVRZTHBSA-N 427.595 4.381 10 10 IICE CCOc1ccc(NC(=O)CN2C(=O)/C(=C\c3c[nH]c4ccccc34)SC2=S)cc1 210677836 NEOFOOFFRMCWRM-YBFXNURJSA-N 437.546 4.407 10 10 IICE CN(C)c1ccc(/C=C\CN2CCC3(CC[C@@H](CNC(=O)c4ccccc4)O3)CC2)cc1 210915854 VISLHQDOIJQNOT-KBDOHKNDSA-N 433.596 4.209 10 10 IICE Cc1ccccc1NC(=O)Cc1noc(Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n1 683450697 MDBAOPIIWFRGPT-UHFFFAOYSA-N 443.551 4.329 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H]4CN(Cc5ccccc5)C[C@H]4C3)ccc(N)c2C1 705983512 YJJIVCRHQDRFNG-SFTDATJTSA-N 448.611 4.130 10 10 IICE CC[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1c(C)noc1C 742749527 HSKMRJMYNCOZMV-VQTJNVASSA-N 444.576 4.233 10 10 IICE C[C@@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)c(F)cc1O 757637619 LIQBDZCMNZGCAU-RISCZKNCSA-N 449.299 4.357 10 10 IICE CCS[C@H]1CC[C@H](N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 769060342 PNBBCIRWFUVVCP-GOTSBHOMSA-N 430.662 4.034 10 10 IICE COc1ccc(O)cc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 780988417 LXAHSQCZUMNGRS-UHFFFAOYSA-N 431.536 4.018 10 10 IICE COC(=O)[C@H](C)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 797366703 FNGGVEZFMQMTIF-DOMQTXCISA-N 443.547 4.421 10 10 IICE Cc1cc(C)nc(-n2cc(C(=O)NCc3cc(Cl)cc(Cl)c3O)c(C(C)C)n2)n1 813684817 XSILYBVPJIBZOU-UHFFFAOYSA-N 434.327 4.345 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CC(=O)N(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 1126079538 DALQMHUQSNRXOT-CVDCTZTESA-N 445.966 4.468 10 10 IICE O=C(CC1(CSc2ccccc2)CC1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129660198 MGFOQVMKFIJTGQ-UHFFFAOYSA-N 432.536 4.380 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 1156288603 ZUEBWPNFSLVMEP-NHCUHLMSSA-N 439.512 4.087 10 10 IICE C[C@H]1CCCN(C(=O)OC[C@@H]2CCCCN2C(=O)c2cc3cc(O)c(O)cc3s2)C1 1157242446 GIUAFNRGYHACMH-HOCLYGCPSA-N 432.542 4.176 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2[C@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1159439901 GFZPAOOPBWQLPC-RBUKOAKNSA-N 432.362 4.425 10 10 IICE Cc1cc(C)cc(OCCN(C)C(=O)CN2CCCc3cc(OC(F)(F)F)ccc32)c1 1167755267 JJJKVVYJCCHEEU-UHFFFAOYSA-N 436.474 4.492 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@H]1CC2(CCOCC2)Oc2ccccc21 1235838417 XWWPQYHRAQUHOB-KRWDZBQOSA-N 447.329 4.027 10 10 IICE CC(C)Cc1nnc(N2CCC(c3cnn(C)c3)CC2)n1CCCSc1nccs1 1287406522 NPQDPDYDKYTNGX-UHFFFAOYSA-N 445.662 4.233 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1294457526 NGEDNRLDWXPLPZ-CTNGQTDRSA-N 426.653 4.382 10 10 IICE CC(C)c1nc(CCn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)cs1 1302546807 NNBFVMHGPXABPK-UHFFFAOYSA-N 436.585 4.448 10 10 IICE CC1CCC(N(C)c2nnc(C(=O)NC(C)C)n2CCCSc2nccs2)CC1 1304969157 IWPOEIGKWQKMST-UHFFFAOYSA-N 436.651 4.070 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CSc2ccccc2O1 1312921287 GJBJJZCISFFRNA-OAHLLOKOSA-N 437.359 4.240 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)cc1C 1316438270 GYVVHWBFNZJACE-LEWJYISDSA-N 429.634 4.274 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCCc1ccccc1 1349514658 LQKJKIXSXOIKKD-CYVLTUHYSA-N 428.554 4.166 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Br)c3ncc(C=O)n3c2)cc1 1440671385 DIZJGQSWULOWRD-UHFFFAOYSA-N 443.345 4.028 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](c3ccccc3)C2)c(C)n1-c1ccc(Br)cn1 1440968217 PKFVMGBKHTUAAB-HXUWFJFHSA-N 440.341 4.465 10 10 IICE Cc1cc(C(=O)N2c3ccccc3C[C@@H]2CO)c(C)n1-c1ccc(Br)cc1 1453133943 QQVZHAMYKLHBKB-LJQANCHMSA-N 425.326 4.420 10 10 IICE C[C@@H](CN(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nccs1 1458215980 ODGACMWIUJNAHQ-XDUBLRSXSA-N 449.598 4.136 10 10 IICE CC[C@@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 1464702019 FZGLSLSZXYLXPF-UTKZUKDTSA-N 433.593 4.110 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CCCCNC(=O)OC(C)(C)C 1503487937 QMXUDPRTBDEKAX-UHFFFAOYSA-N 431.581 4.223 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CC[C@@H](C)C3)CC2)cc1F 1504295864 KBVOJHOSONQOFM-MOPGFXCFSA-N 429.584 4.387 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1512639257 JPFKUOZKIJRSSC-OAQYLSRUSA-N 427.593 4.039 10 10 IICE CCOc1ccc([C@@]2(C(=O)N3CCOc4cc(N(C)C)ccc43)CC2(Cl)Cl)cc1 1523542676 UPEMTWWEOTYIQT-OAQYLSRUSA-N 435.351 4.392 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(NC(=O)c4ccccc4)cc3)C2)cc1 1529404282 SHMROFWBOWNYGR-LJQANCHMSA-N 429.520 4.204 10 10 IICE Cc1cc(CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccc(Cl)cc1 1540751594 FLHVXGXXXNXTBW-UHFFFAOYSA-N 426.904 4.427 10 10 IICE Cc1cc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c(C)n1-c1ccc(Cl)cc1 1542301080 WYADCERIENKPDC-UHFFFAOYSA-N 437.971 4.443 10 10 IICE COc1cccc([C@H](NC(=O)OC(C)(C)C)C(=O)NCCCSc2nccs2)c1 1542956309 QZAGVXAGGCAPMI-INIZCTEOSA-N 437.587 4.016 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(Br)cc1 1545503081 MCTDYKTWYQAAGD-SFHVURJKSA-N 449.345 4.379 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC(C)C)c(C)c1 1559970541 YAPWWVQAZJDJIZ-UHFFFAOYSA-N 427.564 4.058 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(OCCCN(C)C)cc2)c1 1565598790 YACGSCNXEBKXMQ-UHFFFAOYSA-N 433.552 4.167 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)cc1F 1565688018 HBKZOQCWEANLSR-KRWDZBQOSA-N 439.597 4.031 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cn(-c2ccc(Br)cc2)nc1C 1565701864 NRFVSZRPLOQGSU-UHFFFAOYSA-N 427.346 4.248 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CN(Cc4ccccc4)CC[C@@H]3CO)c2C)c1 1566358122 VHLMOWGQIFIPJJ-ZEQKJWHPSA-N 431.580 4.015 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCc1ccccc1Br 1570514657 KIVACNGHBVTUJR-UHFFFAOYSA-N 434.330 4.069 10 10 IICE Cc1ccc(O)c(CNC(=O)C2(Nc3ccccc3)CCN(C(=O)OC(C)(C)C)CC2)c1 1584984024 ZMQZSYMMNYECEY-UHFFFAOYSA-N 439.556 4.199 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCN(c3ccc(C(C)C)cc3)C2=O)cc1F 1616923807 AQQOHPJDAIRVJL-OAQYLSRUSA-N 425.548 4.465 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)OCc1ccc(F)cc1 1618427536 SRXCFUFJJSPSJZ-QGZVFWFLSA-N 430.520 4.119 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)[C@H](O)c3cc(Cl)cc(Cl)c3)CC2)cc1 1622438387 RJCFKQUWOIGOON-HXUWFJFHSA-N 437.367 4.410 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc4c3CCN4S(C)(=O)=O)c2C)c1 1624841089 PCNFVUYCGBMPRG-UHFFFAOYSA-N 437.565 4.285 10 10 IICE Cc1cccc(-c2nnc3n2C[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)CC3)c1 1629136637 GQGNQURJQBMFKD-CQSZACIVSA-N 431.323 4.145 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2Cc3c(C)cccc3N2C(=O)OC(C)(C)C)c1 1631542944 NOHNUBHTKWUPNJ-FOIQADDNSA-N 426.513 4.253 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(O)cc(Br)c1 1634753612 PNTJOWVIRXZGMN-AWEZNQCLSA-N 441.272 4.155 10 10 IICE Cc1cc(CNC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c(C)n1-c1ccccc1 1637577626 FTJJSVSYTCJVPN-UHFFFAOYSA-N 437.975 4.170 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)Cc1ccccc1F 1647778853 XXNGMPFDEDTMQY-KDURUIRLSA-N 445.554 4.107 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)Cc1ccccc1F 1647778857 XXNGMPFDEDTMQY-RTBURBONSA-N 445.554 4.107 10 10 IICE COC1CCN(c2ccc(CN[C@@H]3CCN(C(=O)OC(C)(C)C)C34CCC4)cc2)CC1 1647801221 BSRBAMRMWUHYSN-JOCHJYFZSA-N 429.605 4.324 10 10 IICE CCN1CCN(c2ccc(NC(=O)CN(CCC(C)C)c3ccc(OC)cc3)cc2)CC1 1653511295 VNKQJAQEEMONLG-UHFFFAOYSA-N 438.616 4.328 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](c1nc(-c2cccnc2)no1)C(C)C 1682097047 IDCVHZRIRRCZKP-LAUBAEHRSA-N 436.560 4.134 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OCC)C1 1710822918 PWJYEDFLMLHCRR-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CC[C@@H](C)N(C)CCn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727074354 LYMUPRANGIPWCT-HXUWFJFHSA-N 435.620 4.240 10 10 IICE BrC1=CCCN(c2nnc(CC3CC3)n2CCCSc2nccs2)C1 1740534802 ORPVMRPUHJKTLM-UHFFFAOYSA-N 440.436 4.358 10 10 IICE CCCC1(Cn2c(C(=O)NC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)CC1 1745302843 IXRHSOREEUISQA-UHFFFAOYSA-N 438.620 4.233 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1751409423 BZMXSKPNHHSJNW-KRWDZBQOSA-N 430.547 4.394 10 10 IICE CC(C)C(C)(C)Cn1c([C@@H]2CCC(=O)N2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1760860409 LDMGQRQCUYEHFF-NRFANRHFSA-N 438.620 4.148 10 10 IICE CC(C)Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@@]1(OC(C)C)CCOC1 1761114504 ZNIACQSNZPTLSY-RUZDIDTESA-N 441.620 4.211 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC1CCOCC1 1763710155 GRICJKKHPLUSSB-FQEVSTJZSA-N 441.620 4.334 10 10 IICE CN(CCCn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)CC(F)(F)F 1767328295 VSWJPUGYAYXRMJ-UHFFFAOYSA-N 427.515 4.093 10 10 IICE C[C@H](c1ccccc1O)N(C)C(=O)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2010163424 YDRYHTCTSUAGRI-XLIONFOSSA-N 428.529 4.022 10 10 IICE COC(=O)c1c(C)nn([C@@H](c2ccc(C)cc2O)C(C)(C)C)c1I 2079106721 MKSFOTQGTGHRSE-HNNXBMFYSA-N 442.297 4.232 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@@H](CCNC(=O)OC(C)(C)C)C2)c1O 2236056175 UOPSYWCOXLEHJG-UONOGXRCSA-N 443.382 4.336 10 10 IICE COc1ccc(OCCCOc2c(C=C3SC(=S)NC3=O)cccc2OC)cc1 2297347252 DHAGHFMCSZUXIC-UHFFFAOYSA-N 431.535 4.041 10 10 IICE CCOC(=O)COc1ccc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)cc1OC 2297349848 FQRBVEMDIKTYCV-UHFFFAOYSA-N 447.509 4.182 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3F)C2=O)ccc1O[C@@H](C)C(=O)O 2314934384 ZHXWHMMDUCCIDF-NSHDSACASA-N 433.482 4.092 10 10 IICE Cc1ccc(CNC[C@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352942067 ZEOCYMFCYJKSPB-DZGCQCFKSA-N 427.383 4.446 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)sc2c1CCCC2 21450586 YEOGPGFQILAQEY-MRXNPFEDSA-N 440.565 4.412 10 10 IICE O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1cccn1-c1ccc([N+](=O)[O-])cc1 33398624 CIQUSMISRISDEP-YBEGLDIGSA-N 443.246 4.154 10 10 IICE CCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CC)c2N2CCCCCC2)SC1=S 39989872 LDNUVHSCKYEONA-AQTBWJFISA-N 444.626 4.040 10 10 IICE COc1cc(Cn2c(-c3ccc(N4CCCC4)cc3)cc(C(N)=O)c2C)cc(OC)c1OC 43223905 HDJFHNOCONNQMG-UHFFFAOYSA-N 449.551 4.237 10 10 IICE COc1ccc(Br)cc1/C=C1/C(=O)N(c2ccc(F)cc2)C(=S)N=C1O 96472283 BMRJZERCGPDSJW-NTEUORMPSA-N 435.274 4.268 10 10 IICE CCCNC(=O)Nc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 586611332 YGNLYJTZDAYURS-UHFFFAOYSA-N 427.460 4.246 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCC[C@@H]2c2noc(C3CC3)n2)C1 683445053 ZUUDECYROWJLND-HSZRJFAPSA-N 447.583 4.422 10 10 IICE COCCN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1C[C@H]2CC[C@H]1C2 774831186 DGFGNWNKZIIOML-XGHQBKJUSA-N 437.531 4.103 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(Oc4cnccn4)CC3)cc2Cl)C1 799993768 FGVXZKZNIRXFLI-KRWDZBQOSA-N 443.979 4.119 10 10 IICE C[C@H](NC(=O)Cc1ccc(Br)cc1Cl)c1ccc(N2CCOCC2)cc1 1125518727 KYUYCPSKCQOGGP-AWEZNQCLSA-N 437.765 4.359 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cnn(-c4cc(C)ccc4C)c3C)cc2F)CC1 1144592638 LVFUNXYDFUGNCL-UHFFFAOYSA-N 449.574 4.009 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2ccc([C@@H]3CC(=O)NC(=O)N3)cc2)c1 1148650376 ZGVXGOCILSEPHT-FQEVSTJZSA-N 436.899 4.270 10 10 IICE CCCN(CCC)S(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 1269587984 MYJJIDWNVHSFAZ-SFHVURJKSA-N 431.602 4.054 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4F)C3)cc2Cl)C1 1270433300 TWMOHMSSKRLZAU-AEFFLSMTSA-N 443.950 4.385 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC(c2ccc(F)cc2)C1 1298405204 RMWZQOYRRPUKOF-YBFXNURJSA-N 444.528 4.182 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CC[C@H](C3CCOCC3)C2)nnc1C(C)(C)C 1304240325 KAUATCULCTXBAT-NRFANRHFSA-N 425.621 4.251 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 1306954260 NSDUUQADIRNKQJ-UHFFFAOYSA-N 434.487 4.459 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)cc2C)CC1 1315247518 PVZMQTKEYFPWOD-SANMLTNESA-N 448.615 4.082 10 10 IICE C[C@@H](c1cccnc1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1434936161 BCCMXOWEYDFFKU-HIXWQLQUSA-N 429.542 4.032 10 10 IICE Cc1ccccc1CCNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1435457359 AHTULSFGHDBLGX-XMHGGMMESA-N 428.554 4.084 10 10 IICE COc1cc(C[C@H](CO)CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc(OC)c1 1446031950 AMEVYTUQBGEFFV-NRFANRHFSA-N 436.552 4.001 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cc(Cl)cc(Cl)c3)CC2)c(OC)c1 1461984818 VJJSHPOVVSDOAO-AWEZNQCLSA-N 439.339 4.127 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(OCC(=O)OC(C)(C)C)cc2)cc1F 1465006593 PCBJLJLPRWDDGF-UHFFFAOYSA-N 430.520 4.322 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CC[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C 1469103488 ILXLDAGTVAVOQK-WIYYLYMNSA-N 447.620 4.260 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCN(C4CCCCC4)C3=O)cc2Cl)C1 1469961669 XFQRAYMRPIEWCP-UTKZUKDTSA-N 447.023 4.309 10 10 IICE CCc1ccc(C(C)(C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1473326107 BWWUYZFCSWOGFT-KDURUIRLSA-N 441.591 4.143 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)OC2CCCC2)cc1 1501840743 OFPLKIJKCODDGB-FQEVSTJZSA-N 427.593 4.377 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1CCN(C)C1CCCCC1 1503487914 PEUBNLDCRQEJEB-JOCHJYFZSA-N 427.593 4.126 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(C2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1511934143 ATSTZYCPPBKHIE-UHFFFAOYSA-N 426.540 4.430 10 10 IICE CCO[C@@H](CCn1c(C2CC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)C(C)C 1516178880 YSQFBIOGDDNVBQ-NRFANRHFSA-N 445.583 4.081 10 10 IICE Cc1csc([C@@H](C)CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1521500939 IUENIMNCCSGLMQ-RGZVIEDOSA-N 449.598 4.102 10 10 IICE COC(=O)C(C)(C)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 1526172520 GFSYVTMJDFOPJC-FBMGVBCBSA-N 443.547 4.469 10 10 IICE Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 1540440434 HWOHWFVTBYQDQS-LJQANCHMSA-N 429.362 4.007 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2cc(F)ccc2C1 1544914591 JQFGCZCFVIZEDY-ODLFYWEKSA-N 444.528 4.141 10 10 IICE O=C(c1ccccc1)c1c[nH]c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1545041929 OCCDSMCFSSUQMH-SFHVURJKSA-N 439.462 4.246 10 10 IICE C[C@@H]1N(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCOC1(C)C 1545141563 PKPBVXZKMTZAQL-SFHVURJKSA-N 425.621 4.301 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)CC1 1546969468 GBYQKBCLUFTXMF-UHFFFAOYSA-N 434.588 4.211 10 10 IICE Cc1cc(C(=O)NC2(C(=O)N(C)C)CCCCC2)c(C)n1-c1cccc(Br)c1 1556671635 JKCWPFMHFRBKDK-UHFFFAOYSA-N 446.389 4.378 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(N3CCCC3=O)cc(C(F)(F)F)c2)cc1 1585443819 IDIYKLLEBAIVAP-UHFFFAOYSA-N 449.473 4.049 10 10 IICE Cc1cc(CCNC(=O)CCNC(=O)c2cc3ccccc3[nH]2)c(C)n1-c1ccccc1 1587465966 ZFFMJAHSYIIKTQ-UHFFFAOYSA-N 428.536 4.054 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4F)C3)c2C)c1 1587880546 DEGGRYRJKOJINW-IBGZPJMESA-N 437.490 4.350 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](C)Sc3nc4ccccc4s3)C2)cc1 1598364173 OACQHMALBASBLO-HOTGVXAUSA-N 427.595 4.428 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1615422645 HEBOMTGWIIYGSB-OAQYLSRUSA-N 438.664 4.174 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCCNc1ccccc1 1616249442 KFEHKIXNGTWILC-CYVLTUHYSA-N 443.569 4.035 10 10 IICE CCc1cccc(OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1618253984 VDKHAOZCGSKJTH-QFIPXVFZSA-N 441.572 4.076 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2CCC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1618254199 YJKXTTMMHXYVEI-VQTJNVASSA-N 433.593 4.030 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccccn1 1618934596 VNIGDTNSMSWSFE-LJQANCHMSA-N 430.556 4.419 10 10 IICE ClC1=C(Cl)CN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)CC1 1620326496 VGXBWHZTWCVOPZ-GFCCVEGCSA-N 446.429 4.320 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cc(Br)c(F)cc1O 1626654605 RBFPVOCSBNRXDS-UHFFFAOYSA-N 448.336 4.078 10 10 IICE Cc1cc(CC(=O)N[C@](C)(CO)c2ccc(Br)cc2)c(C)n1-c1ccccc1 1631163231 KVHSUVIBYQGBOU-HSZRJFAPSA-N 441.369 4.423 10 10 IICE Cc1cc(C(=O)N[C@H](CCC(C)(C)C)C(N)=O)c(C)n1-c1cccc(Br)c1 1634166395 VVPZMWYRPROPEL-GOSISDBHSA-N 434.378 4.267 10 10 IICE CCOC(=O)c1cc(COC)cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1636341277 CDODGWALQIINPE-UHFFFAOYSA-N 448.519 4.411 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCCOc3ccccc3Br)CC2)cc1 1636702590 UIJFJVOQJQMNKX-UHFFFAOYSA-N 447.373 4.356 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)Cc1ccc(OC)cc1 1639827027 BOZRINGIYLZJCL-SFHVURJKSA-N 426.557 4.262 10 10 IICE CN(C)c1ccc(CN2CCN(Cc3nc(-c4cccc(C(F)(F)F)c4)no3)CC2)cc1 1652819163 SRRHYBYCXREWEF-UHFFFAOYSA-N 445.489 4.139 10 10 IICE CCN(CC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)Cc1cc(Br)ccc1O 1653469766 YDVKUKPNXNTNNW-ZDUSSCGKSA-N 441.316 4.474 10 10 IICE C[C@H]1[C@@H](C(F)(F)F)CCN1[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1653473466 FLKODDRFLSGDND-QUJCMNEKSA-N 430.426 4.062 10 10 IICE CC(C)C[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccccc1 1653919483 ZWFDKKHAYXUQKT-SKPFHBQLSA-N 441.591 4.433 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC(Cc4ccc(C(F)(F)F)cc4)C3)C2)cc1 1674326376 IQANLEGOHJPXSJ-LJQANCHMSA-N 433.474 4.177 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@@H](C)NC(=O)OC(C)(C)C)CC1 1683421350 MMBVDVPUOURDRG-RBUKOAKNSA-N 446.636 4.327 10 10 IICE CC(C)[C@@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(Cl)cc1F 1686071966 FOOLYOPMWMQKQD-JOCHJYFZSA-N 432.971 4.427 10 10 IICE C[C@@H](NC(=O)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1)c1ccc(N(C)C)cc1 1686173485 JABPKHAJGSKTBS-QGZVFWFLSA-N 434.506 4.360 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2C[C@H](C)CC[C@H]2C)cc1 1710023806 DHUHDIQGYYVMSS-WOJBJXKFSA-N 438.620 4.033 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc[nH]4)n3CCCC(F)(F)F)CC2)cc1 1730181943 WMHMMXPQDNXYMY-UHFFFAOYSA-N 448.493 4.341 10 10 IICE CC(C)[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1760966566 QOSOFALWZRBMBV-QFIPXVFZSA-N 429.584 4.125 10 10 IICE CN(CC1CCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1768768986 USVDLOLOMQHDHX-UHFFFAOYSA-N 425.621 4.069 10 10 IICE COc1ccc(/C=C2/SC(=S)N(C[C@@H](c3ccc(OC)cc3)N(C)C)C2=O)cc1 1858594072 JSYPOLDYKXQNNW-XAJRUKRBSA-N 428.579 4.208 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCCC4)nc(Cc4ccccc4)n3)CC2)cc1 1867944717 PEPLEKRSVBVSQM-UHFFFAOYSA-N 443.595 4.393 10 10 IICE CC(C)(C)OC(=O)N[C@](C)(CNCc1cc(Br)cc(F)c1O)C1CCC1 2137709616 VAMDYJXPGOYYNL-LJQANCHMSA-N 431.346 4.467 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)C1(COCc2ccccc2)CN(C(=O)OC(C)(C)C)C1 2256696238 JIDAFLWDDMKWBW-QHCPKHFHSA-N 439.600 4.467 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2cc(Br)ccc2OCc2ccccc2)S1 2293391507 OCARPJBRKXSVJT-UHFFFAOYSA-N 431.311 4.135 10 10 IICE O=C1NN(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(-c2ccccc2F)o1 2297334668 IMNYNPRNJPOOPD-UHFFFAOYSA-N 427.229 4.310 10 10 IICE CCOC(=O)COc1c(C=C2SC(=S)N(c3ccccc3C)C2=O)cccc1OC 2297357109 CFDBYWWFZFLLHE-UHFFFAOYSA-N 443.546 4.351 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(C3CCCCC3)C2=O)cc1 2323724184 OLFSIFGDLJDCRQ-UHFFFAOYSA-N 432.611 4.468 10 10 IICE CC[C@H](NC[C@@H]1[C@@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2333093375 YZEGDZOJHWIRRX-VDNDLQMASA-N 425.367 4.451 10 10 IICE Cc1ccc(CNC[C@@H]2[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)c(O)c1Br 2352944275 FXUZSQWHUKZVRG-ARFHVFGLSA-N 425.367 4.056 10 10 IICE O=C(O)C/C(=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 9717096 WOSFOHYGCRWXMT-RVDMUPIBSA-N 425.466 4.056 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1)N2)N1CCOCC1 14465011 UVHIHJSTROXJTD-IPJJNNNSSA-N 430.957 4.187 10 10 IICE CCOC(=O)c1ccc(NC(=O)CN2C(=O)/C(=C/c3ccccc3C)SC2=S)cc1 15036008 OTPXAIXFBJYIEO-PDGQHHTCSA-N 440.546 4.012 10 10 IICE CC1=NN(c2ccc(I)cc2)C(=O)/C1=C\c1ccc(N(C)C)cc1 16185272 LFEZBFXYVDAKDJ-PDGQHHTCSA-N 431.277 4.163 10 10 IICE C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccnn1Cc1ccc(N(C)C)cc1 98080420 OPKOKADZGCMIDU-HNNXBMFYSA-N 425.514 4.025 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccccc3N3C[C@@H](C)O[C@H](C)C3)CC2)cc1 255957616 BXGMNFONZMIIKH-WOJBJXKFSA-N 438.572 4.053 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3ccc(Br)cc3O)CC[C@H]2C1 691426237 HRWMMCJJDQILLC-UXLLHSPISA-N 425.367 4.280 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@@H]([C@@H]2CCCN2C(=O)OC(C)(C)C)C1 734687106 IEIHYGDUVKYWHY-IRLDBZIGSA-N 444.620 4.382 10 10 IICE CCN(Cc1nc(O)c2c3c(sc2n1)CCC3)Cc1cc(Br)ccc1O 744425721 LCVHGLKKSMPZRA-UHFFFAOYSA-N 434.359 4.376 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](Cn3ccnc3)c3ccc(C)cc3C)CC2)cc1 750390572 HHHGFJRSJMIVMA-RUZDIDTESA-N 447.583 4.172 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)CC2 758411135 COGHHNFTKRTSAH-MRXNPFEDSA-N 432.490 4.166 10 10 IICE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1Cc1ccc(Oc2ccc(F)cc2)nc1 761000174 STRWVBWVQDJLPO-UHFFFAOYSA-N 441.846 4.336 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@H]1COc2c1ccc(Cl)c2Cl 764790289 JDPXDXJLHMHQAY-LBPRGKRZSA-N 432.101 4.394 10 10 IICE O=C(COC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12)c1ccc(O)c(O)c1 783438694 GGHQXENHYSCAFD-UHFFFAOYSA-N 448.406 4.357 10 10 IICE CCCc1c(NC(=O)NCc2cccc(OC)c2O)cnn1-c1cc(F)c(OC)cc1F 797683478 LOIOGQGDTZJNTG-UHFFFAOYSA-N 446.454 4.148 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(Cc4ccccn4)ccc3C)CC2)cc1F 801903021 NMAXFYWKVOZUKE-UHFFFAOYSA-N 434.515 4.483 10 10 IICE C[C@@H](Oc1ccc(F)cc1Br)C(=O)NCc1cc(Br)ccc1O 804735197 OZOHZKDIZYCAFE-SECBINFHSA-N 447.098 4.140 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C)c(NC(=O)c4ccccc4F)c3)C2)cc1 1131030728 UQEGGSJBTSPDCB-IBGZPJMESA-N 447.510 4.404 10 10 IICE COc1ccc([S@](C)(=O)=NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1134005361 LVLNQCJKBRDRCI-HKBQPEDESA-N 439.581 4.100 10 10 IICE CCN(CC)c1ccc(CNC(=O)CNC(=O)c2ccc(Oc3ccccc3)cc2)cc1 1136300358 NKWMJFJJBXSDCN-UHFFFAOYSA-N 431.536 4.371 10 10 IICE Cc1cc(C(=O)NC[C@@]2(N(C)C)CCSC2)c(C)n1-c1ccc(Br)cc1 1137151028 DAMKBVXWYCYASQ-FQEVSTJZSA-N 436.419 4.024 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@@H](OC(C)(C)C)[C@H]1n1cccn1 1158288831 OWZAIBIXHJXDMR-MZYLBHOOSA-N 434.540 4.030 10 10 IICE C[C@H](NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(=O)N1c2ccccc2C[C@@H]1C 1228460207 RREPUIUVENQOMP-PMACEKPBSA-N 434.584 4.185 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C2 1230200358 IWMHYGOTLLJPAS-GWOFKNCZSA-N 444.620 4.079 10 10 IICE COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1ccccn1 1260771931 LDJBPSJQZNXQEQ-UHFFFAOYSA-N 430.913 4.392 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)cc1 1293364546 MXVVYQJGXDPYAR-QHCPKHFHSA-N 433.527 4.373 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@H]2CCCN(C(=O)C(F)(F)F)C2)c1 1300028577 GACTYKFHBPTJEC-OAHLLOKOSA-N 441.881 4.278 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccccc3COc3cccc(C=O)c3)C2)cc1 1300633804 MLKAYZVOINZZPA-NRFANRHFSA-N 430.504 4.095 10 10 IICE CO[C@H]1CCCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C1 1300774102 JPKXMIMQCJNEPM-INIZCTEOSA-N 435.644 4.185 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCOC1 1300958435 VZFJIUPHNCSTTL-NQIIRXRSSA-N 437.588 4.108 10 10 IICE COCCC1(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2ccccc2O)CCCCC1 1301484185 NRWRGANWODREBV-FQEVSTJZSA-N 428.577 4.111 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3cc(F)cc(Br)c3C2)c([N+](=O)[O-])c1 1307178537 AZZHQEJLIARLNV-HWKANZROSA-N 435.249 4.245 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H](C(=O)OC(C)(C)C)C3CCCC3)cc2F)C[C@@H](C)O1 1354659209 UNYSLTHJUAAZEK-JKSBSHDWSA-N 448.579 4.204 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc2ccc(Br)cc2c(=O)o1 1445902702 SBNVUOVFFLDTGY-UHFFFAOYSA-N 428.282 4.070 10 10 IICE CCOC(=O)COc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1446753010 FEVYFLJGBQLEEN-UHFFFAOYSA-N 434.492 4.030 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@@H](O)C(F)(F)F 1447085150 WMYCVCDQYKUMHL-HZPDHXFCSA-N 433.268 4.288 10 10 IICE CC1(C)CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CCS1 1448734624 IHKIFFXFEWATEN-SSZFMOIBSA-N 438.615 4.161 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1C[C@@]1(F)c1ccccc1 1452000425 YJONZUSIVABWIC-UGZQKDQTSA-N 446.594 4.483 10 10 IICE O=Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2)cc1 1465423758 YXYNTGRPBNECKX-UHFFFAOYSA-N 432.495 4.196 10 10 IICE COc1ccc(N2CCN(C(=O)C(F)(F)c3ccccc3Br)CC2)cc1F 1465930318 MWVOTGVMSFMXCJ-UHFFFAOYSA-N 443.263 4.037 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@@H]2c2ncon2)c(C)n1-c1ccc(Br)cn1 1466330796 QISHAISUWFXQQA-QGZVFWFLSA-N 444.333 4.392 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C/c1ccc2cc(OC)ccc2c1 1466398755 RLEPHAPJPLWTGL-ONNFQVAWSA-N 439.895 4.422 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cc(I)ccc1F 1469301654 BMBNXFFGHDXFOX-UHFFFAOYSA-N 438.284 4.351 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@H](c3ccc(F)cc3)C2(C)C)N(C)C)cc1 1471547023 GWDIYSYYHKPRPR-PKTZIBPZSA-N 426.580 4.472 10 10 IICE COc1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)CC2)cc1F 1472727911 QJUJIEQJMCNBJI-UHFFFAOYSA-N 435.455 4.300 10 10 IICE CCCCO[C@H]1C[C@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(C)C 1473259612 KJFGIIJVJOQHLT-GOTSBHOMSA-N 448.563 4.316 10 10 IICE CCN1C[C@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1502250044 SXKWYGCOLKUCSD-SJORKVTESA-N 440.567 4.019 10 10 IICE CC(C)c1nnc(N2CCO[C@](C)(C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1509018378 GWZCMDFBWYUXQJ-VWLOTQADSA-N 425.621 4.474 10 10 IICE C[C@@H]1C[C@H](Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CCO1 1512023213 WPFKHLWNTQCCOJ-HZPDHXFCSA-N 427.936 4.151 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)nc(C(C)C)n1 1518850717 UMBPBRNNPMOTIW-LFIBNONCSA-N 444.557 4.278 10 10 IICE CO[C@@H]1CCN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)C1 1519483189 RVUNLXLZBUTCMP-GOSISDBHSA-N 429.615 4.041 10 10 IICE COCCOc1ccc(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1524705653 YGQVIJHEDIVXES-GOSISDBHSA-N 430.976 4.460 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CSc3cccc(Br)c3)C2)cc1 1526247308 VUIGLYYRJFYUSD-OAHLLOKOSA-N 435.387 4.193 10 10 IICE CCOC(=O)c1cc(COC)cc(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)c1 1526700588 VAUKITPHUAKRCG-UHFFFAOYSA-N 438.524 4.480 10 10 IICE Cc1cc(CC(=O)NC2(C(=O)NCC(C)C)CCCC2)c(C)n1-c1ccc(Cl)cc1 1534088180 NZRFOAXPHHHVDX-UHFFFAOYSA-N 429.992 4.491 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(C(=O)N(C)c4ccccc4)c3)C2)cc1 1537109044 JQPAPOUCGGITJR-HXUWFJFHSA-N 443.547 4.228 10 10 IICE CCc1ccc(-c2nc(CC(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cs2)cc1 1539705924 JEBUYRWIIITMFS-QHCPKHFHSA-N 436.625 4.400 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC[C@H](N3CCCC3)C2)cc1 1547447529 YUZMQZWRHDSSHJ-DEOSSOPVSA-N 438.664 4.436 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1CCc1nc(C(C)(C)C)cs1 1554175708 SZSONZBOOCSDIE-UHFFFAOYSA-N 449.584 4.074 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(Cc2ccccc2)C[C@H](O)C(F)(F)F)c1 1556156669 FIPRCOXMWGLDQD-QFIPXVFZSA-N 444.453 4.472 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(CCC(F)(F)F)cc1 1583379068 MADVHCUNLSVPIY-UHFFFAOYSA-N 428.401 4.226 10 10 IICE CCSc1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1589061377 AJTKFJSLPUFLGJ-UHFFFAOYSA-N 448.591 4.297 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1607706597 OXPLKHVUHQYGJG-JOCHJYFZSA-N 425.621 4.159 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@@H]2c2cncc(Br)c2)c([N+](=O)[O-])c1 1612954882 HKIGVWZOSLOMPN-BIENSFFJSA-N 432.274 4.280 10 10 IICE COc1ccc(N2CCCN([C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)CC2)cc1 1615219177 CXABPXFUTJFYKQ-OAQYLSRUSA-N 434.367 4.320 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(CC)C2CCCCC2)cc1 1615379537 IZNJROPTJDJARO-QFIPXVFZSA-N 438.620 4.283 10 10 IICE COc1ccc2c(NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)ncnc2c1OC 1615759378 LDHVRAMTGYOQIX-NRFANRHFSA-N 435.572 4.352 10 10 IICE CCC(CC)(C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)OC(C)(C)C 1630262839 QCIVGVQQYCOIFC-SFHVURJKSA-N 438.996 4.274 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@@H]2c2cnn(C)c2)c(C)n1-c1ccc(Br)cn1 1634264651 NKUOAOXPSMNKOF-IBGZPJMESA-N 442.361 4.208 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCCC[C@H]2c2ccc(Cl)cc2)c1 1635284204 KXZVRLWFEGTZHM-PKOBYXMFSA-N 436.961 4.263 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C3)c2C)cc1 1638286775 WQSIGLMWBPLQSY-NRFANRHFSA-N 441.572 4.478 10 10 IICE CCOC(=O)c1oc2ccccc2c1CN(CC(=O)OC)Cc1cc(Cl)ccc1O 1644815787 UGMXCVFZYOTUKH-UHFFFAOYSA-N 431.872 4.144 10 10 IICE CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1676653843 YXJLYSUOJKDFGX-HVCNVCAESA-N 438.616 4.165 10 10 IICE COC[C@@H](NC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)c1cccc(Br)c1 1682102199 YKWCQAZGMDLCOF-HRAATJIYSA-N 448.405 4.441 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1CCCCCN(Cc2ccccc2)C1 1683333667 QVFDEZHLHKVQOH-LJQANCHMSA-N 446.389 4.399 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3ccc(C(F)(F)F)cc3C2)N(C)C)cc1 1687807092 NXBNAZMYVUGJMN-OAQYLSRUSA-N 434.506 4.142 10 10 IICE C#CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@H]1C 1705605378 JAYXKQLRZXVZSZ-KNQAVFIVSA-N 431.584 4.485 10 10 IICE Cc1ccc(-c2nnc(N3CCO[C@@H](C(C)C)C3)n2CCCSc2nccs2)o1 1724326379 VKNCKXPMVUTXSI-QGZVFWFLSA-N 433.603 4.347 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCCO[C@@H](C)C2)cc1 1746093554 QITVFRNKGRMTTO-SIKLNZKXSA-N 427.593 4.029 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](C)c1ncc(C)s1 1763071001 SHJCPRZWHQFZGD-QGZVFWFLSA-N 440.617 4.134 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1763257149 UTSQVKQZOCNBPN-HXOBKFHXSA-N 435.620 4.187 10 10 IICE CCCOC(=O)c1ccc(N2C(=O)/C(=C\c3ccc(O)c(OC)c3)SC2=S)cc1 1860076908 YKUCXOMBHWCJEH-LDADJPATSA-N 429.519 4.373 10 10 IICE CCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2[C@H](C)COC[C@H]2C)n1 1868274249 AOFMBTRCYPWVKU-HZPDHXFCSA-N 442.519 4.172 10 10 IICE Cc1cc(O)c([C@@H](n2nc(C(F)F)c(C(N)=O)c2Br)C2(C)CC2)cc1C 2080055682 IWMZXAAOOLGUPV-CQSZACIVSA-N 428.277 4.394 10 10 IICE COc1ccc(Br)c(CNC[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c1O 2236055657 QXIOWJVGHXJWAH-FQEVSTJZSA-N 443.382 4.290 10 10 IICE Cc1ccc(C2=NC(=O)C(=C3C(=O)N(C)c4c(C)cc(Br)cc43)S2)cc1 2297321725 STPOYVUWYBAPEV-UHFFFAOYSA-N 427.323 4.474 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccco3)C2=O)ccc1O[C@@H](CC)C(=O)O 2314933377 AWYNTZMLACJPCU-HNNXBMFYSA-N 447.534 4.322 10 10 IICE CCC1=NN(Cc2ccc(F)cc2)C(=O)C1=Cc1cc(Br)c(O)c(OC)c1 2332107623 OHRCIAXYAQVZFJ-UHFFFAOYSA-N 433.277 4.494 10 10 IICE CCCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(\C)Nc1ccc(Cn2cncn2)cc1 13183107 IITSXHCSFMFIAQ-HAVVHWLPSA-N 430.512 4.224 10 10 IICE CNC(=O)Cc1nc(CSc2ncc(-c3ccccc3)n2CC(F)(F)F)cs1 748613495 KRQARGVJPMIWCO-UHFFFAOYSA-N 426.489 4.150 10 10 IICE COc1ncccc1-c1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 761688713 DWWLYARNUWQBHR-KAMYIIQDSA-N 444.563 4.036 10 10 IICE O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 769306632 BBTZPCFKWOWVJA-HSZRJFAPSA-N 425.960 4.125 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Br)cc1 770994393 VUFDIJQOOHLELJ-QGZVFWFLSA-N 445.401 4.468 10 10 IICE Cc1ccc(NC(=O)C[C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)c1 773143594 BKJXLNIZYCADFJ-QFIPXVFZSA-N 434.628 4.342 10 10 IICE COc1c([N+](=O)[O-])ccc(CNC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c1O 774973701 CEJAQVNSUPKGGR-UHFFFAOYSA-N 439.434 4.082 10 10 IICE COCc1nc(C(=O)O[C@@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)co1 775080583 VOLKKINCOVSYNG-AWEZNQCLSA-N 448.422 4.258 10 10 IICE COC(=O)Cc1sc(NS(=O)(=O)c2c(F)cccc2Cl)nc1-c1ccccc1 780703415 OFERGWYTEAVYFV-UHFFFAOYSA-N 440.905 4.119 10 10 IICE CC(=O)Nc1cccc(N2C(=O)/C(=C/c3cc(-n4ccnc4)cs3)SC2=S)c1 783699602 WWVHNDUKROLXDK-MFOYZWKCSA-N 426.548 4.298 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C23CC(C(F)(F)F)(C2)C3)NC(=O)OC(C)(C)C)cc1 787075545 ZSLCBHGAYHBKPF-YMTQGWHGSA-N 441.494 4.167 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(-c2csc(C)n2)cc1 803842424 QIRBRJLSMSJGLR-UHFFFAOYSA-N 437.565 4.269 10 10 IICE Cn1cc([C@@H](NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C2(CO)CCC2)cn1 821288738 WBLXYFZWPGHOHE-HSZRJFAPSA-N 432.528 4.268 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3oc4ccccc4c3Br)C2)cc1 1129992888 AKMOZFCLLRQGSZ-AWEZNQCLSA-N 429.314 4.460 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cccc(COCC(F)(F)F)c2)cc1 1224658830 CWXDCRSUDCESNZ-UHFFFAOYSA-N 439.478 4.052 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cccc(C)c3Br)C2)cc1 1226402773 NKEYTBFWQRPNNG-MRXNPFEDSA-N 432.362 4.092 10 10 IICE COc1cccc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1264440163 TVIBGSHDTMFUNG-ONDHQXCVSA-N 444.553 4.303 10 10 IICE CC(C)[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1290482984 HVLFYQGDIKRRTO-FQEVSTJZSA-N 430.551 4.382 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC[C@@H]1OC 1291443258 VIQFDRWFZCFCFH-RRPUWOKSSA-N 441.620 4.080 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)C[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1292016518 GFOQGVJSQROTHA-ROUUACIJSA-N 440.636 4.102 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)Cc1cccc(F)c1 1292998013 XVMYYAAPKSUULF-GOSISDBHSA-N 426.463 4.134 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1Cc1nc(C(C)(C)C)cs1 1298364182 UTLZLJMCEFVSHA-KRWDZBQOSA-N 441.601 4.316 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1 1300681163 WLQBRWBHSDAMSB-AZGAKELHSA-N 430.548 4.074 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)c1cc(O)cs1)Cc1ccccc1O2 1304151638 NNLXHECKELSSAY-UHFFFAOYSA-N 444.553 4.258 10 10 IICE Cc1cc(-c2nnc(N3CCOC(C)(C)C3)n2CCOC(C)C)c(C)n1-c1ccccc1 1304196744 MKNDBLLJHZLPEB-UHFFFAOYSA-N 437.588 4.393 10 10 IICE Cc1ccc(C(=O)N(C)CCc2nccc(C(F)(F)F)n2)cc1-n1c(C)cc(C=O)c1C 1304826388 HZIPOXQMDQETDW-UHFFFAOYSA-N 444.457 4.339 10 10 IICE CCS[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307700566 SHXXTUJVZPZNBA-PAXLWEDBSA-N 436.577 4.443 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCSC[C@H]3c3ccc(C)cc3)C2)cc1 1312903056 TZLLCCFJCCSGAA-CVDCTZTESA-N 425.598 4.330 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)c3nc(F)ccc3Br)ccc21 1354573918 CZFCRVXNQGOZKQ-UHFFFAOYSA-N 425.213 4.011 10 10 IICE CC(C)n1ncc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)c1Br 1359897738 XQZMCAHCTIHAEJ-UHFFFAOYSA-N 447.299 4.497 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2CCCC[C@@H]2[C@H]1C(=O)NCc1ccc2cccnc2c1O 1451957583 KCQLMQGTKPZJOT-LRQRDZAKSA-N 439.556 4.372 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F 1455215486 RJVBFFIGLDEBJN-UNMCSNQZSA-N 444.453 4.171 10 10 IICE CC(C)(C)OC(=O)[C@@]1(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1(C)C 1456077756 RCFVFRDPMXLGRD-QHCPKHFHSA-N 438.515 4.131 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)n(C2CCOCC2)n1 1459576999 JVQXMWHDMOSHEJ-MRXNPFEDSA-N 430.980 4.363 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cn2c(S)nnc2-c2ccc(Cl)cc2)cc1F 1465007257 QFNCYTJQYKGCOO-UHFFFAOYSA-N 447.967 4.189 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2)cc1 1465199153 GDQQABZEZWXVHF-UHFFFAOYSA-N 444.409 4.228 10 10 IICE C[C@H](NC(=O)N(C)Cc1ccc(N2CCCC2)cc1)c1ccc(N2CCCNC2=O)cc1 1470343317 OYXNCWPLFMSMOY-IBGZPJMESA-N 435.572 4.109 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCO[C@@H](C(F)(F)F)C1 1510675806 VHYLAXFIBFKNJW-GOSISDBHSA-N 439.526 4.057 10 10 IICE COC1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)SC)C1 1517904378 OYGJVJZWIYYYSF-QGZVFWFLSA-N 425.602 4.329 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1 1528433118 JLERYJAXUOJPNR-UHFFFAOYSA-N 446.956 4.423 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1[C@@H]1CCC[C@H](C(F)(F)F)C1 1541639196 ZANWSWYRTNEJAZ-JKSUJKDBSA-N 439.482 4.052 10 10 IICE C[C@@H]1CCCCN1CCCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1544019544 ZWISLBQDTQPFFD-IRLDBZIGSA-N 441.620 4.169 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc(C(C)C)cc(C(C)C)c3O)CC2)cc1 1544315708 SKFLSQJKHXMZIC-UHFFFAOYSA-N 439.600 4.200 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnc(SC)n3-c3ccc(F)cc3)CC2)cc1 1545929676 HISCCRDGKBRHFC-UHFFFAOYSA-N 440.544 4.094 10 10 IICE CN(CCc1nccs1)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1554264382 NNLXRBPAQNXHGY-UHFFFAOYSA-N 443.627 4.114 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccccc2)c(C)n1-c1ccccc1Br 1556530008 YJAYHHBDJKPEGB-GOSISDBHSA-N 427.342 4.190 10 10 IICE COCCc1ccnc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1556566776 FIMAFJCVXIQUEF-UHFFFAOYSA-N 429.318 4.088 10 10 IICE Cc1ccc(C(=O)N2[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1556755917 YHTUHNXJDPLVCP-KDURUIRLSA-N 437.584 4.323 10 10 IICE C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1558723628 SOKOUFJDRXRONB-KBMIEXCESA-N 446.595 4.330 10 10 IICE Cc1cc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)n1-c1ccc(F)cc1 1567597404 ZJGARCVJZMQAQR-DEOSSOPVSA-N 435.543 4.254 10 10 IICE COc1cc(N2CCN(C(=O)CCCCc3ccc(Cl)cc3)CC2)cc(OC)c1OC 1584525615 FOYZUDCOSWCLBF-UHFFFAOYSA-N 446.975 4.427 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3[nH]c4c(Cl)cccc4c3C)CC2)cc1 1587447826 POIWCUHKCVZAKX-UHFFFAOYSA-N 440.975 4.080 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(Br)cc3)CC2)c(OC)c1 1595996781 KUSLSOKAECYPAQ-UHFFFAOYSA-N 447.373 4.093 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccccc1 1596408018 AZYKNRJEEBLZOB-LJQANCHMSA-N 428.330 4.369 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)CC2)cc1 1596964937 SLBYFMMXDKTEOB-SANMLTNESA-N 438.568 4.149 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1nc(-c2ccccc2)oc1C1CC1 1597567465 OSSPTLRRJXNQJA-UHFFFAOYSA-N 440.883 4.393 10 10 IICE CN1CC[C@H](C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H]1c1ccccc1 1610971193 GKJXONVLHPOZBL-NYVOZVTQSA-N 429.511 4.066 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCc1nc(Cc2ccccc2)no1 1613060232 LBPTZGFUESWGBN-UHFFFAOYSA-N 428.448 4.454 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 1623549976 OUWVIRSWKKZCJJ-UHFFFAOYSA-N 435.955 4.422 10 10 IICE Cc1cccc2c1CCN2C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1624772561 HFSOFURATCAIHS-CPNJWEJPSA-N 426.538 4.315 10 10 IICE CCOC(=O)C1=CC[C@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1629345743 GMEGBDJYTCIMIW-KRWDZBQOSA-N 431.330 4.238 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@H](O)Cc3cccc(Cl)c3)c2C)c1 1637577993 MEBUGFDIHZSOBC-QHCPKHFHSA-N 425.960 4.459 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](C)SCC(=O)Nc1ccc(F)cc1 1638239132 HRXDPNDJLGXWPI-IRXDYDNUSA-N 431.577 4.008 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)N[C@H](C)c3ccccc3O)cc2)c1C(F)(F)F 1643738618 JSTYVERZJWZPEL-CYBMUJFWSA-N 447.413 4.264 10 10 IICE CC(C)(C)n1nc(Br)c2c(NCCCSc3nccs3)ncnc21 1650728272 AEGXJUJMABQJIZ-UHFFFAOYSA-N 427.397 4.395 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@H]1CCN(c2c(F)cccc2F)C1=O 1657432329 WTGWSBDMZNUNKZ-INIZCTEOSA-N 425.273 4.060 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1683858290 PEOHQFMSNVJNSC-NRFANRHFSA-N 442.604 4.360 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC[C@H](C(F)(F)F)C1 1693004759 BYPUOEWKHIZTFO-KRWDZBQOSA-N 432.494 4.475 10 10 IICE CCc1nnc(N(C)[C@H](C)c2cccs2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1694628358 ZVHBHMQHPOZIIZ-GOSISDBHSA-N 439.629 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2C[C@H](C)CC(C)(C)C2)cc1 1710023852 FRJKJRQFMWUXOZ-LJQANCHMSA-N 440.636 4.183 10 10 IICE CCN(CCC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1728489164 LTTTWTVJCUTAKI-UHFFFAOYSA-N 439.648 4.459 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@H](C)C3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1742120216 WOBDCVABUSYTKY-RTBURBONSA-N 448.615 4.313 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCN1CCCCCC1 1747753065 BIPGMNFBNATWEC-UHFFFAOYSA-N 425.602 4.148 10 10 IICE CC1=C(C)CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1751330290 YWJMWTBWZDZBQM-UHFFFAOYSA-N 437.632 4.280 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)cc1C 1763608943 GLOFFNGYCGYXME-TZIWHRDSSA-N 426.653 4.382 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](O)CC3(CCCC3)C2)cc1 1764931918 ZCHFUBBPMQCMOJ-JOCHJYFZSA-N 425.621 4.427 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)ccc1O 1860087091 YXALGHKYYJBZFA-LDADJPATSA-N 425.535 4.111 10 10 IICE CCc1ccc(NC(=O)c2ccc3c(c2)C(=O)N(CCc2ccccc2)C3=O)c(C(=O)O)c1 1865876809 GLLIAJSPXATISM-UHFFFAOYSA-N 442.471 4.038 10 10 IICE C[C@](CC(=O)O)(Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951860093 MWGBGROWGMWZDJ-AREMUKBSSA-N 447.487 4.412 10 10 IICE O=C(N[C@@H]1CC12CC(NCc1ccc(Br)cc1O)C2)OCc1ccccc1 2026169789 KWOPKQZMXGJYTP-MOMVYJMYSA-N 431.330 4.092 10 10 IICE CCN[C@@H](c1ccc(N(C)C)cc1)[C@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 2044747904 JXLVWOHESYVLBL-ZEQRLZLVSA-N 440.632 4.429 10 10 IICE CCOC(=O)c1c(C)nn([C@@H](CC)c2cc(C)c(C)cc2O)c1I 2079946403 VLDFKGJGGIGXPQ-AWEZNQCLSA-N 442.297 4.295 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NCc3ccc(Br)cc3O)CCC[C@H]2C1 2092950234 QYXIMHWHQDXCDM-UAGQMJEPSA-N 425.367 4.280 10 10 IICE CC[C@@H](C)Oc1ccc(C=C2C(=O)NC(=S)N(c3ccc(Cl)cc3)C2=O)cc1OC 2294216956 UGYAXVWQMBJZHI-CYBMUJFWSA-N 444.940 4.357 10 10 IICE CCOc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1ccc(C)cc1 2297347582 KFRWRYLXQDDRKK-UHFFFAOYSA-N 431.448 4.063 10 10 IICE CCOc1cc(OCC)c(C=C2SC(=S)N(CCOC)C2=O)cc1Br 2297349420 SEBWHCGCZUKAPP-UHFFFAOYSA-N 446.388 4.094 10 10 IICE CC[C@H](C)[C@H](C(=O)NCc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2380740725 ZHBBGRRQOCHZMD-BLLLJJGKSA-N 443.382 4.361 10 10 IICE Cc1ccc(CN(C)C(=O)C(C)(C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2380759642 PVXCKOCSRRJNLJ-UHFFFAOYSA-N 443.382 4.363 10 10 IICE Cc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@@H]32)s1 14456805 CCSWNPMIFJLQGP-ABXWHYIOSA-N 430.595 4.340 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CC(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 15035439 FKBMSBAUVIDBNK-YVLHZVERSA-N 448.953 4.284 10 10 IICE CCN(CC)CCCN[C@@H](CC(=O)Nc1ccc(/N=N/c2ccccc2)cc1)C(=O)O 35355734 UQAQOSKGRVRIAS-ZPKNHPDFSA-N 425.533 4.205 10 10 IICE CCCN1C(=O)/C(=C/c2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)SC1=S 213153183 PXQRIUQCGSENDY-VBKFSLOCSA-N 441.509 4.237 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)C(=O)Nc1nc2c3c(ccc2s1)CCCC3 733850824 SGVPGPQXODUHHK-UHFFFAOYSA-N 434.565 4.030 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CCCc3cn(C(C)C)nc32)C1 766892981 UVLUGCOIMPLZQA-JOCHJYFZSA-N 433.600 4.379 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)C1(c2ccccc2Br)CC1 789737670 SPRFIXJMPRVPPG-UHFFFAOYSA-N 431.399 4.350 10 10 IICE Cc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c(C)c1Br 790663778 RTINHLOIQINABU-UHFFFAOYSA-N 430.346 4.020 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1[C@@H]1C[C@H]2CC[C@H]1C2 917643803 KOXGNURCFBKZNN-CGRGUYNTSA-N 431.320 4.274 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3c(C)ccc4cc(C)ccc34)CC2)cc1 1124518351 SRPZGOMMAMCYDJ-UHFFFAOYSA-N 431.580 4.407 10 10 IICE Cc1sc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Br 1127267371 HDKMSDGEFHMHCS-UHFFFAOYSA-N 448.430 4.281 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(-c4cccc(Cl)c4)[nH]n3)cc2F)C[C@@H](C)O1 1136311198 IMDCVPZBZVIQGF-HUUCEWRRSA-N 442.922 4.413 10 10 IICE Cc1cc(C(=O)NCCOc2ncccc2Cl)c(C)n1-c1ccc(Br)cn1 1137250648 ALRVPRSVYNYOQL-UHFFFAOYSA-N 449.736 4.109 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c(C)n1-c1cccc(Br)c1 1137377088 BOMAGGNRVVXMRY-UTKZUKDTSA-N 430.390 4.413 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC(C)(C)N2C[C@@H](C)C[C@@H](C)C2)C1 1142282325 XTCRZVLDBQGFPD-OYRHEFFESA-N 438.660 4.281 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1C 1148085312 GHSNTQLNBJPIBD-WOJBJXKFSA-N 429.536 4.480 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](C)c1nc(-c2ccccc2)no1 1152968235 VEEDBYJUWNQTRQ-MRXNPFEDSA-N 428.492 4.490 10 10 IICE Cc1ccc(C(=O)NCCCCNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1154016274 KRJGPLKEWLYQGK-UHFFFAOYSA-N 427.545 4.250 10 10 IICE CCNC(=O)c1cccc(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)c1 1177022676 SOCXMEHDIXMZRH-UHFFFAOYSA-N 447.535 4.099 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)C2)cc1 1252922029 CWQCDOVUQXOZCT-HZSPNIEDSA-N 439.400 4.046 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1nccc2c(Br)cccc12 1291625877 DLYCKDCVMKHGGY-UHFFFAOYSA-N 442.382 4.481 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC=C(C(F)(F)F)CC2)cc1F 1298055877 IJAWGCKJMSYWET-UHFFFAOYSA-N 446.452 4.292 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1299438928 RGRYONXDUILWFO-TZIWHRDSSA-N 425.573 4.446 10 10 IICE Cc1cc(C(=O)Nc2cc(C(=O)OC(C)C)[nH]n2)c(C)n1-c1cccc(Br)c1 1304101324 MSKUQTYDTNAJCY-UHFFFAOYSA-N 445.317 4.397 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2CCC2(C)CC2)c(C)n1-c1ccccc1 1304191143 XJYPLXWMPPHQTQ-KRWDZBQOSA-N 434.588 4.243 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)CCc3ccccc3)cc2Cl)C1 1436047841 MLJRBEBIFZCEIR-RBUKOAKNSA-N 442.003 4.330 10 10 IICE C[C@@H]1c2ccc(C(=O)N(C)Cc3ccc(N(C)C)cc3)n2CCN1C(=O)OC(C)(C)C 1440661733 GZDOYWUIOYXBJB-QGZVFWFLSA-N 426.561 4.138 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2nnc3ccc(C(F)(F)F)cn23)c1 1440715103 TWXUCAXYTKVXOF-UHFFFAOYSA-N 427.430 4.394 10 10 IICE Cc1ccc(-c2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)on2)cc1 1445879533 FBAQUPHUERFAOB-IBGZPJMESA-N 425.916 4.403 10 10 IICE COc1ccc2c(c1)[C@H](C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CCC2 1445885558 RKYXZDUDXACYSQ-TZIWHRDSSA-N 428.960 4.255 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445886208 SIXDMZURWJFXKF-IBGZPJMESA-N 442.922 4.073 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N(C4CCCCC4)C3=O)c2C)cc1C 1458893922 CDHHLFFJGGLAIB-UHFFFAOYSA-N 435.524 4.017 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC(C)(C)CC[C@H]2CO)sc(C)c1-c1ccccc1 1460491162 QQGLZWHZYVDBSG-SFHVURJKSA-N 444.597 4.322 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2nnn(-c3ccccc3)c2C)cc1 1464959516 SXXYZWMFJHDEHP-UHFFFAOYSA-N 441.535 4.497 10 10 IICE O=C(Cc1ccccc1OCc1ccncc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1466290177 SCFQGZBYGPCCOQ-QHCPKHFHSA-N 432.520 4.117 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H](CCNC(=O)OC(C)(C)C)C1 1470556559 XILSXNPMRMMVCV-UXHICEINSA-N 446.636 4.328 10 10 IICE COc1cccc(CNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2cccc(F)c2)c1O 1478791717 GBRNUWQXOYZPMJ-XZOQPEGZSA-N 449.526 4.007 10 10 IICE COc1cc([C@H](C)NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc2ccccc12 1479185777 UAMPIRWPMLLUET-IBGZPJMESA-N 432.568 4.161 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CC[C@H](C)C3)CC2)cc1F 1504295870 KBVOJHOSONQOFM-RBUKOAKNSA-N 429.584 4.387 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC(c2ccco2)CC1 1538884534 NYYZHQFDGXFBKI-XMHGGMMESA-N 444.553 4.416 10 10 IICE CCN1C[C@H](CN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)Oc2ccccc21 1539443873 JQHHTAVFSRAATK-DEOSSOPVSA-N 445.563 4.195 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccncc3)CC2)c(C)n1-c1cccc(Br)c1 1540423341 ZRNYYABSKIIVES-UHFFFAOYSA-N 439.357 4.214 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1545257431 MDDUWNRGYPWACN-FNZWTVRRSA-N 448.615 4.374 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cccc(-n4cnc(N(C)C)n4)c3)c2C)cc1 1556310127 NUTXECUTGVKCDU-UHFFFAOYSA-N 430.512 4.002 10 10 IICE COCCNC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1556568199 PEPMYZZHTHBHEJ-UHFFFAOYSA-N 425.916 4.376 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](CCNC(=O)OC(C)(C)C)C2)c1 1558640519 UYMKTINCRJOIRQ-IBGZPJMESA-N 439.556 4.284 10 10 IICE CC(C)OC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 1564649751 LWBMBBHVRXANJZ-KRWDZBQOSA-N 435.996 4.450 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@@H]3CCCC[C@@H]32)c(C)n1-c1cccc(C(C)C)c1 1566370536 DHAGSEHQYOADOE-XZOQPEGZSA-N 428.598 4.399 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1 1598022632 KTAMUYODUZMNRZ-XLIONFOSSA-N 439.556 4.282 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC2(CCOCC2)C1 1611963653 WQSFGGYSTMBGAU-UHFFFAOYSA-N 425.621 4.296 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C 1617756161 GSIOEDYSNPRMPQ-IBGZPJMESA-N 425.529 4.036 10 10 IICE C[C@@]1(CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1(F)F 1618062401 NOVLCKNZCNGUNE-JIIJFUIFSA-N 430.567 4.281 10 10 IICE COC(=O)[C@@H](C)CN(Cc1ccccc1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1624593329 JZFOLWKPRFCRBZ-IBGZPJMESA-N 446.547 4.287 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1625622784 QGANAGJPVHEIGO-QFIPXVFZSA-N 432.542 4.176 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)CC(=O)N(C)[C@@H](C)c2ccccc2)cc1 1625866357 FKICIGPHRAONQY-FQEVSTJZSA-N 445.563 4.127 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(C)n1-c1ccc(Cl)cc1 1626689956 QPJDFBWWQPDRBV-UHFFFAOYSA-N 449.982 4.204 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1632049886 PKVUXONZYYXMCV-UHFFFAOYSA-N 433.552 4.432 10 10 IICE Cc1cc(C(=O)NCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccn1 1634401326 YISFBVLRPSRLTN-VQIMIIECSA-N 426.561 4.112 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cccc(NS(=O)(=O)c2cccs2)c1 1647788959 VTPTXIZTIZTGFJ-UHFFFAOYSA-N 438.530 4.338 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)[C@H](C)C1 1652402748 YVQDNYBUNJZDQJ-CZUORRHYSA-N 433.346 4.270 10 10 IICE COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N[C@H](C)c1ccccc1O 1659815852 WRFXWFPWBNGZPY-KGLIPLIRSA-N 426.435 4.114 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3Cc3cnc(C)s3)CC2)cc1 1697471940 SJAIRBDUJFCTFR-UHFFFAOYSA-N 440.617 4.015 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H](C)c3nccs3)CC2)cc1 1711865478 WXKIBLYSCXUYAW-SFHVURJKSA-N 440.617 4.387 10 10 IICE COCC1(CCn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)CCCC1 1712195427 PNMUFCTWYWXLMS-UHFFFAOYSA-N 435.572 4.203 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCOC2)nnc1N(C)[C@H](C)c1cccs1 1724235040 LWYMRRVAMVRVJZ-IEBWSBKVSA-N 425.602 4.464 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1746091684 FGKYZUDYTGASBI-HSZRJFAPSA-N 448.615 4.020 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1750733753 UJCADKVAJZTWRX-KRWDZBQOSA-N 444.630 4.168 10 10 IICE COC(=O)c1c(NC(=O)c2ccc(CS(C)(=O)=O)o2)sc(C)c1-c1ccc(C)cc1 1865785885 FUTZOZXLQGJCKY-UHFFFAOYSA-N 447.534 4.208 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)/C=C/c2ccc(Br)cc2)c2nccn2C)cc1 1866125779 XNVTWUVYHAFDBR-JJMMYFGJSA-N 439.357 4.168 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC12CCC(NCc1ccc(Br)cc1O)CC2 1967784486 KUZNVJURLNLUEV-CMVHYPBASA-N 425.367 4.470 10 10 IICE Cc1ccc([C@@H](n2nc(C(F)F)c(N)c2I)C2(C)CC2)c(O)c1 2079051600 HWYNGEGNBYGWBD-CYBMUJFWSA-N 433.240 4.411 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C(F)(F)F)c(C(=O)O)c2Br)c(O)c1 2079845125 QECZEMWCHIWUMD-GFCCVEGCSA-N 437.212 4.322 10 10 IICE Oc1ccc(Br)cc1CN[C@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156277322 JIIUPOJCJFUWRQ-IRLDBZIGSA-N 431.374 4.068 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3-c3ccc4ccccc4c3)C2=O)cc1 2294279881 BDPBBTZPCYMOIS-UHFFFAOYSA-N 437.455 4.306 10 10 IICE Cc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2=O)cc1 2296754859 KWWPMICWHSIGEB-UHFFFAOYSA-N 427.507 4.133 10 10 IICE CC1=NN(c2ccc(Cl)cc2)C(=O)C1=CNc1ccc2c3c(cccc13)C(=O)N(C)C2=O 2297511242 WTJJOQPQXRAHOO-UHFFFAOYSA-N 444.878 4.438 10 10 IICE C[C@H](C(=O)Nc1ccc(F)cc1)N1C(=O)C(=Cc2cc(Cl)ccc2O)SC1=S 2314837731 WAQMLBBBLCYTTH-SNVBAGLBSA-N 436.917 4.413 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CC(=O)NCc1ccc(C)c(Br)c1O 2352942391 DLVNSLFKGKWGNV-CYBMUJFWSA-N 429.355 4.115 10 10 IICE Cc1ccc(CNC(=O)CCC2(C)CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381134827 IPMPDXGKZMIDDK-UHFFFAOYSA-N 441.366 4.117 10 10 IICE COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(\C)NCCSc1ccc(C)cc1 205943480 KZWXITXKHXTOIQ-CJLVFECKSA-N 441.528 4.056 10 10 IICE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCCOc1ccccc1-c1ccccc1 209940188 QXVNSDXETLQGGK-QINSGFPZSA-N 428.532 4.399 10 10 IICE CC(C)(C)OC(=O)N1CCC(OCCCNCc2ccc(Br)cc2O)CC1 701014120 LPODEXKZYBOYAF-UHFFFAOYSA-N 443.382 4.051 10 10 IICE CN1CCCc2cc(CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccccc3)ccc21 743669607 BEUUHCVHUGRJMX-OAQYLSRUSA-N 438.572 4.134 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 766444386 AYFUVMOMPJMBIG-RTWAWAEBSA-N 443.513 4.056 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)NCc2ccc(N3CCSCC3)cc2)n1 771268885 KRCOZSLXYPPKJY-UHFFFAOYSA-N 431.612 4.450 10 10 IICE C[C@@H]1C[C@@]2(CCO1)CN(Cc1cc(Br)cc(Br)c1O)C[C@@H](C)O2 797604482 GTPQTSYOTJSPLB-QFSBIZTOSA-N 449.183 4.076 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)Cc4nnn(C(C)(C)C)n4)n3)c2C)cc1 1124276185 HMMKMNRAUBTLTK-UHFFFAOYSA-N 449.584 4.449 10 10 IICE Cc1cc(CC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1127602388 GUFDKISVISTUSX-UHFFFAOYSA-N 431.964 4.273 10 10 IICE CCOC(=O)CCN(C[C@@H]1CCCN1CC)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1142138368 SJYNVPNPKAVLJU-QFIPXVFZSA-N 443.563 4.113 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)C2)cc1 1224641354 JWPFTWUCHMVLJN-HRAATJIYSA-N 427.520 4.262 10 10 IICE CCO[C@@H]1C[C@@H](N(C)C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)C12CCCCC2 1230301187 TYSMNPWQKHBGDA-UEVCKROQSA-N 429.605 4.291 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccc(COC[C@@H]2CCCO2)c1 1231342852 COUCPSMSMUUDLT-DEOSSOPVSA-N 425.573 4.180 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)N1CCC(OC)CC1 1291444892 BZCXNOWNYYZOAU-SFHVURJKSA-N 429.609 4.023 10 10 IICE COCC[C@@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1301519873 YPUNYESABSDELH-KRWDZBQOSA-N 443.592 4.047 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(CC(=O)NC)CC2)n1Cc1ccc(N(CC)CC)cc1 1305439416 NAFXMCVELKWEHA-LJQANCHMSA-N 440.636 4.039 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)C[C@@H](C)CC)n1Cc1ccc2c(c1)CCCN2C 1305577021 MVBYENXQDQXGFU-SFHVURJKSA-N 440.636 4.110 10 10 IICE Cc1ncc(Br)c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)n1 1343620843 NNBMFCWBIJTBQR-UHFFFAOYSA-N 446.276 4.134 10 10 IICE Cc1c(I)cccc1C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1349948878 LBWDTVZPRNIPCH-UHFFFAOYSA-N 434.321 4.470 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(F)c(F)c1F 1352775424 RAJVCUNIHNXQFX-ZROIWOOFSA-N 440.443 4.473 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCCC[C@H]2N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1355606065 UAHQDIDJVCOKBK-DHIUTWEWSA-N 429.992 4.050 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1440664366 IQAAZLFUNONTOB-NYURDRINSA-N 439.987 4.459 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CSCC(=O)N1CCCCC1 1446806353 QZJNHKWJCZBEIJ-LJQANCHMSA-N 426.582 4.228 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(C(F)(F)F)c(O)c1 1448688496 XJBPIKLXCYLBLW-UHFFFAOYSA-N 438.446 4.413 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](O)c3ccccc3Br)c2C)cc1 1451414910 RSBPXNNYGUAOHS-NRFANRHFSA-N 443.341 4.329 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(NC(=O)OC(C)(C)C)cc3)C2)cc1 1461077987 REUDLUNIQSMZPZ-IBGZPJMESA-N 439.556 4.227 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 1464263603 WLWCBAHVQYXURX-UHFFFAOYSA-N 433.577 4.390 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c(C)n1-c1cccc(Br)c1 1464901591 YLMWVJNZVXBOCQ-GOEBONIOSA-N 446.389 4.376 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3nc(Br)c4ccccn34)cc2)CC1 1464962509 QEMYKATVQBHOGR-UHFFFAOYSA-N 427.346 4.263 10 10 IICE CO/C(=C\c1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324413 DSDOAJCNWSARSH-NCJDQSJGSA-N 439.556 4.122 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc(Br)cc(Cl)c1O 1472555923 AGBXOOQZABFPSB-UHFFFAOYSA-N 435.499 4.206 10 10 IICE Cc1cc(CNC(=O)N2CCC(C(=O)NC3CCCCC3)CC2)c(C)n1-c1ccccc1 1479100041 RTWIBBUKBJYTRF-UHFFFAOYSA-N 436.600 4.465 10 10 IICE CN(C[C@H]1CCCOC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1503546054 KOTUSFSOGYDSDS-HXUWFJFHSA-N 443.661 4.040 10 10 IICE CSCCCCCNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1517819228 XZYAWHRURIMSLB-SSZFMOIBSA-N 426.604 4.067 10 10 IICE COC1CCC(CCn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CC1 1518557535 VQBGHEYEIOLGPP-VEDCXYSMSA-N 428.577 4.109 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)nc(C(C)C)n1 1518850719 UMBPBRNNPMOTIW-WJDWOHSUSA-N 444.557 4.278 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(-c4cccc(Cl)c4F)no3)C2)cc1 1526246557 OGUCGONUNRFRPJ-AWEZNQCLSA-N 429.879 4.399 10 10 IICE Cc1cc(CNC(=O)c2cccc(CN3C(=O)CSC3=O)c2)c(C)n1-c1ccccc1 1531612779 VZAFGPXNBNJSFV-UHFFFAOYSA-N 433.533 4.220 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1c(F)cc(F)cc1F 1539716392 AUIZQCROKSFFLF-VIZOYTHASA-N 440.443 4.473 10 10 IICE CO[C@@]1(C)CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1554692703 ZHHUQNWPXAZVPK-URXFXBBRSA-N 445.583 4.169 10 10 IICE Cc1ccc(C(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1556248848 SXBUZNSGALRFAY-OAQYLSRUSA-N 439.556 4.344 10 10 IICE CCCN(CC(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OCC)CC(C)(C)O 1559527142 VJEKWGGWYGTEAJ-UHFFFAOYSA-N 432.586 4.322 10 10 IICE Cc1cc(C(=O)N2CCN(c3ncccc3[N+](=O)[O-])CC2)c(C)n1-c1ccc(C(C)C)cc1 1570092436 QTXLRWNEIYOXLR-UHFFFAOYSA-N 447.539 4.483 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nn(-c2cccc(F)c2F)c2c1CCC2 1597800886 RRPGJTOGCWHVHC-MRXNPFEDSA-N 438.522 4.375 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(NC(=O)OC(C)(C)C)c3)C2)cc1 1598362634 ATSLHBNVORJWSR-QGZVFWFLSA-N 425.529 4.299 10 10 IICE Cc1nnc(N(C)Cc2ccccc2N2CCCC2)n1CCCSc1nccs1 1612538476 YLOUOCXXKGSHJV-UHFFFAOYSA-N 428.631 4.462 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)C[C@H](C)C1 1614973713 SSGIOVTXUHVNSP-OALUTQOASA-N 448.615 4.361 10 10 IICE CCN(CCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1615663194 VIOCWEJCDVUSJA-HSZRJFAPSA-N 440.636 4.097 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@@H]2C(=O)Nc3c(Br)cccc32)cc1F 1616923940 CHCRDSQRQLNMGC-HNNXBMFYSA-N 448.336 4.177 10 10 IICE CCOC(=O)COc1ccc(CCNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1620464099 GFPCIZYUXCVYQQ-UHFFFAOYSA-N 438.499 4.148 10 10 IICE Cc1cc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2F)c(C)n1-c1cccc(Cl)c1 1623837521 ZMKAPTOTHNOMJU-OAQYLSRUSA-N 425.891 4.200 10 10 IICE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@H]1C(=O)NCc1cccc(Br)c1O 1626821755 FCEYPVMSOPPCCQ-MRXNPFEDSA-N 441.366 4.197 10 10 IICE Cc1cc(C)cc(OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1629678449 AGZWSASYTMRBPS-JOCHJYFZSA-N 441.572 4.130 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(=O)n(C)cc1Br 1632696996 CBLUGOFZQFTTIE-HNNXBMFYSA-N 441.325 4.257 10 10 IICE COc1cccc(N(CC(=O)NCCCSc2nccs2)C(=O)OC(C)(C)C)c1 1632806926 HBPOFIFGCNMYCY-UHFFFAOYSA-N 437.587 4.192 10 10 IICE CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1636269805 NPBCSDZHEJLJNR-QGZVFWFLSA-N 438.549 4.191 10 10 IICE O=C(NCC1(n2cc(Br)cn2)CC1)N(Cc1ccccc1O)C1CCCCC1 1638229390 XSBZZYQAISJSBD-UHFFFAOYSA-N 447.377 4.385 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(F)c(F)c1O 1638618574 NTCBDJAPFZUBLN-NTEUORMPSA-N 438.452 4.040 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2C[C@@H](C)O)sc(C)c1-c1ccccc1 1645480022 LAOBPBUJLPOTPP-APWZRJJASA-N 444.597 4.464 10 10 IICE COc1ccc(CN(CCCO)C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1653433514 LDHMOFOZWYVDNL-UHFFFAOYSA-N 434.536 4.248 10 10 IICE C[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)[C@@H]1CCCNC(=O)OC(C)(C)C 1659471195 POVOPQWQUQHAFG-NFBKMPQASA-N 431.621 4.429 10 10 IICE CN(Cc1cccc(OC(F)(F)F)c1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1676653415 NVXGVQBDYQSZRW-FQEVSTJZSA-N 438.494 4.096 10 10 IICE CC[C@@]1(C(=O)OC(C)(C)C)CCCN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)C1 1682188067 FMKDOEVXOVTDJY-KBMIEXCESA-N 445.604 4.065 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCCC[C@H]3c3ccc(F)cc3F)cc2)CC1 1684874780 VJQXLLRVAXHOFY-QHCPKHFHSA-N 428.527 4.153 10 10 IICE CC[C@@]1(C)CCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1694431960 JIFAMHHXZLEAJR-DVECYGJZSA-N 429.609 4.051 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1ccnc(OCC(F)(F)F)c1 1711096029 GRWRNFFPKPXUPA-UHFFFAOYSA-N 449.477 4.302 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1727046111 RBUBLKGJIUZHOQ-MHECFPHRSA-N 447.599 4.054 10 10 IICE CN(Cc1ccco1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1729425687 HVHJEEYAQAZVRH-UHFFFAOYSA-N 441.551 4.120 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCN(C2CCC2)C[C@H](C)C1 1742141807 PDRXDJIOLMYRCN-FQEVSTJZSA-N 438.664 4.210 10 10 IICE CCc1ccc(-c2nnc(N3CCCOCC3)n2CCCSc2nccs2)cc1 1744343987 HRNACISCWILUTR-UHFFFAOYSA-N 429.615 4.373 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)Cc2ccoc2C)cc1 1764934526 BSTGFOHFSDIKTJ-UHFFFAOYSA-N 431.544 4.167 10 10 IICE CCSc1cc(Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)ccn1 1766769689 QYJZOHQYXNWZLE-UHFFFAOYSA-N 432.553 4.237 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1 1860085814 LDZFMEVVFKGZAH-XMHGGMMESA-N 426.563 4.340 10 10 IICE Cc1ccc(C)c2c(=O)cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)[nH]c12 1866491477 KVXLCHCJEUKAQC-HSZRJFAPSA-N 446.595 4.168 10 10 IICE CCCc1nc(N2CCN(c3ccc(OC)cc3)CC2)cc(N2CCc3ccccc3C2)n1 1867975756 KUTMQANNPHETQO-UHFFFAOYSA-N 443.595 4.327 10 10 IICE O=C(O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)c(O)c(O)c1 1951649170 HTYGLWQGKIIURA-FQEVSTJZSA-N 449.459 4.248 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC(CN=[N+]=[N-])CC1 2010403660 HVJWTQQXPIIADW-IBGZPJMESA-N 431.537 4.036 10 10 IICE O=C(N[C@@H]1CC12CC(NCc1cc(Br)ccc1O)C2)OCc1ccccc1 2026163754 MZGQYVSZJLOJRB-MOMVYJMYSA-N 431.330 4.092 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C3(C)CC3)c(CN)c2I)c(O)c1 2079025232 KUBSSXCDBRCZGF-MRXNPFEDSA-N 439.341 4.257 10 10 IICE COc1ccc([C@H](n2nc(C(C)(C)C)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2080039201 UXKPRGOHOOXQKE-INIZCTEOSA-N 438.366 4.392 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CNCc2cc(Br)cc(F)c2O)CC1 2101514215 QOMPXOSPVPNRTJ-JNSHFYNHSA-N 431.346 4.467 10 10 IICE CN1CCc2cc([C@H](O)C3(COCc4ccccc4)CN(C(=O)OC(C)(C)C)C3)ccc21 2256697812 BSHAQRHPRIKKTP-QHCPKHFHSA-N 438.568 4.166 10 10 IICE CC(=O)Nc1c(C)cccc1C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 11034233 FYTUUKBCDXVWIV-UHFFFAOYSA-N 448.475 4.129 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3cc([N+](=O)[O-])ccc3=O)c2C)ccc1Br 22714864 NNJFOJPINVRULT-UHFFFAOYSA-N 444.285 4.118 10 10 IICE CC(C)CN1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33490825 HCYUTKNMVUCFOR-ATVHPVEESA-N 442.610 4.296 10 10 IICE CN(C)c1ccc([N+](=O)[O-])cc1/C=C1\C(=O)N(c2cccc3ccccc23)C(=O)N=C1O 59860161 HHVRVFUULBJONA-AQTBWJFISA-N 430.420 4.321 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3cc(Cl)c(OC)c(OC)c3)CC2)cc1 108430839 JNPJLGPBAIYHAU-BJMVGYQFSA-N 430.932 4.118 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 251369215 QLJBGIYWAKSRKB-XYHOUYMGSA-N 427.526 4.498 10 10 IICE O=C(CCC(=O)c1ccc2c(c1)CCCC2)NCc1ccc(N2CCC(CO)CC2)cc1 302930230 GFJQDQSGVPNIFZ-UHFFFAOYSA-N 434.580 4.053 10 10 IICE CCCCC[C@@H](N)c1cc(I)cc(I)c1O 396909124 HWPWKXXWDDHLTM-LLVKDONJSA-N 445.082 4.182 10 10 IICE CC(C)NC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 586620702 KZCVZTLVQNBQKZ-UHFFFAOYSA-N 427.460 4.244 10 10 IICE COc1ccc2c(c1)OCC[C@@H]2NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 683445419 IIKPGCGRZQGAMF-QFIPXVFZSA-N 433.552 4.056 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2CNCc1cc(Br)cc(F)c1O 715735926 DYVWEUPFPAQRRE-AWEZNQCLSA-N 443.357 4.421 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)c1ccc(Br)cc1 743809240 QAFMSNMIBIMMAO-UHFFFAOYSA-N 441.119 4.149 10 10 IICE Fc1ccc([C@@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c2cnccn2)cc1 753698264 KEQIVFOZVCPNHX-AREMUKBSSA-N 431.559 4.027 10 10 IICE Clc1ccc(-n2cc(CNCc3ccc(N4CCSCC4)cc3)nn2)c(Cl)c1 756001634 ACOQVNWHODFTDR-UHFFFAOYSA-N 434.396 4.417 10 10 IICE C[C@H](NC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(N2CCOCC2)cc1 776014900 SDDDFVYKIWDZCU-DJJJIMSYSA-N 443.416 4.465 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1c(Cl)cccc1OC 791245950 HMNCLWXYKMDGJT-UHFFFAOYSA-N 432.948 4.280 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1 806437061 VRHREXCNZYHGJF-UHFFFAOYSA-N 444.329 4.166 10 10 IICE CCc1ccc(C(=O)CCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 918140385 MJRIYSJYPZLKCX-QZTJIDSGSA-N 426.532 4.281 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CSCc3coc(-c4ccccc4)n3)C2)cc1 1129991524 QMMXMEZLQXXESL-GOSISDBHSA-N 437.565 4.226 10 10 IICE COc1ccc(C)cc1N1C[C@@H](C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1131781592 FTIJVESUQJKHGV-QFIPXVFZSA-N 445.563 4.123 10 10 IICE CC(C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)cc1 1155450979 KLWZGMRHCKBTQT-UHFFFAOYSA-N 434.514 4.059 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(NC(=O)C2CC2)s1 1156286484 CITUBUIEQCOQIJ-UHFFFAOYSA-N 443.569 4.099 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1nnc2ccc(C(F)(F)F)cn12 1162032625 UKWWCUIIOUQXAM-UHFFFAOYSA-N 441.369 4.499 10 10 IICE CC(=O)c1ccc(Br)c(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 1208484759 MCWALZKRYVJTPZ-AWEZNQCLSA-N 446.345 4.371 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2C[C@H](NC(=O)OC(C)(C)C)C[C@H]1C2 1230200359 IWMHYGOTLLJPAS-RJOZEALSSA-N 444.620 4.079 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCC(=O)N1CCCCCC1 1298363961 PPRPSKPHNLPVGV-UHFFFAOYSA-N 425.577 4.070 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCCN(CC(C)C)C1 1306078456 VIFSBUJUBCYEFZ-QHCPKHFHSA-N 438.664 4.445 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C[C@@H]2CCCO2)c(C)n1-c1ccc(C(C)C)cc1 1307277333 ZOVOTOOKYLLURT-FQEVSTJZSA-N 439.585 4.358 10 10 IICE CCOCc1nnc(N(C)Cc2cc(C)cs2)n1Cc1ccc2c(c1)CCCN2C 1314300812 KIBGFZUKMBXQKS-UHFFFAOYSA-N 425.602 4.252 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCc3nc(-c4ccc(C(C)C)cc4)no3)C2)cc1 1437577036 LADRUEHLXIYHNM-FQEVSTJZSA-N 434.540 4.196 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(C(F)(F)F)c(O)c2)c1 1443641486 OAUNZQJQVMIIJX-UHFFFAOYSA-N 443.425 4.155 10 10 IICE COc1ccc(N2CCN(CCNc3cnc4cc(Cl)c(Cl)cc4n3)CC2)cc1 1458136857 LSWRMAHYEYHMKM-UHFFFAOYSA-N 432.355 4.179 10 10 IICE CCOCc1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCC(C)CC2)cc1 1503020239 UUWHOTCUROKVJH-UHFFFAOYSA-N 439.526 4.488 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@H]1COCCO1)C(C)C 1515380139 FJDDKDYGPCMNIB-QFIPXVFZSA-N 437.588 4.393 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 1520624143 MEEHONSRCSVHBP-UHFFFAOYSA-N 442.409 4.063 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3nc4ccccc4cc3Br)C2)cc1 1529709328 XJSPWJDONMWYCX-HNNXBMFYSA-N 440.341 4.262 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C/c3ccc4cc(OC)ccc4c3)cc2F)CC1 1530377439 TTZPCTPALRCRCO-IZZDOVSWSA-N 447.554 4.459 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1531694882 WTPHJNMGGCIRCX-KRWDZBQOSA-N 429.923 4.091 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc1 1539582263 PRIVALAUKFTDDH-MRXNPFEDSA-N 447.482 4.037 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCOCC(F)(F)C(F)F)o1 1542301316 DIPFZUUGRIOHNK-UHFFFAOYSA-N 442.413 4.106 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2csc(N3CCCCC3)n2)cc1 1542490746 XNEDQVOGNSJXBA-HXUWFJFHSA-N 428.602 4.021 10 10 IICE CCc1cc(N2CCC(NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)CC2)ncn1 1545339981 HTMYTNKZQJNZAI-UHFFFAOYSA-N 437.975 4.499 10 10 IICE O=C(CO[C@@H]1CCCc2ccccc21)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632351 IXDUUSVLQBCPNF-NFBKMPQASA-N 428.960 4.220 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 1566846580 YQVNEXNKQFAYIS-RLWLMLJZSA-N 430.548 4.383 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2Cc2cnn(C)c2)c(C)n1-c1ccccc1 1611933983 TWIOPQUCFMZCHG-UHFFFAOYSA-N 443.477 4.133 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@](C)(O)C2CCCCC2)n1 1612185621 LWTKDJWIUSYISH-VWLOTQADSA-N 435.572 4.322 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(-c2ccccc2C)c1 1618427123 BZVRFFMBQJJVOQ-UHFFFAOYSA-N 434.540 4.183 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ccn(-c3ccc(F)cc3)n2)cc1 1618727600 KDQDFWCTGXQPNC-UHFFFAOYSA-N 444.510 4.133 10 10 IICE Cc1ccc(CN2C[C@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1624069142 DCDQCCHIEXTWNW-XMMPIXPASA-N 429.564 4.376 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccccc3OCCN3CCOCC3)c2C)c1 1626895922 RBYWKJIDSZQAMA-UHFFFAOYSA-N 447.579 4.044 10 10 IICE Nc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccnc1-c1ccccc1 1629055412 JBFSNGZOIYPLDP-QGZVFWFLSA-N 438.478 4.331 10 10 IICE C[C@@H](NC(=O)CSc1nnc(-c2ccco2)n1Cc1ccccc1)c1ccccc1O 1632246416 HTRHFILYFALRSN-MRXNPFEDSA-N 434.521 4.262 10 10 IICE CCOc1ccc(OC(C)(C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1635941276 OUXXUNKZRFKNBY-LJQANCHMSA-N 446.975 4.383 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC3(CCN(Cc4ccccc4)C3)CC2)c([N+](=O)[O-])c1 1642530613 FGRHPDRUTSNICJ-NTMALXAHSA-N 435.524 4.274 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4ccc(F)cc4F)CC3)c2C)cc1 1642725908 TUKWKQZZDJCPKW-UHFFFAOYSA-N 425.479 4.343 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)C3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]34)c2C)cc1 1648124385 SMAPZYOQIWHZLB-SFTDATJTSA-N 439.556 4.040 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(C(C)(C)C)CCN(Cc2ccc(N3CCOCC3)cc2)C1 1648128661 OYQMAIGUOZMWDC-VWLOTQADSA-N 431.621 4.286 10 10 IICE CCOC(=O)[C@@H]1[C@H]2CC[C@H](C2)N1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1648292289 MPUHBFWIECPNAU-YRNRMSPPSA-N 445.357 4.413 10 10 IICE CCOC(=O)c1c(C)nc(O)nc1SCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1652185513 UXACRQHLZAFPCR-UHFFFAOYSA-N 443.500 4.189 10 10 IICE CCCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccccc1O 1654290539 VTRPONVPEDBGAA-UHFFFAOYSA-N 442.515 4.408 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)NCc2cc(Cl)ccc2O)CC1 1673340257 LFVGHLYGBWNWFO-SHTZXODSSA-N 425.957 4.176 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@H]3CO)cc2Cl)C1 1680561275 AVBUQVAYUFZFOW-UZUQRXQVSA-N 427.976 4.378 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1746093756 OBEMYQSEBBZBOJ-FQEVSTJZSA-N 448.615 4.162 10 10 IICE CCOCC(C)(C)Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1746999765 KUTRTWJMMGFAAM-NRFANRHFSA-N 441.620 4.081 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1762876620 ZUXJDNGTXIYLQG-DENIHFKCSA-N 441.620 4.372 10 10 IICE CCCN1CCC(N(C)c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1764438652 XZJBTVIMLSMEOH-UHFFFAOYSA-N 442.627 4.500 10 10 IICE CCc1cnc(CCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1764564338 HICUQWGETILAOS-IBGZPJMESA-N 427.574 4.123 10 10 IICE CN1C(=O)CCc2cc(-c3csc(NS(=O)(=O)c4ccc(Cl)cc4)n3)ccc21 1859572070 HZAUNKUKGZTGOI-UHFFFAOYSA-N 433.942 4.173 10 10 IICE COc1ccc(N2CCN(C(=O)CCn3ccc4ccc(Br)cc43)CC2)cc1 1860229710 KQEZMIIJFLAUNC-UHFFFAOYSA-N 442.357 4.151 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C3CC3)c(CO)c2I)c(O)c1 2078999563 RIEQMQVYQRPAFL-QGZVFWFLSA-N 426.298 4.117 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(F)F)c(C(=O)O)c1I 2079049071 GZRCWVZSZYEVOZ-VIFPVBQESA-N 436.196 4.137 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C2(C)CC2)c(I)c1CN 2079955318 ZAGOJDKOZJFDAA-QGZVFWFLSA-N 439.341 4.221 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](NCc2cc(Cl)cc(Br)c2O)C1 2219130355 QULYZCLDFMSRKE-CHWSQXEVSA-N 437.737 4.245 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@H]2CNCc1cc(Cl)cc(Br)c1O 2311871301 JWCRJHKMXDQYQT-WHOFXGATSA-N 431.758 4.153 10 10 IICE CCCOc1ccc(C=C2SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)cc1 2314926693 PMUBCFLEPGREOY-SFHVURJKSA-N 427.547 4.373 10 10 IICE Cc1ccc(CNC[C@H]2CC3(CC3)CN2C(=O)OC(C)(C)C)c(O)c1Br 2352944646 KNXLQWIJSYTCCG-OAHLLOKOSA-N 425.367 4.342 10 10 IICE Cc1ccc(CNC(=O)c2coc(CNC(=O)OC(C)(C)C)c2)c(O)c1Br 2381142230 JRZAGKWPNVMRAF-UHFFFAOYSA-N 439.306 4.011 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)c(C(=O)O)c1OC 16906169 QRHNSJDVCNNTOT-NTEUORMPSA-N 435.910 4.461 10 10 IICE O=C(COc1ccc(/C=C2\SC(=S)N(c3ccccc3)C2=O)cc1)N1CCCCC1 39793779 YKIYYICREYTOIP-HKWRFOASSA-N 438.574 4.484 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccc(Br)o2)SC1=S)OC1CCCCC1 40888949 NJXHFMYHCSBZJF-WQLSENKSSA-N 430.345 4.119 10 10 IICE CC(/C=C1\SC(=S)N([C@H]2CC(=O)N(c3cccc(C)c3)C2=O)C1=O)=C\c1ccccc1 101154659 VQIDPVVZENGYDS-UASNBJHASA-N 448.569 4.475 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 210098017 SOBREBGSORRNOP-WJDWOHSUSA-N 432.479 4.009 10 10 IICE COc1ccc(/C=C2\SC(=S)N(c3cccc(C)c3C)C2=O)c(C(=O)O)c1OC 210400553 QCJKVSBFKNDGQG-YBEGLDIGSA-N 429.519 4.425 10 10 IICE CC[C@@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCCO1)c1cc(Br)ccc1O 390650084 VERGSUJZWHIQFJ-NVXWUHKLSA-N 443.382 4.221 10 10 IICE Cc1cc(C)n(-c2ccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)cn2)n1 435616169 ROTMVZUTMPGPIC-UHFFFAOYSA-N 442.567 4.244 10 10 IICE Cc1cc(C(=O)CN2CCC(c3nnc4n3CCC4)CC2)c(C)n1-c1ccc2c(c1)CCC2 728915755 WNNCEVPMIBZJBG-UHFFFAOYSA-N 443.595 4.183 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1 741923434 SOOJRARZYNFYSJ-UHFFFAOYSA-N 447.501 4.196 10 10 IICE COc1cc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc(NC(C)=O)c1OC 742499069 MZORXRJIMSYNBZ-UHFFFAOYSA-N 435.524 4.042 10 10 IICE COc1ccc(Cn2nc(C)c(CNC3CCN(c4ccc(OC)cc4)CC3)c2C)cc1 766426905 MHBVGDAKEHOFOX-UHFFFAOYSA-N 434.584 4.324 10 10 IICE O=C(NCc1cc(Br)ccc1O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 805004190 LCXAPWNKRJDPDC-CYBMUJFWSA-N 438.753 4.134 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3cccnc3C(F)(F)F)n2)c1 808526853 XJPGGLGVUZAEEN-UHFFFAOYSA-N 445.444 4.042 10 10 IICE COc1ccc(-c2noc(-c3cc(C)n(-c4ccc(Br)cn4)c3C)n2)cn1 904533046 XKDUCSFLJGTKDR-UHFFFAOYSA-N 426.274 4.372 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(c4ccc(F)cc4F)C3)c2C)cc1 1144530379 UVWGZPAKZPGWCW-SFHVURJKSA-N 425.479 4.390 10 10 IICE Cc1cccc(C(=O)Nc2ccccc2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1148701366 VDHCJXGQYHQMBO-UHFFFAOYSA-N 443.547 4.138 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)CCCC1 1149934342 FVTFDMIRTLWDAS-RUZDIDTESA-N 436.552 4.166 10 10 IICE Cc1cc(C(=O)N2CCC(Cn3cnnc3)CC2)c(C)n1-c1ccccc1Br 1165427375 RJNAJMVGYPFYBA-UHFFFAOYSA-N 442.361 4.001 10 10 IICE CCCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1270432842 RPNGWPIUAVYWAO-JXFKEZNVSA-N 438.037 4.284 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc2ccccc2c1O 1295589953 AZTZJLIOCHBQLA-UHFFFAOYSA-N 427.884 4.039 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C(C)C 1313758301 HETNFPXFUSYALI-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CC1(C)CCC(CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 1357222320 YQTBWJLIGUTXEW-UHFFFAOYSA-N 439.579 4.165 10 10 IICE COc1ccc(N2CCC(NC(=O)c3nc(Br)sc3C3CC3)CC2)cc1 1359815985 BKWLDHLKEFPSCC-UHFFFAOYSA-N 436.375 4.190 10 10 IICE Cc1cc(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1360135915 ARPHITNXTCABHP-UHFFFAOYSA-N 425.573 4.400 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3sc(N4CCCC4)nc3s2)N(C)C)cc1 1439960212 KWFCGUJTGGLGHR-QGZVFWFLSA-N 443.642 4.057 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccc(Cl)cc2)c(C)n1-c1ccc(Br)cn1 1450369510 XZYLJOCMPHMPHP-SFHVURJKSA-N 448.748 4.368 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCc4c(Cl)cc(Cl)cc4[C@@H]3C)nc12 1459644530 CDGYGCNQKCMLQK-NSHDSACASA-N 435.311 4.038 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)cc1F 1465005896 KZNPZZXWNYSSOG-UHFFFAOYSA-N 427.501 4.454 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1cc(Cl)cc(Cl)c1 1465532370 AVNIUEBGUWFDDC-CRAIPNDOSA-N 445.293 4.413 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1 1465849136 PMFPWIPDRAJBQV-KRWDZBQOSA-N 446.263 4.126 10 10 IICE Cc1cc(C(=O)Nc2ccc(N3CCCC3)cn2)c(C)n1-c1ccc(Br)cn1 1466252941 FZIGAFGXLXWGBP-UHFFFAOYSA-N 440.345 4.499 10 10 IICE COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1470594468 TZDWBZQXBCROTQ-VGOFRKELSA-N 431.964 4.204 10 10 IICE Cc1nc(Cc2nnc(N3CCC[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1511541270 CODFKKSKLKSFMI-HNNXBMFYSA-N 428.581 4.124 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@]3(C(=O)O)CCCN(Cc4ccccc4)C3)c2C)c1 1517274469 CXVVRJHTYBGAMZ-MHZLTWQESA-N 445.563 4.252 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCc3ccc4c(c3)OC(F)(F)O4)ccc21 1527162149 CFRBRXHJLSZJRV-UHFFFAOYSA-N 430.451 4.199 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)COc2c(F)cccc2F)C1 1531687401 FOWZCEDLGAICKX-KRWDZBQOSA-N 441.522 4.270 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C[C@@H](C(F)(F)F)O1 1544622743 AGGGAWOUJYQOKB-STQMWFEESA-N 449.568 4.371 10 10 IICE CCCN(C)c1nnc([C@@H]2COc3ccccc3O2)n1CCCSc1nccs1 1547091523 RQYGNVLBUCBLAZ-KRWDZBQOSA-N 431.587 4.276 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCCO)C1 1555772300 MXQLHMLYKRVALR-JOCHJYFZSA-N 437.588 4.130 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCc3c(C)nn(Cc4ccc(C)cc4)c3C)C2)cc1 1557449647 JMVNVCIJBIHQGR-QHCPKHFHSA-N 446.595 4.193 10 10 IICE O=C(NCc1cccc(Cl)c1O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1 1558756873 FUFDGWUREBDEQN-UHFFFAOYSA-N 440.849 4.233 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(C3CC3)[C@H](C)c3ccccc3Cl)CC2)cc1 1559525389 LUDJCQSEZJQAGB-DENIHFKCSA-N 444.019 4.057 10 10 IICE Cc1nc(N2CCN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2)sc1C 1565162107 LXZXHMDEOQMBQK-UHFFFAOYSA-N 437.613 4.242 10 10 IICE COc1cccc([C@@H]2CN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CCO2)c1 1566291467 MOBZAFJGGZZCJG-VWLOTQADSA-N 432.520 4.058 10 10 IICE O=C(CNc1cccc(C(F)(F)F)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1566356988 UEPUDPXQRZBURD-SFHVURJKSA-N 441.881 4.257 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(-c4cccs4)s3)cc2)CC1 1616598126 HAZALAMPBCGJKJ-UHFFFAOYSA-N 425.579 4.108 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)C(C)(C)C1 1622309351 ITEDSTFNCLRRAJ-IBGZPJMESA-N 428.529 4.407 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc2c(c1)CCO2 1625811086 LQYFIMSBQMKDOD-JOCHJYFZSA-N 438.911 4.327 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1626106944 TTXCVRZUNGAGRS-QHCPKHFHSA-N 436.531 4.207 10 10 IICE CC(C)(C)OC(=O)NCc1ccccc1CNC(=O)c1cc2cc(O)c(O)cc2s1 1626308026 AKDCFEUWUBPUTB-UHFFFAOYSA-N 428.510 4.267 10 10 IICE CN1CCCc2cc(CNC(=O)C3C[C@@H]4CCC[C@H](C3)C4NC(=O)OC(C)(C)C)ccc21 1626940397 HTYUTPKHAQRDME-CVFDLSLPSA-N 441.616 4.405 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccc(F)cc2n1 1630257207 QWFOUFJYEVYCOT-SFHVURJKSA-N 427.907 4.436 10 10 IICE COc1ccccc1-c1nnc(CC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)o1 1631386215 NAOLIXWEQUWUHO-UHFFFAOYSA-N 434.540 4.373 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc3ccccc3cc2NS(C)(=O)=O)cc1F 1633259707 WUUUDDRWKRVSAI-UHFFFAOYSA-N 443.544 4.127 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc(-c2ccccc2F)nc1C 1638529736 UHBCCZRBAAWSDA-UHFFFAOYSA-N 428.485 4.169 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)C2)cc1 1639332179 NPPZSFMDJIDPHU-JOCHJYFZSA-N 433.508 4.034 10 10 IICE C[C@H]1C[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1cc2cc(O)c(O)cc2s1 1639532751 ULFCAOFSEGIUPM-VNHYZAJKSA-N 434.558 4.324 10 10 IICE CCOC(=O)c1sc([C@@H]2CCN(Cc3ccc(N4CCC(OC)CC4)cc3)C2)nc1C 1644349379 WTVIIJMEZTUSJG-LJQANCHMSA-N 443.613 4.233 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1nnn(-c2ccccc2F)c1C(F)(F)F 1647791298 NIRKQNMPCRAIMJ-UHFFFAOYSA-N 430.361 4.214 10 10 IICE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(C(=O)c1ccc(N=NC(N)=O)cc1)CC2 1653639873 IMWIIOKYPNTGPG-SFHVURJKSA-N 443.548 4.347 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)c1O 1654233373 NGTAVNULIWYUHY-FQEVSTJZSA-N 438.749 4.020 10 10 IICE COC(=O)c1c(NC(=O)CN2CCCc3cc(OC(F)F)ccc32)sc2c1CCC2 1657590444 XSGZDLPGKKIVAV-UHFFFAOYSA-N 436.480 4.016 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1c(F)cccc1F 1658743897 ZMQMKFCZDDKUKY-CQSZACIVSA-N 434.442 4.199 10 10 IICE COc1ccc(N2CCCN(C(=O)NCC3(c4ccc(F)cc4Cl)CC3)CC2)cc1 1681056465 VAWCDSMTLJQBBY-UHFFFAOYSA-N 431.939 4.441 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(Cc1cccc(F)c1)C1CCCC1 1684141280 HAERHFBXGMRIRQ-UHFFFAOYSA-N 425.548 4.441 10 10 IICE Cc1ccsc1Cn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1692936356 MBFRVHPQSROHMM-UHFFFAOYSA-N 425.602 4.293 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H](C)C2)n1CCCSc1nccs1 1727210570 HRLBPZVWOLSWSD-OAHLLOKOSA-N 436.651 4.072 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1744807407 KEEGFXRQDNKCIG-NWZJSZKRSA-N 441.620 4.050 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1761024686 PQLQEDUFZWATER-OAQYLSRUSA-N 443.611 4.373 10 10 IICE O=C(Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)NC1CCCCCC1 1873870644 XRLUFQMQZAWSOZ-UHFFFAOYSA-N 440.547 4.413 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)[C@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1999535871 BUNXCSNFVSAASL-GOTSBHOMSA-N 426.605 4.038 10 10 IICE COc1ccc([C@H](n2nc(C(F)F)c(N)c2I)C2(C)CC2)c(O)c1 2079881841 YCTZRPHATBHSCR-ZDUSSCGKSA-N 449.239 4.111 10 10 IICE CCN[C@@H](c1ccc(I)c(Br)c1)c1ccccc1O 2090045806 RJLMODMUMLUWRK-HNNXBMFYSA-N 432.099 4.458 10 10 IICE COc1ccc(Br)c(CN[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c1O 2227750640 ZGLHGNIJYRVHDC-IBGZPJMESA-N 429.355 4.043 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](C2CC(NCc3cccc(Br)c3O)C2)C1 2265436237 JULUUZMPCFIOAU-QQFBHYJXSA-N 425.367 4.280 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)c(OC)c1OC 2294728337 VMHJTTZDAWNODE-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472266 QLJBGIYWAKSRKB-JNEVIBOXSA-N 427.526 4.498 10 10 IICE COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C/c1cccc(Br)c1 33332400 ZWXRHCOCPAZQET-XMHGGMMESA-N 426.310 4.364 10 10 IICE CCCN(CCC)c1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(CC(C)C)C1=O 33507568 OWLHJLWXVOEZNE-GHRIWEEISA-N 444.626 4.178 10 10 IICE COc1ccc(-n2c(C)cc(/C=C3\C(=N)N4C(SC)=NSC4=NC3=O)c2C)cc1 104372233 ZNXFNFMCYBUQMF-YGHDLIBZSA-N 425.539 4.042 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)Nc1ccc2c(c1)CCCO2 726080904 SMNGSGXCOUEEFR-UHFFFAOYSA-N 435.446 4.189 10 10 IICE O=C(NCc1ccccc1O)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 752397994 HVAMATMFKZDLMX-UHFFFAOYSA-N 448.866 4.036 10 10 IICE O=C1C[C@H](N2CCO[C@H](c3ccco3)C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 753976819 AYINAQMLBQXWMX-UNMCSNQZSA-N 430.464 4.400 10 10 IICE Cc1ccncc1/C=C\C(=O)N(C)c1ccc(CNC(=O)/C=C/c2cnccc2C)cc1 765477925 IAMVHHNGOLYUMK-QZTBCQRESA-N 426.520 4.099 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc([C@@H]2CCCOC2)cc1 780656028 DPVXTQFCOWDVGI-KNQAVFIVSA-N 428.960 4.334 10 10 IICE C[C@H](NC(=O)N1CCC[C@@]2(CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 805311154 YKQHCSKSJLDCES-MHECFPHRSA-N 430.593 4.246 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc(C(C)=O)cc3)C2=O)cc2c1OCCO2 814292014 JFQMKJWQODVIIP-WOJGMQOQSA-N 427.503 4.075 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1SCc1cscn1 917709283 SEQWEAZICDKJDP-UHFFFAOYSA-N 443.569 4.341 10 10 IICE Cc1cc(CC(=O)N2CCSC[C@H]2c2cnn(C)c2)c(C)n1-c1ccc(Cl)cc1 1128751507 YPZAFVQAENBKQR-NRFANRHFSA-N 428.989 4.340 10 10 IICE CN1CCCc2cc(CNC(=O)c3c(F)c(F)c(Br)c(F)c3F)ccc21 1136436765 JCFSKKRSIBOQQZ-UHFFFAOYSA-N 431.227 4.318 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1 1136514426 GIWYJWHNOMIOBD-UHFFFAOYSA-N 429.520 4.073 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(Oc2ccccn2)c1 1137817846 LBSQEVGTAKVDCH-UHFFFAOYSA-N 426.856 4.048 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](CO)Cc1ccccc1Br 1138222682 GFXPXHFJCHQAKN-MRXNPFEDSA-N 447.398 4.499 10 10 IICE COc1ccc(CN2CC[C@H]2C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1139138613 KODKOLMCIZJOPF-UUOWRZLLSA-N 442.003 4.476 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)s1 1140172735 ZKPCSNNGOPIZNO-JKSUJKDBSA-N 439.585 4.210 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc(CN3CCOC3=O)c2)cc1 1141752154 ANLUXPSQJMEOGN-UHFFFAOYSA-N 431.492 4.040 10 10 IICE CC(C)(C)OC(=O)N1CCC(C(=O)NCc2cc(Cl)ccc2O)(C(F)(F)F)CC1 1146232462 LPANHNSDUOLMRN-UHFFFAOYSA-N 436.858 4.241 10 10 IICE COc1cc(F)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(F)c1 1147503592 BFQYYZOMJOPSCR-LJQANCHMSA-N 449.498 4.035 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)cc1 1147953972 ZOOFKKAVJDHYHJ-HSZRJFAPSA-N 444.453 4.015 10 10 IICE COC(=O)[C@@H]1CCCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1153971490 OTQMGNQCJAOCKU-IBGZPJMESA-N 433.346 4.414 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CC[C@H](C(=O)OC(C)(C)C)c3ccccc32)C1 1168421839 QIOIQAMSLRTKEQ-HKUYNNGSSA-N 442.556 4.462 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccc(Br)cc3)C2)cc1 1230301205 UHPORSOFNXMVEB-KRWDZBQOSA-N 432.362 4.126 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3ccc(Br)cc3F)C2)cc1 1252921807 BZLMJLWEBHRKNM-MRXNPFEDSA-N 436.325 4.017 10 10 IICE C[C@@H]1Oc2ccccc2[C@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1274765374 MQMPXBDBOFXMGM-UNMJUTSKSA-N 442.537 4.055 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C\C(=O)NCc2ccc(N3CCSCC3)cc2)o1 1291629860 WPOJJDGWQBRDJC-LUAWRHEFSA-N 428.554 4.118 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3c(F)cccc3F)cc2F)C[C@@H](C)O1 1291756313 OMLJJGMHWBWGDN-OKILXGFUSA-N 444.457 4.038 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Br)cc1 1301349001 DXTLCJYAZNOPED-OAQYLSRUSA-N 431.374 4.220 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3cccc(OC(F)(F)F)c3)C2)cc1 1312901441 GGNAOJVCHGNJEB-QGZVFWFLSA-N 437.462 4.262 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(F)(F)c1cc(F)cc(F)c1 1361063601 QLJWGSPCKFZPMT-OAHLLOKOSA-N 432.364 4.443 10 10 IICE CCSc1nc(C)c([C@H](CC)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 1441796208 XGNBMBGBXNNZGY-INIZCTEOSA-N 437.606 4.349 10 10 IICE Cc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)on2)cc1 1445879549 FBAQUPHUERFAOB-LJQANCHMSA-N 425.916 4.403 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)C4CCC4)cc3)cc2)CC1 1464963430 WICNGCXELIWSJO-UHFFFAOYSA-N 426.582 4.179 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)O[C@@]3(CCOC3)C2)c(C)n1-c1ccc(Br)cc1 1467423994 PDQYDIKOANNHQD-QFIPXVFZSA-N 447.373 4.267 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCC3(c4c(F)cccc4F)CCC3)C2)cc1 1470526111 VBJNQNORJRJZCC-QGZVFWFLSA-N 429.511 4.221 10 10 IICE Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1479030277 GCNDAZZDPLFSQT-KRWDZBQOSA-N 430.618 4.439 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4cccnc4)n3CCCC(C)C)CC2)cc1 1518309464 OVJMIKSFNVRZDF-UHFFFAOYSA-N 448.615 4.425 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(CC(F)(F)F)CC3(C)C)ccc21 1520221789 WRNRKCFSOKTXRZ-UHFFFAOYSA-N 425.495 4.003 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)n1-c1ccccc1 1528956306 SHNROWQFCBHBBW-AREMUKBSSA-N 431.580 4.044 10 10 IICE CO[C@H](C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)c1ccc(Br)s1 1529277050 CXQVVXJQLORFJY-ACJLOTCBSA-N 425.392 4.320 10 10 IICE O=C(NCc1ccccc1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1 1545682039 OFZYLDUXXOWGIC-UHFFFAOYSA-N 426.398 4.317 10 10 IICE COC(=O)[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccc(Cl)c(F)c1 1545874907 GLXRLTWEUOLGJB-OAQYLSRUSA-N 442.874 4.343 10 10 IICE Cc1cc(C(=O)N2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)c(C)n1-c1ccccn1 1557477681 OCJJHUNYMQUZLU-UHFFFAOYSA-N 428.414 4.146 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCc4c(Br)cc(C)cc4C3)C2)cc1 1565055618 HAGYEILTJOZSQY-QGZVFWFLSA-N 444.373 4.113 10 10 IICE CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1584007622 FYHSZLHQHZMZCN-PGRDOPGGSA-N 437.584 4.372 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C3)ccc21 1584862112 ICJKEGXIMYNWAV-OXQOHEQNSA-N 428.573 4.344 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2nn(-c3ccc(Cl)cc3F)c3c2CCC3)c1 1595806518 NMUUUPVGOZJRPK-GFCCVEGCSA-N 429.879 4.359 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCC1CCN(C(=O)C(F)(F)F)CC1 1612089843 AMIBSKDHHWVSAC-UHFFFAOYSA-N 435.402 4.039 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@H]3OCCC[C@@H]3C2)cc1F 1617666922 GHPFLNGDJHXFKK-WIYYLYMNSA-N 429.584 4.125 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@@](C)(O)CCC(C)C)CC2)cc1F 1619302237 LNYNQHIRAUFIPR-DEOSSOPVSA-N 447.599 4.063 10 10 IICE COC[C@@H]1CCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1619698207 AASQEYJSIPHBGK-IAGOWNOFSA-N 437.635 4.021 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC[C@@H]2CC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1628496497 ZFPQXVFVPATZKG-WOJBJXKFSA-N 433.593 4.030 10 10 IICE Cc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(O)nc2ccccc12 1629055699 PRNGCQOFEQBOEJ-HNNXBMFYSA-N 427.451 4.249 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc2c(C)cc(O)nc2c1 1635489132 KLGOUVROSQYZAY-UHFFFAOYSA-N 435.524 4.251 10 10 IICE Cc1cc(C(=O)N2NC(=O)CC23CCCCC3)c(C)n1-c1ccc(Br)cc1 1640234349 KFXOQTAZSDSZPW-UHFFFAOYSA-N 430.346 4.437 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc4c(c3)nc(C)n4[C@H](C)CO)ccc21 1640674707 HDMBZRGWSLTVPS-OAHLLOKOSA-N 434.540 4.368 10 10 IICE Cc1ccc(-n2cnc(=O)n2CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1Cl 1641180718 XJFREZVYKKJXGU-UHFFFAOYSA-N 438.890 4.425 10 10 IICE CC(C)Oc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NCc2ccccc2)cc1 1642710632 PMNFGSYLWJSNMU-UHFFFAOYSA-N 431.536 4.479 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H]3CC[C@@H]2CN(C)CC3)sc(C)c1-c1ccccc1 1648293006 LILIFCDVOJWLAO-RBUKOAKNSA-N 441.597 4.007 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccccc3C(=O)N3CCC[C@H](O)C3)c2C)c1 1651564659 MAUPSTXOQCPZKV-NRFANRHFSA-N 431.536 4.252 10 10 IICE CCO[C@H]1C[C@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1653657508 SYLFOHGMKIUTJO-VXKWHMMOSA-N 448.563 4.316 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O 1657431354 LCRSHRSOJOEICE-LIRRHRJNSA-N 435.337 4.478 10 10 IICE CCN(Cc1ccccc1Br)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684606482 GHCJJFFKWSOBNR-OAQYLSRUSA-N 447.421 4.350 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](CC)O[C@H](C)C1 1696424842 TUXNCEUWRHHKGR-KNQAVFIVSA-N 437.588 4.393 10 10 IICE CC[C@@H]1CCCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)cc2C)C1 1709269750 OVKGEQPAIKQZQV-OAQYLSRUSA-N 435.620 4.189 10 10 IICE CCn1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)cn1 1710178504 BBEMKPNFSYLPKH-LJQANCHMSA-N 447.587 4.240 10 10 IICE CCN(CC)[C@@H](Cn1c(-c2ccccn2)nnc1N(C)Cc1ccccc1O)c1ccco1 1728377664 WMBZWBPGGXGRMW-NRFANRHFSA-N 446.555 4.358 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@H](c3nccs3)C2)n1Cc1ccc(N(C)C)cc1C 1763810972 WPCDWRPJZWLPAH-OXQOHEQNSA-N 440.617 4.249 10 10 IICE CCCN1CCC(N(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1764440371 ORLLAHGKNGDUFH-UHFFFAOYSA-N 430.616 4.041 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccn2)cc1 1764939028 RBNAFTOCZRRQNO-OAQYLSRUSA-N 434.588 4.098 10 10 IICE CCC[C@@H](C)CN(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1765496076 XOWJVTFQGQQUSH-DENIHFKCSA-N 425.621 4.475 10 10 IICE CCOCc1nnc(N2C[C@H](C)C(F)(F)[C@H](C)C2)n1CCCSc1nccs1 1767985087 CETJQIWEYMKFIU-OKILXGFUSA-N 431.578 4.181 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(C)CCc3nccs3)ccc21 1769069397 SJZLOEOOHIXTIW-UHFFFAOYSA-N 438.645 4.433 10 10 IICE CCCC[C@@H](C(=O)O)N1C(=O)/C(=C\c2c(Cl)nc3scc(C)n23)SC1=S 1858592361 OXWCSOIXGRUGCA-CAXXOGMASA-N 429.976 4.202 10 10 IICE CCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCOCC2(C)C)n1 1868274270 AQFHWSRZFPDHHO-UHFFFAOYSA-N 442.519 4.173 10 10 IICE Cc1ccc(CNCC[C@@H](NC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2352941263 OTCUUNRIERZDRI-GFCCVEGCSA-N 441.288 4.398 10 10 IICE CCN1CCN(c2cc(N3CCC(C)CC3)c3c4c(onc24)-c2ccccc2C3=O)CC1 9642024 SRSLZMRWCGXPIS-UHFFFAOYSA-N 430.552 4.417 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc(Br)ccc1O)N2 14461312 AICSEQBLSFOIPN-WHSLLNHNSA-N 443.341 4.357 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccccc1 15039091 RMTZMUAKWJSAHE-LGMDPLHJSA-N 427.507 4.215 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)c(C)n1-c1ccc(Cl)cc1 110483535 OUBYBTIFLRFFFF-UHFFFAOYSA-N 439.903 4.013 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2cccc3cccnc23)C1 435646875 RNLIVANETRZNHT-UHFFFAOYSA-N 426.564 4.315 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)C1 435867588 OEEGBNGMHCLNQS-GOSISDBHSA-N 430.552 4.029 10 10 IICE COCc1nc(Cc2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)cs1 554842146 ILJHIPATULUEDG-UHFFFAOYSA-N 437.569 4.033 10 10 IICE COc1ccc(C[C@H](C)NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1OC 730131619 SRNNEWDPZIOEMW-IBGZPJMESA-N 425.573 4.467 10 10 IICE CCCN(C[C@@H]1CCCCO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905373 NOJIHGCRTWGDPI-PXNSSMCTSA-N 425.520 4.248 10 10 IICE Cc1cc(C(=O)CN2CCC(OCCCO)CC2)c(C)n1-c1cccc(C(F)(F)F)c1 756907626 TYDVXGFOYAZTKA-UHFFFAOYSA-N 438.490 4.159 10 10 IICE CCOC(=O)c1sc([C@@H](C)NC(=O)N(Cc2ccco2)Cc2ccccc2O)nc1C 757274350 VNGKPMCUQFMVQI-OAHLLOKOSA-N 443.525 4.400 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)cc1 763565622 CLYANRGQSFFIJF-RXVVDRJESA-N 432.609 4.320 10 10 IICE Cc1c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cccc1N1CCOC1=O 766767294 STVRVLLBDQJMCY-UHFFFAOYSA-N 446.551 4.312 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(c2cccnc2)CC1 768754129 PULRRRPEAOZPOW-KRWDZBQOSA-N 439.515 4.064 10 10 IICE COc1cccc([C@@H]2[C@@H](NC(=O)c3cc(C)n(-c4ccccn4)c3C)CCN2C2CC2)c1 778494445 NNWYJSDFECIQFD-UKILVPOCSA-N 430.552 4.206 10 10 IICE Cc1oc2c(CN3CC(C)(C)O[C@]4(CCOC4)C3)c(O)ccc2c(=O)c1-c1ccccc1 794695578 RWVAMYQAIRJNGB-AREMUKBSSA-N 435.520 4.244 10 10 IICE CCCN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3)c(OC)c2)C(=O)N(C)C1=O 1081105109 ZVOYWVZQZCHJRF-LDADJPATSA-N 442.899 4.142 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1 1137400086 MLAOWMLTNCQVRF-HXUWFJFHSA-N 432.442 4.283 10 10 IICE Cc1cc(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)c(C)n1-c1cccc(Br)c1 1141550897 NADWBCPZEQLNDY-OAHLLOKOSA-N 430.390 4.413 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(Br)cc(Br)c2)c1 1150543852 VSFSVEYDQWYVFZ-SECBINFHSA-N 429.108 4.417 10 10 IICE CCOc1ccc(N2CCN(Cc3cc4c(cc3Br)OCCCO4)CC2)cc1 1168331508 JCCRKNXYDNDEPM-UHFFFAOYSA-N 447.373 4.331 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@H]3c3cccc(C)c3C)CC2)cc1 1191212603 BWJHMZQXRVUYDK-SQHAQQRYSA-N 437.628 4.022 10 10 IICE COc1cc(N2CCN(Cc3cccc(CN4CCCCC4)c3)CC2)cc(OC)c1OC 1193188423 KBTZPGCRUOQTBO-UHFFFAOYSA-N 439.600 4.021 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCN([C@H](C)c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 1234554997 HBYWFSFGUHAFMX-GSHUGGBRSA-N 426.536 4.004 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4F)C3)cc2Cl)C1 1270433301 TWMOHMSSKRLZAU-FUHWJXTLSA-N 443.950 4.385 10 10 IICE CC(C)c1nnc(N2CC[C@@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1287192296 IOEPMRCCDKGGLR-UXHICEINSA-N 425.621 4.141 10 10 IICE C[C@H](CN1CCCCC1)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1288703623 XGEBCRDLTHVVKP-LJQANCHMSA-N 439.629 4.394 10 10 IICE CC(C)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 1350934037 WTVLFJRSZYXKQQ-HOTGVXAUSA-N 429.492 4.401 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 1357723391 UJQZJKJALBVWTK-YQNUULROSA-N 446.544 4.476 10 10 IICE Cc1nc(-c2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cc2)cs1 1436624070 MIXSTHHBLNCGPM-UHFFFAOYSA-N 429.492 4.163 10 10 IICE COc1ccc([C@@H](CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)N2CCOCC2)cc1 1440722633 MVCWRNMNDHVYIT-AREMUKBSSA-N 447.579 4.214 10 10 IICE CC[C@](O)(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1441783722 MXUZUGJSRBZSTL-VBURHUQHSA-N 434.939 4.007 10 10 IICE CC(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1442706319 PEMIGJUVZVYZDS-UHFFFAOYSA-N 441.329 4.487 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2C1 1444983378 DAUFXWMOKZIFDV-NVXWUHKLSA-N 445.510 4.302 10 10 IICE CCO[C@@H]1C[C@](NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)(C(=O)OC)C1(C)C 1447836881 XNSAFCJYSFGHLO-XXBNENTESA-N 432.948 4.224 10 10 IICE Cc1cc(O)nc(C(C)(C)NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 1452714155 TUTFYODKPGHBMC-UHFFFAOYSA-N 443.345 4.326 10 10 IICE Cc1ccc(O)c(CNC(=O)CCNC(=O)OCC2c3ccccc3-c3ccccc32)c1 1453648437 IVCPJJFMFUNHKM-UHFFFAOYSA-N 430.504 4.246 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C1 1470556137 MZUDIPWDBOWCHE-QRVBRYPASA-N 432.609 4.031 10 10 IICE COc1ccc(N(C)CCN(C)Cc2cc(C)c(I)cc2C)cc1 1473609681 GNZOBXFUZABZOK-UHFFFAOYSA-N 438.353 4.485 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCSC(C)C 1495110759 GODGZNYKZITVOY-LJQANCHMSA-N 431.650 4.406 10 10 IICE CCCCN(CCOC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc2c(c1)CCCN2C 1500453652 ODTMZMCKXBUNMG-QHCPKHFHSA-N 441.620 4.203 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCO[C@@H](COC(C)C)C3)nnc2C(C)(C)C)cc1 1501847362 LRSCGBDZSGAXAC-JOCHJYFZSA-N 443.636 4.100 10 10 IICE CC(C)CC[C@@](C)(O)Cn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1509259245 LNHHDQNEYAFNFF-RUZDIDTESA-N 443.636 4.062 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1519441657 PEWLBDJVQXBIJP-UGKGYDQZSA-N 445.583 4.026 10 10 IICE CCSCC[C@@H](C)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1523498325 LUJOOTJQJPESDD-INQVIGDZSA-N 440.631 4.407 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC[C@H](C2CC2)N1C(=O)OC(C)(C)C 1540488216 IWQURSQJBAMHJL-FGZHOGPDSA-N 427.589 4.423 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)c1ccc(C(F)(F)F)cc1 1556882013 FUIDGKHGZHKDIA-NRFANRHFSA-N 430.426 4.389 10 10 IICE CC(C)[C@@H](Cc1ccccc1)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1560141405 RUBXHPQGFATVHN-XMMPIXPASA-N 426.516 4.257 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cn(-c2ccc(Br)cc2)cn1 1584094243 CPHBWCSHLKETMA-MRXNPFEDSA-N 441.373 4.370 10 10 IICE Cc1cc(CC(=O)N2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1585885405 HONUZGVHMWIFFH-RUZDIDTESA-N 425.573 4.400 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CC[C@@H](NC(=O)OC(C)(C)C)C3)ccc21 1597188508 GQGCNUAKHWZNIY-AZUAARDMSA-N 443.588 4.328 10 10 IICE Cc1cc(Br)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cc1Br 1611430655 FMORJQKOVJJUPV-SNVBAGLBSA-N 443.135 4.292 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)c(C)c1 1620562220 ZNSDZUOEXTYTFI-QZTJIDSGSA-N 431.527 4.030 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(Br)c(F)cc3O)c2)CC1 1624597066 XXTPBCNKAPSLAS-UHFFFAOYSA-N 436.325 4.077 10 10 IICE COc1c(Br)ccc(C)c1C(=O)NCc1ccc(N2CCSCC2)cc1 1624892211 DVRNTOGKGNTQPH-UHFFFAOYSA-N 435.387 4.249 10 10 IICE Cc1ccc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c(N2CCOCC2)c1 1630052962 SFZGNNXRDOSIEZ-UHFFFAOYSA-N 445.563 4.290 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](C)N(C(=O)OC(C)(C)C)C1CC1 1635673700 XNKFTTNYXGQZGW-ZDUSSCGKSA-N 441.366 4.291 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)c(C)n1-c1cccc(Cl)c1 1636342938 SUUKPXQKWOGESP-LJQANCHMSA-N 428.964 4.158 10 10 IICE CCC[C@@H]1CN(c2cccc(C(F)(F)F)c2)CCN1C(=O)c1c(F)ccc(O)c1O 1638518758 ZOALLRSIZAPNDC-OAHLLOKOSA-N 426.410 4.387 10 10 IICE O=C(Cc1cccc(I)c1)NCc1cc(Cl)cc(Cl)c1O 1641997473 PQJWLOJLZRIZJX-UHFFFAOYSA-N 436.076 4.163 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(F)F)CC2)c(C)n1-c1ccccc1Br 1648600830 WFOFUPWWMQWKRP-KRWDZBQOSA-N 427.289 4.353 10 10 IICE COc1cc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nn1C 1650744121 NDXGBTRNRXGEQH-QGZVFWFLSA-N 432.446 4.354 10 10 IICE CCC1CCC(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C2CC2)CC1 1652305785 XUJKEGNFCFHZHH-SYURHXKASA-N 445.623 4.489 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc([N+](=O)[O-])cc1 1654751279 YISHASSTZOWSIH-LSDHHAIUSA-N 443.459 4.048 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(C)C 1683253174 DMFJLXUOJDUJSL-SIKLNZKXSA-N 446.636 4.279 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccccc3SC(F)(F)F)C2)cc1 1683786255 FBSPHALIZNWBIQ-HNNXBMFYSA-N 425.476 4.385 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(COC[C@H]2CCCO2)c1 1687128644 SHLRPYCEJAEMLT-RUZDIDTESA-N 437.584 4.324 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@](C)(OC)C1CC1 1694001031 XEOVZZBUYZSOSS-CLOONOSVSA-N 441.620 4.080 10 10 IICE CCCCOCCn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695274123 YXEKXOXKGGGKTD-UHFFFAOYSA-N 443.636 4.409 10 10 IICE CCOCC(C)(C)Cn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C 1696233359 NICDVYIGFTVNII-UHFFFAOYSA-N 447.599 4.113 10 10 IICE CON(C)c1nnc(-c2ccc(Br)s2)n1CCCSc1nccs1 1698262521 CRRHKUQPTQGZOP-UHFFFAOYSA-N 446.421 4.406 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1698335712 YZKYPZJKWKAGBE-MSOLQXFVSA-N 425.602 4.329 10 10 IICE C=CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C#N)C1 1705941126 ZPILYVDUOFLYEJ-NRFANRHFSA-N 448.596 4.001 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)CCO1 1727322805 RHFKZEVCRYJOMO-RUZDIDTESA-N 437.588 4.394 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@H]3C)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1742118883 ARXLVXBIZCYGSL-RBUKOAKNSA-N 438.645 4.244 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1snnc1C 1743563661 LBXLOLZBRAXDMP-INIZCTEOSA-N 425.606 4.236 10 10 IICE COCCN(Cc1ccco1)c1nnc(C(C)(C)C)n1Cc1ccc(N(C)C)cc1C 1749815587 VBMIWUAOFKMNMT-UHFFFAOYSA-N 425.577 4.244 10 10 IICE CC[C@H](Cn1c(CC2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1762381442 LROXOCPSRIGUDT-JOCHJYFZSA-N 441.620 4.161 10 10 IICE COc1ccc(C)cc1S(=O)(=O)Nc1nc(-c2cccs2)c(CCC(=O)O)s1 1858070087 GIOOCLVJPPWKGM-UHFFFAOYSA-N 438.552 4.007 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2cccc(Cl)n2)sc(C)c1-c1ccc(C)cc1 1860750844 VZVTXVCMVSQCFC-UHFFFAOYSA-N 443.912 4.444 10 10 IICE COc1ccc(N2CCN(c3nc(Nc4cc(C)cc(C)c4)ncc3[N+](=O)[O-])CC2)cc1 1871303817 DDKOXWJIGARAKL-UHFFFAOYSA-N 434.500 4.080 10 10 IICE COc1ccccc1CNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C(C)C)C1=O 1873165241 JZTYWBXAKHAATC-UHFFFAOYSA-N 443.547 4.381 10 10 IICE O=C(N[C@H]1CC12CC(NCc1ccc(Br)cc1O)C2)OCc1ccccc1 2026169788 KWOPKQZMXGJYTP-BIXGBWIQSA-N 431.330 4.092 10 10 IICE O=[N+]([O-])c1c(Br)nn(Cc2cc(C(F)(F)F)ccc2O)c1C(F)(F)F 2079163856 UTUYDAUTNDDYSS-UHFFFAOYSA-N 434.090 4.345 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@H](NCc2cc(Br)ccc2O)C1 2096261269 HXOUYJUKMWOWCI-QGZVFWFLSA-N 425.367 4.424 10 10 IICE COc1ccc(CCN2C(=O)C(=CN3CCc4ccccc4C3)SC2=S)cc1OC 2296535533 RQHZQLVNXRTDSC-UHFFFAOYSA-N 440.590 4.006 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(N4CCCCC4)SC3=NC2=O)c(C)n1Cc1ccccc1 2297352633 IELAWQUWLWXPHU-UHFFFAOYSA-N 446.580 4.216 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(c3cccc(O)c3)C2=O)cc1 2321601550 IXJYHCRVZNSIFY-UHFFFAOYSA-N 442.562 4.045 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352669006 ZTOFXESAYVEVHX-CYBMUJFWSA-N 429.355 4.115 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352683307 GPVRGWGQPLIABY-VGWMRTNUSA-N 425.367 4.245 10 10 IICE COc1ccc(-c2noc(-c3ccc(N4CCN(c5ccc(OC)cc5)CC4)nc3)n2)cc1 65097858 GERDMMZZBXOMNO-UHFFFAOYSA-N 443.507 4.142 10 10 IICE COc1ccc(N2CCN(c3ncc4c(n3)C[C@H](/C=C\c3ccccc3)CC4=O)CC2)cc1 97214973 KVJGRERCXFIDDO-NJRZHNRPSA-N 440.547 4.270 10 10 IICE Cc1cc(/C=C/C(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)c(C)n1-c1ccccc1 110705471 CFQBEDMHVMDUSU-RTHBMQBDSA-N 442.607 4.212 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(OC)c(OC)c3)[C@H]2c2ccc(O)c(O)c2)cc1 526377253 PKBDKJMBTJHKQH-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1 727306072 AQOBYFUSZIVSMR-UHFFFAOYSA-N 436.600 4.113 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1 734687540 HPXBMWKRRXOPML-JOCHJYFZSA-N 440.975 4.372 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)N[C@@H]1CCC(=O)N(C)C1 738500555 OQQFAXWDFVCREM-VQIMIIECSA-N 448.489 4.102 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@H]2CCN(C)[C@H](C)C2)sc(C)c1-c1ccccc1 741790130 CTDRERGNQPOQTH-VQIMIIECSA-N 443.613 4.253 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 764541577 UNRDTMDUJCRICK-PXNSSMCTSA-N 443.544 4.343 10 10 IICE Cc1cc(CCNC(=O)N2CCC([C@@](C)(O)C(F)(F)F)CC2)c(C)n1-c1ccccc1 768180997 MUBMHHZFYGPFPT-JOCHJYFZSA-N 437.506 4.372 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N[C@H](c1ccccc1)c1ccco1 768920008 DZXPLRPBRQRQKO-AREMUKBSSA-N 444.579 4.400 10 10 IICE C[C@@H]1CN(c2ccc(CN[C@H](c3ccc(F)cc3)c3ccn(C)n3)cc2F)C[C@@H](C)O1 775621508 KTPQDGFOACZJIE-HOZJOUCCSA-N 426.511 4.191 10 10 IICE Oc1c(Br)cc(Br)cc1CN1CCC(CN2CCCC2)CC1 775652676 PKOXTGPNUZVXJG-UHFFFAOYSA-N 432.200 4.225 10 10 IICE O=S(=O)(Nc1nc(-c2sccc2Br)cs1)c1ccc2c(c1)OCO2 778078758 SRWOQLWSMMLNRG-UHFFFAOYSA-N 445.341 4.164 10 10 IICE CCN1CC[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 782537299 UDKUVMMUWVSZEN-IRLDBZIGSA-N 434.506 4.147 10 10 IICE CN(C)c1ccc(CN[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(C(F)(F)F)c1 793068275 VMDKTAXGUZGDSG-QGZVFWFLSA-N 433.453 4.274 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3nn(-c4ccc(Cl)cc4)cc3C)CC2)cc1 799248270 DQPAVZJYLLVPND-UHFFFAOYSA-N 425.920 4.197 10 10 IICE COc1ccc(CCC(=O)NCc2cc(Br)ccc2O)cc1Br 804734795 ZOWLEUSBGXMJHE-UHFFFAOYSA-N 443.135 4.175 10 10 IICE Cn1nccc1-c1ccccc1CNCc1ccc(N2CCOCC2)cc1C(F)(F)F 814289581 RLMQHGCIMIKLHJ-UHFFFAOYSA-N 430.474 4.232 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2ccnc(Br)c2)C1 815237653 HITMLVAVOQLIIS-UHFFFAOYSA-N 442.357 4.309 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 919895898 YXPXFTIOOLAMAH-HOYKHHGWSA-N 432.568 4.065 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4c(Br)cccc4cn3)C2)cc1 1130185762 QJFBYBIWAUXSSI-OAHLLOKOSA-N 440.341 4.262 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2(c3cc(Br)ccc3OC)CC2)cc1 1130744867 KSXKMXVLXKTFDA-UHFFFAOYSA-N 447.373 4.093 10 10 IICE CCC[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccn1 1136903843 NCSUTUPIYMUIAK-UNMCSNQZSA-N 440.588 4.414 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1137438109 IDKHOWKFBLTYQL-LJQANCHMSA-N 442.922 4.073 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(Br)cc(C=O)c3)c2)CC1 1138031005 AEEMSUGTRMWVCK-UHFFFAOYSA-N 430.346 4.044 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ncc(Cc2ccccc2)o1 1143191991 VJVSMYVEPILFIW-UHFFFAOYSA-N 427.451 4.266 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(N2CCCCCC2)cc1 1152407125 LQYCZXOUTHLXHN-UHFFFAOYSA-N 430.932 4.241 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCC4)CC3)cc2F)C[C@H](C)O1 1193430687 OIWYYDPVTGTIRF-SFTDATJTSA-N 445.623 4.492 10 10 IICE CC(C)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291089325 CFFJTKMHSNKVPN-HXUWFJFHSA-N 425.621 4.285 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C[C@H]1C 1291257290 IOBFTVNNYUOMBS-WOJBJXKFSA-N 439.648 4.216 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C(=O)CC2CCCCC2)CC1 1292564444 PAQAFPWOHSXAFO-UHFFFAOYSA-N 435.568 4.161 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1293876315 XMNWTCBKFFIIQI-GOSISDBHSA-N 449.603 4.221 10 10 IICE Cc1nnc(N(C)Cc2ccc(Br)o2)n1CCCSc1nccs1 1304792613 JZAMKFXMBKAYKE-UHFFFAOYSA-N 428.381 4.217 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](COC(C)C)C1 1307014998 PHVZVHZJCARNKV-JOCHJYFZSA-N 437.588 4.393 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c(C)c1Br 1438897462 FBEVPVCLZVCSMY-UHFFFAOYSA-N 430.390 4.056 10 10 IICE COc1ccc([C@H](CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)N2CCOCC2)cc1 1440722637 MVCWRNMNDHVYIT-SANMLTNESA-N 447.579 4.214 10 10 IICE Cc1ccc(C(=O)N(C)Cc2cn(C)nc2C(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1446589532 SHUKRBSJJZNIBD-UHFFFAOYSA-N 432.446 4.240 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@H](O)C(F)(F)F 1466536737 OUCLQDCRPVOXJS-ZBFHGGJFSA-N 433.268 4.288 10 10 IICE COC(=O)[C@H](C)N(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CCC1 1466865589 YLZYVMTXCDVCMA-HNNXBMFYSA-N 433.346 4.413 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NCc3cc(Cl)ccc3O)cc2)c1 1469875432 YQPGGQRZIAXKGM-UHFFFAOYSA-N 445.924 4.360 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 1470555091 AYCRVZXZZGMKOM-WIYYLYMNSA-N 425.548 4.436 10 10 IICE Cc1sc2nc(CS[C@@H](C)C(=O)NCc3cccc(Cl)c3O)nc(O)c2c1C 1472315848 GNJZUBQJUBPULP-NSHDSACASA-N 437.974 4.311 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1C[C@H](c1ccsc1)N(C)C 1503487908 PDHCLIUFDIWJTF-HXUWFJFHSA-N 434.569 4.047 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@H](C(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1=O 1527594366 AOJXWVMHYILWDP-VQTJNVASSA-N 437.584 4.156 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Cl)cc(F)c2Br)N(C)C)cc1 1537483239 NNONVYGOTYFCEH-QGZVFWFLSA-N 442.760 4.340 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2nc(-c3ccccc3)n3c2CCCCC3)N(C)C)cc1 1539707173 ONVYIJPOQWPXCD-XMMPIXPASA-N 445.611 4.375 10 10 IICE CO[C@@H](Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1554660050 QBVALZRKOSKGQB-DEOSSOPVSA-N 448.615 4.172 10 10 IICE COCCCN(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)cc1C 1555482953 ILFHAROEXJIASC-FGZHOGPDSA-N 443.636 4.092 10 10 IICE CC[C@](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)(C(=O)OC)c1ccccc1 1556997779 WQYIKUORAUSDCB-HHHXNRCGSA-N 446.547 4.466 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccccc3NC(=O)OC(C)(C)C)C2)cc1 1557133363 IYOJSSHBQIFCLG-GOSISDBHSA-N 439.556 4.227 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)cc2)CC(C)C)cc1 1559919148 AMNNDDXNNXIDMV-PMACEKPBSA-N 425.573 4.410 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H](C2CC2)C2(CO)CCOCC2)cc1 1570873696 SDADTJBSLPUXLV-HSZRJFAPSA-N 436.556 4.466 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2CSC2=NCCS2)cc1 1583622040 NDSGVYBQWLPLQH-UHFFFAOYSA-N 429.611 4.240 10 10 IICE CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1584924352 JIOSBIWBOHMQAN-UHFFFAOYSA-N 445.563 4.200 10 10 IICE COc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1F 1585109680 AJHMATBCTCVXEF-LICLKQGHSA-N 434.489 4.203 10 10 IICE Cc1cccc(CCn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)n1 1612223043 AIQZFXLUVBVNPS-UHFFFAOYSA-N 434.931 4.282 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CCO[C@H]2CNC(=O)OC(C)(C)C)cc1)C1CCCCC1 1625904866 DEZDQJNHZCGJIA-VXKWHMMOSA-N 445.604 4.002 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)c1 1629415059 UDJPWKBIOUCGSV-QFIPXVFZSA-N 425.479 4.218 10 10 IICE COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1630884167 JMPKTKIPJASCTP-SANMLTNESA-N 445.563 4.482 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)[C@@H](OC)c3ccccc3Cl)CC2)cc1F 1634425036 KZMBTZDACSHXSN-QVKFZJNVSA-N 435.927 4.096 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(Oc3ccccc3)c(Cl)c2)c1 1636547026 MHLSBQQLKORVSE-UHFFFAOYSA-N 432.885 4.462 10 10 IICE CCOC(=O)[C@@H]1C[C@H]1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1638143032 YDEDYXJNWPKSRQ-QZTJIDSGSA-N 427.501 4.494 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1Cc2cc(Br)ccc2OC2(CCC2)C1 1638579667 SUBWMMXXHFDEAX-XVNBXDOJSA-N 430.298 4.217 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1646436082 XBSBXZNDLGKNQI-UHFFFAOYSA-N 425.529 4.149 10 10 IICE CCOC(=O)c1csc(CCNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)n1 1650976934 BDIZFLVTJBBOCG-UHFFFAOYSA-N 425.466 4.114 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3c(Br)cc(C)cc3C2)c([N+](=O)[O-])c1 1651769889 SRMGYBOAJDYUKE-XQRVVYSFSA-N 431.286 4.415 10 10 IICE CC1CCC(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C2CC2)CC1 1657004667 CASVEWRENLBKPS-SGBLEOHJSA-N 431.596 4.099 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@H]1c1ccc(Br)cc1 1684279950 DFUQANQCGYXXEP-NRFANRHFSA-N 444.373 4.067 10 10 IICE CC[C@H](C)c1nnc(N2CCOC3(CCOCC3)C2)n1Cc1ccc(N(CC)CC)cc1 1694170536 YSWVOCYOJRACNJ-FQEVSTJZSA-N 441.620 4.072 10 10 IICE Cc1ccc(OCc2nnc(Nc3cnn(C)c3)n2CCCSc2nccs2)cc1 1707553676 RYKWPKFXGOCGGX-UHFFFAOYSA-N 441.586 4.282 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CC[C@H](C)C1 1741434568 ZBCJJPYOTIHLSN-RBBKRZOGSA-N 425.621 4.386 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)NC(C)C)nnc1N(C)[C@H](C)c1cccs1 1742138869 GKWAZCTYYKPCBF-QGZVFWFLSA-N 440.617 4.098 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3Cc3csc(C)c3)CC2)cc1F 1748848998 AXBURTOUDOOUEW-UHFFFAOYSA-N 429.565 4.294 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1763291487 TUCQQCBVGDUKLT-OXQOHEQNSA-N 439.583 4.018 10 10 IICE COC(=O)c1c(NC(=O)CCCCN)sc(C)c1-c1ccc(Br)cc1 1866098002 ZVBCVHUQTKWEEC-UHFFFAOYSA-N 425.348 4.340 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccco3)C(=O)N(Cc3ccco3)C2=O)cc1 1873163992 HAWBRYFZBJAOMX-UHFFFAOYSA-N 441.487 4.350 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1csc(NC(=O)c2cccs2)n1 1891298382 DRWFBHUJVFZSJA-RDJZCZTQSA-N 438.578 4.376 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2(NCc3ccc(Br)cc3O)CC2)C1 1967775421 LCIWGEARGCCGHN-OAHLLOKOSA-N 425.367 4.424 10 10 IICE C[C@H]1C[C@H](NCc2cc(Br)cc(F)c2O)CCN(C(=O)OC(C)(C)C)C1 2103298767 FSCZLGGIFHGKGT-SWLSCSKDSA-N 431.346 4.419 10 10 IICE CN(C)c1ccc([C@@H](N)c2cc(Br)ccc2I)cc1 2106805752 QAOXAXJJDNSAOP-OAHLLOKOSA-N 431.115 4.168 10 10 IICE CCCCN1C(=O)C(=Cc2c(Oc3ccccc3)nc3ccccn3c2=O)SC1=S 2296731458 YXLUVIZZDTXNOO-UHFFFAOYSA-N 437.546 4.488 10 10 IICE CCCOc1ccc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1OCC 2313548692 CGMZEPSZCJKZID-UHFFFAOYSA-N 428.872 4.194 10 10 IICE CCCC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cc(C(=O)OC)cc(C(=O)OC)c1 2313681980 RZTVDNYXOCTHHW-UHFFFAOYSA-N 435.480 4.149 10 10 IICE CCOC(=O)[C@@H](C)N1C(=O)C(=Cc2cc(Br)ccc2OCC)SC1=S 2314741212 WCVACWYQIZUASK-SNVBAGLBSA-N 444.372 4.001 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(C(=O)O)cc1 33373238 QBSRBEJBEGLZOP-SFQUDFHCSA-N 444.509 4.144 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)NCc4ccccc4Cl)cs3)CC2)cc1 65211531 LLRPTKHPGSOEIA-UHFFFAOYSA-N 442.972 4.062 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC[C@H]2c2nc(CCOCC3CC3)no2)cc1 581796739 FBYTYIHRKSXZMG-QFIPXVFZSA-N 434.540 4.424 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@@H]3CCOc4ccccc43)C2=O)cc2c1OCCO2 743284436 MRUWETFTNWANRI-IYSPOMMRSA-N 441.530 4.191 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@@H](Cc3nccn3C)c3ccccc3)cc2)CC1 743600163 KUAAQWOAEHQAQW-DEOSSOPVSA-N 431.584 4.440 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)NCc2cccc(Br)c2O)n1 765346394 IHFWOEADOWHEJU-UHFFFAOYSA-N 425.333 4.365 10 10 IICE COc1cc(O)c(CN2CCC[C@@H]2c2ccccc2I)cc1OC 768448687 VJIDKZCWKDZAMK-MRXNPFEDSA-N 439.293 4.351 10 10 IICE C[C@H](c1cc(F)ccc1F)N(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769040497 FVOHMOMXTKSFNV-GOSISDBHSA-N 442.554 4.399 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CC[C@H](c2ccc(F)cc2)C1 769057445 ULRHOKSOKRFSKX-QHCPKHFHSA-N 436.575 4.057 10 10 IICE COC(=O)c1ccc(CNC(=S)Nc2ccc(OC(F)F)c(Cl)c2)nc1C1CC1 779718061 GJVDZDUMQPENQU-UHFFFAOYSA-N 441.887 4.487 10 10 IICE COc1ccc(C)cc1NC(=O)[C@H]1CCCN1Cc1cc(C)cc(Br)c1O 781914725 YWPYWDMCSDFECD-GOSISDBHSA-N 433.346 4.383 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCc1ccc(C3CC3)cc1)c2[N+](=O)[O-] 792691797 QBESSYDTVWMYTM-UHFFFAOYSA-N 426.428 4.178 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(F)(F)c1cc(F)cc(F)c1 1125949064 XIFKTSALDDFUKK-UHFFFAOYSA-N 432.364 4.443 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc2c1OC(F)(F)O2 1126656912 AQVLIWFBYPZFBR-GFCCVEGCSA-N 426.366 4.008 10 10 IICE COc1ccc(N2CCN(C(=O)CCCOc3ccc4c(c3)CCCC4)CC2)c(OC)c1 1131805162 XREBTIMGERUCDP-UHFFFAOYSA-N 438.568 4.090 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1141738141 XJHDXBRRXBKQEY-SNVBAGLBSA-N 431.678 4.161 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(CCc4ccccc4)ccc3O)C2)cc1 1162717869 BXQMEAGQOORFDP-JOCHJYFZSA-N 430.548 4.442 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H](c1cccnc1)C1CC1 1266792308 JXPZCIITWPINHY-SQWSFHKJSA-N 441.553 4.080 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)CC(F)(F)F 1276234991 IWSKJGZJMFPHPM-ZEVOCZHWSA-N 434.480 4.122 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2CCc2cn[nH]c2)c(C)n1-c1ccccc1 1289355385 CFWDLOVQRIZAPQ-UHFFFAOYSA-N 439.514 4.410 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CC3(C)C)cc2)CC1 1293145107 MLOWOYWZGCQRDP-NRFANRHFSA-N 429.605 4.432 10 10 IICE CCC(O)(CC)C(C)(C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1302734088 OTQKPYKARVQMBL-FYWRMAATSA-N 440.656 4.175 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1312524450 GHSSSUODOZLADV-UYAOXDASSA-N 426.561 4.150 10 10 IICE COC(=O)CC[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1312591565 XXAMYICJEVDOBW-ZWKOTPCHSA-N 435.996 4.451 10 10 IICE CC(C)c1nnc(N2CCN([C@H](C)C(F)(F)F)CC2)n1CCCSc1nccs1 1359714648 DFTSKKFNYQLGHP-CQSZACIVSA-N 448.584 4.113 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccnc(Oc4ccccc4)c3)cc2F)CC1 1360091342 OGTKEROWBSTZFV-UHFFFAOYSA-N 434.515 4.085 10 10 IICE Cc1cc(CC(=O)NCc2cc3c(cc2OC(F)F)OCO3)c(C)n1-c1ccccc1 1435547500 TWIXRIDKVXKSQB-UHFFFAOYSA-N 428.435 4.283 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C3)c2C)cc1 1447015596 XWWNPRQMNXZRKM-PKOBYXMFSA-N 441.572 4.478 10 10 IICE COc1ccc([C@H](CNC(=O)OC(C)(C)C)CN[C@H](C)c2cc(OC)ccc2O)cc1 1459848112 GEWVJCFZRPYHJP-AEFFLSMTSA-N 430.545 4.369 10 10 IICE CCCNC(=O)OC[C@@H]1CCCCN1C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1459861880 AQEJGZBWPUTHCT-FQEVSTJZSA-N 429.561 4.035 10 10 IICE Cc1cc(N2CCC[C@H](N3CCOc4cc(N(C)C)ccc43)C2=O)ccc1Br 1459878208 XZJLOZUQCGINBU-FQEVSTJZSA-N 444.373 4.218 10 10 IICE O=C(N[C@H]1C[C@H](C(=O)OCc2ccccc2)C1)N(Cc1ccco1)Cc1ccccc1O 1471143309 FSZXXTSCLZJZTQ-MEMLXQNLSA-N 434.492 4.219 10 10 IICE CCCN1CC[C@@H](Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)C1 1514853965 CNCBLDIXUOBNHT-QGZVFWFLSA-N 440.979 4.067 10 10 IICE CCN(c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)cc1C)C1CC1 1515386402 XYVXKWXVAWNQAL-UHFFFAOYSA-N 443.393 4.447 10 10 IICE CCO[C@H](CCn1c(C2CC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)C(C)C 1516178883 YSQFBIOGDDNVBQ-OAQYLSRUSA-N 445.583 4.081 10 10 IICE CO[C@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1517860280 MGAHGBCYULDAHJ-FGZHOGPDSA-N 427.593 4.037 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)cncc4s3)CC2)cc1 1526035210 CRLIGLNPGBYZBE-UHFFFAOYSA-N 432.343 4.030 10 10 IICE O=C(COc1ccccc1C(F)(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1527057468 LVEUZJHZPCDUCG-UHFFFAOYSA-N 425.362 4.498 10 10 IICE CCCCOc1ccc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c(Cl)c1 1535157651 XPAIBVLBRWXMGF-UHFFFAOYSA-N 443.975 4.151 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(C)CCCC2)CCOC1 1541718710 WLTGQEGRDHCSEI-XMMPIXPASA-N 428.577 4.241 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCc2cc(C(F)(F)F)ccn2)CCCC1 1544745497 ZYMZSPVKDLNVCK-UHFFFAOYSA-N 431.458 4.301 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(CC)(CC)SC 1546516687 NOGOCVRTUCYHHS-UHFFFAOYSA-N 431.650 4.488 10 10 IICE CCCC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@]2(OC(C)C)CCOC2)CC1 1546935972 MXPDFMSPSVGQPR-DEOSSOPVSA-N 428.577 4.241 10 10 IICE Cc1cc(C(=O)NCc2ccncc2OCCCN(C)C)c(C)n1-c1ccc(Cl)cc1 1556856868 BAKXRLBCEGRMRW-UHFFFAOYSA-N 440.975 4.403 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(c2nccc3sccc23)CC1 1564946832 WSSXUQIUYNSUMA-GOSISDBHSA-N 437.613 4.134 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](c3ccccc3)[C@@H](O)c3ccccc3)C2)cc1 1564962434 KYSGJFSUJHQGMW-VANUSSGQSA-N 445.563 4.296 10 10 IICE Cc1ccc([C@H](O)[C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1570715646 PUCUJYIOISAMCO-QVKFZJNVSA-N 442.357 4.412 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3)C2)cc1 1585664605 DGMJABUVZFQWQC-KRWDZBQOSA-N 425.529 4.299 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(F)F)nc2)NC(=O)OC(C)(C)C)cc1 1586619235 FUZLRNXCVSLUGV-GOSISDBHSA-N 434.487 4.081 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2C[C@@H]2NC(=O)CC2(C)C)c(C)n1-c1ccccc1 1611933711 MOWJYQCZXKTMRN-QFIPXVFZSA-N 448.615 4.360 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](CC(=O)NCc3ccc(F)cc3)C2)c1O 1618867030 WAWMGFLGGNBOAQ-KRWDZBQOSA-N 432.923 4.306 10 10 IICE Cc1cc(C(=O)N2CC[S@](=O)C(C)(C)CC2)c(C)n1-c1ccc(Br)cc1 1624189418 CHEMJELTTYAAAS-SANMLTNESA-N 437.403 4.230 10 10 IICE CCOC(=O)C1=CC[C@@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1629345744 GMEGBDJYTCIMIW-QGZVFWFLSA-N 431.330 4.238 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1630100632 QAILRDPNVBWYTJ-HXUWFJFHSA-N 434.559 4.174 10 10 IICE O=C(CCCCCn1c(S)nc2ccccc2c1=O)NCc1c(O)ccc2ccccc12 1635965117 MTEQFBBURDRJNW-UHFFFAOYSA-N 447.560 4.421 10 10 IICE CC(C)(C)OC(=O)NCCCN(CC(F)(F)F)C(=O)c1cc2cc(O)c(O)cc2s1 1637083604 OZUIQGFFAZXHTL-UHFFFAOYSA-N 448.463 4.232 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC[C@](O)(c2ccc(Br)cc2)C1 1639817304 QPBYYUQDTLYEON-HXUWFJFHSA-N 448.338 4.199 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(C)cc3Br)CC2)cc1 1642353814 DPOGWAFIMFQMFF-QGZVFWFLSA-N 446.389 4.305 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3csc(NC4(C)CCCC4)n3)C2)cc1 1643346995 RZXMPXUXENKDNQ-KRWDZBQOSA-N 428.602 4.082 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCCN2C(=O)C(F)(F)F)c(C)n1-c1ccc(Cl)cc1 1643544209 LDWQCHYGLSZWOD-QGZVFWFLSA-N 441.881 4.421 10 10 IICE CCS(=O)(=O)c1ccc(Sc2ccccc2C(=O)N2Cc3cccc(O)c3C2)cc1 1650674616 JNTCFXPOODGXHA-UHFFFAOYSA-N 439.558 4.493 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@]34CCN(C(=O)OC(C)(C)C)C4)cc2)CC1 1655839024 VYMFIVQSQOOACM-RUZDIDTESA-N 429.605 4.277 10 10 IICE CC(=O)N(c1ccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1)[C@H]1C[C@@H]1C 1662054471 QXCJNJDBTOEJRB-RHGYRFJNSA-N 436.556 4.167 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)c2ccc(F)cc2OC(F)F)cc1 1671315397 QRWHOAWAWHZXOH-CQSZACIVSA-N 425.451 4.275 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1680561706 DXXRMFPVIHQQRS-SZMVWBNQSA-N 435.996 4.496 10 10 IICE COc1cccc([C@@H](O)C2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1686826688 NKECAWLXVFOCCS-CLOONOSVSA-N 439.600 4.156 10 10 IICE COc1ccc(-c2nnc(N(C)C3CC3)n2CCCSc2nccs2)c(OC)c1 1697334259 CCMKNQMWOFTURW-UHFFFAOYSA-N 431.587 4.200 10 10 IICE CC[C@@H](Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)N1CCCC1 1708768334 GLWRVCUIJOABED-NRFANRHFSA-N 440.636 4.001 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763825315 BLAPTCBBCJZPMS-UYAOXDASSA-N 429.634 4.008 10 10 IICE CCOCC(C)(C)Cn1c([C@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1766186771 LWDQLCMSJZDAHV-GOSISDBHSA-N 447.599 4.329 10 10 IICE CCOC[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1766454704 JQVKCKXWQOHDSZ-FQEVSTJZSA-N 425.621 4.259 10 10 IICE CCN(CCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1766885359 PQAFXAKPJNLUJF-UHFFFAOYSA-N 449.647 4.251 10 10 IICE O=C(O)CCCN1C(=O)/C(=C\c2cn(C3CCOCC3)c3ccccc23)SC1=S 1860827416 XKDIZWRUCWWGCN-LDADJPATSA-N 430.551 4.059 10 10 IICE Cc1ccc([C@@H](C2CCC2)n2nc(C(F)F)c(CN)c2I)c(O)c1 2079051769 LAOJYRVUSFNECA-OAHLLOKOSA-N 447.267 4.288 10 10 IICE O=C1Nc2ccc(Br)cc2C1=C1SC(=S)N(c2ccc(F)cc2)C1=O 2296390134 QMGSECOVWREYHQ-UHFFFAOYSA-N 435.299 4.316 10 10 IICE COc1ccc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1Cc1ccccc1 2313571162 OVFBFKYEKQAQKN-UHFFFAOYSA-N 430.435 4.092 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380722537 QNILOYYDQSXSLN-XOBRGWDASA-N 441.366 4.163 10 10 IICE Cc1ccc(CN(C)C(=O)CCCCN(C)C(=O)OC(C)(C)C)c(O)c1Br 2380782754 LWGXGRDGDSOELV-UHFFFAOYSA-N 443.382 4.459 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3cccc(O)c3)SC2=S)cc1 15047528 DPKQKPVESCFNCU-FDIDITGRSA-N 428.535 4.019 10 10 IICE CC(=O)Oc1ccc(/C=C2/C=C(c3ccc(Br)cc3)OC2=O)c(OC(C)=O)c1 33410730 IAYOKSBXFAPKSE-SXGWCWSVSA-N 443.249 4.281 10 10 IICE COc1ccc(N(C(=O)C(C)C)C2CCN(Cc3ccc(N(C)C)cc3)CC2)cc1OC 34682857 NJMXEFZJVGUFLG-UHFFFAOYSA-N 439.600 4.423 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccccc1)C[C@@H](c1cccc(OCC)c1O)N2 65298345 ONRWXFXQLDGKPZ-NRFANRHFSA-N 437.540 4.263 10 10 IICE biogenic CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 226742943 WRJUHDOLWODIRD-SIFCLUCFSA-N 433.917 4.325 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 251369212 QLJBGIYWAKSRKB-AUZXGJTBSA-N 427.526 4.498 10 10 IICE CC(C)CNC(=O)c1cccc(NC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 586699832 ZDFRVGSPDSMZNC-UHFFFAOYSA-N 441.487 4.492 10 10 IICE COC(=O)CCc1nnc(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)s1 736271092 GOTUEKRRMRAGOO-UHFFFAOYSA-N 426.542 4.427 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C[C@@H](C)c3ccc(C(F)(F)F)cc3)CC2)cc1 742916426 HZNNUCURVAQGFA-GOSISDBHSA-N 449.517 4.146 10 10 IICE CC(C)Cn1cnc(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)c1 748635084 AVUIIHQSLDMJGW-UHFFFAOYSA-N 447.405 4.287 10 10 IICE CCN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1cccnc1C 798217925 DCLMTEVOBUXCSM-LGMDPLHJSA-N 431.608 4.486 10 10 IICE CN1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1c1ccc(F)c(F)c1 805242892 GFVNCDRTXYJUKX-DLBZAZTESA-N 430.282 4.222 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cc4ccccc4o3)cs2)cc1 917858905 BYSIZLHDBREGLS-UHFFFAOYSA-N 448.547 4.151 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)c(C)n1-c1ccccc1 919840455 VVWBGXXAZOIBTC-QHCPKHFHSA-N 435.593 4.048 10 10 IICE COc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OCC2CC2)c1 1126657966 NKXCNOQGIARSJE-KRWDZBQOSA-N 446.494 4.484 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(Oc4cc(C)ccn4)cc3)c2)CC1 1128040341 QUWIPIREKQHPNQ-UHFFFAOYSA-N 430.508 4.103 10 10 IICE Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)Cc3ccc(O)c(O)c3)cc2)cc1 1141742662 LVDNRINPCFMDSA-UHFFFAOYSA-N 448.519 4.063 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1 1152401682 OHVIJXTWYLEZKI-CYBMUJFWSA-N 443.849 4.445 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc4c(Cl)c(Cl)ccc4[nH]3)cc2)CC1 1155603482 BLANJTRIBRCUAM-UHFFFAOYSA-N 445.350 4.106 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1157102940 SMUPHHMKIPFHOX-GOSISDBHSA-N 431.529 4.376 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)CCc2nccc(C(F)(F)F)n2)c1 1158792793 NRZIRZWITMGOSC-UHFFFAOYSA-N 430.430 4.030 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl 1162612978 SWOPTUADSSOITA-UHFFFAOYSA-N 447.804 4.123 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@@H]3NC(=O)NC3=O)cc2)c(C)n1-c1ccc(C(C)C)cc1 1168364618 JLGCWDVNRHGOPB-QFIPXVFZSA-N 430.508 4.350 10 10 IICE Brc1cc(CNCCCOCC2CCOCC2)ccc1N1CCCCC1 1177906001 WMQZJGPIOWXBBS-UHFFFAOYSA-N 425.411 4.362 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@]2(CC)CO)sc(C)c1-c1ccccc1 1193562728 DIRHJGGHXLWIRO-QHCPKHFHSA-N 430.570 4.076 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCO)c3cc(Cl)cc(Cl)c3)C2)cc1 1230858884 PWOLXHBKRVHLFC-PXNSSMCTSA-N 438.355 4.004 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3ccc(Br)c(F)c3)C2)cc1 1230859457 ZRFDKBCIWMGVBY-OAHLLOKOSA-N 436.325 4.017 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)c1 1295019360 GQDZJYWGPOKHAY-FQEVSTJZSA-N 433.552 4.368 10 10 IICE Cc1cc(C(=O)NC2(C(=O)N(C)C)CCCCC2)c(C)n1-c1ccccc1Br 1298117566 XTYBNZWSEZYKNG-UHFFFAOYSA-N 446.389 4.378 10 10 IICE CN(C[C@H]1CC=CCC1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1298500655 NRGKXGVJAJSWRI-INIZCTEOSA-N 427.603 4.167 10 10 IICE CC(C)[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1302778309 JNQNPKOFCBUTLY-LEWJYISDSA-N 447.624 4.351 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCCCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1304698160 XQGFVUJVFXLIKM-LJQANCHMSA-N 426.561 4.399 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCC1(C)C 1305726990 XABHRHOQUYYXEG-SFHVURJKSA-N 427.593 4.365 10 10 IICE COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1307628194 CSZXFRZWWNUSDR-HZPDHXFCSA-N 428.488 4.148 10 10 IICE Cc1cc(CC(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c(C)n1-c1ccccc1 1351429753 AQZSPJKRXKFXAN-UHFFFAOYSA-N 439.581 4.352 10 10 IICE Cc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1S(=O)(=O)NC1CC1 1353927693 YSXVEKDGLLILIK-UHFFFAOYSA-N 437.565 4.024 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccc(Cl)c(Cl)c3)cc2F)C[C@H](C)O1 1356036801 PWDBMWYKGNEQLV-KBPBESRZSA-N 441.330 4.441 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1360063398 OZLJXXADRUYZHV-LJQANCHMSA-N 431.600 4.371 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2[C@@H]2C[C@H]2C(C)C)c(C)n1-c1ccccc1 1361044819 GBYYVEHEVPYLEM-QGCDCVKKSA-N 434.588 4.270 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(Cn4cc(Cl)cn4)s3)CC2)cc1 1435025730 JMOKRURAKJSWOO-UHFFFAOYSA-N 430.961 4.054 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@H](C)c3cccc4ccccc34)CC2)c(OC)c1 1460653438 XQSBNCBPOVBTSZ-UXHICEINSA-N 447.579 4.245 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)COCCO1 1514424481 AZRLAQZOALPSPH-RUZDIDTESA-N 437.588 4.394 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCC(C(F)(F)F)CC2)cc1F 1517003412 IBSGECRLAPGIOB-UHFFFAOYSA-N 425.474 4.263 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(-c4c(F)cccc4F)no3)cc2F)C[C@@H](C)O1 1526002547 DZRWNOQDZKJOKK-ZIAGYGMSSA-N 445.441 4.303 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnc(Cc4ccccc4F)s3)C2)cc1 1537109370 NBRRFUVJXZCVKW-INIZCTEOSA-N 425.529 4.138 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](C)N3CCN(c4ccccc4)CC3)c2C)cc1 1540831171 DIUDVCUIBFMYAV-OAQYLSRUSA-N 446.595 4.043 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCS[C@@H](C)C1 1542227035 QQFMZTMXTPNISB-INIZCTEOSA-N 443.020 4.358 10 10 IICE CN(C)c1cccnc1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1552844661 IRFPCQJJKCAEKE-UHFFFAOYSA-N 447.631 4.322 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1555627577 GSSXESKSQQNARK-PZJWPPBQSA-N 443.636 4.297 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)ccc21 1557181540 KFGVLSIQBPEENT-HZPDHXFCSA-N 431.577 4.326 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3ccc(F)c(Br)c3C2)c([N+](=O)[O-])c1 1559242708 VKGPJRJKHWZTBZ-CLTKARDFSA-N 435.249 4.245 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCC3(CC(N)=O)CCCCC3)cc2Cl)C1 1564650045 RSAZIMKEXXVHCM-QGZVFWFLSA-N 435.012 4.201 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)ccc1F 1568939620 SWDDZLDCNRFTEP-UHFFFAOYSA-N 435.908 4.047 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CC(C)(C)CC(=O)c1ccc(C)cc1 1570514989 XEUZMUWKHLHEIS-UHFFFAOYSA-N 425.525 4.282 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c1 1584465601 RTNRISJHXNWPHJ-UHFFFAOYSA-N 442.922 4.048 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)COc2c(F)cccc2F)C1 1585959805 FOWZCEDLGAICKX-QGZVFWFLSA-N 441.522 4.270 10 10 IICE CC[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N(C)C(=O)OC(C)(C)C 1587150113 AHSPMVDBIHXMLH-MAUKXSAKSA-N 441.519 4.019 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccnc(OCC(F)(F)F)c3)c2C)cc1 1596015848 BWLMIXTYNATCOB-UHFFFAOYSA-N 433.430 4.369 10 10 IICE CCc1nnc(N(C)Cc2cn(C)nc2C(F)(F)F)n1Cc1ccc(N(CC)CC)cc1 1613924077 QOMGJCHRUKHJLF-UHFFFAOYSA-N 449.525 4.124 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1C[C@@H](c1cccs1)N(C)C 1617940841 RVVWGEXLXGVLJJ-IBGZPJMESA-N 434.569 4.047 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 1631028621 ARCZWWWRFRKRKW-UHFFFAOYSA-N 426.542 4.101 10 10 IICE CC(=O)c1ccc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1632599053 CAMYJAPZPCYMRG-UHFFFAOYSA-N 440.341 4.427 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc(C)c1OCc1cccnc1 1640232479 RJLIJQHDQMWWMR-RUZDIDTESA-N 446.595 4.376 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1643933444 VSPJJPZADIFSBA-ZACQAIPSSA-N 448.405 4.084 10 10 IICE CCCCN(Cc1ccccc1O)C[C@]1(O)CCCN(C(=O)OCc2ccccc2)C1 1645427937 ARPOALLCGPZQKQ-RUZDIDTESA-N 426.557 4.158 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](Cn3ccnc3)c3ccc(C)cc3C)C2)cc1 1680875443 ANDLEZBPVXJZNV-OFVILXPXSA-N 447.583 4.076 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)C[C@@H]3C)cc2Cl)C1 1682023195 BLXNMTKBSKZNIY-OALUTQOASA-N 442.007 4.392 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)COc1c(F)cccc1F 1682624853 OVFMWPKCXMFRNF-LBPRGKRZSA-N 443.288 4.432 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1ccccc1)CC1CCC1 1683195726 MBCNHUIYIIRBGF-UHFFFAOYSA-N 429.511 4.313 10 10 IICE CCC[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCO1 1695159043 MPIMGXRGPIUXHU-OAQYLSRUSA-N 425.621 4.303 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1CCC(C)(C)C1CC1 1698232295 IWCXNJWXVYHSLF-RXVVDRJESA-N 428.577 4.170 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CC1(O)CCCCC1 1711095662 UFHXZQMLPLDYCB-UHFFFAOYSA-N 427.936 4.031 10 10 IICE CCOCc1nnc(N2C[C@@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1729007895 ZOLSZBFVSKZXNB-HXUWFJFHSA-N 441.620 4.103 10 10 IICE Cn1cc(Nc2nnc(Cc3c(F)cccc3F)n2CCCSc2nccs2)cn1 1729579719 IZZGXSFGAJGUOP-UHFFFAOYSA-N 447.540 4.263 10 10 IICE CC(C)[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1741403594 FAIODWLYUKPUHW-NQIIRXRSSA-N 447.624 4.003 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1765288214 QYZMOIXWFIWTGN-GBXCKJPGSA-N 448.615 4.162 10 10 IICE Fc1cc(Cl)ccc1-c1nnc(N2CCOCC2)n1CCCSc1nccs1 1771523058 IINXSIWXJLBIFD-UHFFFAOYSA-N 439.969 4.213 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)sc(C)c1-c1ccc(C)cc1 1860646332 MRQAXEQYUWLDLD-GOSISDBHSA-N 440.565 4.406 10 10 IICE COc1cc(/C=C2\C(=O)N(c3cccc(Cl)c3)N=C2C(F)(F)F)cc(OC)c1O 1865679912 MTFMWUQPSBMRRD-MLPAPPSSSA-N 426.778 4.411 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])N2CCCCC2)cc1 1866100243 XUUMPVUBGUNVPC-OAQYLSRUSA-N 430.936 4.271 10 10 IICE C[C@@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1cccc([N+](=O)[O-])c1O 1951727301 ZMKZSOLOWMFVQB-DEOSSOPVSA-N 448.431 4.139 10 10 IICE Oc1cc(Br)ccc1Cn1nc(C2CCC2)cc1I 2070165227 NRTBWKPNSRGYFQ-UHFFFAOYSA-N 433.087 4.272 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N(Cc1ccccc1)C1CCC1 2080886479 IXBNQNUQAOXQQR-FQEVSTJZSA-N 440.540 4.115 10 10 IICE Cc1cc2c(n1-c1ccc(Br)cc1I)CCC[C@H]2N 2231671416 ZQTXRZANIQHZKC-CYBMUJFWSA-N 431.115 4.489 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1O 2236048682 GIYDTJVJBMZSPV-BCDXTJNWSA-N 431.374 4.449 10 10 IICE O=C1C[C@@H](N2C(=O)C(=Cc3ccc(Cl)cc3)SC2=S)C(=O)N1c1ccc(F)cc1 2296774281 FZDZVXDSEUWJEK-OAHLLOKOSA-N 446.912 4.012 10 10 IICE COc1ccc(C=C2SC(=O)N(CCC(=O)Nc3ccccc3C(=O)O)C2=S)cc1 2297450069 LCTZZVOYYTULBB-UHFFFAOYSA-N 442.518 4.259 10 10 IICE CCOc1c(C=C2C(=O)N(c3ccccn3)N=C2c2ccc(OC)cc2)cccc1OC 2332117557 UPMVCYNYILVVIU-UHFFFAOYSA-N 429.476 4.332 10 10 IICE COc1ccc(N2N=C(C(F)(F)F)C(=Cc3cc(Cl)c(O)c(OC)c3)C2=O)cc1 2332139736 MJNKQSWQJIGJBU-UHFFFAOYSA-N 426.778 4.411 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352953017 RINHQHWHPHJZQP-LSDHHAIUSA-N 427.383 4.492 10 10 IICE O=C1Nc2ccc(Br)cc2/C1=C1\SC(=S)N(c2ccc(F)cc2)C1=O 2284685 QMGSECOVWREYHQ-BUHFOSPRSA-N 435.299 4.316 10 10 IICE C[C@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccccc3Cl)s2)C1=O 11636141 DZMRKRRIFGOMGM-LLVKDONJSA-N 440.015 4.355 10 10 IICE CCOc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1ccc(C)cc1 20236619 KFRWRYLXQDDRKK-GUOILJMFSA-N 431.448 4.063 10 10 IICE COc1cc(NC(=O)/C=C/c2ccc(-c3ccccc3)o2)c(N2CCOCC2)cc1OC 20968622 DCPMMGDNMXSQFN-PKNBQFBNSA-N 434.492 4.452 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)cc1 97012554 RGAPBRYASSSHMM-UHFFFAOYSA-N 433.487 4.363 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cc3ccc4c(c3)OCCO4)no2)C1 685237573 HZOVXIUCPPOOAL-UHFFFAOYSA-N 444.535 4.201 10 10 IICE COc1cc(CNC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc(OC)c1O 726247606 OBRVMMUJSLWYFX-UHFFFAOYSA-N 427.545 4.178 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NOCc1ccc(F)cc1 757609967 DDXIQASPPPULBK-WJDWOHSUSA-N 436.555 4.117 10 10 IICE c1cnc(Oc2ccc(CNCc3ccc(N4CCN(CC5CC5)CC4)cc3)cc2)cn1 768668901 BCCWQKOKZCAOEP-UHFFFAOYSA-N 429.568 4.091 10 10 IICE O=C(c1ccccc1F)N(CC(F)(F)F)C1CCN(Cc2cc(F)ccc2O)CC1 779018774 GVMIFKMTIKSUQT-UHFFFAOYSA-N 428.401 4.340 10 10 IICE Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 784071316 GQSKVSNPLSOBLQ-KBPBESRZSA-N 435.883 4.239 10 10 IICE C[C@H](NCc1cc(Cl)ccc1N1CCOCC1)c1cc(Br)ccc1O 798935973 YLURNVSXLOEPTA-ZDUSSCGKSA-N 425.754 4.496 10 10 IICE O=S(=O)(Nc1nc(-c2sccc2Br)cs1)c1cccc2c1OCO2 800925443 AUOXNDXXIQDRRG-UHFFFAOYSA-N 445.341 4.164 10 10 IICE CSc1cnn(-c2ccccc2)c1NC(=O)NCc1cc(Br)ccc1O 806344142 FYGUYYBIRULVDF-UHFFFAOYSA-N 433.331 4.384 10 10 IICE Fc1cc(CNc2cc(C(F)(F)F)cc(Br)n2)ccc1N1CCOCC1 806670296 FJMYRTWYAOPMTL-UHFFFAOYSA-N 434.231 4.451 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N1CCN(Cc2ccc(F)cc2Cl)CC1 918210588 VKPAQSMESGRTHH-UHFFFAOYSA-N 430.955 4.107 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(C)nc(-c4ccc(Cl)cc4)n3)C2)cc1 1130185326 DXNSQGVSXVMOIH-KRWDZBQOSA-N 436.943 4.370 10 10 IICE COc1ccc(C)cc1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1136438021 ZIQAZRUXFNYNBC-UHFFFAOYSA-N 428.330 4.499 10 10 IICE O=C(NCCCSc1nccs1)c1ccc(Cn2ccc(C(F)(F)F)n2)cc1 1136661557 IURGRECIAKEIFG-UHFFFAOYSA-N 426.489 4.319 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(CCO)Cc3cnn(Cc4ccccc4)c3)c2C)c1 1137616898 FTLMINKICBFYMA-UHFFFAOYSA-N 442.563 4.282 10 10 IICE C[C@H](NC(=O)C1CC2(C1)C[C@@H](NC(=O)OC(C)(C)C)CCS2)c1ccc(N(C)C)cc1 1138363829 RFHKQXQNLAGRDX-TWZOFJNBSA-N 447.645 4.499 10 10 IICE CCOC(=O)C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1cccc(Br)c1 1152058874 RGJDEWFDLNFHKI-INIZCTEOSA-N 447.289 4.036 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 1175648303 ODUGPRSCNGDYMX-IMAOXBOFSA-N 442.556 4.139 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCC[C@H]2Cc2cnn(C)c2)cc1 1253222429 WWKJWTJTRZBFQG-XUZZJYLKSA-N 435.572 4.202 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(OCc2ccccc2)cs1 1275224301 BTVKROVJDDFZLL-UHFFFAOYSA-N 444.503 4.372 10 10 IICE COc1cccc([C@@H](C)CCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1275224480 KZZCMFHCOOPVPL-KRWDZBQOSA-N 432.511 4.400 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccccc3Cl)cc2F)C[C@@H](C)O1 1291755395 GYVZYCSTHSTRAF-GASCZTMLSA-N 442.922 4.413 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@](C)(O)c1cccs1 1292832653 GWQJFXRCCLGSRK-QHCPKHFHSA-N 425.602 4.046 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)OC(C)C)c(C)n1-c1cccc(Br)c1 1293844955 FLMZSFRUPQFOKG-IBGZPJMESA-N 433.346 4.413 10 10 IICE Cc1ccc(-c2ccc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2)nn1 1294859161 JWWYHECVBNSPJE-NRFANRHFSA-N 436.943 4.205 10 10 IICE CCc1cc(O)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1296351113 YGTFOFDVNCNSBP-WQRHYEAKSA-N 430.526 4.324 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCOC3(CCCC3)C2)cc1F 1298062729 XAFFKGQTTVAWEW-UHFFFAOYSA-N 429.584 4.270 10 10 IICE CC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(F)ccc1F 1307625113 LGPRCHBZMOAIFE-HXUWFJFHSA-N 434.442 4.420 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)c(C)n1-c1ccccc1 1435798291 STFLUHOVJHESRT-JOCHJYFZSA-N 439.918 4.351 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c(C)n1-c1cnccn1 1441151259 OOHAZJVIRRCWKM-UHFFFAOYSA-N 429.524 4.386 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1442312860 GVNDIRPZAJMRDZ-YLJYHZDGSA-N 425.573 4.260 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)cnc1OCC1CC1 1442345435 YPYJGBFCDJNLJR-UHFFFAOYSA-N 432.362 4.361 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 1457037686 NAOSKBVFDWNESI-INIZCTEOSA-N 427.715 4.273 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cc1 1464548139 JOMITDMYIHTPJU-VWLOTQADSA-N 443.591 4.478 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)NCc3cc(Cl)cc(Cl)c3O)ccnc21 1468669910 ULGVOFLZLUPKNB-UHFFFAOYSA-N 438.311 4.322 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCC(=O)Nc2c(F)cccc2F)cc1 1469611724 HMBGELJDOQHABX-UHFFFAOYSA-N 443.416 4.341 10 10 IICE CN(C[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(OCc2ccccc2)cc1 1473389189 KOLCNNKEMCQNIC-QFIPXVFZSA-N 432.520 4.026 10 10 IICE Cc1cc([C@@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)C2)c(O)cc1Cl 1479030917 UXVYLICRRIUKSN-GOSISDBHSA-N 443.975 4.014 10 10 IICE Cc1ccc([C@H]2CSCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1479534812 OSBUMGIFCGIIOL-XZOQPEGZSA-N 426.630 4.163 10 10 IICE CC[C@H]1CN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1499727657 HPIUIMXULVHDLQ-CTNGQTDRSA-N 429.634 4.008 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(CC)[C@H](C)C2)cc1 1515533393 VZJFXFNOKOAWJS-HXUWFJFHSA-N 426.653 4.292 10 10 IICE COC[C@@H](OC)C(=O)Nc1sc(C)c(-c2ccc(Cl)cc2Cl)c1C(=O)OC 1524953709 YSGGHPDYYHTGOZ-CYBMUJFWSA-N 432.325 4.417 10 10 IICE COc1cc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)ccc1OCc1cscn1 1528923607 CIQNWBQOKYICCD-KRWDZBQOSA-N 439.581 4.466 10 10 IICE COC(=O)c1cnc([C@H](C)NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)s1 1529527831 RFHPGKOMSGHUPG-ZDUSSCGKSA-N 431.945 4.411 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(Br)c(C)c3)CC2)cc1 1535590932 XJTNPVRSLWCWKK-UHFFFAOYSA-N 431.374 4.393 10 10 IICE CCCCNC(=O)OC[C@@H]1CCCCN1C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1544478680 ZMBPLNMCQMXSBE-NRFANRHFSA-N 443.588 4.426 10 10 IICE CNC(=O)CN(Cc1ccc(N2CCC(OC)CC2)cc1)Cc1cccc(C(F)(F)F)c1 1559612120 CUKWKTSJGHXNQT-UHFFFAOYSA-N 449.517 4.069 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc2c(c1)C(C)(C)C(=O)N2C 1588193106 LFYWKBBSMMVKIJ-UHFFFAOYSA-N 431.330 4.071 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(F)c(Br)ccc4[nH]3)CC2)cc1 1594799343 HDMXQXGDDAJKJM-UHFFFAOYSA-N 432.293 4.041 10 10 IICE Cc1cc(C)cc([C@H](C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1616786237 FULPORZIWXNZPW-AQNXPRMDSA-N 427.564 4.023 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc(-c2ccccc2)[nH]1 1623929141 VBVXATWFXXOYQY-UHFFFAOYSA-N 426.900 4.175 10 10 IICE CC[C@H](C(=O)NCc1ccc(N2CCCCC2)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1630698275 QPYFIZBFWWSPOV-OAQYLSRUSA-N 438.963 4.251 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c[nH]nc1-c1cccc(Cl)c1 1631425987 UZSNDXPOOXUKFI-SFHVURJKSA-N 445.350 4.484 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 1636240001 VUGBAZANRYIYNW-WOJBJXKFSA-N 432.609 4.366 10 10 IICE CCOC(=O)[C@H](CC1(OC)CCC1)NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1640785761 FGLLBZSWXQAYLA-NRFANRHFSA-N 446.975 4.297 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C2)c1O 1647788525 ZTANUOIFPFMWEC-YOEHRIQHSA-N 448.457 4.259 10 10 IICE C[C@H](NCCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(N2CCOCC2)cc1 1653132669 FINJOCBXMCDXQB-NRFANRHFSA-N 443.035 4.040 10 10 IICE COC(=O)CN(Cc1csc(-c2ccc3c(c2)OCO3)n1)Cc1cc(Cl)ccc1O 1653611818 NFUJEOXDDBFOIY-UHFFFAOYSA-N 446.912 4.073 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccc2ccccc12 1654816274 YSJKTYILEFGGJD-DEOSSOPVSA-N 435.543 4.173 10 10 IICE COc1ccc([C@H](CNC(=O)CN[C@H](C)c2ccccc2O)c2c[nH]c3ccccc23)cc1 1655349606 MVOIAKRCFJQQPY-JPYJTQIMSA-N 443.547 4.481 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cc(C)ccc3Br)C2)cc1 1682084413 PQSDNKZEMBSNGC-MRXNPFEDSA-N 432.362 4.092 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@H](c4ccc(F)c(F)c4)C3(C)C)cc2)CC1 1684878550 VNOMKGIIBNSNIJ-OAQYLSRUSA-N 442.554 4.194 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1CCC(c2ccc(F)cc2)CC1 1686069261 RYVBLOMGOINMTD-UHFFFAOYSA-N 425.548 4.312 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(C)C)cc1C 1694049697 RLADTLAAKVFRDI-ICSRJNTNSA-N 435.620 4.017 10 10 IICE CCN(Cc1cccs1)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1728443111 GJUBNLIMCIYEPZ-LJQANCHMSA-N 425.602 4.293 10 10 IICE Cc1cnn(CC2CCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)cc3C)CC2)c1 1762184705 FERWUIDTMRYJIJ-UHFFFAOYSA-N 449.647 4.420 10 10 IICE CN(CC1CC(F)(F)C1)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1768748083 SELMIAJCUNPNLQ-UHFFFAOYSA-N 436.557 4.461 10 10 IICE C[C@@H](Oc1cccnc1NC(=O)Oc1ccc(N)cc1)C(=O)Nc1ccccc1Cl 1858687491 LUMPMRHQTMZNCZ-CYBMUJFWSA-N 426.860 4.334 10 10 IICE CCc1c(C2CC2)nn(Cc2ccc(Br)cc2O)c1I 2079829114 ZNUCUWANIAVPEK-UHFFFAOYSA-N 447.114 4.444 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NCc1cccc(Br)c1O 2144150448 LKDXLQQDKRJCFM-QZTJIDSGSA-N 433.346 4.435 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(Cc3ccccc3)C3(CCC3)C2)c1O 2236054465 IMNOJFGPBLYGPQ-QGZVFWFLSA-N 431.374 4.450 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2ccc(F)cc2)c1C 2294037503 LVPSZOMDFNQDOC-NRFANRHFSA-N 438.499 4.085 10 10 IICE CCCCCCN1C(=O)C(=Cc2c(NCC)nc3c(C)cccn3c2=O)SC1=S 2314414584 DTOKQILLUATXAD-UHFFFAOYSA-N 430.599 4.216 10 10 IICE O=C(CCCN1C(=O)C(=Cc2c[nH]c3ccccc23)SC1=S)NCc1ccccc1 2314831020 AOQIYLMYYHISRL-UHFFFAOYSA-N 435.574 4.466 10 10 IICE COc1cc(C=C2SC(=S)N([C@@H](C)[C@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 2323680400 DABHEVGAQJTHJY-AUZPSNTRSA-N 434.539 4.335 10 10 IICE Cc1ccc(CNC(=O)C[C@H](C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2352646558 VSYGBQRKLDWFQF-GFCCVEGCSA-N 429.355 4.020 10 10 IICE CC[C@@H](N[C@]12CO[C@H](C1)[C@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2359240944 IWCCMSNPVTUPKI-YVTWGWGSSA-N 441.366 4.020 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2ccc(F)cc2)c1C 2813307 LVPSZOMDFNQDOC-XWRADEMYSA-N 438.499 4.085 10 10 IICE O=C(COc1ccc(Cl)cc1/C=C1\SC(=S)NC1=O)Nc1cccc(Cl)c1 39793939 WPSLWIPMFRBKPI-CHHVJCJISA-N 439.345 4.500 10 10 IICE COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)/C2=C(\C)NCCCOC(C)C)cc1 205960995 XLFYCSGOEQCPFI-OQKWZONESA-N 425.504 4.264 10 10 IICE Cc1c(C(F)(F)F)nn(C)c1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 436039684 PIDKYXPCOMJVTO-UHFFFAOYSA-N 433.478 4.107 10 10 IICE COC[C@H](C)Nc1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 437616844 WVNLUHKYDGMQHU-IBGZPJMESA-N 434.584 4.493 10 10 IICE COCCn1ncc2ccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)cc21 683442092 HDNAKZMLQPRQBI-UHFFFAOYSA-N 445.567 4.043 10 10 IICE CCc1nc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cs1 730785231 DGKPGURGYSRFBR-ZROIWOOFSA-N 437.637 4.065 10 10 IICE Cc1cc(CCNC(=O)c2sccc2S(=O)(=O)C(F)F)c(C)n1-c1ccccc1 731000253 XTPFRLIFTRGLMJ-UHFFFAOYSA-N 438.521 4.124 10 10 IICE CC[C@@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C)nn(C)c1C 743695169 VIXRXGYCBVFUNA-VQIMIIECSA-N 435.519 4.058 10 10 IICE C[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(Cl)s1 754595618 FPHJAUKKNDDKNP-KFWWJZLASA-N 439.984 4.121 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN(C)C3CCN(c4cnccn4)CC3)c2C)cc1F 789365187 GGMHLIKWYIJFRN-UHFFFAOYSA-N 435.547 4.115 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(O)c3ccccc3c2)c1 792142161 QWDXWQOFYZJFJW-UHFFFAOYSA-N 425.488 4.290 10 10 IICE Cc1cc(Br)cn2c(CNCc3cc(Br)ccc3O)cnc12 809713664 WVZZBLMTKSUMRG-UHFFFAOYSA-N 425.124 4.163 10 10 IICE COc1ccc(CCC2CCN(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2)cc1 919790154 NBZWKFXNGSHUIS-UHFFFAOYSA-N 437.584 4.086 10 10 IICE COc1ccc2c(CC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)coc2c1C 1125258144 FEYHNTOGQKBEPA-HZPDHXFCSA-N 440.515 4.361 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)C2)cc1 1131029765 GIJYCAIRJKXIIY-AUSIDOKSSA-N 448.485 4.058 10 10 IICE CN(C)c1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cc1 1134538550 GKWWWGNYUIHWOL-UHFFFAOYSA-N 436.313 4.477 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(OC(F)(F)F)c(Cl)c2)N(C)C)cc1 1134686785 WNBSABHGSSYFQN-QGZVFWFLSA-N 429.870 4.337 10 10 IICE CCc1ccc(C(=O)N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1136108223 FHKGWVXZEBVIQC-UHFFFAOYSA-N 443.547 4.067 10 10 IICE CCOC(=O)C1(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCC1 1136853765 RVYWOZWURMMIRM-UHFFFAOYSA-N 433.346 4.320 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c(C)n1-c1ccccc1Br 1150029411 FCFOLUCHLQIWSV-PXNSSMCTSA-N 430.390 4.413 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1 1230809663 SHCMNRSRGBGQJW-WIYYLYMNSA-N 433.911 4.043 10 10 IICE COc1ccccc1CC(C)(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266258897 JYEMLSXMBIAMCI-UHFFFAOYSA-N 435.612 4.112 10 10 IICE CCCNC(=O)OC[C@@H]1CCCCN1C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1271709181 VYLQKZZEGZGZMT-SFHVURJKSA-N 441.572 4.046 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C2)cc1 1278861976 STVJZSIRMHDKQK-AWEZNQCLSA-N 431.323 4.196 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H]3C(C)C)n2Cc2ccc(N(C)C)cc2C)n1 1290638873 MGVRGGHWFYLGDO-HSZRJFAPSA-N 435.620 4.187 10 10 IICE Cn1ccc(Nc2ccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2)n1 1292593887 MJUCNWUKNHPLEP-UHFFFAOYSA-N 441.482 4.164 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CCCCS1 1298314904 LDLUIKQXYVPPEN-NRFANRHFSA-N 443.661 4.334 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CC(C)(C)NC(=O)OC(C)(C)C 1298358605 HCSNQRWBHXJHCF-UHFFFAOYSA-N 431.581 4.221 10 10 IICE CC(C)(C)OC(=O)NCCCSCCC(=O)NCc1cc(Cl)cc(Cl)c1O 1298842191 SKAOZYUEIWNXOJ-UHFFFAOYSA-N 437.389 4.353 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CC4)n3C[C@](C)(O)CCC(C)C)CC2)cc1 1300247780 PNMPBWSZSPLJAV-RUZDIDTESA-N 441.620 4.068 10 10 IICE CN(CCOc1ccccc1C(=O)NCc1cc(Cl)ccc1O)C(=O)OC(C)(C)C 1300395682 BIZOQZHNSOIYNO-UHFFFAOYSA-N 434.920 4.221 10 10 IICE CCOC(=O)c1cn(C)nc1NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1306097243 UFCXTGIDIHWMNP-UHFFFAOYSA-N 445.317 4.019 10 10 IICE CCCN(CC)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1306799370 KUPSHKVLNPJGMG-UHFFFAOYSA-N 425.602 4.052 10 10 IICE COc1ccc(N2CCCN([C@@H](C)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1307424484 RXFUMBDYYCEPSY-RTWAWAEBSA-N 435.612 4.352 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](C)COc2ccc(F)cc2F)CCCC1 1351449829 UFCSUOIBJMQKLN-HNNXBMFYSA-N 428.479 4.391 10 10 IICE Cc1ccc(-c2cc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)n[nH]2)cc1 1441644714 BFNFBICGEKOWMQ-UHFFFAOYSA-N 444.457 4.171 10 10 IICE COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1446862402 ANAGOSRGIUHGMV-LAUBAEHRSA-N 448.361 4.103 10 10 IICE CCc1ccc(N(CC(C)C)C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1448961725 AAQRKGDMKCVHII-CCEZHUSRSA-N 449.595 4.152 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3cc(Cl)cc([N+](=O)[O-])c3=O)c2C)c1 1459002929 ZFHBHTGJQPMTQD-UHFFFAOYSA-N 431.901 4.422 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC2(C(=O)OC(C)(C)C)CCOCC2)c1 1461792963 FYSSSCBPADLUCG-UHFFFAOYSA-N 432.948 4.368 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2C)c1 1468017788 PAGSUVMFKBFSKG-MOPGFXCFSA-N 447.501 4.194 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2C[C@H](N3CCOCC3)C2(C)C)cc1 1469715233 HPPPNOZUNYXLOS-GOTSBHOMSA-N 435.572 4.397 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1 1479163815 PIQJZKHBNSCCNB-PKTZIBPZSA-N 443.975 4.238 10 10 IICE COc1ccc2cc(CN(C)C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)ccc2c1 1479532225 BNIZHBWQDDMKDG-VWLOTQADSA-N 434.584 4.359 10 10 IICE CCc1nnc(N2CCN(CC3CCCCC3)CC2)n1Cc1ccc(N(CC)CC)cc1 1499189533 CRFZFMKTVYYZCD-UHFFFAOYSA-N 438.664 4.437 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1C[C@@H]1CCN(CC(F)(F)F)C1 1503488508 VEHORXYIIWTRDF-MRXNPFEDSA-N 439.526 4.093 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)[C@H]1C 1504891935 KPVXTDYVXIBIKG-IEBWSBKVSA-N 425.602 4.329 10 10 IICE CC1CCN(CCCCn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)CC1 1512335876 IHCYLGFQPRITBZ-UHFFFAOYSA-N 448.615 4.118 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCC(C)CC3)C2)n1Cc1ccc(N(C)C)cc1C 1513901060 RKCZDRUHFXTHSX-JOCHJYFZSA-N 438.664 4.212 10 10 IICE COCCOc1cc(C)ccc1CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1516010266 KZYUHDIXXUUYDP-UHFFFAOYSA-N 436.552 4.179 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 1528923876 FHLBBNLIGHIFCY-RXVVDRJESA-N 442.003 4.314 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)cc1 1538138820 ZJUDXCWVMBXTQT-JOCHJYFZSA-N 427.976 4.242 10 10 IICE CCCn1nccc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1539360561 AWYLOSNEBVJHIF-UHFFFAOYSA-N 425.290 4.018 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCO[C@H]2C(C)C)c(C)n1-c1ccc(Br)cn1 1544926912 BVFIAXUZXIONEX-JXFKEZNVSA-N 434.378 4.433 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CO)c3cccc(Br)c3)c2C)cc1 1546099205 ZIDPBRWQHPYZFJ-NRFANRHFSA-N 443.341 4.329 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H](N3CCCCC3)C2)cc1 1547446940 KYSTYHAYSYNAKR-DEOSSOPVSA-N 438.664 4.436 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)C(=O)Nc3ccccc3)cc2Cl)C1 1564649432 CNKRYICESYPXKB-DLBZAZTESA-N 428.964 4.403 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCCCSc2nccs2)cs1 1565620365 PPOPLYHGSOXSOA-NSHDSACASA-N 428.605 4.098 10 10 IICE Cc1cc2ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)cn2c1 1565882478 ZKBRCWZESPARQT-JOCHJYFZSA-N 436.556 4.310 10 10 IICE Cc1cc(C(=O)NCCN2C(=O)COc3ccccc32)c(C)n1-c1ccc(C(C)C)cc1 1583997458 KUMNLHFMPMBKFY-UHFFFAOYSA-N 431.536 4.373 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCO[C@H]1c1cncc(Br)c1 1597774264 HHXZKQICKZLVIV-UXHICEINSA-N 432.362 4.036 10 10 IICE COc1cc([C@H](C)NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)ccc1S(C)(=O)=O 1607749483 NXHPOFOUSNHOEY-SFHVURJKSA-N 440.565 4.306 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2ccc(Br)cc2)ns1 1611430740 HEGABDCNASJQRE-LLVKDONJSA-N 433.327 4.345 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN1CCSCC1 1615386112 JCDRTCJLRUMNHW-UHFFFAOYSA-N 438.645 4.248 10 10 IICE O=C(Cc1ccc(Cl)cn1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1618369272 SYAYXHQUZHDFPN-UHFFFAOYSA-N 442.704 4.388 10 10 IICE CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)c2)CC1 1625379721 OVLGICQYAJERAK-UHFFFAOYSA-N 444.579 4.319 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)cc1 1626319159 WNUCVITVUUYWDZ-UHFFFAOYSA-N 445.563 4.197 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1(c2cccc(Br)c2)CC(=O)C1 1626723327 ZQOPXNQNSQEDJB-MRXNPFEDSA-N 443.385 4.172 10 10 IICE Cc1cc(C(=O)NCc2c(C3CCC3)cnn2C)c(C)n1-c1ccc(Br)cn1 1629043087 RVQNBAMUKCCYAW-UHFFFAOYSA-N 442.361 4.183 10 10 IICE COc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC(C)C)c1 1631425913 SBHDMNXQXOOOEQ-GOSISDBHSA-N 432.948 4.236 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1C 1632748195 WRHMDSPDFAVEOA-DEOSSOPVSA-N 431.580 4.289 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC[C@@H](S(=O)(=O)Nc3ccccc3)C2)cc1 1632902040 JLUINSNDFMAISO-HSZRJFAPSA-N 437.565 4.141 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cnc(CC3CCN(C(=O)OC(C)(C)C)CC3)s2)c1 1633286540 GUUYRQUQHADBIU-UHFFFAOYSA-N 445.585 4.277 10 10 IICE COc1ccc(N(CC(=O)NCCc2ccc(OC(F)(F)F)cc2)C(C)C)cc1F 1642246787 MMLNORSZRMMAJM-UHFFFAOYSA-N 428.426 4.307 10 10 IICE COC(=O)/C=C\c1ccc(N2CC3(CC(OC)(OC)C3)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 1643213452 DHOLGWUUKQLROQ-HLXJENQHSA-N 438.480 4.112 10 10 IICE COc1ccc([C@@H](CNC(=O)OC(C)(C)C)CN(C)c2ccc(OC)c(OC)c2)cc1 1644464367 JCUUCSMNEZJPBG-SFHVURJKSA-N 430.545 4.457 10 10 IICE Cc1cc(CN2CCC[C@@H](C(=O)Nc3ccc(Br)cn3)C2)ccc1N(C)C 1652865759 VTFKUORIYUVRRQ-QGZVFWFLSA-N 431.378 4.069 10 10 IICE COc1ccc(N(C)CCN(C)Cc2csc(-c3ccc(OC)cc3OC)n2)cc1 1654114572 LPCARQOUSSZDNM-UHFFFAOYSA-N 427.570 4.404 10 10 IICE C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1673472607 SGQQJAIMNNYKHP-QVKFZJNVSA-N 433.474 4.233 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](COC)c1cccc(Br)c1 1675426921 GWSZZKOKTGSGND-HXUWFJFHSA-N 434.378 4.434 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1 1680477797 QQLVBUYFUJIDNA-KRWDZBQOSA-N 446.954 4.272 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(N4CCCOC4=O)CC3)cc2Cl)C1 1680561249 AHYYUETZVOJSRS-QGZVFWFLSA-N 448.995 4.093 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(C)C 1683253172 DMFJLXUOJDUJSL-DENIHFKCSA-N 446.636 4.279 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1C[C@@H](OCc2ccccc2)C1(C)C 1686204523 FOMWWLTZTOJPTG-BJKOFHAPSA-N 437.584 4.049 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccccc3)cc2Cl)C1 1686268899 IEFXYTJALBHBRW-NQIIRXRSSA-N 429.992 4.227 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1695627684 ZMGJUDNCIXVJJA-TZIWHRDSSA-N 441.620 4.070 10 10 IICE CCc1nnc(N2CCCC[C@H](COC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1727592455 VSEJCWABUUAQHZ-QFIPXVFZSA-N 425.621 4.378 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](OC)C(C)C 1730718800 VWLVZQPTVVNYDU-JOCHJYFZSA-N 425.577 4.106 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)CCCO1 1763098778 OVYGFRXYCFRLDK-OAHLLOKOSA-N 433.578 4.338 10 10 IICE CCCO[C@@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1764642247 HNEYHMRARQHFDI-DENIHFKCSA-N 445.583 4.169 10 10 IICE CN(Cc1cscn1)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1767160230 LJCPOQCITGFUTJ-UHFFFAOYSA-N 429.600 4.072 10 10 IICE COc1ccccc1OCC(=O)N(c1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 1859892044 VPERQXMYYYUOQR-UHFFFAOYSA-N 429.472 4.291 10 10 IICE O=C1/C(=C\c2ccc(O)cc2)SC(=S)N1c1ccc(I)cc1 1860074768 LMDLAPKOJZWJFX-NTEUORMPSA-N 439.299 4.403 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccc4c[nH]nc4c3)C(=O)N(C3CC3)C2=O)cc1 1873422020 BQLBJMSKPKKGBB-UHFFFAOYSA-N 437.503 4.325 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)[C@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1999535873 BUNXCSNFVSAASL-XZOQPEGZSA-N 426.605 4.038 10 10 IICE O=C(COc1cccc(C=C2SC(=S)NC2=O)c1)Nc1ccc(Cl)c(Cl)c1 2314835353 FYFCZXAFALJUBU-UHFFFAOYSA-N 439.345 4.500 10 10 IICE CCN(CC)c1ccc(N2C(=O)C(=Cc3ccc(OCC(=O)O)cc3)SC2=S)cc1 2314929297 KRGNVGAPIUIGJG-UHFFFAOYSA-N 442.562 4.402 10 10 IICE CCOC(=O)CN1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 33332511 VDIDVHBLAKDJNZ-XDHOZWIPSA-N 443.546 4.039 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C/c3ccc(-c4cccc([N+](=O)[O-])c4)o3)C(=N)N12 104372648 UAMABTSGQLLRPB-VOPKFQMRSA-N 427.467 4.185 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S)Nc1ccc(O)cc1 210743395 KIIJBLJMUPZPSB-XMHGGMMESA-N 442.562 4.498 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1C(C1CC1)C1CC1 734881253 YJMTZFYCGNHHQL-XFFZJAGNSA-N 431.320 4.274 10 10 IICE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NCCCSc1nccs1 742668837 BVKFYOXWHBGIFJ-UHFFFAOYSA-N 429.596 4.223 10 10 IICE COc1cccc(F)c1[C@H](C)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743661433 XTGFLWIVRYHQLG-LSDHHAIUSA-N 437.462 4.465 10 10 IICE CCOC(=O)c1sc([C@@H](C)NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)nc1C 756935670 YQPAOTSNZZQCEA-QGZVFWFLSA-N 444.601 4.425 10 10 IICE COC[C@H](NC(=O)NCc1cc(Br)ccc1O)c1cccc(C(F)(F)F)c1 806829822 WOZKTABJSSBBRI-HNNXBMFYSA-N 447.251 4.360 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@](C)(CNC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1130185443 HXXASIJHWAEVCW-DFBJGRDBSA-N 447.620 4.215 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@@H]1CCCCO1 1130494074 AZHSBDYDZLGACO-WPKOWNOESA-N 438.640 4.193 10 10 IICE C[C@H](c1ccc(Br)cc1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 1138501093 MAOOTTVZQGVYIQ-LJQANCHMSA-N 444.417 4.165 10 10 IICE O=C(Cc1c[nH]c2ccc(Br)cc12)NCc1cccc(Br)c1O 1139975095 UCLIBHCZEUBPKV-UHFFFAOYSA-N 438.119 4.257 10 10 IICE CC(C)CN(CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)C(=O)OC(C)(C)C 1142712969 LRENFTPKFFPJBP-JOCHJYFZSA-N 447.620 4.153 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC4(CC(OC)(OC)C4)[C@H]3C(C)C)ccc21 1163813010 OOCKBARNSXPETO-JOCHJYFZSA-N 428.573 4.154 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cccc(F)c1F 1192803164 PEUNRARMVMHOAF-UONOGXRCSA-N 434.442 4.418 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCC[C@H]1CCCN1C(=O)OC(C)(C)C 1228516547 KQDHOUPWXQODMP-NRFANRHFSA-N 432.609 4.464 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](Cc3ccccc3)c3ccccn3)CC2)cc1F 1251416816 FDQQQEGFILLBKL-HSZRJFAPSA-N 434.515 4.045 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1271357826 ZVHALZFMXCUURN-QMMMGPOBSA-N 425.659 4.175 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1276283386 FLJYRBDWURXBLA-VLUSQRCCSA-N 449.595 4.157 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Br)ccc3OC(F)F)C2)cc1 1278860703 ADZHWAJYYKXXMP-CYBMUJFWSA-N 441.272 4.068 10 10 IICE C[C@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1301350747 XVMOYOGOJHQSNQ-MRXNPFEDSA-N 436.474 4.041 10 10 IICE Cc1cncc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1Cl 1320550602 PEXGAOWTKZKVSS-ZDUSSCGKSA-N 448.862 4.003 10 10 IICE CC(C)CCn1nccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1352510481 ODYOOGUNDRCXDC-LGMDPLHJSA-N 446.573 4.298 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3nc(-c4ccccc4)cs3)cc2F)C[C@H](C)O1 1354657330 KPAUSDDDPYOWFZ-HOTGVXAUSA-N 425.529 4.493 10 10 IICE Cc1nc(-c2c(C)noc2C)sc1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1357128218 KYFLVSRTFZBRHG-ZDUSSCGKSA-N 426.542 4.051 10 10 IICE CCOC(=O)[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1440471887 NVFGMUYVFWQEBS-INIZCTEOSA-N 433.346 4.272 10 10 IICE CC(C)(C)OC(=O)/C=C\c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)co1 1446571571 YMPGUBGYYXWXNX-JPMGXVIASA-N 427.497 4.162 10 10 IICE CC[C@H]1COC(C)(C)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1461378134 POQZJKKPVUROAC-HNDQUVLASA-N 438.640 4.146 10 10 IICE CC(C)c1ncsc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324383 DIHQEMQRTNCRFJ-QGZVFWFLSA-N 432.590 4.328 10 10 IICE CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2Cc3cccc(O)c3C2)c1 1471355675 QLOGYDYGWNXYBB-UHFFFAOYSA-N 442.924 4.027 10 10 IICE COc1cc2c(cc1OC)CN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)CC2 1479064597 UILKACSAQBUKOY-UHFFFAOYSA-N 433.552 4.422 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1513094552 UCDKSESKQSYGTM-UGKGYDQZSA-N 443.661 4.254 10 10 IICE CCc1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1525308374 ACRZPHIGEWTYJO-GZTJUZNOSA-N 434.583 4.357 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(I)c(F)c1 1525761903 IFUAEOCXNFGDOQ-CYBMUJFWSA-N 440.300 4.166 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@]12C[C@H]1CCCN2C(=O)OC(C)(C)C 1540543256 GKFMRMWWVLXPBF-NLFFAJNJSA-N 427.589 4.425 10 10 IICE CCC[C@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1546955560 YFXWXIIDBYWWQR-GGAORHGYSA-N 441.620 4.072 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C(F)(F)c1ccccc1OC 1556426373 JZFCICAKKSGUIG-UHFFFAOYSA-N 434.483 4.176 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1nc2ccc(Br)cn2c1F 1557139689 JNXKNNNHHSVDFJ-UHFFFAOYSA-N 431.309 4.156 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](C)CN3CCN(c4ccccc4)CC3)c2C)c1 1565886529 OCVFBGJWTCWFLY-OAQYLSRUSA-N 430.596 4.343 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@@]3(C)c3cccc(Br)c3)C2)cc1 1584444637 VERPQSYCTQFFOL-HNKPZJSLSA-N 443.385 4.378 10 10 IICE CC[C@@](C)(NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2)C(N)=O 1585333956 OCLHQIBCUYHWHI-DRTHVRHMSA-N 442.563 4.171 10 10 IICE CC[C@@H](Cc1ccc(F)cc1)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1586022964 WUXWOOCXBYXIJC-INIZCTEOSA-N 446.434 4.260 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(F)cc1F 1595435856 NBGJXFXRLXNZJK-OAQYLSRUSA-N 445.510 4.447 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H](C)Sc3nc4ccccc4s3)C2)cc1 1598364175 OACQHMALBASBLO-JKSUJKDBSA-N 427.595 4.428 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(-c4ccc(Cl)s4)on3)cc2F)CC1 1616496945 ZYDNKQKUYULNMI-UHFFFAOYSA-N 448.951 4.268 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(Cc4ccccc4)CCOCC3)cc2F)C[C@H](C)O1 1626159052 QREYUOPUGMWLTO-PMACEKPBSA-N 440.559 4.095 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)nc2)c(C)n1-c1cccc(C(C)C)c1 1629314061 CNRKVOWOPDKMSA-UHFFFAOYSA-N 445.611 4.294 10 10 IICE COCCn1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 1630256954 IRWROHCGRUMJCW-LJQANCHMSA-N 441.959 4.041 10 10 IICE CCCCN1C(=O)C[C@@H](C(=O)NCc2ccc(N(C)C)cc2C)[C@@H]1c1ccc(OC)cc1 1633340148 CDHNYFGMFZREAS-NOZRDPDXSA-N 437.584 4.076 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCC12CCN(C(=O)OC(C)(C)C)CC2 1633818088 DOBXYLQJEHBNCX-HKUYNNGSSA-N 446.588 4.353 10 10 IICE CC(=O)N1CCN(Cc2ccc(NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)cc2)CC1 1637385292 UVDFCARKEYONNJ-UHFFFAOYSA-N 444.579 4.319 10 10 IICE COc1ccc(N(C)CC(=O)N2CCN(Cc3ccc(C(C)C)cc3)CC2)cc1Cl 1644865872 KECOVGUEJQMWSY-UHFFFAOYSA-N 429.992 4.253 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccccc2)c2nc(O)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1648697070 XZOJJJHUELCTAR-NRFANRHFSA-N 449.942 4.214 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)CC1CCCCC1 1652332735 CVMUOPMTUZVDSE-PMACEKPBSA-N 433.612 4.348 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3c(Cl)cccc3OC(F)F)C2)cc1 1682188571 UTZJSKZWGOHKHJ-CQSZACIVSA-N 439.890 4.276 10 10 IICE C[C@@H]1CCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1693735032 RUTOVVUXZPWHCV-GOSISDBHSA-N 436.579 4.390 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1697962991 FEEPTMLIXFHQBZ-FQEVSTJZSA-N 437.588 4.394 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC1=CCCCC1 1710722083 SMVLSCBAFWQCDQ-UHFFFAOYSA-N 439.604 4.430 10 10 IICE C[C@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CCCSc2nccs2)C1 1743138441 SMAWDEVAIBRXDP-AWEZNQCLSA-N 430.559 4.338 10 10 IICE CCc1cnc(CCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1764564339 HICUQWGETILAOS-LJQANCHMSA-N 427.574 4.123 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCOC4)n3CCC=C(C)C)CC2)cc1F 1768705213 ZAEFAYBVTAVIQO-IBGZPJMESA-N 443.567 4.003 10 10 IICE Cc1cc(C)c2oc(=O)c(C(=O)N[C@H](c3ccc(N(C)C)cc3)c3nccn3C)c(C)c2c1 1866296882 JYWSSHLTRZBORA-JOCHJYFZSA-N 444.535 4.037 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCc3cccs3)C(=O)N(C3CC3)C2=O)cc1 1873169053 WURBUDJJYXRCPU-UHFFFAOYSA-N 431.561 4.230 10 10 IICE O=C(N[C@]1(c2ccc(F)cc2O)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952760651 HBBBMIQHAYLFOM-OFVILXPXSA-N 433.435 4.370 10 10 IICE CCN1CCc2cc([C@H](O)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044715750 WSHQOYYXQQPABO-XMMPIXPASA-N 439.600 4.129 10 10 IICE CC(C)(C)OC(=O)NCC1CC2(C1)CC(NCc1ccc(Br)cc1O)C2 2108259389 RQDMJRWLLAVRGN-UHFFFAOYSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@H](NCc1ccc(Br)cc1O)C2 2226145297 VSJKWBNERXJKBY-JLJPHGGASA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)c1O 2236048567 FCVBNEDONOQGJK-BBRMVZONSA-N 443.382 4.336 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@@H]1[C@@H](NCc1cc(Br)cc(F)c1O)C2 2358980133 CLTRIGBHPLJMLF-WGHIXYSZSA-N 443.357 4.465 10 10 IICE CCN1C(=O)/C(=C\c2ccc(OCCOc3ccccc3OC)c(OC)c2)SC1=S 6178473 NHSALDQBAYKGHU-XSFVSMFZSA-N 445.562 4.383 10 10 IICE COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(\C)Nc1ccc(Cl)cc1C 17095638 FYPKFPIDTZHGIL-KGENOOAVSA-N 427.888 4.309 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(Br)cc1 33247358 NDKWUEPTXMSQSJ-NTEUORMPSA-N 437.315 4.134 10 10 IICE CCN1CCN(c2cc(C)c3cc(NC(=O)/C=C\c4ccc(OC)cc4)ccc3n2)CC1 38153922 BYSCWUNLAIWJED-GHXNOFRVSA-N 430.552 4.346 10 10 IICE CCOc1ccc(NC(=O)COc2ccc(Cl)cc2/C=C2\SC(=S)NC2=O)cc1 39794075 AOOQOEYHTNNZFJ-YVLHZVERSA-N 448.953 4.245 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cccc(C)c4C)c3[N+](=O)[O-])CC2)cc1 40611154 RZQJWLONBAJRTR-UHFFFAOYSA-N 434.500 4.080 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)C3CCCCC3)CC2)c(C)n1-c1ccc(F)cc1 62694493 GDQMPBNZORYBDL-UHFFFAOYSA-N 425.548 4.140 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(N(C)C)c3)[C@H]2c2ccc(O)c(O)c2)cc1 526503987 MGPOJNKXCTULRU-QHCPKHFHSA-N 432.476 4.230 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3cccc(Cl)c3)c(C)s2)cc1 733730709 DXYNGUPMAVPAGD-UHFFFAOYSA-N 436.942 4.288 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCC[C@H]1CCCCO1 754774021 DIGNBMCPGSSMBT-LBFFYKKLSA-N 425.597 4.232 10 10 IICE C[C@H](CCCC(F)(F)F)NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 755313546 RXLJJNPCEDAWKI-QGZVFWFLSA-N 426.527 4.139 10 10 IICE C[C@@H](NC[C@@H](CO)c1ccccc1)c1cc(Br)cc(Br)c1O 756636917 XSQJNGXOIWNPEF-YPMHNXCESA-N 429.152 4.344 10 10 IICE Cc1ccc(NC(=O)NCc2cc(Br)ccc2O)c(OC[C@@H]2CCCO2)c1 806228895 ODFRFUKDSRDYDA-INIZCTEOSA-N 435.318 4.343 10 10 IICE CCOc1ccc([C@H](O)C2CCN(c3ccc(/C=C/C(=O)OC)cc3[N+](=O)[O-])CC2)cc1 812482418 WXHWVYXSZUJNQU-REHZOHHSSA-N 440.496 4.130 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3CCN(c4ccccc4Cl)C3)cc2F)C[C@@H](C)O1 1125187534 GIPWMPBZHUHJTG-LMMKCTJWSA-N 445.966 4.235 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127267738 LKNSQFHSMSJBKZ-UHFFFAOYSA-N 443.538 4.026 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(F)c(NC(=O)OC(C)(C)C)c3)C2)cc1 1129991746 XCERDDALGCVHAO-MRXNPFEDSA-N 443.519 4.438 10 10 IICE C[C@H](NC(=O)C1(Nc2ccccc2)CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O 1151892229 LXGWLQZRIUUXAQ-SFHVURJKSA-N 439.556 4.451 10 10 IICE CN(CCC(F)(F)F)[C@@H](CNC(=O)c1c(F)ccc(O)c1O)c1ccc(Cl)cc1 1161319746 OVTXFVHDEBORMK-AWEZNQCLSA-N 434.817 4.246 10 10 IICE CC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1F 1189682293 AEKRHUQFOZAVQG-CQSZACIVSA-N 438.952 4.397 10 10 IICE CC(C)(C)C[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1 1192652073 AWDFAHNTBCRMSB-JOCHJYFZSA-N 445.554 4.185 10 10 IICE COc1ccc(CNC(=O)N[C@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)c(O)c1 1253016124 GDPGFMLJFMUAFY-IBGZPJMESA-N 427.501 4.235 10 10 IICE CCC[C@H](NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2)C(N)=O 1271906010 LZNFOSRZKQMQOY-NGIFANIDSA-N 442.563 4.171 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCc3ncc(-c4ccccc4Cl)o3)C2)cc1 1278862111 XILWKQDPINTQHQ-INIZCTEOSA-N 425.916 4.331 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)n1-c1ccon1 1292593817 JGGYBXLKCKYGSP-UHFFFAOYSA-N 430.455 4.082 10 10 IICE CCOCCC1(Cn2c(-c3cnn(C)c3)nnc2N(C)Cc2ccccc2O)CCCC1 1297434880 USLPWAZWWJFSNK-UHFFFAOYSA-N 438.576 4.008 10 10 IICE CC(C)[C@H]1CN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CCS1 1302772266 AEKUBPOUTRVGCQ-MRXNPFEDSA-N 434.660 4.490 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@H](C)c3ccc(C(F)(F)F)cc3)CC2)cc1 1349007036 ZKFBZCCWKOJCQN-GOSISDBHSA-N 449.517 4.146 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1351559120 YHJZILVZRBDIIZ-NFECSFHCSA-N 426.538 4.395 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCCCCC1 1354371540 OJRFJSSFPDZJJG-NRFANRHFSA-N 431.577 4.342 10 10 IICE COc1cccc(C(F)(F)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1435334124 SONGTJCLTNZWHD-HNNXBMFYSA-N 426.410 4.174 10 10 IICE CCCCOc1c(Cl)cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1OC 1438887382 PVGIRBOYZOPPEW-UHFFFAOYSA-N 445.991 4.209 10 10 IICE Cc1cc(CC(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)c(C)n1-c1ccccc1 1447621311 YJCBZBJLQAJKPM-UHFFFAOYSA-N 431.580 4.404 10 10 IICE CCO[C@H]1C[C@](CO)(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1447795986 IALPCSXSXNLELT-SIKLNZKXSA-N 449.389 4.153 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl 1449126938 VSTPHWXTEBUZRT-UHFFFAOYSA-N 445.825 4.061 10 10 IICE C[C@H](NC(=O)CSCc1nc(O)c2c3c(sc2n1)CCCC3)c1ccccc1O 1454817755 LRPBYSWNCDPPOX-LBPRGKRZSA-N 429.567 4.092 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(c1)OCCN(C(=O)OC(C)(C)C)C2 1463750916 HHVMAVRKWLKOAP-UHFFFAOYSA-N 439.556 4.154 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1)C1CCCCC1 1464536378 KZXQRDULGBHULH-LJQANCHMSA-N 441.494 4.235 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 1469104658 QUOJZXCCWWQBRT-RPHTVSPISA-N 429.605 4.144 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCc3ccc(O)cc32)c(C)n1-c1ccc(Br)cn1 1470253673 JZZDSVMYWJOJQY-LJQANCHMSA-N 426.314 4.375 10 10 IICE COc1ccc(N2CCN(CCCC3CCN(C(=O)OC(C)(C)C)CC3)CC2)c(OC)c1 1473732068 AEBPGWGFNMWTEO-UHFFFAOYSA-N 447.620 4.253 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCC(=O)NC(C)(C)C 1509134383 ZUNAIQBPPQAXFK-UHFFFAOYSA-N 440.636 4.018 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C[C@@H](C)S1 1512434250 YDWJPJCGTFFWHN-HUUCEWRRSA-N 432.644 4.309 10 10 IICE CC[C@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1513469280 UQFPQQBFGJSFOU-GOSISDBHSA-N 429.565 4.191 10 10 IICE CCOC(=O)c1c(NC(=O)c2nc(OC)cc(OC)n2)sc(C)c1-c1ccc(F)cc1 1531749605 KWHIIDXPZJWZIF-UHFFFAOYSA-N 445.472 4.099 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3ccc(C(C)(C)C)cc3)CC2)c(OC)c1 1534278359 XIKUJAJXTUYMSR-UHFFFAOYSA-N 428.598 4.442 10 10 IICE COc1ccc(CN2C[C@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1544080737 PXNRMUDFEFLTFE-HSZRJFAPSA-N 445.563 4.076 10 10 IICE CC[C@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1545965409 XEVAUTYRJKHPDD-LJQANCHMSA-N 440.979 4.210 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1548235220 WJTPIBGBVQQLHE-UHFFFAOYSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCN(c3nnc(CC4CCCC4)n3CC(F)(F)F)CC2)cc1F 1554961169 YKVSMTKPAPLMNR-UHFFFAOYSA-N 441.473 4.047 10 10 IICE CC(C)(C)OC(=O)NC[C@@]12CCCC[C@@H]1CN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1558856722 GWIWXUDPLHFPGM-IQMFZBJNSA-N 446.569 4.470 10 10 IICE COC(=O)C[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(F)cc1 1597375516 HHKBMIFEXNEUGL-QHCPKHFHSA-N 436.483 4.009 10 10 IICE CC[C@@H](C)[C@H](Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1613137248 BSBQAMWEMDBBBA-XXBNENTESA-N 441.620 4.332 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC[C@H]3C[C@H](F)C3)CC2)cc1F 1619302675 XVHTVNOIYACRRK-QAQDUYKDSA-N 433.547 4.188 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CCCN3Cc3ccc(Cl)cc3)CC2)cc1 1630718258 SOWWNDGYYJYGSQ-HSZRJFAPSA-N 427.976 4.052 10 10 IICE CCn1cc(Br)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635940300 BJJPZOIPWIPAAW-MRXNPFEDSA-N 440.769 4.024 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3nnc4ccc(Br)cn34)c2C)cc1 1636910133 JLIKTUUFNGZVOX-UHFFFAOYSA-N 440.301 4.160 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@](C)(C(F)(F)F)C1 1655517783 DXJGXBKKVHZHFA-DMZKTXOQSA-N 430.426 4.063 10 10 IICE CCCN(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1683420936 BDVRZPNTLWLYRZ-DENIHFKCSA-N 446.636 4.423 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1684444203 KPQITWUPCVMXDG-NRFANRHFSA-N 440.588 4.335 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2COC(C)(C)OC2)n1Cc1ccc2c(c1)CCCN2C 1694002509 DMAVTAMFPIUONB-GOSISDBHSA-N 441.620 4.058 10 10 IICE C#C[C@]1(C)CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@](=O)CC 1705669232 GUCFRWOYRAOIML-NLGDKJDOSA-N 449.624 4.113 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC(C)(C)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1707828674 ZAHBDGMLQLFJQE-UHFFFAOYSA-N 439.583 4.020 10 10 IICE CCCCN(CC)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709616391 AREXUYJAISAATJ-HSZRJFAPSA-N 441.620 4.013 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H](Cc2cnn(C)c2)C1 1724235512 OVVSXBHHXDKMLS-HXUWFJFHSA-N 449.647 4.092 10 10 IICE CC[C@H]1CCCN1c1nnc([C@H](C)CC)n1Cc1ccc(N2CCC(CO)CC2)cc1 1743713903 NDPQFTDRCPIIBF-KNQAVFIVSA-N 425.621 4.427 10 10 IICE CC(C)C(C)(C)Cn1c([C@H]2CCC(=O)N2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1760860410 LDMGQRQCUYEHFF-OAQYLSRUSA-N 438.620 4.148 10 10 IICE COc1ccc(NC(=O)CNCc2cc(Cl)cc(Br)c2O)cc1Cl 1860721002 BFDFHSDXCKCXOB-UHFFFAOYSA-N 434.117 4.198 10 10 IICE [N-]=[N+]=NCC1CCN(C(=O)c2ccc(I)c(Br)c2)CC1 1912188269 NEVVXPXEJMTLCQ-UHFFFAOYSA-N 449.090 4.216 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@](NCc3cc(Br)cc(F)c3O)(C2)C1 2116629134 HCIOILLSMNCFOF-HXPMCKFVSA-N 429.330 4.173 10 10 IICE CCOc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1cccc(C)c1 2297347729 XMGZEMTWEMXHLT-UHFFFAOYSA-N 431.448 4.063 10 10 IICE O=C(NN1C(=O)C(=Cc2c(Cl)cccc2Cl)SC1=S)c1cccc(O)c1 2314926961 WIIYFHFXTZFDQF-UHFFFAOYSA-N 425.318 4.245 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[C@H](NCc1cc(Br)cc(F)c1O)C2 2329447219 UQPBQMJGBVNJLR-DETPVDSQSA-N 429.330 4.029 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccc(NC(C)=O)cc3)N=C2c2ccccc2)ccc1O 12379623 WIJRTCUVGNJOPY-KGENOOAVSA-N 427.460 4.194 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S 40888212 VIYQNLNOJXCUAC-RGEXLXHISA-N 427.547 4.420 10 10 IICE COCCOC(=O)c1ccc(N[C@H](c2ccncc2)c2ccc3cccnc3c2O)cc1 54620245 JMKONBKOEYOBEY-JOCHJYFZSA-N 429.476 4.340 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CNC3(c4ccc(Cl)cc4)CCCCC3)nc12 60343278 LBKCZCIXUCQGMZ-UHFFFAOYSA-N 428.920 4.214 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cccc(Br)c3)n2)cc1 325127295 FMBHNYZSJHKOAI-UHFFFAOYSA-N 425.329 4.382 10 10 IICE CCC(=O)N(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1ccc(CC)cc1 586264316 ORHVUYOCTANTFS-UHFFFAOYSA-N 447.512 4.156 10 10 IICE Cc1cccc2[nH]cc(CCNC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)c12 728596970 LCSQGSDKXRLQLZ-QZTJIDSGSA-N 438.547 4.271 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)cc1 728837701 XFKKPGQGTJOJQV-HXUWFJFHSA-N 449.473 4.075 10 10 IICE CC(C)[C@@H](NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2)C(N)=O 730509229 RNEQTYXSCBKGFP-VIESLWHTSA-N 442.563 4.027 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)cc1 751060329 ATCVVICAQYVKRS-PMOQBDJRSA-N 439.987 4.496 10 10 IICE C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754660446 GPRHVNXDRUPSCD-SJLPKXTDSA-N 433.499 4.235 10 10 IICE CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3ccc4nc(C)sc4c3)n2)cc1 794003459 WIZOSBZQMBTQHS-UHFFFAOYSA-N 444.563 4.487 10 10 IICE COc1ccccc1SCc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCO1 812261878 UAORWQWCRQDQBF-GOSISDBHSA-N 440.569 4.100 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(OCc2cccc(F)c2)cc1 1084555265 SZCUPYVVBAMSKX-BKUYFWCQSA-N 434.398 4.210 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1c(F)ccc(Br)c1F 1129974147 NLZCVQUIQXXSGY-CYBMUJFWSA-N 425.317 4.392 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4cccc(Cl)c4F)no3)CC2)c(OC)c1 1132032284 QYCKOALLMJQALM-UHFFFAOYSA-N 445.878 4.114 10 10 IICE C[C@@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1)c1ccc(N(C)C)cc1 1138363541 NXYGKXYVLFCULB-MRXNPFEDSA-N 441.528 4.184 10 10 IICE CCc1ccc(-n2nc(C(=O)NCc3cccc(Br)c3O)c3c2CCC3)cc1 1156792758 PJWBUAMVRGJRII-UHFFFAOYSA-N 440.341 4.322 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)c1 1160599242 GSOIOOLXQSMBDD-UHFFFAOYSA-N 434.471 4.218 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)[C@H](C)C2)cc1 1264916033 SNMMBRKKXLSBJU-HXUWFJFHSA-N 445.563 4.161 10 10 IICE Cc1cc(C(=O)Nc2ccc3nc(O)[nH]c3c2)c(C)n1-c1ccc(Br)cn1 1290334405 BGQUDIDHGOEUOP-UHFFFAOYSA-N 426.274 4.086 10 10 IICE CC[C@H]1CCCN1c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1293411714 ONECSDYPYQWQDR-NRFANRHFSA-N 438.620 4.080 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 1295406944 ZXOMRZRMKXRPPL-XHPAXPNTSA-N 444.572 4.103 10 10 IICE Cc1cc(N2CCC[C@@H](NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)n(C)n1 1297187533 KOXFIZPGMAHKKO-LJQANCHMSA-N 425.964 4.188 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(CCn2ccnc2)Cc2cnn(C)c2)c1 1297663012 WKCWYVGZMRAJLY-UHFFFAOYSA-N 436.947 4.020 10 10 IICE CC(C)(C)OC(=O)NC1[C@H]2CCC[C@H]1CC(C(=O)NCc1ccc3cccnc3c1O)C2 1299724203 COICYMPMMYMYGW-BEEJXANESA-N 439.556 4.276 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCC3CCN(CC(F)(F)F)CC3)c2C)c1 1312502111 ZXJTVZWGSNJZRC-UHFFFAOYSA-N 436.522 4.476 10 10 IICE CO[C@H](C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1)[C@@H]1CCOC1 1353908920 VNWWHYJMKSZXGS-QRWLVFNGSA-N 429.517 4.347 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccccc3CNC(=O)OC(C)(C)C)CC2)cc1 1355030476 BSUVZFVJQARHLA-UHFFFAOYSA-N 439.556 4.072 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(Br)cnc3C3CC3)CC2)cc1 1358140613 OTGWDYKBVGIAMO-UHFFFAOYSA-N 430.346 4.083 10 10 IICE Cc1ccc(CN(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1361124736 HKJACGRXBMYWLG-BOPFTXTBSA-N 434.583 4.446 10 10 IICE O=C([C@H]1CCc2cc(Br)ccc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446566420 KUIMKUYVBQJMDJ-ICSRJNTNSA-N 430.342 4.392 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Nc2nc(C)cs2)cc1 1446816230 MVYSZFNLPQTMSU-UHFFFAOYSA-N 445.928 4.370 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C/C(=O)N2CCN(C3CC3)c3ccc(F)cc32)C1 1448022762 RCFYIZDIBVPTTB-CEUCYRDJSA-N 429.536 4.344 10 10 IICE CC(C)c1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cnn1-c1ccc(F)cc1 1453980160 DSIZDITXWOYZCN-UHFFFAOYSA-N 436.531 4.026 10 10 IICE C[C@@H](NC(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1)c1ccccc1O 1471194474 UEZOSEAPGQOFRE-GFCCVEGCSA-N 429.270 4.491 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](CCO)c1cccc(C(F)(F)F)c1 1478840349 AMAPQWMRUYPIMS-HRAATJIYSA-N 437.506 4.434 10 10 IICE CCN(CC)[C@@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1cccc(C(F)(F)F)c1 1526034861 BCWACMJJXOWBCB-JOCHJYFZSA-N 449.517 4.446 10 10 IICE COc1ccc(N2C[C@@H](NC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)CC2=O)cc1 1528203441 WPWDUQUSKRAOFW-KRWDZBQOSA-N 437.927 4.291 10 10 IICE Cc1ccc(OCCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(Cl)c1 1528262071 UMESRQWNHGKQDD-UHFFFAOYSA-N 438.902 4.239 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](F)c3ccc(C(F)(F)F)cc3)cc2F)CC1 1530376741 NCVCGFBYOUGQBG-HXUWFJFHSA-N 441.444 4.313 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(Cl)c4occc34)CC2)cc1 1531525307 URIYEVWUUNZRIX-UHFFFAOYSA-N 427.932 4.037 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(Cl)cc3Cl)CC2)c(OC)c1 1534283784 WWCLVRGJVTXERR-AWEZNQCLSA-N 439.339 4.127 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)C(F)(F)F)cc3)cc2)CC1 1543143243 WVWCAORUMINIOX-UHFFFAOYSA-N 440.487 4.146 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1[C@@H]1CCCOC1 1544676803 MYVYWJFPZUKWKL-LVCYWYKZSA-N 443.563 4.139 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(c3cnn(C)c3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545415919 SFWWTNFOEODIBD-QGZVFWFLSA-N 439.583 4.163 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)C(F)(F)c1ncccc1Br 1556883874 GNHKZRWTNAJQOD-UHFFFAOYSA-N 426.044 4.265 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CC1 1564945418 AZYDKUAFVNXKFI-ZJOUEHCJSA-N 446.636 4.375 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H]3Cc3cc(F)ccc3F)C2)cc1 1564962730 OKFSMKAHQBZWLM-UWJYYQICSA-N 429.511 4.216 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2c(F)cncc2F)c(C)n1-c1ccc(Br)cn1 1568787170 BQSVUHPTBURULQ-LLVKDONJSA-N 435.272 4.416 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCCCC2)cc1 1583622335 PXNAWNXJUBGYPS-NRFANRHFSA-N 433.593 4.063 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c(C)o1 1584504704 XPJCCRRQSSZLRX-UHFFFAOYSA-N 447.535 4.151 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)CC(C)C)CC2)c(C)n1-c1ccccc1Br 1596429892 DVAXKYBRGRMTPA-UHFFFAOYSA-N 446.389 4.187 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCOC3(CCSCC3)C2)cc1-n1c(C)cc(C=O)c1C 1596670485 UKUHLFLUDPSHKH-NRFANRHFSA-N 426.582 4.390 10 10 IICE CC(C)Oc1ccc(N(C)C(=O)c2c[nH]nc2[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 1616199247 SUEJKRZQVDNKTJ-MRXNPFEDSA-N 428.533 4.198 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)c2ccccc2Br)N(C)C)cc1 1616866542 FKAKZFJLSUIISO-FQEVSTJZSA-N 432.406 4.212 10 10 IICE Cc1ccc(C(=O)NCCCN(C(=O)C2CCC2)C2CC2)cc1-n1c(C)cc(C=O)c1C 1617259954 BIVGUVSRTFYTFX-UHFFFAOYSA-N 435.568 4.126 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCCN1CCCCCC1=O 1617939392 BVTVHBMVFXTAQS-UHFFFAOYSA-N 425.577 4.070 10 10 IICE CSCCCCn1c(Cc2cn3ccccc3n2)nnc1N(C)Cc1ccccc1O 1620280328 QZYJPHQAJJROES-UHFFFAOYSA-N 436.585 4.002 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 1628204370 VLCFTJGHDGRMGE-JOCHJYFZSA-N 425.479 4.218 10 10 IICE COc1ccccc1[C@H](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)N1CCCC1 1628258537 AHFHXPPOOIBVJE-VWLOTQADSA-N 445.563 4.482 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1oc2ccccc2c1Br 1628854029 FARUSEZAJYYPSR-UHFFFAOYSA-N 429.314 4.304 10 10 IICE CCc1ccc2c(c1)[C@H](CCNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)C(=O)N2 1629322133 AHQHAWTUATZEMM-FQEVSTJZSA-N 429.520 4.325 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630262664 OHKCFRINCXJTOG-DLBZAZTESA-N 437.371 4.065 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(NC(=O)Nc2ccccc2)cc1 1630480676 FHLDBOQALBGJSU-UHFFFAOYSA-N 447.491 4.242 10 10 IICE Cc1cc(C(=O)NC[C@]2(O)CCc3ccccc32)c(C)n1-c1ccc(Br)cc1 1631214642 RTADOSDWRCCGHS-HSZRJFAPSA-N 439.353 4.420 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@@H](C(=O)NCc1cc(Cl)ccc1O)C2 1632228733 RFFOBEHUJFGZKG-GOSISDBHSA-N 434.895 4.476 10 10 IICE Cc1nc2cc(O)nn2c(C)c1CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1632697284 KBIOZEHQJZNTGC-KRWDZBQOSA-N 430.508 4.090 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C[C@H]2c3ccccc3CN2C(=O)OC(C)(C)C)c1 1636061839 YVFVFMYWNSUMCE-YWZLYKJASA-N 426.513 4.460 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1 1637102317 LVAGDIQDCHDGHV-QZTJIDSGSA-N 436.339 4.239 10 10 IICE Cc1cc(C(=O)N[C@H]2CCOC23CCCCC3)c(C)n1-c1ccc(Br)cn1 1646162731 IEYJWSCMKNJFER-SFHVURJKSA-N 432.362 4.473 10 10 IICE CC(C)CN1C[C@H]2CN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CCN2C1=O 1653494492 VPVJAJKXQOBSJG-JOCHJYFZSA-N 434.544 4.118 10 10 IICE Cc1cc(C(=O)Cn2nnc3ccccc3c2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 1656082597 RTNMGNHKQCKLPH-UHFFFAOYSA-N 427.291 4.389 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H]2CC[C@@]21CNC(=O)OC(C)(C)C 1673744432 LUWYGNRSXVLXQL-DMJCMNNJSA-N 444.620 4.081 10 10 IICE C[C@@H](NC(=O)NCc1ccn(-c2ccc(Br)cc2)n1)c1ccc(N(C)C)cc1 1681552568 PDNGQJBLWCVFAH-OAHLLOKOSA-N 442.361 4.261 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCc1ccc(OCC(F)(F)F)nc1 1686203098 MNSHDQDKJDXWAO-UHFFFAOYSA-N 436.478 4.007 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC(OCC2CC2)CC1 1693005182 FDMZOULCQLDNJK-UHFFFAOYSA-N 425.621 4.295 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694803824 IYXNGEUSYILQRW-GHTZIAJQSA-N 429.584 4.125 10 10 IICE CN(CC(C)(C)C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1696660535 BHJNMFZJQJLLMC-UHFFFAOYSA-N 436.604 4.013 10 10 IICE C=C(C)CN(CC)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1705717369 IPKPNHXMOMKJIE-NRFANRHFSA-N 441.645 4.176 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)CCO1 1709547871 MLBLQKUAFSDVOP-JOCHJYFZSA-N 437.588 4.394 10 10 IICE C[C@@H]1CCC[C@H](N(C)c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1726520850 MHPDLCACMIUGRT-SJORKVTESA-N 448.662 4.168 10 10 IICE CO[C@@H](Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1729882885 KXVDNNXULKSNHL-UNMCSNQZSA-N 441.620 4.080 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)cc1C 1731107756 NSIJGTDSPDTTBH-QUCCMNQESA-N 431.650 4.173 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1743287370 UCKDGIOUXDAASJ-CABCVRRESA-N 425.649 4.100 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C[C@@H](C)O1 1745001416 JHMDYKIQIZSUII-NNMXDRDESA-N 437.588 4.391 10 10 IICE C[C@H](CN(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1761391679 YEBPIVGNIZSLHD-DNVCBOLYSA-N 444.580 4.079 10 10 IICE CC1=NN(c2ccccc2)C(=O)C1=Cc1cc(C)n(-c2cc(C(=O)O)cc(C(=O)O)c2)c1C 2313565199 ZSDWVLAYJQNGGW-UHFFFAOYSA-N 443.459 4.297 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(CCCCCC(=O)O)C1=O)C(C)=O 2314928036 OZHMUYZRLPFGSR-INIZCTEOSA-N 435.567 4.279 10 10 IICE Cc1ccc(CN[C@]2(C)CN(C(=O)OC(C)(C)C)CC2(F)F)c(O)c1Br 2352944648 KPBFKQOUSYLGND-QGZVFWFLSA-N 435.309 4.197 10 10 IICE CC[C@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccc(C)cc3)s2)C1=O 11636323 YJNOBXOVSNXFFV-MRXNPFEDSA-N 433.624 4.400 10 10 IICE Cc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(C(C)C)C1=O 39835867 YQGRFAFESHEBAG-SFQUDFHCSA-N 437.546 4.405 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)OCC(=O)N3)c(C)n1-c1cccc(Br)c1 195589022 GUHSDNUHIYBYQU-UHFFFAOYSA-N 440.297 4.440 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccccc2OC(F)F)C1 435668145 VBOAFBUCRUHCDK-UHFFFAOYSA-N 427.495 4.326 10 10 IICE Cc1nc([C@H]2CCCCCN2C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)no1 436035320 CRDARXGFKWKRPJ-HSZRJFAPSA-N 435.572 4.243 10 10 IICE C[C@H](NCc1cc(Br)cc(F)c1O)C1CCN(C(=O)OC(C)(C)C)CC1 715745173 ODFYLGOPLXWMPW-LBPRGKRZSA-N 431.346 4.419 10 10 IICE C[C@H]1CN(Cc2cccc(NC(=S)NCCCN(C)c3ccccc3)c2)C[C@@H](C)O1 737449816 PSZHQDZZZKCPRJ-BGYRXZFFSA-N 426.630 4.109 10 10 IICE CC(C)[C@H](C)CNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 739631756 YNBZWLFAEKVAHC-PWDRSIHYSA-N 441.416 4.059 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](c1ccc(F)cc1)C(F)(F)F 792501207 MMZUKLRHZRVIRL-LJQANCHMSA-N 443.416 4.029 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 804646406 BKPXUACMBZTQDW-UHFFFAOYSA-N 430.961 4.172 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)N2C[C@@H](C)Cc3cc(C(F)(F)F)cc(Cl)c32)c1 1133395341 ZDGGUFNTRWSPRC-PCAWENJQSA-N 437.849 4.352 10 10 IICE C[C@@H](c1ccc(Br)cc1)N1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 1138501090 MAOOTTVZQGVYIQ-IBGZPJMESA-N 444.417 4.165 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@@](C)(C(F)F)C2)c(C)n1-c1ccc(Br)cn1 1167341458 HMPLPJNACBDIFV-CWTRNNRKSA-N 442.304 4.136 10 10 IICE CC[C@H](Cc1ccccc1Br)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1167762559 OMQVUSSXKODASS-GOSISDBHSA-N 445.401 4.295 10 10 IICE Cc1cc(CC(=O)Nc2ccc(CN3CCOCC3)cn2)c(C)n1-c1ccc(Cl)cc1 1183124719 HNCPSFSYGDERPB-UHFFFAOYSA-N 438.959 4.156 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 1251602516 JORKWCPMRIWLHQ-KRWDZBQOSA-N 431.577 4.107 10 10 IICE O=C(CC(F)(F)C(F)F)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1289510989 SIKVPPNPRRIPNV-UHFFFAOYSA-N 431.187 4.388 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](OCC(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1291517167 QDLQOWCFBIQRSW-DENIHFKCSA-N 425.621 4.474 10 10 IICE COC(=O)CC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCCC1 1312590422 LBRIUZKVZCMSRR-QGZVFWFLSA-N 435.996 4.499 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](CCc3ccccc3)C(C)C)cc2F)CC1 1352969991 OOJZQMKISXRFLE-QHCPKHFHSA-N 425.592 4.489 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(I)ccc2F)cc1 1355015791 QTXPUWIIIAZLFO-UHFFFAOYSA-N 426.273 4.207 10 10 IICE C[C@@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1356165675 PJSMCNQBZRLPGV-IRXDYDNUSA-N 436.474 4.478 10 10 IICE COc1ccc(-c2cncc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)c2)cc1 1357836247 QOBJVWATDPTXNH-ROUUACIJSA-N 449.526 4.440 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cncc(-c4ccc(OC)cc4C)c3)CC2)cc1 1358140401 MBWAXQXBQHFHEV-UHFFFAOYSA-N 431.536 4.427 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1nccnc1C1CC1 1439590962 ZBPCOKKSGYBQOS-KAMYIIQDSA-N 430.580 4.036 10 10 IICE Cc1cc(C(=O)NCc2ccc3cccnc3c2O)nn1-c1ccc(Br)cc1 1451953066 KYVOBDNMTVBFLW-UHFFFAOYSA-N 437.297 4.127 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)[C@H]1CCC[C@@H](OC)C1 1452752369 DMZZCNDAPFEWHK-LDQXTDLNSA-N 432.948 4.224 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ncn(Cc4ccc(Cl)cc4)n3)ccc21 1457507194 QJXCURJLIMLDLY-UHFFFAOYSA-N 437.931 4.450 10 10 IICE CCCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1cccc(F)c1 1461080921 ZYSHISRRFMHYDZ-SFHVURJKSA-N 436.531 4.229 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc(C(=O)OC(C)(C)C)c1 1463279720 JPQDQNUNWWGHSB-QFIPXVFZSA-N 425.573 4.049 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccncc3OC[C@H]3CCOC3)c2C)c1 1470406652 PTTSSETXXLNZPK-NRFANRHFSA-N 448.567 4.212 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)c1cccc(C(=O)OC)c1 1472952899 MHDWWSCZZZTUDX-UHFFFAOYSA-N 438.505 4.103 10 10 IICE Cc1cc(CNC(=O)NCc2cccc(Br)c2O)ccc1Br 1478787832 CQKQBOVDMRSTNN-UHFFFAOYSA-N 428.124 4.225 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1525821830 JSGLKJDHFMTROB-AVRDEDQJSA-N 448.563 4.065 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(C(=O)N(C)c4ccccc4)c3)C2)cc1 1537109043 JQPAPOUCGGITJR-FQEVSTJZSA-N 443.547 4.228 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc3c(c2)CN(C(=O)OC(C)(C)C)C3)cc1 1538161418 XMNIAJFQKPVCPK-UHFFFAOYSA-N 439.556 4.154 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CCN(C(=O)c2ccccc2F)CC1 1541089779 CNIGRLCUGLCGQG-UHFFFAOYSA-N 447.510 4.080 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](CN1CCCC1)c1ccccc1 1545632927 YYAMDLZTPODUTD-GOTSBHOMSA-N 442.003 4.006 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1cc(F)cc(F)c1O 1546150553 QZQZYSXNVKDZBP-UHFFFAOYSA-N 437.490 4.287 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2ccccn2)n1CCOC(C)(C)C 1554159974 OGQXRPCTMMZMGO-UHFFFAOYSA-N 434.588 4.392 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 1556426698 XUCHPECQODYERR-UHFFFAOYSA-N 433.892 4.250 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](ONC(=O)OC(C)(C)C)C(C)C)c1 1557089591 IBWWHNNOJWDNDC-NRFANRHFSA-N 443.544 4.117 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@H]2c2ccc(Br)cn2)c([N+](=O)[O-])c1 1559207255 HOEYYRCPOGAVJJ-GEZBDVBVSA-N 432.274 4.280 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nccc(C(F)(F)F)n3)cc2Cl)C1 1564649453 DEBLPAPTHMPAQR-CYBMUJFWSA-N 441.885 4.385 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CSCc3ccc(Br)cc3)C2)cc1 1585665113 MBSMZVYDILVVQF-KRWDZBQOSA-N 449.414 4.334 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)[C@@H](C)Oc4ccccc43)cc2Cl)C1 1586081382 DIXMAVCGVKABBS-DLBZAZTESA-N 441.959 4.007 10 10 IICE COCCCOc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cn1 1586081983 LGKYOGMHJVZJNY-KRWDZBQOSA-N 431.964 4.317 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc(C)n(-c3c(Cl)cccc3Cl)n2)cc1 1586649990 USHXUOPBBGGDDC-UHFFFAOYSA-N 448.354 4.100 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)n1 1598290814 DXXIKLCWRFPTIY-JOCHJYFZSA-N 436.531 4.207 10 10 IICE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(OCCOc2ccc(Cl)cc2)cc1 1611287106 LTFSGZPAHIMZFU-UHFFFAOYSA-N 427.884 4.068 10 10 IICE Cc1ncc(CN(C)c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)s1 1612433339 LSVAXUUVKWNWOE-UHFFFAOYSA-N 447.612 4.088 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(CC)[C@H]2c2cccc(C)c2)cc1F 1616924872 OPWZZGKJDKDORK-RDPSFJRHSA-N 425.548 4.206 10 10 IICE COc1ccc(CCNC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c(Cl)c1OC 1635583215 SNMQEDXACIMJCT-MRXNPFEDSA-N 433.980 4.205 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(-c2cnc3nc(O)n(C)c3c2)c1 1639341397 SFBVIOXCNHOFSN-KRWDZBQOSA-N 443.551 4.076 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccc(F)cc2)c(C)n1-c1ccccc1Br 1639766672 UQPSWUUZXULRLR-FQEVSTJZSA-N 431.305 4.459 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]3[C@@H](C2)C3(F)F)sc(C)c1-c1ccccc1 1653831045 ZCWXMKSTHJPBRK-JKSUJKDBSA-N 434.508 4.426 10 10 IICE Cc1ccc(CN2CCO[C@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1684483636 WFAZWXKULYAIGF-AREMUKBSSA-N 446.595 4.103 10 10 IICE C#CCN(CC#CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)CCC 1705590604 QPUSHWPNHMVKLB-HHHXNRCGSA-N 443.595 4.367 10 10 IICE Cc1ncc(CN(C)c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)s1 1707778723 OCKDQVGZGXBMMS-UHFFFAOYSA-N 431.616 4.313 10 10 IICE CN(CCC(F)(F)F)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1711169948 MWCNUSSMAIRUFJ-UHFFFAOYSA-N 439.526 4.140 10 10 IICE Cc1ccc(-c2nnc(N(C)C[C@@H]3CCCCO3)n2CCCSc2nccs2)o1 1742184072 QXUGPDOLCYUHRG-INIZCTEOSA-N 433.603 4.491 10 10 IICE CC(C)c1nnc(N(C)[C@@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752089942 FGKZPLIGXINOKF-AZUAARDMSA-N 429.584 4.440 10 10 IICE CCS[C@@H]1CCCCN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768381957 CJTAJBIMBSVKKO-RTBURBONSA-N 447.624 4.147 10 10 IICE CN(CC1CC(F)C1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1768752959 HZHUEAWHMGHWHV-UYSNPLJNSA-N 425.599 4.343 10 10 IICE COc1ccc(C(=O)c2ccccc2NS(=O)(=O)c2ccc(Br)cc2)cc1 1858035379 NDTDXRNIMOQTHV-UHFFFAOYSA-N 446.322 4.490 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010397263 RJXKHQGNMQJKPG-RTBURBONSA-N 431.537 4.036 10 10 IICE O=C(NCCOC12C[C@H]3C[C@@H](C1)C[C@@H](C2)C3)c1nc(-c2ccc(-n3cccc3)cc2)no1 2059072899 PMHUKWKUQNZHKM-LPSAYFBNSA-N 432.524 4.243 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCCOc4ccccc4)cc3)C2=O)cc1 2293228184 CUSWPAPVSOHGOS-UHFFFAOYSA-N 442.471 4.119 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)cc(Cl)c1OC(=O)c1ccc(OC)cc1 2297306915 HMQFUOHQHCPPGN-UHFFFAOYSA-N 449.937 4.455 10 10 IICE O=C1NC(=S)N(c2ccccc2F)C(=O)C1=Cc1ccc(OCc2ccccc2)cc1 2313558861 LKCVRKPALNDONP-UHFFFAOYSA-N 432.476 4.236 10 10 IICE COC(=O)c1cccc(N2C(=O)C(=Cc3cn(C)c4ccc(OC)cc34)SC2=S)c1 2321720124 RZYSNGBAHPEEQP-UHFFFAOYSA-N 438.530 4.379 10 10 IICE Cc1ccc(CN[C@@H]2CCC3(C2)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352689281 XMCOZJKCIRONSD-OAHLLOKOSA-N 425.367 4.342 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CC2CCC2)NC(=O)OC(C)(C)C)c(O)c1Br 2381134476 CQEBLDYXGHJLCP-OAHLLOKOSA-N 441.366 4.163 10 10 IICE CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C/NC(=O)Nc1ccc(C)c(C)c1 13633590 UZKJYAPCAWGOGK-WOJGMQOQSA-N 427.302 4.494 10 10 IICE O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C\c2ccccc2Br)SC1=S 70462958 WFKCIIITTKPPTO-KFXIKWRMSA-N 448.363 4.346 10 10 IICE CCOC(=O)c1ccc(-n2c(C)cc(C=c3sc4nc5ccccc5n4c3=O)c2C)cc1 254627467 KZXWUELOUYCKOH-UHFFFAOYSA-N 443.528 4.041 10 10 IICE Cc1cc2c(n1-c1ccc(Br)c(I)c1)CCC[C@H]2N 311410267 AMRMCEAUFLYNKZ-CQSZACIVSA-N 431.115 4.489 10 10 IICE Cc1[nH]c2ccccc2c1C1=CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CC1 579297855 VFQNKOZKECBOAE-UHFFFAOYSA-N 436.943 4.291 10 10 IICE COc1ccc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1NC(C)=O 765128639 WXTWTIZXSBCMOE-BBWFWOEESA-N 429.536 4.257 10 10 IICE Cc1ccncc1/C=C\C(=O)NCc1ccc(N(C)C(=O)/C=C\c2cnccc2C)cc1 765477928 IAMVHHNGOLYUMK-SQXCDDPUSA-N 426.520 4.099 10 10 IICE O=C(CCc1cnc2ccccc2c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 791685473 QADZDFAZPGFGAH-UHFFFAOYSA-N 428.580 4.016 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 805400123 OSGBUJASEKHUBZ-UHFFFAOYSA-N 440.293 4.304 10 10 IICE COc1ccc(CNC(=O)NCc2cc(Br)ccc2O)cc1OC1CCCC1 806726378 SIVGWOWSKDTORY-UHFFFAOYSA-N 449.345 4.484 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CN2C(=O)CSc3ccccc32)cc1 914454803 ABSZMHRLNYLSPB-UHFFFAOYSA-N 435.549 4.013 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(C)nn(Cc3ccc(F)cc3)c2Cl)cc1 1130544239 LEPDHBRIHWKOPD-UHFFFAOYSA-N 444.938 4.249 10 10 IICE Cc1ccc(C(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1137359035 CTKCZSXUCHLDAZ-RUZDIDTESA-N 434.536 4.466 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC[C@@H](C(=O)OCc2ccccc2)c2ccccc2)cc1 1138319599 XXUZAMZUAYRNJQ-OAQYLSRUSA-N 430.464 4.106 10 10 IICE CCN(Cc1c(CO)cnc(C)c1O)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1142186412 SOHSBHGLJFSKJG-UHFFFAOYSA-N 441.959 4.240 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3sccc3-n3c(C)ccc3C)[C@H](C)C2)cc1 1143423676 XMOSUAOBEKYAPZ-GOSISDBHSA-N 437.565 4.293 10 10 IICE CCCc1c(C(=O)NCc2cc(Cl)ccc2O)cnn1-c1cc(F)c(OC)cc1F 1146232924 NQHIBPXOHPSWDI-UHFFFAOYSA-N 435.858 4.401 10 10 IICE COc1cccc([C@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c2nccn2C)c1 1149424340 BOBZXWJDFGDGJA-DEOSSOPVSA-N 442.519 4.168 10 10 IICE COc1ccc(CNC(=O)[C@H]2CN(Cc3ccccc3)C[C@]2(C)c2ccccc2)c(O)c1 1155574098 FGOQFJATUSYTKS-SHQCIBLASA-N 430.548 4.107 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1255299261 DQGQODJKABGLRR-UYAOXDASSA-N 444.620 4.320 10 10 IICE CCN(CC)Cc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 1291755254 BNHQZTGCUAXWNE-RTBURBONSA-N 427.564 4.211 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccc1 1293417202 XHAVBSGMXFTYFV-OAHLLOKOSA-N 428.510 4.308 10 10 IICE CCOC(=O)c1sc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)nc1C 1300031704 CMYQQDCNZLDKJC-UHFFFAOYSA-N 425.510 4.409 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2cscn2)cc1 1313679757 SQFZOSASMAKCPW-HXUWFJFHSA-N 426.590 4.117 10 10 IICE CN(Cc1cccc(F)c1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1348571551 AKEOMCBAZDCTSH-PDGQHHTCSA-N 432.517 4.215 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@H]1c1cccnc1 1351683051 ISNQWNITSGCYRJ-DYGKOUCMSA-N 441.553 4.176 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354755456 RYGSPPHWGRCTHD-HNNXBMFYSA-N 449.523 4.405 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C 1440663510 QJAJRHHZKKZZJR-QFIPXVFZSA-N 439.556 4.082 10 10 IICE Cc1nccn1-c1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1F 1442113580 QGKFFEYDOJHHBS-UHFFFAOYSA-N 430.483 4.470 10 10 IICE Cc1ccc(CN2CCO[C@H](CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)cc1 1454866321 GBGVXPYRXRIKNS-XMMPIXPASA-N 431.580 4.342 10 10 IICE Brc1ccc(-c2cncnc2NCc2ccc(N3CCOCC3)cc2)cc1 1458136054 ZAXUZPPXJFJYLX-UHFFFAOYSA-N 425.330 4.355 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCCc3ccccc3Br)C2)cc1 1461075336 FFCALGFTEVDWKZ-KRWDZBQOSA-N 431.374 4.423 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Cc3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1461982712 NXIVQNUXODGONF-INIZCTEOSA-N 436.474 4.250 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@H]3C(=O)OCc3ccccc3)c2C)cc1 1464835795 DZHYTIYXEPNGRF-DEOSSOPVSA-N 432.520 4.451 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c(C)n1-c1ccccc1Br 1467747973 ZKCXTDICARWTFI-LBUQITIBSA-N 447.373 4.265 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(Cl)cc(Br)c3)C2)cc1 1470539165 LOXBFXLEVFHLMY-INIZCTEOSA-N 438.753 4.189 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CCCCC2 1515519683 LLJOEJRJMSZABK-CQSZACIVSA-N 444.528 4.324 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1CCc1nc(C(F)(F)F)cs1 1517142513 MZXZBRMWBPDOJD-UHFFFAOYSA-N 448.474 4.333 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C=C\[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1540567474 NKPWFIIUPYVZIB-ACQXMXPUSA-N 427.589 4.449 10 10 IICE COc1cc(OC)cc(N2CCCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)c1 1544433142 AFBWJWWZAFRHJL-UHFFFAOYSA-N 433.552 4.464 10 10 IICE CSc1ccncc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1545205601 YSNYALQSOHVNLM-YBEGLDIGSA-N 433.555 4.173 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1ccco1)Cc1cccs1 1564895442 IWUUKLPEYSIFHA-UHFFFAOYSA-N 447.507 4.368 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@H]1CCN(c2ccccc2Cl)C1 1564945933 IFSZVLLMSOIYKB-RTBURBONSA-N 429.008 4.471 10 10 IICE CCN(CC)C(=O)CCC1CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 1564946246 LSQMUUDFNZQWDZ-FQEVSTJZSA-N 430.637 4.062 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)[C@@H](O)c2c(F)cccc2Cl)cc1 1566342411 RYYDHNWRKVZGDM-IZHWHUGBSA-N 442.918 4.480 10 10 IICE O=C(Cc1ccccc1Br)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1566357026 VJBHFNWGAVVBAM-QGZVFWFLSA-N 437.765 4.131 10 10 IICE CCCN1CCN(C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)c2cc(F)ccc21 1570067389 PIGXMBYOVXOKQM-UHFFFAOYSA-N 440.519 4.395 10 10 IICE Nc1cc(C(F)(F)F)ccc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1584356343 IZQSCCGVIVQKAW-UHFFFAOYSA-N 429.389 4.288 10 10 IICE CC(C)CN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccc(F)cn1 1585142020 ULRFYPRZOCOOBP-UHFFFAOYSA-N 447.422 4.207 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCOC[C@@H]2C)cc1 1615381636 AOILZAQMBSYTIW-SFHVURJKSA-N 425.602 4.050 10 10 IICE CC(=O)c1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1C 1618253097 KLCSXPKLROFBMF-JOCHJYFZSA-N 439.556 4.259 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N(C)C)cc1C 1620097163 UELMAOCMNZUKMV-UNMCSNQZSA-N 441.620 4.051 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccccc4Cl)nc3)cc2)CC1 1625146024 VAQUYPWNBKYYPF-UHFFFAOYSA-N 436.943 4.209 10 10 IICE CCCNC(=O)CN(CCC)C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1625223166 GWUWBMWAHGAILL-UHFFFAOYSA-N 434.378 4.235 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C3CCCCC3)C2)cc1 1627153948 CZPHVGCZGUPPOZ-GCJKJVERSA-N 445.604 4.111 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)cc1)C1CCCCC1 1631385015 CGPGKYBDSWXMNE-QIJUGHKUSA-N 427.589 4.470 10 10 IICE COc1ccc(Oc2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)nc2)cc1 1632399086 NDBNRBKNBGLSSC-QFIPXVFZSA-N 434.492 4.410 10 10 IICE Cc1ccc(C(=O)N(C[C@H]2CCCO2)[C@@H]2CCSC2)cc1-n1c(C)cc(C=O)c1C 1632984477 JWSSBTHBAMSVHT-FGZHOGPDSA-N 426.582 4.342 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCCO[C@H]3c3ccc(Cl)cc3)C2)cc1 1636853984 PQGGTMHQVROXFR-BWAGFHJFSA-N 429.948 4.147 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(c3ccc(F)c(F)c3)CC2)N(C)C)cc1 1638918537 XBFXHHWNLJOWDA-HSZRJFAPSA-N 430.543 4.223 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(F)c(S(=O)(=O)N(C)C)c3)c2C)c1 1640516337 LDRZZKWZJHLYLY-UHFFFAOYSA-N 429.517 4.044 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1640569519 BQJFVDBULJXWGC-JPYJTQIMSA-N 434.536 4.253 10 10 IICE CN(C)c1ccc(CN(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)C2CC2)cc1 1641554672 PSQXCTPNPIVXQT-UHFFFAOYSA-N 434.584 4.028 10 10 IICE CCO[C@H]1C[C@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1642127760 ZOQRFQKAUADLQB-GOTSBHOMSA-N 448.563 4.316 10 10 IICE Cc1ccc(Br)c2[nH]c(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc12 1642155484 UOSUQZXDTFCXHH-UHFFFAOYSA-N 442.357 4.130 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)Oc1ccccc1Cc1ccccc1 1643245672 UXHMAEWKYYASHB-FQEVSTJZSA-N 447.531 4.342 10 10 IICE Cc1cc(C(=O)COc2ccc([N+](=O)[O-])cc2F)c(C)n1-c1ccc2c(c1)OCCO2 1643644007 JUXSFUJKYMCIQU-UHFFFAOYSA-N 426.400 4.174 10 10 IICE Cc1cc(C(=O)Cn2c(O)nnc2-c2ccccn2)c(C)n1-c1cccc(C(F)(F)F)c1 1643912483 WYXSGYZFCWANAB-UHFFFAOYSA-N 441.413 4.355 10 10 IICE CO[C@](C)(CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)COCc1ccccc1 1645158930 OJDMUUFRPRLFKQ-AREMUKBSSA-N 434.536 4.258 10 10 IICE Cc1cc(C(=O)N2Cc3cncnc3[C@@H](C)C2)c(C)n1-c1ccccc1Br 1650871665 LCYHQDJKHBFEOO-ZDUSSCGKSA-N 425.330 4.406 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2C2(O)CC2)sc(C)c1-c1ccccc1 1653822815 IIMHHXVGJKUJFB-SFHVURJKSA-N 442.581 4.218 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H](c3ccc(F)cc3)c3cccs3)cc2)CC1 1684875111 ZURIYNDOEQWKRC-HSZRJFAPSA-N 438.572 4.228 10 10 IICE C[C@@H]1CCCCN1CCC1CCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1685681396 FQHFHZZERUBVEM-PXDATVDWSA-N 443.680 4.041 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(N)=O)C1 1694979946 LPOCAODYIPDDRX-GZKVFJCDSA-N 432.572 4.021 10 10 IICE CCC[C@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1695072331 FRYZABXVRBQQTP-SFHVURJKSA-N 437.636 4.435 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1695727221 QSCDORDJBAAWGU-OAQYLSRUSA-N 425.621 4.303 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)C3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1707272388 KWIIEPVCQPGMKL-SFHVURJKSA-N 434.588 4.114 10 10 IICE CNC(=O)[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(C)CC1 1711296639 MKNYBTRIEZOEKW-GOSISDBHSA-N 448.615 4.361 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1723207554 WREJSYMJCHCQPG-NRFANRHFSA-N 436.579 4.390 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)Cc1cscn1 1724236801 YXMJPIKOKOPKOS-UHFFFAOYSA-N 438.626 4.446 10 10 IICE CCc1nnc(N2CC=C(C(C)(C)C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1727536536 YEYVAXUBAFWDJZ-UHFFFAOYSA-N 427.568 4.047 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CCC[C@H](O)C1 1747720686 PMJHVKKILPWKNZ-UNMCSNQZSA-N 425.621 4.363 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCSCC(C)C 1763071033 TXYTZITUYGKKNH-UHFFFAOYSA-N 431.650 4.345 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765021374 NXLQMKBRILBKJI-WMZHIEFXSA-N 425.621 4.283 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1765535029 JUSGOAVEOJQWOO-CBQOVEMMSA-N 429.609 4.050 10 10 IICE C[C@@H]1CCCN(C(=O)Cn2c3c(c4ccccc42)CCN2C(=O)c4ccccc4N(C)[C@H]32)C1 1860347508 SMFAOHRBFXMGTM-DWXRJYCRSA-N 442.563 4.047 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2cccc(OC)c2)sc(C)c1-c1ccccc1 1860747736 UJOCLIKZBKSJKM-UHFFFAOYSA-N 438.505 4.486 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C(C)C)c(CN)c2I)cc1C 2079972603 WZDLYHSQDCBMBT-SFHVURJKSA-N 439.341 4.392 10 10 IICE CC[C@@H](CC(=O)N(C)Cc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2352659781 BUPJSXUVCWNREJ-AWEZNQCLSA-N 429.355 4.115 10 10 IICE Cc1ccc(CNC(=O)C23CCC(CC2)N3C(=O)OC(C)(C)C)c(O)c1Br 2380755084 XXQWTIDEIYAEEA-UHFFFAOYSA-N 439.350 4.011 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@@H]3C=CC[C@@H]32)ccc1O 14459078 GJYFVXFYCNPAAU-JLHGSKIFSA-N 428.554 4.304 10 10 IICE CCN(CC)c1ccc(CN(C[C@H](O)COc2ccccc2C=O)c2ccccn2)cc1 54120903 MILOEBFFFVLTPS-DEOSSOPVSA-N 433.552 4.187 10 10 IICE O=C1/C(=C/c2ccccc2Cl)N=C(c2ccccc2)N1c1ccc(S(=O)(=O)O)cc1 83302324 FSSZIRUQBYBDCK-ZHZULCJRSA-N 438.892 4.421 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C)c1 750391981 OWKLOCHOYJMAFH-VWNXMTODSA-N 448.567 4.338 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCC(=O)c2cc(F)ccc2F)C1 769664505 FWBJEHLSDPHNIE-UHFFFAOYSA-N 426.463 4.112 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCC[C@H](C(F)(F)F)[C@H]2C)c([N+](=O)[O-])c1Br 775547462 PHBSDYGNYQCKAR-SFYZADRCSA-N 442.188 4.441 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](C)(CNC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 798948409 JXIWBRCXJADOHR-HSZRJFAPSA-N 439.547 4.494 10 10 IICE Cc1noc2nc(-c3ccccc3)cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c12 917709463 YEOGSBLKRVIUPT-UHFFFAOYSA-N 446.482 4.104 10 10 IICE CCOc1ccc([C@@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 918200105 XIURMZFHQMXBTC-FGTMMUONSA-N 429.536 4.398 10 10 IICE CCC(CC)(COCc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1125188447 PJUDDFNDOAPWIU-UHFFFAOYSA-N 428.548 4.302 10 10 IICE COc1cccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1OC(C)C 1125189078 ZTTXDYZICCVOIH-IAGOWNOFSA-N 430.520 4.165 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(Br)c3)CC2)c(OC)c1 1131804992 UZVRHYXYKHRCOA-UHFFFAOYSA-N 439.737 4.082 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)C)C(=O)[C@H]2C)c(C)n1-c1ccc(Br)cc1 1138561757 BANRTTUARPHYRD-QGZVFWFLSA-N 446.389 4.186 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2c2ncon2)c(C)n1-c1ccc(Br)cn1 1147276576 KJLRZTYEIQVFNO-MRXNPFEDSA-N 430.306 4.002 10 10 IICE COc1ccccc1-c1noc([C@H](C)NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1148561156 HKQCOWGJONWFMX-INIZCTEOSA-N 444.491 4.456 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1snc(Cl)c1Cl 1156287970 SSRFERHMNMJNIA-UHFFFAOYSA-N 430.357 4.452 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)CCS2 1164310504 NLOBPXNISLSPAH-BNGSBABLSA-N 440.521 4.455 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H](C)c1cccc(O)c1 1191297500 KXOIJDFJBYEROL-MRXNPFEDSA-N 428.488 4.189 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](CNC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1255754549 NXSNVFBAQPVQHQ-SMDDNHRTSA-N 432.348 4.192 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CC(C)(C)OC(C)(C)C1 1289423428 KLWCLDHVUBDEDC-NRFANRHFSA-N 441.620 4.336 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CCc2cc(Br)ccc21 1293928701 IUQOFVMOLSBHGE-QFIPXVFZSA-N 443.385 4.004 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CCCC2 1351557950 MLFCJPAORMDPMG-HWOWSKLDSA-N 432.586 4.169 10 10 IICE COc1ccc(N2CCCN(C(=O)c3c(C)nn(C)c3Sc3ccccc3)CC2)cc1 1358140319 KFNOGGZCBKTBBA-UHFFFAOYSA-N 436.581 4.241 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@@H](C)C3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1361052041 KOJYHKVTWSPLTQ-MOPGFXCFSA-N 438.645 4.244 10 10 IICE CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)C1 1435046412 UYWSIUQDTNVMBD-HXUWFJFHSA-N 435.568 4.113 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1nn(-c2ccc(F)cc2)c2c1CCC2 1459683311 AYTBQLROBFEIFF-UHFFFAOYSA-N 443.906 4.034 10 10 IICE CCc1cc(C(=O)OC)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)s1 1461067086 RQGXUVSSWBOHFL-UHFFFAOYSA-N 439.581 4.457 10 10 IICE COc1cc(NC2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)cc(OC)c1 1465811161 IOGKHNRLGZASHJ-UHFFFAOYSA-N 428.510 4.046 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1c[nH]c2cnc(Cl)cc12 1467631668 OVOIZYONSQCGJA-UHFFFAOYSA-N 442.947 4.147 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1504787813 DDNFMCCFXAXCOO-HXUWFJFHSA-N 437.588 4.394 10 10 IICE Cc1nc(CC(C)C)c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1519555671 DEDJYUVPFIULQM-UHFFFAOYSA-N 426.630 4.112 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3cccc(F)c3)c3c2CCCC3)cc1 1527596438 ZQJKGPHUXZLIHC-UHFFFAOYSA-N 436.531 4.107 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cccc(Cl)n1 1527851622 SBWPANVMLONXBF-KAMYIIQDSA-N 435.933 4.128 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1533684242 NQFSNNOPCPPRJX-RAXLEYEMSA-N 444.579 4.105 10 10 IICE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1537483501 OJGBFRHWYRBCOX-OVKKFJMPSA-N 435.490 4.474 10 10 IICE Cc1ccc(-c2ncc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)s2)c(C)c1 1537839789 QHAIQIQUWOYRMX-UHFFFAOYSA-N 448.592 4.059 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@@H]2CCCC[C@@H]2C1 1538543666 ZRMXEPKFYANIKG-WCAHNUQUSA-N 432.586 4.456 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(F)(F)c2ccc(Br)cc2)N(C)C)cc1 1539236149 PZODZIIKCSTHBF-SFHVURJKSA-N 440.332 4.026 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1 1540337695 AIZIHIBHQVQZRY-AREMUKBSSA-N 429.564 4.402 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1 1557063222 ISRPPOJIZQKVRF-CJFMBICVSA-N 429.564 4.280 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CO[C@H](CN3CCCc4cc(OC(F)F)ccc43)C2)C1 1559605354 OSEDKYRYJZPGGA-FDDCHVKYSA-N 438.515 4.457 10 10 IICE Cc1ccccc1CCN(C)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559863233 SEAOYCNRKXUZEH-GOSISDBHSA-N 426.516 4.272 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]1C 1564945999 WOEXRKYIOFVHOQ-IPMKNSEASA-N 432.609 4.031 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H](NC(=O)OC(C)(C)C)c2ccc(F)cc2F)c1 1566374763 SRWQYMKACIDWMC-HXPMCKFVSA-N 436.455 4.122 10 10 IICE CCOC(=O)[C@@]1(COC)CCCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1567940052 YWEJHFGJNANASQ-QHCPKHFHSA-N 432.948 4.179 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CCC(=O)NCc2cc(Cl)cc(Cl)c2O)COC1(C)C 1570027839 YZVQBRLOXCIFNQ-CQSZACIVSA-N 447.359 4.467 10 10 IICE COC(=O)c1cnc(SCC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)s1 1613812515 MWOMLUTVONBIKY-UHFFFAOYSA-N 430.473 4.232 10 10 IICE CN(C)c1ccc(CNC[C@@H]2C[C@H]3CCN2C[C@H]3c2cc(-c3cccs3)nn2C)cc1 1616156613 ZNFGDKGEPAAEEW-BAGYTPMASA-N 435.641 4.182 10 10 IICE CC[C@H]1CCCN(C(C)(C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)C1 1617183995 AQBZGAYRVATBKO-NRFANRHFSA-N 438.660 4.425 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1 1624301135 GFOGAZHNLUPFPE-UHFFFAOYSA-N 447.510 4.080 10 10 IICE CCO/C=C\[C@](O)(CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)C(F)(F)F 1628621708 AFTDWKUEACEUJS-QWUACUGRSA-N 430.854 4.321 10 10 IICE C/C=C\C[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C(=O)OCC 1632607446 LZWCJNNWHQWUNF-SUOMESGTSA-N 433.346 4.484 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 1636262924 JWDSKYVLPADUIJ-SIKLNZKXSA-N 446.599 4.366 10 10 IICE CCc1nc(C(=O)NCc2cc(Cl)ccc2O)nn1-c1c(Cl)cccc1Cl 1640920087 KMXOCRAIXUZCRF-UHFFFAOYSA-N 425.703 4.426 10 10 IICE CC(C)c1cccc(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1644398868 PUWGLGBATNYATI-KDURUIRLSA-N 427.564 4.315 10 10 IICE CN(CC(=O)Nc1ccccc1I)c1ccc(-c2nccs2)cc1 1654678967 PMWFMDHKKKJSSZ-UHFFFAOYSA-N 449.317 4.490 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCC(=O)OC2CCCCC2)cc1 1672079535 SWTGDIALVMMWFJ-UHFFFAOYSA-N 427.545 4.323 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(NC(=O)c4ccoc4C)CC3)c2C)c1 1683302865 CNHDWWPKJMAEGP-UHFFFAOYSA-N 448.567 4.408 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1686856086 HAUNWYMWIIXHMP-CTNGQTDRSA-N 434.584 4.334 10 10 IICE COCCN(Cc1ccc2c(c1)OCO2)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1687217707 WAHZCYJITDXWDW-UHFFFAOYSA-N 449.551 4.224 10 10 IICE Cc1cnn(CC2CCN(c3nnc(C(C)C)n3CCCSc3nccs3)CC2)c1 1693303205 MNNXLEXUIYWSGS-UHFFFAOYSA-N 445.662 4.462 10 10 IICE Cc1cc(-c2nnc(N3CCCC3)n2CCCNC(=O)C(C)C)c(C)n1-c1ccccc1 1724200089 ZYQVFYRJSXORTL-UHFFFAOYSA-N 434.588 4.115 10 10 IICE C[C@@H]1C[C@@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1726486904 QHMUSOKFCDGAPZ-OWYHZJEWSA-N 441.576 4.047 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1N(C)CCCC1(C)C 1730963574 BQAHQJKHPFYOIV-JOCHJYFZSA-N 436.604 4.471 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC(C)(C)NC(=O)OC(C)(C)C 1742755482 FLOQHNIXGZGWTB-UHFFFAOYSA-N 442.608 4.126 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1746090451 ZAQWUIJIOWCHTJ-DVECYGJZSA-N 448.615 4.404 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@H]1CCC=CO1 1747754211 NYMLPERKVYPEBI-SFHLNBCPSA-N 426.561 4.231 10 10 IICE Cc1cc(C)n(Cc2nnc(N(CC(C)C)C(C)C)n2Cc2ccc3c(c2)CCCN3C)n1 1751839633 GRJUILZYHHWGQS-UHFFFAOYSA-N 449.647 4.441 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N(C)Cc1cnc(C(C)C)nc1 1761698389 NBWVJVITOXECMZ-UHFFFAOYSA-N 435.620 4.449 10 10 IICE CCS[C@@H]1CCCCN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768381955 CJTAJBIMBSVKKO-RBUKOAKNSA-N 447.624 4.147 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1 1769198198 OOCRYHOCUCVQDT-XMSQKQJNSA-N 437.588 4.250 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCCCCC1 1769319639 FWGOTURXJOKGOF-UHFFFAOYSA-N 434.588 4.259 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)N2CCCCC2)cc1 1865990907 VHCBNOOGOQAESN-NRFANRHFSA-N 430.936 4.271 10 10 IICE CCc1ccc(Nc2ncc([N+](=O)[O-])c(N3CCN(c4ccc(OC)cc4)CC3)n2)cc1 1871304778 FPMAFBVIOXOUBZ-UHFFFAOYSA-N 434.500 4.026 10 10 IICE COCCN1C(=O)C(N[C@@H](C)c2ccccc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873167926 CXVSDAWBRHZPII-FQEVSTJZSA-N 443.547 4.171 10 10 IICE CCOc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)n(C)n2)cc1 1891528488 UXKAUHBGIOVASJ-UGKGYDQZSA-N 430.552 4.405 10 10 IICE C[C@H](O)c1ccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)c(Br)c1 2093157019 YSHWLNPFWZBYOH-HNNXBMFYSA-N 425.317 4.460 10 10 IICE CC(C)(C)OC(=O)NCc1nc(CNCc2cc(Br)cc(F)c2O)cs1 2271165613 GBURTQYVTVDHTP-UHFFFAOYSA-N 446.342 4.065 10 10 IICE Cc1ccc2[nH]c(C)c(C=C3C(=O)NC(=O)N(c4ccc(Br)cc4)C3=O)c2c1 2296660165 KTWNWMJSVCPBNP-UHFFFAOYSA-N 438.281 4.214 10 10 IICE CC(C)[C@H](C(=O)O)N1C(=O)C(=CC(Cl)=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2297449414 PRYFAIRNMBRKEO-CQSZACIVSA-N 426.903 4.028 10 10 IICE COc1ccc(N2CCN(CCCNc3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC2)cc1 215735888 RHQDLAXFDULVIH-UHFFFAOYSA-N 438.450 4.246 10 10 IICE COc1cccc(N2CC[C@@H](CNC(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)c1 303427555 ZYUDTLFWDXRBII-QFIPXVFZSA-N 436.600 4.257 10 10 IICE C[C@H]1CN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)CCN1Cc1ccccc1 396356351 IMNUITREYRCJLM-IBGZPJMESA-N 436.600 4.273 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2cc(C)c(F)cc2F)cs1 749012067 XEMPFDKTXUXLEN-UHFFFAOYSA-N 441.437 4.114 10 10 IICE CN(c1ccc(CNC(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)cc1)C1CCCCC1 756684839 NFRVYTVHIYLQMQ-XZOQPEGZSA-N 441.572 4.083 10 10 IICE COc1cc(Cl)cc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1O 761213246 DUICPIIMRVTVQI-OAHLLOKOSA-N 432.952 4.286 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C\c2ccnc(Cl)c2)NC(=O)OC(C)(C)C)cc1 761776678 SZAOLEJDFYVQQH-PVABEOQZSA-N 444.963 4.196 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(Br)s1 768545102 SLAQIZSBVBTHDZ-UHFFFAOYSA-N 448.430 4.281 10 10 IICE Cc1c(S(=O)(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c2ccccc2n1C 790187658 HDRFJBKTALEHHL-UHFFFAOYSA-N 449.523 4.035 10 10 IICE COC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)cs2)c1 914576752 VWGOJHUXPBJRNC-UHFFFAOYSA-N 438.914 4.060 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccncc3Oc3ccccc3)cc2F)CC1 1125975993 GUTSRZPZIMUITC-UHFFFAOYSA-N 434.515 4.085 10 10 IICE CN(c1ccc(CNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)cc1)C1CCCCC1 1136446397 HFLLHBQOQKAAGX-RUZDIDTESA-N 439.575 4.284 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cnn1-c1ccccc1C 1137658416 HFJXSZHOSDJVOK-UHFFFAOYSA-N 432.568 4.494 10 10 IICE CC[C@@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1141985235 LLPNSMDUQINJKI-NQIIRXRSSA-N 433.593 4.063 10 10 IICE Cc1cc(CC(=O)Nc2cc(Br)c(=O)n(C)c2)c(C)n1-c1ccc(Cl)cc1 1149642737 PITZQLCSKMDGQQ-UHFFFAOYSA-N 448.748 4.390 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(C(=O)c2ccco2)c1 1150353982 IJKQJQJRHNFLKF-FQEVSTJZSA-N 438.911 4.264 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)cc1F 1293224625 BIDYAAOZUPFSQY-XMMPIXPASA-N 447.554 4.329 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c1C 1296404778 YPUYNSICIHVHRF-DEOSSOPVSA-N 431.580 4.423 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H](C3CCC3)C2)c(C)n1-c1ccc(Br)cn1 1298480269 ZRPWLMHPGOCSLZ-KRWDZBQOSA-N 432.362 4.140 10 10 IICE CN1CCCc2cc(Cn3c(N4CC(C)(C)OC(C)(C)C4)nnc3C(C)(C)C)ccc21 1298887594 KHZGEDQCNRVWMT-UHFFFAOYSA-N 425.621 4.400 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1C[C@H](C)OC(C)(C)C1 1304240083 GVCCNQQCZYTAGI-SFHVURJKSA-N 439.629 4.357 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)C2)cc1 1312818324 LSCLUUDKJYHMFE-RDGATRHJSA-N 438.616 4.075 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1ccnn1)C(C)C 1313581845 JFSJZNNFODEZJK-UHFFFAOYSA-N 432.576 4.269 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@]1(N(C)C)CCSC1 1359680479 SHHGSSHBZWDNEE-DEOSSOPVSA-N 442.677 4.075 10 10 IICE CC(C)C[C@H](Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)N(C)C 1359767857 PDOKOEJQJDQNHD-HSZRJFAPSA-N 449.647 4.486 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@@H](C)C3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1361052042 KOJYHKVTWSPLTQ-OALUTQOASA-N 438.645 4.244 10 10 IICE COc1ccc(NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)cc1S(C)(=O)=O 1460922432 BMFBAHQZURZUPC-UHFFFAOYSA-N 432.929 4.412 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC([C@@H](O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])c1 1472803277 CJZDOINICPYBCL-NEAHNDPRSA-N 432.423 4.009 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)C1 1499569581 SUUHTOJMXGWQNC-FQEVSTJZSA-N 434.588 4.067 10 10 IICE CO[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CC[C@@H]1C 1504516093 JVUSXABLCNMXNI-FDDCHVKYSA-N 425.621 4.295 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@]1(O)CCC[C@@H]1C 1509131977 JPEJGNCQKIECBG-CPJSRVTESA-N 425.621 4.264 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@@H](C)C1 1519144621 OCRNMVNJGKQVHS-YLJYHZDGSA-N 429.584 4.125 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@H](OC(C)(C)C)[C@H]3n3cccn3)ccc21 1521747038 CZTBXYCJHDIWFR-PUHATCMVSA-N 438.572 4.028 10 10 IICE CCc1ccccc1-n1cc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)nn1 1530324753 CEQQIDBZLLNRGX-UHFFFAOYSA-N 431.462 4.100 10 10 IICE C[C@H](NC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1)c1ccc(N(C)C)cc1 1537679051 DOZMFABVJKGWFI-JTSKRJEESA-N 439.625 4.443 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1 1537803662 VQGWGNCKCCKYRV-OAQYLSRUSA-N 429.536 4.125 10 10 IICE CCOC(=O)[C@@H](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)Cc1ccccc1 1544101212 VKGLAQIDAWQXIJ-HXUWFJFHSA-N 448.563 4.067 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(=O)NC)C1 1546779951 ASBIAJDSYQXZJS-CLLRAFFISA-N 446.599 4.281 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C(C)C 1547310767 FOAJZMINYLMGCJ-QHCPKHFHSA-N 448.615 4.456 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)CN(C)C 1555510748 TYTSTRSYOIVJPG-UHFFFAOYSA-N 438.620 4.023 10 10 IICE CCOC(=O)N1CCC([C@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1556307694 HFCGXLXVGGKYEH-SFHVURJKSA-N 439.556 4.202 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CCc4cc(Br)ccc43)C2)cc1 1584444736 YZJQUKONGMJPAH-YCRPNKLZSA-N 429.358 4.130 10 10 IICE CC(C)(C)[S@](C)(=O)=NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1584721476 BQGDFQYDVPKBER-PUHSMXRQSA-N 430.642 4.152 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(OCc4csc(C)n4)c3)C2)cc1 1585666042 ZHVOUQURYDURQT-SFHVURJKSA-N 437.565 4.295 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)Cc1cc(Cl)ccn1 1611963451 QUMNYSDSBYFZAG-UHFFFAOYSA-N 447.974 4.448 10 10 IICE CN(C)c1ccc([C@H](CNc2ncnc(-c3ccccc3)n2)NC(=O)OC(C)(C)C)cc1 1612346004 ZMFVXLKTZXVLAW-FQEVSTJZSA-N 434.544 4.283 10 10 IICE CCCc1cc(=O)oc2c(CN(CCOC)C[C@@H]3CCCN4CCCC[C@@H]34)c(O)ccc12 1614472031 DVXFOPIDPZWHRF-REWPJTCUSA-N 442.600 4.164 10 10 IICE CN(Cc1cnn(C)c1)c1nnc(CC2CCCC2)n1CCCSc1nccs1 1617972941 MXJQQHXGKDGPSR-UHFFFAOYSA-N 431.635 4.020 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCC2CCN(CC(F)(F)F)CC2)cc1 1621582959 FPRWVHKCMJKBIH-UHFFFAOYSA-N 449.517 4.230 10 10 IICE CCCN(CCN(CC)CC)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1624824213 LLPVJJFCOAXGAS-UHFFFAOYSA-N 435.410 4.446 10 10 IICE CCCN1CCN(C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)c2ccc(F)cc21 1625159039 PGWPRNXEVMUSFY-UHFFFAOYSA-N 440.519 4.395 10 10 IICE Cc1ccc(C(=O)N(C)[C@H]2CCN(c3ccccc3F)C2=O)cc1-n1c(C)cc(C=O)c1C 1627689763 PMFNIWGMYUTFNA-QHCPKHFHSA-N 447.510 4.232 10 10 IICE Cc1ncc2c(n1)CCC[C@@H]2NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1633351115 LPYHBLDWXBFVRA-IBGZPJMESA-N 440.345 4.157 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3ccccc3F)C[C@@H]2C)cc1 1635774085 UWSPIXOSDIUYOQ-IBGZPJMESA-N 433.527 4.326 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1(c2cccc(Cl)c2)CCC1 1635996744 LIIZZEOJVLODCB-UHFFFAOYSA-N 435.902 4.333 10 10 IICE CSc1cc(F)ccc1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1638831441 LZTJCKOSRWWJHL-UHFFFAOYSA-N 438.527 4.368 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCCN1C(=O)COc2ccccc21 1642352766 VEJGOGOIROGLSO-UHFFFAOYSA-N 431.448 4.053 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]3COCC[C@@H]32)sc(C)c1-c1ccccc1 1644947168 QLJSVCWTRYMDIH-MOPGFXCFSA-N 442.581 4.340 10 10 IICE CC(C)C[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 1645076207 LZYTWFJEZIUKJA-JOCHJYFZSA-N 447.982 4.309 10 10 IICE CCOc1ccc(N2CCN(CCOc3ccccc3C(=O)OC(C)(C)C)CC2)cc1 1652964219 ITXDEUHDWIOOCJ-UHFFFAOYSA-N 426.557 4.242 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])c1 1655534258 JBTFVBWVUDVXTR-ISGGHPHESA-N 445.516 4.008 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@H]3CCO[C@H](c4ccc(F)cc4)C3)C2)cc1 1673822768 HJSPAELTHTWAMA-OUOWLKGYSA-N 441.547 4.222 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H]1CCc1ccccc1 1681849559 DLLQKIYDWZZSSK-HXUWFJFHSA-N 429.511 4.108 10 10 IICE COc1cc(OC)c(C[C@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c(OC)c1 1682491822 VTWLTNFDCULUDR-SFHVURJKSA-N 443.588 4.330 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3sc(C)cc3Br)CC2)cc1 1684124087 KGCJLCFVLCMSDS-UHFFFAOYSA-N 438.391 4.250 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@]2(C)Cc2cccc(F)c2)N(C)C)cc1 1684606245 CURAMECFNLIAJR-ZCYQVOJMSA-N 426.580 4.301 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@H](NC(=O)OC(C)(C)C)C(C)C 1692079912 IXUYOQSVVCNWNQ-LJQANCHMSA-N 445.608 4.368 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccoc1)OC 1697753335 FQFJVVMGFOFJGO-JOCHJYFZSA-N 449.555 4.243 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1728383040 RCNQVCKRFLJUCS-KNQAVFIVSA-N 441.620 4.418 10 10 IICE CCN(Cc1ccccc1)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1728437705 XKWBKZFTTZHUNH-GOSISDBHSA-N 429.615 4.447 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCCO[C@H](C)C2)cc1 1746093553 QITVFRNKGRMTTO-KNQAVFIVSA-N 427.593 4.029 10 10 IICE CC[C@@H](C)N(C)CCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1762002958 ASMIYJHZSNTERN-OAQYLSRUSA-N 449.647 4.251 10 10 IICE CCc1nnc(N(C)Cc2nc(C(F)(F)F)cs2)n1Cc1ccc(N(C)C)c(F)c1 1764725903 UIJMUACJQHRMDG-UHFFFAOYSA-N 442.486 4.206 10 10 IICE CCCO[C@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1766328294 HZTKNCYZEPEJEI-XZOQPEGZSA-N 441.620 4.338 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1766615068 VTRPWHKPWRGEKQ-GBXCKJPGSA-N 448.615 4.020 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)c(CC(=O)O)s2)cc1Cl 1858004289 ZOZCIXFFIMALNL-UHFFFAOYSA-N 428.944 4.261 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@]1(C)CNCc1cc(Br)ccc1O 2102786707 RNWZBKBNZFSXRR-KRWDZBQOSA-N 435.309 4.279 10 10 IICE O=C(O)c1cnc(Sc2cc(I)ccc2Br)s1 2300789867 FWDMHSOJGNNVJT-UHFFFAOYSA-N 442.097 4.360 10 10 IICE CCc1ccccc1N1C(=O)C(=Cc2ccc(OCC(=O)O)c(OC)c2)SC1=S 2314932909 PVXHDEPIBIDJER-UHFFFAOYSA-N 429.519 4.127 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(C[C@@H](O)CN2CCCCC2)c2ccccc12 13541054 WAJAAXUKXQAYFT-NAZSJVEXSA-N 442.563 4.294 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471748 NBKUNXBYLPWQOX-DXIQSLLYSA-N 427.526 4.452 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471788 NUAVGBMVFGHSST-OPYAIIAOSA-N 427.526 4.498 10 10 IICE COC(=O)C1=C(C)N(CCc2ccc(OC)c(OC)c2)C(=O)/C1=C/c1cccc(Cl)c1 33298432 KTLOLVYVJMZDEW-CPNJWEJPSA-N 441.911 4.273 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(S(C)(=O)=O)c2)cc1 98071253 GIEULUSPENFYBA-UHFFFAOYSA-N 438.549 4.012 10 10 IICE CN(C)c1ccc(CNC[C@H]2C[C@H]3CCN2C[C@H]3c2cc(-c3ccc(F)cc3)nn2C)cc1 207392139 ZZQCNNHAICPHEC-NQHRYMMQSA-N 447.602 4.260 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@@H]3C=CC[C@@H]32)cc1O 226673164 BYWVLKLBRPAYHT-IMWIBFENSA-N 440.565 4.402 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 226791813 WKGVFLPSQQEGBS-LVCYWYKZSA-N 427.526 4.498 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 226881736 LIVRQJJFONDDEK-YJLYGGOZSA-N 435.549 4.015 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1F 726250468 WZABSCQLOZFBJY-UYAOXDASSA-N 448.583 4.213 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(C)(C)c1cccc(Br)c1 726524697 DEJFIMVAVUQEEM-UHFFFAOYSA-N 431.374 4.222 10 10 IICE O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405659 ILBMBLQALBJRJD-SOFGYWHQSA-N 439.918 4.318 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H]4CC[C@H](C3)O4)n2C[C@H]2CCCCO2)c(C)n1-c1ccccc1 752835467 JEVONUHCGREBPI-ZLNRFVROSA-N 447.583 4.289 10 10 IICE CCn1nccc1S(=O)(=O)Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1 769846949 HILABMFRSUOEKI-UHFFFAOYSA-N 438.534 4.058 10 10 IICE O=C(CCC(=O)c1ccc(F)c(F)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771060135 VVTHVUULVYQDLU-QGZVFWFLSA-N 436.886 4.068 10 10 IICE c1ccc(-c2ccc(Cn3cncn3)cc2)c(CNCc2ccc(N3CCOCC3)cc2)c1 780771166 GMXWYADMBDWRTK-UHFFFAOYSA-N 439.563 4.120 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1cc(F)c(F)c(F)c1 780881532 PGYPZAGGJLLJKC-UHFFFAOYSA-N 431.252 4.346 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)OCC(=O)N3CCC[C@@H](C(F)(F)F)C3)c2C)cc1 918895149 BJWKQJNZRUQDHI-MRXNPFEDSA-N 438.446 4.060 10 10 IICE CCOc1ccc(OCC)c(N2C(=O)NC(=O)/C(=C/c3cn(CC)c4ccccc34)C2=O)c1 1084394969 OLDRCLFOAWIJQA-UYRXBGFRSA-N 447.491 4.125 10 10 IICE Cc1cccc(-c2nnc3n2C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC3)c1 1124872650 POBSFMRMPPESFR-QFIPXVFZSA-N 431.584 4.319 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(NC(=O)C(C)(C)C)nc2)cc1 1125963996 PETDQUZFRZJQRK-UHFFFAOYSA-N 436.478 4.337 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1c2ccccc2C[C@@H]1C 1136743198 LELVSZKTQSREBR-IEXUWNMDSA-N 433.596 4.461 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)cc1 1143999378 JQEXCLHFLPNGJL-UHFFFAOYSA-N 448.401 4.119 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3ccc(Cl)s3)ccc2=O)c(C)n1-c1ccc(F)cn1 1189650109 RLQNKEGDGYTBHF-UHFFFAOYSA-N 442.903 4.450 10 10 IICE COc1ccc(N(C)CCN(C)[C@@H](C)C(=O)Nc2ccc(C)cc2Br)cc1 1195790688 VPUPETPEXIEJNA-INIZCTEOSA-N 434.378 4.161 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@H]2CC(c3ccc(OC)c(C)c3)=NO2)cc1 1227024538 CFFJUBTXNFHLSX-JOCHJYFZSA-N 438.572 4.184 10 10 IICE Cc1cc(CC(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c(C)n1-c1ccccc1 1265131896 NVDSIHUCUSTTPQ-UHFFFAOYSA-N 444.579 4.101 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCSC[C@@H]1C 1289424364 VQTJDIXZMBNJTA-KRWDZBQOSA-N 427.643 4.295 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)c(F)c1 1292025891 WMYQXHBVBNSKLN-IAGOWNOFSA-N 444.599 4.075 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H](c3ccc(Cl)cc3Cl)N3CCOCC3)ccc21 1292206994 ORKPFXYCHFDOHR-JOCHJYFZSA-N 448.394 4.066 10 10 IICE Cc1cc(C(=O)NC(C)(C)[C@H](O)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1302811275 JFFUNYWYRHVEOU-INIZCTEOSA-N 433.268 4.288 10 10 IICE CC[C@@](O)(CCC(F)(F)F)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1304201510 FKLPUXQFWFFSPL-JOCHJYFZSA-N 439.522 4.008 10 10 IICE Cc1ccc(CN(C)c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)s1 1304346673 WKZLLIIXHZAZFT-GOSISDBHSA-N 443.592 4.432 10 10 IICE Cc1ccc2c(c1)CCN2c1nnc(C(=O)NC(C)C)n1CCCSc1nccs1 1304442951 MHEQTQUKXLPGJL-UHFFFAOYSA-N 442.614 4.058 10 10 IICE CCc1nnc(N2C[C@H](c3ccccc3)O[C@H](C)C2)n1CCCSc1nccs1 1306112507 KYZGQSQHYTWILK-SJLPKXTDSA-N 429.615 4.446 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@H]3CCCC[C@H]32)sc2c1CC[C@@H](C)C2 1353908381 VPLWLFKXICIVQT-WTTBNOFXSA-N 432.586 4.072 10 10 IICE Cc1nc(-c2ccccn2)sc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1354658535 PQCYXDPHFJTAKJ-GJZGRUSLSA-N 440.544 4.196 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1cscn1 1361097757 HTYXSYUPWZMBTG-HXUWFJFHSA-N 426.590 4.035 10 10 IICE COc1cc(OCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)ccc1[N+](=O)[O-] 1436047030 ISDQITYVFHZTEA-OAHLLOKOSA-N 447.919 4.188 10 10 IICE Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1444991572 WNAJAOLIHDSRIQ-MRXNPFEDSA-N 449.454 4.059 10 10 IICE Cc1cc(C(=O)N2CCOc3cccc(F)c3C2)c(C)n1-c1ccc(Br)cn1 1448375296 QUMMWPGXCKGJJI-UHFFFAOYSA-N 444.304 4.426 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N2CCCC2)c(C)n1-c1ccc(C(C)C)cc1 1463832602 QNXQNVJMAXJADI-QFIPXVFZSA-N 425.598 4.355 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)C[C@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1473455750 OQJVUZDSOSWLRE-PUFAWVJESA-N 439.575 4.139 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2cnn(CC)c2)sc(C)c1-c1ccccc1 1473472372 MPCKPZNBDHTZNN-HNNXBMFYSA-N 440.569 4.406 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)[C@]12CCCO2 1478409307 OFQKKKDRBIHQSM-BWWDHELJSA-N 435.996 4.102 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2cccn2C)n1Cc1ccc2c(c1)CCCN2C 1505236480 WFKMPEGVPQMXPJ-GOSISDBHSA-N 438.645 4.292 10 10 IICE CC[C@@H](C)c1nnc(N(C)C[C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1512823901 ZREZYQMMUNGUAL-DENIHFKCSA-N 443.661 4.398 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OCCC)c1 1516762433 QYLPMWJFVBJVST-UHFFFAOYSA-N 430.520 4.170 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@@H](C)c3ccc(F)c(Br)c3)C2)cc1 1538745524 FCRDAXAIHULCJD-GDBMZVCRSA-N 435.337 4.486 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(OC(F)(F)F)cc1Br 1539108403 VJBMLLPRNFCHDE-UHFFFAOYSA-N 445.235 4.453 10 10 IICE Cc1cc(C(=O)Nc2ccc(Cl)cc2C(N)=O)c(C)n1-c1ccc(Br)cn1 1544576899 DVFVMFOVUIRLJE-UHFFFAOYSA-N 447.720 4.256 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C(C)C 1554478946 FEFUPQTTXRVZKW-JOCHJYFZSA-N 434.588 4.114 10 10 IICE CCC1(CC)CN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCS1 1559729396 VWGJTBOOMBEASZ-MRXNPFEDSA-N 436.577 4.397 10 10 IICE CN(C1CCCCC1)S(=O)(=O)c1cccc(NC(=O)c2ccc(N=NC(N)=O)cc2)c1 1565851383 YVBXMASIPZVWGO-UHFFFAOYSA-N 443.529 4.055 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Cl)c(O)c2)NC(=O)OC(C)(C)C)cc1 1565883986 FWKNYBRWMFJSGW-GOSISDBHSA-N 433.936 4.107 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2(c3cccc(F)c3)CCOCC2)cc1 1566118942 YRYFGCSPXATPTI-UHFFFAOYSA-N 434.511 4.410 10 10 IICE Cc1ccc(C)c(OCCCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1596684378 KMCAOLHDTYUMEB-UHFFFAOYSA-N 432.511 4.284 10 10 IICE COc1ccc(CN2C[C@@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)cc1 1597950247 LDSSEYNJUKHRRG-QFIPXVFZSA-N 449.595 4.129 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc4oc(=O)n(CCN(C)C)c4c3)c2C)c1 1598251157 JDEJIQIEBJFLPN-UHFFFAOYSA-N 446.551 4.433 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1613397802 YZQSLXRATLQDMN-LJQANCHMSA-N 431.600 4.373 10 10 IICE CC[C@]1(C)CC[C@H](Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)O1 1613684099 FLVJRUXHFYRZGH-AUSIDOKSSA-N 441.601 4.324 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc3c(c2)N(C(=O)OC(C)(C)C)CC3)cc1 1628469316 WLSMXCSTZAPAEL-UHFFFAOYSA-N 439.556 4.201 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2C)c1 1628651000 JZSHJZQSSFIIIY-LJQANCHMSA-N 433.512 4.341 10 10 IICE COc1cccc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2)c1 1629625924 PWEFMASUERHDMK-UHFFFAOYSA-N 445.563 4.318 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(S(N)(=O)=O)c(Cl)c1 1637243781 JBXHXFZLTLCGCY-HNNXBMFYSA-N 444.940 4.097 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F 1642998103 WZTKHUMDFNCSCS-KRWDZBQOSA-N 446.588 4.277 10 10 IICE COc1ccc(N2CCN([C@@H](C)c3nc(Cc4ccc(Cl)cc4)no3)CC2)c(OC)c1 1644225810 ZJBXRYQFQLHZKK-INIZCTEOSA-N 442.947 4.214 10 10 IICE COc1ccc(N2CCN(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)CC2)cc1F 1655258408 QBWMIMRGZJOCFB-UHFFFAOYSA-N 426.423 4.270 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)N(C)C)cc1 1679471156 MNUOMMMPGVKYFH-NHCUHLMSSA-N 430.980 4.222 10 10 IICE O=C(NCc1cccc(Br)c1O)NCC1(c2ccc(F)cc2Cl)CC1 1681265698 ANEGFOIFWIRRCV-UHFFFAOYSA-N 427.701 4.478 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H]3CC(=O)N(c4ccccc4F)C3)c2C)c1 1682713510 XAQLGDKNLVQRMX-HXUWFJFHSA-N 434.515 4.146 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC([C@@H](F)c4ccccc4F)CC3)cc2)CC1 1684973403 QVDSXWPWFOHYJQ-XMMPIXPASA-N 442.554 4.210 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1727690330 WMSWQIJHPLSPQH-RXVVDRJESA-N 448.615 4.456 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@H]1CCSC1 1729405472 XWGWKVVKJDVECL-HXUWFJFHSA-N 443.661 4.093 10 10 IICE Cc1cc(-c2nnc(N3CCN(CC(F)F)CC3)n2CC(C)C)c(C)n1-c1ccccc1 1742119297 SAFSEFRDWVLWHF-UHFFFAOYSA-N 442.558 4.396 10 10 IICE CCCNC(=O)[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)C1 1764502987 FDCBWNDSPWWLED-NRFANRHFSA-N 440.636 4.039 10 10 IICE CCCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1766001454 OFKZDVCHEHEHSB-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@@H](C)C1 1771095498 RBFIRMKGOWITKB-ZWCUEREDSA-N 445.583 4.024 10 10 IICE COC(=O)c1ccc(O)c(-c2csc(NS(=O)(=O)c3ccc(C)c(Cl)c3)n2)c1 1858073793 JWILWBIVFLOARQ-UHFFFAOYSA-N 438.914 4.065 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H]2NCc2c(O)cccc2Br)C1 1918963757 OHYIBIZGYVCCMH-YLJYHZDGSA-N 425.367 4.424 10 10 IICE COc1ccc(O)c([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1 1951376068 KCYFMCMZOVLWNU-JOCHJYFZSA-N 433.460 4.455 10 10 IICE Cc1ccc(OCCCOc2ccc(C=C3C(=O)NN(c4ccccc4)C3=O)cc2)cc1 2293420542 LFNOYHLDMLLSKM-UHFFFAOYSA-N 428.488 4.304 10 10 IICE CC1CCN(C(=O)CN2C(=O)C(=Cc3ccc(-c4ccccc4)o3)SC2=S)CC1 2314485641 ALLTZFJXPIHADO-UHFFFAOYSA-N 426.563 4.406 10 10 IICE Cc1ccc(CN=c2[nH]c(CN(C)C(=O)OC(C)(C)C)cs2)c(O)c1Br 2352946925 DRMLMQTWWPJDQV-UHFFFAOYSA-N 442.379 4.321 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457446 NMFAWQPPLQLABQ-JOJBRYAWSA-N 428.554 4.304 10 10 IICE Cc1ccc(Cl)cc1N1C(=O)N=C(O)/C(=C/c2cc(Cl)ccc2OCC(=O)O)C1=O 33306136 KFFXZMQFCWSHLT-AUWJEWJLSA-N 449.246 4.272 10 10 IICE Cc1cccc(C(=O)Nc2ccc(N3CCCN(Cc4ccc(N(C)C)cc4)CC3)nc2)c1 34681860 XRISWIFPFMOHRA-UHFFFAOYSA-N 443.595 4.421 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(c3ccc(C(=O)OC)cc3)C2=O)cc1OC 40859254 LWHZDILDIPPLDD-PDGQHHTCSA-N 429.519 4.286 10 10 IICE CCCOC(=O)c1nc2cc(C)c(C)cc2nc1N1CCN(c2ccc(OC)cc2)CC1 64690507 MYASLXFKYDUEEW-UHFFFAOYSA-N 434.540 4.149 10 10 IICE CC(C)OC(=O)c1ccc(-c2ccc(/C=C3\C(=O)NN(c4ccc(F)cc4)C3=O)o2)cc1 103385875 DDQDBCSRNXRAFZ-DEDYPNTBSA-N 434.423 4.112 10 10 IICE COc1ccc(OC)c([C@@H](C)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726703000 SUAUOQAPCLSHDX-OAHLLOKOSA-N 449.498 4.334 10 10 IICE CN(C)C(=O)c1cccc(NC(=O)CN2CCCc3cc(OCc4ccccc4)ccc32)c1 734485113 ARAZMRIIVJCSTL-UHFFFAOYSA-N 443.547 4.359 10 10 IICE CCCN(C[C@@H]1CCCCO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905377 NOJIHGCRTWGDPI-XLIONFOSSA-N 425.520 4.248 10 10 IICE Cc1cc(CCNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 746424262 HYLRYOMXGFBWHQ-UHFFFAOYSA-N 425.573 4.400 10 10 IICE Cc1cc(CCNC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 765555198 IBABOZSBGPJWOS-LJQANCHMSA-N 435.515 4.301 10 10 IICE O=S(=O)(Cc1ccc(Cl)cc1Cl)N(Cc1ccccc1O)C[C@@H]1CCCO1 779624040 KBOCUBUBWDNHMX-KRWDZBQOSA-N 430.353 4.210 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cc(C)cc(Br)c2O)C1 781912586 QOWNMJOZNPLGDD-ZDUSSCGKSA-N 437.300 4.086 10 10 IICE CC[C@H]1CCCCN1C(=O)CN(CC(=O)N1CCCC[C@@H]1CC)c1ccc(OC)cc1 914868059 JEFUDDVTHWCBBS-SFTDATJTSA-N 429.605 4.084 10 10 IICE C[C@@H]1CN(c2ccc(CNc3ccc(/C=C\C(=O)O)cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 917087269 VQFJIPVFOLUFRX-OVUXIIJLSA-N 429.448 4.057 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 1124549653 NXZHFYIJTOACOK-JTHBVZDNSA-N 425.960 4.118 10 10 IICE CCc1nc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cs1 1126259796 HDXSNQWTHNPFGM-HMHNVIDESA-N 449.598 4.313 10 10 IICE CON(C[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1141446971 TYSVGHXNPVZWSN-BFSNVGPHSA-N 448.585 4.243 10 10 IICE Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)n(-c2ccccc2)n1 1224439264 CIMUESGRVJFDOS-PMACEKPBSA-N 433.600 4.417 10 10 IICE COc1ccc(C[C@@H](C)CNC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1OC 1225337531 HSRBZCAFQKFFLN-MJGOQNOKSA-N 427.589 4.187 10 10 IICE CCOc1ccc(N2CCN(Cc3ccc(OC)c(OC)c3Br)CC2)cc1 1233203499 ZKBXIVTYNJZMME-UHFFFAOYSA-N 435.362 4.187 10 10 IICE C[C@H]1CC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)CN1C(=O)OC(C)(C)C 1234107051 OMZAYGNCMLPAOM-SMDDNHRTSA-N 432.348 4.286 10 10 IICE CC(C)(C)OC(=O)NCC(F)(F)CNC(=O)N(Cc1ccccc1O)C1CCCCC1 1234938316 NOUPPVCPFUXJIY-UHFFFAOYSA-N 441.519 4.397 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCN(C4CCC(C(C)C)CC4)CC3)C2)cc1 1252115263 JDHFZCHFCYLYAH-DDRJZQQSSA-N 442.648 4.064 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)N(C)C)cc1 1256231859 HEJWXJWRHYKEPF-GGAORHGYSA-N 445.007 4.262 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)CC2)cc1 1264733195 QRPYVRJJSCYKHH-NRFANRHFSA-N 445.604 4.160 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)C[C@@H](C)S1 1291250605 VXKGSHHRAWYMGX-BZUAXINKSA-N 439.676 4.141 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCNc3ccc(-c4ccccc4)nn3)ccc21 1294515450 JLYHXTHJZBFYGN-UHFFFAOYSA-N 443.551 4.203 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OCCOC)C1 1294593414 LPJHYCQNBUXNRV-QFIPXVFZSA-N 437.588 4.394 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c1 1300028576 GACTYKFHBPTJEC-HNNXBMFYSA-N 441.881 4.278 10 10 IICE Cc1nn(C)c(Sc2ccccc2)c1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1357129079 OCEKFUCPXGQUKO-QGZVFWFLSA-N 436.581 4.207 10 10 IICE CCC1(CC)[C@H](OC)C[C@H]1N(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357356065 LCVFGMDEVDWHBD-DNQXCXABSA-N 425.617 4.460 10 10 IICE CCc1ccccc1N1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CC1=O 1360071813 IWHHGIQHAQMHOR-LJQANCHMSA-N 447.501 4.259 10 10 IICE CCOc1ccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c(C(N)=O)c1 1435225818 WNNFKKBOPGGJME-UHFFFAOYSA-N 425.916 4.426 10 10 IICE Cc1noc(C2CC2)c1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1435667618 VBDKBJGEDBEJND-XNTDXEJSSA-N 431.514 4.230 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(Cl)c(Cl)c3N)cc2F)C[C@@H](C)O1 1441788156 SFHGKDSZFBUWQU-TXEJJXNPSA-N 426.319 4.258 10 10 IICE CC(C)[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)N1C[C@H](C)O[C@H](C)C1 1448454198 UFINYULIKBVNHO-GBPOLFSSSA-N 436.040 4.326 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccccc3-c3ccccc3)CC2)c(OC)c1 1461983607 PFRBXLZBMAPHKT-UHFFFAOYSA-N 432.520 4.098 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)cc1 1479002800 PLZJDTJMLNCNMT-DNQXCXABSA-N 436.600 4.415 10 10 IICE CC(C)CNC(=O)c1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1523631191 IAPRQVPDBKJLFC-UHFFFAOYSA-N 446.595 4.432 10 10 IICE CC(C)c1ccccc1OCCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1535560856 GCJWZRYLJNRPNL-UHFFFAOYSA-N 435.612 4.427 10 10 IICE COc1ccccc1N1C[C@@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 1542412336 WUCZMFFPDNLNOD-FQEVSTJZSA-N 435.568 4.133 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1c(Cl)cc(F)cc1Br 1557640912 WZIDJHATGKQKFM-UHFFFAOYSA-N 441.728 4.133 10 10 IICE C[C@@H](NC(=O)c1ccc(I)c(Br)c1)c1ccccc1O 1557966876 RRSOXHVJOLYUCV-SECBINFHSA-N 446.082 4.250 10 10 IICE CC(C)(C)OC(=O)NC[C@]12CCCC[C@@H]1CN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1558856721 GWIWXUDPLHFPGM-CMJOXMDJSA-N 446.569 4.470 10 10 IICE COc1cc(Cl)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1565882185 SAUVHMJDSJZLER-FQEVSTJZSA-N 447.963 4.410 10 10 IICE CCc1cc2c(CC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)csc2s1 1586863889 AKVQSLOHYDPZGA-UHFFFAOYSA-N 432.586 4.484 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(CC)[C@@H]2c2cccc(C)c2)cc1F 1616924871 OPWZZGKJDKDORK-HYBUGGRVSA-N 425.548 4.206 10 10 IICE CCC[C@@]1(CO)CCN(CC(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OCC)C1 1618265097 HENVHUNKWIRCMI-XMMPIXPASA-N 444.597 4.323 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(C3CC3)[C@@H]2c2cccc(OC)c2)cc1 1623451935 ORVDVLDYLDONOI-AOYPEHQESA-N 449.595 4.252 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nccnc1C(=O)Nc1ccc(Cl)cc1 1623549752 KKWXCVOHUSLONE-UHFFFAOYSA-N 449.942 4.255 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1cc(Cl)c2c(c1)OCCO2 1624734222 NMIKPSPWUOQQNN-UHFFFAOYSA-N 438.911 4.304 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)CCCC1 1628179764 JRHMYOOAMHRHDR-QGZVFWFLSA-N 443.588 4.148 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(Oc4ccccc4OC)cn3)CC2)cc1 1636702091 BUOOWNSVKRCMRE-UHFFFAOYSA-N 433.508 4.244 10 10 IICE Cc1c(Br)ccc2[nH]c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cc12 1637004686 LNZDTSVVMFJHQD-NRFANRHFSA-N 443.389 4.338 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccc(F)cc3Cl)CC3CC3)cc2)CC1 1638007461 NPDMWWWYTMXAIN-UHFFFAOYSA-N 444.982 4.353 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1CC2(C1)CC(NC(=O)OC(C)(C)C)C2 1683425450 PSMFQFHYLSWJIJ-BRICXYORSA-N 444.620 4.127 10 10 IICE C[C@H](NC(=O)NCc1cccc(Br)c1O)c1cc(Cl)cc2c1OCC2 1685387848 LBQFYUAAZBHXES-JTQLQIEISA-N 425.710 4.303 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2C[C@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1692987735 LOVZHOSTJXWENJ-FXAWDEMLSA-N 448.615 4.360 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2scnc2C)n1Cc1ccc(N2CCOCC2)cc1 1693992056 USFMJUCMDJNXJS-KRWDZBQOSA-N 440.617 4.078 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1698406376 JSDYQIBZJAJVKT-OXQOHEQNSA-N 435.613 4.351 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1709480725 JUFRIMMDRCSVAY-DWXRJYCRSA-N 448.615 4.456 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CC[C@@H](F)C1 1747719888 DEBZSBYOSNTCTF-VQTJNVASSA-N 429.584 4.187 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1750303501 JMDRLJLWQLFCGV-WMZOPIPTSA-N 435.613 4.003 10 10 IICE COc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)c(CCC(=O)O)s2)cc1C 1858070532 RMHGFZBMEMONEG-UHFFFAOYSA-N 438.552 4.007 10 10 IICE COc1ccc2c(c1)c(/C=C1/SC(=S)N([C@H](C(=O)O)c3ccccc3)C1=O)cn2C 1858591175 AJXGYZVXGAWROS-VBIXMBBUSA-N 438.530 4.214 10 10 IICE COc1cc(/C=C2/SC(=S)N(C[C@@H](c3ccccc3)N3CCCC3)C2=O)ccc1O 1858594215 PTYNZGFWFKDUFX-SXZORUHJSA-N 440.590 4.439 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CCCN(C(C)=O)C2)sc(C)c1-c1ccc(C)c(C)c1 1860645548 CGKHSULVYRFCOV-GOSISDBHSA-N 428.554 4.324 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3Br)CC2)cc1 1891648812 FFOCCKCDAXBURF-UHFFFAOYSA-N 443.263 4.439 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@H]2NCc2c(O)cccc2Br)C1 1918963756 OHYIBIZGYVCCMH-XLIONFOSSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1CCNCc1cccc(Br)c1O 2226207563 QARSBERGIOYNLA-CYBMUJFWSA-N 435.309 4.279 10 10 IICE COc1ccc(Br)c(CNC2([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1O 2236049802 WKAQLIYIKIGLFW-CYBMUJFWSA-N 441.366 4.043 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C2CC2)c1O 2236051518 UKUBKTXSCPSUGM-RDJZCZTQSA-N 441.366 4.041 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)c1O 2236056767 XIWOKXYAUMSXSK-KBPBESRZSA-N 443.382 4.146 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1cccc(C(=O)O)c1 2293175961 JTZGYFSJKDLGJM-UHFFFAOYSA-N 426.519 4.005 10 10 IICE CCOc1ccc(C=C2SC(=S)N([C@H](C(=O)O)c3ccccc3)C2=O)cc1OC 2295982128 ITDPGNMDEFQEJZ-SFHVURJKSA-N 429.519 4.121 10 10 IICE CCSC1=NN2C(=N)C(=Cc3cc(C)n(-c4ccc(OC)cc4)c3C)C(=O)N=C2S1 2297463270 XTXGHDGFIBUQMB-UHFFFAOYSA-N 439.566 4.433 10 10 IICE COc1cccc2c1O[C@H](C)C(C=C1SC(=S)N(CCCCCC(=O)O)C1=O)=C2 2314450705 MQRASQFHYMPBRK-CYBMUJFWSA-N 433.551 4.249 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[C@@H](NCc1cc(Br)cc(F)c1O)C2 2329450767 UQPBQMJGBVNJLR-RBOXIYTFSA-N 429.330 4.029 10 10 IICE NCc1ccc2c(c1)CCN2Cc1ccc(I)c(Br)c1 2377344849 SZYHILHIDOCQHP-UHFFFAOYSA-N 443.126 4.075 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2cccc(C)c2)c1C 1101753 VTXUGKVHJBBVRP-ZZAWEDPDSA-N 434.536 4.254 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccccc2)SC1=S)NCc1nc2ccccc2s1 206726166 ZXFMMKVGMMBZBU-SFQUDFHCSA-N 439.587 4.204 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)Cc2c(C)nn(-c3ccc(C(F)(F)F)cn3)c2C)c1 728981969 GMTCAHPKOLSLHE-GFCCVEGCSA-N 448.445 4.037 10 10 IICE CN(CC(=O)N1CCC(OCc2ccccc2)CC1)Cc1ccc(N2CCCCC2)cc1 738298968 KFCZCQRZMNGKCE-UHFFFAOYSA-N 435.612 4.317 10 10 IICE CCc1ccc(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1CC 760008314 KSHPLFUNZBXGSY-UHFFFAOYSA-N 427.545 4.191 10 10 IICE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1[C@H]1COc2c1ccc(Cl)c2Cl 761250065 FDNUEGWUHSLJTB-ZDUSSCGKSA-N 427.671 4.250 10 10 IICE Cc1ccc2c(c1)[C@H](NCc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)CCCO2 765279314 DGKLRXJDHUCDOW-HSZRJFAPSA-N 447.558 4.254 10 10 IICE C[C@H]1CN(Cc2cccc(N[C@@H](C)c3ccc(N4CCOCC4)c(F)c3)c2)C[C@@H](C)O1 777226458 FOZVRYKMPIDOOI-ZCNNSNEGSA-N 427.564 4.445 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](c4cccc(O)c4)C3)n2C)c(C)n1-c1ccccc1 809872556 HHCLFFQEDYGBHJ-HSZRJFAPSA-N 429.524 4.173 10 10 IICE Cc1cc(Br)c(O)c(CN2CC[C@@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c1 856558540 JFTJVOXUZWLXFP-HXUWFJFHSA-N 448.405 4.352 10 10 IICE COc1ccc(OC)c([C@@H]2CCCN2C(=O)NCc2ccc(N3CCSCC3)cc2)c1 916626055 QZNFJIJXOPPRHH-QFIPXVFZSA-N 441.597 4.304 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2CCC(OC[C@H]3CCCO3)CC2)cc1 1125893417 MBDLTARFGCXRJE-DQVLVPHSSA-N 442.522 4.398 10 10 IICE COc1ccccc1C(F)(F)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1125949028 VOGMUPNZZYWHRK-UHFFFAOYSA-N 426.410 4.174 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(NC(=O)CC(C)C)c(F)c3)C2)cc1 1130185783 QWERUWTZCORCFP-KRWDZBQOSA-N 427.520 4.075 10 10 IICE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1131781688 JWDUTTXYMJNALU-VWLOTQADSA-N 445.563 4.066 10 10 IICE CCOC(=O)Cc1csc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)n1 1136310134 XMGFMUWEKKLJKI-UHFFFAOYSA-N 425.510 4.029 10 10 IICE Cc1nc(C(=O)NCc2ccc3cccnc3c2O)nn1-c1c(Cl)cccc1Cl 1142728192 NTYVMPMTGAMAFZ-UHFFFAOYSA-N 428.279 4.066 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@]3(C(=O)OC(C)(C)C)CCCO3)cc2Cl)C1 1155727484 SYSHPJYDBKNEQI-QMHKHESXSA-N 436.980 4.083 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@]3(C2)CN(Cc2ccccc2)C[C@@H](C)O3)c1O 1197272710 DGMZCLKPJORRTA-OSPHWJPCSA-N 428.960 4.114 10 10 IICE CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1255508839 GKTQWEGPGZUVOH-DQEYMECFSA-N 448.611 4.256 10 10 IICE O=C(N(Cc1ccccc1O)C[C@H]1CCCO1)C(F)(F)c1ccc(Br)cc1 1295406093 OERFBMJSIZSHIQ-QGZVFWFLSA-N 440.284 4.454 10 10 IICE O=C(CCCc1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)cc1 1301349481 HMMXGGMVXVFKCH-UHFFFAOYSA-N 431.374 4.049 10 10 IICE Cc1cc(C(=O)N=[S@@]2(=O)CCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1303912357 KLTZBKYWHAKDTE-HHHXNRCGSA-N 444.354 4.475 10 10 IICE CCc1nnc(N2CCN(Cc3ccccc3)C[C@H]2C)n1CCCSc1nccs1 1306205704 SLACDCNXQUUGLZ-GOSISDBHSA-N 442.658 4.190 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NC(C)C 1306345188 GURJHFOADKWDEG-FQEVSTJZSA-N 434.588 4.256 10 10 IICE CC(C)N(CC(=O)Nc1ccccc1C(=O)NC1CCCC1)Cc1ccc(N(C)C)cc1 1307423878 JJMADAIYASXCNT-UHFFFAOYSA-N 436.600 4.274 10 10 IICE COC(=O)c1cc(C(=O)CN(Cc2ccc(C)s2)c2ccc3c(c2)OCCO3)c(C)[nH]1 1307540589 AVHZQBADSLSBJT-UHFFFAOYSA-N 440.521 4.140 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCC[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 1312313024 CWABLUFSEGLBDH-GGAORHGYSA-N 438.616 4.074 10 10 IICE Cc1cc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c(C)n1-c1ccc(Cl)cc1 1349400830 FDURZTTWIDTOEE-UHFFFAOYSA-N 445.972 4.179 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OC(C)C)c1 1354659554 WHXOZBIYCZKDIC-UHFFFAOYSA-N 430.520 4.168 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)c(Br)cc3F)CC2)cc1 1356444676 BYMQWUVRTJUFIS-UHFFFAOYSA-N 427.701 4.213 10 10 IICE CCOC(=O)CN(CCC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccccc1O 1460281193 WOSNTJIPMQOBDA-UHFFFAOYSA-N 425.312 4.093 10 10 IICE Cc1cc(CC(=O)Nc2cc(C(N)=O)ccc2OCC(F)F)c(C)n1-c1ccccc1 1460650094 OQSHHCCLIMUJIJ-UHFFFAOYSA-N 427.451 4.018 10 10 IICE CN(c1ccc(CNC(=O)CCc2ccc(S(C)(=O)=O)cc2)cc1)C1CCCCC1 1464538435 OPEUSRLWRQTCOH-UHFFFAOYSA-N 428.598 4.108 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CCO1 1497617358 ZFDJRYPEAXQQAO-FQEVSTJZSA-N 433.603 4.491 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(CN3C(=O)c4ccccc4C3=O)c(C)o2)cc1 1516600117 SCDGAEYHPLDGMF-UHFFFAOYSA-N 445.519 4.160 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCOCc2ccc(Cl)cc2)C1 1525981452 VEMUKIOLTOBBRR-UHFFFAOYSA-N 439.987 4.394 10 10 IICE COc1ccc([C@H](OC)[C@H](C)NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1527126901 GKTBREGPWZKTRU-MRDQGFSESA-N 436.552 4.430 10 10 IICE CCOC(=O)c1c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc(OC)cc1OC 1533500054 ANBNDMLNRVJGKI-UHFFFAOYSA-N 436.508 4.469 10 10 IICE CC(C)c1ccc(-c2noc(CCC(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)n2)cc1 1539235022 JVMZEHZIITULKE-HSZRJFAPSA-N 449.599 4.278 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543040381 WMOJYXJSHSYWTK-OAQYLSRUSA-N 435.620 4.045 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCc3nnc(-c4ccccc4)n3C)c2C)c1 1556148130 WQRKFIJOJOBHLY-UHFFFAOYSA-N 427.552 4.479 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1556807625 LWODCRKFZVSSRS-KRWDZBQOSA-N 434.378 4.170 10 10 IICE COc1ccccc1-c1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)s1 1567592069 PIDARSJXGBMREH-UHFFFAOYSA-N 449.576 4.022 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1 1587686545 ALYSFWTVNLFMBO-DRKIFQHWSA-N 436.577 4.406 10 10 IICE C[C@@H](Sc1nc2ccccc2s1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1616858197 IUXBHQNEEAKDIY-DNVCBOLYSA-N 428.627 4.262 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CC1(N(C)C)CCC1 1617941453 QTFJZQLCPBRPEJ-TZIWHRDSSA-N 441.620 4.023 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C/C(=O)N(CCN2CCCC2)c2ccccc2)C1 1618187622 OYGHALNYVYQAQE-ARKBFRDHSA-N 427.589 4.319 10 10 IICE CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623549701 ISTIDESXLJBWPH-HSZRJFAPSA-N 440.563 4.052 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C)Cc1ccccc1OC 1623581058 SEKSBUBMKNUSLV-NRFANRHFSA-N 434.536 4.173 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1 1628399351 SFODEMQLTRWZLW-HSZRJFAPSA-N 449.938 4.024 10 10 IICE COCc1cc(O)ccc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1629689041 UMRILNLMIVVFKG-GZTJUZNOSA-N 448.591 4.220 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccccc2F)c(C)n1-c1ccc(Br)cc1 1630956810 FYEZBDWOFFLDNI-HXUWFJFHSA-N 431.305 4.459 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCNc3ncnc4ccc([N+](=O)[O-])cc34)c2C)c1 1634397808 KUULFVPXTQQGHB-UHFFFAOYSA-N 444.495 4.096 10 10 IICE Cc1nc(O)c(Br)cc1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1634866692 GWTUDLJEJWLCPF-UHFFFAOYSA-N 428.330 4.238 10 10 IICE Cc1cc(CC(=O)N(C)CC(C)(C)CN2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1637015457 BROHSVKJBFZXPJ-UHFFFAOYSA-N 432.008 4.107 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2COc2cccc(C=O)c2)cc1 1639813972 FCVLWEUFEFSFON-UHFFFAOYSA-N 432.520 4.295 10 10 IICE CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1671424420 BUMRXAQEMSNVHT-ZCYQVOJMSA-N 448.611 4.147 10 10 IICE C[C@H]1CCCCN1CCC1CCN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1685681395 FQHFHZZERUBVEM-OFVILXPXSA-N 443.680 4.041 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1CSCCN1Cc1ccccc1 1686093297 PONYYNZLZRICTL-DEOSSOPVSA-N 438.641 4.046 10 10 IICE C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCN1C(=O)OC(C)(C)C 1686310165 XIWCIRAFOIFTAP-ICSRJNTNSA-N 430.593 4.216 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)c(F)c1 1692651240 DLKOBIJDLSPAHG-QGZVFWFLSA-N 434.519 4.308 10 10 IICE C[C@@H]1CCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C[C@@H]1C 1726618122 CECWHFYYFQVWJO-SJORKVTESA-N 428.631 4.385 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1 1726798681 FMHVFKQDHLIKNH-OFVILXPXSA-N 437.588 4.129 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1730479537 JCVHGLRQFCEWOJ-UYAOXDASSA-N 443.592 4.279 10 10 IICE CC(C)c1nnc(N2CCC(C(=O)C(F)(F)F)CC2)n1CCCSc1nccs1 1760905002 PCMDQFHAFBUSTC-UHFFFAOYSA-N 447.552 4.388 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@H]3C)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1761676346 GMBZWSULRNPUHZ-UYAOXDASSA-N 448.615 4.360 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC[C@@H](C)C1 1767766288 DNPNAMLOTYJVPL-NQIIRXRSSA-N 448.615 4.361 10 10 IICE Cc1c(NC(=O)CCNCc2cc(Cl)cc(Br)c2O)cccc1[N+](=O)[O-] 1860714943 DYGFDWUJFNMPKT-UHFFFAOYSA-N 442.697 4.143 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c1O 2236050156 BGIAROGKQJKGDG-LRDDRELGSA-N 443.382 4.192 10 10 IICE CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(-c3ccc(C)c(C(=O)O)c3)o2)C1=O 2313556592 FBPGFZXVSHHAST-UHFFFAOYSA-N 444.443 4.182 10 10 IICE O=C1N=C(O)/C(=C/c2cc(Cl)cc(Br)c2O)C(=O)N1c1ccc(F)cc1 59135003 FZUMUQVCAHOPQM-SDQBBNPISA-N 439.624 4.454 10 10 IICE CCOC(=O)c1ccccc1NCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S 96576525 FOQVWSCHUZBFGN-BOPFTXTBSA-N 443.506 4.042 10 10 IICE Cc1nc(C)c([C@@H](C)N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 769044659 WWNKILSFULXAIQ-GOSISDBHSA-N 441.645 4.195 10 10 IICE COc1ccc(Cl)cc1N1C(=O)/C(=C\c2c(Br)cnn2C)SC1=S 779221211 RBXUPPVJZSDBIM-AWNIVKPZSA-N 444.763 4.250 10 10 IICE COC(=O)c1cc(-c2csc(NS(=O)(=O)c3cc(C(C)C)c(OC)cc3C)n2)c[nH]1 788544252 HRJSACNWUOZCRH-UHFFFAOYSA-N 449.554 4.166 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H]([C@H]2CCCOC2)C(F)(F)F)C1 789646425 OVJQMBIBBLHRRY-KSFYIVLOSA-N 438.490 4.309 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccoc2C(F)(F)F)NC(=O)OC(C)(C)C)cc1 810448234 WYAPZVAFENFUHW-INIZCTEOSA-N 441.450 4.360 10 10 IICE COc1cc(Cl)ccc1-c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCO1 812255601 JEIJUUXOMMEXGA-QGZVFWFLSA-N 428.920 4.128 10 10 IICE Nc1nnc(CCCN(N=Nc2cccc([N+](=O)[O-])c2)c2cccc([N+](=O)[O-])c2)s1 1084076023 QLMXJSFQFKDXGI-UHFFFAOYSA-N 428.434 4.075 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CC(c4ccccc4[N+](=O)[O-])=NO3)c2C)c1 1132044777 YBFDJKPDXYJTMR-QHCPKHFHSA-N 432.480 4.120 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CCCN3C(=O)OC(C)(C)C)c2C)cc1 1147021955 XIPAZWGLLKASGI-LJQANCHMSA-N 427.545 4.232 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](Cn3ccccc3=O)c3ccccc3)c2C)cc1 1155551822 PNZJIYPGKSMBOC-VWLOTQADSA-N 441.531 4.436 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cccc(Br)c2O)c1 1156790190 FCQNNLSCEWILDA-UHFFFAOYSA-N 427.298 4.305 10 10 IICE CCN(Cc1c(CO)cnc(C)c1O)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1161767350 HWEGVSBBMZLXJY-UHFFFAOYSA-N 427.932 4.311 10 10 IICE Cc1nn(CCSc2ncc(-c3ccc(Br)cc3)n2CC(C)C)c(=O)o1 1165240269 ZTOUIKVFQQGMDX-UHFFFAOYSA-N 437.363 4.219 10 10 IICE CC(C)[C@@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c2ccccc21 1194000875 ZFWOPFYCUZRRRA-KNKQGSTJSA-N 439.575 4.315 10 10 IICE COc1ccc(C[C@@H]2CCCN(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)C2)cc1 1252117952 ZMIIDBQLJRWVKM-VXKWHMMOSA-N 437.584 4.194 10 10 IICE CC(C)(C)OC(=O)N1CCCCC[C@H]1CNC(=O)NCc1c(O)ccc2c1CCCC2 1256162843 WOESEFYELXDHLO-SFHVURJKSA-N 431.577 4.250 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Cc3ccc(C4CCCCC4)cc3)cc2)C1 1264736808 DBJCVNUKIGEEIB-DEOSSOPVSA-N 433.596 4.295 10 10 IICE CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1289600219 NKHKFBZYQBUTBX-HXUWFJFHSA-N 430.574 4.194 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1292056429 HLVGPAFTDGOYFN-CABCVRRESA-N 433.394 4.102 10 10 IICE CO[C@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC1(C)C 1300810008 LNYPDUBTBPSGMH-KRWDZBQOSA-N 429.615 4.445 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C 1315728780 BGCPMPPRXZSUIP-IIBYNOLFSA-N 443.592 4.045 10 10 IICE Cc1c(O)nc2ccccc2c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880157 FPVKZQBQUVLTRJ-KRWDZBQOSA-N 425.916 4.002 10 10 IICE Cc1[nH]nc(C(F)F)c1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1446213563 ZNHUUGPXSZZHRO-WQLSENKSSA-N 440.472 4.025 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCC3(CCC3)O2)c(C)n1-c1ccc(Br)cn1 1456554381 BOKRXYDLOQDGQC-QGZVFWFLSA-N 432.362 4.473 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCCS(=O)(=O)Cc1ccccc1 1458102098 UUOKWAJNXUIYSR-UHFFFAOYSA-N 438.505 4.243 10 10 IICE Cc1cccc([C@@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCOCC2)c1 1464141912 SDHHQXBZYWMXQR-AREMUKBSSA-N 445.563 4.018 10 10 IICE C[C@H](Cc1ccc(F)c(Br)c1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1470447390 GWLBCHLZHLAPJI-OAHLLOKOSA-N 449.364 4.044 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC[C@@H]3CN3C[C@@H](C)O[C@H](C)C3)c2C)c1 1471036779 ZKKGWRAUHJUIML-DNRQZRRGSA-N 438.616 4.186 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@]3(C=Cc4ccccc4O3)C2)N(C)C)cc1 1471546802 FUZSVNRPIFNAOH-BVAGGSTKSA-N 434.584 4.005 10 10 IICE Cc1csc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1529759310 LIDNFWAYTPHEID-KMHUVPDISA-N 435.571 4.059 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@@H]1c1ccncc1 1540585954 CGVQMTHYSJRNFE-XWALVKJWSA-N 441.553 4.176 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N(C)CC2COC(C)(C)OC2)cc1F 1552822662 KSHFQGNFPBUWIG-UHFFFAOYSA-N 445.583 4.024 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@H](N(C)C)C23CCC3)c(C)n1-c1ccc(Br)cc1 1557697610 WJDKWAJJVYOBTF-PMACEKPBSA-N 430.390 4.459 10 10 IICE CCCCNC(=O)[C@@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1587661238 MRFZLFKZZDQKDI-FQEVSTJZSA-N 434.005 4.108 10 10 IICE CCC[C@@H](Cn1c([C@@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1614395725 XBXRCHILPNKUQQ-HKUYNNGSSA-N 433.572 4.081 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1615430977 FXQXJYAQYZNXMT-JOCHJYFZSA-N 438.664 4.075 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2CCNS(C)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1625119846 VKZMLLPBXAQRMP-NRFANRHFSA-N 445.629 4.152 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1626155590 YQSPLDBQAFHTCZ-GJZGRUSLSA-N 445.560 4.088 10 10 IICE Cc1cc(CC(=O)Nc2ccnn2C2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1627358705 WWHFQYCNHXOZLZ-UHFFFAOYSA-N 449.555 4.264 10 10 IICE CC(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1628854593 QMFSLUGXGFHELB-XNMGPUDCSA-N 449.639 4.276 10 10 IICE Cc1cc(C(=O)N2CCC(c3ccncn3)CC2)c(C)n1-c1ccc(Br)cn1 1629838950 FLPYHZYHWRGYFK-UHFFFAOYSA-N 440.345 4.061 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cccc(CS(=O)(=O)C(C)C)c2)c1 1633481672 RPFNBDWJRURTGC-UHFFFAOYSA-N 438.549 4.482 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c1 1634944627 XLAVWHPUGJZDJF-UHFFFAOYSA-N 439.462 4.274 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC[C@@H](S(=O)(=O)Nc2ccccc2)C1 1645437318 VBLZHQRMHXRJJM-LJQANCHMSA-N 443.594 4.202 10 10 IICE O=S1(=O)N=C(CSc2ncc(-c3ccccc3)n2CC(F)(F)F)c2ccccc21 1656247127 XULUNGRPBZFJSH-UHFFFAOYSA-N 437.468 4.396 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@@H]2CCC(=O)OC(C)(C)C)N(C)C)cc1 1684612108 NOHOGMAZVMDLEQ-YADHBBJMSA-N 446.636 4.041 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCN(CC(C)C)C2)n1 1707582722 CNWAMQDHKDLQGK-NRFANRHFSA-N 448.615 4.359 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1727174483 TULRCGFXHZRKPU-UHFFFAOYSA-N 444.599 4.219 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1727662493 KODVZNQCVFBDQO-VGSWGCGISA-N 434.588 4.066 10 10 IICE CC/C=C/Cn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727846364 ZFSGDNZEGAPATB-QPJJXVBHSA-N 445.571 4.128 10 10 IICE CCN(CC1CCN(c2ccccn2)CC1)c1nnc(C)n1Cc1ccc(N(C)C)cc1C 1728479238 LFXKDBGJEDVBAD-UHFFFAOYSA-N 447.631 4.147 10 10 IICE CCSc1cc(Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)ccn1 1747478995 SXEMGHZQVAFWCD-UHFFFAOYSA-N 432.553 4.237 10 10 IICE CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1866114036 HPTMVCYMLPTLHG-RUZDIDTESA-N 426.520 4.027 10 10 IICE CC[C@@H](CN(C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2)NC(=O)OC(C)(C)C 2053100084 LKVDIWSEQXPBSM-INIZCTEOSA-N 448.608 4.302 10 10 IICE COC(=O)c1c(C(F)F)nn([C@@H](c2ccc(OC)cc2O)C2(C)CC2)c1Br 2079877293 WCZDWALVMXVRON-AWEZNQCLSA-N 445.260 4.474 10 10 IICE COC(=O)c1c(C2CC2)nn([C@@H](C)c2cc(C)c(C)cc2O)c1I 2079980658 HXROXKKJGDLDLK-NSHDSACASA-N 440.281 4.083 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C2CC2)c(CO)c1I 2079983161 YRFNEIKXGCYIKK-HNNXBMFYSA-N 426.298 4.179 10 10 IICE Cc1cc(C=C2C(=O)NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 2296930510 LFYSEAFGWKRWNP-UHFFFAOYSA-N 433.895 4.410 10 10 IICE COC(=O)c1ccccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)o1 2297332392 MSZRNZDENGVCHQ-UHFFFAOYSA-N 444.443 4.016 10 10 IICE CC[C@@H](C)N(CC(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2380760595 YUWMSEYFPOSIQL-CQSZACIVSA-N 443.382 4.457 10 10 IICE Cc1ccc(CN(C)C(=O)C=CC(C)(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380786157 HSVDXKBXAPUSPF-UHFFFAOYSA-N 441.366 4.281 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457141 HMRJNLLOXFBFOO-IXFSTUDKSA-N 428.554 4.258 10 10 IICE O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(S(=O)(=O)N3CCCC3)cc2[C@H]2C=CC[C@@H]21 14478046 OTHDFLUDLDVQNY-PNLZDCPESA-N 425.510 4.206 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551046 IPQSQFWUYLXWDV-XXULJNORSA-N 427.526 4.498 10 10 IICE CCCCOc1ccc(/C=C2\SC(Nc3ccc(O)c(C(=O)O)c3)=NC2=O)cc1OC 16933387 PKPPGXJWIMJENX-ODLFYWEKSA-N 442.493 4.360 10 10 IICE COc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=O)OC(C)(c3ccccc3)OC2=O)o1 59336955 BKKORJWFFVWPNY-UHFFFAOYSA-N 435.388 4.220 10 10 IICE CCCCn1nc(C)c(/C=C/C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1Cl 110360681 VXPYGHDDMSFSIY-ZHACJKMWSA-N 430.980 4.452 10 10 IICE COc1ccc(N2CCCN(C(=O)NC3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)CC2)cc1 303437594 DXUPJRCWTMLSAC-WINZOAQQSA-N 448.611 4.113 10 10 IICE CN1CCC[C@H](CNC(=O)NCc2ccc(N3CCSCC3)cc2)[C@H]1c1cccs1 743555504 ZYMMLJADUYEPBE-KNQAVFIVSA-N 444.670 4.184 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CCO[C@@H]1c1cnn(Cc2ccccc2)c1 752922814 OZLZRKIGNYCKBZ-IZZNHLLZSA-N 444.579 4.316 10 10 IICE C[C@H](N[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cc([N+](=O)[O-])ccc1O 756646235 KAQUSHFCIPJBOL-JQWIXIFHSA-N 430.814 4.297 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 760198625 CPPWGDUHGLWGRU-UHFFFAOYSA-N 447.583 4.174 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc(Cl)c1 761745549 KTLXLOJMACQRTO-CZAAIQMYSA-N 426.944 4.478 10 10 IICE COc1cc(C)c(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1C 767302806 NQNSMBCWWXHEBR-UHFFFAOYSA-N 430.416 4.248 10 10 IICE Cc1cncc(/C=C\C(=O)N2CCOc3c(NC(=O)/C=C/c4cncc(C)c4)cccc32)c1 791076201 HWTXRVCPNPSLKX-FFELTBSMSA-N 440.503 4.184 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(-c3ccccc3)on2)n1C[C@H]1CCCO1 812267015 IQHIKUNMNPYHRR-LJQANCHMSA-N 431.496 4.121 10 10 IICE Cc1cc(C(=O)N[C@H](c2cnn(C)c2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 820168420 OWHFDGYKDBXEJP-OAQYLSRUSA-N 426.948 4.115 10 10 IICE Cc1cc(C(=O)N2CCC(n3cc(N(C)C)cn3)CC2)c(C)n1-c1cccc(Cl)c1 820510510 PELPZAGGIVGFBJ-UHFFFAOYSA-N 425.964 4.487 10 10 IICE Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2/C(=O)N(C)C(=O)N(c3ccccc3)C2=O)o1 1084248863 KUMCXNYXDZIJAR-UYRXBGFRSA-N 431.404 4.172 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc4c(Br)cccc4cn3)CC2)cc1 1125248940 ALBASEYDQDBIOL-UHFFFAOYSA-N 440.341 4.358 10 10 IICE CCOc1ccc([C@@]2(C(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2(Cl)Cl)cc1 1127276671 LUTKPCBXHNSKRX-JOCHJYFZSA-N 449.378 4.258 10 10 IICE CCCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccccc1C 1129991420 PJFQOBWNMWOCKR-FQEVSTJZSA-N 432.568 4.398 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCC(=O)c2cccs2)NC(=O)OC(C)(C)C)cc1 1147505808 LGFSDRYPEPQFNZ-SFHVURJKSA-N 445.585 4.159 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1-c1cccc(Cl)c1 1147775415 KBGIFEMPOZOGFE-QGZVFWFLSA-N 439.903 4.377 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H](NC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1233975111 WRUNDEIGICWUDF-XMMPIXPASA-N 444.579 4.241 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(C)c4ncccc4C3)cc2Cl)C1 1235832716 GJWPQPHEJIENJR-KRWDZBQOSA-N 427.980 4.133 10 10 IICE COCCCOc1ccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1271763883 FMLRRJXBDUKIQY-UHFFFAOYSA-N 436.552 4.260 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 1292382613 UTBIQERJVMVMLT-AOYPEHQESA-N 435.612 4.172 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1293295821 ARAGFLCOJVPLML-MJGOQNOKSA-N 429.584 4.224 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCO[C@](C)(CC)C2)cc1 1295420891 ZAQYVHCLKLRATL-AREMUKBSSA-N 448.615 4.164 10 10 IICE Cc1cccc(-c2nnc(N(C)CCC(F)(F)F)n2Cc2ccc3c(c2)CCCN3C)n1 1304458646 SJZSNSGPYHWCRR-UHFFFAOYSA-N 444.505 4.468 10 10 IICE CC(=O)c1cc(F)cc(CN(CCc2ccc(Cl)cc2)C[C@@H](O)C(F)(F)F)c1O 1307813631 NSONLPWMABRSAK-GOSISDBHSA-N 433.829 4.355 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3ccc(Br)c(C)c3)C2)cc1 1312835123 GYUGPNYTAOOXFR-QGZVFWFLSA-N 432.362 4.092 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CNC(=O)NCc1cccc(Cl)c1O 1313232847 RBQPFWPUCCKHRU-GOSISDBHSA-N 445.947 4.207 10 10 IICE COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1313414822 NSUUSTGLZSUCSE-YKSBVNFPSA-N 438.616 4.343 10 10 IICE CCCOc1ccc(Cn2c(CC)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cn1 1313516594 MOSAPAMANLLOGU-UHFFFAOYSA-N 434.588 4.309 10 10 IICE CCN1CCN(c2ccc(CN[C@@H](c3ccccc3Cl)c3nccn3C)cc2F)CC1 1321277110 LTRNDWAJLJINJM-QHCPKHFHSA-N 441.982 4.234 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](C)COc2ccc(F)cc2F)CCCC1 1351449830 UFCSUOIBJMQKLN-OAHLLOKOSA-N 428.479 4.391 10 10 IICE COC(=O)[C@@H]1CC[C@H](C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)O1 1352965279 MCTDMMBANIDCQB-MOPGFXCFSA-N 443.500 4.016 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1CC[C@@H]1c1ccc(F)cc1 1354326866 DJYFKJNWDXQVGB-WOJBJXKFSA-N 436.449 4.491 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)cnc2Br)cc1 1355016057 STQOWFZCAWQSIQ-UHFFFAOYSA-N 441.167 4.383 10 10 IICE CC(C)(C)c1ccc(C(F)(F)C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 1355063800 BLAHALLUEDJVEI-SFHVURJKSA-N 443.538 4.094 10 10 IICE Cc1cc(-c2nnc(Nc3ccn(C)n3)n2CC(C)(C)CN(C)C)c(C)n1-c1ccccc1 1361051824 BMHALDZEDRBSCM-UHFFFAOYSA-N 446.603 4.418 10 10 IICE CCOc1ccc(C[C@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1435572661 LHDRDGWWXYJYNM-NRFANRHFSA-N 435.612 4.112 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2 1440668107 UWEYSTISAAQUKY-UHFFFAOYSA-N 426.923 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN[C@H](c3ccc(Cl)cc3)C2)cc1 1454267342 QQPXPPDPVJCYKS-DEOSSOPVSA-N 435.955 4.276 10 10 IICE CC1(C)CN(C(=O)OCc2ccccc2)[C@@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1469301693 BYCZSENNUFCWRM-HSZRJFAPSA-N 435.568 4.340 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)c2cnn(CC)c2)sc(C)c1-c1ccccc1 1473472374 MPCKPZNBDHTZNN-OAHLLOKOSA-N 440.569 4.406 10 10 IICE Cc1nccn1CCCCn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1511614164 XRNYAGWQQCPQSE-UHFFFAOYSA-N 436.585 4.258 10 10 IICE Cc1nn(C)c(C)c1CN(C)c1nnc(CC(C)C)n1CCCSc1nccs1 1511642836 UNPVCUALOAOZJD-UHFFFAOYSA-N 433.651 4.102 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccsc1 1517583775 ICRVGAFANKYYSZ-UHFFFAOYSA-N 448.596 4.187 10 10 IICE CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1524246247 XMZZVMPCEWYQIU-ICSRJNTNSA-N 449.039 4.270 10 10 IICE COc1ccc(C[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1OC 1527057958 OUFMCTAKUWBJDE-HNNXBMFYSA-N 429.472 4.297 10 10 IICE COc1cc(CCNC(=O)c2sccc2-n2c(C)ccc2C)c([N+](=O)[O-])cc1OC 1539202197 GDHXOGKTPYQPGH-UHFFFAOYSA-N 429.498 4.054 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc3[nH]c(-c4cccs4)nc23)N(C)C)cc1 1558723137 IREOSLLBTDIUSB-HXUWFJFHSA-N 433.581 4.390 10 10 IICE Cc1cc(C(=O)N2NC(=O)C[C@@H]2c2ccccc2)c(C)n1-c1cccc(Br)c1 1558888878 PMDSKQYZFMSNGY-HXUWFJFHSA-N 438.325 4.475 10 10 IICE CCN(Cc1cc(OC)c(C(=O)OC)cc1Br)c1ccc(OC)c(OC)c1 1559641931 WEMMJIOMFCNEBP-UHFFFAOYSA-N 438.318 4.288 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3c3ccc(C(C)C)cc3)CC2)cc1 1559718240 DLEZDGDPEIDBMS-BDYUSTAISA-N 437.628 4.139 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H]2C[C@@H](OC)C2(C)C)sc(C)c1-c1ccccc1 1559845927 QWFCKQSDXHCGEV-DLBZAZTESA-N 430.570 4.242 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@@H](C(=O)OC(C)(C)C)C[C@@H](C)C2)CCCC1 1570425964 NPLYHOHSULHGCU-MSOLQXFVSA-N 440.584 4.355 10 10 IICE CO[C@](C)(C1CC1)[C@H](C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1597434270 SSJTVBGKIXGZPN-YONRERHISA-N 438.640 4.049 10 10 IICE CCOc1ccccc1[C@](N)(C(=O)N(C)Cc1ccc(N(CC)CC)cc1)C(F)(F)F 1608432969 WIRUOTBGWGFFDY-QFIPXVFZSA-N 437.506 4.306 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3cnc4cnc(Cl)cc4c3=O)c2C)c1 1613698608 IRQCIXWSVZJLKV-UHFFFAOYSA-N 438.940 4.457 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@H](C)C3CCCCC3)cc2F)C[C@@H](C)O1 1620486157 WNXUTIFCLDKBLJ-SLFFLAALSA-N 433.612 4.204 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Oc2ccccc2)ccc1O 1626058851 KBAJQHNWFRJEOV-UHFFFAOYSA-N 440.446 4.229 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(O)(Cc4nc(C)cs4)CC3)c2C)cc1 1629119993 FNHDFRDYDNETHK-UHFFFAOYSA-N 439.581 4.077 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)c(C)n1-c1ccc(Br)cn1 1629963354 KUCHMLGJXWSPIS-IAQYHMDHSA-N 446.267 4.043 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2c2ncccn2)c(C)n1-c1ccc(Br)cn1 1633624370 VGAIZPFWRCXXEY-GOSISDBHSA-N 440.345 4.409 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)cc1 1636405162 DNAYTOSUHISRRT-QGZVFWFLSA-N 440.975 4.465 10 10 IICE CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)N[C@@H](C)c1ccccc1O 1643742065 MUPHTMYNCHQPPV-INIZCTEOSA-N 444.487 4.078 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3nc(-c4cccs4)cs3)CC2)cc1 1652964241 JQTUEWWRWZRIAH-UHFFFAOYSA-N 428.583 4.031 10 10 IICE O=C(Cc1ccccc1)N1CCC[C@@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1 1680451559 DVBZIZFSIVNBES-HSZRJFAPSA-N 449.595 4.470 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1696363916 GGASQGLLDNEWGF-LJQANCHMSA-N 431.600 4.373 10 10 IICE Cc1ccc(OCc2nnc(N3CCSCC3)n2CCCSc2nccs2)cc1 1707553146 VXRWOZQMEFIPLM-UHFFFAOYSA-N 447.655 4.358 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)CC(C)(C)C)n2CCCSc2nccs2)n1 1707814997 WNDJWYWPJJCMJT-UHFFFAOYSA-N 433.651 4.261 10 10 IICE CCc1nnc(N2CC[C@@H](OCc3ccccc3)C2)n1CCCSc1nccs1 1727564941 PGGKVTJMTPTCLY-GOSISDBHSA-N 429.615 4.275 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2cscn2)cc1 1746094279 WKFYDZGDZRMTHZ-UHFFFAOYSA-N 447.612 4.251 10 10 IICE COC1CCC(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CC1 1749147818 IONBILAQRRNSJB-UHFFFAOYSA-N 441.620 4.080 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CC4)n3CCSCC(C)C)CC2)cc1 1770257526 CSSJTJDGBKAUJF-UHFFFAOYSA-N 443.661 4.345 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C2CC2)n1Cc1ccc(N2CCSCC2)cc1 1771451338 GWPUXJKXZXTLNH-QGZVFWFLSA-N 431.675 4.335 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCc3ccccc3)C(=O)N(C3CC3)C2=O)cc1 1873162370 RQZJEYMOTJIGRK-UHFFFAOYSA-N 425.532 4.169 10 10 IICE CCN1C(=O)C(=Cc2ccc(NC(=O)C=Cc3cccc([N+](=O)[O-])c3)cc2)SC1=S 2053504825 KKAQFDMENGTPQN-UHFFFAOYSA-N 439.518 4.468 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3ccc(Br)cc3O)C(C)(C)[C@@H]21 2119290655 JGONPDOAOGFAMX-HYVNUMGLSA-N 425.367 4.278 10 10 IICE NCc1ccc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)c(F)c1Br 2152787946 FIBIAIYKBAWHTR-UHFFFAOYSA-N 442.323 4.395 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c1O 2238190838 CMIDLUGMNGMOPR-VBNZEHGJSA-N 441.366 4.183 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2293030987 AFRNHDVVLHZGOZ-OAHLLOKOSA-N 448.363 4.346 10 10 IICE CC[C@H](C)Oc1ccc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1Cl 2294235498 YQCSSUPYTOHHFL-LBPRGKRZSA-N 432.904 4.488 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCC(=O)Nc3ccc(F)cc3)C2=O)ccc1O 2314827758 LWPYIKNNLVXPRT-UHFFFAOYSA-N 446.525 4.160 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)ccc1OCC(=O)O 2314931137 CPYATYBHXYAZCX-UHFFFAOYSA-N 433.482 4.094 10 10 IICE Cc1ccc(CNC(=O)CC[C@@H]2CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380724436 ZWJMMYZPXZSPSD-HNNXBMFYSA-N 441.366 4.259 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)c(O)c1Br 2380747686 WQOVIQMOXOFKFG-CQSZACIVSA-N 441.366 4.115 10 10 IICE COc1ccc2nc(SCC(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)[nH]c2c1 8759978 NEJYPFCZALKOAY-UHFFFAOYSA-N 443.484 4.078 10 10 IICE CC1=NN(c2ccc(Cl)c(C(=O)O)c2)C(=O)/C1=C/c1ccc(-c2ccc(C(N)=O)cc2)o1 12412867 VILCYENATODQJO-GZTJUZNOSA-N 449.850 4.203 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)cc(Br)c1OC 34138325 USNZBJBYBMSYIH-NTUHNPAUSA-N 449.232 4.112 10 10 IICE O=C(COC(=O)/C=C\c1ccccc1)Nc1cc2c(cc1Cl)C(=O)c1ccccc1C2=O 34795323 RCLSVOATZVOUNG-KHPPLWFESA-N 445.858 4.311 10 10 IICE COC(=O)c1c(NC(=O)[C@H](C)[C@H]2Sc3ccccc3NC2=O)sc2c1CCCC2 40839480 ONMQFNYVLYYFCE-PIGZYNQJSA-N 430.551 4.101 10 10 IICE COCCOC(=O)c1ccc(N[C@@H](c2ccncc2)c2ccc3cccnc3c2O)cc1 54620242 JMKONBKOEYOBEY-QFIPXVFZSA-N 429.476 4.340 10 10 IICE COc1ccc(N2CCN(c3nccc(-c4cn(-c5ccc(C)cc5)nc4C)n3)CC2)cc1 72462229 NOWNUQYEOWNIGD-UHFFFAOYSA-N 440.551 4.281 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccoc3CN3c4ccccc4C[C@H]3C)CC2)cc1 111150530 SUFWVGOHTQYEQE-LJQANCHMSA-N 431.536 4.202 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1 443903759 DQTAIOOAXMAIJF-UHFFFAOYSA-N 426.564 4.474 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(Cc2ccncc2)C[C@H]2CCCO2)C1 444143235 LZIITXLGEWVCRX-JOCHJYFZSA-N 446.595 4.011 10 10 IICE O=C(O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc(C(=O)O)c1O 687736056 KPVULTLEEJNGMR-OAQYLSRUSA-N 447.443 4.145 10 10 IICE CCn1nc(C)c(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c1Cl 745361898 IWZIMQAPPVPBBC-UHFFFAOYSA-N 443.887 4.041 10 10 IICE O=C(O)c1cccc(N2C(=O)/C(=C/c3cnc(-c4ccccn4)s3)SC2=S)c1 753134555 JOQDBJRHSXKPNK-DHDCSXOGSA-N 425.516 4.309 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(C(F)F)c3Cl)cc2)C1 758246965 DGNUNNHTTVXMEX-CQSZACIVSA-N 436.890 4.301 10 10 IICE O=C(CN1CCOC[C@@H]1C[C@H](O)c1ccco1)Nc1ccc(N=Nc2ccccc2)cc1 763664050 KLIOMGRDKCDDPO-VXKWHMMOSA-N 434.496 4.458 10 10 IICE Cc1ncc(/C=C\C(=O)NCc2ccc(N(C)C(=O)/C=C\c3cnc(C)s3)cc2)s1 765483044 TWFGHCIABNNSOM-WGEIWTTOSA-N 438.578 4.222 10 10 IICE CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NCc2ccc(O)c(O)c2)CC1 813490256 HUXYCEKFYNRRQB-UHFFFAOYSA-N 440.540 4.217 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Nc3ccnn3C3CCCCC3)cc2F)C[C@@H](C)O1 918220749 LSACNXGZKPHYBE-IAGOWNOFSA-N 429.540 4.463 10 10 IICE CCOC(=O)c1ccc(NCN2C(=O)S/C(=C\c3ccc(N(C)C)cc3)C2=O)cc1 1084333783 QJKMDZADAPRNMN-UYRXBGFRSA-N 425.510 4.035 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCCC[C@H]3C)cc2)cc1 1125233274 HIXKJBBLPPXYOV-LJQANCHMSA-N 443.613 4.026 10 10 IICE COc1cc(N2CCN(C(=O)[C@H]3CCC[C@@H]3Cc3ccccc3)CC2)cc(OC)c1OC 1127931916 GQYHZCFKBGAEFF-IRLDBZIGSA-N 438.568 4.020 10 10 IICE Cc1cc(C(=O)NC2(CC(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccc(F)cc1 1141855233 HZCHKTPHXIKWIC-UHFFFAOYSA-N 430.520 4.244 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCc2c(O)ccc3c2CCCC3)cs1 1150385720 CRMFFGMCPQPWQI-ZDUSSCGKSA-N 431.558 4.243 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(F)cc2NC(=O)OC(C)(C)C)cc1 1164596645 AUMCJHVWLFZUAB-UHFFFAOYSA-N 431.508 4.390 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H](C)C[C@H]3CNC(=O)OC(C)(C)C)cc2)CC1 1196218890 SZJOBQRILWSMSA-KNQAVFIVSA-N 431.621 4.427 10 10 IICE COc1ccc(C[C@@](C)(CO)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1234325356 CTIWKBQEZAGIRV-SANMLTNESA-N 435.568 4.204 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)c(F)c1 1292025892 WMYQXHBVBNSKLN-IRXDYDNUSA-N 444.599 4.075 10 10 IICE CCc1nnc(N2CCC(OCCC(C)C)CC2)n1Cc1ccc2c(c1)CCCN2C 1292994968 PLNVOBLEVFTCKB-UHFFFAOYSA-N 425.621 4.303 10 10 IICE CCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)CC1 1293457793 XIEAZWOSWGPUMK-UHFFFAOYSA-N 448.615 4.457 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4cc(F)ccc4F)CC3)c2C)cc1 1294487806 OJUFVHDAIUYFRD-UHFFFAOYSA-N 425.479 4.343 10 10 IICE Cn1nccc1CN(c1nnc(CC(C)(C)C)n1CCCSc1nccs1)C1CC1 1298909085 YMNUVHVKIWKZPS-UHFFFAOYSA-N 445.662 4.408 10 10 IICE CO[C@]1(C)CCCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1299745463 UHEBYTJFPGKBCP-RUZDIDTESA-N 425.621 4.402 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1)OC 1300996862 CICLXEVKTRGFAV-QFIPXVFZSA-N 435.572 4.170 10 10 IICE CC(C)Cc1nnc(N2CCc3ccc(O)cc3C2)n1CCCSc1nccs1 1302912243 IUNGAABMKWCVBI-UHFFFAOYSA-N 429.615 4.384 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C)[C@@H]3C)n2CCCSc2nccs2)n1 1304752544 XMWCTNRGAGTNTO-YOEHRIQHSA-N 431.635 4.013 10 10 IICE C[C@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N1CCOc2cc(N(C)C)ccc21 1307647300 BBJZEHBEPVXRTI-GOSISDBHSA-N 429.520 4.210 10 10 IICE COc1ccc(N2CCN(C(=O)NC/C=C\c3ccc(Br)cc3)CC2)cc1F 1312754316 FACXPHFZKBZYQN-IHWYPQMZSA-N 448.336 4.142 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2nc(F)ccc2Br)cc1 1353012987 GVIFOGSIJBCAQN-UHFFFAOYSA-N 432.293 4.485 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(C(C)C)ncc3OCc3ccccc3)CC2)cc1 1356445564 JYZZGYQUCVSWSW-UHFFFAOYSA-N 446.551 4.150 10 10 IICE Cc1ccc(C(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)cc1-n1c(C)cc(C=O)c1C 1445680254 RHTQUHGMZPGFRG-RUZDIDTESA-N 434.536 4.466 10 10 IICE Cc1ccc(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)cc1-n1c(C)cc(C=O)c1C 1446333536 JIIFAAPXMOVTMH-QFIPXVFZSA-N 429.520 4.030 10 10 IICE Cc1cc(Br)cn2cc(CCNC(=O)c3cc4cc(O)c(O)cc4s3)nc12 1466758473 CBOSROOPJCOAQO-UHFFFAOYSA-N 446.326 4.004 10 10 IICE O=C(NCc1cccc(Cl)c1O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1 1472315669 CDGLEPFIVJQKER-LDADJPATSA-N 437.912 4.075 10 10 IICE Cc1cc(CC(=O)NC[C@@H](NCc2ccccc2)C(F)(F)F)c(C)n1-c1ccccc1 1472567615 GLWMCLGFSUKSQF-JOCHJYFZSA-N 429.486 4.474 10 10 IICE COC(=O)[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C[C@H]1c1ccc(Cl)cc1 1478471104 NRJRADKVZDIOHQ-GQWLDOHISA-N 429.948 4.065 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](CC)C1)OC 1497190258 GDYANROOUZSDIN-FGZHOGPDSA-N 437.588 4.393 10 10 IICE CC[C@](C)(NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C(F)(F)F 1530428150 KQJUNLCZNMLJLY-QFSNBGPKSA-N 434.480 4.264 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4ccc(C(F)(F)F)cc4)c3C)C2)cc1 1531740183 FULVUDMSCOGSFZ-KRWDZBQOSA-N 444.457 4.217 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](C(C)C)N2CCC(C)CC2)CCCC1 1533659122 ZNFYWZWKSBJSBD-RUZDIDTESA-N 425.617 4.401 10 10 IICE C[C@@]1(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1(Cl)Cl 1534129650 IXIJVIOEKWGXSK-MRXNPFEDSA-N 425.278 4.132 10 10 IICE CCOC(=O)CCN(CC1CC1)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1542260262 RRNJTAAVJAUKQU-UHFFFAOYSA-N 448.361 4.057 10 10 IICE C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NCc1ccc2cccnc2c1O 1557120367 BMNXIYNGUBSECL-LLVKDONJSA-N 435.705 4.440 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](C)CN3CCN(c4ccccc4)CC3)c2C)c1 1565886528 OCVFBGJWTCWFLY-NRFANRHFSA-N 430.596 4.343 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1565985322 BPIDHQVLGMAOCJ-UHFFFAOYSA-N 439.556 4.396 10 10 IICE COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1567365481 VCVVZYVHKBIFSM-NFBKMPQASA-N 431.536 4.271 10 10 IICE COc1cc(OCCN(C)C)ccc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1570331681 XMDAHILIGYOUKI-UHFFFAOYSA-N 435.524 4.108 10 10 IICE CCc1c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cnn1CCC(C)C 1596695348 QZAFGTXVHSXAMU-ROUUACIJSA-N 430.568 4.174 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC(CCN(C)C(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1 1612145104 JXEDGGMHOJTREK-CLFYSBASSA-N 447.532 4.254 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](c1cccnc1)C(C)C 1614012316 QOYMHOYXBUNTFW-XMMPIXPASA-N 448.615 4.401 10 10 IICE CCCc1cc(=O)oc2c(CN(CCOC)C[C@H]3CCCN4CCCC[C@H]34)c(O)ccc12 1614472030 DVXFOPIDPZWHRF-NFBKMPQASA-N 442.600 4.164 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2CCCSc2nccs2)C[C@@H]1C 1615768116 IXLJBLWJEHZTOJ-DLBZAZTESA-N 436.695 4.425 10 10 IICE CC(C)COc1cn(-c2ccccc2)nc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1616858206 JAKKHUJVBUCBBA-HSZRJFAPSA-N 449.599 4.006 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3nc(C(C)C)ncc3OCc3ccccc3)C2)cc1 1617262247 CHAVYPKKYWWKRM-HXUWFJFHSA-N 446.551 4.196 10 10 IICE CO[C@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccccc1 1626509299 QIMDFIRLTDUKKU-LJQANCHMSA-N 428.330 4.369 10 10 IICE CSc1cccc(N2C[C@H](C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2=O)c1 1633111138 NQBQIDOHALCVTC-HXUWFJFHSA-N 437.609 4.314 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H](CC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1636353640 FVYGKYCRQMHHNY-PMACEKPBSA-N 447.620 4.215 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(CCc3ccccc3)Cc3ccncc3)C2)cc1 1636354296 WPYLUXUIUVMZER-XMMPIXPASA-N 444.579 4.371 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(S(N)(=O)=O)c(Cl)c1 1637243782 JBXHXFZLTLCGCY-OAHLLOKOSA-N 444.940 4.097 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)N2CCCC[C@@H]2C)c1 1639522058 FXXIETXDBAZOED-IBGZPJMESA-N 444.597 4.398 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCc1nc(O)c2c(n1)CCOC2 1640762191 FEEJIRCSWIOKSS-UHFFFAOYSA-N 447.358 4.193 10 10 IICE CN(C)c1ccc(CNC(=O)CN(C)[C@H]2CCSc3ccc(Br)cc32)cc1 1641803812 XLGVLOWQCKZSNK-IBGZPJMESA-N 448.430 4.300 10 10 IICE C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1681161068 PDLJMCDTXNPPTD-OAHLLOKOSA-N 436.383 4.385 10 10 IICE CCS(=O)(=O)c1ccc(CNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)s1 1682089431 CQBYRNNRPATDBD-UHFFFAOYSA-N 445.610 4.257 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cccnc4)n3CCC=C(C)C)CC2)cc1 1697470085 AWACWZPXOVNVSA-UHFFFAOYSA-N 432.572 4.422 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)CCOC(C)(C)C)cc1 1710025931 RKWNVLFMXSKPLI-UHFFFAOYSA-N 436.604 4.486 10 10 IICE CC(C)N(C)CCCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1723520073 VYYVRQMNKXBTNH-UHFFFAOYSA-N 449.647 4.251 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@]3(C)CCCS3)CC2)cc1 1730179713 CIQZTKXRIJVURC-XMMPIXPASA-N 443.661 4.488 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1741442699 GZIGSEPMYNOBTN-RTBURBONSA-N 429.584 4.125 10 10 IICE CC/C=C\Cn1c([C@@H]2CCCCO2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1745095586 GBHUHBZIOOWLBS-DKYZEMOZSA-N 425.577 4.211 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@@H](F)C3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1761677425 OODNUBOFKMFKAG-QRWLVFNGSA-N 447.505 4.429 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1CC1CCC(C(F)(F)F)CC1 1767111827 HRMVPCQREBVAGT-NXYGQSRBSA-N 438.494 4.493 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1770892504 ZQQYLEADUBCAOB-QGZVFWFLSA-N 444.630 4.232 10 10 IICE CC(C)n1nc(CCNC(=O)CCn2c3c(c4ccccc42)CCCC3)c2c1CCOC2 1857662165 HCTDOLWRHKLAIN-UHFFFAOYSA-N 434.584 4.119 10 10 IICE CC(C)c1ccc(S(=O)(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1858074117 DYQQOZBJKWAMLJ-XMMPIXPASA-N 429.630 4.382 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H](CNCc2cc(Br)cc(F)c2O)C1(C)C 1885866468 PNRZEOPFSGZVOE-WFASDCNBSA-N 431.346 4.323 10 10 IICE CCOC(=O)c1c(CC)nn([C@H](CC)c2ccc(C)cc2O)c1I 2079124351 GQSLZAPBMUSEOX-CQSZACIVSA-N 442.297 4.240 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2=O)c1 2294134094 RWQVRHAXALQHIN-UHFFFAOYSA-N 431.404 4.138 10 10 IICE O=C1NN(c2ccc(Br)cc2)C(=O)C1=Cc1ccccc1OCc1ccccc1 2297350623 GDGIDPLHJRZNAV-UHFFFAOYSA-N 449.304 4.490 10 10 IICE COc1cc(NC(C)=C2C(=O)N(c3nc4ccccc4s3)N=C2C)cc(OC)c1OC 2313682077 UPRQZRPEBFFRPM-UHFFFAOYSA-N 438.509 4.431 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(CC(C)C)C1=O 2314414777 LXJBDXMMUIMRJL-UHFFFAOYSA-N 430.599 4.154 10 10 IICE CC[C@H](C)[C@@H](C(=O)NCc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2380740726 ZHBBGRRQOCHZMD-LRDDRELGSA-N 443.382 4.361 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472449 NTABJDONIMPISH-IMSXRSKXSA-N 434.540 4.493 10 10 IICE CSC1=NSC2=NC(=O)/C(=C\c3ccc(OCCOc4ccccc4)cc3)C(=N)N12 20154689 WYXSOMZJYLIPJU-LKUHCXOVSA-N 438.534 4.084 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N3CCCC3)CC2)c(C)n1-c1ccc(F)c(Cl)c1 105349936 MJVGIVNHGLDUCR-UHFFFAOYSA-N 445.966 4.404 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCCO[C@H]2C(C)(C)C)C1 435876950 MAZHXDNKUZEJTR-UQBPGWFLSA-N 425.617 4.365 10 10 IICE Cc1nc(-c2cccc(NC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c2)no1 726699959 WQWPRQPLPSXALN-UHFFFAOYSA-N 443.454 4.437 10 10 IICE C[C@@H](NCc1ccc(N2CCc3ccccc3C2)nc1)c1ccc(N2CCOCC2)c(F)c1 765068661 SWJWQWOMOZXUNL-HXUWFJFHSA-N 446.570 4.471 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H]3CCCOc4cc5c(cc43)CCCC5)cc2)C1 768508480 NULXNXYZXFPHRP-RCZVLFRGSA-N 433.596 4.271 10 10 IICE Cc1cc(Br)cc(CNC2CCN(C(=O)CCc3ccccc3)CC2)c1O 776006223 GXGCIYCDZFZYHJ-UHFFFAOYSA-N 431.374 4.177 10 10 IICE C[C@@H](NCc1ccc(N2CCSCC2)cc1)c1c[nH]ccc1=NC(=O)OC(C)(C)C 796691665 DGEVNGAVCWMMRM-QGZVFWFLSA-N 428.602 4.255 10 10 IICE Cc1oc2c(CN3[C@H]4CC[C@H]3[C@H](CO)C4)c(O)ccc2c(=O)c1-c1ccccc1Cl 811797951 XDXIOISIFZOCLQ-AVYPCKFXSA-N 425.912 4.473 10 10 IICE CCN1C[C@@H](C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)CC1=O 1124783660 GHIFZULAACMNJG-HNNXBMFYSA-N 426.517 4.164 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@@H](NC(=O)c2ccccc2)c2ccccc2)cc1 1130544818 VCMVIDBWKFSNIH-RUZDIDTESA-N 445.563 4.151 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1 1135085372 WJHANLRHBLQJJU-XIKOKIGWSA-N 441.881 4.277 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1C[C@]1(C)c1cccc(Br)c1 1135732775 GEMGTHBBCJUKJN-JTHBVZDNSA-N 443.385 4.222 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(O)c(Br)c3)ccc21 1137446546 ZKUJXZGYPGYNJD-UHFFFAOYSA-N 431.330 4.303 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ncc(Cc2ccccc2)o1 1156287990 ULOJYTBVOJXIFN-UHFFFAOYSA-N 435.524 4.268 10 10 IICE CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)NCc1ccc(N2CCCCC2)cc1 1162800424 HQAZPRDPBVTCLY-UHFFFAOYSA-N 430.892 4.127 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CO[C@H](CN(Cc3ccco3)Cc3ccccc3O)C2)C1 1167982629 FMXGMRVQNWBNTF-OFVILXPXSA-N 442.556 4.404 10 10 IICE CC[C@H](c1cccc(OC)c1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1194109012 ZFBWTGOEPNAHBP-XMMPIXPASA-N 442.515 4.492 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)C[C@H]2CCCCO2)cc1 1295413907 UZPBVVCYQXAICO-JOCHJYFZSA-N 436.604 4.183 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(Oc3ncccc3F)CC2)cc1 1297338843 YPZFQBCVNZPZOV-UHFFFAOYSA-N 435.499 4.053 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)COc1ccc(Oc2ccc(C)cc2)cc1 1299699372 ITKDNGDPDGSAHO-UHFFFAOYSA-N 449.503 4.464 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1csc([C@H](C)OC)n1 1306078387 SGQQHYBSIGAFLZ-KRWDZBQOSA-N 440.617 4.289 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1312524444 GHSSSUODOZLADV-AZUAARDMSA-N 426.561 4.150 10 10 IICE COC(=O)c1cc(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)no1 1349833733 DQPWTTOOEHGDGK-UHFFFAOYSA-N 428.466 4.316 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnn2c(C(F)F)cc(C3CC3)nc12 1436847046 JWOHYFHBLXSNPU-AWEZNQCLSA-N 427.499 4.280 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(F)c(I)c1 1442342771 NOWONJDJIRGVHX-UHFFFAOYSA-N 426.273 4.159 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C[C@@H](O)CC(C)(C)C)C2CCN(C)CC2)cc1 1449380863 AQFCKDCKTGDGDI-DEOSSOPVSA-N 425.617 4.428 10 10 IICE COc1ccc(CCCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 1457095576 KHFADHJOFGBIFO-GOSISDBHSA-N 448.510 4.413 10 10 IICE CCCN(Cc1ccccc1O)[C@@H](C)C(=O)Nc1ccc(I)cc1 1459552629 AKDAHOSLCIOFEJ-AWEZNQCLSA-N 438.309 4.236 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC(F)(F)c2cccc(F)c2)C1 1461411676 TYDQVUNSVVSNPR-UHFFFAOYSA-N 429.486 4.455 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C3)cc2)CC1 1473252200 JSSKLVHZYIXZJD-TZIWHRDSSA-N 431.621 4.427 10 10 IICE CCC(O)(CC)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1513515057 MQRPWTNSLIYYPQ-UHFFFAOYSA-N 436.604 4.071 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1)c1ccc(N(C)C)cc1 1523638897 HMQGCPDJPTWSRL-SFHVURJKSA-N 443.613 4.197 10 10 IICE CCCCC[C@@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 1527966119 ALIMUEOWZSJQRI-OAQYLSRUSA-N 441.595 4.411 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)c2)c1C 1529404225 ROZWOUZRQFZXBT-HXUWFJFHSA-N 432.568 4.316 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Oc3ccc(Cl)cc3)C(C)C)CC2)c(OC)c1 1530967802 GQGGVVSXPSDBKD-JOCHJYFZSA-N 432.948 4.109 10 10 IICE COc1ccc([C@@H]2[C@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC(=O)N2C)cc1 1535136458 OTDYWCATMGKRFM-AOYPEHQESA-N 445.563 4.247 10 10 IICE C/C(=C/C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1537839936 RQOZIEAIZUJFFF-PEZBUJJGSA-N 445.485 4.127 10 10 IICE C[C@@H](CNC(=O)OC(C)(C)C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccccc1O 1541884715 MRPKHRGEGQCJFK-KRWDZBQOSA-N 443.592 4.439 10 10 IICE COc1cccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCSc2nccs2)c1 1542956310 QZAGVXAGGCAPMI-MRXNPFEDSA-N 437.587 4.016 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C[C@H]1C 1544303443 XRLMFNMYHDXRLQ-VQTJNVASSA-N 439.648 4.315 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)CC2(C)OCCO2)c(C)n1-c1ccc(Br)cc1 1544543698 WHYBHJKMUAHLBR-AWEZNQCLSA-N 435.362 4.376 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1548052903 CETALLPIBPNTDF-GOTSBHOMSA-N 441.620 4.420 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccnc(-c2ccccc2)c1N 1556426371 JYBSQGQGQZTSOZ-UHFFFAOYSA-N 446.551 4.333 10 10 IICE Cc1ccc(C2(CNC(=O)NCc3ccc(N4CCC(CO)CC4)cc3)CCC2)cc1C 1564679119 VLZPSVBKHFQZTE-UHFFFAOYSA-N 435.612 4.433 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(F)(F)c3ccccc3Br)C2)cc1 1584444512 QCALSIUZSKCFDW-CQSZACIVSA-N 439.300 4.192 10 10 IICE O=C(COc1ccc2c(c1)CCCC2)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595585633 ZGSIZEZKOOINOF-OAQYLSRUSA-N 428.960 4.084 10 10 IICE COc1ccc(CNC(=O)/C=C\C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)cc1 1597567522 QJQQGCMGYVCELA-DHQBXBPASA-N 444.531 4.363 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@](C)(O)c1cc(C)oc1C 1613921227 PEDADPQJLYFLQG-VWLOTQADSA-N 437.588 4.195 10 10 IICE CN(C)c1ccc(Cn2c(C3CCC3)nnc2N2CCC=C(Br)C2)cc1F 1617664953 BOHZUSNYTWRAEF-UHFFFAOYSA-N 434.357 4.288 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1618649323 ZOFOALZGIYCOSH-UHFFFAOYSA-N 443.519 4.288 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1 1624479928 QEWDTCQREWFZRF-UHFFFAOYSA-N 429.499 4.412 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c3ccc(F)cc3F)ccc21 1626940667 LNCXYOQAOMOVHW-NRFANRHFSA-N 445.510 4.229 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2CCCN(c3ccccc3)C2=O)cc1 1627988550 FGWONVXESQZJMO-HXUWFJFHSA-N 433.474 4.087 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1cccc(OC)c1 1628947847 FWWGSMBHWGWJBW-RUZDIDTESA-N 438.499 4.450 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@@H](c2ccccc2)c2ncc[nH]2)cc1 1631612525 PTQTVQMKAREKBA-RPWUZVMVSA-N 432.568 4.206 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(Nc2cnccn2)c1 1635489336 UAPPJHILXWKZHE-UHFFFAOYSA-N 447.539 4.222 10 10 IICE O=C([C@H]1CC(c2cccc(Cl)c2F)=NO1)N(Cc1ccco1)Cc1ccccc1O 1635647508 KWQQOWYZMKWBRR-HXUWFJFHSA-N 428.847 4.500 10 10 IICE COc1ccc(C[C@@H](C)CN(C)C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1636353491 CQTVMUZRKKUIPO-CTNGQTDRSA-N 425.573 4.050 10 10 IICE Cc1cc(C(=O)N2CCN(C3CCN(C(C)C)CC3)CC2)c(C)n1-c1ccc(Cl)cc1 1636656978 BFSMQXLRAJLWMS-UHFFFAOYSA-N 443.035 4.378 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnc(OC2CCCCC2)c(Cl)c1 1639587844 IDWHWWUYMKCWEO-UHFFFAOYSA-N 446.931 4.358 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@H](C)[C@H](C(=O)OC(C)(C)C)C2)cc1 1639923634 WBOPFJJGGJYNLE-UZUQRXQVSA-N 438.568 4.275 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cccc(Cl)c1O 1640404509 BTTMYBVPIOVITJ-IBGZPJMESA-N 443.931 4.279 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@]3(C)c3ccccc3)cc2F)C[C@@H](C)O1 1654648211 YCGFDNLXASHZIY-KYTVRQNUSA-N 439.575 4.067 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(CNC(=O)OC(C)(C)C)cc1 1673839441 VZRFOZAXUYPCND-UHFFFAOYSA-N 426.561 4.119 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@H]1CSCCN1Cc1ccccc1 1681540990 ZRGNICRVLJNIAR-QFIPXVFZSA-N 427.614 4.322 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@H]3CC3CCCCC3)cc2)CC1 1685244480 RLYGTVOWLCJWOF-QHCPKHFHSA-N 426.605 4.033 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)C1CC1 1695420838 GCDQGSGXHQZXMT-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1696558187 LGHXBTYUPUWMNZ-SJLPKXTDSA-N 435.613 4.003 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CCC[C@@H](C(C)C)C2)cc1 1746090391 WYSDDKZUCKNRFZ-OAQYLSRUSA-N 435.620 4.446 10 10 IICE COCC1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1749530450 VWDKQUAGTXLTHS-UHFFFAOYSA-N 443.592 4.047 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](C)N2CCC[C@@H](C)C2)n1 1761916914 SFJCXXBQDBHAAF-QUCCMNQESA-N 434.588 4.111 10 10 IICE CCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1-c1cccc(Cl)c1 1862306528 IFYGFTLNZNFPTG-UHFFFAOYSA-N 438.959 4.449 10 10 IICE COc1ccc(N2N=C(C(F)(F)F)/C(=C/c3cc(Cl)c(O)c(OC)c3)C2=O)cc1 1865675053 MJNKQSWQJIGJBU-QPEQYQDCSA-N 426.778 4.411 10 10 IICE CC(C)Cc1cc(I)n(Cc2cccc(Br)c2O)n1 2070026125 OBAXHRINOUHVJF-UHFFFAOYSA-N 435.103 4.203 10 10 IICE COc1ccc(Br)c(CNCC2CC3(CCN3C(=O)OC(C)(C)C)C2)c1O 2236055037 NLUUMMKISVXRTF-UHFFFAOYSA-N 441.366 4.043 10 10 IICE Cc1ccc(CNC[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2352949631 HJJIJSAJOLZSMO-GFCCVEGCSA-N 441.288 4.256 10 10 IICE COc1ccccc1OCCN/C(C)=C1/C(=O)N(c2ccccc2)N=C1c1ccccc1 17095413 HNNQTXHRJPFLIA-LYBHJNIJSA-N 427.504 4.389 10 10 IICE Cc1ccc2nc(NC3CCCCC3)c(/C=C3\SC(=S)N(C(C)C)C3=O)c(=O)n2c1 33489168 KWOHKFHMINKIDL-BOPFTXTBSA-N 442.610 4.357 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1c(C)cccc1C 102466322 XALNJWUSGFEFJS-SEOKDCOXSA-N 447.491 4.220 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3c(C)nn(-c4ccc(F)cc4)c3C)CC2)cc1 110358826 XYSZRMDJBHCEFC-OUKQBFOZSA-N 448.542 4.435 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)ccc1O 210710460 TXRHMLHAZWZPRR-XMHGGMMESA-N 442.562 4.411 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2cc3ccccc3o2)cs1 748813477 RYCJBJLBDXUCKH-UHFFFAOYSA-N 431.451 4.274 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(F)cc(Cl)c3)n2)cc1OC 755427764 SWZBELZNUUARTF-UHFFFAOYSA-N 428.894 4.421 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)n2ccc(=NCC(F)(F)F)cc2)C1 766830886 SMLPTOMIHFGCGK-UHFFFAOYSA-N 430.474 4.013 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](CO)c2ccsc2)sc(C)c1-c1ccccc1 770690180 WRUXCHIBCQAUBT-QGZVFWFLSA-N 444.578 4.223 10 10 IICE Cc1csc(C2(N[C@H](C)C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)CCC2)n1 778128075 NIYVTENRPBUHET-OAHLLOKOSA-N 445.544 4.223 10 10 IICE COc1ccc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1124864584 ZIXUFVWXPQTQFX-QIQQCEGHSA-N 444.553 4.303 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3ccccc3)cc2OCC(C)C)cc1 1130543727 DGINFFUVKBWMKH-UHFFFAOYSA-N 436.556 4.124 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(-c4c(F)cccc4F)s3)CC2)c(OC)c1 1132032391 VEGLIZBPWMOWFV-UHFFFAOYSA-N 445.491 4.068 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccccc3NCC(F)(F)F)cc2F)C[C@H](C)O1 1141901264 DJWJFWCZDUUSJW-GJZGRUSLSA-N 439.453 4.344 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(Br)ccc1Br 1142728507 WDKFAQRENAOHAP-UHFFFAOYSA-N 436.103 4.395 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)Cc2ccccc21 1144740872 NFVQOPIPAKKOPD-HNNXBMFYSA-N 440.521 4.409 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2cc(Cl)ccc2O)cc1 1165497143 AACJHAXFVBYERZ-UHFFFAOYSA-N 430.913 4.085 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCCSC[C@H]2C(F)(F)F)CCCC1 1289694677 LFZMQNGHVZBVDT-IBGZPJMESA-N 426.504 4.425 10 10 IICE O=C(NCc1csc2ccccc12)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1290956753 WWDLECRLWVSJCS-UHFFFAOYSA-N 444.559 4.399 10 10 IICE CCOC(=O)CCN(Cc1cccnc1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1292120194 BWEYJBLFWRXFMY-UHFFFAOYSA-N 447.535 4.206 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)CC2CC(F)(F)C2)cc1 1295415647 ROJASTNQLMPNDK-UHFFFAOYSA-N 441.530 4.111 10 10 IICE CC(C)[C@@H](Cn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1359665352 XUQLQUZMHHICOU-JOCHJYFZSA-N 425.621 4.473 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@H]2C2CCN(C(=O)OC(C)(C)C)CC2)cc1 1441715916 QYZOKDIMHNVCSG-FCHUYYIVSA-N 429.605 4.432 10 10 IICE Cc1cc(OCCN2CCNC2=O)ccc1NC(=O)c1sccc1-n1c(C)ccc1C 1448222221 GZRWBXCRSSEHPT-UHFFFAOYSA-N 438.553 4.120 10 10 IICE Cc1ccc(C(=O)NC[C@H](O)c2cc(F)cc(Cl)c2)cc1-n1c(C)cc(C=O)c1C 1448828123 VRXJGPKSRBVBFO-QFIPXVFZSA-N 428.891 4.471 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)Cc1cc(Br)cc2cccnc12 1460279470 KYWGWDOFFZTIPY-UHFFFAOYSA-N 429.314 4.268 10 10 IICE C/C(=C/c1cccnc1)C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1462930746 NBMOORKRYYJDSJ-FJJYYWMZSA-N 425.504 4.354 10 10 IICE CCOC(=O)N1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CC1 1464585854 RIGRYGLPDMRQNP-UHFFFAOYSA-N 448.361 4.161 10 10 IICE Cc1cc(C(=O)N(C)CCC(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cn1 1466076392 ADEXRGPARVZMLQ-UHFFFAOYSA-N 436.350 4.055 10 10 IICE CC(C)(C)OC(=O)NCCOCCN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1473158940 ULVHWSPWAVLXJT-UHFFFAOYSA-N 449.592 4.005 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCCCSC)CC2)cc1F 1504292338 LWKBYPDDOXCSHA-UHFFFAOYSA-N 435.613 4.193 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc(C(=O)c4cccc(OC)c4)cc3)c2)CC1 1517995792 KPYSRNZNWQLWDG-UHFFFAOYSA-N 443.547 4.320 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3cc(Br)ccc3F)C2)cc1 1526247588 ZHBZITUVMJLPFQ-HNNXBMFYSA-N 435.337 4.172 10 10 IICE Cc1csc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1529759309 LIDNFWAYTPHEID-DGGAMASNSA-N 435.571 4.059 10 10 IICE Cc1cc(CC(=O)NCCCNC(=O)c2ccc(F)cc2)c(C)n1-c1ccc(Cl)cc1 1531583308 GGCTUKVSLQGHET-UHFFFAOYSA-N 441.934 4.365 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(Br)c(Br)[nH]1 1540488309 MTEAFXCOWVHYFD-UHFFFAOYSA-N 441.167 4.412 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1557639410 JFGFKVHUIFPUSL-UHFFFAOYSA-N 444.531 4.031 10 10 IICE C[C@@H](NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(N(C)C)cc1 1564598097 ZJOROIZZSGENDX-CJFMBICVSA-N 444.579 4.041 10 10 IICE COc1cc(OC)c2cc(CCCNC(=O)c3cc4cc(O)c(O)cc4s3)[nH]c2c1 1566384431 QECRZWYMMHTHCI-UHFFFAOYSA-N 426.494 4.174 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC[C@]2(C1)CC2(F)F 1583444429 GIZXIQRPSMVIPH-PMXLPMHFSA-N 442.578 4.377 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)cc1 1585614504 RAFJJTCJJOCHMK-FQEVSTJZSA-N 445.563 4.481 10 10 IICE CCc1nnc(N2CCC[C@@H](C[C@H]3CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613996498 GJCVMZPSSYNMIT-FCHUYYIVSA-N 425.621 4.378 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@H]3CC[C@@H](OC)[C@H]3C2)cc1 1615381346 UPPZHKXZKVOURA-AKIFATBCSA-N 425.621 4.232 10 10 IICE Cc1ccc(/C=C\C(=O)N2C[C@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)cn1 1617132972 MAPBRNPZTPIXEV-VOCYLRNQSA-N 425.504 4.273 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 1618427296 IPAXXWAMGCCMIK-UHFFFAOYSA-N 433.892 4.250 10 10 IICE Cc1cc(CNC(=O)C(F)(F)F)cc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)c1 1624009521 RSONQECWWPJNPY-UHFFFAOYSA-N 430.430 4.228 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c1 1625117519 PTARORZUBAJYSP-KRWDZBQOSA-N 438.549 4.143 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2csc(-c3ccccc3Cl)n2)N(C)C)cc1 1627465050 VHRZDRWOUIKXAX-NRFANRHFSA-N 443.016 4.491 10 10 IICE C[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(C)c2ccccc12 1630261865 DOIDJNKTUOMWTN-QFBILLFUSA-N 425.960 4.422 10 10 IICE Cc1cc(C(=O)NC[C@@H](ONC(=O)OC(C)(C)C)C(C)C)c(C)n1-c1ccc(F)cc1 1630330295 SVPWHLHPROTTKU-HXUWFJFHSA-N 433.524 4.444 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC(=O)NCc1c(O)ccc2c1CCCC2 1635351099 MJHIXPKPLWGYDN-GOSISDBHSA-N 431.577 4.250 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3OC[C@H]2F)c(C)n1-c1ccc(Br)cn1 1638067477 WAERJSMBVVCTOQ-YLJYHZDGSA-N 444.304 4.453 10 10 IICE Cc1cc(CNC(=O)c2cc(I)ccc2N)c(C)n1-c1ccccc1 1643370569 PLEPIJROHXKCPI-UHFFFAOYSA-N 445.304 4.211 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3cccs3)n2)c(C)n1-c1ccc(Br)cc1 1643529359 BQIGZZBABPHIIP-UHFFFAOYSA-N 442.342 4.455 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)cc1F 1684603888 DYHPHFXKBFKTRW-UHFFFAOYSA-N 436.531 4.274 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CCOc1cccc(C(F)(F)F)n1 1706280629 IZBRLFNRJUBVAI-UHFFFAOYSA-N 435.450 4.236 10 10 IICE CCn1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)cn1 1710178530 CLIAFISPGAJJKT-UHFFFAOYSA-N 447.587 4.242 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2cccnc2)n1Cc1ccc2c(c1)CCCN2C 1712797838 UFKIVULDJGAFBP-SFHVURJKSA-N 436.629 4.349 10 10 IICE CCC(CC)c1cc(Cn2c(-c3cnccn3)nnc2N(C)Cc2ccccc2O)on1 1744002296 VUFAECGBWWQGNY-UHFFFAOYSA-N 433.516 4.017 10 10 IICE CN(CCc1cccs1)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1747899340 HYONBKREDCDCKD-HNNXBMFYSA-N 435.644 4.161 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1749987385 UKBYZLNRCLSZMZ-UYAOXDASSA-N 429.609 4.051 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)CC(F)(F)F)cc1F 1768496851 ULXBVDUIYGJDIR-UHFFFAOYSA-N 427.471 4.182 10 10 IICE COc1ccc(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)[C@@H](C)C(=O)N3)c(C)s1 1859572428 HDVPBGQCIKXNDT-GFCCVEGCSA-N 443.550 4.292 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3cccc(F)c3)N=C2c2ccccc2)cc(OC)c1O 1865679843 JMXNYOSJVWAESC-NDENLUEZSA-N 432.451 4.379 10 10 IICE COc1ccc(Cc2nc3ccc(C(=O)Nc4cccc(N(C)C)c4)cc3[nH]2)c(OC)c1 1872807522 RGJVSHOOQLRIHQ-UHFFFAOYSA-N 430.508 4.489 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)[C@@H]1C1CC1 1886006831 OOVGPRASMTVRJA-CVEARBPZSA-N 429.330 4.171 10 10 IICE COC(=O)c1c(C2CC2)nn([C@H](c2ccc(OC)cc2O)C2(C)CC2)c1Br 2080004595 CRMJLFDTOPTIJM-QGZVFWFLSA-N 435.318 4.413 10 10 IICE CC[C@@H](NC[C@@]1(C)CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2143387432 OYWSHBIOAQLZNN-UZLBHIALSA-N 443.382 4.221 10 10 IICE COC(=O)c1ccccc1N1C(=O)C(=CC=Cc2ccccc2[N+](=O)[O-])SC1=S 2314539215 NFDLTKWKBVXEFR-UHFFFAOYSA-N 426.475 4.343 10 10 IICE COc1cc(N2C(=O)C(=Cc3ccc4c(c3)OCO4)SC2=S)c(OC)cc1Cl 2321629404 WLRQUMSDSGVOMQ-UHFFFAOYSA-N 435.910 4.492 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3ccccc3C)nc3c(C)cccn3c2=O)SC1=S 39836128 OHSFEYAQIPITOD-SFQUDFHCSA-N 437.546 4.325 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@H](C(=O)NCc4ccc(F)cc4)[C@@H]3C2)cc1 96457117 UQCHVMVWXYGEDZ-AHWVRZQESA-N 445.538 4.018 10 10 IICE CCOc1cc(/C=C2\SC(Nc3cccc(F)c3)=NC2=O)ccc1OCCC(=O)O 210469828 IJZRNBJHWPJPJR-WQRHYEAKSA-N 430.457 4.160 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526226232 FDKTVBNQRMLPRG-QFIPXVFZSA-N 437.423 4.311 10 10 IICE Cc1cc(CCNC(=O)NCc2ccnc(OC3CCOCC3)c2)c(C)n1-c1ccccc1 733354149 YYAUKHHKWMQBGN-UHFFFAOYSA-N 448.567 4.089 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NOCc1ccc(F)cc1 757609966 DDXIQASPPPULBK-LFIBNONCSA-N 436.555 4.117 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2scnc2C2CC2)NC(=O)OC(C)(C)C)cc1 760624771 HYVQHRJXIAYEKZ-KRWDZBQOSA-N 430.574 4.082 10 10 IICE COc1cccc(N2CC[C@@H](CN[C@@H](C)c3ccc(N4CCOCC4)cc3Cl)C2)c1 765638786 QJPIKTRMXYMBPQ-OALUTQOASA-N 429.992 4.362 10 10 IICE C[C@H]1CN(Cc2c(O)ccc3ccc(O)c(CN4C[C@@H](C)O[C@H](C)[C@@H]4C)c23)[C@@H](C)[C@@H](C)O1 783547467 XFDKZDPKCUJOHY-GNVSMLMZSA-N 442.600 4.246 10 10 IICE Cc1cncc(/C=C\C(=O)Nc2cccc3c2OCCN3C(=O)/C=C/c2cncc(C)c2)c1 791076203 HWTXRVCPNPSLKX-MKKAVFGOSA-N 440.503 4.184 10 10 IICE Cc1cc(Br)cc([C@@H](C)NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c1O 797087062 OKXCAMUTESOIPX-GFCCVEGCSA-N 440.769 4.400 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 1126580670 BIMKQVVCPTZZFV-RYGJVYDSSA-N 431.439 4.085 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H](N2CCOCC2)C(F)(F)F)cc1 1128694351 UJCQXEMOCDTFSH-FQEVSTJZSA-N 449.477 4.161 10 10 IICE O=C(CCc1cncs1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1134751302 WUTGOKIUQNQVDD-UHFFFAOYSA-N 428.315 4.187 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2CCCN(CCc3ccccc3)C2)cc1 1136480604 RQAQPVNHTVRRMA-XNMGPUDCSA-N 449.639 4.215 10 10 IICE Cc1ccc(C[C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(C)c1 1136767144 KHHVTYAQTQXXPR-MRXNPFEDSA-N 444.578 4.232 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(-c2ccc(Cl)cc2)c1 1137438831 WDXPEJOBRDJEFY-LJQANCHMSA-N 445.350 4.279 10 10 IICE CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(-c4ccccc4C)c3C)c2)CC1 1138289870 NEEXXOUYBLCDFZ-UHFFFAOYSA-N 444.579 4.319 10 10 IICE COc1cc(/C=C(/C(=O)N2CCOc3cc(N(C)C)ccc32)c2ccccc2)ccc1O 1147888731 VHRUTLGCPZXWMU-RCCKNPSSSA-N 430.504 4.433 10 10 IICE CCN(CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])Cc1cc(Br)ccc1O 1191266978 BTUUPCSGHSVYSL-UHFFFAOYSA-N 442.697 4.177 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1226235793 OPBHBGLYWKGETD-MJGOQNOKSA-N 440.975 4.181 10 10 IICE C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1231187187 QWNWFAKNJHWDQJ-MRXNPFEDSA-N 435.399 4.176 10 10 IICE CCOc1ccc(C2=CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)CC2)cc1 1233604571 PMWHTZNVTKCXGX-UHFFFAOYSA-N 435.568 4.045 10 10 IICE C[C@@H]1C[C@@H](CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCO1 1291018487 GUEAUSNQPVIRML-MSOLQXFVSA-N 426.586 4.478 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2ccccc2)c(C)n1-c1ccccc1Br 1293927866 JYFOJQNVEWICLK-LJQANCHMSA-N 441.369 4.438 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1O 1297562115 BVVKMNTWYOYZDY-UHFFFAOYSA-N 447.434 4.044 10 10 IICE CN(Cc1ccsc1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1298427458 PZDAEEJVIRJGSB-UHFFFAOYSA-N 429.600 4.072 10 10 IICE Cc1cc(C(=O)NC(C)(C)[C@@H](O)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1302811276 JFFUNYWYRHVEOU-MRXNPFEDSA-N 433.268 4.288 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cnn(CC(C)C)c1C 1306077848 CVGHWUYFBDTEBV-UHFFFAOYSA-N 435.620 4.286 10 10 IICE CCOc1ccc(C2=CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CC2)cc1 1313410198 FIRUSYZLUHKGFC-VWLOTQADSA-N 436.600 4.253 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Oc2ccccc2C(=O)N2CCOCC2)c1 1352705779 BGRQUNAEAXLHEM-UHFFFAOYSA-N 438.911 4.439 10 10 IICE COc1ccc2c(c1)[C@H](C(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CCC2 1354783766 DFWJAACMDWQXGZ-HXUWFJFHSA-N 448.485 4.287 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(C)c(C(N)=O)cn2)sc(C)c1-c1ccc(C)cc1 1355888548 NGDHECHKBZRZRR-UHFFFAOYSA-N 437.521 4.263 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCN(C)C)Cc2cccc(C)c2)CCCC1 1358282152 WSHVULZLZMYXNS-UHFFFAOYSA-N 433.596 4.428 10 10 IICE CCN(C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccccc1C(=O)OC 1360090668 NZZIEWGKPIPXRQ-UHFFFAOYSA-N 438.524 4.433 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)c(F)c1 1360458583 LKMKRIUKENWQHE-KRWDZBQOSA-N 434.519 4.308 10 10 IICE COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N[C@H](C)c3ccccc3O)c2)cc1 1454808994 ZIJREURKWGBPKV-MRXNPFEDSA-N 440.521 4.001 10 10 IICE COc1cccc(C2=NO[C@@H](C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)C2)c1 1459579168 LEQYKXGQXFOCCQ-WAIKUNEKSA-N 441.959 4.394 10 10 IICE CCC(CC)(COCc1ccccc1)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1461977105 IKEJIYZSDIHBAK-UHFFFAOYSA-N 440.584 4.376 10 10 IICE Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)o1 1470449056 GTJLMQSNDAVDPE-FOIQADDNSA-N 433.499 4.386 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)OC3(CCC3)C2)sc(C)c1-c1ccccc1 1473607445 RHGXXAAVAPFHIH-INIZCTEOSA-N 442.581 4.482 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CC=C(c2cccc(Cl)c2)CC1 1478786080 IXUYMIUUUXATDE-UHFFFAOYSA-N 447.913 4.454 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(CCN(C)C)Cc1cccc(Cl)c1 1478841292 SSIYJSVGMIFHKP-LJQANCHMSA-N 431.024 4.419 10 10 IICE COc1cccc(-c2nnc(N3C[C@@H](C)[C@@H](F)C3)n2CCCSc2nccs2)c1 1504346895 RXQKWRMSWQLEDV-PBHICJAKSA-N 433.578 4.387 10 10 IICE CC(C)Cc1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1509202594 VRRAFMKLHPUDPN-LJQANCHMSA-N 429.584 4.127 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCNc1nccc(C(F)(F)F)n1 1512806285 HCVDETJFCPXCEU-CQSZACIVSA-N 449.481 4.055 10 10 IICE COc1cc(Cl)c(F)c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1525806608 SXFQBIZIBYPAKW-UHFFFAOYSA-N 446.828 4.273 10 10 IICE Cc1cccc(N2CCN(CCCNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)c1 1540547053 SMSFMIDQMNBBOW-UHFFFAOYSA-N 448.586 4.484 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC[C@@H](C[C@@H]2CCOC2)C1 1542224355 DUCJGYUDACUELW-SFTDATJTSA-N 425.621 4.467 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](O)c2ccccc2C(F)(F)F)cc1 1542490640 UHAZKEBKFALXRO-GHTZIAJQSA-N 436.474 4.013 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2C)cc1 1556611494 UHZMBOTXPWRLAB-OAQYLSRUSA-N 448.441 4.465 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)c3ccc(F)cc3)cc2Cl)C1 1564649305 AJQWNJBFMPFXCW-APWZRJJASA-N 433.955 4.291 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](CN(C)C(=O)OC(C)(C)C)C1 1565679454 QASZRUZSBMYYPO-LJQANCHMSA-N 439.556 4.236 10 10 IICE Cc1ccc(C(=O)NCc2ccc(NC(=O)N(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1568083774 OQHWKQFHICKMET-UHFFFAOYSA-N 432.524 4.239 10 10 IICE CCO[C@@H]1COCC[C@H]1CC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 1585492587 MUVWFQCGFYTCJL-GBXCKJPGSA-N 426.557 4.126 10 10 IICE C[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1O 1587446967 DRZMPOPEGYBXAV-ZDUSSCGKSA-N 437.418 4.413 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(Cl)cc(Br)c3N)CC2)cc1 1611011118 DTKASSDUAYGKNB-UHFFFAOYSA-N 438.753 4.092 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C)C3)n2CCCCCCO)c(C)n1-c1ccccc1 1611935746 HJTNAVFDWLXRIH-HXUWFJFHSA-N 437.588 4.130 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1614266493 MHBXROHVFIUDSY-BVYCBKJFSA-N 427.593 4.028 10 10 IICE CC1=C(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)SCCO1 1618368468 HLSRCPYCXBRTQX-UHFFFAOYSA-N 431.315 4.092 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(I)cc1F 1626885802 MOZHCXBBQUROMB-UHFFFAOYSA-N 426.273 4.159 10 10 IICE COc1nc(C)c(Br)cc1C(=O)NCc1ccc(N2CCC(C)CC2)cc1 1628608661 IYLFYLCVWYZMTL-UHFFFAOYSA-N 432.362 4.327 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 1631675528 OYHDVGAEDCOPHW-PXDATVDWSA-N 443.591 4.476 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@H]2CCCC2=O)c(C)n1-c1ccc(Br)cn1 1633205787 JRPPFXYCSWAWCD-AEFFLSMTSA-N 430.346 4.225 10 10 IICE COc1cccc(CC2(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)CCCCC2)c1 1643609929 PURRGQWZIPDONB-UHFFFAOYSA-N 435.612 4.256 10 10 IICE CC(C)N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccccc1F 1644453850 TWBNQHSEVPEQME-UHFFFAOYSA-N 430.479 4.450 10 10 IICE COc1nsc(CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1Br 1646109347 SNUWGCYEXHDIFJ-UHFFFAOYSA-N 434.359 4.181 10 10 IICE COc1cc(N2CCN(CCc3cc(Cl)cc(Cl)c3)CC2)cc(OC)c1OC 1658172395 OAPVPPNAHDCABA-UHFFFAOYSA-N 425.356 4.384 10 10 IICE Cc1ccc(C)c(OC2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)CC2)c1 1684142377 XYBDNYDBFAEQPG-UHFFFAOYSA-N 437.584 4.018 10 10 IICE Cc1ccsc1Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1692949126 VBRGLWZKGDDGLB-UHFFFAOYSA-N 439.629 4.467 10 10 IICE CCC[C@H](Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1709516077 MARSUMQWAQYXSI-FYYLOGMGSA-N 441.620 4.224 10 10 IICE CCCN(CC)CCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1709717308 MXZOOIBEXIFZBU-UHFFFAOYSA-N 440.636 4.003 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728936682 YKXYPPIZAJKGIP-YADHBBJMSA-N 425.621 4.293 10 10 IICE CC[C@@H](C)c1nnc(N2CCS[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743803100 LJEGSKMQNIZUKV-MSOLQXFVSA-N 431.675 4.335 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCOC1 1748380232 IOSPYLJWABZDMH-TZIWHRDSSA-N 437.588 4.250 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@@H](C)C1 1749800226 YUVJBTVHFFBDSO-SXSPYAJSSA-N 441.620 4.194 10 10 IICE CCN(CC)C1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1764966862 VQJMOGWLHINKFQ-UHFFFAOYSA-N 438.664 4.317 10 10 IICE COCC[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1769611571 YWSSWQUQLXUADO-FQEVSTJZSA-N 443.661 4.040 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3ccc(NC(=O)C4CCCC4)cc3)CC2)cc1 1874757125 GCJJXUVDFICFEL-UHFFFAOYSA-N 435.568 4.219 10 10 IICE O=C(N[C@@]1(c2cc(F)ccc2O)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952765809 FXGNSEQKMAVULM-PXDATVDWSA-N 433.435 4.370 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)[C@H](N)c1ccc2c(c1)CCN2C 1999536021 DYEJLPLEZLFGKA-IMRHEYAYSA-N 425.573 4.177 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNCc1cc(Br)cc(F)c1O)c1ccco1 2116245702 GOQOZVVQZKHJEW-AWEZNQCLSA-N 429.286 4.242 10 10 IICE CNCc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)cc1Br 2186724127 ZRXYXKHLWGEASB-LJQANCHMSA-N 442.323 4.422 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]3CCC[C@@H]23)c1O 2236050671 JAWQSXRGOLRCQP-APHBMKBZSA-N 441.366 4.041 10 10 IICE CC[C@@H](Nc1cnn(CCNC(=O)OC(C)(C)C)c1)c1cc(Br)ccc1O 2237656444 WQWSCUFUOODUFO-MRXNPFEDSA-N 439.354 4.439 10 10 IICE CC(C)[C@H](C(=O)NCCc1ccc(O)cc1)N1C(=O)C(=Cc2cccs2)SC1=S 2296566775 DJNVJABGFYWXHZ-GOSISDBHSA-N 446.619 4.038 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(Cl)cc2Cl)SC1=S)c1ccccc1O 2297319162 JYSJQIHURMNOAN-UHFFFAOYSA-N 425.318 4.245 10 10 IICE CSC1=NSC2=NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C(=N)N12 2297348218 VDSPNBKSMOUVRQ-UHFFFAOYSA-N 427.467 4.103 10 10 IICE CCOC(=O)CCCCCN1C(=O)C(=Cc2ccc(Br)o2)SC1=S 2314754882 GMPVDLNYEFQGNZ-UHFFFAOYSA-N 432.361 4.367 10 10 IICE CCN1C(=O)/C(=C/c2c(NC3CCC(C)CC3)nc3ccc(C)cn3c2=O)SC1=S 33457681 PYVZFJPPTWTPRD-BOPFTXTBSA-N 442.610 4.215 10 10 IICE CCOc1cc(/C=C\C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1OC(F)F 209669953 ZQOFPYUSXRFGKN-SDQBBNPISA-N 446.494 4.447 10 10 IICE COC(=O)c1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526354083 WGHIHXXEIKWJKF-OAQYLSRUSA-N 435.407 4.081 10 10 IICE CN(C)c1ccc(CN(C2CC2)S(=O)(=O)/C=C/c2ccc(Br)cc2)cc1 727448370 IOQBPNJFIDKIEL-BUHFOSPRSA-N 435.387 4.480 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3CCC(C(=O)N4CCCCC4)CC3)c2C)cc1F 740168696 VPFOODKVWGFETO-UHFFFAOYSA-N 439.575 4.449 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 743415565 GEMIIPLGXSYYMZ-NRFANRHFSA-N 425.573 4.203 10 10 IICE O=C(CCc1cc2ccccc2nc1O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 767794384 JMCNXUWXJVZYHM-FQEVSTJZSA-N 439.943 4.013 10 10 IICE COc1ccc(N2CCC(NCc3nc(-c4ccc(Br)cc4)n[nH]3)CC2)cc1 773041958 JPJDNMONVFYUAO-UHFFFAOYSA-N 442.361 4.001 10 10 IICE O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1c(Cl)cccc1Br 800899110 IEOOZCYXMZKKAR-UHFFFAOYSA-N 429.767 4.181 10 10 IICE CC(C)c1noc2ncc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)cc12 917715747 UMAVFQHDQMHBBO-GASCZTMLSA-N 426.492 4.029 10 10 IICE CCN1CCN(c2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)cc2F)CC1 921146992 AXTSENNXXIOGCL-UHFFFAOYSA-N 426.580 4.084 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)c3c(F)cccc3Cl)CC2)cc1 1125842998 VJJMQQVUHLRILV-UHFFFAOYSA-N 439.918 4.485 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O 1142419108 NPTHEPPUKAQBRX-KXBFYZLASA-N 448.394 4.468 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC(C)(C)c2cn(-c3ccccc3)nn2)cc1 1149786315 YDIUYXXALPQWDG-UHFFFAOYSA-N 441.535 4.081 10 10 IICE C[C@@H](Oc1ccc(F)cc1Cl)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348678 QSLCYYSGMNSTAG-CXAGYDPISA-N 441.330 4.386 10 10 IICE Cc1ccc(C[C@@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cc1 1154316537 NOHPVNKANBLXHU-FQEVSTJZSA-N 441.369 4.498 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)cc1F 1155324187 PNLGVRFWBDALTH-NRFANRHFSA-N 435.499 4.094 10 10 IICE CC[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cc(F)ccc1F 1168632994 HWPUHBUTGMBOEQ-JOCHJYFZSA-N 434.442 4.420 10 10 IICE CC[C@H](CNC(=O)N(CC)Cc1cc(Br)ccc1O)C(=O)OC(C)(C)C 1251167328 YBSYIWCSANNGSH-CYBMUJFWSA-N 429.355 4.054 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@]12CCN(C(=O)OC(C)(C)C)C2 1251990023 RARNKIXCJVUDPM-UQBPGWFLSA-N 444.620 4.177 10 10 IICE CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1255508841 GKTQWEGPGZUVOH-LOSJGSFVSA-N 448.611 4.256 10 10 IICE CC1CCN(c2ccc(Cn3c([C@H]4CCOC4)nnc3N(C)CC(F)(F)F)cc2)CC1 1291145343 GFQYPPNFLBNNPY-SFHVURJKSA-N 437.510 4.065 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@H](C)C1 1291361692 RCRXLDQPZNIVPQ-RRQZXNHTSA-N 437.588 4.127 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nccs1 1297514202 UVFHMDBHOCNNMW-UHFFFAOYSA-N 436.585 4.330 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1C 1313548844 ZZDOSGBMGJIERM-MJGOQNOKSA-N 434.588 4.066 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1C[C@]12CCCN(C(=O)OC(C)(C)C)C2 1436848301 MJAFNZLOWHBZMC-HCYUJWNOSA-N 429.605 4.145 10 10 IICE Cc1cc(C(=O)NC2CCN(C(C)(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1441820359 OTYRACZXMNFWRP-UHFFFAOYSA-N 433.394 4.244 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)CSc1nc2ccccc2nc1N1CCCC1 1442345066 VVIBNOPMADMZSU-UHFFFAOYSA-N 449.624 4.437 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(COc4ccccc4OC)o3)C2)cc1 1461080781 ZHWWRNVBVGRYBQ-GOSISDBHSA-N 436.508 4.132 10 10 IICE C[C@H](C(=O)NCCCSc1nccs1)c1ccc(I)cc1 1464899805 IZECGOAMJFQFDM-NSHDSACASA-N 432.352 4.150 10 10 IICE Cc1cc(CC(=O)NOC[C@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1466137692 MRLAFKCZYZAGFF-AWEZNQCLSA-N 435.952 4.251 10 10 IICE COCCCOc1cccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1C 1466650329 QXCKDXFBUBKBFV-UHFFFAOYSA-N 425.573 4.193 10 10 IICE CN(Cc1ccccc1CNC(=O)NCc1cccc(Cl)c1O)C(=O)OC(C)(C)C 1470703245 WTAPKKMEUBYUAJ-UHFFFAOYSA-N 433.936 4.412 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)CCO1 1514162028 JIRXNIAMAVOHBW-GOSISDBHSA-N 447.605 4.262 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCO[C@H](C(C)C)C2)cc1 1515524693 HJNVXQVDDFOTHS-QHCPKHFHSA-N 436.604 4.039 10 10 IICE CCOC(C)(C)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1516092649 LCXKCENCHOOINH-UHFFFAOYSA-N 448.615 4.316 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1[C@H]2c3cccc(Br)c3C[C@H]21 1525761643 FGKSUOMGLVZHLN-GSXQUDMHSA-N 427.386 4.457 10 10 IICE Cc1cc(CCNC(=O)c2ccc(I)cn2)c(C)n1-c1ccccc1 1543592863 ACCVQNMOJOJXAD-UHFFFAOYSA-N 445.304 4.066 10 10 IICE C[C@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N(C(C)(C)C)C3)c2C(=O)OC(C)(C)C)C1 1544362690 YYGAXGVQBLLQLN-UONOGXRCSA-N 434.602 4.414 10 10 IICE COc1cccc(-n2cc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)nn2)c1 1557214012 GKRCJCUJOSQNBX-UHFFFAOYSA-N 429.480 4.057 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCN(C(C)C)CC2)sc(C)c1-c1ccccc1 1559521930 SECAFILVWNBLCY-UHFFFAOYSA-N 443.613 4.255 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)N(CC)C[C@H]2C)sc(C)c1-c1ccccc1 1559712513 OLQCHLQTGCYHJK-DLBZAZTESA-N 443.613 4.253 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc3c(c2)CN(C(=O)OC(C)(C)C)CC3)cc1F 1583753517 WBDKXNIDWNMYAR-UHFFFAOYSA-N 427.520 4.115 10 10 IICE C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1584514849 DLBUIQVFXLNMKD-GFCCVEGCSA-N 445.293 4.192 10 10 IICE Cc1cc(Br)cc(Cl)c1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1585536036 NUCPLACXRUYALW-UHFFFAOYSA-N 437.765 4.302 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1 1585585360 QYWDLTWNGDAXSS-LJQANCHMSA-N 439.556 4.284 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(NC(=O)c3cccs3)cc2)N(C)C)cc1 1586054404 HWIIKITZJLMWRV-NRFANRHFSA-N 436.581 4.099 10 10 IICE Cc1ccnc(Nc2cccc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)c2)n1 1596694918 JWQLOMRMKLNTRN-ROUUACIJSA-N 449.530 4.211 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CCSC(C)(C)C1 1611963768 ZVNAVMACBRTCNC-HXUWFJFHSA-N 429.634 4.274 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3cc(C)c(Br)cc3C2)c([N+](=O)[O-])c1 1612966288 BYBJQGVTLPYBQR-XQRVVYSFSA-N 431.286 4.415 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)c(N)c([N+](=O)[O-])c3)cc2)CC1 1616695483 QRYSWKKLOLNKHA-UHFFFAOYSA-N 447.333 4.106 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(Cl)cc(Cl)c1O 1623161460 KVCDCHYVYTUXRD-UHFFFAOYSA-N 434.367 4.161 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1 1626312855 YGKHXMHDBRLVMC-VWLOTQADSA-N 441.547 4.240 10 10 IICE C[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ncccc1F 1626503006 HYOKROUVKYCLJF-PKVLTRFUSA-N 435.571 4.141 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cn1nc(C(F)(F)F)c2c1CCCC2 1628874040 WQHSQIFDJSYBNZ-UHFFFAOYSA-N 434.506 4.430 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccccc3NC(=O)OCc3ccccc3)C2)cc1 1632612053 SHRYTCPKFNEJKP-FQEVSTJZSA-N 445.519 4.453 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N[C@@H](C)C(C)C)c(C)n1-c1cccc(Cl)c1 1633273773 OIEDUBYMFMLWMI-MGPUTAFESA-N 434.005 4.423 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC(=O)c3cc4cc(O)c(O)cc4s3)CC[C@H]2C1 1638771291 BRZQOMMYUFFOTO-CFVMTHIKSA-N 432.542 4.078 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(c3c(C)cc(Br)cc3C)C2)c(O)c1O 1640279057 RZCHJFNIEJBSRX-MRXNPFEDSA-N 433.346 4.184 10 10 IICE Cc1ccc(C(=O)NCCn2nc(C(F)(F)F)cc2C)cc1-n1c(C)cc(C=O)c1C 1644817000 UMZNQUWSFRJKCC-UHFFFAOYSA-N 432.446 4.169 10 10 IICE CCOC(=O)[C@@H]1[C@H]2CC[C@H](C2)N1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1649105766 ANHBNLAJVPVBCO-CVAIRZPRSA-N 445.357 4.413 10 10 IICE COc1cc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nn1C 1650744120 NDXGBTRNRXGEQH-KRWDZBQOSA-N 432.446 4.354 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(F)nc2Br)CCCC1 1652488483 VLDJBAYCJWQJPU-UHFFFAOYSA-N 446.320 4.142 10 10 IICE COc1ccc(N2CCN(Cc3c(C)nn(Cc4ccccc4)c3Cl)CC2)c(OC)c1 1655378703 LVPCUYWKJADZLX-UHFFFAOYSA-N 440.975 4.233 10 10 IICE CC(C)(C)n1nc(Br)c2c(NCc3ccc4cccnc4c3O)ncnc21 1655584673 ALSKUUFUXLGGQS-UHFFFAOYSA-N 427.306 4.210 10 10 IICE COC1CCN(c2ccc(CNC3(c4ncc(Br)cn4)CCC3)cc2)CC1 1660284406 UXAUTYPGPLIEGP-UHFFFAOYSA-N 431.378 4.023 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](C)c1ccc(N2CCCOC2=O)cc1 1682890131 VCHMZDHLPZSYND-RBUKOAKNSA-N 438.572 4.399 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@@H]2c3ccccc3C(=O)N2Cc2ccccc2)c1 1683996169 JQLFSKZXEYYVIC-UZUQRXQVSA-N 445.519 4.158 10 10 IICE CC(C)(C)[C@@H]1CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1706120541 AVGWJCKBNSAJAS-MRXNPFEDSA-N 448.662 4.025 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCC(F)(F)CC2)cc1 1710026241 BFZYEORUZTWTDR-IBGZPJMESA-N 433.547 4.302 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@@H]3CCSC3(C)C)CC2)cc1F 1711866180 RPPVXNZERNOXLH-KRWDZBQOSA-N 447.624 4.408 10 10 IICE COCC(C)(C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1712124246 NDTQBXYTTAXHSI-UHFFFAOYSA-N 443.636 4.012 10 10 IICE CCc1nnc(N2CCC(Cl)=C(Cl)C2)n1Cc1ccc(N2CCSCC2)cc1 1727556745 ZNJMUXGKQQMTLD-UHFFFAOYSA-N 438.428 4.341 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(CC(C)C)CC2)CCOC1 1728764206 BYEUEWAOHHINAE-XMMPIXPASA-N 428.577 4.099 10 10 IICE CC[C@@H](C)c1nnc(N2CCc3c(ccnc3O)C2)n1CCCSc1nccs1 1743676525 FNPYITHHJPGJKI-CQSZACIVSA-N 430.603 4.094 10 10 IICE CO[C@@H]1CCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1749157396 BZUZXBAHNVKBOL-PKOBYXMFSA-N 427.936 4.151 10 10 IICE CC(C)(C)c1nnc(N2CCCC2(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1750446024 MHUGAKIPXMJCRW-UHFFFAOYSA-N 425.621 4.211 10 10 IICE Cc1c(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cnn1CC(C)C 1761636615 PCWVPUWNWSRIFQ-JOCHJYFZSA-N 438.576 4.071 10 10 IICE CCOc1ccccc1OCCOc1cn(CCCOc2ccc(N)cc2)c(C)cc1=O 1857916626 FCIFINKNYACEGF-UHFFFAOYSA-N 438.524 4.065 10 10 IICE CCN(CC)c1ccc(CNCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1860717198 ZQTDNYMLJGONEG-UHFFFAOYSA-N 441.531 4.037 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3c[nH]c4ccc(Cl)cc4c3=O)cccc21 1866073261 DTZFLLGVZBQNSD-UHFFFAOYSA-N 428.831 4.209 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCC3)C(=O)N(Cc3cccnc3)C2=O)cc1 1873165067 AQGYEMVWUVWXCP-UHFFFAOYSA-N 440.547 4.301 10 10 IICE O=C(N[C@@H](CCCc1ccc(O)c(O)c1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1951401373 FEZZJUCNBMRPRX-QFIPXVFZSA-N 447.487 4.412 10 10 IICE CCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCO3)SC1=S 2314522426 IWRURXNVFSFKJK-UHFFFAOYSA-N 435.530 4.489 10 10 IICE CN(C)c1ccc(/C=C(\NC(=O)c2ccccc2F)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 27521066 RAHPIYJLXKDPTG-JCMHNJIXSA-N 448.454 4.210 10 10 IICE Cc1ccccc1-n1cccc1/C=C1\C(=N)N2N=C(COc3ccccc3)SC2=NC1=O 32964226 PQBWWNKAFOCRLX-NLEVOZIKSA-N 441.516 4.484 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C\c2ccc(OCC)c(OCC)c2)SC1=S 206872172 OHVXIRRSQZOIEU-NBVRZTHBSA-N 437.583 4.419 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCCN(c4cccc(OC)c4)C3)ccc21 303662993 HVLNHJBGUPTHRE-OAQYLSRUSA-N 435.568 4.312 10 10 IICE C[C@@H]1CN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)CCN1Cc1ccccc1 396356380 IMNUITREYRCJLM-LJQANCHMSA-N 436.600 4.273 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)c(F)c3)[C@H]2c2ccc(O)c(O)c2)cc1 526540274 HDTHQBAIRXFMBU-NRFANRHFSA-N 425.387 4.442 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nn1-c1ccccc1 742801915 UNVCGHZDPLAMIX-KRWDZBQOSA-N 426.467 4.181 10 10 IICE Cc1cc(CCNC(=O)Nc2ccn(CCc3ccncc3)n2)c(C)n1-c1ccccc1 743187990 HKRXJKGGUBDZFN-UHFFFAOYSA-N 428.540 4.293 10 10 IICE C[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@H](c2ccccc2)O1 745903850 JDYIJQIRTDGFQC-ZWCUEREDSA-N 445.510 4.428 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(c2cccnc2)CC1 768755214 JAKQKIZGAJTAOR-KRWDZBQOSA-N 439.515 4.064 10 10 IICE COc1cc([C@@H](C)NCC(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1OC1CCCC1 775010903 DSZBAJPPRLXPCI-LJQANCHMSA-N 439.600 4.392 10 10 IICE CCN1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1cc(F)c(F)c(F)c1 782518765 AUUUUTQPJBOTOX-FYYLOGMGSA-N 444.501 4.115 10 10 IICE CN(C)c1ccc([C@H](CNCc2ccc(-c3cc[nH]n3)o2)NC(=O)OC(C)(C)C)cc1 788524080 UNGJASRGKLUTKY-FQEVSTJZSA-N 425.533 4.091 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CN3CCC(C(=O)N4CCCC4)CC3)c2C)c1 800743925 WAGXCMGWNBQDJC-UHFFFAOYSA-N 439.625 4.333 10 10 IICE Cc1cc(NC(=O)c2ccco2)sc1C(=O)NCc1cc(Br)ccc1O 804739224 BNRAKKLKRFCFEQ-UHFFFAOYSA-N 435.299 4.300 10 10 IICE C[C@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457204 GPNVUJBMLGDJBN-FDDCHVKYSA-N 425.548 4.470 10 10 IICE COC(=O)Nc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1F 1125948164 GWGACVQTOFEXQZ-UHFFFAOYSA-N 437.418 4.004 10 10 IICE CCCO[C@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)cc1C 1129549421 JWCSWEVURMVRNK-QFIPXVFZSA-N 436.474 4.033 10 10 IICE Cc1cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1-c1cccc(Cl)c1 1147775414 KBGIFEMPOZOGFE-KRWDZBQOSA-N 439.903 4.377 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)NC(C)(C)C)c(C)n1-c1cccc(Br)c1 1156296406 JKKNHXJAIYHNQS-IBGZPJMESA-N 446.389 4.376 10 10 IICE CCN(C)c1ccc(CN2CCN(C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)CC2)cc1 1198791521 WFBICVLCANONEN-UHFFFAOYSA-N 448.608 4.348 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccc(COC[C@H]2CCCO2)c1 1231342853 COUCPSMSMUUDLT-XMMPIXPASA-N 425.573 4.180 10 10 IICE C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1248501016 CKNZBRNOMAQFHZ-GOSISDBHSA-N 446.478 4.474 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4F)C3)cc2Cl)C1 1270433302 TWMOHMSSKRLZAU-SJLPKXTDSA-N 443.950 4.385 10 10 IICE Cc1cnc([C@H](C)Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1290293950 PIGPZAXVHSSBOC-DNVCBOLYSA-N 427.574 4.430 10 10 IICE CC[C@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1306442467 OJKGKKHFNHCLRH-RDPSFJRHSA-N 448.615 4.162 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)C(F)(F)F)cc1 1355124635 YAQOYMUISQQSLX-UHFFFAOYSA-N 432.364 4.246 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)c4c(c3)OCO4)cc2)CC1 1443662237 JDIIEGFWUAXKSA-UHFFFAOYSA-N 431.330 4.344 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)cc1C 1448246753 XQCGCRCLHZSJCB-OAQYLSRUSA-N 435.499 4.473 10 10 IICE Cc1noc(C[C@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)C2)n1 1469961614 WFRUCTOAJOYTFJ-QFBILLFUSA-N 445.995 4.432 10 10 IICE CC(=O)c1nn(C(C)C)cc1OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 1473085355 ISIYPJQQKNBUHQ-UHFFFAOYSA-N 437.496 4.107 10 10 IICE COC(=O)[C@@H](c1ccc(Br)s1)N(C)Cc1cc(Cl)cc(C(C)=O)c1O 1473731679 YIXQAJMMNMCTLA-OAHLLOKOSA-N 446.750 4.418 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2c(C)nn(C)c2C)n1Cc1ccc2c(c1)CCCN2C 1512801850 OIOUBFCOYOPJHY-QGZVFWFLSA-N 435.620 4.209 10 10 IICE CC[C@@]1(C)CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1513591026 VOXNNINNTQCGNI-QHCPKHFHSA-N 443.592 4.189 10 10 IICE Cc1oc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)nc1C1CC1 1527308837 IPZCBUXPQIGJOX-GDNBJRDFSA-N 431.514 4.230 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cncc(-c4ccc(OC)cc4C)c3)CC2)cc1 1528110671 OJCSQOALQTYPNO-UHFFFAOYSA-N 431.536 4.473 10 10 IICE CCOc1c(Cl)cccc1CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1533992269 NBOMQXOLKBDNJY-UHFFFAOYSA-N 442.003 4.130 10 10 IICE Cc1cc(CCNC(=O)/C=C/c2ccc(OCCN(C)C)cc2)c(C)n1-c1ccccc1 1534548897 HLWLHZLIHPURBX-NTCAYCPXSA-N 431.580 4.407 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)N(C)C)cc1 1537482604 HBOXKQCTVDJNTH-QFIPXVFZSA-N 449.599 4.424 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCc2cc(Br)ccc21 1544410141 YDNMEUVWNKLYPS-FQEVSTJZSA-N 431.399 4.349 10 10 IICE CC[C@@](O)(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Cl)c1 1545043461 ZWRKPJKCFQUPPB-JTSKRJEESA-N 438.902 4.324 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(COC)CCC1 1545332909 QOQCFMOPVHRTIE-HXUWFJFHSA-N 441.620 4.081 10 10 IICE CN(Cc1ccoc1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1554191779 KVBHZWODGWABKH-UHFFFAOYSA-N 441.551 4.120 10 10 IICE CN(CC1CC(F)(F)C1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1554208043 FUSQDKKIXVWMJL-UHFFFAOYSA-N 447.574 4.233 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cccc(C(=O)N4CCOCC4)c3)c2C)c1 1556306243 UVWPVSWDDCSDIK-UHFFFAOYSA-N 445.563 4.113 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCc1ccc(N(C)C)cc1 1568378527 IDCIUISQZFGECT-UHFFFAOYSA-N 425.573 4.074 10 10 IICE Cc1cc(C(=O)N2CCOCC23CCCCC3)c(C)n1-c1ccc(Br)cn1 1569106100 JXMDBBHHQZCJNL-UHFFFAOYSA-N 432.362 4.427 10 10 IICE Cc1ncsc1/C=C/C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1584901518 OGISXFDIYTWIGN-MVGZEHJDSA-N 431.533 4.334 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)c3cccc(C(=O)c4ccccc4)c3)C2)cc1 1585988135 KAONAAVOYQSLAT-CVDCTZTESA-N 428.532 4.425 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H](Oc3ccc(F)c(F)c3)c3ccccc3)C2)cc1 1587112566 HBHWKUZPIJLBHA-MHECFPHRSA-N 438.474 4.489 10 10 IICE CCN1C(=O)C[C@H](C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)[C@H]1c1cccnc1 1596483709 VJPIFYMSWVITEW-UKILVPOCSA-N 430.552 4.023 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1cccc2ccccc12 1597567323 JUQKYRUSANTGFK-HNNXBMFYSA-N 427.884 4.168 10 10 IICE Cc1cc(C(=O)Oc2ccc(NC(=O)c3cnn(C)c3)cc2)c(C)n1-c1ccc(F)cc1 1611280575 NLGPSRFDKNVYJL-UHFFFAOYSA-N 432.455 4.438 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccnc(OC(F)F)c1 1613921495 YRPZRZZINIXLCD-UHFFFAOYSA-N 442.514 4.122 10 10 IICE Cc1cccc(C[C@H](CO)NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1 1616333930 WHNPCSWDJNXCBX-HXUWFJFHSA-N 441.369 4.498 10 10 IICE CCOC(=O)N1[C@H](C(=O)N(CC)Cc2ccc(N(C)C)cc2)CC[C@H]1c1ccc(C)o1 1626885964 TUHTYWGDZRDDEB-SFTDATJTSA-N 427.545 4.365 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1630273914 XQEDRVRTXLAAKR-AWEZNQCLSA-N 433.335 4.247 10 10 IICE CN(CCC(=O)NCc1ccccc1O)C(=O)OCC1c2ccccc2-c2ccccc21 1630363089 IXGAORXGGHIKON-UHFFFAOYSA-N 430.504 4.279 10 10 IICE Cc1cc(C(=O)NC[C@]2(N(C)C)CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1630863406 NGPDNJCLVNMAAM-QRQCRPRQSA-N 447.421 4.492 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@]3(O)CCCN(Cc4ccccc4)C3)c2C)c1 1631793816 HZDATJFXVSXCDL-MHZLTWQESA-N 431.580 4.046 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@H](Oc1ccccc1Br)c1ccccc1 1639444586 QNMNTFFNWBRDIP-HXUWFJFHSA-N 428.282 4.297 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCCC2)[C@@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1643394670 QKHNFFYSUSSVOO-NRFANRHFSA-N 427.589 4.473 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@@H](c1ccc(Br)cc1)N1CCCC1 1654366067 MZXLALKSEMQEQW-JOCHJYFZSA-N 443.385 4.487 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3ccc(Br)cc3F)C2)cc1 1673290012 ITRURXDFXPKQSL-HIFRSBDPSA-N 436.325 4.236 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CC[C@@H](C(F)(F)F)O2)cc1 1685139796 INEFRTHOFGEPSX-HKUYNNGSSA-N 425.451 4.167 10 10 IICE CC(C)c1nnc(N(C)CCc2cccs2)n1Cc1ccc(N2CCOCC2)c(F)c1 1691687052 HCPREAFVGAKKGF-UHFFFAOYSA-N 443.592 4.166 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CC(C)(C)c2ccccn2)n1 1707583142 LMFWUOZUWKZFEP-UHFFFAOYSA-N 428.540 4.363 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1723318704 JGFRHSBCVWMMOS-NRFANRHFSA-N 439.648 4.360 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2C[C@H](C)O[C@H](COC)C2)cc1 1746089494 CJONNCDRLCITFM-CVDCTZTESA-N 441.620 4.070 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCCO[C@@H](C)C2)cc1 1746093555 QITVFRNKGRMTTO-UGKGYDQZSA-N 427.593 4.029 10 10 IICE Cc1nnc(N2CCO[C@@H](c3ccc(F)cc3F)C2)n1CCCSc1nccs1 1751937851 LCHKEACZFJKLBF-QGZVFWFLSA-N 437.541 4.082 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCS[C@H](C)C2)cc1 1764935839 BKNWOMRCIMIBMO-LJQANCHMSA-N 436.629 4.100 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1765427016 CQZAEWDTVDAEKX-BWKNWUBXSA-N 437.588 4.129 10 10 IICE CCO[C@@]1(c2nnc(N(C)CC(C)(C)C)n2CCCSc2nccs2)CCOC1 1765812028 CXKYLYFKUOAEOO-FQEVSTJZSA-N 439.651 4.051 10 10 IICE CCCN1CCC(N(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)cc2C)CC1 1766107517 VMWOSJLHEITJPQ-UHFFFAOYSA-N 426.653 4.210 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)[C@@H]2CCSC2)cc1 1766615437 XIVPFYDTNRRLMX-PZJWPPBQSA-N 429.634 4.008 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@H](C(F)F)C2)cc1F 1768495209 YJXVDQIGWJSAKK-QFBILLFUSA-N 437.510 4.255 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)N(C)C)cc1 1858594445 ZSZVLFXZBVFGPE-LSCADSNKSA-N 443.550 4.108 10 10 IICE COCCN1C(=O)C(N[C@H](C)c2ccccc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873167927 CXVSDAWBRHZPII-HXUWFJFHSA-N 443.547 4.171 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3ccc(OC(=O)C4CCCC4)cc3)CC2)cc1 1874747605 QXLHVFSEFLSAKE-UHFFFAOYSA-N 436.552 4.186 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](CNCc1cccc(Br)c1O)C2 2103449426 IAXVOPZOAQDPKL-MKZZRHPPSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2C[C@H]1C[C@H]2NCc1cc(Br)cc(F)c1O 2108256706 SWWOXFVOKLOKOW-CJTUPEFNSA-N 429.330 4.075 10 10 IICE COc1ccc(Br)c(CNCc2c(C)nn(Cc3ccccc3)c2C)c1O 2236047791 VZBGDBIAYCVOSE-UHFFFAOYSA-N 430.346 4.315 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3-c3ccc(Cl)cc3)C2=O)cc1 2294093670 BPDWAFWVAOWESE-UHFFFAOYSA-N 435.867 4.196 10 10 IICE CC(C)c1ccc(C=C2SC(=S)N(CCC(=O)NCc3cccnc3)C2=O)cc1 2296730282 PPLSYFMIXZYFOH-UHFFFAOYSA-N 425.579 4.113 10 10 IICE CCOC(=O)CCN1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 2314939425 SOBREBGSORRNOP-UHFFFAOYSA-N 432.479 4.009 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1cccc(Br)c1O)[C@@H]2F 2333285167 UBSWLOMBQYRMCI-OJLVUWQFSA-N 429.330 4.123 10 10 IICE CCCN1C(=O)/C(=C\c2c(Oc3ccc(C)cc3)nc3ccccn3c2=O)SC1=S 33933601 GEYPIJDZUNJKKO-GHRIWEEISA-N 437.546 4.406 10 10 IICE CCc1ccc(Oc2ncnc(N3CCN(c4ccc(OC)cc4)CC3)c2[N+](=O)[O-])cc1 40611288 NIFJLWGOOXXDNE-UHFFFAOYSA-N 435.484 4.075 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1S(N)(=O)=O 72002683 CFAZWYKJAMUBLS-UHFFFAOYSA-N 441.553 4.126 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 226741473 NUAVGBMVFGHSST-LVCYWYKZSA-N 427.526 4.498 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(Cc2ccco2)C[C@H]2CCCO2)C1 426884364 TVHCACLPKBTQOP-OAQYLSRUSA-N 435.568 4.209 10 10 IICE CC[C@H](Oc1ccccc1C(C)C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 730030589 KQXSMONVUDWGSS-QHCPKHFHSA-N 428.548 4.384 10 10 IICE Cc1oc2c(CN3CCC[C@@H](C(=O)N4CCCC4)C3)c(O)ccc2c(=O)c1-c1ccccc1 732189254 CCHOHVRAEBNCEO-HXUWFJFHSA-N 446.547 4.308 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ncoc3-c3ccccc3Cl)cc2F)CC1 741927143 NDSAWDXJZCBYHL-UHFFFAOYSA-N 442.922 4.206 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F 791246605 OYFYVSQQTVCTNW-UYAOXDASSA-N 430.495 4.457 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C)n(-c2ccccc2)n1 791251115 ZZERZDGVWNEHBM-UHFFFAOYSA-N 434.540 4.183 10 10 IICE C[C@@H](NCc1ccc(I)cc1Cl)c1cc([N+](=O)[O-])ccc1O 794840195 HDFJOBJQFAQDNU-SECBINFHSA-N 432.645 4.409 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O[C@@H](C)C2 920881777 RHIJKHDYVAMSTH-AXVPCFCXSA-N 436.552 4.136 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cccc(Cl)c1 1124424724 LBSFSPAXIRZUCI-GZTJUZNOSA-N 434.945 4.387 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCOc3cccc(C(F)(F)F)n3)ccc21 1127789330 ABXWFQDSOXBAKO-UHFFFAOYSA-N 435.446 4.127 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)CC2)cc1 1137658309 CQNTVJUHLIIANM-UHFFFAOYSA-N 442.274 4.402 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(Cc2cccc(Cl)c2)C(=O)C1 1150900849 FSYSVKSIAVNCNA-UHFFFAOYSA-N 427.957 4.294 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCn3ccc(C(F)(F)F)n3)cc2Cl)C1 1227206832 ABNKTZINSUMXOM-AWEZNQCLSA-N 443.901 4.291 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1289601985 IDOTWDSUWLDZGL-ARMFNRFLSA-N 436.644 4.020 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)cc1 1293364545 MXVVYQJGXDPYAR-HSZRJFAPSA-N 433.527 4.373 10 10 IICE COCC[C@H]1CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1301507777 VSHAFJGULZKIQM-MRXNPFEDSA-N 433.603 4.348 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@@H]3CCCN3C[C@@H]2C)cc1 1313678044 BBRZGJRXTUIVFG-REWPJTCUSA-N 438.664 4.434 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCOC2)n1CCCC(F)(F)F 1314735893 DLRUVKIIKIRQLV-SFHVURJKSA-N 437.510 4.361 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(F)c(F)c1F 1352775421 RAJVCUNIHNXQFX-NTEUORMPSA-N 440.443 4.473 10 10 IICE Cc1cc(-c2csc(NC(=O)Cn3nnnc3C(C)C)n2)c(C)n1-c1ccc(F)cc1 1352964731 FSCPELMWYSFSLS-UHFFFAOYSA-N 439.520 4.105 10 10 IICE COc1ccc(CCCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1OC 1357835660 HVDXSSUCCFCRHD-ROUUACIJSA-N 444.547 4.096 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc3nc(O)n(CC(F)(F)F)c3c2)cc1F 1443771927 MYPIHUBEPYYZIK-UHFFFAOYSA-N 438.425 4.220 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 1444974365 JHARWZXBIBYOID-NFQMXDRXSA-N 443.591 4.476 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CC(=O)N(c2ccc(F)c(C)c2)C1 1445660732 WYZGHJSDTSZUEC-HNNXBMFYSA-N 449.320 4.004 10 10 IICE Cc1cccc([C@H](C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1C 1459860216 MFDFXBSRKWNFOQ-GGPKGHCWSA-N 427.564 4.023 10 10 IICE C[C@@H](NC(=O)N[C@H]1C[C@@](CNC(=O)OC(C)(C)C)(c2ccccc2)C1)c1ccccc1O 1471426762 YDYZGOTZIAHTCG-IZJXBPLLSA-N 439.556 4.378 10 10 IICE C[C@]1(Cc2cccc(F)c2)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1479031015 WWBWXEBFNXASPL-RUZDIDTESA-N 425.548 4.094 10 10 IICE CCc1nnc(N2CCN(c3ccccc3Cl)CC2)n1CCCSc1nccs1 1513921740 OWHYUNZRNHRFIE-UHFFFAOYSA-N 449.049 4.459 10 10 IICE CC(C)c1ccc(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)cc1[N+](=O)[O-] 1528770296 PBJNHPZRLTZJHM-UHFFFAOYSA-N 446.507 4.462 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 1532656334 RBTSGHNKCDHNRU-CUWPLCDZSA-N 443.588 4.436 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)n1 1543244906 FQQJLOIJQZHETO-OAQYLSRUSA-N 444.535 4.101 10 10 IICE Cc1cc(CNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c(C)n1-c1ccccc1 1544086478 IORCMXRRMFEVSY-UHFFFAOYSA-N 425.479 4.139 10 10 IICE Cc1ccc([C@H](CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)N(C)C)cc1 1544272597 DCSWKRAXJVUECH-SANMLTNESA-N 432.612 4.135 10 10 IICE CCOC(=O)C1(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)Cc2ccccc2C1 1545020174 ZTPIZDAEFNNWAM-UHFFFAOYSA-N 444.531 4.046 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NCc1cc(Cl)ccc1O 1557386380 SMJDWWGEQMDLKK-CDHQVMDDSA-N 426.944 4.446 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1 1559836996 JFZPPHHDJMYKFA-UHFFFAOYSA-N 433.955 4.095 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1c1nc(C(=O)NCCCSc2nccs2)co1 1565619911 DTMATVIBMVVFJQ-AWEZNQCLSA-N 438.575 4.115 10 10 IICE COCCN1C(=O)CCc2cc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)ccc21 1567884068 UMTRVLBIGIKJIF-UHFFFAOYSA-N 445.519 4.085 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1c(Br)sc(C)c1C 1570514457 BLDMDESGDYZPGJ-UHFFFAOYSA-N 426.332 4.039 10 10 IICE CCOC(=O)[C@]1(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CCCOC1 1586247856 DPLONUZLJJXKTL-VWLOTQADSA-N 426.557 4.307 10 10 IICE CCC(CC)n1nccc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1586619808 NOWDBNUKHQBWRB-FQEVSTJZSA-N 443.592 4.306 10 10 IICE CCOC(=O)N1[C@H](C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC[C@@H]1c1ccc(C)o1 1597800734 OMYACGGLIWUYOQ-YHYVQYDKSA-N 441.572 4.372 10 10 IICE COCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1597949297 CTFCWMYOEYFZSX-NRFANRHFSA-N 433.593 4.002 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1F 1616924280 IEZARHCTCBDOMN-KSFYIVLOSA-N 449.929 4.300 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1cccnc1 1619863533 MATSJWMSUFNFCW-UHFFFAOYSA-N 430.556 4.073 10 10 IICE C[C@@H](NC(=O)[C@]1(C)CC(c2cccc(Cl)c2F)=NO1)c1ccc(N2CCOCC2)cc1 1625882088 CPLXWZPHQKQBEW-CMJOXMDJSA-N 445.922 4.076 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C(=O)c2cc(Cl)cc(Cl)c2)cc1 1626106578 OVRVTIFGGDQSAQ-HXUWFJFHSA-N 435.351 4.450 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1sc(C(C)(C)OC)nc1C 1626511674 PVURUJAKFSMXJX-UHFFFAOYSA-N 447.601 4.335 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc4ccccc4cc3NC(=O)C(C)C)C2)cc1 1629084483 PBTHJOAMLVMVCO-HXUWFJFHSA-N 431.536 4.452 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1C(=O)c1cccs1 1642297901 VADFADUPDZNJSF-UHFFFAOYSA-N 442.487 4.024 10 10 IICE O=C(NCc1c(O)cccc1O)c1ccc(COc2ccccc2Br)cc1 1647269549 HMFXDZZHLXVCDF-UHFFFAOYSA-N 428.282 4.369 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3cc(F)ccc3F)cc2Cl)C1 1672137999 ZYYKKOCTJSFSRP-VBKZILBWSA-N 437.918 4.387 10 10 IICE Cc1ccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1680563106 PBOGSWBFGODMSY-RXVVDRJESA-N 429.992 4.288 10 10 IICE Cc1cc(CNC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)c(C)n1-c1ccccc1 1683307516 INIPJBRMGDIDCB-XMMPIXPASA-N 430.552 4.431 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1c2ccccc2CC[C@H]1n1ccnc1 1686826706 NQLFMVYLFOQLTO-OWAUWMPXSA-N 431.584 4.417 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1(C)C 1693700940 GSDDDROAJLMISH-SFHVURJKSA-N 443.611 4.472 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1694004383 ZQVWPSVQVQFSQV-IBGZPJMESA-N 425.621 4.285 10 10 IICE CC(C)(C)[C@@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CCO1 1722925457 IKJIFVFCISJUPZ-CVEARBPZSA-N 437.635 4.020 10 10 IICE CC[C@H](C)CN(CC)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763886186 IBKMVWCETUBJHH-PGRDOPGGSA-N 445.583 4.026 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765512452 CLGNXXOGBMBOCQ-HXUWFJFHSA-N 448.615 4.222 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866140470 BUGGARRDWOFUKS-LJQANCHMSA-N 434.492 4.190 10 10 IICE COc1ccc(N2CCN(Cc3cc(=O)c(OC)cn3CCC3=CCCCC3)CC2)cc1 1870555502 JEAMIRLBXACSTN-UHFFFAOYSA-N 437.584 4.078 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nc(=Nc3cc(Cl)ccc3O)nc(N3C[C@@H](C)C[C@@H](C)C3)[nH]2)C1 1871732293 AYPBGQYPPFTKCN-WNKDZCFJSA-N 445.011 4.361 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCN(C)C)C(=O)N(C3CCCCCC3)C2=O)cc1 1873164884 XGNATUZTXHAERQ-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CN(CCN(Cc1ccccc1)c1cc2c(cc1Cl)[C@@H](N)C(=O)N2)Cc1ccccc1 1946822836 SAURMVZZKCCTEN-XMMPIXPASA-N 434.971 4.431 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4C)o3)C2=O)cc1 2294133999 PEFLKYREMZELIF-UHFFFAOYSA-N 431.404 4.138 10 10 IICE COc1cc(OC)c([N+](=O)[O-])cc1C=C1C=C(c2ccc(Br)cc2)OC1=O 2294253365 HZCZCLHOWIXPPV-UHFFFAOYSA-N 432.226 4.356 10 10 IICE CC[C@H](C)N1C(=O)C(=Cc2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 2296545975 DOVJPOZRRSIXKI-AWEZNQCLSA-N 430.599 4.071 10 10 IICE CCOc1cc(/C=C2/SC(Nc3cccc(OC)c3)=NC2=O)ccc1OCCC(=O)O 16920060 ZCJWIBFDZHEAOH-XDHOZWIPSA-N 442.493 4.030 10 10 IICE O=C1N=C(O)/C(=C\c2coc3ccccc3c2=O)C(=O)N1c1ccc(Br)cc1 96484495 WPVBMFIOCJPZSR-OQLLNIDSSA-N 439.221 4.062 10 10 IICE Cc1cc(C(=O)N2CCC(C(=O)NC(C)C)CC2)c(C)n1-c1ccc(Br)cc1 109786452 SQHYMKFQVBFNCK-UHFFFAOYSA-N 446.389 4.233 10 10 IICE CC(C)(C)c1ccc(C(=O)NN2C(=O)/C(=C/c3ccc(C(=O)O)cc3)SC2=S)cc1 208023301 JQZOHQJNDIQVRG-ATVHPVEESA-N 440.546 4.229 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 226850138 USBAQQJDZNTAJR-ZOCZFRKYSA-N 427.888 4.451 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(Cc2ccco2)C2CCN(C)CC2)C1 435664960 TWRMEHOJAYLDIJ-UHFFFAOYSA-N 448.611 4.124 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)c(C)n1-c1ccccc1 728311380 XZRSSVHOEBGRSK-GOSISDBHSA-N 430.552 4.216 10 10 IICE COc1ncccc1-c1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 761688718 DWWLYARNUWQBHR-SDNWHVSQSA-N 444.563 4.036 10 10 IICE COCCc1nnc(-c2cccc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)c2)o1 778718577 MIGOGJLAYYUXTR-UHFFFAOYSA-N 434.540 4.092 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H]1Cc1c(F)cccc1Cl 919790787 PQHPDZPQKWSTSJ-IBGZPJMESA-N 431.939 4.232 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Br)cc1Cl 1129549678 VLTBKWPQARQJRB-UHFFFAOYSA-N 445.691 4.147 10 10 IICE COc1ccccc1CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1134538905 WDPQYVTVLCNJLH-UHFFFAOYSA-N 437.297 4.349 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1C[C@@]1(C)c1cccc(Br)c1 1135732773 GEMGTHBBCJUKJN-GGAORHGYSA-N 443.385 4.222 10 10 IICE COC(=O)Nc1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c(Cl)c1 1136389543 BVPLPIIYQNCNST-UHFFFAOYSA-N 442.947 4.303 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CC(C)(C)CNC(=O)OC(C)(C)C)cc1 1136480233 GFCVVJUORBXGQW-NRFANRHFSA-N 447.620 4.201 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1CCN(C2CCCCC2)C1 1139584736 JLRROIHFHZNBBU-IBGZPJMESA-N 429.605 4.030 10 10 IICE CCC[C@H]1CN(CC(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OCC)CCO1 1168200193 GHLVIBMYDXALRD-SFHVURJKSA-N 430.570 4.340 10 10 IICE Cc1cccc(OCc2nnc(N3CCCOCC3)n2CCCSc2nccs2)c1 1290071865 VQMUENVICCCIHW-UHFFFAOYSA-N 445.614 4.031 10 10 IICE COc1cc(C(=O)N(C)C)ccc1NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1294094215 ILRIIZKOTGRSRR-UHFFFAOYSA-N 433.508 4.178 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCSC[C@H]2C)cc1 1295415175 OVZGINHWGVBANJ-NQIIRXRSSA-N 429.634 4.356 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCN(C(C)=O)CC1 1295428111 NVBKGAXVESUHPR-UHFFFAOYSA-N 448.615 4.457 10 10 IICE Cc1cccc(C2=CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)c1C 1312833706 LSYVQFKMBPULRA-UHFFFAOYSA-N 441.522 4.417 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1316172495 LEPHISUVSSCJET-SFTDATJTSA-N 441.620 4.133 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C=C/c1ccc(I)o1 1351672088 CHNNYYSRINTLCQ-PKNBQFBNSA-N 436.293 4.156 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2ccc(-n3c(C)ccc3C)cc2)s1 1357479349 JIZKNGSZCLQQJZ-UHFFFAOYSA-N 445.610 4.116 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc3nccc(C(F)(F)F)n3n2)cc1 1360072217 VSPWGOFHROQNMI-UHFFFAOYSA-N 445.367 4.019 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCC[C@@H](C(F)F)C1 1361098369 SQKOBPUZDQTIGD-LJQANCHMSA-N 440.542 4.168 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cnn(Cc3ccccc3)c2N)cc1 1441155174 UTNNHSRCUHQVIN-UHFFFAOYSA-N 429.524 4.015 10 10 IICE CCOC(=O)c1cccc(N(CC)C(=O)/C=C/[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1441971465 RDQSFPHHYXNGFH-KAUXGEHWSA-N 430.545 4.420 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CS[C@H](C)C(=O)NCC(=O)OC(C)C)c2C)cc1C 1459126067 KXHXTHUBRLAOFM-LJQANCHMSA-N 444.597 4.083 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(Cc4ccccc4)nc3C)CC2)c(OC)c1 1461978360 CDWVUNDFTCVIPU-UHFFFAOYSA-N 437.565 4.022 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1464637727 KUANGWAFAWKBCG-DEOSSOPVSA-N 443.547 4.250 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@H]1CN(c2ccc(Cl)cc2)CCO1 1470810769 SCWGTLUCKVJHNX-NRFANRHFSA-N 431.964 4.263 10 10 IICE CCc1ccc(C(C)(C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 1473326109 BWWUYZFCSWOGFT-RTBURBONSA-N 441.591 4.143 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCC[C@@H]3CCCCO3)CC2)cc1F 1504292804 SRZNAKQUIOMZSW-FQEVSTJZSA-N 445.583 4.225 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1CC(C)(C)C1 1509133814 WNFFEWCYYGMQGA-UHFFFAOYSA-N 425.621 4.386 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1514324368 YCPHXDZWFWEJGR-CTNGQTDRSA-N 443.661 4.398 10 10 IICE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1535135590 DFZRZBIXVFSUAL-VWLOTQADSA-N 445.563 4.332 10 10 IICE C[C@@H](NC(=O)CC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1535557635 CJXINIFYDYMJBP-UXHICEINSA-N 445.604 4.128 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(-c4ccccc4Cl)o3)cc2)CC1 1537839126 JYQQHKHLNPOXEM-UHFFFAOYSA-N 437.927 4.232 10 10 IICE Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3ccc(C)c(O)c3O)cc2)cc1 1542609302 SWQQWNRMIIURGD-UHFFFAOYSA-N 448.519 4.442 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C)OC 1545306805 XCZXHLGWBAJMRB-DENIHFKCSA-N 443.636 4.110 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1546590178 DBTBIIGXPSDPQD-WOIUINJBSA-N 441.620 4.058 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)N(CC)C[C@@H]2C)sc(C)c1-c1ccccc1 1559712516 OLQCHLQTGCYHJK-SJORKVTESA-N 443.613 4.253 10 10 IICE CCCCN(CC(=O)N1CCN(Cc2ccc(C(C)C)cc2)CC1)Cc1ccccc1O 1559790386 QZYRAKDTYKBTOK-UHFFFAOYSA-N 437.628 4.462 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc3c(nc2O)CCC[C@H]3O)cc1 1565655813 AYZIKYIVVJJAFO-XMMPIXPASA-N 447.535 4.079 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)cc1 1588094392 VQIOGFYSDHDHDI-UHFFFAOYSA-N 449.526 4.464 10 10 IICE COC(=O)CCCN(Cc1ccccc1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1595493299 CYCGBJIPNHETCQ-UHFFFAOYSA-N 446.547 4.431 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(=O)n(C)c(=O)n(C)c3c2)c(C)n1-c1cccc(C(C)C)c1 1596906883 MDRWOCHMQPGEFK-UHFFFAOYSA-N 444.535 4.020 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@@H](C1CCCCC1)N(C)C 1617941301 WDIMDKBSFHAVAK-QHCPKHFHSA-N 448.615 4.116 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc3nc(C(F)F)[nH]c23)c1 1633079980 SZROZPIAWQSBIF-UHFFFAOYSA-N 449.461 4.245 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)cc1F 1633259689 WCXUPPKBLISHSR-INIZCTEOSA-N 447.938 4.003 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)N(CC)C(=O)OC(C)(C)C 1635489354 UQZPXPPHHDVMDP-QGZVFWFLSA-N 449.592 4.021 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(CCc4ccc(O)cc4)CC3)C2)cc1 1636354301 WQDYOXCXIPWFEP-JOCHJYFZSA-N 437.584 4.282 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(C)(C)Oc3ccc(Br)cc3)CC2)cc1 1636702113 CPSKPCSTOUCLRM-UHFFFAOYSA-N 447.373 4.354 10 10 IICE COc1ccc(N2CCCN([C@@H]3CCN(c4ccc(Cl)cc4Cl)C3=O)CC2)cc1 1657024003 QITAZBAADKOXOM-OAQYLSRUSA-N 434.367 4.320 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H](O)COc1cc(C)ccc1Cl 1657431370 LORXGMVBSIQJSO-MRXNPFEDSA-N 428.754 4.378 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](c1nc(-c2cccnc2)no1)C(C)C 1682097046 IDCVHZRIRRCZKP-DYESRHJHSA-N 436.560 4.134 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c2C)c1 1684599789 KFPUKHDZLUBDEZ-KRWDZBQOSA-N 428.577 4.457 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)CCC(F)(F)F 1707305267 VHDFNPIAIJXTDZ-UHFFFAOYSA-N 432.494 4.075 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1709220958 WODIANOKQBYXHO-YLJYHZDGSA-N 434.588 4.114 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1CC1(N(C)C)CCCCC1 1711095205 FAZODFZVWXCFFB-NRFANRHFSA-N 427.593 4.126 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C2CC2)O1 1726704933 RSAHTCRNPACPKX-HRAATJIYSA-N 429.584 4.124 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCCCC1 1728200004 YAIVFHWAXXDKLN-UHFFFAOYSA-N 434.588 4.259 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1728378702 DDGSLSDECKDKSX-VWLOTQADSA-N 434.588 4.240 10 10 IICE C[C@H]1C[C@H]1n1c(C2CCN(C(=O)OC(C)(C)C)CC2)nnc1N(C)Cc1ccccc1O 1752055766 SELWITIFXAPDHU-QFBILLFUSA-N 441.576 4.316 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](N3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752710171 YKSXSBBTDUFMCO-AZUAARDMSA-N 428.600 4.110 10 10 IICE Cc1cccc(-c2nnc(N3CC(C)(C)OC(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1761930429 CLZABQJXQYHRFB-UHFFFAOYSA-N 448.615 4.465 10 10 IICE COCCN1C(=O)C(=Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)SC1=S 2042449555 AMAXDZWZCSHIBJ-UHFFFAOYSA-N 447.607 4.292 10 10 IICE CC(C)(C)OC(=O)N1CC([C@H](F)CNCc2cc(Cl)cc(Br)c2O)C1 2050103269 FHNCPAIGDWJJGH-CQSZACIVSA-N 437.737 4.103 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@]1(CN)CCCN(Cc2ccccc2)C1 2074363267 CKJNJNTTWJKAEE-AREMUKBSSA-N 438.616 4.141 10 10 IICE Cc1cc(O)c([C@H](C(C)C)n2nc(C)c(C(=O)O)c2I)cc1C 2079928497 GYZAYJOELHNFSC-HNNXBMFYSA-N 428.270 4.062 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)C1=Cc1cc(OC)ccc1OC 2293188350 WTJWZOJBNPGHHG-UHFFFAOYSA-N 443.883 4.243 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352674828 ZTOFXESAYVEVHX-ZDUSSCGKSA-N 429.355 4.115 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc(OC)c1OC 59396941 BVPVUTXGBWJHIK-MFOYZWKCSA-N 446.506 4.335 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc(OC)c1OC 59397701 KBMMPAJGLUFOQG-MFOYZWKCSA-N 446.506 4.335 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccn(-c3c(F)cccc3F)n2)cc1 749364146 RJWHOJXQNVXEMI-IBGZPJMESA-N 440.494 4.038 10 10 IICE C[C@H](NCc1ccc(Cn2ccccc2=O)cc1)c1ccc(N2CCOCC2)cc1Cl 765386884 WPWZGGQYOACCLI-IBGZPJMESA-N 437.971 4.237 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC[C@H](C)NC(=O)OC(C)(C)C 765423707 GXFWUEGLNUMTAF-ZDUSSCGKSA-N 429.355 4.197 10 10 IICE Cc1cc(CCNC(=O)N2CCC([C@](C)(O)C(F)(F)F)CC2)c(C)n1-c1ccccc1 768180998 MUBMHHZFYGPFPT-QFIPXVFZSA-N 437.506 4.372 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccc(-c2ncco2)c1 768906160 LUFQTSUDYJTIFH-UHFFFAOYSA-N 431.540 4.195 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc(SC(F)F)nc2)c(C)n1-c1ccccc1 771193747 ITXXTLIHCDFALS-UHFFFAOYSA-N 444.507 4.101 10 10 IICE Oc1cccc([C@@H]2CN(Cc3cc(Br)cc(Br)c3O)CCO2)c1 775701324 RPIZUUVOKOKNDF-INIZCTEOSA-N 443.135 4.196 10 10 IICE Cc1nc([C@H]2CCCN2C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cs1 776173058 LNMJSSJLIHDXAI-HSZRJFAPSA-N 439.629 4.030 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cnccc3C(F)(F)F)n2)cc1[N+](=O)[O-] 785544048 PAKFZQVFXILLLH-UHFFFAOYSA-N 444.416 4.241 10 10 IICE CC(C)(C)C(=O)NCc1ccc(Cl)c(C(=O)NCCCSc2nccs2)c1 786159339 OPJDYMMJYMKBBE-UHFFFAOYSA-N 426.007 4.371 10 10 IICE CN(C)c1ccc(CNC2CCN(C(=O)CCc3ccccc3)CC2)c(C(F)(F)F)c1 792917422 HLEOKEQIKFXZMW-UHFFFAOYSA-N 433.518 4.485 10 10 IICE Cc1onc(-c2cccnc2)c1C(=O)N1C[C@H](NC(=O)OC(C)(C)C)Cc2ccccc21 1129851827 CFJOAUHCGTWXTA-GOSISDBHSA-N 434.496 4.141 10 10 IICE COCC(C)(C)N1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CC1 1142655716 UCGCMNIDHSNNOS-UHFFFAOYSA-N 448.405 4.039 10 10 IICE O=C(NCc1c(O)cccc1O)c1cccnc1Oc1ccc(F)cc1Br 1156880839 DCJRHZYSYLEHQO-UHFFFAOYSA-N 433.233 4.117 10 10 IICE COC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1160646133 MYHHHWBNMZJPBL-SCTDSRPQSA-N 434.458 4.497 10 10 IICE COc1ccc(-c2nc(NC(=O)CN3CCOc4cc(N(C)C)ccc43)sc2C)cc1 1168858969 HZIWRLHBRYDEAS-UHFFFAOYSA-N 438.553 4.031 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N[C@@H](C)c2ccccc2O)sc2c1CC[C@@H](C)C2 1175419248 UJTKOMOQWSCXNV-ILXRZTDVSA-N 430.570 4.433 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCNC(=O)[C@@H]3c3cccs3)cc2Cl)C1 1227207234 FACSRQKZKPQBPX-YWZLYKJASA-N 447.004 4.021 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(CCc3ccc(O)cc3)CC2)N(C)C)cc1 1256232889 WRRBVXQDTKWUNS-RUZDIDTESA-N 438.616 4.115 10 10 IICE CCc1noc(COCC(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)n1 1264383522 UEJUPZNUWSIQGV-UHFFFAOYSA-N 443.525 4.389 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1289602291 ODMBHYKOBQGGTH-FQEVSTJZSA-N 426.561 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccoc2)cc1 1295420094 LSRQUPCTBWGKKZ-UHFFFAOYSA-N 430.556 4.388 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC=CCC1 1299205633 WJEMIXXGTYIAIJ-NRFANRHFSA-N 446.599 4.281 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)CCO1 1306618058 VIHQTDASBLWNFM-NRFANRHFSA-N 437.588 4.129 10 10 IICE O=[N+]([O-])c1c(Br)cccc1NCc1cc(F)c(N2CCOCC2)c(F)c1 1307137665 DZQUJJHACGVCJA-UHFFFAOYSA-N 428.233 4.084 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@H](C(=O)OC)Oc2ccccc21 1349686228 SHXABHCWOYRKCA-OTDUKCBNSA-N 432.476 4.004 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(C)c3C)C2)sc2c1CCCC2 1351238345 CVNIXMFIMJSRFS-OAHLLOKOSA-N 426.538 4.022 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)CCn4cnccc4=O)n3)c2C)cc1 1352326409 BSUVQKVTZUAJFN-UHFFFAOYSA-N 433.537 4.112 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnc(Br)c(Br)c2)cc1 1355015452 NQECAKOKMOCFBT-UHFFFAOYSA-N 441.167 4.383 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(C(=O)Nc3ccccc3)c2)N(C)C)cc1 1439962167 VWXFZDTYFMUWKN-DEOSSOPVSA-N 430.552 4.038 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](c3cccc(C)c3)C(C)(C)C)CC2)cc1 1442056046 ULFXXFOUGZCPQB-SLIGWNDSSA-N 449.595 4.112 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)cc1F 1443767739 GWUGSUYKWQYTRG-CJLVFECKSA-N 435.499 4.352 10 10 IICE CO[C@@H](C)c1nsc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1457823659 UMRYUWUXUPTXET-NSHDSACASA-N 436.335 4.063 10 10 IICE C[C@@H](CN(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nccs1 1458215976 ODGACMWIUJNAHQ-RERGGYADSA-N 449.598 4.136 10 10 IICE COc1ccccc1-n1cnnc1SCC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C 1458846571 PQKILYLSKQJWNJ-UHFFFAOYSA-N 437.500 4.193 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 1464702010 FZGLSLSZXYLXPF-LAUBAEHRSA-N 433.593 4.110 10 10 IICE Cc1cc(CCNC(=O)N[C@H](c2ccccc2)c2cnn(C)c2)c(C)n1-c1ccccc1 1469764903 SSPGYULSSYVQTF-RUZDIDTESA-N 427.552 4.459 10 10 IICE C[C@@H]1Cc2ccccc2CN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1514830796 WQKCPMFDMQNNGR-CTFRJJSNSA-N 440.565 4.390 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@]3(CCCOC3)C2)cc1 1515532595 RPXBWRRBEVOTLD-RUZDIDTESA-N 425.621 4.378 10 10 IICE CCN1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C[C@H]1C 1515912444 HNPCLUDNMCGURY-QGZVFWFLSA-N 428.631 4.114 10 10 IICE CCSCC[C@H](C)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1523498323 LUJOOTJQJPESDD-DLRWLJPMSA-N 440.631 4.407 10 10 IICE CC[C@@H](CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)CC(F)(F)F 1529164485 KUVMGELAKUGBQX-LLVKDONJSA-N 434.370 4.079 10 10 IICE Cc1cc(CNC(=O)[C@H]2CO[C@@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1535142455 BILBLVGQJWMVBA-IRLDBZIGSA-N 426.557 4.237 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccc(-c4noc(CC(C)(C)C)n4)c3)cc2)CC1 1536933624 MPAWBQBCNBUDRA-UHFFFAOYSA-N 447.583 4.007 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1538138580 UNOQJQLCIJYEIU-UHFFFAOYSA-N 447.501 4.001 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccccc3CNC(=O)OC(C)(C)C)c2)CC1 1539247587 XSTOEUGXKKCVHB-UHFFFAOYSA-N 438.572 4.106 10 10 IICE CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)C1 1542476856 QXMYAGINQZWLKQ-OAQYLSRUSA-N 437.584 4.455 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)NC(=O)CC3)c(C)n1-c1ccc(Br)cn1 1543478473 JKXPCSNKBAWJDI-UHFFFAOYSA-N 439.313 4.389 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1544740697 UWHZSBSEQUMZOX-HUUCEWRRSA-N 428.943 4.339 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C(C)C 1547310766 FOAJZMINYLMGCJ-HSZRJFAPSA-N 448.615 4.456 10 10 IICE CCOCc1nnc(N(C)OC2CCCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1548092812 HDUILDUZSJYQBC-UHFFFAOYSA-N 427.593 4.410 10 10 IICE Cc1ccc(C(=O)N2CCN(c3nc(C)c(C)s3)CC2)cc1-n1c(C)cc(C=O)c1C 1556054922 VCWIMZQFYMWYDP-UHFFFAOYSA-N 436.581 4.251 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H](CN(C)CC)C2)sc(C)c1-c1ccccc1 1559581649 NGNXUXKGMCNPKH-SFHVURJKSA-N 443.613 4.112 10 10 IICE CC(C)Oc1cc(Cl)ccc1CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1565287618 JIMPIKXAOOYFES-OAQYLSRUSA-N 432.996 4.295 10 10 IICE COc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(OCCC(C)C)c1 1566346839 NXQVVMYPGUZNJG-UHFFFAOYSA-N 430.520 4.230 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccccc2S(N)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1569589865 CJSVSFZPLBOQPH-UHFFFAOYSA-N 439.581 4.137 10 10 IICE C[C@@H](NC(=O)[C@@H]1[C@@H](NC(=O)OCc2ccccc2)[C@H]2C=C[C@H]1C2)c1ccc(N(C)C)cc1 1585422785 CQESRGJEFZPJHY-LHAKMFHHSA-N 433.552 4.047 10 10 IICE Cc1noc(C)c1CCC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1585834971 ZHDJLQGGUPKTJE-UHFFFAOYSA-N 440.301 4.335 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2C)c1 1596471496 FPBGLKFJNPJEAC-QFIPXVFZSA-N 444.579 4.034 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1 1596733605 VMKWCZIRRSSYPF-VQTJNVASSA-N 434.458 4.436 10 10 IICE CN(CCOC(C)(C)C)c1nnc(C2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1618319848 JCONCCAYJQNHPK-UHFFFAOYSA-N 443.661 4.398 10 10 IICE COC(=O)CC[C@H](Cc1ccccc1)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1624497393 JJRIEIXYSSQFSX-HSZRJFAPSA-N 432.520 4.201 10 10 IICE Cc1noc(COc2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc2)n1 1628043050 RBZJOWRMRQHOHH-UHFFFAOYSA-N 430.464 4.429 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(OCCCN(C)C)cc2)cc1 1628678639 RUTWRDJERQPVKJ-UHFFFAOYSA-N 433.552 4.418 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CN(Cc4ccccc4)CC[C@H]3CO)c2C)c1 1631430507 VBTAYWFAEMYNTC-RPLLCQBOSA-N 445.607 4.324 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1C 1634974352 PQLWSFOHJUDILV-UHFFFAOYSA-N 444.579 4.034 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(F)(F)c1cc(F)cc(F)c1 1635947256 SMQWJDQWFYGBHY-KRWDZBQOSA-N 430.829 4.196 10 10 IICE CCOC(=O)CS[C@@H](CNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1636347382 RKHQGOKXMOLHDQ-SFHVURJKSA-N 442.503 4.360 10 10 IICE CCOC(=O)c1nc(N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1Br 1642154188 PDAGOWUOYZANGS-AWEZNQCLSA-N 434.334 4.031 10 10 IICE CCCO[C@H]1CCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1644583054 AHTZPFHPEAGZTK-MSOLQXFVSA-N 434.536 4.070 10 10 IICE CCCO[C@H]1CCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1644583056 AHTZPFHPEAGZTK-ROUUACIJSA-N 434.536 4.070 10 10 IICE COc1ccc(N2CCN(CCCNc3ccnc(CSc4ccccc4)n3)CC2)cc1 1649447045 QNQLSXPEIFINNN-UHFFFAOYSA-N 449.624 4.402 10 10 IICE CCC1(CC)CCN(c2nnc(C(=O)NC(C)C)n2CCCSc2nccs2)C1 1649595151 OWDGCHAKKWFXAF-UHFFFAOYSA-N 436.651 4.072 10 10 IICE C[C@@H](c1nc2ccccc2s1)N(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684607440 PXBGSODQYGOISO-OXJNMPFZSA-N 425.602 4.368 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@@H]2CCC(=O)OC(C)(C)C)N(C)C)cc1 1684612106 NOHOGMAZVMDLEQ-FGZHOGPDSA-N 446.636 4.041 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1696558188 LGHXBTYUPUWMNZ-WMZOPIPTSA-N 435.613 4.003 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1708314239 IJUWHQFPSYCYFO-QHCPKHFHSA-N 425.602 4.067 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCOC(C)(C)[C@H]1C 1724234914 KZJANSORHPHTPE-LJQANCHMSA-N 425.621 4.437 10 10 IICE CC(C)(C)CCN1CCN(c2nnc(CC3CC3)n2CCCSc2nccs2)CC1 1750482193 URIWWGXOSKYZTQ-UHFFFAOYSA-N 448.706 4.428 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1761348605 FLVJEAYPVHFPPX-QGZVFWFLSA-N 441.551 4.390 10 10 IICE CC[C@@]1(C)CC[C@@H](Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)O1 1762426333 LRGSUYCNKCPNOA-CYFREDJKSA-N 445.583 4.224 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(F)F)c(C(=O)O)c2I)c(O)c1 2079050398 RQXWDULBUKHQAK-CYBMUJFWSA-N 448.207 4.137 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@@H](NCc1cc(Br)ccc1O)C2 2232281994 NPXSFUXFGZVIHC-STECZYCISA-N 425.367 4.326 10 10 IICE CC[C@H](C)NCc1ccc(N(C)C[C@@H](O)COCc2ccccc2)c(Br)c1 2239998884 IIYVCRKNQZDOTM-FXAWDEMLSA-N 435.406 4.351 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NC=C2C(=O)N(c3cccc(Cl)c3)N=C2C)cc1 2296645884 VYYKNQNHPUJGEN-UHFFFAOYSA-N 446.960 4.089 10 10 IICE CN(C)c1ccc(/C=C(/NC(=O)c2ccccc2F)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 1516008 CTRXAIHBNJLVQK-HYARGMPZSA-N 448.454 4.210 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472272 QLJBGIYWAKSRKB-DQVRNGEASA-N 427.526 4.498 10 10 IICE CCc1ccccc1N1C(=O)/C(=C\c2ccc(OC)c(OC)c2C(=O)O)SC1=S 16906179 VVZQXGCGMGOPTE-LFIBNONCSA-N 429.519 4.370 10 10 IICE N=C1/C(=C\c2ccc(SCc3ccco3)o2)C(=O)N=C2SC(C(F)(F)F)=NN12 20239013 NCFAYPYDISOJDT-DLMCZINNSA-N 426.401 4.346 10 10 IICE O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(S(=O)(=O)N3CCCC3)cc2[C@@H]2C=CC[C@H]21 20713129 OTHDFLUDLDVQNY-DRSNIGMVSA-N 425.510 4.206 10 10 IICE CCOC(=O)c1cnc2c(c(C)nn2C)c1N1CC=C(c2c[nH]c3ccc(OC)cc23)CC1 302126418 WKWOLJLAXKSLBF-UHFFFAOYSA-N 445.523 4.237 10 10 IICE Cc1cn2cc(NC(=O)CCCN3C(=O)/C(=C/c4cccs4)SC3=S)ccc2n1 726948489 VHXUFPYXSBKJKJ-YBEGLDIGSA-N 442.591 4.324 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3cccc4ncccc34)n2)c1 727246778 PZWUJIPRKRUEDH-UHFFFAOYSA-N 427.507 4.176 10 10 IICE C[C@H]1CN(c2ccc(CN[C@@H](C)c3cc(Br)c(F)cc3O)cn2)C[C@@H](C)O1 756419563 VMQQSZZYLJQKFU-MJBXVCDLSA-N 438.341 4.153 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 765757707 UDFLIINBTVOUSB-HNNXBMFYSA-N 432.362 4.278 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cnn(Cc2ccccc2)c1 773146113 OKOBFESHRSVIJP-QFIPXVFZSA-N 429.612 4.314 10 10 IICE Cc1cc(NC(=O)C(=O)N(Cc2ccccc2O)C2CCCCC2)n(-c2ccccc2C)n1 782895649 BLJCHHJMEDNZCC-UHFFFAOYSA-N 446.551 4.495 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC(C)(C)O[C@]4(CCOC4)C3)cc2Cl)C1 799994577 RJAAMIQPRZLGGJ-GAJHUEQPSA-N 435.996 4.056 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCOC2)CC[C@H]1C 802761102 KDTYFKKMUQJEKV-UTSGNWPNSA-N 449.599 4.250 10 10 IICE O=C(NCc1cc(Br)ccc1O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 805099870 NWPUDAIMVMQAPE-IHWFROFDSA-N 444.373 4.150 10 10 IICE CN1CC[C@@H](NC(=O)NCc2cc(Br)ccc2O)[C@H]1c1ccc(Cl)cc1 805239746 PDCMDAUECQRUQG-SJLPKXTDSA-N 438.753 4.053 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cccc(C(=O)N2CCCCC2)c1 806220961 VFFOQBRQIMJZGO-UHFFFAOYSA-N 432.318 4.103 10 10 IICE Cc1cc(C(=O)COC(=O)CCc2nc(-c3ccccn3)no2)c(C)n1-c1ccc(F)cc1 915396847 FKZRSQMGSUEKQK-UHFFFAOYSA-N 448.454 4.037 10 10 IICE Cc1ccc(/C=C\C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Br)c1 920881889 SQSLFMPXJIVRNU-CGQZWFTASA-N 429.358 4.485 10 10 IICE CC[C@@H](NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2)C(=O)NC 1129926297 ZWURRVQULXVJNB-WTYVIMSDSA-N 442.563 4.042 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@](C)(Cc2ccccc2)[C@H](C)O)C1 1140089259 LOIVFHOELDKYJM-RBTNQOKQSA-N 447.623 4.154 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccccc1O)c1ccc(Br)cc1 1146613587 YSKYCTRRICKQCJ-KRWDZBQOSA-N 435.318 4.037 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCCCn3cc(Br)cn3)c2C)cc1 1156838580 HQXCBWCDYMEQCR-UHFFFAOYSA-N 445.361 4.272 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@@H](CCCc4ccccc4)C3)cc2)CC1 1246301414 GHENCICROYTWPK-RUZDIDTESA-N 434.628 4.383 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1c[nH]c2ccc(F)cc12 1297228140 BALMRJJNRVXRDL-UHFFFAOYSA-N 425.504 4.238 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1 1298839835 VGFYPOJVILWISI-CYBMUJFWSA-N 427.715 4.017 10 10 IICE C[C@@H]1C[C@@H]1c1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n[nH]1 1299911229 RKQFNXAJROYEQT-QRTYOACDSA-N 432.596 4.215 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1305483911 YLDVNUOZCLHNAD-IEBWSBKVSA-N 439.583 4.163 10 10 IICE COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1308061127 FCFIASSNHVYSFG-IRXDYDNUSA-N 442.515 4.457 10 10 IICE CC(C)c1ccc2c(c1)CCN(C(=O)NCc1cc(F)c(N3CCOCC3)c(F)c1)C2 1312833278 HSFQMZCUJRTSRV-UHFFFAOYSA-N 429.511 4.193 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(OC[C@@H]4CCOC4)CC3)c2C)c1 1313133823 WOEOZIDQZZTWQO-OAQYLSRUSA-N 425.573 4.130 10 10 IICE CCO[C@H](CCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1314061150 VAJIRFLFHFROKI-JTHBVZDNSA-N 442.604 4.500 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1)C(C)C 1315189978 UQSSSHPOLKFOHB-QFIPXVFZSA-N 437.588 4.249 10 10 IICE COc1ccc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c(OCCOC(C)C)c1 1352614649 HTBGPWKLTRFVIP-UHFFFAOYSA-N 426.557 4.371 10 10 IICE Cc1cc(C(=O)N2CCOCC2)ccc1N(C)C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1355477213 ALCGIRIBBJDNFF-UHFFFAOYSA-N 445.563 4.080 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)Cc1ccc(OCCOc2ccccc2)cc1 1435285198 CHPSDBVUYKNBNU-UHFFFAOYSA-N 432.520 4.179 10 10 IICE COc1ccc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)c(OCCC(C)C)c1 1438186220 QHWCWHMJOBIGCN-UHFFFAOYSA-N 442.556 4.100 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)[C@H]1Oc1ccccc1 1448160108 KMMPOMOFKUDSED-QLBJFCOMSA-N 432.520 4.261 10 10 IICE C[C@@H](NC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1)c1ccc(N(C)C)cc1 1459175895 AGIQZNSGCQMRRV-VFNWGFHPSA-N 436.383 4.310 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCCC12CCN(C(=O)/C=C/c1ccc(O)c(O)c1)CC2 1472410085 YZFVCVJWTYVKTH-PDFOZTTASA-N 430.545 4.045 10 10 IICE CCCCc1nnc(NC(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)s1 1473225045 ISJXKIHIBMBKMS-UHFFFAOYSA-N 444.582 4.359 10 10 IICE CN(CC1CC(F)C1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1517200394 AOPZZXMGUAGIAC-UHFFFAOYSA-N 447.574 4.075 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Oc1ccc2c(c1)CCCO2 1524344786 FUIBHUHWRXCXHB-UNOMPAQXSA-N 443.521 4.348 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)cc2Cl)C1 1524702700 CLMGGUOVFGGIOM-WIYYLYMNSA-N 439.987 4.241 10 10 IICE CSCC1CCC(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1 1526737329 XGZOPMNNOBRQNM-UHFFFAOYSA-N 438.505 4.022 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3c(Cl)cc(Cl)cc3Cl)cc2)C1 1534540841 RKTBTMSNZAJAFK-CYBMUJFWSA-N 440.758 4.279 10 10 IICE CSCC[C@@H](C)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1538625511 GABAFCRJFOJRND-MLDYKZIASA-N 426.604 4.017 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1540518669 XMGBPFMXRVOLNR-FQEVSTJZSA-N 433.499 4.255 10 10 IICE CC(C)Cc1nnc(N2CCOC(C)(C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1541479377 YQJPHOBKDSKGHX-LJQANCHMSA-N 443.661 4.082 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Nc4cccnc4)cc3)cc2F)CC1 1543070226 HVWYGNIKPNRQET-UHFFFAOYSA-N 433.531 4.036 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc3c(s2)CCN(C(=O)OC(C)(C)C)C3)c1 1545684212 NXJGGOJKCUXVSD-ZDUSSCGKSA-N 432.542 4.247 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1N[C@H]1CCc2ncc(Br)n2C1 1559300773 CYEBJXRZXCHBON-AWEZNQCLSA-N 441.285 4.212 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1564945419 BBAMBRCAEMBPKG-JYMRHQFYSA-N 444.620 4.223 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(C(=O)N2CCOCC2)cc1 1566845756 IABJUTPLCMXKQQ-HXUWFJFHSA-N 444.531 4.268 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1OCc1cccs1 1583378296 BOYVNDZTGMLRMR-UHFFFAOYSA-N 444.503 4.372 10 10 IICE Cc1cc(CCNC(=O)CCCOc2ccc3c(c2)NC(=O)CC3)c(C)n1-c1ccccc1 1587465623 SJPNENZZTAADEU-UHFFFAOYSA-N 445.563 4.497 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1612629315 HLEXQFPUCUXSOT-UHFFFAOYSA-N 441.586 4.220 10 10 IICE CC[C@@H](C)N(C)CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1613418248 SAMXWPGZQHHNIX-SYYKKAFVSA-N 443.636 4.269 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1614266495 MHBXROHVFIUDSY-VLCRHTCISA-N 427.593 4.028 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CSc2cccc(Br)c2)N(C)C)cc1 1618641617 BYTVYMIXDAGCMR-IBGZPJMESA-N 436.419 4.026 10 10 IICE CC(C)(C)OC(=O)N1CCCc2cc(CNC(=O)c3ccc(N=NC(N)=O)cc3)ccc21 1625063904 NELDWKSMHFCBBA-UHFFFAOYSA-N 437.500 4.467 10 10 IICE Cc1ccc(C)c(C2=NO[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)C2)c1 1626106351 NYDTZGQHNWLHPJ-DHLKQENFSA-N 435.568 4.070 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)NCc3ccc(N4CCCCC4)cc3)CCC[C@H]12 1630698289 RFUBASZRWLWVML-SQJMNOBHSA-N 427.589 4.473 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@](C)(O)c1cccc(C(F)(F)F)c1 1631166492 HVARBGOMBTVFHE-GOSISDBHSA-N 446.263 4.430 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCC(=O)NCc2cccc(Br)c2O)C1 1634724808 JJOWPLHLZGPZTI-AWEZNQCLSA-N 441.366 4.198 10 10 IICE O=C(Nc1cc(F)c(O)cc1Cl)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1646002485 AOVMLKBWKZYEFL-UHFFFAOYSA-N 442.877 4.005 10 10 IICE CCOC(=O)CN(CCC(=O)Nc1ccccc1-c1ccccc1)Cc1ccccc1O 1646326478 LYMNZYUHBOJPEO-UHFFFAOYSA-N 432.520 4.453 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)CCc3nccc(C(F)(F)F)n3)c2C)cc1 1653453979 FYPGTANYRIZJHV-UHFFFAOYSA-N 432.446 4.226 10 10 IICE CC(=O)N1CC[C@H](C)c2ccc(S(=O)(=O)NCc3cc(Cl)cc(Cl)c3O)cc21 1655535916 PUQWRWIGRNZMDB-NSHDSACASA-N 443.352 4.038 10 10 IICE CN(Cc1cccc(OC(F)(F)F)c1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1676653416 NVXGVQBDYQSZRW-HXUWFJFHSA-N 438.494 4.096 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H]3C[C@H](c4cccc(C(F)(F)F)c4)C3)cc2)CC1 1682074705 APTTUZLSMSOFJA-XUTJKUGGSA-N 446.517 4.203 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)N(C)C)cc1 1685682286 XVTIKCFZFYDPLS-TZRRMPRUSA-N 442.579 4.056 10 10 IICE CS[C@@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1698381467 NXGGKFICTKUKBM-OAQYLSRUSA-N 443.661 4.182 10 10 IICE CCC[C@H](C)CN(C)c1nnc(C2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709473967 HAACAZFERBYVNW-IBGZPJMESA-N 425.621 4.285 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](Cc3cnn(C)c3)C2)n1CCCSc1nccs1 1726933160 SUBJWLRMCGDJFL-DLBZAZTESA-N 445.662 4.233 10 10 IICE CCC(CC)(Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1762136238 YAAIWFQTKATFRM-OAQYLSRUSA-N 441.620 4.224 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(=O)NC(C)C 1765324172 GTDBDLFZJWWLJD-XYOKQWHBSA-N 434.588 4.280 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CCC(N)=O)CC1 1766039608 GCYJSTAFGZVIMV-UHFFFAOYSA-N 434.588 4.245 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCN(C)C)C2=O)ccc1OCc1ccccc1 1858595630 FOSJBBMMAJHCPM-XSFVSMFZSA-N 428.579 4.037 10 10 IICE CCCCOCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCC)C1=O 1873169465 BJQGZOUSFFSCNN-UHFFFAOYSA-N 437.584 4.380 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1O 1951965049 WEAIBAMMRWBNEJ-VWLOTQADSA-N 449.459 4.032 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C3(C)CC3)c(C=O)c2I)c(O)c1 2079022019 BVRWKUUVTYXQFW-MRXNPFEDSA-N 436.293 4.365 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C3(C)CC3)c(C(=O)O)c2I)cc1C 2080009314 YYKXOZICTAOELK-NSHDSACASA-N 440.281 4.169 10 10 IICE NCc1cc(F)c(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1Br 2148931786 COCJEHATVQNEML-MJGOQNOKSA-N 432.381 4.395 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)c1ccc(I)c(Br)c1 2163067464 XBZZCRFJABRUBQ-MRXNPFEDSA-N 445.142 4.429 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)C(=Cc3ccc(F)cc3)SC2=S)cc1 2297258636 IHXKYZFXHUHUNR-UHFFFAOYSA-N 430.526 4.454 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(C(=O)OC)cc3)C2=O)ccc1OC 2321698502 ZRWYYQIFEFLRBB-UHFFFAOYSA-N 429.519 4.286 10 10 IICE Cc1ccc(CN[C@H](C)[C@H]2[C@H]3C[C@H]2N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352946236 HWMLRONLEDLISU-BVUBDWEXSA-N 425.367 4.197 10 10 IICE Cc1ccc(C2=NN3C(=N)/C(=C\c4cccc(Br)c4)C(=O)N=C3S2)cc1 3854639 DKXJWNFBMVZMHI-GDXBMZNVSA-N 425.311 4.425 10 10 IICE Cc1cc(C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)c(C)n1-c1ccccc1 32503540 NJNYNEKQTZZNGS-UHFFFAOYSA-N 425.554 4.423 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc3c(cc2F)CCC(=O)N3)C1 435619730 VXIBDMDYBBJMLT-UHFFFAOYSA-N 434.515 4.070 10 10 IICE COc1cc(OC)c(OC)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435915167 IPPPXLKZMFAYLI-UHFFFAOYSA-N 437.540 4.072 10 10 IICE CCCNC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 586705538 XDZWUGWPCFJQEI-UHFFFAOYSA-N 427.460 4.246 10 10 IICE COc1cc2c(cc1OC)CCN(C(=O)NCc1ccc(N3CCC(C)CC3)cc1)CC2 731048287 HFOSOUITJCFBJU-UHFFFAOYSA-N 437.584 4.251 10 10 IICE Cc1cc(C(=O)COC(=O)c2c(F)cc(F)cc2F)c(C)n1-c1ccc2c(c1)OCO2 745151681 PUKPLZLTYILYBL-UHFFFAOYSA-N 431.366 4.280 10 10 IICE CC(C)(C)OC(=O)c1ccc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 745904676 MJIPXQGCLATPMK-NRFANRHFSA-N 440.540 4.238 10 10 IICE COc1cc2c(cc1NCC(=O)Nc1cc(S(C)(=O)=O)ccc1F)oc1ccccc12 749606244 UZJBSRNGLQKBPR-UHFFFAOYSA-N 442.468 4.188 10 10 IICE COC(=O)c1cc2ccccc2c(CNC2(c3ccc(F)cc3F)CCOCC2)c1O 764135201 XZZSKEMTTAAXRG-UHFFFAOYSA-N 427.447 4.406 10 10 IICE CCOc1cc2c(cc1/C=C/C(=O)N1CCCN(c3ccc(OC)cc3)CC1)O[C@@H](C)C2 917821400 GQJBHNUVLXYAOB-NJGYHNCTSA-N 436.552 4.169 10 10 IICE CC(C)c1ccc(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1135291758 JKTQAULKQPUDRP-UHFFFAOYSA-N 444.578 4.350 10 10 IICE Cc1nn(C)c2ncc(NC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)cc12 1136085506 HDVIILOIMXGHEP-UHFFFAOYSA-N 439.317 4.094 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2CCNC3=O)c(C)n1-c1cccc(Br)c1 1142177013 VTBQPUWAPLPATE-UHFFFAOYSA-N 438.325 4.395 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc3c(c2)N(C)CCO3)cc1 1144711488 KNZNPEHHHJNLBV-UHFFFAOYSA-N 431.536 4.437 10 10 IICE C[C@@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 1154668779 LYAKDELDEYXIKR-JLTOFOAXSA-N 433.499 4.474 10 10 IICE CC[C@@H](Cc1ccccc1Br)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1167762560 OMQVUSSXKODASS-SFHVURJKSA-N 445.401 4.295 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(C(F)(F)F)cc(Cl)n3)cc2F)C[C@H](C)O1 1182412944 KERKDDXTXDZWET-RYUDHWBXSA-N 445.844 4.437 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](C)c3nc(-c4cc(C)ccn4)n[nH]3)c2C)c1 1254074476 QWVLXYPSCJCDRU-GOSISDBHSA-N 443.555 4.451 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3ccc(Cl)c(Cl)c3Cl)CC2)cc1 1260425573 NOQDZYHHRZNEEF-UHFFFAOYSA-N 435.760 4.166 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccco2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291446768 NOMLVJCAPSUWAM-QGZVFWFLSA-N 427.524 4.045 10 10 IICE CN(c1ccc(CNC(=O)c2ccc(CNC(=O)C(F)(F)F)o2)cc1)C1CCCCC1 1292259044 YPGKAGFMOQXSGQ-UHFFFAOYSA-N 437.462 4.157 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)Cc1cccc(F)c1 1292998014 XVMYYAAPKSUULF-SFHVURJKSA-N 426.463 4.134 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCN1Cc1ccc(F)cc1 1294162205 ZLJBIFRDVOFQDH-DENIHFKCSA-N 447.501 4.177 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CCC(C)CC2)cc1 1295418316 FWRKXPOKQPEXRA-UHFFFAOYSA-N 435.620 4.271 10 10 IICE CCOCc1nnc(N2CCCc3sccc3C2)n1Cc1ccc(N(C)C)cc1C 1297241034 HHLMMUFHBPOHBP-UHFFFAOYSA-N 425.602 4.252 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@H](O)c3cc(F)c(F)c(F)c3)c2C)c1 1313132732 OYZYRRAYJSBQOZ-OAQYLSRUSA-N 431.458 4.353 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)sc2c1CCCC2 1349146735 LWLMZWAFEWEOME-AWEZNQCLSA-N 446.956 4.054 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](OCC)[C@H]2CCOC2)sc(C)c1-c1ccc(F)cc1 1352684895 ZLRTWUIAVOPVJY-KXBFYZLASA-N 435.517 4.419 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1 1356036126 ASZAEYLEMLKIPE-GOSISDBHSA-N 435.337 4.235 10 10 IICE C[C@H](NC(=O)c1cc(-c2cccc(Cl)c2F)no1)c1ccc(N2CCOCC2)cc1 1357129414 RNAXVVLDGCFXCP-AWEZNQCLSA-N 429.879 4.462 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C(C)C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359798809 QHJKMYNNPLYKCK-QHCPKHFHSA-N 439.648 4.216 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CSCC(=O)N1CCCCC1 1446806349 QZJNHKWJCZBEIJ-IBGZPJMESA-N 426.582 4.228 10 10 IICE COc1cc(/C=C\C(=O)NCc2c(O)cccc2F)ccc1OCc1c(C)noc1C 1471976063 QHLUOPDJPXQKQB-NTMALXAHSA-N 426.444 4.053 10 10 IICE COc1ccc(N(Cc2nnc(C(=O)NCc3ccc(F)cc3)s2)CC2CC2)cc1 1473485932 OBCVIECQFQINFC-UHFFFAOYSA-N 426.517 4.032 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1499338263 UEVBQEIDTTVEOR-XLIONFOSSA-N 429.584 4.224 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(OC(F)F)c(F)c2)C1 1526711836 CLBNRTMSILJJSO-UHFFFAOYSA-N 445.485 4.465 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2CC(c3c(F)cccc3F)=NO2)cc1 1528645208 YYKQPMPELLZWGE-GOSISDBHSA-N 441.400 4.115 10 10 IICE CCOc1ccc(N2C[C@@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1530888851 DVDXVAPOZQONHX-QFIPXVFZSA-N 445.563 4.205 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)N(C)C)cc1 1539705694 HOQCMYKVPHFKPE-QFIPXVFZSA-N 449.599 4.424 10 10 IICE C[C@H](Cn1ccc2ccccc21)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1541097176 KOXJPUHOZDERCM-QGZVFWFLSA-N 445.485 4.449 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC[C@@H](C)N(C)C(=O)OC(C)(C)C)cc1 1543266040 XNPDGNDWZRFRMD-QGZVFWFLSA-N 441.572 4.211 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3cnc4c(c3=O)CCC4)c2C)ccc1Br 1559400464 FCYZOBKODVOEDC-UHFFFAOYSA-N 440.341 4.093 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCCc3ccccc3OCc3ccccc3)C2)cc1 1565056409 UIOAQDFRFIEPCR-QHCPKHFHSA-N 445.563 4.395 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1 1566305011 DWFUBZLPCVPBGC-UHFFFAOYSA-N 428.488 4.241 10 10 IICE CCc1cc(OCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1Cl 1566356806 OJIUJFXUHQEDCC-GOSISDBHSA-N 437.367 4.421 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@H]1CCCOC1 1583308285 LLDLZANNLRRLDD-NPVOPIMNSA-N 438.640 4.051 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)cc1F 1585698031 HMKNWANWZHIQTJ-UHFFFAOYSA-N 426.492 4.009 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC(c2nccn2C)c2nccn2C)cc1 1587643941 ZXRNYBCIHCEEKQ-UHFFFAOYSA-N 442.527 4.154 10 10 IICE Cc1ccc(C(=O)NCc2c(O)ccc3ccccc23)cc1S(=O)(=O)NC1CCCC1 1597737229 SPNTXFNBYASIAG-UHFFFAOYSA-N 438.549 4.005 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H](SC)C(C)(C)C 1613920941 DVQRLSOZGRWJGY-FQEVSTJZSA-N 431.650 4.091 10 10 IICE COC(=O)Cc1cc(=NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)c2ccccc2[nH]1 1615759356 FVHMMJOGMQRIAR-AREMUKBSSA-N 446.595 4.077 10 10 IICE CC1(C)CCC[C@@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)O1 1618441748 JNHAGZLVLTWESE-QXPQOBGOSA-N 438.640 4.193 10 10 IICE CSCC[C@H](C)N(C)c1nnc(CC2CC2)n1Cc1ccc(N2CCSCC2)cc1 1620266796 IWKYJGIYINPGAD-SFHVURJKSA-N 445.702 4.410 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1 1622664586 YPLZFAPRXGGAKX-QFIPXVFZSA-N 449.378 4.268 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)NCc2ccc(N3CCSCC3)cc2)C(C)(C)C1(C)C 1624892801 OZTLOLYMONNHOA-UHFFFAOYSA-N 432.630 4.250 10 10 IICE Cc1cc(C)c(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)s1 1628494002 BGPRAEOJBSENAJ-IBGZPJMESA-N 431.602 4.356 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3cccc(Cl)c3)C(=O)C2)c(C)n1-c1ccc(F)cc1 1630601769 ZVVPFUZJPZCSLS-UHFFFAOYSA-N 439.918 4.371 10 10 IICE CC(=O)c1ccc(CCNC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1632441561 IGQOOVMVBPHWNW-IBGZPJMESA-N 431.483 4.001 10 10 IICE CON(Cc1ccccc1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1632639667 WERUKCZKUARTGF-QGOAFFKASA-N 430.526 4.007 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)NCc2ccc(N(C)C)cc2C)[C@H]1c1ccc(OC)cc1 1633340149 CDHNYFGMFZREAS-UKILVPOCSA-N 437.584 4.076 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CSCCN2Cc2ccccc2)c1 1638504256 ZEZOUFATDSUROE-RUZDIDTESA-N 447.604 4.254 10 10 IICE COc1ccccc1Nc1nc2sc(C(=O)NCc3c(O)cccc3O)cc2s1 1639289321 NNXHGXKKTCZVPX-UHFFFAOYSA-N 427.507 4.451 10 10 IICE CCN(Cc1ccc(OC)cc1)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652299298 JKYGOFMYPUCLNJ-KRWDZBQOSA-N 442.515 4.320 10 10 IICE Cc1ccccc1CN(Cc1cccnc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1674711876 BLNXDRDPBMGUIK-UHFFFAOYSA-N 444.579 4.263 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCn3c(cc4cc(Cl)ccc43)C2)N(C)C)cc1 1685608800 HIGLBANDIWGETQ-HSZRJFAPSA-N 439.991 4.189 10 10 IICE COc1ccccc1[C@H]1CN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CCO1 1687219878 ZQEYRGHZGWSKRS-RUZDIDTESA-N 433.552 4.428 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)CCO1 1727821395 RHDBDVGJSHFTEX-QHCPKHFHSA-N 425.621 4.376 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cscn1 1729831596 QOMOHXPWSVQNIV-KRWDZBQOSA-N 436.585 4.480 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(CC)(CC)SC 1764914213 ZKTLYNJGTAUTRZ-UHFFFAOYSA-N 435.613 4.237 10 10 IICE CC[C@@H]1CCCN(c2nnc(C(=O)N3CCCC3)n2Cc2ccc(N(CC)CC)cc2)C1 1765106281 LQJHWTCSGBEWBT-HXUWFJFHSA-N 438.620 4.035 10 10 IICE CCN(c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1766502868 FQSRFLCOOISXMI-UHFFFAOYSA-N 429.584 4.270 10 10 IICE CCCOc1cn(CCC(C)C)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870656926 YESWVCCVCJAKLB-UHFFFAOYSA-N 427.589 4.014 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1O 2227747971 HWZLXLAAUUAAAL-OAHLLOKOSA-N 429.355 4.041 10 10 IICE CCCOc1ccc2ccccc2c1C=C1C(=O)NC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 2297350481 TYGVHYCUCBOMAL-UHFFFAOYSA-N 445.431 4.203 10 10 IICE O=C(O)CN1C(=CC=C2SC(=S)N(c3ccccc3)C2=O)Sc2ccccc21 2297360190 OUZFXLQMYQTECB-UHFFFAOYSA-N 426.544 4.474 10 10 IICE COc1ccc(C2=NN(c3ccccc3)C(=O)C2=C(C)NCc2ccc3c(c2)OCO3)cc1 2313682377 BFUFBPJMSFPHJZ-UHFFFAOYSA-N 441.487 4.239 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1)C(=O)O 2314930208 ZDSSTFZZRDGJEL-OAHLLOKOSA-N 443.502 4.063 10 10 IICE CN(C)c1ccc([C@@H](N)Cc2ccc(I)c(Br)c2)cc1 2377346312 YNHBMEKSOKGGKM-INIZCTEOSA-N 445.142 4.362 10 10 IICE Nc1ccc(CCC(=O)Cc2ccc(I)c(Br)c2)cc1 2377439937 QYXFUNSYVJWFMU-UHFFFAOYSA-N 444.110 4.380 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S)Nc1ccc(O)cc1 15044306 KIIJBLJMUPZPSB-RGEXLXHISA-N 442.562 4.498 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)ccc1C(=O)c1ccccc1 16247991 MVXDHYHRDQOJOX-HMAPJEAMSA-N 440.455 4.431 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1c[nH]c3ccccc13)N2 250520843 BMMHOFXNJOFTPA-IRSRUACTSA-N 449.576 4.452 10 10 IICE O=C(COc1ccc(Cl)c2cccnc12)N(Cc1ccccc1O)C[C@@H]1CCCO1 731856939 VSDNRDIRHPLSBJ-KRWDZBQOSA-N 426.900 4.180 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1 786764265 JSYYJIUDFYDCMZ-UHFFFAOYSA-N 429.590 4.029 10 10 IICE C[C@@H](Cn1ncc2ccccc21)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 790458025 AQCOZFAGTWFTDR-INIZCTEOSA-N 428.483 4.059 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)OCC(=O)N4)cc2Cl)C1 800526913 HCGFCKNHLWTHOI-AWEZNQCLSA-N 428.920 4.229 10 10 IICE CCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(Br)ccc1O 804735568 FJWFUSWOBCQNKZ-UHFFFAOYSA-N 425.304 4.495 10 10 IICE COc1ccc(NC(=O)NCc2cc(Br)ccc2O)c(Br)c1 806252578 WGLVTYJOMYVIIM-UHFFFAOYSA-N 430.096 4.248 10 10 IICE Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)c(C)c1 1084131159 CNNKBOHEGJQMGG-PDGQHHTCSA-N 431.404 4.138 10 10 IICE COC[C@@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(F)cc1 1122007712 HGKFYJHPZGURJE-FXAWDEMLSA-N 437.462 4.083 10 10 IICE CN(C)c1ccc(CNC(=O)c2nn(-c3ccc(Cl)c(F)c3)c3c2CCC3)cc1F 1125535457 VTLLSBMWTGFRON-UHFFFAOYSA-N 430.886 4.289 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C)[C@H](n3ccnc3)C2)c(C)n1-c1ccc(Br)cn1 1137483956 JWOQHMOFHXJFDT-IFXJQAMLSA-N 442.361 4.171 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)CCC[C@H]12 1151903582 ORDYTUQZNLBVHL-QYXIYQDXSA-N 444.572 4.080 10 10 IICE Cc1cc(CC(=O)N[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c(C)n1-c1ccc(Cl)cc1 1159989985 GMGVUZGECDTBEF-XVAYZXCPSA-N 443.975 4.272 10 10 IICE Oc1ccccc1CN(C[C@@H]1CCCO1)c1ncnc(C(F)(F)F)c1Br 1185839005 VPQAKGAEEPYXBQ-LBPRGKRZSA-N 432.240 4.149 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@](C)(O)c2ccc(F)c(Br)c2)cc1F 1293225612 YOBVJQNRVLQTML-FQEVSTJZSA-N 441.316 4.097 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)C(=O)NCC3)c(C)n1-c1ccc(Br)cc1 1298827883 RXJUTNUWUMVORQ-UHFFFAOYSA-N 438.325 4.395 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)CC[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1304750008 OETURABISCCLCB-AEFFLSMTSA-N 439.583 4.018 10 10 IICE O=C(N[C@@H](Cc1ccccc1)C1CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1443979030 OOYDYKDMZJAGSI-IBGZPJMESA-N 442.562 4.006 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)[C@H]1Oc1ccccc1 1448160105 KMMPOMOFKUDSED-ICDZXHCJSA-N 432.520 4.261 10 10 IICE COCCOC(=O)Nc1cccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1464430739 OSOQYVJUAMBMPK-UHFFFAOYSA-N 449.507 4.283 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(C/C=C/c3ccccc3)CC2)cc1 1465018427 XWPVKRDPSXDMEU-RMKNXTFCSA-N 441.575 4.307 10 10 IICE CC[C@](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)(C(=O)OC)c1ccccc1 1468942116 AECISZWEFKEHOH-AREMUKBSSA-N 434.536 4.354 10 10 IICE Cc1cn2ccc(NC(=O)CCCN3C(=O)/C(=C\c4cccs4)SC3=S)cc2n1 1470448670 RUYMRJNHTPZTFU-LFIBNONCSA-N 442.591 4.324 10 10 IICE Cc1cc(C(=O)N[C@H]2Cc3ccccc3NC2=O)c(C)n1-c1ccc(Br)cc1 1471012451 PMPZSJQQPDCNOL-FQEVSTJZSA-N 438.325 4.150 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 1478841170 QKLVXJAFTHALAZ-QFBILLFUSA-N 437.510 4.254 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CCO1 1497617359 ZFDJRYPEAXQQAO-HXUWFJFHSA-N 433.603 4.491 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CC4)n3C[C@H](SC)C(C)(C)C)CC2)cc1F 1518310909 NLMLGOFOXRCFNK-FQEVSTJZSA-N 447.624 4.408 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1CCC(F)(F)F 1524851532 WZLSVJUDMRNMMY-UHFFFAOYSA-N 428.401 4.226 10 10 IICE Cc1cc(CC(=O)Nc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)c(C)n1-c1ccccc1 1525154467 GIWKNPKJOMJOCY-LJQANCHMSA-N 442.523 4.067 10 10 IICE CCOC(=O)Cc1cccc(N(C)C(=O)c2cn(-c3ccccc3)nc2-c2cccnc2)c1 1540117554 UJWSVZIIJASAKV-UHFFFAOYSA-N 440.503 4.317 10 10 IICE Cc1ccc(C(=O)Nc2cc(Br)cnc2O)cc1-n1c(C)cc(C=O)c1C 1542347179 WDPZDMULBVHRAS-UHFFFAOYSA-N 428.286 4.330 10 10 IICE CC(=O)Nc1cccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1542605970 WAEAZQXMJOJOCG-UHFFFAOYSA-N 441.329 4.140 10 10 IICE Cc1cc(C(=O)NC[C@H](C)CC2(C)OCCO2)c(C)n1-c1ccc(Br)cc1 1544543701 WHYBHJKMUAHLBR-CQSZACIVSA-N 435.362 4.376 10 10 IICE Cc1cc(C(=O)N(C)CCn2cc(Br)cn2)c(C)n1-c1cccc(Cl)c1 1556904283 BKWAGCRDMJSKTD-UHFFFAOYSA-N 435.753 4.479 10 10 IICE Cc1cc(CC(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)n1-c1ccc(Cl)cc1 1557939151 QOTKTOZBTFWZJO-QHCPKHFHSA-N 441.915 4.222 10 10 IICE O=C(CN(Cc1ccccc1O)C1CCCC1)NCc1cccc(OCC(F)(F)F)c1 1559530051 KCAGRYVGFZXKCQ-UHFFFAOYSA-N 436.474 4.394 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCOC[C@H]2CC(=O)c2cccs2)c1 1566210985 SXDLPZCBFBBLHN-OAQYLSRUSA-N 436.533 4.082 10 10 IICE C[C@H](C1CC1)n1nccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1584821616 WBSZMXRDXYIEKH-LVLBFHFTSA-N 444.557 4.223 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(N(C)C(=O)OC(C)(C)C)CC1 1585513891 WREFVENCSNHQTM-UHFFFAOYSA-N 439.556 4.378 10 10 IICE CCc1ccc(Br)cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1586799949 KAWIMOKXHAXKSA-UHFFFAOYSA-N 431.374 4.150 10 10 IICE COc1ccc(CN2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)cc1F 1587280485 QHGSZZGJBLIPJU-UHFFFAOYSA-N 427.545 4.261 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2[C@@H]3CCCC[C@@H]3CCN2C(=O)OC(C)(C)C)c1 1595806528 NUSRYVNNJOUKOL-LZKITUNOSA-N 432.561 4.394 10 10 IICE Cc1cc(-c2nnc(N3CCC(C)CC3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1611935672 VDVYHJDPPZPESS-UHFFFAOYSA-N 448.615 4.361 10 10 IICE C[C@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1612945202 YVJIGIYFLCZRIQ-IEBWSBKVSA-N 429.584 4.298 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(CCOC)CCCC1 1614011638 BEXSDTODJMDWJP-UHFFFAOYSA-N 441.620 4.163 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2cc(Br)ccc2F)N(C)C)cc1 1618641480 AYMVEKZXHKNXNQ-HXUWFJFHSA-N 436.369 4.006 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CCCOC(F)F)CC2)cc1 1619301653 SOALPXKNQYIMTN-UHFFFAOYSA-N 449.546 4.290 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)s1 1627007020 ONYWAVWNJNJEAC-HOTGVXAUSA-N 439.585 4.210 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1632040585 VZHSOIXFQAANCD-HNNXBMFYSA-N 434.458 4.421 10 10 IICE COc1ccccc1O[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 1636262471 HIQKFSLFNJOKBV-UGKGYDQZSA-N 425.573 4.254 10 10 IICE Cc1cc(CNC(=O)[C@H](Cc2ccncc2)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1648611787 PEEUHHPNHABRNX-QHCPKHFHSA-N 448.567 4.241 10 10 IICE CCc1ccc(CNC(=O)CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)s1 1652477059 XJKRFPZIYAUDKR-UHFFFAOYSA-N 443.613 4.404 10 10 IICE C[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccc(C2CC2)c1 1653716444 LKSJTHRMNOPOLQ-QRVBRYPASA-N 439.575 4.284 10 10 IICE COCCn1cc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)cn1 1654197683 CLKFYWDZGSPCDY-UHFFFAOYSA-N 439.516 4.452 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(c2=O)CCCC3)c(C)n1-c1cccc(Br)c1 1656423259 HUCXAPODCINSJH-UHFFFAOYSA-N 440.341 4.175 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)cc1F 1657763983 ZCXMLTGQQITABT-RTBURBONSA-N 439.575 4.101 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC)[C@H]2CCCOC2)sc(C)c1-c1ccccc1 1659281520 ZKJIAYAJYNMHAN-SFHVURJKSA-N 430.570 4.340 10 10 IICE CN(C)c1ccc(C2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CC2)cc1 1685681190 BUVDSZDSJUNNJJ-RUZDIDTESA-N 437.632 4.011 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1730479536 JCVHGLRQFCEWOJ-QUCCMNQESA-N 443.592 4.279 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@@H](C)O1 1745029928 GSVNYSJSFPDSDG-NQIIRXRSSA-N 425.621 4.301 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1745231892 VZWCKEAEDBOVNA-SFHVURJKSA-N 436.604 4.456 10 10 IICE CCO[C@@]1(c2nnc(N3CCC[C@@H](C)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1746714899 LZADUKCCYVIYED-NLFFAJNJSA-N 441.620 4.061 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1F 1747572907 QYPWIUDNRVSNIF-OAQYLSRUSA-N 429.584 4.440 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3CCc3csc(C(C)C)n3)CC2)cc1 1748848053 RUFLHKPJGSUOJS-UHFFFAOYSA-N 440.617 4.134 10 10 IICE Cc1c(CN(C)c2nnc(CC3CCCC3)n2CCCSc2nccs2)cnn1C 1761625333 ISAQIQFXBQMXLV-UHFFFAOYSA-N 445.662 4.328 10 10 IICE CCOc1ncccc1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)OC 1766099577 XBTFQBGWUSTUPJ-UHFFFAOYSA-N 432.528 4.192 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3cc(C)ccc3C)sc2CCC(=O)O)cc1 1858034923 KEPMJSSLKWRCRZ-UHFFFAOYSA-N 446.550 4.254 10 10 IICE CC(=O)NCCn1cc(OCC(C)C)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1870858724 DICDTJQRWYYZQQ-UHFFFAOYSA-N 448.567 4.375 10 10 IICE CCCCCN1C(=O)C(NC[C@H]2CCCO2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873166622 UABJBAMOKNDSSF-JOCHJYFZSA-N 435.568 4.133 10 10 IICE CC(C)(c1cccc(O)c1O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1952542427 CRHBVBRKXDQSMO-QHCPKHFHSA-N 447.487 4.367 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2060638821 BFPASTKVMLJIHM-WMZHIEFXSA-N 443.548 4.132 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C(C)(C)C)c(N)c2I)c(O)c1 2079848801 NHWHYRZALRNRIR-HNNXBMFYSA-N 443.329 4.327 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C3CC3)c(C=O)c2I)cc1C 2079977538 NNJOBKNEIFQBFQ-SFHVURJKSA-N 436.293 4.499 10 10 IICE Cc1ccc(CNC2(CNC(=O)OC(C)(C)C)CCN(Cc3ccccc3)CC2)c(O)c1 2084074846 DTOLFLXMJBUYCK-UHFFFAOYSA-N 439.600 4.350 10 10 IICE CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1OC)c1cc(Br)ccc1O 2146729548 XMPFRXZKUKWLNR-BQFCYCMXSA-N 443.382 4.220 10 10 IICE Cc1ccc(OCCOc2ccc([N+](=O)[O-])cc2C=C2SC(=S)N(C)C2=O)cc1 2293692850 PFCZEBYMOXDDCT-UHFFFAOYSA-N 430.507 4.192 10 10 IICE COc1cc(C=C2SC(=S)N(CNc3ccc(C)cc3)C2=O)cc(OC)c1OC 2313503070 JUZUXAMNYQZECN-UHFFFAOYSA-N 430.551 4.292 10 10 IICE Cc1cccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)c1 2314837230 PULZERKSZUACNX-ZDUSSCGKSA-N 427.507 4.132 10 10 IICE COc1ccc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccc(F)cc3)C2=O)cc1OC 2314837653 VKGVLGSPKWUAHA-LBPRGKRZSA-N 446.525 4.071 10 10 IICE Cc1ccc(CNc2cc(F)cc(CNC(=O)C(F)(F)F)c2)c(O)c1Br 2381132443 AWFKMELWAZGOCO-UHFFFAOYSA-N 435.215 4.393 10 10 IICE COc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@H]32)cc1O 14457114 BYWVLKLBRPAYHT-XLNZFTOWSA-N 440.565 4.402 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1cc(Br)ccc1F 16134735 RKILXVYHMJEKGN-RUDMXATFSA-N 433.321 4.097 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)/C1=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 33424205 CTEQJPXSFBXNJX-LFIBNONCSA-N 443.843 4.303 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)COc2ccc(C=O)cc2)cc1 72413061 ORJLSNWEAVYKMY-VWLOTQADSA-N 427.504 4.322 10 10 IICE COc1ccc(/C=C2/SC(=S)N(C)C2=O)cc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 103374861 QBKJABCLAWJBHF-LZYBPNLTSA-N 447.450 4.135 10 10 IICE Cc1cc(CCNC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)c(C)n1-c1ccccc1 729306021 GINRZESGETXCOA-GOSISDBHSA-N 442.556 4.144 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(-c4csc(C)n4)cc3)CC2)cc1F 753931899 XFBIYTUWCCIYPZ-UHFFFAOYSA-N 440.544 4.298 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(F)c1F 768742201 ZXZBTACOJJCJIT-KRWDZBQOSA-N 428.527 4.057 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1c[nH]cc1-c1ccc(F)cc1 768912109 WRBQGTDAPIFYCH-UHFFFAOYSA-N 432.543 4.283 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cnc4ccccc4c3)n2)cc1OC 800925716 WJSHXSHKGJDHRF-UHFFFAOYSA-N 427.507 4.176 10 10 IICE CCc1ccc(-c2noc([C@@H](C)NC(=O)NCc3cc(Br)ccc3O)n2)cc1 805203912 YUZBAMRNCPHAPM-GFCCVEGCSA-N 445.317 4.328 10 10 IICE C[C@@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccc(-n2cccn2)cc1 807753548 CRSHDRMRLXMIEV-LJQANCHMSA-N 446.551 4.117 10 10 IICE CN(Cc1ccccc1O)c1nnc(CN2CCCc3ccccc32)n1C[C@H]1CCCCO1 812433251 JEZIOHGXKUXXAJ-JOCHJYFZSA-N 447.583 4.142 10 10 IICE O=C(C[C@@H]1CSc2ccccc2O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1125878420 SELWBVZZYTUBMN-GOSISDBHSA-N 434.508 4.316 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCO[C@@H](CNC(=O)OC(C)(C)C)C3)c2C)c1 1138305854 XPHLZAFCPZJEHK-NRFANRHFSA-N 441.572 4.077 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cccc(C(=O)N4CCCCC4)c3)c2)CC1 1153552932 RPZPBYMYZDVCJK-UHFFFAOYSA-N 434.584 4.095 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCN(Cc4ccccc4)C3=O)cc2Cl)C1 1155727404 RBDUPZGMQZCUJR-RXVVDRJESA-N 439.987 4.241 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(Cc3nc(C(C)C)n[nH]3)CC2)c1 1164363192 UZRVLUNNQJLZQJ-UHFFFAOYSA-N 433.556 4.243 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(c4cccc(F)c4F)CC3)C2)cc1 1230301227 UPDOPMQHGGNCFR-QGZVFWFLSA-N 429.511 4.389 10 10 IICE CC(C)[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)[C@@H](O)c1ccc(Cl)cc1 1251501033 MOEYGNUKAHNBAW-VABKMULXSA-N 447.023 4.066 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1-c1cnn(C)c1 1294859801 OWELYMYRHBGMKX-OAQYLSRUSA-N 438.959 4.149 10 10 IICE Cc1cc(C(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)c(C)n1-c1cccc(C(C)C)c1 1297536663 BNBQUOQWMNVKAO-OAQYLSRUSA-N 437.506 4.210 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)c3ccccc3)CC2)c(C)n1-c1ccccc1 1313132414 NDVDADSHQJEJAM-UHFFFAOYSA-N 430.552 4.152 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCSC[C@@H]2C)cc1 1313678185 BSXOEHGWIGNKDX-AZUAARDMSA-N 429.634 4.008 10 10 IICE CSCC[C@H](C)N(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)cc1C 1316447937 BGQLSTWQBSQOOL-IBGZPJMESA-N 438.645 4.264 10 10 IICE FC(F)(F)C1CCN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)CC1 1316510887 RLKSCXQCODBEND-ZDUSSCGKSA-N 447.552 4.200 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](COC)c1ccc(F)cc1 1351535823 IUPWZMIGCCSPRH-KRWDZBQOSA-N 425.298 4.213 10 10 IICE C[C@@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1356165671 PJSMCNQBZRLPGV-DLBZAZTESA-N 436.474 4.478 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NC(=O)c1ccc(OC)cc1)c1ccccc1 1442356853 XPIQASFAUBSNFY-RUZDIDTESA-N 445.563 4.281 10 10 IICE Cc1cc(C(=O)N(C)CCCNC(=O)C2CCC2)c(C)n1-c1ccc(Br)cc1 1447665495 NMBARNKBMLKZEZ-UHFFFAOYSA-N 446.389 4.235 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](c4cccc(Br)c4)C3)C2)cc1 1470773485 PNYFGUWKCBJJMB-MJGOQNOKSA-N 444.373 4.236 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H]3CCCC34CCCCC4)CC2)cc(OC)c1OC 1470793756 PRYKUPBQPALYTR-NRFANRHFSA-N 431.577 4.047 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccsc1 1510675070 RWPSTBPMAFGFFJ-FQEVSTJZSA-N 425.602 4.293 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(SC(F)F)cc1 1519555882 HIDGLJOZQOZQLJ-UHFFFAOYSA-N 431.552 4.463 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3cccc(F)c3Br)C2)cc1 1526246223 GEKWQFFHTXPALJ-OAHLLOKOSA-N 435.337 4.172 10 10 IICE Cc1nnc(N(Cc2cccs2)C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543176756 QQADEJXUBNITLA-UHFFFAOYSA-N 439.629 4.320 10 10 IICE Cc1cc(C(=O)Nc2cnn(-c3ccccn3)c2)c(C)n1-c1ccc(Br)cn1 1544209278 AZLUFVGMSWGGMY-UHFFFAOYSA-N 437.301 4.085 10 10 IICE Cc1cc([C@@](C)(O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(C)o1 1544667691 VWTMCWZUWYOTNE-NRFANRHFSA-N 446.345 4.099 10 10 IICE COC1(C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1554704957 YKAKOQJRKFFJDT-UHFFFAOYSA-N 425.621 4.376 10 10 IICE CCCN(Cc1ccccc1O)C(=O)CCOc1ccccc1I 1566305395 SWPZYPMFEFTWTB-UHFFFAOYSA-N 439.293 4.205 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccn(Cc3ccccc3)n2)cc1 1568817095 LJACXSFHWPSAKX-UHFFFAOYSA-N 426.520 4.010 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1 1570022954 GSXXXXAZHAUFBL-OAQYLSRUSA-N 430.426 4.389 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613375956 PNOOYJXHATYDKT-FQEVSTJZSA-N 448.615 4.079 10 10 IICE Cc1nc(-c2ccco2)ccc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257173 QBHDQTZFRHJPKK-GOSISDBHSA-N 425.916 4.403 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccnc1Sc1ccc(Br)cc1 1630301914 MZUPEGJEJAOAIG-UHFFFAOYSA-N 431.311 4.337 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c(C)n1-c1ccc(Br)cc1 1632752521 FPRXPZCPJIAYLQ-GDBMZVCRSA-N 446.389 4.376 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CSC(c4ccccc4O)=N3)cc2Cl)C1 1635125825 HUQDKFHGIYRUAM-DNVCBOLYSA-N 444.000 4.460 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3cccc(OC)c3)CC(C)C)C2)cc1 1636353980 NMVVTHSTTBZDDE-NRFANRHFSA-N 425.573 4.398 10 10 IICE CC(C)(C)OC(=O)N1CC2CC1(CCC(=O)NCc1cc(Cl)cc(Cl)c1O)C2 1638305722 NEXAAKSQHWJPFL-UHFFFAOYSA-N 429.344 4.495 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCOc1ccccc1-c1ccccc1 1638529797 WCLQLMBMKDCJLN-UHFFFAOYSA-N 433.504 4.420 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCO[C@H](c3ccc(F)cc3F)C2)cc1 1639047337 MKIGSGDQGFWJBX-DEOSSOPVSA-N 438.474 4.327 10 10 IICE COc1ccc(N2CCN(CCCNc3nc(-c4cc(F)cc(F)c4)ns3)CC2)cc1 1641999232 PRCAJENQRVGEMP-UHFFFAOYSA-N 445.539 4.116 10 10 IICE COc1cn(C)nc1[C@@H](C)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1652634818 LXPCMNBYHWIXIW-CYBMUJFWSA-N 431.334 4.090 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1COc2cccc(Br)c2C1 1675508510 LRGMEDPHXJHNNZ-KRWDZBQOSA-N 446.389 4.439 10 10 IICE COc1ccc(C[C@@H](C)CNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1OC 1679664966 KOWMGJIFWFWCPN-LJQANCHMSA-N 425.573 4.324 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCO[C@@H](c3ccncc3)C2)cc1 1682628279 PGFPZYMEZFBUEI-XUZZJYLKSA-N 434.540 4.373 10 10 IICE Cc1cc(-c2nnc(N3CCC(C)CC3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1692984256 HQTJXXMHBKRRPT-UHFFFAOYSA-N 434.588 4.114 10 10 IICE C=C(C)CN(CC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1705709629 CEUBZAHSCOAEIN-UHFFFAOYSA-N 425.621 4.235 10 10 IICE Cc1ccc(Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)s1 1707504400 DDVXERYJOXEFNE-UHFFFAOYSA-N 439.629 4.467 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCN(C)C(=O)OC(C)(C)C 1726355080 OPJFKCBTDUXGLG-UHFFFAOYSA-N 442.608 4.080 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@](C)(C(N)=O)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1742120331 XYEUCXZNZGEOCO-RUZDIDTESA-N 434.588 4.100 10 10 IICE O=C(OCc1ccccc1)N1CC[C@@H](NCc2cc(Cl)cc(Br)c2O)C1 1938937539 YGPORGYESWTNCS-MRXNPFEDSA-N 439.737 4.309 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cc(Cl)cc(Br)c2O)COC1(C)C 2103041306 MKKCSJQHJXERHD-CYBMUJFWSA-N 449.773 4.270 10 10 IICE CCN1C(=O)C(=C2SC(=S)N(C3CCCC3)C2=O)c2cc(Br)ccc21 2296711418 YGLKVAMXRIOAOU-UHFFFAOYSA-N 437.384 4.330 10 10 IICE CS(=O)(=O)Oc1ccc(Cl)cc1C=C1SC(=S)N(c2ccc(F)cc2)C1=O 2297357283 WRHXHYFZXRUOTE-UHFFFAOYSA-N 443.930 4.223 10 10 IICE CCCCOC(=O)c1ccc(-n2c(C)cc(C=C3C(=O)N(C)C(=S)N3C)c2C)cc1 2297454240 NRGSCJVECVJMDO-UHFFFAOYSA-N 425.554 4.081 10 10 IICE N=C1C(=Cc2ccc(OCc3ccccc3)cc2)C(=O)N=C2SC(C(F)(F)F)=NN12 2297455633 LITZADACZDOWJG-UHFFFAOYSA-N 430.411 4.447 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccc(F)cc3)SC2=S)cc1 2314836750 JNEWKRPCIVFFKZ-ZDUSSCGKSA-N 430.526 4.453 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2c(O)cccc2Br)C[C@@H]2CCC[C@@H]21 2335115773 OPIJJOWCZLNPJK-ZQIUZPCESA-N 425.367 4.422 10 10 IICE COc1ccc(CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1 5098633 MHSIIGJDALWDMY-SANMLTNESA-N 429.564 4.224 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccccc1C(=O)O 33317806 KTOBBCXQKIATEY-SFQUDFHCSA-N 444.509 4.144 10 10 IICE CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 741671426 HRWAGJXLLYGLTF-UHFFFAOYSA-N 430.936 4.349 10 10 IICE Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405438 DZUWTVZINCFYGK-UHFFFAOYSA-N 447.576 4.071 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1ccc(Br)c(Cl)c1 751589356 QMOSAMKAFQGMDS-UHFFFAOYSA-N 430.736 4.422 10 10 IICE CC(C)n1ncc2ccc(NC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)cc21 768881341 MTKFENAWBGZGRA-UHFFFAOYSA-N 446.599 4.471 10 10 IICE CC(C)(C)OCc1ccccc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 773590521 SMSCWKZLTVFAEZ-UHFFFAOYSA-N 435.612 4.464 10 10 IICE Cc1ccc(COc2ccc(/C=C3/C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)cc2)cc1 1084399834 WTDDFVHEIMGBTL-HMAPJEAMSA-N 430.435 4.380 10 10 IICE COC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)c(C)c1 1084475863 YTMACPZOOQKHMO-ZHZULCJRSA-N 444.443 4.050 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc(C(C)C)ncc2OCc2ccccc2)cc1 1130547623 NATOAIZBZGKLEH-UHFFFAOYSA-N 448.567 4.396 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccccc3)c3ccc(C)cc3)CC2)cc1 1192070865 PADXGJOBIBTVOC-HHHXNRCGSA-N 445.607 4.193 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3c(C(F)(F)F)cnn3C)cc2Cl)C1 1227209697 VRACATYDFRGPDF-CYBMUJFWSA-N 443.901 4.328 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@@H]1[C@@H]1CCCO1 1289423173 HDYRXNOTRNSKHK-YADHBBJMSA-N 425.621 4.437 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(F)(F)F)C2)c(C)n1-c1ccccc1Br 1293750409 NCZZSUUATGKPMQ-MRXNPFEDSA-N 431.252 4.260 10 10 IICE COC(=O)CC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1312591564 XXAMYICJEVDOBW-ROUUACIJSA-N 435.996 4.451 10 10 IICE Cc1cc(CCNC(=O)NCc2ccc(C3(C)OCCO3)cc2)c(C)n1-c1ccccc1 1313100793 OVWJWUMTHUHRHS-UHFFFAOYSA-N 433.552 4.356 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1314938571 IKXBBZSYURPSPT-UHFFFAOYSA-N 446.599 4.281 10 10 IICE C[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(F)cc1OC(F)F 1329099308 CIIBUNHABLDDLV-VIFPVBQESA-N 433.224 4.456 10 10 IICE Cc1sc(Br)nc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1350629012 PRHFCYGETLXJSR-UHFFFAOYSA-N 427.279 4.242 10 10 IICE Cc1cc2ccccc2nc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1357519250 OHBCOQLJXNJCTL-UHFFFAOYSA-N 429.442 4.329 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cncc(-c4ccc(N(C)C)cc4)c3)C2)cc1 1436970151 HWEOFUOMSOMKBH-LJQANCHMSA-N 430.552 4.080 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)c1C 1441491489 GTKOCXZGBYLLGZ-JOCHJYFZSA-N 430.596 4.343 10 10 IICE Cc1cc(CC(=O)N2CCN(Cc3cccc(Cl)c3)C(=O)C2)c(C)n1-c1ccccc1 1446146413 XBPSIQOWVBSFPI-UHFFFAOYSA-N 435.955 4.161 10 10 IICE COC(=O)C[C@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccccn1 1459368272 VNADMNRADOLTDQ-DEOSSOPVSA-N 439.943 4.280 10 10 IICE CC(C)CC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1459718803 DZXKOZPMANOSSL-SJBKTWHCSA-N 433.612 4.346 10 10 IICE Cc1cccc(NC(=O)c2ccc(N=NC(N)=O)cc2)c1C(=O)NCCc1ccccc1 1464579030 OVETXCLQPOEMKM-UHFFFAOYSA-N 429.480 4.382 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nc(-c3cccc(Cl)c3)no2)cc1 1465237171 LXDVWAOUCBGEBO-UHFFFAOYSA-N 448.910 4.469 10 10 IICE COc1ccc(S[C@@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952114 VPKHZSWIDYMZTN-MAUKXSAKSA-N 434.989 4.316 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccncc3)C(=O)OC(C)(C)C)c2C)c1 1469464844 ZUKWXKDZRPAQQP-QHCPKHFHSA-N 433.552 4.480 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccoc2CN2c3ccccc3C[C@H]2C)cc1 1469807164 VHLBPCRDMIEDTR-LJQANCHMSA-N 433.552 4.448 10 10 IICE COc1ccc(N2CCN(c3ncncc3-c3ccc(Br)cc3)CC2)cc1 1472726502 FSCVKIIIPTXJPL-UHFFFAOYSA-N 425.330 4.241 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCC(=O)N2)n1CCCC(C)(C)C 1503473196 KGGWUCUUVHONSX-OAQYLSRUSA-N 438.620 4.292 10 10 IICE Cc1c(CN(C)c2nnc(C3CCCC3)n2CCCSc2nccs2)cnn1C 1510482297 LPBTZYPYUNANCN-UHFFFAOYSA-N 431.635 4.253 10 10 IICE Cc1cccc(-c2nnc(N(C)C[C@H]3CCCCO3)n2CCCSc2nccs2)n1 1511093729 WXGZIEMCXFJZMU-QGZVFWFLSA-N 444.630 4.293 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nc(NCc2ccco2)ncc1Cl 1528924077 IMRRBRDFXUACFA-OAHLLOKOSA-N 427.936 4.071 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H](C)N2CSCCSC2)cc1 1565656064 NDDYVWURGZTPSA-SFHVURJKSA-N 445.654 4.380 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(C(F)(F)F)cc1O 1595582938 HGDHKSRWYGRFHM-OAHLLOKOSA-N 428.838 4.164 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCCN1C(=O)C(F)(F)F 1612528773 KMJMWJXYYFKTHK-MRXNPFEDSA-N 435.402 4.181 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)c(F)c1 1616615675 KBCAEAOWRZVADU-PMAPCBKXSA-N 445.554 4.244 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@H]3OCCC[C@@H]3C2)cc1F 1617666920 GHPFLNGDJHXFKK-NQIIRXRSSA-N 429.584 4.125 10 10 IICE Cc1ccc(C(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1628575331 OHPMIUGXLAWWTA-HSZRJFAPSA-N 429.520 4.093 10 10 IICE Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1629160627 TYGVAIFRRPTOLJ-RGEXLXHISA-N 428.554 4.084 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3ccc(Br)c(Cl)c3)CC2)cc1F 1631376879 DNEQQEFGDKRQLJ-UHFFFAOYSA-N 441.728 4.142 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1 1634008825 LWGANSIGTCVYHF-UHFFFAOYSA-N 444.597 4.399 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H](C(=O)N(C)c4ccccc4)C3)c2C)cc1 1635406198 PSLVTVLXEFMFEA-HXUWFJFHSA-N 431.536 4.228 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C1CC(O)(CCC(C)(C)C)C1 1635489231 PNNRNQCCENPEPL-UHFFFAOYSA-N 432.605 4.342 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1639814273 RACKZUJDPWATLA-UXHICEINSA-N 447.620 4.263 10 10 IICE Cc1cc(C(=O)Nc2cc([C@@H]3CCCOC3)[nH]n2)c(C)n1-c1ccc(Br)cn1 1639924956 BHAMGNMMQXWOSS-CQSZACIVSA-N 444.333 4.121 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(C(=O)OC(C)(C)C)CCC23CCC3)c([N+](=O)[O-])c1 1640342684 AKYRTGCVMCPERQ-CLFYSBASSA-N 445.516 4.151 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C(=O)OC(C)(C)C)c(C)n1-c1ccc(C(C)C)cc1 1641400592 MTKUXKXGXLWAOU-JOCHJYFZSA-N 426.557 4.400 10 10 IICE Cc1ccc(CN(CC(=O)NCc2ccc(F)cc2)c2ccc3c(c2)OCCO3)s1 1644825801 PMRXUXNQOPREHT-UHFFFAOYSA-N 426.513 4.290 10 10 IICE CC1CCC(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C2CC2)CC1 1657004666 CASVEWRENLBKPS-JMDAGXMHSA-N 431.596 4.099 10 10 IICE Cc1ccc(C[C@@H](C)N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1657368763 HCOYDZGLGOFPBK-GOSISDBHSA-N 426.516 4.272 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC4(CCCCC4)CC3)cc2F)C[C@@H](C)O1 1659344718 SWNMIKRHYHDFLF-WOJBJXKFSA-N 431.596 4.102 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1(c2ccc(F)cc2F)CCCC1 1681586259 DFEFVWRSXMMYFH-UHFFFAOYSA-N 443.538 4.237 10 10 IICE CCCCOc1ncccc1Cn1c(C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709667266 QDUBCXIWPXEVGN-UHFFFAOYSA-N 434.588 4.445 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1710026245 BIFLEMAOGRVWCA-RCZVLFRGSA-N 441.620 4.420 10 10 IICE CCOCc1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1710703369 UAIMPUSSQCJUDW-NRFANRHFSA-N 443.661 4.289 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1 1726798680 FMHVFKQDHLIKNH-BWKNWUBXSA-N 437.588 4.129 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCSC(C)(C)C2)cc1F 1766911760 JLRBKAYXAKSUJM-IBGZPJMESA-N 433.597 4.105 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3ccc(Br)cc3O)CCC[C@@H]12 2087289478 MWJIXYMTFLRLKA-XLIONFOSSA-N 425.367 4.424 10 10 IICE Oc1cc(Br)ccc1CN[C@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156292645 ONKLYVHDAQVXPV-HXUWFJFHSA-N 431.374 4.068 10 10 IICE COc1ccc(Br)c(CNC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(C)C)c1O 2236054368 HPPXQFHYCOBGHV-CJNGLKHVSA-N 445.398 4.438 10 10 IICE CSc1ncc(CNC(=O)c2scc(Br)c2Br)s1 2257097182 OIMZXOAYQKUJFN-UHFFFAOYSA-N 428.196 4.382 10 10 IICE CCOC(=O)c1ccc(N2N=C(C(F)(F)F)C(=Cc3ccc(O)c(OCC)c3)C2=O)cc1 2297312520 PZNWIEQNQDKLSE-UHFFFAOYSA-N 448.397 4.316 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2F)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2314831848 TYXLHRGFBPADOZ-UHFFFAOYSA-N 445.497 4.354 10 10 IICE CCC1=NN(c2ccc(Br)cc2)C(=O)C1=Cc1cc(OC)c(O)c(OC)c1 2332147717 SUFPANGIIKRQMD-UHFFFAOYSA-N 431.286 4.368 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccc(C)c(C)c1 20235873 HIZPIQIRGPMIMZ-ZIJAOZNWSA-N 447.491 4.220 10 10 IICE Cc1cc(N(C)C)ccc1CNc1nc(CN2CCOCC2)nc2sc(C)c(C)c12 301267920 HAXNVKXOTRYKKV-UHFFFAOYSA-N 425.602 4.127 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)Cn2ccc(=O)c3ccccc32)c1C 744520204 WJXNJRJTBFIENG-UHFFFAOYSA-N 428.488 4.144 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(c2cccnc2)CC1 768948187 DKCHTYFTWGJWGF-IBGZPJMESA-N 430.499 4.241 10 10 IICE Cc1cccc(O[C@@H](C)C(=O)N2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)c1 1126070429 VTQAKSHFQBBTNC-QFIPXVFZSA-N 445.563 4.154 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cc(C(N)=O)c2ccccc21 1137817009 XWUWENCNPXJKHS-SFHVURJKSA-N 427.504 4.236 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(OCC(F)(F)F)nc3)c2C)cc1 1141688350 ONZVKRMHGBCPQD-UHFFFAOYSA-N 433.430 4.369 10 10 IICE Cc1cc(C(=O)N[C@@H](c2ccc(Cl)c(F)c2)c2nn[nH]n2)c(C)n1-c1ccc(F)cc1 1153820271 LTSJBERGRUSJEB-IBGZPJMESA-N 442.857 4.058 10 10 IICE C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 1154668782 LYAKDELDEYXIKR-XOBRGWDASA-N 433.499 4.474 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](NC(=O)OC(C)(C)C)c1cccc(Cl)c1 1157103185 VURSYYJAHATGDY-GOSISDBHSA-N 439.936 4.414 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3cc(Br)sc3[nH]2)N(C)C)cc1 1158717042 KVMIJQIWEVDXJY-MRXNPFEDSA-N 435.391 4.091 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)C1 1178091046 YLUXSJWVHNDMGV-IBGZPJMESA-N 425.529 4.036 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H](C)[C@@H](CNC(=O)OC(C)(C)C)C1 1230196290 XUKWGHMLIRARSE-CUWPLCDZSA-N 446.636 4.184 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccccc3)CC3CCOCC3)C2)cc1 1230301026 ORCCOYUUWJOUEQ-QHCPKHFHSA-N 437.584 4.160 10 10 IICE CCO[C@@H]1C[C@H](N(C)C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)C12CCCCC2 1230301186 TYSMNPWQKHBGDA-AJSBUHFISA-N 429.605 4.291 10 10 IICE CC(C)(C)c1nnc(N2C[C@@H](O)CC3(CCCC3)C2)n1CCCSc1nccs1 1286997009 HDGJQHAHHVZSSF-INIZCTEOSA-N 435.663 4.346 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC[C@H]1CCCS1 1287354383 LGOFVMXZMNEVBW-DKXRRRNBSA-N 426.654 4.131 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(NC(=O)c4ccc(C)cc4)CC3)ccc21 1287453783 ZEUUILRMYUNDBC-UHFFFAOYSA-N 447.579 4.248 10 10 IICE CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1296741960 UBYLQJDYOVQLEZ-INIZCTEOSA-N 433.268 4.242 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1csc(CC)n1 1297056076 JCCMRYNNKCNGKO-UHFFFAOYSA-N 440.617 4.118 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCn1cccn1 1302540085 BMZPNDNBULJWRO-LJQANCHMSA-N 449.628 4.437 10 10 IICE CS[C@H](C)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1302569522 QECADFHSWLJPHE-LJQANCHMSA-N 443.661 4.235 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H]2OCCC[C@@H]2C1 1304238205 MHDQHIGZMPFWRY-IRLDBZIGSA-N 425.621 4.295 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2CCOCC2)n1Cc1ccc(N2CCSCC2)cc1 1305390650 DZIJKQSMBVJQLE-LJQANCHMSA-N 443.661 4.256 10 10 IICE COc1cc(N2CCN(CCCc3ccccc3Br)CC2)cc(OC)c1OC 1307666279 JFVYRVCENPIHFO-UHFFFAOYSA-N 449.389 4.230 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1316172492 LEPHISUVSSCJET-LEWJYISDSA-N 441.620 4.133 10 10 IICE CSC[C@H]1CCCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCSCC2)cc1 1316438816 JILMCXUVRSFGAC-OAQYLSRUSA-N 445.702 4.410 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nc(C)cs1 1353069892 XPLPLUXWVQTUTO-HEUOVEHFSA-N 449.598 4.449 10 10 IICE CCOC(=O)N[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1441475003 YWDVGZAMSPOYAT-MRXNPFEDSA-N 448.361 4.207 10 10 IICE C[C@@H](Cc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1458018760 LGRJJISKHJKYFK-IBGZPJMESA-N 426.004 4.367 10 10 IICE C[C@H](NC(=O)c1cc(Br)nc(Br)c1)c1ccc(N(C)C)cc1 1459178484 MOXOEMSACOJEBP-JTQLQIEISA-N 427.140 4.164 10 10 IICE COc1cc(OC)c(NC(=O)CCN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1Cl 1459733171 DXGOYACTGUQRAI-KRWDZBQOSA-N 448.947 4.073 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(F)c(Br)c(Cl)c3)C2)cc1 1461492299 DVKMRZFGVYINJR-LBPRGKRZSA-N 427.701 4.259 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)cc1F 1464289909 CVIAHZVDDIQAQY-UHFFFAOYSA-N 437.490 4.279 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cccc2c(Br)cccc12 1464450540 IXEONCYRCMMQAX-UHFFFAOYSA-N 425.326 4.369 10 10 IICE C[C@H](NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)c1ccc(N(C)C)cc1 1478471350 UXJCFVGRCPQVQL-SFHVURJKSA-N 430.556 4.255 10 10 IICE Cc1cccc(-c2nnc(N3C[C@@H](C)OC(C)(C)C3)n2CCCSc2nccs2)n1 1492505482 BPZPNENNINGSSS-MRXNPFEDSA-N 444.630 4.291 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H]3C(C)C)n2Cc2ccc(N(C)C)c(F)c2)n1 1492750404 XFMAZBSVEMGZAN-NRFANRHFSA-N 439.583 4.018 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@@H](C)[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1511540793 VGVVOEMBUSKNPZ-HZPDHXFCSA-N 442.608 4.370 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1516636328 AUJSOPBWNUNCTG-OFNKIYASSA-N 441.620 4.195 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC=CCO1 1519039372 RTBHDBGXLPUPET-JOCHJYFZSA-N 435.572 4.170 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC=C(c2ccco2)C1 1521076953 ZMELVPTXGCQUAA-UYRXBGFRSA-N 442.537 4.326 10 10 IICE CN(C)c1ccc(CN(C(=O)C(C)(C)n2cc(NC(=O)OC(C)(C)C)cn2)C2CC2)cc1 1524793226 CMEBCGXTUYWQFP-UHFFFAOYSA-N 441.576 4.222 10 10 IICE COc1cc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1C 1528193384 UYAKQIQGIORQND-UNOMPAQXSA-N 444.553 4.050 10 10 IICE CC(C)(CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)CC(F)F 1536705323 HIXNHZJXWROBCE-ZROIWOOFSA-N 430.517 4.215 10 10 IICE CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1538422013 RTTKBMLXFVYULX-CMKODMSKSA-N 434.024 4.477 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@@H]2CCCC[C@H]2C1 1538543668 ZRMXEPKFYANIKG-ZAODVUJUSA-N 432.586 4.456 10 10 IICE O=C(CCc1cc(F)ccc1[N+](=O)[O-])N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1539581866 KZGBBJSEKVXJFH-INIZCTEOSA-N 437.418 4.053 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)N(C)C)cc1 1539705692 HOQCMYKVPHFKPE-JOCHJYFZSA-N 449.599 4.424 10 10 IICE CNS(=O)(=O)c1ccc(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)s1 1540721798 QSKPUOGSHHOOFO-UHFFFAOYSA-N 445.610 4.117 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C[C@H](C(F)(F)F)O1 1544622740 AGGGAWOUJYQOKB-CHWSQXEVSA-N 449.568 4.371 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCSCC(F)(F)F 1546418880 QCZWCQNKZNAUAS-UHFFFAOYSA-N 427.540 4.373 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCn2nc(C(=O)NCc3c(O)ccc4ccccc34)cc21 1558555372 ZDHBXIASKGONCV-SFHVURJKSA-N 436.512 4.032 10 10 IICE CN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1CCC[C@H]1c1ccccc1 1564895270 CFJYGAXEUJMWKJ-SIKLNZKXSA-N 429.511 4.279 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C)c(Cl)cc2I)c1 1566374684 QISQJFRXHAXWJZ-SNVBAGLBSA-N 445.684 4.458 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSCc1ccc(F)cc1 1568375182 IZDDPEBGCOHVBG-UHFFFAOYSA-N 432.561 4.448 10 10 IICE Cc1ccccc1CCN(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1583733945 IGCCSXVDTDRRQC-HKWRFOASSA-N 442.581 4.427 10 10 IICE C[C@@H]1O[C@H](C)[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)[C@H]1C 1585834656 LYZANRHNSYIKSK-APNQJHFZSA-N 429.318 4.157 10 10 IICE Cc1nc([C@@H]2CCCCN2C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)no1 1586491567 WGTUTQWKVBXGDB-KRWDZBQOSA-N 444.333 4.310 10 10 IICE CNc1ccc(Cl)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1586619136 CSEYXXPSCATALW-HXUWFJFHSA-N 446.979 4.444 10 10 IICE CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)NCc1cccc(Cl)c1O 1606860008 FIMHDIUGOOZRRC-CYBMUJFWSA-N 427.975 4.026 10 10 IICE Cc1cc(CCNC(=O)[C@@](N)(c2cccc(F)c2)C(F)(F)F)c(C)n1-c1ccccc1 1611616099 IDNVJFYNXQSDOG-QFIPXVFZSA-N 433.449 4.308 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3OCCN(C4CC4)[C@H]3c3ccccc3)cc2)CC1 1614600710 JETWQEAODWZQGS-UIOOFZCWSA-N 433.596 4.144 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1616602593 MXYNQZJOVWLMHJ-IRXDYDNUSA-N 437.635 4.164 10 10 IICE COc1ccccc1-c1nnc(N(C)C[C@H]2CCOC2)n1CCCSc1nccs1 1619384100 GUJYKZUYEZWCGJ-MRXNPFEDSA-N 445.614 4.065 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2c(O)cnc3c(Br)cccc23)cc1 1625014028 IVBJJLFTDDJZJH-UHFFFAOYSA-N 428.330 4.479 10 10 IICE Cc1cc(C(=O)NCc2cccc(CN(C)C)c2)c(C)n1-c1ccc(Br)cn1 1625078507 AUGBPLFBOAJMSS-UHFFFAOYSA-N 441.373 4.243 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1 1635663858 ZOMAONYFSDLGKS-UHFFFAOYSA-N 430.551 4.307 10 10 IICE Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1)C2=O 1637244164 VJLPFWXPABPOKG-RBUKOAKNSA-N 442.515 4.475 10 10 IICE Cc1ccc(N2C(=O)C(=O)N(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)c(C)c1 1640842074 OWZWIEYQAQGBCI-UHFFFAOYSA-N 447.466 4.028 10 10 IICE COC(=O)[C@H](C[C@H]1CCCOC1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1643523611 DSFFGWITCSKQQE-VGSWGCGISA-N 438.528 4.256 10 10 IICE CC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(OC)cc1 1645125433 SMZXHPLYZRAUSU-NRFANRHFSA-N 428.488 4.150 10 10 IICE COc1ccc(N(CC(=O)NCc2ccc(N(C)C)cc2)Cc2ccccc2)cc1OC 1655929507 YKSALIWEZNYTQW-UHFFFAOYSA-N 433.552 4.093 10 10 IICE CN(C)c1ccc(C2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CC2)cc1 1685681191 BUVDSZDSJUNNJJ-VWLOTQADSA-N 437.632 4.011 10 10 IICE C=C(Cl)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CO)CC1 1705746622 WOEUBSUQNQAIPJ-UHFFFAOYSA-N 425.964 4.314 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1710773423 LWADENWPJORXFN-FPOVZHCZSA-N 437.588 4.250 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1Cc1ccc2c(c1)CCCN2C 1726884019 ZYDQMGYPUJBGEV-MRXNPFEDSA-N 442.011 4.246 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCC[C@H]1OC 1727004261 VWGCYDWLSNGLNO-WAOWUJCRSA-N 445.583 4.081 10 10 IICE CC(C)c1nnc(N(C)[C@@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752089945 FGKZPLIGXINOKF-UYAOXDASSA-N 429.584 4.440 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](NC(C)=O)C1 1763605766 LOFZIFIMDPANEP-LPLSSMDUSA-N 446.599 4.424 10 10 IICE Cc1nc2scc(C)n2c1/C=C1/SC(=S)N(CCc2nc3ccccc3[nH]2)C1=O 1860087031 WHJCEHOVVHHCHH-CXUHLZMHSA-N 439.591 4.333 10 10 IICE COC(=O)c1c(NC(=O)C(=O)N[C@H]2CCCC[C@H]2C)sc(C)c1-c1ccc(C)cc1 1860760989 LQWSMSJCOTYESC-PBHICJAKSA-N 428.554 4.452 10 10 IICE COc1ccc([C@@](C)(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c(O)c1 1951738158 XHLVWTVIJNKOQP-RUZDIDTESA-N 433.460 4.239 10 10 IICE COC(=O)c1c(C(F)F)nn([C@@H](c2ccc(OC)cc2O)C2CCC2)c1Br 2079875076 OEBJHSPSSWNVNP-OAHLLOKOSA-N 445.260 4.474 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C2(C)CC2)c(I)c1N 2079951702 WXFIFIYFRAKKTN-INIZCTEOSA-N 425.314 4.344 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C3(C)CC3)c(C(=O)O)c2Br)c(O)c1 2080030258 KKRBRUSDJLVADM-INIZCTEOSA-N 435.318 4.499 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)o2)cc1 2294133781 JXLRDSMPVCTREQ-UHFFFAOYSA-N 444.443 4.098 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3cc(OC)c(OC)c(OC)c3)SC2=S)cc1 2296674115 SKFGWEZSIAOAEX-UHFFFAOYSA-N 445.562 4.165 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2314828380 SNDLCAVJSYAAEB-UHFFFAOYSA-N 447.925 4.478 10 10 IICE C/C=C/C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135957 YOEYHQXPUUPJRC-KIUWMYQTSA-N 441.366 4.281 10 10 IICE CN(C)c1ccc(CNC(=O)c2cccc(NC(=O)N3CCSc4ncccc43)c2)cc1 8594684 FPQWFIBAEDYTPB-UHFFFAOYSA-N 447.564 4.222 10 10 IICE CC[C@@H]1SC(=S)N(CCC(=O)Nc2ncc(Cc3ccccc3Cl)s2)C1=O 11635792 FJUWHDPOTPSJQY-AWEZNQCLSA-N 440.015 4.355 10 10 IICE Cc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)c1 205691370 MCLBRFYKKNJOJE-SFQUDFHCSA-N 427.507 4.133 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3cccc(C)c3C)C2=O)ccc1OCC(=O)O 206594710 SFMGPBWJFULMTK-ZDLGFXPLSA-N 429.519 4.181 10 10 IICE COc1cccc(/C=C\C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)c1OC(F)F 229866125 VVLIWLPQNHJMIS-XFXZXTDPSA-N 442.466 4.259 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc3c(c2)CN(C)C(=O)N3)C1 444362439 HFZDAPXUOZYQRA-UHFFFAOYSA-N 431.540 4.024 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(OC)c(OC(F)F)c3)ccc21 483016550 BNYXBNZLLFLJMS-UHFFFAOYSA-N 432.467 4.445 10 10 IICE CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 731015173 REDIPRSCHGVLFT-HXUWFJFHSA-N 435.634 4.186 10 10 IICE CCC(=O)c1ccc(OCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742799875 DSVYICZOTNEFNO-QGZVFWFLSA-N 432.467 4.045 10 10 IICE O=S(=O)(/C=C/c1ccccc1Br)NCc1cccc(Br)c1O 766200790 ODXFIXKOQHFTEO-CMDGGOBGSA-N 447.148 4.008 10 10 IICE COC(=O)c1ncsc1S(=O)(=O)Nc1nc(-c2ccc3ccccc3c2)cs1 777665708 PBHFGZOJJPZGJH-UHFFFAOYSA-N 431.520 4.007 10 10 IICE COc1ccccc1-c1ncc(/C=C2\SC(=S)N(c3cccc(C(=O)O)c3)C2=O)cn1 792867424 VDXXTMVRHQGHPS-NVMNQCDNSA-N 449.513 4.256 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 918564412 DLERBEFUXUJLJJ-QFIPXVFZSA-N 439.575 4.110 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cc2ccccc2[nH]1 1157766574 KAGOITDVGVXNDT-YBFXNURJSA-N 439.537 4.215 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(C)c4ccccc43)cc2F)C[C@H](C)O1 1194792082 PULLSLVKICGYLX-OALUTQOASA-N 439.575 4.243 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1 1246371859 NUWYLSFIXMWLTD-LJQANCHMSA-N 445.405 4.326 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)c1ccccc1 1269298078 QMSBLQYBUSKBRD-AREMUKBSSA-N 436.552 4.155 10 10 IICE C[C@H]1CCCN(CCCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1291125386 UBXCYMODGUSVJQ-FQEVSTJZSA-N 434.588 4.194 10 10 IICE COC(=O)c1cc(Cl)cc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1O 1297629533 OARYXYYOQKSLFS-UHFFFAOYSA-N 426.856 4.305 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)c1 1299566990 FWSJMCSSUBGWCJ-XMSQKQJNSA-N 439.556 4.424 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 1299698674 JRCLTEHCKPTGJY-UHFFFAOYSA-N 448.306 4.090 10 10 IICE Cc1cc(C(=O)NC(C)(C)[C@@H](O)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1302811224 HJMVPBLXAINFKV-MRXNPFEDSA-N 433.268 4.288 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3cc(Cl)cc(Cl)c3C2)N(C)C)cc1 1313410862 GJWBEDFXHJXINU-OAQYLSRUSA-N 435.399 4.430 10 10 IICE CN(CCc1ccccc1C(=O)N1CCOc2cc(N(C)C)ccc21)C(=O)OC(C)(C)C 1360848011 GGIUTEFEWINQND-UHFFFAOYSA-N 439.556 4.201 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(CCc2ccccc2)n1 1361063755 RFZDJQPRFOQTAK-IBGZPJMESA-N 440.494 4.126 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2cc(Cl)ccc2Br)cc1 1437384806 XDOYAMTWOJUQAD-UHFFFAOYSA-N 425.754 4.248 10 10 IICE CCN1CCC(N2CCCN(C(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)CC2)CC1 1451673805 KFULZCHGQFEQFJ-UHFFFAOYSA-N 443.035 4.380 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(Br)c2O)cc1 1452619406 ZYFIFCOLDRABBZ-UHFFFAOYSA-N 431.252 4.425 10 10 IICE O=C(CN(CC1CCC1)CC(F)(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1459552771 DHVWQOKZDSLYSG-UHFFFAOYSA-N 430.426 4.065 10 10 IICE CCCCN(CCS(=O)(=O)c1cccc(Br)c1)Cc1ccccc1O 1460023448 JKOSQWSTSOEVCD-UHFFFAOYSA-N 426.376 4.231 10 10 IICE CN(C)c1ccc(CN(C(=O)c2nc3ccc(Br)cn3c2F)C2CC2)cc1 1464058374 PXBUFEYDVZIZBR-UHFFFAOYSA-N 431.309 4.107 10 10 IICE CC(C)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@@H](O)c1ccccc1 1467625625 KXLUPWGERIYJJS-SXOMAYOGSA-N 433.596 4.282 10 10 IICE Cc1ccc(C(=O)NCc2ncc(Br)s2)cc1-n1c(C)cc(C=O)c1C 1471393249 BFPQBXOMKUWAGW-UHFFFAOYSA-N 432.343 4.364 10 10 IICE C[C@H]1CCCC[C@@H]1OCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1493610957 NMWWXNUDTCWTKR-CVDCTZTESA-N 435.572 4.201 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)C(=O)NC 1500373809 YNZUJRGXGBPXKR-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2C[C@H](C)[C@@H](C)C2)cc1 1501844316 OMEXGZTXFYJLIC-OALUTQOASA-N 435.620 4.126 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(=O)NC)C1 1514200273 ZRFNZRBXKWPCCE-VMLCMGRWSA-N 446.599 4.281 10 10 IICE COCOc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1520056683 NPCLPXJFZSMMQT-PDGQHHTCSA-N 446.525 4.038 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1520962436 UZDXPTGGVLZMCB-HNNXBMFYSA-N 431.499 4.289 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(NC(=O)OC(C)(C)C)CC2(CCC2)C1 1525761949 JCJAQTUXUVRYPO-SFHVURJKSA-N 429.605 4.336 10 10 IICE CC(C)(C)c1nnc(N2CCC[C@H](N3CCCC3)C2)n1CCCSc1nccs1 1541154977 RDNHSCFADCYPAX-KRWDZBQOSA-N 434.679 4.279 10 10 IICE COc1cccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NCc2ccc(N3CCCC3)cc2)c1 1543591604 PHDIKYYYVWGTLW-JOCHJYFZSA-N 439.556 4.178 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1ccn(-c2ccccc2C(F)(F)F)n1 1544409850 VGFYZYOSYAZNAO-UHFFFAOYSA-N 446.498 4.374 10 10 IICE COC(=O)c1ccc(C)c(OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)c1 1559360576 VKQOVNMJTONOJI-UHFFFAOYSA-N 435.476 4.222 10 10 IICE O=C(C/C=C\c1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1566023203 OHAAPMQYNHTXHD-UPHRSURJSA-N 447.348 4.269 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1 1567106526 JLTBYBFRDRUMHL-QFIPXVFZSA-N 435.955 4.498 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3c(Cl)cccc3Br)C2)cc1 1584444000 BUSNHSMBGVKPFN-AWEZNQCLSA-N 437.765 4.296 10 10 IICE COC(=O)/C=C\c1ccc(N(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)c([N+](=O)[O-])c1 1611817970 KCNNAHRXNAYQIT-SDQBBNPISA-N 438.459 4.379 10 10 IICE Cc1cc(C(=O)N2CCN(c3nc(F)c(F)cc3F)CC2)c(C)n1-c1ccc(F)cc1 1615210430 DNEZMOGFNOZAMT-UHFFFAOYSA-N 432.421 4.008 10 10 IICE Cc1ccc(C(=O)NC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)cc1-n1c(C)cc(C=O)c1C 1625096945 SSXXSHWFIQUUNB-JYFHCDHNSA-N 434.511 4.250 10 10 IICE Cc1cc(CC(=O)N2CCC(C(=O)NCCc3cccs3)CC2)c(C)n1-c1ccccc1 1627122580 YMMLWIISOQMPQI-UHFFFAOYSA-N 449.620 4.296 10 10 IICE CCCCNC(=O)[C@@H]1CCCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1627292880 XOMDCNIMSDOLFL-LJQANCHMSA-N 429.992 4.445 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2oc3ccccc3c2Br)N(C)C)cc1 1627465313 ZAPOEBYDTUUOLS-KRWDZBQOSA-N 430.346 4.294 10 10 IICE CCc1ccc2c(c1)[C@@H](CCNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)C(=O)N2 1629322134 AHQHAWTUATZEMM-HXUWFJFHSA-N 429.520 4.325 10 10 IICE COc1ccc(N2CCCN(C(=O)c3nccnc3SCc3ccccc3)CC2)cc1 1630713223 CAFODAVINLWQIS-UHFFFAOYSA-N 434.565 4.130 10 10 IICE CC[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc2ccccc12 1638485016 QWDKGFMIGQWXOB-RUZDIDTESA-N 444.579 4.492 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1638649608 KQSKDYKAMYIYRV-HXUWFJFHSA-N 431.536 4.172 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)cc1 1654114114 FOSOQDNPNNFCID-HHHXNRCGSA-N 443.591 4.238 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCCCN(Cc3ccc(N4CCOCC4)cc3)C2)C1 1655587071 NVBLYIWNSYXUQB-VWLOTQADSA-N 429.605 4.136 10 10 IICE CC(C)c1ccc(O[C@H](C)CNC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1672572254 QBYAISNPGBUTSQ-NTKDMRAZSA-N 426.605 4.245 10 10 IICE C[C@@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(-n2cccn2)c(F)c1 1672977900 BBVRZKPAARVVSV-XLIONFOSSA-N 438.503 4.169 10 10 IICE Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1685328217 SUPOEGJEQSDEAT-JWQCQUIFSA-N 448.611 4.174 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC3(C)CCOCC3)CC2)cc1 1711865137 JWFUOONHGQMJNC-UHFFFAOYSA-N 441.620 4.019 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2noc3c2COCC3)n1CCCSc1nccs1 1727056330 ZSUDSDDEWLCYMS-CQSZACIVSA-N 448.618 4.127 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C(C)C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1761676365 HDHHHIVIPKDKEI-OAQYLSRUSA-N 448.615 4.313 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCN1CCc2sccc2C1 1767113716 VBUFLJALHJEAMV-UHFFFAOYSA-N 439.629 4.329 10 10 IICE CO[C@H](CCn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)C(F)(F)F 1768068581 RJWCLLIUOXOABI-QGZVFWFLSA-N 440.491 4.240 10 10 IICE Cc1cc(OCC(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)ccc1Cl 1865928643 LVBFFSKONPAVQM-HSZRJFAPSA-N 429.992 4.437 10 10 IICE CC(C)(C)OC(=O)NC[C@H](CNCc1cc(Br)cc(F)c1O)C(F)(F)F 2105247049 IMTBYIJKFQXIOD-JTQLQIEISA-N 445.251 4.087 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNCc1cc(Br)ccc1O)C2 2126080571 APGOEETYMSYYDS-VBQJREDUSA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1O 2236048683 GIYDTJVJBMZSPV-NNZMDNLPSA-N 431.374 4.449 10 10 IICE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCc1c(Br)ccc(OC)c1O 2236054297 HBODBDNQYUFMFK-CJNGLKHVSA-N 443.382 4.289 10 10 IICE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCc1c(Br)ccc(OC)c1O 2236054298 HBODBDNQYUFMFK-CZUORRHYSA-N 443.382 4.289 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2ccccc2F)c1C 2294037469 IHHLMAHPYOQRDU-LJQANCHMSA-N 438.499 4.085 10 10 IICE Cc1ccc(N2C(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4C)o3)C(=O)NC2=S)cc1 2294259035 CFBOTFZBWNRMLJ-UHFFFAOYSA-N 447.472 4.303 10 10 IICE COc1ccc(Cl)cc1-n1c(C)cc(C=C2C(=N)N3N=C(C)SC3=NC2=O)c1C 2297470376 IJECVXUQDNKLTQ-UHFFFAOYSA-N 427.917 4.395 10 10 IICE O=C(COc1cccc(C=C2SC(=S)NC2=O)c1)Nc1cccc(C(F)(F)F)c1 2314835845 SYWUUCXCIDXZGO-UHFFFAOYSA-N 438.452 4.212 10 10 IICE O=C(O)CCCCCN1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323809101 WBDRPYWMHUIFRF-UHFFFAOYSA-N 432.336 4.434 10 10 IICE COC(=O)c1sc2ncnc(Nc3cccc4c3C(=O)c3ccccc3C4=O)c2c1C 20161731 HWCCJYJDUSEKQU-UHFFFAOYSA-N 429.457 4.305 10 10 IICE O=C1N=C(N2CCC(Cc3ccccc3)CC2)S/C1=C/c1ccc(N2CCOCC2)o1 205771710 PEONMFWHQBXNMQ-HEHNFIMWSA-N 437.565 4.041 10 10 IICE CCCCOc1ccc(/C=C2/SC(=S)N(c3ccccc3C(N)=O)C2=O)cc1OC 210221778 XFFXYKDNGWBAHO-CPNJWEJPSA-N 442.562 4.379 10 10 IICE Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 745647072 IMFLQMZZRZHJBP-AOMKIAJQSA-N 429.536 4.371 10 10 IICE CCCN(Cc1cccc(Br)c1O)C1CCN(c2cc(C)nc(C)n2)CC1 769423951 XHHZBDYUNKPLKE-UHFFFAOYSA-N 433.394 4.443 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c1 804201893 WZFAIYXNJPHDGO-GOSISDBHSA-N 435.490 4.323 10 10 IICE C[C@H]1CN(c2ccccc2NC(=O)NCc2cc(Br)ccc2O)C[C@H](C)O1 806217675 NXWBXRVADUCOKS-KBPBESRZSA-N 434.334 4.090 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(C(F)(F)F)c2)n1C[C@@H]1CCCO1 812306972 KOCUBDXHJMMGCR-SFHVURJKSA-N 432.446 4.485 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3nnc(SCc4ccccc4)s3)CC2)cc1 915310733 DHTIGGJSJMZZMK-UHFFFAOYSA-N 441.582 4.193 10 10 IICE CC1=NN(c2ccc(C)cc2)C(=O)/C1=C/Nc1c(C)nn(-c2ccc([N+](=O)[O-])cc2)c1C 1084508149 FECPUPPQWYPURN-FYJGNVAPSA-N 430.468 4.424 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 1124623359 SHNQIUKXWUPRGT-UHFFFAOYSA-N 429.446 4.159 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)c(O)c3)cc2F)C[C@@H](C)O1 1141901354 GFCHRAYBIILTCX-CHWSQXEVSA-N 426.410 4.094 10 10 IICE C[C@H](COCC1CCCCC1)N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1176345440 NWGNBLNAKQQIIX-QZTJIDSGSA-N 448.563 4.364 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@]3(C)Cc3ccc(F)c(F)c3)C2)cc1 1230858188 IWMSIZOJSQUBIJ-KOSHJBKYSA-N 429.511 4.359 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3c(C)cc(C)cc3C)C2)sc2c1CCCC2 1264290805 XRCPPHQFJQEEQA-INIZCTEOSA-N 440.565 4.330 10 10 IICE CCOC(=O)[C@@H]1[C@H](C)C[C@H](C)N(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@@H]1C 1289761611 JEDSLJMXKATYLK-QIEVIBBNSA-N 428.573 4.343 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(C)(=O)=O 1294234410 IWOBPLMFVMUBLG-UHFFFAOYSA-N 443.617 4.024 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)N(C)C)cc1 1312342145 MJBSYXGHONINBB-SFTDATJTSA-N 428.552 4.096 10 10 IICE COC(C)(C)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1315138105 CQDQVKOHPRHAPE-NRFANRHFSA-N 427.593 4.181 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1 1465849137 PMFPWIPDRAJBQV-QGZVFWFLSA-N 446.263 4.126 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(I)cc1O 1467497558 KXZRFGFPBXQARI-UHFFFAOYSA-N 425.266 4.145 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CO)c3ccccc3OC(F)(F)F)c2C)cc1 1467754787 JWHQBERHUQDHMI-HXUWFJFHSA-N 448.441 4.465 10 10 IICE COC(=O)c1sc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)nc1C 1472482637 OZAJJCXWBHFWRL-UHFFFAOYSA-N 449.330 4.055 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)[C@@H](O)Cc3ccccc3)cc2Cl)C1 1478529241 XPHAYMKMEHQDFU-PNCHPQGNSA-N 429.992 4.368 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C(C)(C)C 1501853566 NCQORAFIEPWKNC-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccco2)n1Cc1ccc(N2CCSCC2)cc1 1509137222 JOBYQBWBWOFGOS-UHFFFAOYSA-N 425.602 4.308 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1cc(Cl)ccn1 1510673908 OUNLUFZHDSJODT-UHFFFAOYSA-N 435.963 4.381 10 10 IICE Cc1cc(CC(=O)N2CCN(c3ncccc3F)CC2)c(C)n1-c1ccc(Cl)cc1 1521098203 GOOYXLWMXLORMM-UHFFFAOYSA-N 426.923 4.173 10 10 IICE CN(C)CCOc1ccc(/C=C\C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1525593003 DXGYAJGAGTZVAX-ZROIWOOFSA-N 440.499 4.054 10 10 IICE Cc1ccc2c(C(=O)NCc3ccc(N(C)C)c(F)c3)cc(-c3cnn(C)c3)nc2c1C 1527014011 QDDXQDQZNAVDSL-UHFFFAOYSA-N 431.515 4.387 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(C(F)(F)F)c(I)c1 1558456206 VLLMWBYBXJQDTO-KXFIGUGUSA-N 449.166 4.373 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1564555645 WZKANWHFGCUGBF-YLORPAJWSA-N 441.591 4.204 10 10 IICE CC[C@@]1(Cc2ccccc2)CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1565364889 YJIOQDZSHOUQOI-MHZLTWQESA-N 448.611 4.085 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CC(c4ccc(OC)c(C)c4)=NO3)c2C)cc1 1567999335 MDHBLLPRCKUWAA-JOCHJYFZSA-N 447.535 4.343 10 10 IICE CCC(CC)(COCc1ccccc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1583383781 LRNZRRLPFQFCNK-UHFFFAOYSA-N 446.538 4.441 10 10 IICE CO[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccc(Br)s1 1596368467 JTJHPNZWFUBGRM-KRWDZBQOSA-N 441.416 4.068 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CC=CCC2)CCOC1 1610362212 WVFJXMQJADSXAB-NTKDMRAZSA-N 426.561 4.017 10 10 IICE Cc1cc(C(F)(F)F)n2nc(C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)cc2n1 1623477072 OXMWMQMQJVGDOQ-UHFFFAOYSA-N 431.462 4.319 10 10 IICE COc1cc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)ccc1N1CCCC1=O 1623696201 XPGAVHWHLQTGHX-UHFFFAOYSA-N 431.492 4.294 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2cccc(Br)c2O)cc1)[C@@H]1C[C@H]1C 1625066569 LCUIBYYSLKUDQB-KZULUSFZSA-N 432.318 4.238 10 10 IICE Cc1ccc(C(=O)NCc2ccc(OCCN(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1627060403 RGHBXIUVAHBTCL-UHFFFAOYSA-N 433.552 4.085 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 1627980124 GUOGVAQSPMJKOF-QGZVFWFLSA-N 429.520 4.211 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2Cc3ccc(O)cc3N2C(=O)OC(C)(C)C)cc1 1630469823 MFONVMUPLRVFGL-QFIPXVFZSA-N 439.556 4.221 10 10 IICE COc1cccc(CNC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)c3ccccc32)c1O 1631542045 DWLCJFGRTCCDHL-MRXNPFEDSA-N 426.513 4.336 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)NCCOc1ccc(Br)cc1C(F)(F)F 1633228484 QZQQPABMLGJIAY-KXFIGUGUSA-N 446.219 4.088 10 10 IICE Cc1cc(CN2CCC([C@H]3OCCC[C@@H]3NC(=O)OC(C)(C)C)CC2)ccc1N(C)C 1643326394 UOAJWLHXOGYGBQ-JTHBVZDNSA-N 431.621 4.345 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@](C)(COC)C2)sc(C)c1-c1ccccc1 1654520873 CSUSYFUHYVXCHU-HSZRJFAPSA-N 430.570 4.197 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N(C)Cc2ccccc2O)sc2c1CC[C@@H](C)C2 1657599116 DILOAXKSVSBPOB-CABCVRRESA-N 430.570 4.214 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@]3(C)C3CCCCC3)cc2F)C[C@@H](C)O1 1659918953 UDCFRSPRVNIMBM-CEYNDMKZSA-N 431.596 4.100 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(CCN(C)C(=O)OC(C)(C)C)C(C)C 1673745490 UZTZCZCCTJCEMM-IBGZPJMESA-N 434.625 4.279 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 1673745497 VCUVZYGPHVGYDA-SDUSCBPUSA-N 434.628 4.156 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@H](C)Oc3ccc(C(C)C)cc3)CC2)c(OC)c1 1680995158 GDEKCGOBEQIIGB-IBGZPJMESA-N 441.572 4.126 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCCOc2ccc(Cl)c(Cl)c2)N(C)C)cc1 1682759407 NUEVLLALFXIKLD-FQEVSTJZSA-N 439.387 4.040 10 10 IICE Cc1cc(CNC(=O)NC[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1 1683307301 CBRRYDGKYBYCNL-QGZVFWFLSA-N 439.581 4.101 10 10 IICE Cc1cc(CCNC(=O)N[C@H](CC(N)=O)c2cccc(Cl)c2)c(C)n1-c1ccccc1 1687218028 ZEVNXMTTYWFTAF-JOCHJYFZSA-N 438.959 4.206 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1709197160 APVNYQYLUPXVCP-JPYJTQIMSA-N 448.615 4.456 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)n1 1725966179 UZLCDRRKOJXJOV-UHFFFAOYSA-N 439.583 4.020 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2cnn(CC)c2)cc1 1764934701 DJFHUSUAAMOWRV-UHFFFAOYSA-N 432.576 4.021 10 10 IICE CCC(CC)C(=O)Nc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccn1 1860500632 NPOCPRFOLYIKBZ-UHFFFAOYSA-N 441.487 4.484 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C3(C)CC3)c(C(=O)O)c2I)cc1C 2080009313 YYKXOZICTAOELK-LLVKDONJSA-N 440.281 4.169 10 10 IICE Cc1ccc(Oc2nc3ccccn3c(=O)c2C=C2SC(=S)N(C(C)C)C2=O)cc1 2296731375 SHHBOIDGSQQIFS-UHFFFAOYSA-N 437.546 4.405 10 10 IICE COc1ccc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccc(F)cc3)C2=O)cc1OC 2314837652 VKGVLGSPKWUAHA-GFCCVEGCSA-N 446.525 4.071 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(NC(=O)Nc4ccccc4)s3)CC2)cc1 97133621 ACFNZRKGJOKUEQ-UHFFFAOYSA-N 436.537 4.363 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CC(=O)N(C)C3CCCCC3)no2)C1 561920180 UVQWJXQGFRUZQC-UHFFFAOYSA-N 449.599 4.173 10 10 IICE O=S(=O)(Nc1nc(-c2cccc(F)c2)cs1)c1cc2c(cc1Cl)OCCO2 727244861 JSCNFXGTYVPUEA-UHFFFAOYSA-N 426.878 4.175 10 10 IICE Cc1ccccc1-c1csc(NS(=O)(=O)c2cc(C(=O)N(C)C)ccc2Cl)n1 747750351 RGRWHZSWMCFXAR-UHFFFAOYSA-N 435.958 4.275 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(C(=O)N[C@@H](C)C(C)C)CC3)c2C)cc1 748775748 WTWNXXOXYUWLLW-SFHVURJKSA-N 425.573 4.116 10 10 IICE CCC(=O)Nc1ccc(C)c(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768870496 BIPYQKLVZDRDEX-UHFFFAOYSA-N 449.599 4.197 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)Nc3ccc4c(c3)CCCO4)cc2Cl)C1 800636667 NAEPKOQMCJTUAB-MRXNPFEDSA-N 441.959 4.156 10 10 IICE CN(Cc1ccccc1O)c1nnc(CN2CCCc3ccccc32)n1C[C@@H]1CCCCO1 812433252 JEZIOHGXKUXXAJ-QFIPXVFZSA-N 447.583 4.142 10 10 IICE COC(=O)[C@@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c2ccccc2O1 1124798549 CDASCBSNCJJRCO-QFIPXVFZSA-N 438.911 4.257 10 10 IICE COc1cc(N2CCN(C(=O)[C@@H]3CCC[C@H]3Cc3ccccc3)CC2)cc(OC)c1OC 1127931917 GQYHZCFKBGAEFF-RBBKRZOGSA-N 438.568 4.020 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC[C@@H]1[C@@H](C)Nc2ccnn2[C@@H]1C 1137350543 PNRNADQWAWHAQO-CKEIUWERSA-N 435.366 4.171 10 10 IICE C[C@@H](Cn1ccc2ccccc21)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348081 NEZWJJVWACSESU-UWJYYQICSA-N 425.960 4.417 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCC1(OCCO)CCC(C(F)F)CC1 1164261458 RDEGZFHAARWIEB-UHFFFAOYSA-N 448.466 4.441 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CC(C)(C)Oc4cc(F)ccc43)C2)cc1 1224641355 JWPFTWUCHMVLJN-IERDGZPVSA-N 427.520 4.262 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1 1230809656 SHCMNRSRGBGQJW-GHTZIAJQSA-N 433.911 4.043 10 10 IICE COCC1(C)CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1301076553 FPLRAZOVNZGLNN-UHFFFAOYSA-N 425.621 4.259 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)CCCC1 1353974709 WCNIQROVYJEOAD-UHFFFAOYSA-N 448.491 4.164 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCc2cc(F)ccc21 1434874075 VIXWWRUSWUVZLR-PYJSORCASA-N 444.528 4.360 10 10 IICE CCOc1ccc(N2CCN(C(=O)COc3ccc(Oc4ccccn4)cc3)CC2)cc1 1446414092 DMTLTEOZCBHBRL-UHFFFAOYSA-N 433.508 4.000 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(Oc4ccc(OC)cc4)cn3)CC2)cc1 1446420714 QVLXJDRMEWIFIU-UHFFFAOYSA-N 433.508 4.244 10 10 IICE CCOC(=O)C(C)(C)c1csc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1450834238 ZUNSNTWMHYEUHK-UHFFFAOYSA-N 439.537 4.456 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)Sc3ccc(Br)cc3)C2)cc1 1461493867 IUDMEAXCXMYECP-HOCLYGCPSA-N 435.387 4.333 10 10 IICE CC(C)(C)OC(=O)Nc1cccc(C2CCN(C(=O)Cc3ccc(O)c(O)c3)CC2)c1 1468817995 BEZYVBAVEDSOCW-UHFFFAOYSA-N 426.513 4.394 10 10 IICE Cc1cc(C(=O)N2CC[C@@](C(N)=O)(c3ccccc3)C2)c(C)n1-c1cccc(C(C)C)c1 1469027338 YMJCZIDREWYKHJ-MHZLTWQESA-N 429.564 4.487 10 10 IICE CC(C)(C)c1ccc(C[C@]2(C)CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 1469900437 JZNXUOVXYFDICQ-DEOSSOPVSA-N 444.597 4.299 10 10 IICE CCS[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473396388 BEKFZUXAONKKLM-KBJGYGKASA-N 436.577 4.443 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 1478538824 ZDQBOGZNZNQFFK-KESTWPANSA-N 447.501 4.412 10 10 IICE C[C@H]1CCN(c2nnc([C@@H]3CCO[C@H]3C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1494034539 WOZFEPXOFQUUPT-YRISNDGFSA-N 429.584 4.296 10 10 IICE CCc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1Br 1528260982 BWAIAGIHYZXUGN-UHFFFAOYSA-N 439.300 4.056 10 10 IICE C[C@@H](NC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O)c1ccc(N(C)C)cc1 1529467503 MMBJHLUPZQINJL-QGZVFWFLSA-N 427.504 4.040 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)cc1 1530325376 XQUYLVXLHYGXGF-KRWDZBQOSA-N 443.510 4.289 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc4ccc(Br)cc4s3)cc2)CC1 1536924672 KYUZESGEVRPOND-UHFFFAOYSA-N 444.398 4.346 10 10 IICE COC(=O)CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)C[C@H](C)C2 1540610197 LZFVIBWSBTYXAH-BYFYWULKSA-N 443.547 4.327 10 10 IICE CCN(CC)CCC[C@@H](C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1543407144 XWIJKSHWUPSJDZ-OAHLLOKOSA-N 435.410 4.492 10 10 IICE C[C@H]1CCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C[C@@H]1C 1544425881 HPTLNJDQHPGDAI-IRXDYDNUSA-N 428.631 4.385 10 10 IICE COC(=O)c1ccc(OC)c2c1CCN(C(=O)c1cc(C)ccc1-n1c(C)ccc1C)C2 1558190464 BAMYGWHIUNCPEK-UHFFFAOYSA-N 432.520 4.396 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CC[C@@H](c2cccc(Cl)c2)C1 1564908790 XGEQFFILFNPBRO-CTNGQTDRSA-N 427.976 4.437 10 10 IICE CCOC(=O)[C@]1(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CCc2ccccc21 1565793288 CSGZGMNPASMNHI-MHZLTWQESA-N 444.531 4.350 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(Br)cc1N 1566306675 SFRVADHMEZFPFK-UHFFFAOYSA-N 428.124 4.162 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(C(F)(F)F)cc4)CCC3)CC2)c(OC)c1 1595996208 CFTXBYZSRZLQLR-UHFFFAOYSA-N 448.485 4.493 10 10 IICE C[C@@]1(C(F)(F)F)CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1597098522 CIONALUZSQGPTF-RXEWJAMOSA-N 446.491 4.218 10 10 IICE COc1ccncc1Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1619472673 VVVXPQSHENHBSN-UHFFFAOYSA-N 434.588 4.165 10 10 IICE CCN(Cc1nc(O)c2ccccc2n1)C(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1623514363 FNOQBSMZYVNGLS-UHFFFAOYSA-N 428.492 4.218 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC([C@H](O)c3ccnn3C)CC2)c1 1630178234 PCYYMPHRAVJVCA-QFIPXVFZSA-N 426.948 4.067 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc2cc(O)c(O)cc2s1 1635947252 SKEZNTPLAVEWNJ-HNNXBMFYSA-N 432.929 4.066 10 10 IICE COC(=O)c1cnc(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)s1 1638442386 YKADXMWWIXSHAR-UHFFFAOYSA-N 448.342 4.030 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3ccsc3)n2)c(C)n1-c1ccc(OC(F)F)cc1 1640786585 FMFLGDJCHDTYEV-UHFFFAOYSA-N 429.452 4.293 10 10 IICE CC(C)(C)Sc1c(F)cc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1F 1641069295 OACSUYXDQCDFCM-UHFFFAOYSA-N 430.498 4.185 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3c(Br)cccc3=O)c2C)cc1 1643968047 RFAWPHHVBNOQFD-UHFFFAOYSA-N 429.314 4.300 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c(O)cc(Cl)cc3Cl)cc2F)C[C@@H](C)O1 1648474121 ABVGTHULDGZWDR-TXEJJXNPSA-N 427.303 4.382 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CSc3nnnn3-c3ccc(O)cc3)c2C)c1 1651608799 ISFDGIGMIDRPNR-UHFFFAOYSA-N 433.537 4.367 10 10 IICE CC(C)N(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccc(F)c1 1659506854 LDUXJNGSJIIZHB-QZTJIDSGSA-N 431.527 4.110 10 10 IICE CC(C)[C@@](C)(Cc1ccccc1)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1673472505 ONVJVHGRWXISPR-XMMPIXPASA-N 431.527 4.258 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CC(C)(C)Oc3ccc(F)cc32)N(C)C)cc1 1674160887 JWYGDMUDMREWSL-SFTDATJTSA-N 428.552 4.096 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 1683253293 GTTWMGLTAQYSLS-PMACEKPBSA-N 446.636 4.281 10 10 IICE COC(=O)c1cnc([C@@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)s1 1683476099 UPGNISYTSYAAOS-OAHLLOKOSA-N 442.541 4.062 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1708574683 NMLUTBMGKHHKBR-WXTAPIANSA-N 448.615 4.313 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(CC)CCCC1 1728983206 YEJOHTXLZNTXGT-UHFFFAOYSA-N 441.620 4.258 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)N1CCC(C)CC1 1730964233 HOPONDWEDIOKIN-HXUWFJFHSA-N 436.604 4.471 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCCS1 1741433454 KKHZRDZFTDGIHQ-QFIPXVFZSA-N 443.661 4.235 10 10 IICE C[C@H]1C[C@H](C)CN(CCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1762728716 IKFYYTHBCLGNCD-PMACEKPBSA-N 434.588 4.050 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCOC1 1768104524 LNDPBDYTWXYPBT-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1768158863 BSYMLTSZZQYGCQ-XMMPIXPASA-N 441.551 4.495 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@@H](C)C1 1771095497 RBFIRMKGOWITKB-SFGWALBWSA-N 445.583 4.024 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)c4cc(Cl)c(C)cc4oc3=O)CC2)cc1 1866413658 UITFPSMFSFNWNN-UHFFFAOYSA-N 426.900 4.034 10 10 IICE COc1ccccc1NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CC2)C1=O 1873422317 QQHQFWWNIVSQOP-UHFFFAOYSA-N 427.504 4.457 10 10 IICE COc1ccc([C@H](n2nc(C(C)(C)C)c(C(N)=O)c2Br)C2(C)CC2)c(O)c1 2080056260 QQQZQQFGEHWLJB-INIZCTEOSA-N 436.350 4.146 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NCc2c(O)cccc2Br)C12CCC2 2118412399 AYMXHGLTJBRQFC-SUMWQHHRSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)NCC1CC2(C1)CC(NCc1cc(Br)cc(F)c1O)C2 2164526360 ZEVRLDGYTAAZBY-UHFFFAOYSA-N 443.357 4.467 10 10 IICE CCN(CC)c1ccc(C=C2SC(=S)N(C(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 2297578834 QEWASRXNYHMLGL-UHFFFAOYSA-N 441.534 4.483 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3C[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352670650 JTTYOPLJYXHIKT-BPUTZDHNSA-N 425.367 4.198 10 10 IICE Cc1ccc(CN[C@@]23CCCN(C(=O)OC(C)(C)C)C[C@H]2C3)c(O)c1Br 2352945052 QADNWEZJNKWNGZ-FOIQADDNSA-N 425.367 4.342 10 10 IICE O=C(Cn1ncc(=O)c2ccccc21)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 57770798 NISIPDLKTHNYCL-MHZLTWQESA-N 435.483 4.161 10 10 IICE O=c1cc(CN(Cc2ccccc2O)C[C@@H]2CCCO2)c2ccc(Br)cc2o1 96971043 KJLYUTQZTPJVRK-SFHVURJKSA-N 444.325 4.442 10 10 IICE CC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C\c1ccc(-c2ccc3c(c2)C(=O)OC3)o1 113867525 BUNBCDJWRDZBPF-ODLFYWEKSA-N 428.400 4.121 10 10 IICE O=C(Nc1cccc(C(=O)N2CCCC2)c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 586716693 DSSXJQJDVFXMSW-UHFFFAOYSA-N 439.471 4.342 10 10 IICE COC(=O)c1cccc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1C 726695167 CZCUKEIWTGVMNR-UHFFFAOYSA-N 433.455 4.174 10 10 IICE Cc1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)c(C)n1-c1ccccn1 742127476 XYCHMRYSYHYQTM-NRFANRHFSA-N 434.540 4.485 10 10 IICE CN1CC[C@@H](NC(=O)NCCCSc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 755083236 JEQBQSLZLHBSEF-CVEARBPZSA-N 428.986 4.162 10 10 IICE CC(C)n1ncc2cc(NC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)ccc21 768900778 IDHXHQJEXDDHFK-UHFFFAOYSA-N 446.599 4.471 10 10 IICE Cc1ccc(/C=C/C(=O)Nc2cccc3c2OCCN3C(=O)/C=C/c2ccc(C)nc2)cn1 791079039 XVTBKRHQPNBTQX-DCIPZJNNSA-N 440.503 4.184 10 10 IICE C[C@@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)c1ccc(N2CCCCC2)c(F)c1 800993693 MSHJKKRVZQHDFB-TZIWHRDSSA-N 425.548 4.147 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCCN(C(=O)NCc3ccc(N4CCCC4)cc3)C2)C1 804966632 CPKFMPUTDKMXEP-RUZDIDTESA-N 442.604 4.219 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2C[C@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1C 807705489 JKWFUPOHBSYIDL-SFTDATJTSA-N 443.547 4.052 10 10 IICE CCOc1ccc([C@@H](O)C2CCN(c3ccc(/C=C\C(=O)OC)cc3[N+](=O)[O-])CC2)cc1 812482420 WXHWVYXSZUJNQU-ZGDJEKQGSA-N 440.496 4.130 10 10 IICE CC(C)NC(=O)[C@@H](C(C)C)N1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1081156728 ACODGNACFTUZCN-AAWPKVBNSA-N 441.416 4.200 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 1136446001 SGDDQTNCIBASFU-SFHVURJKSA-N 437.490 4.441 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)Cc3ccccc3Cl)CC2)cc1 1142389307 BSKJHIDTUAOPML-UHFFFAOYSA-N 435.955 4.275 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCCCc4ccccc43)cc2F)C[C@@H](C)O1 1191781243 ORKYANSGISWPCH-WOJBJXKFSA-N 439.575 4.289 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)N(C)C)cc1 1289599441 BOEQZJUWHIWVIF-QHCPKHFHSA-N 448.523 4.486 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)C[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1292016516 GFOQGVJSQROTHA-HDICACEKSA-N 440.636 4.102 10 10 IICE COC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cn1 1295536611 PPPSUNWQIDSMRR-UHFFFAOYSA-N 428.286 4.291 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CC(OCC)C1 1306778204 BZVYJBIELKFQKB-UHFFFAOYSA-N 437.588 4.129 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3=C(c4ccccc4)SCCO3)cc2F)C[C@@H](C)O1 1441780414 FLAXVWSEUJYAHB-CALCHBBNSA-N 442.556 4.188 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1=C(c2ccccc2)SCCO1 1445883845 OHCSSSRGVBFHJM-IBGZPJMESA-N 444.984 4.258 10 10 IICE Cc1cc(C(=O)NCC[C@@]2(O)C(=O)Nc3ccccc32)c(C)n1-c1cccc(C(C)C)c1 1455308508 HEWIWSZEELDCKM-SANMLTNESA-N 431.536 4.177 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)Nc1ccc(N2CCCCC2)nc1 1459688703 CLTVRFDQXZVXQP-UHFFFAOYSA-N 434.462 4.362 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C 1463782449 COIXKKSVGOOZMG-NRFANRHFSA-N 447.645 4.378 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccn(-c3cc(F)cc(F)c3)n2)cc1 1464603056 ITFGKNWCLMLTII-JOCHJYFZSA-N 440.494 4.038 10 10 IICE COc1cccc([C@H]2CN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CCO2)c1 1470968760 HHCVURAGULHJCK-RUZDIDTESA-N 433.552 4.428 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)[C@@H](OC)c3ccccc3Cl)C2)cc1 1478466436 ITPHTRFWRHRKAX-GSHUGGBRSA-N 431.964 4.250 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1500619694 YTFDJMKNRZFZRP-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CC(C)(C)Cc1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1508609095 QYQZRIJHAZZKQF-UHFFFAOYSA-N 443.661 4.083 10 10 IICE CC(C)CCOC1CCN(c2nnc(C3CC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1509339200 SHVFFBWNRMEUHA-UHFFFAOYSA-N 429.584 4.440 10 10 IICE Cc1ccccc1-c1nnc(N(C)C[C@H]2CCOC2)n1CCCSc1nccs1 1511245662 RFCYNUGNZHGIOZ-QGZVFWFLSA-N 429.615 4.365 10 10 IICE COCCCCn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1519032977 DQDYVIXEGDHWMW-UHFFFAOYSA-N 427.593 4.088 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1-c1cccc(C)c1 1526004345 ZXTGTWKNHNJGHF-UHFFFAOYSA-N 436.531 4.039 10 10 IICE Cc1cc(CNC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)c(C)n1-c1ccccc1 1544081104 RGQVXRSAALPJEO-QGZVFWFLSA-N 428.529 4.102 10 10 IICE CC(C)(C)OC(=O)[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(C)(C)C 1545632274 HCXXDDGSIPWTBN-MJGOQNOKSA-N 438.996 4.130 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1556260631 OWIRVMYZUYMBKT-GOSISDBHSA-N 437.565 4.353 10 10 IICE Cc1ccccc1-n1nc(C(=O)NCc2cccc(Br)c2O)c2c1CCC2 1556480574 XMZUQGSKQPGGDY-UHFFFAOYSA-N 426.314 4.068 10 10 IICE Cc1cc(CC(=O)NC[C@H](c2ccccc2)c2nc[nH]n2)c(C)n1-c1ccc(Cl)cc1 1556594231 UMDSWWWRJKGQCV-JOCHJYFZSA-N 433.943 4.356 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CO[C@@H](CN3CCCc4cc(OC(F)F)ccc43)C2)C1 1559605357 OSEDKYRYJZPGGA-WZONZLPQSA-N 438.515 4.457 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2ccc3c(=O)cc[nH]c3c2)cc1 1564891833 BZXNETBPZKWBQX-UHFFFAOYSA-N 430.508 4.099 10 10 IICE CCN(Cc1ccccc1Br)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1565126651 AVYRBWAUNHNJES-UHFFFAOYSA-N 446.389 4.142 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(CCc3ccccc3)Cc3ccccc3)cc2)CC1 1565271877 ZJCJQAKNLVLBNB-UHFFFAOYSA-N 442.607 4.393 10 10 IICE CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1583700010 PMBWLALXENHIML-XXBNENTESA-N 428.621 4.292 10 10 IICE COc1ccc(CN2CC[C@@H](NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2=O)cc1 1586090845 FLLPUWZHMWIEHE-RUZDIDTESA-N 445.563 4.250 10 10 IICE Cc1ccc(CN2CCO[C@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)cc1 1587510961 MCWIXEFVDRAVRE-XMMPIXPASA-N 435.543 4.172 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N2CCCC2)c(C)n1-c1cccc(C(C)C)c1 1587610681 APRCQUSZHPKQIK-JOCHJYFZSA-N 425.598 4.355 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)CC2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1613532282 LAYUYXXHKCNJSN-UHFFFAOYSA-N 444.599 4.076 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@H]2C(=O)Nc3c(Br)cccc32)cc1F 1616923944 CHCRDSQRQLNMGC-OAHLLOKOSA-N 448.336 4.177 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1c(F)cccc1F 1618101675 OLTXAAVRSIMEAC-AWEZNQCLSA-N 434.442 4.199 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC(Cc2ccccc2)C1 1624206075 BBLWFZJAFTVOHT-DEDYPNTBSA-N 440.565 4.118 10 10 IICE Cc1cccc(C(C)(C)CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1626033333 HIRPNZIVTCLMFS-UHFFFAOYSA-N 444.578 4.271 10 10 IICE CC(C)(C)c1ccc([C@H](O)CCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1626155010 SCBFXUXQVRUKIK-HSZRJFAPSA-N 428.548 4.090 10 10 IICE CCOC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)Cc1ccccc1 1626890588 CTAPNEAZRZZHPC-NRFANRHFSA-N 434.536 4.255 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2CCC(C(C)(C)O)CC2)NC(=O)OC(C)(C)C)cc1 1628495918 PQJKJJFYWADBJW-GZNCHQMQSA-N 447.620 4.012 10 10 IICE Cc1nc(CCCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cs1 1629679096 KTZBCMVVHZFYLM-HXUWFJFHSA-N 446.617 4.222 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccc(O)c4)CC3)cc2Cl)C1 1634719622 AYZMEBZORKCACW-GOSISDBHSA-N 442.991 4.314 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@H](C)N(C(=O)c1cc(C)n(-c3cccc(Cl)c3)c1C)C2 1635115619 FEOKRDSKQIDZKH-HNNXBMFYSA-N 440.931 4.165 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 1638348521 SXALCNCCAUKFHW-WMZOPIPTSA-N 440.540 4.464 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1640260161 SZLLECWKLJFFTH-DLBZAZTESA-N 425.566 4.167 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)CC1CCCCC1 1652332734 CVMUOPMTUZVDSE-BGYRXZFFSA-N 433.612 4.348 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1708721044 CAECHGVNVMXNLD-UHFFFAOYSA-N 444.599 4.076 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1710952485 QCPUMONTGZVDOI-IBGZPJMESA-N 445.677 4.428 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](COC)C1 1728005567 BZCKWUSDXUGSDI-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CC1=CCCN(c2nnc(Cc3csc(C)n3)n2CCCSc2nccs2)C1 1742475697 URFXONVOLFAFSH-UHFFFAOYSA-N 432.644 4.429 10 10 IICE O=C1/C(=C\c2cc(Cl)cc(Br)c2O)SC(=S)N1C[C@@H]1CCCO1 1858587549 KZHAXKNWAJYXTK-YIVIPITNSA-N 434.764 4.188 10 10 IICE CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1860568655 KXRKUKALFLZMTR-UHFFFAOYSA-N 443.459 4.456 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(N3CCN(C(=O)c4ccc(F)cc4)CC3)cc2)c1 1860908001 MIMBDMKRCSSQIS-UHFFFAOYSA-N 446.526 4.106 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2cccc([N+](=O)[O-])c2)cc1 1865677002 QOOBJXBZLNLSSI-PXLXIMEGSA-N 429.432 4.447 10 10 IICE Oc1c(Br)cc(Cl)cc1CN[C@H]1CCOC[C@H]1OCc1ccccc1 1965931099 CMQXWHNMUDLALF-ZWKOTPCHSA-N 426.738 4.272 10 10 IICE CN(C)c1ccc(C=C2SC(=O)N(CC(=O)Nc3cccc(C(F)(F)F)c3)C2=O)cc1 2040489948 IHKZBHLSZFXOLE-UHFFFAOYSA-N 449.454 4.446 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C(C)C)c(CO)c2I)cc1C 2079955890 GLOBOTAXQXCWPR-SFHVURJKSA-N 440.325 4.425 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@@H](NCc2cccc(Br)c2O)C1 2096261481 KEAVWIDAQFNXIC-INIZCTEOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N[C@H](Cc1ccccc1Br)C(=O)NCCCCN=[N+]=[N-] 2237422326 UKYUPMVBEHTBJM-OAHLLOKOSA-N 440.342 4.092 10 10 IICE CN(C)c1ccc(C=C[C@]23NC(=O)CN2c2ccc(Br)cc2C3(C)C)cc1 2297471197 KGZUVUNFFZRBDN-QFIPXVFZSA-N 426.358 4.152 10 10 IICE COc1ccc(OC)c(C=CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)c1 2326807172 IBQBFIVBRPVEPL-DEOSSOPVSA-N 437.584 4.126 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cc(C)ccc3C)C2)sc2c1CCCC2 15464725 CGXOPENESXCBPV-MRXNPFEDSA-N 440.565 4.412 10 10 IICE Cc1cccc(Oc2nc3ccccn3c(=O)c2/C=C2/SC(=S)N(C(C)C)C2=O)c1 33734096 JURCBIQGXFFTQM-SFQUDFHCSA-N 437.546 4.405 10 10 IICE Cc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S 47152173 HTGCJBZBNHBVBQ-ATVHPVEESA-N 427.507 4.133 10 10 IICE CC(=O)N1N=C(c2cccc(Br)c2)O[C@@H]1c1cc(Br)ccc1O 64819686 FEXBYCKGYUQSSP-MRXNPFEDSA-N 440.091 4.156 10 10 IICE CN(C)c1ccc([C@H]2CC(c3ccc(F)cc3)=NN2C(=O)COc2cccc(C=O)c2)cc1 72413290 JVCPAMOYSYQBFE-RUZDIDTESA-N 445.494 4.461 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccccc3OC)SC2=S)cc1 210718130 PJSCMAGIEQZQQK-XMHGGMMESA-N 442.562 4.324 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)c1OC 526400469 KKRGYWVYWGXCID-QFIPXVFZSA-N 433.460 4.481 10 10 IICE CC(C)OC(=O)N1CCC(NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 733048285 REVRMHSCOZIQGW-UHFFFAOYSA-N 442.560 4.067 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc2cc(OC)c(OC)cc2[nH]1 743808446 UUBPJWRWDMSXOC-UHFFFAOYSA-N 433.302 4.316 10 10 IICE Cc1cc(Br)c(O)c(CN2CCCC[C@@H]2c2nnc(C3CCOCC3)o2)c1 752830197 RDCSJRPMCVILJY-QGZVFWFLSA-N 436.350 4.467 10 10 IICE O=C(Cc1c[nH]c2ccc(Cl)cc12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768533945 WJBSZAVRDRYIPX-UHFFFAOYSA-N 436.987 4.212 10 10 IICE CCOc1ccc(OCC)c(NC(=S)NCc2cc(Br)ccc2O)c1 795153214 BSIOOHJXBNATGC-UHFFFAOYSA-N 425.348 4.439 10 10 IICE Cc1noc(C)c1CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)C1 800742222 AAGSFPAGTZHHRD-NRFANRHFSA-N 446.555 4.290 10 10 IICE Cc1cc(CC(=O)N[C@H](C)c2nnc3n2CCCCC3)c(C)n1-c1ccc(Cl)cc1 914605202 AWTGXLUNHGLUKH-MRXNPFEDSA-N 425.964 4.485 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CSc3ccc(Br)cc3C)C2)cc1 1130826710 HPOITSTWKBURKF-INIZCTEOSA-N 435.387 4.253 10 10 IICE CCOc1ccccc1N1C[C@H](C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1131782004 SLVQZVQTZUFINW-JOCHJYFZSA-N 445.563 4.205 10 10 IICE CC(C)(C)O[C@@H]1C[C@H]1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1134542308 PPIMZNAWKXPIPM-UKRRQHHQSA-N 429.318 4.301 10 10 IICE Cc1cccc(-c2nc(C)c(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)[nH]2)c1 1150349097 WJOTXESDZGMGJK-FQEVSTJZSA-N 438.959 4.447 10 10 IICE Cc1c(C(=O)NCc2c(O)ccc3c2CCCC3)c(=O)oc2ccc(Br)cc12 1150378943 YQZWXAYGAFVFGF-UHFFFAOYSA-N 442.309 4.378 10 10 IICE O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1Cc2cccc(O)c2C1 1152564140 DCSUFIIKJAZUPX-UHFFFAOYSA-N 435.402 4.078 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC(Cc4cccc(OC(F)(F)F)c4)C3)C2)cc1 1230858465 KZLHNIMWMNOTBZ-SFHVURJKSA-N 449.473 4.057 10 10 IICE CCN(CCC1CCN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1)CC1CC1 1252114248 BIQNJWMMNLMPSH-QHCPKHFHSA-N 442.648 4.065 10 10 IICE C[C@@H](NC(=O)c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1)c1ccccc1O 1302530191 DTIIEQHDCQZUFF-MRXNPFEDSA-N 445.544 4.125 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H](C(=O)OC(C)(C)C)C(C)C 1312926148 LMFOSPGNURAEEI-MRXNPFEDSA-N 443.382 4.300 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2cc(Cl)cc(I)c2)cc1 1452032371 SHVLYGMPVCWFPN-UHFFFAOYSA-N 442.644 4.037 10 10 IICE Cc1cnc(N2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)s1 1465363983 QGTBAXMMOGGWKF-UHFFFAOYSA-N 428.989 4.404 10 10 IICE COC(=O)C1(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCCC1 1465744762 QYHNYSKGHHKHNO-UHFFFAOYSA-N 433.346 4.320 10 10 IICE Cc1cc(C(=O)N[C@H](C)C[C@H](O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1465805638 OTDHYUKKAGGQHS-VLIAUNLRSA-N 442.357 4.494 10 10 IICE O=C(CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)CC1CCCCC1 1471455354 XBTCIZHPSDLTQK-CPNJWEJPSA-N 448.585 4.073 10 10 IICE CN1CCC[C@H](c2cccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)C1 1472521099 LQECSDPLKLTBDQ-SFTDATJTSA-N 443.538 4.496 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)C[C@@H]3c3ccccc3)cc2F)C[C@H](C)O1 1473455747 OQJVUZDSOSWLRE-GFTAFNIFSA-N 439.575 4.139 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1500703277 PGOGJBOILWVEPQ-NRFANRHFSA-N 438.664 4.174 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2C[C@H](C)S[C@H](C)C2)cc1 1501847030 ALMOZPCMJQMTSN-LVCYWYKZSA-N 429.634 4.354 10 10 IICE CC(C)CCN1CCC(Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)CC1 1509323317 CCWXQYPTGZCTLU-UHFFFAOYSA-N 448.615 4.440 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(CC(F)(F)F)CC2)n1CCCSc1nccs1 1513041670 QXWQECDLKXEJIQ-CQSZACIVSA-N 448.584 4.115 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)CCCC4)cc2F)C[C@@H](C)O1 1516818318 UAAQLUOCNAGACY-QZTJIDSGSA-N 426.532 4.013 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CCC[C@@H](C(F)F)C1 1542226815 KFGZYORLQALBDG-MOPGFXCFSA-N 433.547 4.076 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(O)(Cc2ccccc2F)CC1 1556420583 RTADZROGCFOSJT-UHFFFAOYSA-N 434.511 4.256 10 10 IICE Cc1cc(CN(C)[C@H](C(N)=O)c2cccc(Br)c2)ccc1N1CCCCC1 1559697285 YILBTEFULCQWIL-NRFANRHFSA-N 430.390 4.406 10 10 IICE CCC(CC)(COCc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1566023367 SGALNMLBDDHHGJ-UHFFFAOYSA-N 442.575 4.426 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cnn2ccccc12 1587300184 YHHFVVHVCJCGLL-WJDWOHSUSA-N 428.564 4.016 10 10 IICE CCCCc1nc(C)c(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 1595583995 LAWJEIQTMGWDDG-SFHVURJKSA-N 436.021 4.476 10 10 IICE CC1(C)CO[C@@H](CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1597742063 CFKDAGHWQGLRAJ-LUYJPIOASA-N 438.640 4.051 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N(CC(F)F)C1CCC1 1597971551 LATHQGUECSPLIQ-GXDHUFHOSA-N 430.567 4.376 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCCC[C@H]3C)C2)n1Cc1ccc(N(C)C)cc1C 1613997735 FEVKYCMUYJFMPQ-YADHBBJMSA-N 438.664 4.354 10 10 IICE Cc1cc(C(F)(F)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnc1Cl 1622635238 UTNLYTSFBCLZES-MRXNPFEDSA-N 444.309 4.275 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCSc2ncnc3sc(C)c(C)c23)cc1 1632050045 RJEYHMLDBVKCNC-UHFFFAOYSA-N 444.626 4.394 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccc(Br)cc4)CCC3)C2)cc1 1636853838 LGVIHLOGFFCYDK-SFHVURJKSA-N 444.373 4.415 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@H]3CCC4(CCOCC4)CO3)c2C)c1 1637577604 FESMYBYKNXNLGE-HSZRJFAPSA-N 425.573 4.178 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(CC(=O)NCc3ccc4cccnc4c3O)cccc2C1 1638573476 ZETBGNNBHQJETA-UHFFFAOYSA-N 447.535 4.093 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)c2ccc3c(c2)OCCO3)sc2c1CCCC2 1638778500 HDUVANAPRHEQQC-UHFFFAOYSA-N 443.521 4.176 10 10 IICE Cc1cc(C(=O)Cn2nnn(-c3ccccc3)c2=O)c(C)n1-c1cc(Cl)cc(Cl)c1 1640783072 ACNYPNNFCOFAEJ-UHFFFAOYSA-N 442.306 4.026 10 10 IICE Cc1nc2nc(SCC(=O)c3cc(C)n(-c4ccc(Cl)cn4)c3C)nn2c(C)c1C 1640861235 MNJGAFWOXSKDEH-UHFFFAOYSA-N 440.960 4.481 10 10 IICE CC1CCC(NS(=O)(=O)c2ccc(NCc3ccc(N(C)C)cc3)c([N+](=O)[O-])c2)CC1 1649352124 LHAPRPIPTDXHFA-UHFFFAOYSA-N 446.573 4.130 10 10 IICE COC(=O)c1c(NC(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)sc2c1CCCC2 1657023725 NXCUCLBRDVOOBR-UHFFFAOYSA-N 443.613 4.329 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC(=O)NCc2c(O)ccc3c2CCCC3)C1 1670913215 BJFYQVJIYDHGLF-DEOSSOPVSA-N 431.577 4.107 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H]1c1ccc(F)cc1F 1686725600 OUMSDMAYWJYHGK-HXUWFJFHSA-N 437.437 4.126 10 10 IICE Cc1cc(CCNC(=O)NCC2CCN(Cc3ccncc3)CC2)c(C)n1-c1ccccc1 1686984169 OZIBDWWPTMVAAZ-UHFFFAOYSA-N 445.611 4.243 10 10 IICE C=CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](COC(C)C)C1 1705886194 AARFAOKDFSJMQP-JOCHJYFZSA-N 435.572 4.169 10 10 IICE CC(C)CCN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1706457988 YCHVWXYRKYSPNS-UHFFFAOYSA-N 429.584 4.442 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1708722128 HNKNVBDKZMTWIK-IBGZPJMESA-N 440.636 4.102 10 10 IICE CC[C@H](C)N(C)CCn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727074352 LYMUPRANGIPWCT-FQEVSTJZSA-N 435.620 4.240 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CCOc1cccc(C(F)(F)F)n1 1729418256 BOJLXQZVHADUSL-UHFFFAOYSA-N 449.477 4.410 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)CCO1 1745341155 DBGLDKPIGLJFAQ-QFIPXVFZSA-N 436.604 4.183 10 10 IICE C[C@H]1C[C@H](C)CN(CCCCn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)C1 1762725861 WIQFTHKITZWUMI-PMACEKPBSA-N 436.604 4.373 10 10 IICE COc1ccc(N2CCN(c3nc(Nc4ccc(C)c(C)c4)ncc3[N+](=O)[O-])CC2)cc1 1871303376 XAKLGTOSGIRQTI-UHFFFAOYSA-N 434.500 4.080 10 10 IICE CCCN1C(=O)C(NCc2ccc(OC)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873166310 LFCXZJFGJFQZNP-UHFFFAOYSA-N 443.547 4.382 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2CCC2)c(CN)c1I 2079004588 ATUUHCYMLVUCDI-HNNXBMFYSA-N 425.314 4.227 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@](NCc3cc(Br)ccc3O)(C2)C1 2138714752 FJOZEHCOORHBFX-VBKZILBWSA-N 425.367 4.424 10 10 IICE Cc1c(Cl)cccc1-n1c(C)cc(C=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)c1C 2294581424 VTXCABQQTASRJY-UHFFFAOYSA-N 437.883 4.311 10 10 IICE CC(C)(C)c1ccc(C=C2SC(=S)N(Cc3ccc(S(N)(=O)=O)cc3)C2=O)cc1 2323683584 LFBAQTDJFXWMOX-UHFFFAOYSA-N 446.619 4.033 10 10 IICE O=C1C(=Cc2ccc([N+](=O)[O-])cc2)SC(=S)N1C1CCN(Cc2ccccc2)CC1 2323873959 CNSUNNZVKZWPHV-UHFFFAOYSA-N 439.562 4.461 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H]2CNCc1cc(Br)cc(F)c1O 2330513999 PHKMMXPXIYPSMM-XFJVYGCCSA-N 429.330 4.171 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@H](c2ccccc2Cl)N3)CC1 14466118 JNCQFZUXRIAJTR-YZZKKUAISA-N 444.000 4.103 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)c3ccccc3Cl)c3ccco3)CC2)cc1 38598111 NLTKPPDKDMGKDN-QFIPXVFZSA-N 439.943 4.235 10 10 IICE Cc1c(Br)ccc(N2C(=O)N=C(O)/C(=C\c3ccc4c(c3)OCO4)C2=O)c1C 59859976 RFVJVGSMTUGKBS-NTUHNPAUSA-N 443.253 4.301 10 10 IICE CC[C@@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCCO1)c1cc(Br)ccc1O 390650082 VERGSUJZWHIQFJ-DOTOQJQBSA-N 443.382 4.221 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@@H](C)Cc3ccc(Br)cc3)CC2)cc1 726610376 DVTMTYHGAFXYKF-INIZCTEOSA-N 446.389 4.357 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C[C@@H]2CCCC[C@@H]21 727134557 ZYJSRSINQFTJAR-BVSLBCMMSA-N 427.589 4.471 10 10 IICE C[C@H]1CCc2ccccc2N1C(=O)[C@@H](C)OC(=O)c1csc(Cc2ccc(N)cc2)n1 751930649 GXERSDGMUJSIAR-JKSUJKDBSA-N 435.549 4.229 10 10 IICE Cc1ccccc1-c1csc(NS(=O)(=O)c2cc3c4c(c2)CCC(=O)N4CCC3)n1 758388617 KNUBFJGGOWXSKH-UHFFFAOYSA-N 439.562 4.145 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNc3nnc(-c4ccccc4Cl)s3)cc2)C1 760493133 YGTDLOPBVKEPNF-HNNXBMFYSA-N 427.961 4.172 10 10 IICE COc1cc(Cl)cc(CN2CCC[C@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1O 761213245 DUICPIIMRVTVQI-HNNXBMFYSA-N 432.952 4.286 10 10 IICE Cc1noc(C)c1CO[C@H]1CCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1 762631603 DOJXLLGNEKDWJJ-NRFANRHFSA-N 425.504 4.312 10 10 IICE CSc1nnc(CCCNCc2cc(C)cc(Br)c2O)n1CC(C)C 781629587 KEELXEAUZQIXTO-UHFFFAOYSA-N 427.412 4.155 10 10 IICE Cc1ccc(Cc2ccccn2)cc1NC(=O)NCc1ccc(N2CCOCC2)c(F)c1 801903096 UTSWTWMVWRWANV-UHFFFAOYSA-N 434.515 4.278 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCOCC3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802686818 AZAAASFNHVRJFY-QHCPKHFHSA-N 449.599 4.394 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc([N+](=O)[O-])cc3F)n2)c1C 917869389 PQIXCFBXRFMWJV-UHFFFAOYSA-N 438.506 4.487 10 10 IICE COC(=O)c1ccc(C)c(-c2ccc(/C=C3/C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)c1 1084096042 SMNCXPLFFCRMJE-ZHZULCJRSA-N 444.443 4.050 10 10 IICE COc1ccc(-c2cn(-c3ccccc3)nc2C(=O)NCc2ccccc2O)cc1OC 1115922003 XDXSIQUUPWRLBD-UHFFFAOYSA-N 429.476 4.192 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSc2nc3ccccc3nc2N2CCCC2)cc1 1136299916 ABEJCIJZFOQTCH-UHFFFAOYSA-N 449.624 4.485 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 1137816522 JKEVVHGQEDBGKX-GOSISDBHSA-N 447.491 4.210 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](CO)c2ccc(C(F)(F)F)cc2)cc1 1137982943 LGVSWVAFSLYPFB-JOCHJYFZSA-N 444.453 4.318 10 10 IICE Cc1cc(C(=O)NCCC(=O)NC2CCCCC2)c(C)n1-c1ccccc1Br 1141996195 LZGVEJOTNFVDMI-UHFFFAOYSA-N 446.389 4.425 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2cccc(OC(F)(F)F)c2)cc1 1142712860 IYVVJVPHSVZTDO-NRFANRHFSA-N 436.474 4.402 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1142713313 SWZXOFLRPWRZHF-FDDCHVKYSA-N 426.532 4.308 10 10 IICE Cc1ccncc1/C=C\C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1178393998 BLHIBICTZAKXRI-CTEOGUNLSA-N 425.504 4.273 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N(C4CCCCC4)C3=O)c2C)c1 1188599310 VNSPNLZUYQZDOV-UHFFFAOYSA-N 435.524 4.017 10 10 IICE Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1246508578 LBUIPEGGNSVVPS-OAQYLSRUSA-N 434.506 4.240 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCS(C)(=O)=O 1306665021 QRCNGAMYZPMDDE-UHFFFAOYSA-N 443.617 4.024 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC(C)(C)c3cc(Cl)ccc3OC)C2)cc1 1312902997 RXBFVCUNTLBWKT-INIZCTEOSA-N 431.964 4.418 10 10 IICE C[C@H](Cc1ccccc1F)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1351274664 IVEPQNSINZAGBQ-RMENWYJGSA-N 446.544 4.304 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)no2)cc1 1435334610 VKVOXKLWTNAHKO-INIZCTEOSA-N 443.450 4.350 10 10 IICE Cc1cc(CC(=O)NCc2nc(COc3ccccc3)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1447964980 KDWAJCDIRIXMQL-UHFFFAOYSA-N 449.942 4.304 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3c(O)cccc3O)[C@H]2c2cccs2)cc1 1456235800 OHDLEHYTWOQMMJ-SBUREZEXSA-N 436.533 4.268 10 10 IICE Cc1cccc([C@H](NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C(C)C)c1 1473702668 MESKAPPTFRHVDM-CUVVAGTFSA-N 441.591 4.351 10 10 IICE Cc1cccc(-c2nnc(N(C)CCOC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)n1 1492503796 WIVBSKQZODIUSN-UHFFFAOYSA-N 440.567 4.153 10 10 IICE C[C@H]1CSCCN1c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1494614502 YQTNRUMHYPKDGC-LSDHHAIUSA-N 425.649 4.100 10 10 IICE CCCCN(C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1500377471 PPRJNHFIEDQLAD-UHFFFAOYSA-N 427.524 4.107 10 10 IICE CCc1nnc(N2CCC[C@H]2c2ccc(COC)o2)n1Cc1ccc(N(C)C)c(F)c1 1513894434 UMPNHDXLQKROSI-FQEVSTJZSA-N 427.524 4.175 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1CCC(F)(F)CC1 1513902224 GBEPVEORNGELHC-UHFFFAOYSA-N 433.547 4.391 10 10 IICE CCCN1CC[C@H](Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)C1 1514853963 CNCBLDIXUOBNHT-KRWDZBQOSA-N 440.979 4.067 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C1CCc2ccccc2CC1 1516256000 JSIFNKFSSXRVJX-UHFFFAOYSA-N 432.486 4.353 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(O[C@H]2CC2(F)F)cc1 1533330051 VDGMJPCEOMXEEY-BEFAXECRSA-N 438.421 4.473 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(Br)ccc1C1CC1 1534309744 XUSRMWYJERFUET-UHFFFAOYSA-N 433.321 4.232 10 10 IICE COC(=O)[C@H](Cc1ccccc1O)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1557590487 BPGKSGKNBYABNH-QHCPKHFHSA-N 434.536 4.437 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)COc2ccccc2)c(C)n1-c1ccc(Br)cc1 1566332401 FNOMDWPWUADQHC-LJQANCHMSA-N 443.341 4.026 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCCCC[C@@H]1C(=O)NCc1ccc2cccnc2c1O 1570533776 QAIBEOYDPTYRLG-OALUTQOASA-N 427.545 4.420 10 10 IICE Cc1ccc2nc(COc3ccc(C(=O)NCc4ccc(N(C)C)c(F)c4)cc3)cn2c1 1583753528 WKOMDDWWATZBEB-UHFFFAOYSA-N 432.499 4.357 10 10 IICE CN(c1ccc(CNC(=O)c2ccc(N3CCOCC3)c(F)c2)cc1)C1CCCCC1 1625905501 VNVHLZYUGMCCOT-UHFFFAOYSA-N 425.548 4.361 10 10 IICE CCOC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cn1C 1630297524 JVFFCACYBZLVRW-UHFFFAOYSA-N 445.317 4.019 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2=CCN(C(=O)OC(C)(C)C)CC2)cc1 1631513563 UBSGONIFVKTRNL-UHFFFAOYSA-N 441.494 4.211 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCNC(=O)N3CCc4ccccc4C3)c2C)c1 1631793800 HKEMCVFIQVJTPL-UHFFFAOYSA-N 444.579 4.177 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@H](c2cccnc2)C1 1639866344 QAFBTWLKCGXUIW-JIHKLPAASA-N 443.619 4.141 10 10 IICE COc1ccc([C@@H](NC(C)C)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1641335328 TYURAARPNMYVBX-XMSQKQJNSA-N 447.526 4.121 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1oc(CNC(=O)OC(C)(C)C)cc1C 1642998067 WEMHSJDHILRZJI-QGZVFWFLSA-N 429.561 4.348 10 10 IICE Cc1nc(C)c(Br)c(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1651492100 DDCRKLROTNAYLV-HNNXBMFYSA-N 425.758 4.291 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cccc(S(=O)(=O)Cc2ccccc2)c1 1652705706 MPKADXMZVMWOBO-UHFFFAOYSA-N 431.513 4.449 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3cccc(-c4csc(C)n4)c3)CC2)cc1 1657876433 SOVKOWFIPBGEMR-UHFFFAOYSA-N 436.581 4.278 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC/C=C/c3ccc(Br)cc3)C2)cc1 1682626891 LDXVBHPYLLPYAB-DCKQQPRJSA-N 430.346 4.049 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCO[C@H]3c3ccc(Cl)cc3)C2)cc1 1683504514 VYANYAFQELPTJX-HVETUWLQSA-N 429.948 4.004 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2cccnc2N2CCCC2)cc1 1683775726 GJHGHGVLPUOPMK-UHFFFAOYSA-N 433.556 4.253 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)cc2C)CC1 1711603506 XJRWYMPZRQIIJO-SANMLTNESA-N 448.615 4.082 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCSC1 1750707764 IGPTZCGBIKEVFU-OAQYLSRUSA-N 443.661 4.093 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H](OC)[C@H](C)CC 1763748643 RZADWVFNWIFVEZ-FGSXEWAUSA-N 447.599 4.327 10 10 IICE CC[C@H](NC(=O)/C=C/c1ccc(C(C)C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862143222 LTBUKWPUUIVTDN-HRDREGIBSA-N 449.595 4.075 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@H](CO)C(C)C)c(Br)c1 1915264228 KFJBSKQZFUZYOV-JOCHJYFZSA-N 435.406 4.209 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)[C@H](O)c1ccc2c(c1)CCN2C 1999507079 GCYLQOISKQUTJJ-JJEOQYAHSA-N 426.557 4.211 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(F)(F)F)c(C=O)c1I 2079036651 ZREIOBXSNSTYNP-NSHDSACASA-N 438.187 4.332 10 10 IICE Cc1nn(Cc2ccc(Br)cc2O)c(I)c1C1CC1 2079617200 AZZSGXAQAHKDDB-UHFFFAOYSA-N 433.087 4.190 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(NCc2ccc(Br)cc2O)C[C@H]2CC[C@H]1C2 2131759691 DWQDBJVIBOAAGT-KPHUOKFYSA-N 425.367 4.328 10 10 IICE CSc1ncc(Cn2c(=N)[nH]c3cc(Br)c(Br)cc32)s1 2284692387 GMKPAVYNLOONQH-UHFFFAOYSA-N 434.182 4.201 10 10 IICE Cc1cccc(-n2c(C)cc(C=C3C(=O)NC(=S)N(c4ccc(F)cc4)C3=O)c2C)c1 2294199218 FZLMITFLSNQAJW-UHFFFAOYSA-N 433.508 4.373 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=O)NC(=S)N(c4ccc(F)cc4)C3=O)c2C)cc1 2296930198 GIIFPYPOEZBSON-UHFFFAOYSA-N 433.508 4.373 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC=C[C@H]21 14471231 AVPLTBQWZCPHJR-AUSJPIAWSA-N 427.888 4.451 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1/C=C1/SC(=S)N(CCC)C1=O 33457849 JRAGEIXBNVCPMJ-DTQAZKPQSA-N 430.599 4.216 10 10 IICE CCCCN1C(=O)/C(=C\c2cc3cc(C)ccc3nc2N2CCOCC2)SC1=S 208279905 DYSJCPVHZXROTD-XMHGGMMESA-N 427.595 4.381 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4F)c3C(F)(F)F)CC2)cc1 219393498 HRQNAEUDHHKAOT-UHFFFAOYSA-N 448.420 4.001 10 10 IICE COCCNCc1ccc(N2CC[C@H](COCc3ccccc3)C2)c(Br)c1 384158534 FMCWLDSLCZQHIM-FQEVSTJZSA-N 433.390 4.228 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1 741897929 DQPGPQPNKXFBLT-GOTSBHOMSA-N 432.520 4.449 10 10 IICE CN(C(=O)NCc1ccc(N2CCCC2)cc1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 752645397 CGRZUSMHUCHTDU-CBQGHPETSA-N 442.604 4.359 10 10 IICE FC(F)Oc1ccc(NC(=S)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768293669 CEARHHKESNTQBZ-UHFFFAOYSA-N 446.567 4.307 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccccc3SCc3nc(C)no3)c2)CC1 770146866 ISUQBHCEALHLNC-UHFFFAOYSA-N 437.569 4.065 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(Cl)ccc3OC)n2)cc1OC 783826109 BSFSXQPJWUDNMN-UHFFFAOYSA-N 440.930 4.290 10 10 IICE Cc1cc([C@H](CC(=O)N(C)Cc2ccccc2O)NC(=O)OC(C)(C)C)cc(Cl)n1 788519066 YXKGNSFNXGDLHQ-KRWDZBQOSA-N 433.936 4.364 10 10 IICE Cc1nc(CC(C)C)oc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 789793702 HQGYATXIOYJCPI-LJQANCHMSA-N 444.576 4.243 10 10 IICE O=C(NCc1cc(Br)ccc1O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 807112751 CLNSPJSEFKHTMQ-QGZVFWFLSA-N 433.350 4.343 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCCC[C@H]2c2nnc(CC(F)(F)F)o2)cc1 812009352 OFOWHBIABSXXQL-KRWDZBQOSA-N 439.482 4.457 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OCC(F)(F)F)cc1 1127182416 YIXDUAFDCHMOPM-UHFFFAOYSA-N 447.501 4.090 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CCN(C(=O)OC(C)(C)C)c3ccccc32)C1 1129536626 HDNWMPCHVXQCQL-QGZVFWFLSA-N 443.544 4.388 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(C2SCCS2)cc1 1129662230 XIPDLYFVWJPCNI-UHFFFAOYSA-N 436.549 4.210 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CN(Cc3ccccc3)c3ccccc3)C2)cc1 1129991736 WYLLDKNMIUVYHK-HSZRJFAPSA-N 429.564 4.345 10 10 IICE CC(C)(C)C(F)(F)CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1131351914 IFQNCUSQIOBLNS-UVTDQMKNSA-N 430.517 4.215 10 10 IICE CCN(C)c1ccc(CN2C[C@@H](C(=O)OC)[C@H](c3ccc(Br)cc3)C2)cc1 1171371536 XKRUCPFRDBGCMQ-LEWJYISDSA-N 431.374 4.294 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2C[C@@H](OCc3ccccc3)C2(C)C)cc1 1226856090 BHRHTUKDLZECQO-DHIUTWEWSA-N 425.573 4.157 10 10 IICE O=C(NCc1cccc(Cl)c1O)NC[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1 1230967594 OTRZGFNWWORNQW-OAQYLSRUSA-N 435.911 4.242 10 10 IICE CC(C)[C@@H]1OCC[C@H]1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1287304820 DMBYUZUHMKOHNH-UGKGYDQZSA-N 426.586 4.334 10 10 IICE COC(=O)[C@@H]1CCCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)C1 1299348689 OQEJKIWSJBJTDR-QGZVFWFLSA-N 449.646 4.039 10 10 IICE O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)NCc1cc(O)ccc1O 1303223512 SJMSOZRWYKCTAR-UHFFFAOYSA-N 433.895 4.463 10 10 IICE CCCN(CC)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1306797470 WGNYHUCFRMZUGF-UHFFFAOYSA-N 427.637 4.360 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)CCOC(C)(C)C)cc1 1313679944 KYRXXSOXTJZJGJ-NRFANRHFSA-N 443.636 4.318 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1C 1316261987 CSPAIJLNECSKBW-ICSRJNTNSA-N 437.588 4.250 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(C)n1-c1ccccc1 1438180108 UZKPOUSFWIGRHE-SIKLNZKXSA-N 425.573 4.398 10 10 IICE C[C@H]1CN(C(=O)c2cccc3c2CCN3C(=O)OC(C)(C)C)c2ccccc2N(C)C1=O 1445035463 SZUDVVOCEZURTA-INIZCTEOSA-N 435.524 4.244 10 10 IICE CC(C)[C@H](c1ccccc1)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1459576489 WOYURKCCXWJTJK-XMERXJNXSA-N 441.591 4.385 10 10 IICE Cc1ccc(C(=O)N(Cc2ccncc2)C[C@H]2CCCO2)cc1-n1c(C)cc(C=O)c1C 1464875263 ZFKINJOLKCLKOS-XMMPIXPASA-N 431.536 4.431 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C1CC2(C1)C[C@H](NC(=O)OC(C)(C)C)CCS2 1465030839 NSNZBYCWSSXAJZ-IQJRZOLZSA-N 447.645 4.246 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccnc(F)c4)CC3)cc2Cl)C1 1469961458 VTJMOEPXWQDYCO-KRWDZBQOSA-N 445.970 4.142 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1495431779 FYIHPTVBCDYJQI-IRLDBZIGSA-N 449.647 4.489 10 10 IICE CCCOc1ncccc1Cn1c(CC)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1501286364 GCIWDQFOSYIVSG-UHFFFAOYSA-N 434.588 4.309 10 10 IICE CCc1ccc(S(C)(=O)=O)cc1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1524253381 FFJCMNTUPYKMHL-MRXNPFEDSA-N 449.016 4.472 10 10 IICE COc1ccc(-n2cc(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)nn2)cc1 1538420880 GVYUROKVBKGDFI-MRXNPFEDSA-N 439.947 4.096 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCCCC3)n2CCCSc2nccs2)n1 1543056475 MUNZCOQAUWLHHD-UHFFFAOYSA-N 431.635 4.159 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2(C)CCN(C(=O)OC(C)(C)C)CC2)c1 1556282785 RZVIDFDCJAMKRH-UHFFFAOYSA-N 439.556 4.426 10 10 IICE CCc1nc(N)nc(SCC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 1559395612 AWRJAGNDVJLQGY-UHFFFAOYSA-N 433.484 4.000 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2CC(=O)c2cccs2)c(C)n1-c1ccc(F)cc1 1566211006 UFIYLOWCMKNFRC-LJQANCHMSA-N 426.513 4.409 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1583527487 WZYVDKGPJIVMNZ-KGVIQGDOSA-N 429.992 4.461 10 10 IICE CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1583703919 KCAHNPCXDIBART-DEOSSOPVSA-N 437.584 4.429 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(Oc4cccc(OC)c4)cn3)C2)cc1 1585664570 CPNJOSHVEBLEFY-GOSISDBHSA-N 433.508 4.147 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC[C@@H]3CCCCO3)CC2)cc1 1619301243 COQMDRRMACIUSY-QFIPXVFZSA-N 441.620 4.260 10 10 IICE COC(=O)c1cc(Br)c2c(c1)CN(Cc1ccc(N(C)C)c(C)c1)CCO2 1620682590 MQPXKPWPBYTOCD-UHFFFAOYSA-N 433.346 4.005 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3sc(SCC(C)C)nc3C)CC2)cc1 1623429552 GVSDJTWDHNCCRU-UHFFFAOYSA-N 433.643 4.490 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1623726158 ZHTCJWZVICQHLN-NZQKXSOJSA-N 445.629 4.055 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(F)c(Cl)c(N)c3Cl)c2)CC1 1624596946 UEENFBFSFTZKLW-UHFFFAOYSA-N 425.335 4.497 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c1 1628808933 LLVOFCOJFMIMEK-UHFFFAOYSA-N 430.483 4.204 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(c4cc(OC)cc(OC)c4)C3)c2C)cc1 1630488445 WYMJTDCVUGGKCT-LJQANCHMSA-N 449.551 4.129 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3=Cc4ccccc4O[C@H]3C(F)(F)F)C2)cc1 1630618747 GLJAYCABHMTJQD-QVKFZJNVSA-N 432.442 4.045 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)c2ccccc2)c(C)n1-c1ccccc1Br 1631610256 JEFZZUYILLNADY-SFHVURJKSA-N 427.342 4.363 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3[nH]cnc3C(=O)c3ccccc3)cc2Cl)C1 1634022730 OSZQYIZSQQVHBH-INIZCTEOSA-N 436.943 4.460 10 10 IICE CCS(=O)(=O)c1ccc(CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1 1634440474 UYMVPOSVMRTKJU-UHFFFAOYSA-N 430.957 4.471 10 10 IICE Nc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cccc1C(F)(F)F 1634753116 FMOMXDVZEOXOOA-GFCCVEGCSA-N 429.389 4.288 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3CCC(N4CCOCC4)CC3)cc2Cl)C1 1635126286 LBZZZPYKIRJIFE-PELRDEGISA-N 434.024 4.084 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccncc3OCCCN(C)C)c2C)c1 1636973798 NAVMPIQETZRAIK-UHFFFAOYSA-N 434.584 4.366 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C\c2ccc(O)c(O)c2)C1 1638739931 VOUJULSIEPFJFE-ZRVJFILXSA-N 430.545 4.139 10 10 IICE Cc1ccccc1CN1CCCN(C(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)CC1 1641550739 QFOFTBNDYBYAPM-UHFFFAOYSA-N 436.644 4.006 10 10 IICE COCCN(CC1CCN(C(=O)OCc2ccccc2)CC1)c1ccc(OC)c(OC)c1 1644797439 SMWIBBIUUAAYEN-UHFFFAOYSA-N 442.556 4.205 10 10 IICE Cn1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc2cc(C(F)(F)F)ccc21 1646434565 DYQUXHLGKPJXQH-UHFFFAOYSA-N 431.458 4.088 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(c3ccsc3)C3CCCCC3)CC2)cc1 1658488308 MKYPOLWXRVMJPM-HSZRJFAPSA-N 429.630 4.079 10 10 IICE C[C@@H](NC(=O)N1CC[C@@]2(CCCCN2C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671852177 SHMYBQZZOONZPF-KOSHJBKYSA-N 430.593 4.389 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3cc(C)nc(N4CCCC4)n3)c2C)c1 1683050706 XWRFTKSZHGGMFI-UHFFFAOYSA-N 432.572 4.101 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@H]2CSCCN2Cc2ccccc2)cc1 1686093241 OSHSJIFKARSDID-DEOSSOPVSA-N 440.657 4.292 10 10 IICE C=C(Br)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1705685894 KZMYSUQNIOVYBE-UHFFFAOYSA-N 446.393 4.180 10 10 IICE CCc1nnc(N2CCC[C@H](C(F)(F)F)C2)n1Cc1ccc(N2CCSCC2)cc1 1727576214 RIQOKQYSSUVOPI-KRWDZBQOSA-N 439.551 4.221 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCS1 1752609996 SHJXZDNACSPXEM-RXVVDRJESA-N 429.634 4.160 10 10 IICE CCc1nnc(N2C[C@H](C)O[C@H](c3ccsc3)C2)n1Cc1ccc(N(C)C)cc1C 1762931388 UIQZOWATSKVXJJ-UWJYYQICSA-N 425.602 4.291 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2C[C@@H](C)S[C@H](C)C2)cc1 1766614403 LUQOXLWNWADWMP-SFHLNBCPSA-N 443.661 4.397 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(Cc2cccnc2)n1CC(F)(F)F 1767080367 GHHPDIKDSLSCQH-UHFFFAOYSA-N 430.478 4.063 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)cc1C 1770547015 WCIQUEYJGIXUBN-LJQANCHMSA-N 438.645 4.264 10 10 IICE CC(C)CC(=O)Nc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccn1 1860504322 ZFHXFTVIFJINDT-UHFFFAOYSA-N 427.460 4.094 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C2CCC2)c(I)c1N 2079951591 UYAUYBKYZTWJTN-QGZVFWFLSA-N 425.314 4.344 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]3CC[C@@H]23)c1O 2236048103 YCDHLAUOJXBAEV-APHBMKBZSA-N 441.366 4.041 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccc(Br)c2)SC1=S)Nc1cccnc1 2296881923 DNWWHNKBBQHULR-UHFFFAOYSA-N 448.367 4.074 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\c3ccc(OC)c(OC)c3C(=O)O)SC2=S)cc1 6266675 MHRHRVAKGTXMMV-LFIBNONCSA-N 445.518 4.207 10 10 IICE COc1ccc(N2CCN(c3nccc(-c4cn(-c5ccc(F)cc5)nc4C)n3)CC2)cc1 72462062 YIFDFTBDHDDPCG-UHFFFAOYSA-N 444.514 4.112 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CNCc1cccc(Br)c1O)C2 720657252 IAXVOPZOAQDPKL-HOTGVXAUSA-N 425.367 4.422 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccc2nccn2c1 733969535 KOEJZJUPLJIJBN-PTNGSMBKSA-N 428.564 4.016 10 10 IICE CC(=O)N[C@@H](CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)c1ccc(F)cc1F 741664635 DOLHIIAAYGVNRB-DEOSSOPVSA-N 439.506 4.299 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccc(N2CCOCC2)cc1 764691279 BVMXQXRKVCVSRL-WZONZLPQSA-N 437.588 4.273 10 10 IICE CC(C)Cn1ncc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1C(C)C 766523127 XIPMNZUIBJOQJV-UHFFFAOYSA-N 427.593 4.193 10 10 IICE O=C(Cc1c(F)ccc(Br)c1F)NCc1cccc(Br)c1O 800554876 GOPNLNWFFOMEEJ-UHFFFAOYSA-N 435.062 4.054 10 10 IICE CC1(C2CC2)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1 811864798 LTIXKYLOABZIMC-UHFFFAOYSA-N 425.495 4.264 10 10 IICE Cc1cc(C(=O)COC(=O)CCc2nc(C(C)(C)C)no2)c(C)n1-c1cccc(F)c1 919124943 SUEUJXRSQBCIDG-UHFFFAOYSA-N 427.476 4.272 10 10 IICE CCC(CC)Oc1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 1125976366 XCTXRHQKVGMQAE-UHFFFAOYSA-N 427.564 4.465 10 10 IICE CCOc1ccccc1[C@H](CC(=O)NCc1cc(C)n(-c2ccccc2)c1C)NC(C)=O 1132048393 TWJMAOLUAOELCV-DEOSSOPVSA-N 433.552 4.377 10 10 IICE COc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)ccc1OC1CCCC1 1134682023 QHNKKGNYPZCTGG-JOCHJYFZSA-N 425.573 4.115 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cnn(CCN(C)C)c3-c3ccccc3)cc2)CC1 1136705233 GCOLEBSGYNBNMA-UHFFFAOYSA-N 445.611 4.278 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(Cc2ccccc2)ccc1O 1136959893 FCWAISPPANPJGN-UHFFFAOYSA-N 430.548 4.122 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(-c4noc(C(F)F)n4)cc3)CC2)cc1 1137658257 AFZCYCAUSLFIKU-UHFFFAOYSA-N 428.439 4.035 10 10 IICE C[C@H](C(=O)NCc1ccc2cccnc2c1O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 1142728195 ODXWFLRFHCVWCQ-JXFKEZNVSA-N 435.524 4.459 10 10 IICE Cc1cc(C(=O)Nc2cccnc2N2CCCC2)c(C)n1-c1ccc(Br)cn1 1143382813 GSZIPHSOUAWHCO-UHFFFAOYSA-N 440.345 4.499 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc2c(c1)nc(C)n2[C@@H](C)CO 1157936448 JNWLOCGYWCHIBP-INIZCTEOSA-N 430.508 4.370 10 10 IICE COC(=O)c1ccc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)cc1 1165462473 AKVWPXVCBRMNFK-HXUWFJFHSA-N 436.533 4.491 10 10 IICE COc1cc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)ncn1 1182481385 GOOFGWZUPZVJAM-QGZVFWFLSA-N 430.430 4.411 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccccc3OCCC(C)C)CC2)cc1F 1234113522 LGQFSSCVPIRMRZ-UHFFFAOYSA-N 429.536 4.291 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(Cc3ccc(C(N)=O)cc3)C3CC3)c2C)c1 1254072915 CUABOTQRHCJHGH-UHFFFAOYSA-N 430.552 4.376 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Oc2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1 1264848260 WZMNQAXOMAJGIJ-UHFFFAOYSA-N 438.549 4.488 10 10 IICE CCCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccc(F)cc1 1276831813 FLDKGTJXZRWXPJ-GOSISDBHSA-N 436.531 4.229 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC=C(C)CC2)n1Cc1ccc(N(CC)CC)cc1 1292033527 QDALZSNRFJEGHT-UHFFFAOYSA-N 438.620 4.247 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCc3ccsc3)CC2)cc1F 1300245996 BRPBWNIRGVOFRN-UHFFFAOYSA-N 429.565 4.180 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(Cl)c(F)c1 1305083787 CLRSOSKAUCVIGK-LIRRHRJNSA-N 439.314 4.453 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1312388719 AKECFUPDQZCMFS-IBGZPJMESA-N 435.355 4.006 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2C[C@@H](OCc3ccccc3)C2(C)C)N(C)C)cc1 1312555706 KYZJOBMBANDSAF-RBZQAINGSA-N 438.616 4.038 10 10 IICE C[C@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1356165674 PJSMCNQBZRLPGV-IAGOWNOFSA-N 436.474 4.478 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3cc(Cl)cc4ccccc34)cc2)C1 1358168302 PIMICOAHIQXFCW-LJQANCHMSA-N 435.955 4.054 10 10 IICE CCOc1ncc(C)cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1436507421 ACOYIHCLYPCCIX-BOPFTXTBSA-N 445.541 4.158 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)c3ccc(F)cc3F)CC2)c1 1442954290 SLTOZBGIIHQCTC-UHFFFAOYSA-N 437.490 4.279 10 10 IICE CCN(CC)[C@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)CC(C)C 1443419777 COWJHKZCRYFRSQ-NRFANRHFSA-N 426.649 4.281 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(F)(F)F)C2)c(C)n1-c1ccc(Br)cc1 1444404971 JAWGUBSFPMRRDM-INIZCTEOSA-N 431.252 4.260 10 10 IICE Cc1ccc(C(=O)NCc2ccc(C3(C)OCCO3)cc2)cc1-n1c(C)cc(C=O)c1C 1454617016 OSLONZVKMXPUGQ-UHFFFAOYSA-N 432.520 4.365 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@](C)(CO)Cc3ccc(Cl)cc3)c2C)cc1 1454970514 UMHGTOPZDJZALP-XMMPIXPASA-N 426.944 4.480 10 10 IICE O=C(NCc1cc(C2CC2)ccc1F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1468428797 YTGZJKLCTMOLJB-UHFFFAOYSA-N 446.525 4.201 10 10 IICE CC(C)c1cnc(S[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1C 1472997800 ORDKINIPLJCXBX-AWEZNQCLSA-N 433.533 4.438 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)CC3CCC3)n2CCCSc2nccs2)n1 1492737642 ABAGNFKMPXFKLU-UHFFFAOYSA-N 431.635 4.015 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1 1503904578 NFCDENIHCMJIEQ-KDURUIRLSA-N 437.588 4.391 10 10 IICE Cc1ccc2snc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)c2c1 1527245352 JYFQKSIPEGUQRE-UHFFFAOYSA-N 435.471 4.390 10 10 IICE COCCCOc1cccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1C 1527482290 XMTDMJXQSDDJSC-QZTJIDSGSA-N 444.547 4.093 10 10 IICE C[C@@H]1CC(F)(F)CCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1532074397 IPMJGQJXKPBSPY-HLVNSREUSA-N 430.567 4.376 10 10 IICE Cc1nc(-c2cccs2)c(CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)s1 1537483124 LXNKHKHISSYMFU-SFHVURJKSA-N 428.627 4.208 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c1C 1540277233 BQDXPUPXIQKPEH-UHFFFAOYSA-N 425.554 4.214 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(OCC2CC2)c1 1543233145 FIFRXTWDRGQUOS-IAGOWNOFSA-N 442.531 4.167 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1544267140 CMMGXPZWFNGGRE-ROUUACIJSA-N 425.520 4.260 10 10 IICE Cc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)n[nH]2)cc1C 1544677541 URIGKOCGDKOUSM-QZTJIDSGSA-N 436.531 4.376 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCCn1cc(Br)cn1 1545337344 SPYJXKAMNDJDAA-OAHLLOKOSA-N 447.381 4.183 10 10 IICE CCn1cc(CN(C)c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)cn1 1547613922 IQGAIKFGLANQEC-UHFFFAOYSA-N 425.556 4.042 10 10 IICE Cc1cc(CCNC(=O)NC/C=C/CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1564856354 LWYUDHMOPFQMGO-MDZDMXLPSA-N 426.561 4.017 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNC(=O)N(Cc1ccco1)Cc1ccccc1O 1565373491 QJTLLYGFWDHDBR-IEBWSBKVSA-N 443.544 4.200 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2ccc(F)cc2)c(C)n1-c1ccc(Cl)cc1 1565768252 OEQGMEKFPBHIQG-UHFFFAOYSA-N 427.907 4.437 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](CN3CCN(C)CC3)c3ccccc3)c2C)c1 1584730248 PESYTGVABWESSF-HHHXNRCGSA-N 444.623 4.429 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cnn4cccc(Br)c34)cc2)CC1 1627467888 RTDNHBWAOIVQTK-UHFFFAOYSA-N 427.346 4.263 10 10 IICE Cc1nc([C@H](NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c2cnn(C)c2)no1 1628637460 QZOUMTRXXPQYLS-JOCHJYFZSA-N 432.528 4.162 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2C)c1 1628650999 JZSHJZQSSFIIIY-IBGZPJMESA-N 433.512 4.341 10 10 IICE C[C@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630263256 VIIYWVCXAAQMKN-QRWLVFNGSA-N 432.923 4.174 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1640036547 BXJRYASMHLQINV-GOSISDBHSA-N 441.572 4.211 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1640569518 BQJFVDBULJXWGC-FDDCHVKYSA-N 434.536 4.253 10 10 IICE CC1(c2ccccc2)CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1641080290 QPGPBFFQRQVXPG-UYRXBGFRSA-N 440.565 4.217 10 10 IICE CCN(CCCS(=O)(=O)c1cccc(C)c1)Cc1cc(Br)ccc1O 1641892529 HLCDFZDVSBNLID-UHFFFAOYSA-N 426.376 4.149 10 10 IICE Cc1cc(C(=O)N2CCN[C@@H](c3ccccc3)C2)c(C)n1-c1ccc(Br)cn1 1642843000 LMOMQHLZGJVDSU-HXUWFJFHSA-N 439.357 4.038 10 10 IICE CCN(CC)c1nc2sc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc2s1 1646431214 IZPZWNYEHDBZHA-UHFFFAOYSA-N 444.626 4.095 10 10 IICE CCN(C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@H]1CCN(CC(F)(F)F)C1 1647879600 MROFRXZUKGFJQJ-SFHVURJKSA-N 425.495 4.003 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C)c3cccc(C4CC4)c3)cc2F)C[C@@H](C)O1 1653716443 LKSJTHRMNOPOLQ-OTWHNJEPSA-N 439.575 4.284 10 10 IICE Cc1ccc(CN(CC(=O)NCc2cc(F)cc(F)c2)c2ccc3c(c2)OCCO3)s1 1657616180 RTDRJDYTEPHWQY-UHFFFAOYSA-N 444.503 4.429 10 10 IICE O=C(NCC[C@H]1CSc2ccccc2O1)N(Cc1ccccc1O)C[C@H]1CCCO1 1673863784 VAIOTVOVCLRMOZ-MOPGFXCFSA-N 428.554 4.026 10 10 IICE Cc1cc(CCNC(=O)N2CCN(CCCOC(C)(C)C)CC2)c(C)n1-c1ccccc1 1674930179 NEOUCVNUDOJAON-UHFFFAOYSA-N 440.632 4.169 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@](C)(O)c2cc(C)oc2C)o1 1707345664 BJLOBSRESYZJBB-DEOSSOPVSA-N 436.512 4.306 10 10 IICE CCOCCn1c(-c2ccc(Br)s2)nnc1N(C)Cc1ccccc1O 1710823845 CEVCSSXAPNSRLI-UHFFFAOYSA-N 437.363 4.148 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1761052235 RVRAKLAHHSDJSC-HXUWFJFHSA-N 429.584 4.298 10 10 IICE C[C@H]1C[C@H](C)CN(CCCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1762723698 KEEDSAMUSUVJGR-SFTDATJTSA-N 448.615 4.440 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1766170195 XUERQAHISSGLSC-MRXNPFEDSA-N 433.603 4.491 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N(C)C)c(F)c1 1766815519 DIWKRVNNFNWNLL-GOSISDBHSA-N 427.524 4.105 10 10 IICE COC(=O)c1c(NC(=O)CCc2cnc(OC)nc2)sc(C)c1-c1ccc(C)c(C)c1 1866151370 QYOVXOBDWHBOEB-UHFFFAOYSA-N 439.537 4.497 10 10 IICE CCN1C(=O)C(Nc2cc(OC)ccc2OC)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422582 FCHILXAUHLWWBO-UHFFFAOYSA-N 445.519 4.323 10 10 IICE CN(Cc1cnn(Cc2ccccc2)c1)c1ccc(C=CC(=O)O)cc1Br 1915066288 UDXSJCVZJZKFDU-UHFFFAOYSA-N 426.314 4.428 10 10 IICE CN(CCN(Cc1ccccc1)[C@@H](CN)c1ccc2c(c1)CCN2C)Cc1ccccc1 2034744397 XEOFIWAOTVMEQK-NDEPHWFRSA-N 428.624 4.313 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc(Br)cc2O)[C@H]2CCCC[C@H]21 2122810964 DRUGUFUCHYIJEN-IXDOHACOSA-N 425.367 4.422 10 10 IICE Cc1ccc(OCCOCCOc2ccccc2C=C2SC(=S)N(C)C2=O)cc1 2293163818 JOGTZLCBQVBMQX-UHFFFAOYSA-N 429.563 4.300 10 10 IICE COc1ccc(-c2ccc(C=C3C(=O)N(c4ccc(C(=O)O)cc4)N=C3C)o2)c([N+](=O)[O-])c1 2294400567 CEZYHUNXQSPGPL-UHFFFAOYSA-N 447.403 4.368 10 10 IICE CC(C)(C)c1ccc(C=C2SC(=S)N(CCC(=O)NCc3cccnc3)C2=O)cc1 2296730167 BXCALKMSDBJJML-UHFFFAOYSA-N 439.606 4.287 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)C1=Cc1ccc(N2CCCCC2)o1 2313559994 FEMRZTSNMBRXAF-UHFFFAOYSA-N 434.279 4.243 10 10 IICE Cc1ccc(CN[C@]23CCC[C@@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352690521 BVMQWDWMOGZUGG-QRWLVFNGSA-N 425.367 4.342 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(-c4ccco4)nc4onc(C)c34)CC2)cc1 108428633 NJRFMQTVKMEMEV-UHFFFAOYSA-N 432.480 4.152 10 10 IICE CCOC(=O)c1c(NC(=O)CCSCC(=O)OC)sc(C)c1-c1ccc(F)cc1 1264290378 DLRARNRWGBSJAB-UHFFFAOYSA-N 439.530 4.274 10 10 IICE C[C@@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1ccc([N+](=O)[O-])cc1O 1951729427 DCTYNRYNEXDXNS-DEOSSOPVSA-N 448.431 4.139 10 10 IICE CCOC(=O)c1cccc(-n2c(C)cc(/C=c3/sc4nc5ccccc5n4c3=O)c2C)c1 33316857 TVBNMVOPPHSHKS-HYARGMPZSA-N 443.528 4.041 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1[C@@H]1C[C@H]2CC[C@H]1C2 917643805 KOXGNURCFBKZNN-YDYJISLESA-N 431.320 4.274 10 10 IICE C[C@H](NC(=O)N1CCn2c(cc3cc(Cl)ccc32)C1)c1ccc(N2CCOCC2)cc1 755244441 MEOHENJRSJSFGV-KRWDZBQOSA-N 438.959 4.418 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H]4CCCC[C@H]4N3c3ncccn3)cc2)CC1 764099728 SSMFMSVYRXYZGS-QTJGBDASSA-N 433.600 4.167 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)C1 766709728 CBPHVCLKVDVTKM-FQEVSTJZSA-N 446.595 4.272 10 10 IICE O=C(NCc1cccc(Br)c1O)C1CCN(c2nc3ccccc3s2)CC1 765748081 VKFOWADXKLXHJH-UHFFFAOYSA-N 446.370 4.297 10 10 IICE Cc1cc(CCNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)c(C)n1-c1ccccc1 788317427 YYSKKBQYFGKCLY-UHFFFAOYSA-N 442.563 4.170 10 10 IICE CC[C@H](C)NS(=O)(=O)Cc1cccc(NCc2cc(C)cc(Br)c2O)c1 781635339 GFAWHCVVWVSQOH-AWEZNQCLSA-N 441.391 4.293 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCOc1ccc(Br)cc1 1136483161 ATDFANPUANZKOC-UHFFFAOYSA-N 441.325 4.478 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@@H](NC(=O)OC(C)(C)C)c3ccccc3)C2)cc1 1130826631 FREKVZGAXVJWCJ-SIKLNZKXSA-N 439.556 4.046 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F 1147838437 WSVJNLLEJYCXIW-IFMALSPDSA-N 430.951 4.498 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cc(Cl)ccc1O)c1c(F)cccc1F 1300396450 UEKHDZNRIKVHCJ-KRWDZBQOSA-N 426.847 4.206 10 10 IICE COc1ccc(N2CCN(C(=O)CCCc3ccccc3Br)CC2)cc1F 1150241286 WHJRSHDMFATHRR-UHFFFAOYSA-N 435.337 4.268 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CC[C@@H](F)C3)CC2)cc1 1300247255 KHTIVYBTSMOZHT-WOJBJXKFSA-N 429.584 4.340 10 10 IICE CC[C@@H](CSc1ccccc1)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1312340907 FTJIJYCHZIECGK-KRWDZBQOSA-N 435.540 4.172 10 10 IICE CC(C)CON(CC1CCCCC1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1313304893 MMRWOAAGOVIFJU-UHFFFAOYSA-N 444.620 4.068 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](c3nccn3C)C(F)(F)F)cc2Cl)C1 1312590606 MSRFUQBLVIHALU-GUYCJALGSA-N 443.901 4.413 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1CCCCCN1CCCCC1 1314752976 IQVRHULUYXKYAK-JOCHJYFZSA-N 441.620 4.170 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1314612079 ZJVAWZKZJMTPSG-SFHVURJKSA-N 449.640 4.393 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC(Cc3cccc(C(F)(F)F)c3)C2)N(C)C)cc1 1251501192 NZNIDUKRLBAKRF-QFIPXVFZSA-N 448.533 4.258 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3cc(SCc4ccccc4)ncn3)cc2)CC1 1187639403 BVSLVICSKVDWJV-UHFFFAOYSA-N 433.581 4.083 10 10 IICE Cc1cc(CNC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1254080660 ZSQTVNQXABMCSW-GOSISDBHSA-N 426.561 4.245 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 1354768306 VKQBWCSTCRFYEX-CDHQVMDDSA-N 431.439 4.085 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)cc1 1355015953 RKYCLIJTFYMFEP-UXHICEINSA-N 432.362 4.084 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(CC)CC)cc2)C1 1503153428 WZHDIMSFXNFIRK-QFIPXVFZSA-N 448.615 4.406 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(OCCC(C)C)c(OC)c3)CC2)c(OC)c1 1438185338 BZPBKTVGOASMHF-UHFFFAOYSA-N 442.556 4.100 10 10 IICE C[C@@H]1COCC[C@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1512544092 UHFKQZGNVDJCAT-BAYUQKDNSA-N 442.604 4.211 10 10 IICE O=C(Cc1csc(CCC(F)(F)F)n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446569031 RSXMNABICRDDFL-INIZCTEOSA-N 428.476 4.094 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1nc(C(F)(F)F)cs1 1448686993 QSCLURKMXZPARI-UHFFFAOYSA-N 443.491 4.093 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@@H](C)C1 1519135711 NIUVQOFPVNCKGU-MJGOQNOKSA-N 440.567 4.168 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 1297296960 GUVZPDJMRMVCHF-ROUUACIJSA-N 432.524 4.168 10 10 IICE Cc1cnc([C@@H](C)Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1290293951 PIGPZAXVHSSBOC-HNAYVOBHSA-N 427.574 4.430 10 10 IICE Cc1cc(Cl)ncc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1517990021 QSSSXRPNLBHXPL-DHDCSXOGSA-N 435.933 4.413 10 10 IICE CCC(CC)N1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CC1=O 1293124587 BCQWOBFXKGUJJF-FQEVSTJZSA-N 437.584 4.332 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(CC(C)(C)C)CC(C)(C)C)cc2F)C[C@@H](C)O1 1459889865 JFWGEBKBTBBCPG-RTBURBONSA-N 435.628 4.450 10 10 IICE Cc1ccccc1C[C@@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1527450647 SIDQKMYFJMIONF-ZHTGWBIJSA-N 442.581 4.473 10 10 IICE O=C(CCOc1ccc(Cl)cc1Br)NCc1ccc2cccnc2c1O 1299721648 OGGGQCZFSPHFKV-UHFFFAOYSA-N 435.705 4.442 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](OCC1CCCC1)c1ccccc1 1524855330 INEDQNGETGSBTJ-DEOSSOPVSA-N 444.522 4.366 10 10 IICE Cc1ccc(-c2ccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)nn1 1539581883 LNCVIIVRIWUMBS-IBGZPJMESA-N 438.478 4.452 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1541080311 FNFFTAKIFOJSRC-PXNSSMCTSA-N 435.634 4.186 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CCN(C(C)C)C[C@@H]3c3cnn(C)c3)c2C)c1 1544079324 FIYAOORLHPVTGC-IZZNHLLZSA-N 447.627 4.266 10 10 IICE CCCN1CCC(N(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)CC1 1547185442 VSWZVTCMLYMPIP-UHFFFAOYSA-N 447.631 4.073 10 10 IICE CCO[C@@H]1CCCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1616610111 LVNKCQZSTKLALI-XMMPIXPASA-N 448.615 4.164 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CCCC[C@@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1542171739 YWPBSEIGAJIWFN-PXDATVDWSA-N 445.604 4.208 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H]3CCC[C@@H]32)n1CCCSc1nccs1 1545892579 WPMQNPJNCSQTKA-RDJZCZTQSA-N 448.662 4.214 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccnc(N3CCCCC3)c2)cc1 1541126610 RQVBTUYTTWYNGN-UHFFFAOYSA-N 430.552 4.151 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(CN4CCCCC4)c3)cc2F)C[C@@H](C)O1 1542112859 HDNKCISQISXZBH-BGYRXZFFSA-N 439.575 4.355 10 10 IICE Cc1cc(C(=O)NC[C@](C)(O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cn1 1471949342 ZSWMHBDPCKQBEL-NRFANRHFSA-N 446.320 4.028 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)c1 1543727492 DOGZDMSEZNNMCH-DEOSSOPVSA-N 431.536 4.450 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCCC(F)(F)F)CC2)cc1F 1619302024 GLQQMJGQCSFXHT-UHFFFAOYSA-N 443.489 4.392 10 10 IICE Cc1cc(Cn2c(N(C)Cc3ccccc3O)nnc2C(C)(C)C)cc(N2CCCC2)n1 1542213330 KKXPIZSAHQISME-UHFFFAOYSA-N 434.588 4.270 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)CC(F)(F)F)cc1 1547447477 YAJPZQJYGUYVIC-GOSISDBHSA-N 425.499 4.413 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]3CCC[C@@H]32)n1Cc1ccc(N(C)C)cc1C 1555658023 ZEYGEGBOOOLGAB-QTEQDKRBSA-N 441.620 4.194 10 10 IICE C[C@H](NC(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1)c1ccc(N(C)C)cc1 1625544710 WRUBHTWXAKTZPA-KRWDZBQOSA-N 427.504 4.040 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)NCc1cc(Cl)ccc1O 1557386383 SMJDWWGEQMDLKK-YSGRDPCXSA-N 426.944 4.446 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1cc2cc(O)c(O)cc2s1 1623792229 UTVGGOGZWWCPPI-UHFFFAOYSA-N 440.502 4.366 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1634218727 JCPBFRMGXQKUGJ-GHTZIAJQSA-N 441.330 4.411 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H]1CC1CCCC1 1631661309 JCMKFYVUWCOXHH-KRWDZBQOSA-N 434.583 4.439 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCO[C@H]3c3ccc(Cl)c(F)c3)C2)cc1 1564963483 YASSTSGSPPEOJF-ARBPTSGCSA-N 447.938 4.143 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2nc(-c3ccncc3)n[nH]2)cc1 1630099721 DGNKZRMFRZMGFB-UHFFFAOYSA-N 426.484 4.278 10 10 IICE Cc1ccc(C(=O)NC[C@@H](c2ccc(Cl)cc2)N(C)CCC(F)(F)F)c(O)c1O 1636422503 OSJIBSQPALECQQ-INIZCTEOSA-N 430.854 4.415 10 10 IICE CC(C)C[C@@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N(C)C(=O)OC(C)(C)C 1631219029 LBFIWHOLVIYUOK-UXHICEINSA-N 434.577 4.181 10 10 IICE CCCCCn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1728010930 RUHPFVYXDPNKJO-UHFFFAOYSA-N 434.588 4.312 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1cc([N+](=O)[O-])n[nH]1 1641202758 LLQGLPSEQKQBSR-OAHLLOKOSA-N 433.390 4.243 10 10 IICE Cc1noc([C@@H]2CCCN(c3nnc(CC(C)C)n3CCCSc3nccs3)C2)n1 1742888375 IEKFVEDVGABVTH-MRXNPFEDSA-N 447.634 4.191 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3c(Br)cnn3C3CC3)ccc21 1586384765 HJWSGZWIGLVTBQ-UHFFFAOYSA-N 431.334 4.451 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC1CCOCC1 1745903293 SUBMOAVQSZTBBC-UHFFFAOYSA-N 437.588 4.394 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H](C)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1751848669 OAOZTUGRUUSYMT-SFHVURJKSA-N 435.620 4.189 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1766615071 VTRPWHKPWRGEKQ-YKSBVNFPSA-N 448.615 4.020 10 10 IICE CCc1nnc(N2C[C@H](C)O[C@@H](c3ccsc3)C2)n1Cc1ccc(N(C)C)cc1C 1762931386 UIQZOWATSKVXJJ-LAUBAEHRSA-N 425.602 4.291 10 10 IICE O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(O)cc1O)N2 13639987 QTLAHGOYFLVJGI-WZOHSFFVSA-N 448.544 4.403 10 10 IICE O=C(O)CN1C(=O)/C(=C/c2cc(C34CC5CC(CC(C5)C3)C4)ccc2O)SC1=S 207097468 PIYNXRMYJQDPTC-WSVATBPTSA-N 429.563 4.146 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C(C)(C)C)c(CN)c2I)cc1C 2080042962 NTEXIRIHMJKKRE-LBPRGKRZSA-N 427.330 4.176 10 10 IICE CC[C@H](NCC[C@H]1CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2181158221 IWDQYPWCFUJMQM-RDJZCZTQSA-N 443.382 4.221 10 10 IICE COc1ccc(Br)c(CNCCCCCCNC(=O)OC(C)(C)C)c1O 2227751913 SKSRJTDQOCFTMA-UHFFFAOYSA-N 431.371 4.338 10 10 IICE COc1ccccc1N1C(=O)C(=Cc2cc(C)n(-c3ccc(C)cc3)c2C)C(=O)NC1=S 2296946523 JWYBVWCRMPHTKY-UHFFFAOYSA-N 445.544 4.242 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(C(=O)OC(C)C)c3)C2=O)ccc1O 2321720084 OVHICNKKALHASP-UHFFFAOYSA-N 429.519 4.372 10 10 IICE CC[C@H](C)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323829834 ZFVZIFLKSHBZAD-ISVAXAHUSA-N 432.336 4.289 10 10 IICE Cc1ccc(CN[C@@H]2CC[C@H]3C[C@H]2CN3C(=O)OC(C)(C)C)c(O)c1Br 2352932568 ORHGOJCRNSJNLE-HRCADAONSA-N 425.367 4.341 10 10 IICE O=C1N=C(O)/C(=C/c2cnn(-c3ccccc3)c2)C(=O)N1c1ccc(Br)cc1 1181432 DONRYSKEHSFSCB-YVLHZVERSA-N 437.253 4.142 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)C)cc3[C@@H]3C=CC[C@H]32)cc1OC 14479394 HVVPXQSGBOCGRG-PNCHPQGNSA-N 428.554 4.217 10 10 IICE COCCCn1c(SCC(=O)c2ccc(O)c(O)c2)nnc1-c1ccccc1Cl 24832895 NRMAIGPYYIOBRK-UHFFFAOYSA-N 433.917 4.021 10 10 IICE CNC(=O)N1Cc2c(C)nn(-c3ccccc3)c2-n2cccc2[C@H]1c1ccc(N(C)C)cc1 32977706 IPHKMGAJXGMECZ-XMMPIXPASA-N 440.551 4.282 10 10 IICE CCN(CC)c1ccc(CN(C(=O)c2ccccc2F)C2CC2)c(OS(=O)(=O)CC)c1 37421036 PHYYFZREMZOZOD-UHFFFAOYSA-N 448.560 4.205 10 10 IICE CCOc1ccc(-n2cccc2/C=C2\C(=N)N3C(SCC)=NSC3=NC2=O)cc1 96462627 OVFVMLMZODNOBW-PZNVHLGOSA-N 425.539 4.206 10 10 IICE CC1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@@H](c2ccc(O)cc2O)N3)CC1 226779013 HAEWHHKKTAJPCU-IMWIBFENSA-N 440.565 4.345 10 10 IICE COc1ccc(OC)c([C@H](C)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726702999 SUAUOQAPCLSHDX-HNNXBMFYSA-N 449.498 4.334 10 10 IICE O=C(Nc1ccc([S@](=O)C(F)(F)F)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 750615419 CHNGWEGEKWOZLM-JTBPQFFMSA-N 442.459 4.233 10 10 IICE O=C(CCC(=O)c1ccc(Cl)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768531729 AJCISQHDPQJYFA-UHFFFAOYSA-N 439.987 4.151 10 10 IICE Cc1n[nH]cc1-c1nnc(NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)s1 782092110 CIEBTRLKJLAXMS-UHFFFAOYSA-N 437.529 4.130 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4ccc(C)cc4)c3C(F)(F)F)C2)cc1 1130826524 BMMJYKDHRUHYAC-INIZCTEOSA-N 444.457 4.217 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Br)cc(C(F)(F)F)c3)C2)cc1 1130827158 VDJDGFSJDHRTFU-HNNXBMFYSA-N 443.263 4.485 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(I)c2)cc1F 1136729962 WTZMWKIQUJVFPB-UHFFFAOYSA-N 426.273 4.207 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc2ccc(C(F)(F)F)cc2[nH]1 1141926430 BSAYCOILSMZYGF-UHFFFAOYSA-N 439.384 4.232 10 10 IICE Cc1cc(F)c(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1F 1147507552 SCQLEHCNZDMGFJ-OAQYLSRUSA-N 447.526 4.264 10 10 IICE Cc1cc(CC(=O)NC[C@@H](O)COc2ccc(F)c(F)c2)c(C)n1-c1ccc(Cl)cc1 1149909541 WKYJVTSUSKWAEL-LJQANCHMSA-N 448.897 4.124 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 1156288605 ZUEBWPNFSLVMEP-SFTDATJTSA-N 439.512 4.087 10 10 IICE C[C@H](NC(=O)NC[C@@](O)(c1ccccc1Cl)C(F)(F)F)c1ccc(N(C)C)cc1 1234554789 FIQRFJQMVVAHHN-ORAYPTAESA-N 429.870 4.216 10 10 IICE CCN1CCC(CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CC1 1296027930 VCUWHUOXXXFNBF-UHFFFAOYSA-N 439.629 4.394 10 10 IICE CN(Cc1ccoc1)c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1298419435 WMUSQHIYJFBDKR-UHFFFAOYSA-N 426.571 4.132 10 10 IICE COCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccc(N2CCCCC2)c(C)c1 1308140042 BUTUACSUZCXKIG-JOCHJYFZSA-N 431.621 4.443 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@H](C)O[C@@H](C3CC3)C2)cc1 1313679631 OXVSNUXNODXCPS-WMZHIEFXSA-N 425.621 4.375 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@@H](CC)C2 1348205042 JKYXPEYYWUMFHI-HUUCEWRRSA-N 444.553 4.020 10 10 IICE COCCOc1cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)ccc1OC 1351686800 DNYDGMASYCDBEK-UHFFFAOYSA-N 438.524 4.201 10 10 IICE CCOC(=O)CCN(C[C@H]1CCCN1CC)C(=O)c1cc(C)n(-c2ccccc2C)c1C 1442120371 QJPXDCRLPVCNRD-JOCHJYFZSA-N 439.600 4.282 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C 1445651686 CHYPWKHIAXJJLZ-INIZCTEOSA-N 429.355 4.053 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2nn(-c3cc(Cl)ccc3F)c3c2CCC3)c1 1465993730 VZFIBUUCWRZOQG-LBPRGKRZSA-N 429.879 4.359 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1 1471004848 OZELABTUPSQLIX-LJQANCHMSA-N 430.955 4.500 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC3CCN(c4ccncc4)CC3)cc2Cl)C1 1478529186 XDOIXBRRARQKAS-SFHVURJKSA-N 442.007 4.440 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3c(Cl)cccc3OC(F)F)CC2)cc1F 1479128034 RTFGNTJEXFBHPR-UHFFFAOYSA-N 443.853 4.121 10 10 IICE CCc1ccc([C@@H]2CCCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)C2)cc1 1479344101 OEOZWKXCKVDCOY-XMMPIXPASA-N 448.611 4.040 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCCCN2CCCC2)n1 1492499407 AFDRVKSUUGDLAP-UHFFFAOYSA-N 434.588 4.257 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CC1=CCN(C(=O)OC(C)(C)C)CC1 1503487215 JFWAWDJJTARVTQ-UHFFFAOYSA-N 439.560 4.065 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)C(=O)NC)C1 1514089407 LVLRALQJABWIEO-FQEVSTJZSA-N 448.615 4.361 10 10 IICE CNC(=O)[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)C1 1517502285 GOSUBFLGEWMLNT-OAQYLSRUSA-N 448.615 4.361 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OC(F)(F)Cl)cc1 1519555982 JQGNONJNTSASHA-UHFFFAOYSA-N 449.929 4.317 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1520960869 HTBSNIWTTBBQED-QGZVFWFLSA-N 441.494 4.257 10 10 IICE FC1(F)CCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC1 1521006816 XOUGRMJKFDBFNE-AWEZNQCLSA-N 429.562 4.394 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)[C@@H]1C[C@H]2CC[C@H]1C2 1525904039 RWISMDJZZMQMKD-OOQALIRLSA-N 432.586 4.358 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@]1(C)CC1(Br)Br 1529276869 BIKGZPRFQDEATA-LRDDRELGSA-N 432.200 4.004 10 10 IICE COc1ccc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nc1Br 1534543481 WWWOVPNLTKNJGR-UHFFFAOYSA-N 428.330 4.233 10 10 IICE COc1ccccc1[C@@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1535509737 KIGCTXRHJDPCMD-NFECSFHCSA-N 444.553 4.303 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccc(F)cc4)cc3)cc2)CC1 1538131905 RPVHXFWGUGTJIN-UHFFFAOYSA-N 447.510 4.250 10 10 IICE COc1cccc(N(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C(=O)OC(C)(C)C)c1 1539187500 ATRLJFNYPFDMGY-UHFFFAOYSA-N 427.545 4.161 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2OCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1586619224 FPVKCRXYOREHPU-YADHBBJMSA-N 439.556 4.096 10 10 IICE COc1cccc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1C 1586766414 IWZNNGZAIKOSTE-LDADJPATSA-N 446.619 4.363 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C(=O)OC(C)(C)C)CC[C@@H]3C)ccc21 1598054523 ZLLSSZSTCZBZAA-JXFKEZNVSA-N 428.573 4.487 10 10 IICE CC[C@H]1CCCN(c2nnc([C@H]3OCC[C@H]3COC)n2Cc2ccc(N(C)C)cc2C)C1 1614157897 PXHLGEJHTBLSTH-RRPUWOKSSA-N 441.620 4.051 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(CC(F)(F)F)CC1 1617854720 UVFGONXHXXYMGV-CQSZACIVSA-N 444.453 4.453 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCOc2ccccc2)NC(=O)OC(C)(C)C)cc1 1618253803 QYBNGXLPEDMMCH-JOCHJYFZSA-N 441.572 4.294 10 10 IICE O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1625683978 HGFZEDWGYKWIME-FQEVSTJZSA-N 441.286 4.066 10 10 IICE CCc1ccccc1[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)OC(C)(C)C 1625699247 CVNKZQUROCHZPW-IBGZPJMESA-N 439.516 4.407 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1 1635113348 DULQKEBJFCMWHM-UHFFFAOYSA-N 443.503 4.239 10 10 IICE Cc1cc(C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(N)=O)c(C)n1-c1ccc(Cl)cc1 1636006039 RYHBWTLXPIAHDJ-FQEVSTJZSA-N 430.335 4.227 10 10 IICE COc1ccc(C[C@H](C)CN(C)C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1636353492 CQTVMUZRKKUIPO-FPOVZHCZSA-N 425.573 4.050 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N(C)[C@H](c2ccccc2)c2ccc(F)cc2)cc1 1643684684 LALIZXMCOMXDND-HHHXNRCGSA-N 449.570 4.450 10 10 IICE CCOC(=O)c1[nH]nc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1C 1647831169 PZMRWCIZEUJDIT-UHFFFAOYSA-N 445.317 4.317 10 10 IICE COc1cc(OC)cc(N2CC[C@H](N(C)Cc3ccc(N4CCCCC4)c(C)c3)C2=O)c1 1653713395 YJKDCOYOSMFSAM-VWLOTQADSA-N 437.584 4.240 10 10 IICE COc1ccc(N(CC(=O)NCCOc2ccc(C(F)(F)F)cc2)C(C)C)cc1F 1653758879 IDFMZNADFBOJLJ-UHFFFAOYSA-N 428.426 4.263 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)c3cccc(OC(F)(F)F)c3)C2)cc1 1673823631 XHXDPTKCFPMIPM-JKSUJKDBSA-N 437.462 4.481 10 10 IICE CCN(CC)CC[C@H](NC(=O)NCc1cccc(Br)c1O)c1ccccc1 1676794530 RWSUZNOUIWFXBP-IBGZPJMESA-N 434.378 4.427 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCCc1cn(-c2ccccc2)nc1C 1681798407 KQEAMRGNZUTUSB-HXUWFJFHSA-N 433.600 4.418 10 10 IICE Cc1noc([C@@H]2CCCN(c3nnc(C(C)(C)C)n3CCCSc3nccs3)C2)n1 1693539860 UHCABLPSYCCZRZ-OAHLLOKOSA-N 447.634 4.290 10 10 IICE CCOCc1nnc(N(C)Cc2cscn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1696251134 IOAWHIZIBSVYLS-UHFFFAOYSA-N 440.617 4.192 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCCCCO)n1 1707582008 AQMBWNNXZXAQDE-UHFFFAOYSA-N 434.588 4.048 10 10 IICE CC[C@@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1709316019 FZAVNYOSZSJIDV-WOIUINJBSA-N 443.661 4.397 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)C[C@H]2CC=CCC2)cc1 1728379039 FPQLGGKUVRKPOX-FQEVSTJZSA-N 433.604 4.366 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCC(=O)N1CCCCCC1 1747749708 DCADXCCSYMANPN-UHFFFAOYSA-N 427.593 4.001 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1766661769 XSYHYPXFCPYFFB-FQEVSTJZSA-N 426.653 4.166 10 10 IICE CC(C)CS(=O)(=O)c1ccccc1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1859616532 ONLNRXUSKLPZEH-UHFFFAOYSA-N 447.512 4.144 10 10 IICE COc1ccc(CC(=O)N(c2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)c(OC)c1 1859891391 ADGXLDOEUWWTOH-UHFFFAOYSA-N 443.499 4.463 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccccn3)C(=O)N(C3CCCC3)C2=O)cc1 1873164285 UKHCYAFXUYJRET-UHFFFAOYSA-N 440.547 4.301 10 10 IICE CC[C@H](N[C@@H]1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1cc(Br)ccc1O 2095041824 PPIHGAKPYUAFLV-NKKGCODLSA-N 425.367 4.451 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)C[C@H]2CCCO2)cc1Br 2152224414 XSZQLPCASSGIJQ-OAQYLSRUSA-N 433.390 4.371 10 10 IICE CCN(CC)c1ccc(C=C2C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)c(OC)c1 2313547833 DCXQCKZMLVMLPG-UHFFFAOYSA-N 443.503 4.361 10 10 IICE O=C1C(=Cc2ccc(O)cc2O)C(C(F)(F)F)=NN1c1ccc(Br)cc1 2332096137 UYHORBKRCYCAOF-UHFFFAOYSA-N 427.176 4.209 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2ccc(Br)cc2O)C[C@H]2CCC[C@H]21 2335106063 QSXSPZMCFWKJFC-XOKHGSTOSA-N 425.367 4.422 10 10 IICE CC[C@H]1C[C@H](C(=O)NCc2ccc(C)c(Br)c2O)N(C(=O)OC(C)(C)C)C1 2380719400 CYGMNTQHDGKONJ-DZGCQCFKSA-N 441.366 4.115 10 10 IICE CCN1CCN(c2cc(C)c3cc(NC(=O)/C=C/c4ccc(OC)cc4)ccc3n2)CC1 13671923 BYSCWUNLAIWJED-KPKJPENVSA-N 430.552 4.346 10 10 IICE in-vivo O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1)N2)N1CCOCC1 20695015 RUTXHTQTSSBPOE-KNKQGSTJSA-N 430.957 4.187 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)O[C@H](C)C(=O)Nc3cccc(NC(C)=O)c3)c2C)cc1 26661412 AYAKLNPJGJCMJH-QGZVFWFLSA-N 449.507 4.245 10 10 IICE Cc1cc(C(=O)N[C@H](c2nc(C3CC3)no2)C(C)C)c(C)n1-c1ccc2c(c1)OCCO2 110698276 JQLQMLSKDRZHNZ-NRFANRHFSA-N 436.512 4.253 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)N[C@@H]1CCC(=O)N(C)C1 738500548 OQQFAXWDFVCREM-APWZRJJASA-N 448.489 4.102 10 10 IICE C[C@@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2c(c1)OCO2 743521042 OJIKMEPYPJTZLU-ZBFHGGJFSA-N 433.455 4.046 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2ccncn2)c(C)n1-c1cccc(Br)c1 754922839 OLFVADBWPLDBAS-VOTSOKGWSA-N 440.297 4.086 10 10 IICE C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1cc(Br)cc(F)c1O 756760496 JQUJZUXVKWGQRB-VFZGTOFNSA-N 433.115 4.441 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 764541578 UNRDTMDUJCRICK-XLIONFOSSA-N 443.544 4.343 10 10 IICE COc1cc([C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc(OC)c1OC 773144522 FVKICTDHRYJFRO-LJQANCHMSA-N 439.600 4.095 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)Nc3cccc(C(C)(F)F)c3)CC2)cc1 782084638 IJIYGTBTNSVFIJ-UHFFFAOYSA-N 432.515 4.141 10 10 IICE COc1ccc(F)cc1-c1csc(NS(=O)(=O)c2cccnc2C(F)(F)F)n1 808530384 SNPQNHHRMUZSIQ-UHFFFAOYSA-N 433.408 4.172 10 10 IICE CC(C)C[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccs1 919655212 USXYQXUBHHVQML-UYAOXDASSA-N 428.602 4.036 10 10 IICE COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc(-n2c(C)ccc2C)cc1 1127109337 YRDSYNKBOPJYEP-NRFANRHFSA-N 430.426 4.498 10 10 IICE Cc1cc(C(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)c(C)n1-c1ccc(Cl)cc1 1147959915 KSXJZQMNURGWLW-VWLOTQADSA-N 437.971 4.114 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(C3CCOCC3)cc2)c1 1265026817 WMYXZLCFFRZTDM-UHFFFAOYSA-N 443.547 4.325 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1 1292562305 DLQCOSFSHRXJSW-UHFFFAOYSA-N 439.556 4.284 10 10 IICE CS[C@H](Cn1c(C2CC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 1302579974 KUEPUBKDXJYKSG-OAQYLSRUSA-N 443.661 4.406 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2C[C@H]2COCCO2)c(C)n1-c1ccccc1 1304190489 ROQZJBWXKKIVEA-NRFANRHFSA-N 437.588 4.250 10 10 IICE Cc1ccc(C2(NCC(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)CCC2)cc1 1307897675 RVPFSXNKDYLDGX-PMACEKPBSA-N 439.575 4.033 10 10 IICE CCOC(=O)c1sc2nc(C)cc(C)c2c1NC(=O)CN[C@H](C)c1ccccc1O 1308010675 WCSYNFQELQZNBN-CQSZACIVSA-N 427.526 4.085 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1ccc(Cl)s1 1349480642 MAUIQXZEDNCSBC-NTEUORMPSA-N 440.974 4.448 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2ccccc2C1 1350309806 KZKCQBSNXHAJGR-UYRXBGFRSA-N 426.538 4.002 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)OC(C)(C)C)CC3(C)C)ccc21 1353454713 MDIMOYUNNULUIS-UHFFFAOYSA-N 443.588 4.376 10 10 IICE C[C@@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1440670784 ABENIYSYWBFHCX-KRWDZBQOSA-N 436.474 4.259 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCOc3ccc(Cl)c(F)c3)cc2F)C[C@H](C)O1 1441792826 ZYGWFFMUVILVMW-GJZGRUSLSA-N 438.902 4.317 10 10 IICE Cc1ccccc1[C@H]1C[C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1448662309 MLGSYHJKXGSCCL-JCNLHEQBSA-N 442.562 4.239 10 10 IICE CCc1c(C(=O)N(C)CCN(C)c2ccc(OC)cc2)cnn1-c1ccc(Cl)cc1 1452834968 KRZUKGBKRLYFBP-UHFFFAOYSA-N 426.948 4.305 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2[C@H]1C(C)(C)[C@@H]2NC(=O)c1ccc(N=NC(N)=O)cc1 1454467494 NMTINWSKUCQVCM-ZACQAIPSSA-N 429.521 4.003 10 10 IICE CC[C@H](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)N1CCc2ccccc2C1 1464099341 KPMVKGROBYVILP-RUZDIDTESA-N 429.564 4.473 10 10 IICE COc1cc(OCCN(C)C)ccc1NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1469009401 BFGCJEZUZRZQIZ-UHFFFAOYSA-N 449.551 4.416 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3nc(-c4ccc(C)cc4)cs3)CC2)cc1 1473296867 SKKCUYPISVRIMJ-UHFFFAOYSA-N 436.581 4.278 10 10 IICE C[C@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1478449654 HQKHSCWPJKHJHQ-MRXNPFEDSA-N 435.490 4.269 10 10 IICE Cc1nn(C)c(C)c1CN(C)c1nnc(C2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1492719492 NKHHIOSUKVZOFZ-UHFFFAOYSA-N 439.583 4.176 10 10 IICE Cn1cc([C@@H]2CCN(c3nnc(CC(C)(C)C)n3CCCSc3nccs3)C2)cn1 1517377235 VTZQPOUWGGSQDW-MRXNPFEDSA-N 445.662 4.233 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 1525106807 MPZQHGOKXTVLSU-CVDCTZTESA-N 443.950 4.257 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Br)c(Cl)c2F)N(C)C)cc1 1537482301 DATMJATVDSEOBV-INIZCTEOSA-N 442.760 4.340 10 10 IICE O=C(CO[C@@H]1CCCc2ccccc21)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632352 IXDUUSVLQBCPNF-NZQKXSOJSA-N 428.960 4.220 10 10 IICE CC[C@H](C)CN(C)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1545635442 CPCAZUMDMRPPHR-HNNXBMFYSA-N 430.597 4.370 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(CSc3nc[nH]n3)cc2)cc1 1557276373 VKMSWVDQSSWUSU-UHFFFAOYSA-N 449.502 4.368 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(NS(=O)(=O)c2cccs2)cc1 1566359418 CDMCZTZQHLCKNL-UHFFFAOYSA-N 442.562 4.063 10 10 IICE O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)NCc1ccc2cccnc2c1O 1570533504 FJUAMEYIIXATQI-HSZRJFAPSA-N 428.488 4.259 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1586061332 PHEKNJSZCHXBSC-VWLOTQADSA-N 445.563 4.239 10 10 IICE CSCC1(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC1 1587035777 WLESQPPRZVAVKC-FOWTUZBSSA-N 438.615 4.067 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(-c3cccc(Cl)c3)nc2O)cc1 1616534580 PKXMSTBUYOUCBJ-UHFFFAOYSA-N 425.916 4.325 10 10 IICE CC1(C)CCC[C@@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)O1 1618441746 JNHAGZLVLTWESE-AOHITCTBSA-N 438.640 4.193 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)C2CC2)cc1 1624261936 FFHLFBCWGOWIPH-QHCPKHFHSA-N 427.539 4.401 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC(C)(C)N2CCc3ccccc3C2)c1 1626853519 QRMXIKMGZOGVJU-UHFFFAOYSA-N 429.564 4.473 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)CCCC1 1628867475 BXNCRWYEASFYQZ-HXUWFJFHSA-N 443.588 4.194 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](c1cccc(Cl)c1)N(C)C 1629969231 RSEZJVCHDNGQCM-GOSISDBHSA-N 425.754 4.460 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1-c1ccon1 1630281218 YUEDVVDRDPUKAN-MRXNPFEDSA-N 430.455 4.082 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC(OCCCOc4ccccc4)C3)ccc21 1630436027 HAZQWYQJRCVFJT-UHFFFAOYSA-N 436.552 4.215 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)c(C)n1-c1ccc(Cl)cc1 1641923755 NKVMXZOUQVURBZ-SFHVURJKSA-N 427.898 4.433 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1S(C)(=O)=O 1642874272 ITFKWCUZQSWTQV-UHFFFAOYSA-N 426.538 4.375 10 10 IICE COc1ccc(N2CCCN(CC(=O)N(C)Cc3cc(Cl)cc(Cl)c3)CC2)cc1 1644371434 SWSUPSPAVBFHAL-UHFFFAOYSA-N 436.383 4.173 10 10 IICE COc1ccc(N(C)CCN(C)Cc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)cc1 1646720638 WKVVHUULPVSODV-UHFFFAOYSA-N 438.593 4.405 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)c4nc(C)c(C)[nH]c4=O)n3)c2C)cc1 1654153488 IOZXXKOGOHHZGI-UHFFFAOYSA-N 433.537 4.479 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@]3(C)C3CCCCC3)cc2F)C[C@@H](C)O1 1659918955 UDCFRSPRVNIMBM-HHJKRLRDSA-N 431.596 4.100 10 10 IICE Cc1ccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1680563104 PBOGSWBFGODMSY-GHTZIAJQSA-N 429.992 4.288 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC(C)(C)c2cccc(Cl)c2F)N(C)C)cc1 1686220173 HEWWIVSRNJFWJV-FQEVSTJZSA-N 434.987 4.425 10 10 IICE CCN(CCC1CC1)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1695735605 QBJFHWFTLINHHY-UHFFFAOYSA-N 435.620 4.189 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](F)(C#N)C1 1705653913 SNTRXOORTOHWMX-XMMPIXPASA-N 448.571 4.161 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2Cc2cccs2)n1Cc1ccc(N(C)C)c(F)c1 1710723217 IHJGBTVGNONQRK-GOSISDBHSA-N 443.592 4.341 10 10 IICE CO[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC[C@@H]1C 1712070152 BWKBOQYSHLEXKM-WMLDXEAASA-N 433.603 4.347 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCN1CC 1743727119 YZQQCVRCWLTXPC-IRLDBZIGSA-N 440.636 4.001 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@H](c3cnn(C)c3)C2)cc1 1746091396 AIHNJOAWSGJFGD-OAQYLSRUSA-N 449.647 4.489 10 10 IICE CCC[C@](C)(O)Cn1c(Nc2cnn(C)c2)nnc1-c1cc(C)n(-c2ccccc2)c1C 1765469564 PXPSFYBXHWWNKH-DEOSSOPVSA-N 433.560 4.381 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCSC[C@@H]2C)cc1 1766613887 JTRBIXCBNLELNN-IBGZPJMESA-N 436.629 4.100 10 10 IICE COc1ccc(C(=O)c2ccccc2NS(=O)(=O)c2c(C)cc(OC)cc2C)cc1 1858035724 XBNZTMNUZQXZQR-UHFFFAOYSA-N 425.506 4.352 10 10 IICE COc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4)c(C)s2)cc1 1859571455 IAEYSPRBZRQHCW-UHFFFAOYSA-N 443.550 4.158 10 10 IICE COc1cc(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])s3)SC2=S)cc(OC)c1OC 1860087555 GDILAVFVYCCVKC-MDWZMJQESA-N 438.508 4.088 10 10 IICE CCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCCCN2CCCC2)C1=O 1873164926 YXOFLVNFINILCG-UHFFFAOYSA-N 448.611 4.050 10 10 IICE COc1ccc(Br)c(CNc2ccc(I)cc2)c1O 2227748334 NAFMAQWHNXSGSQ-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC(=O)c4ccccc4)cc3)C2=O)cc1 2293993157 PNELRSVGGWITJH-UHFFFAOYSA-N 440.455 4.135 10 10 IICE CC(=O)n1cc(C=C2C(=O)NC(=S)N(c3cccc4ccccc34)C2=O)c2ccccc21 2297552993 QMBYSEIGPRXIGY-UHFFFAOYSA-N 439.496 4.286 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)ccc1OC(C)C 2313549183 PFSGQBQKRTWLJR-UHFFFAOYSA-N 430.460 4.302 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccccc3C)C2=O)ccc1O 15045513 LVIPJLYEESTABZ-VCRXTVNUSA-N 442.562 4.328 10 10 IICE CC1CCN(S(=O)(=O)c2ccc3nc(NCc4ccc(N(C)C)cc4)ccc3c2)CC1 21881954 FBAPHZVPOOIAEB-UHFFFAOYSA-N 438.597 4.334 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccco2)SC1=S)Nc1cccc2nonc12 33526663 LTVDOHIUYSUMGD-FOWTUZBSSA-N 442.522 4.216 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S)Nc1nccs1 210757767 NNDDUHFTKJNETJ-NTCAYCPXSA-N 433.580 4.249 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)c1cc(C)n(-c3ccccn3)c1C)O[C@H](C)C2 730780936 UVLSPEUAWMZJLZ-QGCDCVKKSA-N 431.536 4.497 10 10 IICE CCC(C)(C)c1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 759222843 XVKHVQDHVKTYBS-UHFFFAOYSA-N 426.557 4.362 10 10 IICE CN1CC[C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@H]1c1ccc(Cl)cc1 760878946 OKCWKSSNGUYMTL-QNWVGRARSA-N 443.975 4.182 10 10 IICE Cc1nc([C@H]2CCCN2C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cs1 773238317 UDGRPXBIGYAHQT-VFCRVFHLSA-N 432.565 4.251 10 10 IICE CN1[C@H]2CC[C@H]1CC([C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccc(Cl)cc1)C2 802409035 PEFVXCHSGKLPMO-XZHLNKSASA-N 426.944 4.495 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(C)c1 1125769347 DJUWVRUHFMKJQQ-PDGQHHTCSA-N 430.526 4.373 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)cc1 1125893097 BKYAUCGPJZOCSM-UHFFFAOYSA-N 447.417 4.051 10 10 IICE Cn1cc(CN(C(=O)/C=C/c2cnc3ccccc3n2)c2ccc(Br)cc2)cn1 1133065881 PDTAVCMWNXMKIK-DHZHZOJOSA-N 448.324 4.372 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](c3nccc(C(F)(F)F)n3)C2)c(C)n1-c1ccccc1 1134541236 YOLLZALWQKHQLZ-QGZVFWFLSA-N 428.458 4.462 10 10 IICE Cc1cc(Cc2cnc(NC(=O)Cc3ccc(O)c(O)c3)s2)ccc1Br 1136303307 PYZDXSCUALUXER-UHFFFAOYSA-N 433.327 4.397 10 10 IICE Cc1cc(C(=O)NCc2ccc3nc(O)[nH]c3c2)c(C)n1-c1ccc(Br)cc1 1152156730 XZPCIEFQOXKLQF-UHFFFAOYSA-N 439.313 4.369 10 10 IICE C[C@H](Oc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cn1)c1ccccc1 1158716704 HEYAPNGDORNQEV-YADARESESA-N 432.568 4.320 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1C[C@H](CNC(=O)OC(C)(C)C)C1 1251466065 DPUWKGYCLYHPKY-MXVIHJGJSA-N 430.593 4.122 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1271357825 ZVHALZFMXCUURN-MRVPVSSYSA-N 425.659 4.175 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)C[C@@H]2CC)n1Cc1ccc(N(C)C)cc1C 1292020491 HYSQEDUWJIGBBN-UWJYYQICSA-N 440.636 4.244 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2Cc2ccn(C)n2)c(C)n1-c1ccccc1 1304191547 BLQACRRTQGUKHH-UHFFFAOYSA-N 439.514 4.226 10 10 IICE C[C@H]1C[C@H](C)CN(C(C)(C)Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1304913626 WPYRWUSMYPKXCH-PMACEKPBSA-N 448.615 4.439 10 10 IICE C[C@H]1CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C[C@@H](C)O1 1305152625 RIGCAKLUHGCBKT-GASCZTMLSA-N 433.578 4.337 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCc1cnn(C)c1 1305384736 UZRFKYZGQBKLIG-HXUWFJFHSA-N 435.620 4.395 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)cc1F 1307575233 UPEOEKIGQWBVJZ-CQSZACIVSA-N 425.426 4.002 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(-c4cccc(F)c4)s3)cc2)C1 1355065541 PLFHKDNCRSAOOU-GOSISDBHSA-N 437.540 4.186 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CCSc3cccc(Cl)c3)CC2)cc1 1356066547 YQWDZIPIUNGFCV-UHFFFAOYSA-N 448.032 4.159 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)COc3ccccc3C(C)(C)C)cc2F)C[C@@H](C)O1 1357836320 TUIRDRZHKYOEQF-QZTJIDSGSA-N 428.548 4.432 10 10 IICE C[C@@H](CNC(=O)OC(C)(C)C)Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O 1360611678 UXMYVXLLNFTHHQ-INIZCTEOSA-N 429.565 4.048 10 10 IICE Cc1c(Cl)cccc1-n1ccnc1SCC(=O)N1CCOc2cc(N(C)C)ccc21 1444704579 XAEUSMZOJDSYEL-UHFFFAOYSA-N 442.972 4.418 10 10 IICE Cc1cc(C(=O)N(Cc2ccccc2)C[C@@H](C)O)c(C)n1-c1ccc(Br)cn1 1465357556 VBWYEONTUBUQCO-MRXNPFEDSA-N 442.357 4.275 10 10 IICE Cc1cc(C(=O)NCC2(CC(N)=O)CCCCC2)c(C)n1-c1ccc(Br)cc1 1470473736 JQYCXWAPRBERAK-UHFFFAOYSA-N 446.389 4.412 10 10 IICE CC[C@@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)CCS1 1499659347 MYZHFYUYBPAKBP-IEBWSBKVSA-N 447.624 4.147 10 10 IICE CN(C)c1ccc(Cn2c(N3CCOC[C@@H](C4CCC4)C3)nnc2C(C)(C)C)cc1F 1503394039 VMRUIWVSOVFHLG-IBGZPJMESA-N 429.584 4.082 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCS(C)(=O)=O 1514639605 RCGFFPIKEYYYBF-UHFFFAOYSA-N 443.617 4.024 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Sc3ccc(Br)cc3)CC2)cc1 1526035201 CNXMRRZSRDRBGJ-HNNXBMFYSA-N 435.387 4.287 10 10 IICE Cc1cc(CC(=O)Nc2nc3c(s2)C(=O)NC(C)(C)C3)c(C)n1-c1ccc(Cl)cc1 1527034409 RSBKIYAVBZSTEC-UHFFFAOYSA-N 442.972 4.450 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1[C@H]1CCCOC1 1544676804 MYVYWJFPZUKWKL-UEXGIBASSA-N 443.563 4.139 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CCCCCC2)cc1 1547448044 IAHAKQPNADIRQL-GMAHTHKFSA-N 441.620 4.277 10 10 IICE CCc1ccc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1556053889 ASFXGGCRNXXYAL-AWEZNQCLSA-N 430.551 4.308 10 10 IICE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(C)ccc1-n1c(C)ccc1C)CCS2 1558718108 XZUPRWBDBOJBDG-IQJRZOLZSA-N 426.582 4.350 10 10 IICE CC[C@@H](c1ccccc1)N(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)C(C)C 1560021557 NRQUANHELQWSCD-RSXGOPAZSA-N 425.617 4.040 10 10 IICE C[C@H](NC(=O)NCc1cc(Br)ccc1Br)c1ccccc1O 1564588532 DXQNCZBOMJYRNT-JTQLQIEISA-N 428.124 4.478 10 10 IICE CC[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)[C@H](O)c1c(F)cccc1F 1566341271 CWVUJAPNPFWVAI-GMAHTHKFSA-N 426.463 4.427 10 10 IICE Cc1cc(C(=O)N2C[C@H](O)C[C@H]2c2ccccc2)c(C)n1-c1ccc(Br)cn1 1570266379 NJLVSFYAPQQZCP-QUCCMNQESA-N 440.341 4.200 10 10 IICE C[C@@H](Nc1ccc(C(=O)NCc2ccc3cccnc3c2O)cc1[N+](=O)[O-])c1ccccn1 1570531731 MRCRAARVQHYMSC-OAHLLOKOSA-N 443.463 4.347 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccn(-c4cccc(C(F)(F)F)c4)n3)C2)cc1 1584444600 TZFSCEJFCZWGEU-MRXNPFEDSA-N 444.457 4.156 10 10 IICE CCNC(=O)c1cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(C)s1 1587303847 XCFRKQRVFPVSSQ-UHFFFAOYSA-N 425.554 4.287 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2c[nH]c3cccc(Br)c23)N(C)C)cc1 1603555058 NQOPLLSCAJZAHQ-IBGZPJMESA-N 429.362 4.029 10 10 IICE CCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)C)CC1 1614176868 FYTIASTWNYNTLT-UHFFFAOYSA-N 434.588 4.067 10 10 IICE O=C(Cc1cc(C(F)(F)F)cc(Cl)n1)NCc1ccc(N2CCSCC2)cc1 1624892881 RFONKKKOKPEFJV-UHFFFAOYSA-N 429.895 4.166 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)Cc1cccc(C)c1 1633115430 SYVFYVSLXZOIOJ-NRFANRHFSA-N 434.536 4.173 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c(C)n1-c1ccc(C(C)C)cc1 1634626517 UIRFPFPNOLNABC-SFHVURJKSA-N 435.490 4.358 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1 1636263873 UFWAPRMWFYTTBL-IBGZPJMESA-N 446.599 4.366 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccn1 1639802353 KNQZQVPXESRMOM-APWZRJJASA-N 426.561 4.112 10 10 IICE COC(=O)C[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1cccc(C)c1 1644180954 UHNVHRHTNYPCHY-DEOSSOPVSA-N 432.520 4.178 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(OCC(F)(F)F)nn3)c2C)c1 1645216340 WONGBMVJQOBSIJ-UHFFFAOYSA-N 432.446 4.372 10 10 IICE O=C(NCCCSc1nccs1)[C@@H](c1ccc(Br)cc1)N1CCCC1 1648541549 DUDVWFCPBQOLEJ-MRXNPFEDSA-N 440.432 4.341 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCCC4)C3)cc2F)C[C@@H](C)O1 1653494988 MHDKQSLYHYUYAO-NHCUHLMSSA-N 445.623 4.492 10 10 IICE COc1ccc2c(=O)c(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)c[nH]c2c1 1654201020 QEKBYRVXMRWXFR-UHFFFAOYSA-N 431.492 4.038 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)cc1 1682141331 FDDUGEIYKJBNKW-VQTJNVASSA-N 432.362 4.091 10 10 IICE CCc1nnc(N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)n1Cc1ccc(N(C)C)c(F)c1 1694698421 UJKYRHAWCMYYGU-APWZRJJASA-N 426.367 4.114 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1710773422 LWADENWPJORXFN-CTNGQTDRSA-N 437.588 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCO[C@](C)(CC)C2)cc1 1728378701 DDGSLSDECKDKSX-RUZDIDTESA-N 434.588 4.240 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3Cc3cccs3)CC2)cc1F 1730181049 ZCPLPDQWBXJMBT-UHFFFAOYSA-N 443.592 4.451 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1 1748357838 PUWQZLFIYMVUFT-UHFFFAOYSA-N 434.544 4.402 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3CCc4c(c5cc(Cl)ccc5n4C)C3)CC2)cc1 1858153757 UEDKKKCJWBIPIB-QGZVFWFLSA-N 437.971 4.294 10 10 IICE C[C@@H](NC(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)c1ccccc1 1860343558 GOOQRWNJTHNVMY-GOSISDBHSA-N 448.526 4.452 10 10 IICE COc1ccc(C)cc1NC(=O)CCNCc1cc(Cl)cc(Br)c1O 1860714982 HAJCZJYEAGFDKA-UHFFFAOYSA-N 427.726 4.244 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cccc(NC(=O)C(F)(F)F)c1 1866034285 NWQWDVXUJPKKJX-UHFFFAOYSA-N 438.361 4.215 10 10 IICE CC(C)CCn1cc(OCC(N)=O)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1871114551 CMPGIPQGNFFSRI-UHFFFAOYSA-N 434.540 4.114 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@@H](NCc2ccc(Br)cc2O)C1 1967845438 KCFNZZOVRGQXMK-KRWDZBQOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@@H]1CNCc1cc(Cl)cc(Br)c1O 2078327246 AZCQZGXAJJILER-WHOFXGATSA-N 431.758 4.153 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C(C)C)c(CO)c2I)c(O)c1 2080001298 GRASLDGZNDCWEP-KRWDZBQOSA-N 444.313 4.063 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4cccnc4)SC3=NC2=O)c(C)n1-c1cccc(F)c1 2297469888 IBFSWFBZCCZHBA-UHFFFAOYSA-N 444.495 4.296 10 10 IICE CC1=NN(c2ccc(S(N)(=O)=O)cc2)C(=O)C1=Cc1ccc(-c2cccc(Cl)c2)o1 2297533519 IVMBWAIEMYEVTA-UHFFFAOYSA-N 441.896 4.054 10 10 IICE Cc1ccc2nc(N3CCOCC3)c(C=C3SC(=S)N(CC(C)C)C3=O)cc2c1 2314648108 OQHFYSDWHDENFU-UHFFFAOYSA-N 427.595 4.237 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OC 2314717269 XUSWJQWCQNOJQC-UHFFFAOYSA-N 428.535 4.030 10 10 IICE COc1cc(C=C2C(=O)N(c3ccccn3)N=C2C)cc(Br)c1OC(C)C 2332127024 URPZWKIQZMXRLT-UHFFFAOYSA-N 430.302 4.446 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2ccc([S@@](C)=O)cc2)C1 435917195 LOAZIMGHPQRXHJ-FZEVHQGJSA-N 437.609 4.023 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3cc(OC)c(OC)c(C)c3OC)ccc21 478613354 CXCSTZGEAZYTLT-UHFFFAOYSA-N 426.513 4.491 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(C(C)=O)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526260978 IYFFGPURSLAPTM-QHCPKHFHSA-N 431.444 4.366 10 10 IICE Cc1sc(NS(=O)(=O)c2cccc3c2COC3=O)nc1-c1c(F)cc(F)cc1F 729111260 BYQPWLUUTSZWBN-UHFFFAOYSA-N 440.424 4.007 10 10 IICE C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732241460 JQWLOBZCAQHXPS-QVKFZJNVSA-N 433.474 4.275 10 10 IICE CC(C)(C)OC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 743554687 KFWYTMSBVUHPKA-UHFFFAOYSA-N 441.597 4.195 10 10 IICE CCOc1ccc(C(=O)N2CCC(NCc3cc(Br)cc(C)c3O)CC2)cc1 775827085 BJPAJXHQKBIHSK-UHFFFAOYSA-N 447.373 4.256 10 10 IICE CN(C)c1ccc(CN[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(C(F)(F)F)c1 793068264 VMDKTAXGUZGDSG-KRWDZBQOSA-N 433.453 4.274 10 10 IICE Cn1nccc1C1=CCN([C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CC1 794739380 NPWNGDMCOUZARY-QHCPKHFHSA-N 440.507 4.257 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](c3ccccc3)c3nc[nH]n3)cc2Cl)C1 800718755 DFCQPQBNQQUXRS-HRAATJIYSA-N 438.963 4.283 10 10 IICE Cc1ccc(C)c(C2=NO[C@@H](C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2)c1 1126657516 JLTIFDFQRKGNCY-HTAPYJJXSA-N 443.494 4.183 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CN(Cc3ccccc3)C[C@H]2CC(C)C)cc1 1130745427 WBKRPIUUCNZZRR-ZEQKJWHPSA-N 437.628 4.384 10 10 IICE Cc1cccc(-c2nnc(S)n2CCC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 1184099335 SCMIGANLZWFXHT-UHFFFAOYSA-N 437.613 4.436 10 10 IICE O=C(CN[C@H](c1ccccc1)C(F)(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1191839719 RKXBDDHNWULXGV-HSZRJFAPSA-N 438.405 4.294 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4ccccc4C)c3C(F)(F)F)C2)cc1 1278861478 JIMNPPHWCAJMCB-INIZCTEOSA-N 444.457 4.217 10 10 IICE CSC[C@@H]1CCCN1c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1302705844 DDSQQVKPUMHOGF-QFIPXVFZSA-N 436.629 4.018 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1305594811 RNTAHGSREAMKLG-GOSISDBHSA-N 436.604 4.313 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](OC)C(C)(C)C1 1316031932 BRLZVTUSKCLYDQ-QFIPXVFZSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3ccc(C(=O)OC(C)(C)C)o3)CC2)cc1 1435026268 SRQZDEOVMOIAAP-ZRDIBKRKSA-N 426.513 4.042 10 10 IICE COC(=O)[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1cc(C)cc(C)c1 1436018163 IFRNUBIIXWVOEL-RUZDIDTESA-N 434.536 4.176 10 10 IICE CC[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)/C=C/c1cncc(C(=O)NC)c1 1458252718 LZZQJKNJYVTPHI-RUCTVCJSSA-N 432.568 4.203 10 10 IICE CC[C@H](C)COc1cc([N+](=O)[O-])c(CN2CCOc3cc(N(C)C)ccc32)cc1OC 1459875040 KOFAMVFOCXFDNG-INIZCTEOSA-N 429.517 4.493 10 10 IICE CCN(c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1501607732 RITQRGASHGWJAH-OAQYLSRUSA-N 429.634 4.356 10 10 IICE CN(CCC(F)F)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1503570434 RSFGTOHOTFBBQW-UHFFFAOYSA-N 444.555 4.033 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](N3CCCC3=O)C2)n1CCCSc1nccs1 1512965852 IQMKAKKSVWAVLN-SJORKVTESA-N 448.662 4.022 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N2CCO[C@H](C(F)(F)F)C2)cc1 1515533277 VKAYDFCFFWSQJG-IBGZPJMESA-N 437.510 4.208 10 10 IICE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1525761708 GCSURYGLQSHLBD-KHOMTPLRSA-N 435.612 4.108 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1-c1ccccc1Br 1539187507 AXDLJNKFBTUGAM-UHFFFAOYSA-N 427.346 4.281 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1ccc(Br)c([N+](=O)[O-])c1 1540488368 OPOPVKDMFKTCER-UHFFFAOYSA-N 432.318 4.159 10 10 IICE CC(C)[C@@H]1CCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541380821 YOKPNVKYHMBUCQ-QHCPKHFHSA-N 439.648 4.457 10 10 IICE COC(=O)c1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)c(OCC(F)(F)F)c1 1546261028 PTFLSYWUHGDURX-UHFFFAOYSA-N 441.383 4.293 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CCC[C@H]3C)CC2)cc1F 1554960217 CMWTWAHBRWCGBU-MOPGFXCFSA-N 429.584 4.387 10 10 IICE Cc1cc(C(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)c(C)n1-c1ccc(F)cc1 1567823836 OROTWZVLXXFEKB-UHFFFAOYSA-N 425.451 4.123 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)cc1 1585614505 RAFJJTCJJOCHMK-HXUWFJFHSA-N 445.563 4.481 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)COc3ccc(Br)cn3)c2C)c1 1596482535 OZEHPHZVWRWSST-UHFFFAOYSA-N 428.330 4.255 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@H](CC(=O)OC(C)C)C2)CCCC1 1611030374 ONNWRTZKSSQTKQ-GOSISDBHSA-N 426.557 4.109 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3ccc(Cl)s3)cc2F)C[C@H](C)O1 1617055587 FPHJAUKKNDDKNP-SOUVJXGZSA-N 439.984 4.121 10 10 IICE CCOc1ccccc1N1C[C@@H](C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1=O 1623471687 KYPINJYCSBYKRQ-NRFANRHFSA-N 435.568 4.087 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1ccc(Cl)cc1 1627092125 VSFDEYYFJZXXKR-LSDHHAIUSA-N 440.931 4.241 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C 1628859971 HUELQPGFZIAVRV-QFIPXVFZSA-N 439.556 4.048 10 10 IICE CCc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)c2c(CC(C)(C)C)noc2n1 1631069253 DFMRPDRRDYFBCJ-UHFFFAOYSA-N 436.556 4.140 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1cc(F)cc([N+](=O)[O-])c1 1631527533 WVXPFURTYZNLBW-UHFFFAOYSA-N 448.498 4.351 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)c2C)cc1 1632269031 NWPVPPFAGOYCQQ-IYARVYRRSA-N 427.545 4.136 10 10 IICE COc1cccc([C@@H](O)CN(Cc2ccccc2)C(=O)c2ccc(N=NC(N)=O)cc2)c1 1633382318 PJRFXCCWZGUALV-QFIPXVFZSA-N 432.480 4.234 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](F)CN(Cc1ccccc1)Cc1ccccc1 1633818425 HVRWJUHHAJVDLB-XXBNENTESA-N 436.527 4.186 10 10 IICE COC(=O)[C@@H](Cc1cc2ccccc2o1)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1634282932 GRSMDTDERPDOIH-JOCHJYFZSA-N 434.467 4.494 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCN(CCCc2ccccc2)CC1 1636263327 OYHMIVPGTORXAK-QHCPKHFHSA-N 436.644 4.342 10 10 IICE Cc1cc(C(=O)NCc2nc3c(s2)COCC3)c(C)n1-c1ccc(Br)cc1 1638996975 JRCABJOKWFLOOY-UHFFFAOYSA-N 446.370 4.316 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(C)c3ccc(C(C)(C)C)cc3)cc2F)C[C@@H](C)O1 1641568792 FPCTURMQGCKEEK-RTBURBONSA-N 441.591 4.489 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@H](C)c3cccc4ccccc34)CC2)cc1F 1644919515 QHXKJLCGCMWQSJ-MOPGFXCFSA-N 435.543 4.375 10 10 IICE COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c1 1652603477 LBWZOASAGUBXIT-UHFFFAOYSA-N 426.400 4.190 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])c1 1655534257 JBTFVBWVUDVXTR-HKPHNFCXSA-N 445.516 4.008 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1657875752 GSBWUGWVPQGDRQ-RTWAWAEBSA-N 435.612 4.352 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[S@](=O)C(C)(C)CC3)cc2Cl)C1 1681828342 SMSNQMOHTJVABA-OLRZCDJHSA-N 426.026 4.019 10 10 IICE Cc1cc(CNC(=O)N(C)CCN2CCN(c3ccccc3)CC2)c(C)n1-c1ccccc1 1684479286 VWBPYSDLOALRGK-UHFFFAOYSA-N 445.611 4.058 10 10 IICE CCc1cnc(CN(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)s1 1694558943 CKAYAHZRZKSXNZ-UHFFFAOYSA-N 439.564 4.182 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)CC1CC(F)(F)C1 1707304897 JTPVYQYJISENRP-UHFFFAOYSA-N 440.542 4.168 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@](C)(OC)C1CC1 1708507488 LQDYZWLHRPNUSE-DFBJGRDBSA-N 441.620 4.332 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCOC(C)(C)C 1708508659 KKOUCHDKMVFUTH-LJQANCHMSA-N 429.609 4.332 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2CCCC2)n1CCCOC(F)F 1711080051 DAVHERKTSGUVBC-UHFFFAOYSA-N 449.546 4.038 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCCCCC2)nnc1[C@]1(OC(C)C)CCOC1 1724233623 AATDDMMOLZFOAL-VWLOTQADSA-N 441.620 4.122 10 10 IICE CCN(CC(C)C)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1728340886 OIZDSAJAPDYELM-UHFFFAOYSA-N 430.597 4.370 10 10 IICE CCN1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)CC1=O 1767079722 KQZKDYHZVWLLQM-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CCOCCC1(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCC1 1768054555 BMGCMVVDVPPWNH-FQEVSTJZSA-N 428.577 4.111 10 10 IICE CN(C)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccsc2)cc1F 1768496322 GXUYVTKKOPWDTH-UHFFFAOYSA-N 436.560 4.215 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3C[C@@](C)(O)C(C)C)CC2)cc1 1768705064 UDJTVZHBLDPYQC-RUZDIDTESA-N 441.620 4.068 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CCSC3)CC2)cc1 1770257711 HBMSVEHSPVYKEI-IBGZPJMESA-N 443.661 4.345 10 10 IICE COc1ccc(N2N=C(C(F)(F)F)/C(=C/c3cc(OC)c(OC)cc3OC)C2=O)cc1 1865678688 ZFAAUOHHSVAXGJ-DHDCSXOGSA-N 436.386 4.070 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2c(O)cccc2Br)C[C@H]1C1CC1 1895877173 XXQYXTPWVZCBNB-YOEHRIQHSA-N 425.367 4.422 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)c(O)c(O)c1 1951855180 LZVWTNQHUPTZHH-VWLOTQADSA-N 449.459 4.032 10 10 IICE CC(C)c1ccccc1NC=C1C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O 2296938896 JTMIFHFQJDBHDA-UHFFFAOYSA-N 428.286 4.151 10 10 IICE Cn1cc(C=C2C(=O)NC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)c2ccccc21 2297360424 YUTMQZIVKUUKBP-UHFFFAOYSA-N 429.423 4.028 10 10 IICE COc1cc(C=C2C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)ccc1OC(=O)c1ccco1 2313656791 MNAZEGKXCFENHE-UHFFFAOYSA-N 446.415 4.012 10 10 IICE O=C1C(=Cc2ccc(F)c(Br)c2)SC(=S)N1CCCn1ccnc1 2318684013 MRSNACCIMSGGPE-UHFFFAOYSA-N 426.336 4.076 10 10 IICE CCCC1=NN(CC(C)C)C(=O)C1=Cc1ccc(OCC(=O)N(CC)CC)c(OCC)c1 2332139674 GIRCHCFBDUYOME-UHFFFAOYSA-N 443.588 4.370 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1cccc(Br)c1O)[C@H]2F 2333276457 UBSWLOMBQYRMCI-SYAUCNOPSA-N 429.330 4.123 10 10 IICE Cc1ccc(CNC(=O)CCC[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352638866 TXKFBTGMFMDHFP-CYBMUJFWSA-N 429.355 4.163 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H](C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2352942223 BESIJYYOEZEFHG-ZDUSSCGKSA-N 429.355 4.067 10 10 IICE CC(=O)c1cccc(N2C(=O)/C(=C\c3ccc(OCCC(=O)O)cc3)SC2=S)c1 16907863 UBUSNYVXKKZLDO-WOJGMQOQSA-N 427.503 4.149 10 10 IICE COc1ccc(N2CCN(c3ncnc(Oc4ccc5ccccc5c4)c3N)CC2)cc1 40687750 GFSGGYJGPVNCTD-UHFFFAOYSA-N 427.508 4.340 10 10 IICE COC(=O)c1c(NC(=O)[C@@H](C)[C@@H]2Sc3ccccc3NC2=O)sc2c1CCCC2 40839482 ONMQFNYVLYYFCE-GTNSWQLSSA-N 430.551 4.101 10 10 IICE CCOc1ccc(N2C(=O)N=C(O)/C(=C/c3cc(C)n(C[C@@H]4CCCO4)c3C)C2=O)cc1 59109230 CUQUGLJHSBGGKX-GAASDFDMSA-N 437.496 4.189 10 10 IICE Cn1nc(C(=O)N(c2ccccc2)c2ccc(N)cc2)c2c1CCN(C(=O)OC(C)(C)C)C2 170244277 LQAVKLKYNGPBSV-UHFFFAOYSA-N 447.539 4.274 10 10 IICE Cc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2cccc([N+](=O)[O-])c2)SC1=S 205691306 HTGCJBZBNHBVBQ-SFQUDFHCSA-N 427.507 4.133 10 10 IICE Nc1ccc(NC(=O)Nc2ccc(Br)c(I)c2)cc1 311606149 CMADQCGHRWFPSJ-UHFFFAOYSA-N 432.059 4.280 10 10 IICE C[C@H](Cc1ccc(Br)cc1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761123752 VMCNXCVFIXKRQK-GFCCVEGCSA-N 437.721 4.204 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H]1c1ccccc1I 779519416 DBVMGCBOBRKJOJ-XAVKZTDYSA-N 435.261 4.079 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3nc(-c4ccsc4)ns3)cc2F)C[C@@H](C)O1 790522807 JEZSMYLLEPVCCH-BETUJISGSA-N 447.561 4.341 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(C)cc(C)c3OC)n2)cc1OC 800924635 DAFSKXWDLAUSMK-UHFFFAOYSA-N 434.539 4.254 10 10 IICE CCCN1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@@H](CC)C3)CC1=O 1128128185 HAAYGJQRFNZLAU-CABCVRRESA-N 434.602 4.415 10 10 IICE CN(c1ccc(CNC(=O)[C@@]2(O)CCCN(Cc3ccccc3)C2)cc1)C1CCCCC1 1136446660 QFGROCSSKHNMPD-HHHXNRCGSA-N 435.612 4.099 10 10 IICE COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1OCc1ccc2ccccc2n1 1143621193 AMASBAHHBMJDCR-UHFFFAOYSA-N 430.460 4.415 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 1151723893 ARAPEPQWOFBUCE-IBGZPJMESA-N 430.552 4.257 10 10 IICE COc1cc(N)c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1Br 1170856578 ATVGRTZMFWBDLU-UHFFFAOYSA-N 428.330 4.377 10 10 IICE Cc1cc(CCNC(=O)NC[C@H]2COC3(CCC(C)CC3)O2)c(C)n1-c1ccccc1 1225148519 WFJMAVXUAPHYMM-JXHKIWKSSA-N 425.573 4.258 10 10 IICE COCCCC[C@@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1 1248459718 JNXALTZZWXHYCW-JOCHJYFZSA-N 447.526 4.159 10 10 IICE CC[C@H](c1cccc(OC)c1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251750897 QDBWURZJXHWGLO-OAQYLSRUSA-N 433.499 4.103 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)CC(F)(F)F 1276234989 IWSKJGZJMFPHPM-KSSSLANASA-N 434.480 4.122 10 10 IICE CCN1CCN(Cc2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc2)CC1 1290859871 KQYLKXBLKVDSFU-UHFFFAOYSA-N 444.579 4.296 10 10 IICE CO[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCCC1 1293793742 QYGAMBSHHLYJRX-RTWAWAEBSA-N 433.593 4.030 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)n(-c3ccccc3Br)n2)c1 1294936237 CUXLDBFCOHVCKG-ZDUSSCGKSA-N 430.302 4.148 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2C[C@H](C)CC(C)(C)C2)cc1 1295416407 ZTHOQHPIJGTHBS-LJQANCHMSA-N 435.620 4.446 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2ccc(F)cc2)nc1 1295590477 JCXKSFLBYBTRHU-UHFFFAOYSA-N 444.846 4.187 10 10 IICE COCc1cc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc(C(=O)OC)c1 1298417458 ZSPLPLGGZQUGRL-UHFFFAOYSA-N 434.492 4.400 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H]1c1ncc(Br)cn1 1312885477 QAPVOTGWTDIZNX-BEFAXECRSA-N 446.393 4.091 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 1350046267 ZBKXNCYJASDZHU-UHFFFAOYSA-N 435.528 4.265 10 10 IICE CN(CCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(=O)OCc1ccccc1 1355508884 OJRQEGMJEBEUNA-UHFFFAOYSA-N 442.471 4.059 10 10 IICE Cc1cc(CNC(=O)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)c(C)n1-c1ccccc1 1438307307 YSCSZHNEUCNNSN-JOCHJYFZSA-N 445.563 4.028 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cccc4nc(O)n(CC(C)(C)C)c34)CC2)cc1 1455934847 VSOLAPNMQIFUCV-UHFFFAOYSA-N 436.556 4.195 10 10 IICE COC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1459861091 BGCNVLFIWOTORM-GOSISDBHSA-N 434.536 4.119 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@@H]1C 1503798560 RTWRLDDCNUEULV-GHTZIAJQSA-N 448.615 4.361 10 10 IICE Cc1cccc(N2CCN(c3nnc(C)n3CCCSc3nccs3)CC2)c1C 1511179384 CHKDRZPJLWXWMY-UHFFFAOYSA-N 428.631 4.169 10 10 IICE Cc1csc([C@H](C)Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)n1 1511449030 RZDREABGJFVFCL-BEFAXECRSA-N 427.574 4.430 10 10 IICE COC(=O)c1c(NC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)nc2n1CCC2 1532028584 OAIWCEQJYOGCRE-UHFFFAOYSA-N 432.484 4.350 10 10 IICE C[C@H](Sc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1535568206 AHILRGRBORYNHS-SFHVURJKSA-N 427.589 4.155 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3ccc(-c4ccccc4)cc3)cc2F)CC1 1537534501 BVYZHZVDYJTMNR-UHFFFAOYSA-N 431.555 4.494 10 10 IICE Cc1cccc(-c2nnc(N3CC(C)(C)OC[C@@H]3C)n2CCCSc2nccs2)n1 1542591012 ZAAOVVNIPTXHLK-INIZCTEOSA-N 444.630 4.291 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(C)C 1547249070 FSPZZLXXZKRMER-UHFFFAOYSA-N 436.604 4.361 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCc3c(C)nn(Cc4ccc(C)cc4)c3C)C2)cc1 1557449643 JMVNVCIJBIHQGR-HSZRJFAPSA-N 446.595 4.193 10 10 IICE Cc1nn(C)c(C)c1[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)C(F)(F)F 1566177040 UNVJCADMEYEYCZ-FQEVSTJZSA-N 432.446 4.290 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 1566846579 YQVNEXNKQFAYIS-QFQXNSOFSA-N 430.548 4.383 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)n1[C@@H]1CCCOC1 1584357102 XQODMSHGNPMVBF-HXUWFJFHSA-N 447.526 4.457 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(-c4noc(C(F)(F)F)n4)cc3)C2)cc1 1584438258 BBJFATJHUYFURX-AWEZNQCLSA-N 446.429 4.020 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H](N3CCCC3=O)CC2)c(C)n1-c1ccc(Cl)cc1 1584984426 CNBLXSXTJLBMMR-OAQYLSRUSA-N 427.976 4.294 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1C 1587004541 OZEYLVNGXHYKKW-UHFFFAOYSA-N 437.565 4.439 10 10 IICE CCOc1cccc(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1587314633 RSRIOMDIYBORFY-LDADJPATSA-N 431.510 4.421 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)CC[C@H]3C)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935053 FLHNVQCILTVGIT-ZWKOTPCHSA-N 434.588 4.066 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)C[C@@H](C)C1 1614973712 SSGIOVTXUHVNSP-KDURUIRLSA-N 448.615 4.361 10 10 IICE C[C@@H]1Nc2ccnn2[C@@H](C)[C@H]1CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1626479140 CFHZJFKMXRUZRV-FTRWYGJKSA-N 447.530 4.041 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2csc(-c3ccccc3Cl)n2)N(C)C)cc1 1627465051 VHRZDRWOUIKXAX-OAQYLSRUSA-N 443.016 4.491 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)cc1 1628635038 SMJQDNAQHFOEES-FQEVSTJZSA-N 445.563 4.481 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ccc(Cn2cc(N)c(C(F)(F)F)n2)cc1 1629960093 ZZOOIRCWQGUYLQ-UHFFFAOYSA-N 432.446 4.290 10 10 IICE CC(C)(C)C(=O)Nc1ccccc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257019 KZWNFKQJEWOMPC-GOSISDBHSA-N 443.975 4.425 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccn(-c2ccc(Cl)cc2)n1 1630257162 PWUZNEHXMXIGRH-GOSISDBHSA-N 445.350 4.279 10 10 IICE Cc1c(Br)ccc2[nH]c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cc12 1637004687 LNZDTSVVMFJHQD-OAQYLSRUSA-N 443.389 4.338 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(C3CCCCC3)C2)c(C)n1-c1ccc(Br)cn1 1641721350 FRSSSLSZXOYWLI-GOSISDBHSA-N 445.405 4.388 10 10 IICE Cc1cc(C(=O)NC2(C)CCC3(CC2)OCCO3)c(C)n1-c1ccc(Br)cn1 1653612574 YOSBUWYGTVAGRM-UHFFFAOYSA-N 448.361 4.057 10 10 IICE COc1ccc(C[C@@H]2CCCCN2C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1673822421 AYWLGABCTPNUNQ-GMAHTHKFSA-N 437.584 4.337 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1680563092 PAJDIAAUVXHTBP-JXFKEZNVSA-N 433.955 4.118 10 10 IICE CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1682096841 BVEXVRWBYRSZRT-BWKNWUBXSA-N 437.632 4.083 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1706326101 WTLISFJDHMLUPA-FQEVSTJZSA-N 443.611 4.472 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752135354 NQIXWPVMLSGTRE-CTNGQTDRSA-N 441.620 4.025 10 10 IICE CC[C@H](C)N(C)CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763897435 WOMXZQUNEPLXAT-INIZCTEOSA-N 428.968 4.066 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C[C@@H](C)O1 1765293038 ITEUPQISLMNMEO-XMSQKQJNSA-N 439.629 4.357 10 10 IICE COc1ccc([N+](=O)[O-])cc1N1C(=O)/C(=C\c2c(C)nc3scc(C)n23)SC1=S 1860084240 RPTKUAHNWLZBBX-VIZOYTHASA-N 446.535 4.335 10 10 IICE COC(=O)c1ccc(N2C(=O)/C(=C\c3cn(C)c4ccc(OC)cc34)SC2=S)cc1 1860086207 QGPHTRPPLNQODM-VXLYETTFSA-N 438.530 4.379 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)c1O 2227748804 QOVYYJVCDQBLPG-DOMZBBRYSA-N 429.355 4.041 10 10 IICE CC[C@@H]1CCCCN1C(=O)CCCN1C(=O)C(=Cc2cccc(OC)c2)SC1=S 2297554716 URULGDFWBHEZNU-QGZVFWFLSA-N 432.611 4.468 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3O)C2=O)cc(Br)c1O 2321664262 FKHWMFXKLIBENK-UHFFFAOYSA-N 438.324 4.275 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(c4ccc(C(=O)O)cc4)C3=O)n12 2321706159 STGGLGQJUXUADU-UHFFFAOYSA-N 435.939 4.462 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC[C@H](NC(=O)OC(C)(C)C)CC2)c(O)c1Br 2380757832 SNQCKMWPPRAISG-CTYIDZIISA-N 441.366 4.163 10 10 IICE CC1=NN2C(=N)/C(=C\c3cn(Cc4ccccc4[N+](=O)[O-])c4ccccc34)C(=O)N=C2S1 34910057 OUROVMKBKAEFLO-ZZYMSUEGSA-N 444.476 4.237 10 10 IICE COc1cc(/C=C2/C(=N)N3N=CSC3=NC2=O)ccc1OCc1ccc(Cl)cc1 89267730 BTKVFXZYTLEJMZ-UJNQTBGZSA-N 426.885 4.177 10 10 IICE CCN1CCN(c2cc(C)c3cc(NC(=O)/C=C\c4ccc5c(c4)OCO5)ccc3n2)CC1 104345101 JIMBJMCDCNAGRC-UITAMQMPSA-N 444.535 4.066 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2ccc3ccccc3n2)C1 435741445 PEDYBTSEAJPTFY-UHFFFAOYSA-N 426.564 4.315 10 10 IICE Cc1cc(C(=O)COC(=O)CCCc2ccc3c(c2)CC(=O)N3)c(C)n1-c1ccc(F)cc1 729760391 UKIVVAYIHKOPLB-UHFFFAOYSA-N 448.494 4.477 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccnc(N3CCCCC3)n2)c(C)n1-c1ccc(F)cc1 740314965 JMKDNIRMGWENSQ-UHFFFAOYSA-N 436.487 4.053 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N(C[C@H]1CCCO1)C1CCCC1 749564496 KSWUPWVIYTXYKB-OAQYLSRUSA-N 437.531 4.390 10 10 IICE Cc1ccccc1CC1CN(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 752865813 MTBMOEBAZXRMMQ-UHFFFAOYSA-N 447.501 4.235 10 10 IICE C[C@H](Nc1cnn(CC(=O)NC2CCCC2)c1)c1cc(Br)cc(Cl)c1O 756867454 KHTJMADLUSEKOB-NSHDSACASA-N 441.757 4.237 10 10 IICE Cc1nccc(N2CCN(C(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)CC2)n1 760094233 GZQUHRUOMGCOQV-UHFFFAOYSA-N 429.528 4.229 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2/SC(=S)N(CCc3ccccn3)C2=O)cc1 764886749 SHHJQCVRVYXJSN-NBVRZTHBSA-N 426.563 4.481 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 773285552 NDYJKXKILLXUJD-OFVILXPXSA-N 449.595 4.012 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 781645480 CHLAHGUAESQSNU-UHFFFAOYSA-N 447.360 4.467 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)c([N+](=O)[O-])c1 782381278 ZQZZYBOGLWLBFX-KFILLSGMSA-N 436.386 4.378 10 10 IICE COC(=O)c1ccc(-c2csc(NS(=O)(=O)c3cc(C)cc(C)c3OC)n2)cc1 800925993 ZQAZRAZRXNMHHC-UHFFFAOYSA-N 432.523 4.023 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3C)C2=O)o1 1084519979 YAXXTESDJAMKMR-UYRXBGFRSA-N 445.431 4.392 10 10 IICE CSc1cccc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)CC2=O)c1 1124873377 WLBYHHJBSWLQIM-LJQANCHMSA-N 425.598 4.265 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)c1 1126027555 TXXHLZNEKJQLKW-UHFFFAOYSA-N 439.918 4.485 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2C[C@@]2(C)c2cccc(Br)c2)cc1 1130547523 KZCSMYDVFMOLGK-IRLDBZIGSA-N 431.374 4.330 10 10 IICE COc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1N1CCOC1=O 1136972548 QUKGAEYLGYKMQK-UHFFFAOYSA-N 433.464 4.124 10 10 IICE COc1ccc(N(C)C(=O)c2c[nH]nc2[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1Cl 1150045986 KCEPADITPGCOFG-CYBMUJFWSA-N 434.924 4.073 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc(Cc2ccc(F)cc2)nc1C 1162540007 PPCSYPHIKWBQTF-UHFFFAOYSA-N 442.512 4.093 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3ccccc3NC2=O)c(C)n1-c1ccccc1Br 1170838592 YSFYBLUYOBIJQS-LJQANCHMSA-N 438.325 4.150 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@](C)(C(F)(F)F)C1 1197555808 YRJOXOSXBYQOGK-XMHCIUCPSA-N 430.426 4.063 10 10 IICE CC(C)(C)Cc1nnc(N2CCC[C@H](C(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1287028302 DZKRXUBWQZABQF-IBGZPJMESA-N 447.574 4.233 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2CCCN(Cc3ccccc3)C2)cc1 1292382614 UTBIQERJVMVMLT-AZGAKELHSA-N 435.612 4.172 10 10 IICE CCOC(=O)[C@@H](C[C@H]1CCCO1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1303455292 AIUDVPYJMBMMEZ-FYYLOGMGSA-N 426.557 4.448 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCN(C)[C@@H]1c1cccs1 1306080542 MJBPYVOCZWOGFD-GCJKJVERSA-N 425.602 4.327 10 10 IICE CO[C@]1(C)CCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CC1 1315256358 MBCSZQPEMUONQK-OXQOHEQNSA-N 437.635 4.164 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(F)c(F)cc1F 1353107501 QWLCKVUQXFRMBG-APSNUPSMSA-N 440.443 4.473 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1cccc([N+](=O)[O-])c1 1356452224 TWDYBIZWGIONMD-BOPFTXTBSA-N 446.481 4.069 10 10 IICE Cc1nc(-c2cccs2)sc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436623725 HEVWCOMBWGIIFW-UHFFFAOYSA-N 435.521 4.225 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnn2c(C(F)F)cc(C3CC3)nc12 1436847051 JWOHYFHBLXSNPU-CQSZACIVSA-N 427.499 4.280 10 10 IICE COc1cc(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1F 1437345371 DVMCMOAZAQKMHX-YVLHZVERSA-N 435.473 4.170 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(C)n1-c1ccccc1Br 1450039836 UMIVBJODPPRBKL-RXVVDRJESA-N 431.374 4.384 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2noc(C(F)F)n2)c(C)n1-c1ccc(Br)cn1 1451064059 IEGSSSZDJPWOAZ-SECBINFHSA-N 440.248 4.063 10 10 IICE CCN(Cc1cccc(Br)c1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1471543389 HXIOREVUYIRRRR-OAQYLSRUSA-N 447.421 4.350 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H]3C)n2CCSCCCO)c(C)n1-c1ccccc1 1510616456 BIGFUSNMZFIWKX-SFHVURJKSA-N 439.629 4.457 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)c(C)n1-c1ccccc1 1538028590 IMLFBBKCMBFYPD-UHFFFAOYSA-N 425.573 4.495 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H](c3ccc(C)o3)N3CCOCC3)c2C)c1 1540558901 FLCARLKFZJHNDJ-XMMPIXPASA-N 435.568 4.416 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](O)c2ccccc2C(F)(F)F)cc1 1542490642 UHAZKEBKFALXRO-RXVVDRJESA-N 436.474 4.013 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Br)sc(C)c3C)CC2)cc1F 1545606348 MFBYDNQDENGJGR-UHFFFAOYSA-N 427.339 4.238 10 10 IICE CC/C=C\Cn1c(-c2cc(Br)cn2C)nnc1N(C)Cc1ccccc1O 1546781162 WHRXTNPPZQQGTJ-YVMONPNESA-N 430.350 4.354 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)CCOc1ccc(Br)cc1 1564945314 NICJBOPYULCBBS-KRWDZBQOSA-N 448.405 4.475 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc2c1OC(F)(F)O2 1568379076 SDKHVXMVCPONCI-UHFFFAOYSA-N 434.439 4.010 10 10 IICE CC[C@@H](C)N(CC)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1587197165 NTOXHZSUAZLWOO-JXCQQFQQSA-N 441.416 4.297 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C1 1628627149 OJDOMALTCORHSB-HRAATJIYSA-N 439.556 4.282 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1ccc(C(F)(F)F)cc1 1630280332 KACJNPRPAUOTLZ-MAUKXSAKSA-N 444.400 4.125 10 10 IICE COc1ccc(Br)cc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 1632290591 NDRRKLXMIUFDQP-UHFFFAOYSA-N 432.362 4.240 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@]1(F)c1ccccc1 1639654184 SYGOVPONFHSMAT-LMHTWTQYSA-N 444.528 4.171 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1641201061 PBNINZWZRVQQJG-FMIVXFBMSA-N 445.563 4.314 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(C3CCCCC3)C2)c(C)n1-c1ccc(Br)cn1 1641721351 FRSSSLSZXOYWLI-SFHVURJKSA-N 445.405 4.388 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)c2ncnc3c(Cl)cc([N+](=O)[O-])cc23)cc1 1642527797 FZENVQDHGCNDJB-SFHVURJKSA-N 441.919 4.443 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cc(Cl)ccc1O)c1ccc(F)cc1F 1644590439 AEBDFODEZJXHFC-KRWDZBQOSA-N 426.847 4.206 10 10 IICE CC(C)[C@@H]1c2ccccc2CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683018057 CTBLUNBUGMBFMZ-JOCHJYFZSA-N 429.511 4.266 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC=C(c2ccccc2Cl)CC1 1684281264 WMZOSLSRNKMTEG-UHFFFAOYSA-N 425.960 4.300 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2C[C@@H]2COCCO2)c(C)n1-c1ccccc1 1707253666 ROQZJBWXKKIVEA-OAQYLSRUSA-N 437.588 4.250 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](N3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752710172 YKSXSBBTDUFMCO-ICSRJNTNSA-N 428.600 4.110 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)C[C@H]3CC=CCC3)n2Cc2ccc(N(C)C)cc2C)n1 1762422847 VCTGXJNFSSAKDJ-QFIPXVFZSA-N 447.631 4.355 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1772868042 YNBYUBVSKVRCCV-JOCHJYFZSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)c4ccc(F)c(F)c4F)cn3)CC2)cc1 1858427276 YYPGMUXUUZGKEK-UHFFFAOYSA-N 442.441 4.086 10 10 IICE CCOC(=O)c1c(NC(=O)Cc2ccc(N)cc2)sc(C(=O)OC2CCCCC2)c1C 1865957103 VZKSQYVMWDSAHB-UHFFFAOYSA-N 444.553 4.486 10 10 IICE CCc1ccc2[nH]c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc(=O)c2c1 1866487408 DVWKVFPQDZHWPU-RUZDIDTESA-N 446.595 4.114 10 10 IICE O=C(O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc([N+](=O)[O-])cc1O 1951375000 GZTTWVXRWLUDJP-NRFANRHFSA-N 448.431 4.355 10 10 IICE O=C(O)CCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2ccccc2)SC1=S 2053466898 ZAUCUBQEDCQPEH-UHFFFAOYSA-N 435.530 4.215 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(c3cccc(OC)c3)C2=O)c1)C(=O)O 2314930525 FLEPXUOQGFQMJU-QGZVFWFLSA-N 429.519 4.343 10 10 IICE CCCOC(=O)CN1C(=O)/C(=C/c2cc(Br)ccc2OCC)SC1=S 1781800 APPJPDZZBHKCJV-ZROIWOOFSA-N 444.372 4.002 10 10 IICE CCOc1ccc2ccc(OCC)c(/C=C3/C(=O)NC(=O)N(C4CCCCC4)C3=O)c2c1 33678193 KAOGWEQMIJVAPH-QNGOZBTKSA-N 436.508 4.432 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1C 59271052 RCMBUTSLWOXDEW-VWLOTQADSA-N 433.483 4.192 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)ccc1OCCC(=O)O 210463475 LDSZSZKGRHDWCY-AQTBWJFISA-N 429.519 4.345 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccc(-c3ccccc3)o2)SC1=S)Nc1nccs1 211947760 FZIKUIGCBTUAKT-XNTDXEJSSA-N 427.532 4.243 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)[C@H]2OCCc3sccc32)C1 561835431 MOPBNBGWPFAYEM-CRICUBBOSA-N 437.609 4.288 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nn1-c1ccccc1 742801917 UNVCGHZDPLAMIX-QGZVFWFLSA-N 426.467 4.181 10 10 IICE O=C(O)[C@H](Cc1c[nH]c2ccc(Br)cc12)NCc1c(O)ccc(Cl)c1F 756331767 CFRJIHGAMTUGMZ-HNNXBMFYSA-N 441.684 4.214 10 10 IICE COc1ccccc1Nc1nc2sc(C(=O)NCCc3ccc(O)c(O)c3)cc2s1 762262251 WZNHSEMOIPOEHT-UHFFFAOYSA-N 441.534 4.494 10 10 IICE C[C@@H](NC[C@@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(Cl)c(Cl)cc1O 797022898 XWDXCYUJXTXHHX-NEPJUHHUSA-N 435.398 4.122 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)/C=C\c2ccc(-n3ccnc3)cc2)cc1 917115124 WHHUPOKEVGHUGC-JRDGUAIDSA-N 430.552 4.159 10 10 IICE Cc1ccc2c(c1)N(C(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)CC2 1125440103 RHKBRYLLKPQANE-UYRXBGFRSA-N 426.538 4.315 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C/Sc3cc(F)ccc3F)cc2F)CC1 1125907924 PGQCEGXQYPLLEU-KPKJPENVSA-N 435.515 4.168 10 10 IICE CN(CCc1cccs1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1126664658 UTOIXPOVGSXBOO-GHRIWEEISA-N 434.583 4.180 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H](c1ccncc1)C1CC1 1134646884 YJMISSJRBZBBRP-BLMOFCDVSA-N 443.619 4.392 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)no2)cc1 1137440234 QQMSIIYJSUUQKR-SFHVURJKSA-N 441.915 4.104 10 10 IICE CON(C[C@H]1C[C@H]2CC[C@H]1C2)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1141446972 TYSVGHXNPVZWSN-CJYRXKSBSA-N 448.585 4.243 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@@H]2CO)c1C 1150369401 VEMZTPVSGCHATC-NOZRDPDXSA-N 431.580 4.015 10 10 IICE Cc1cc(C)cc(OCC(=O)N2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)c1 1150926186 NXBVJKALGONRKN-UHFFFAOYSA-N 445.563 4.074 10 10 IICE CCS(=O)(=O)c1ccccc1CCNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1154461288 LKEANDFBFFZFME-UHFFFAOYSA-N 438.593 4.477 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(OC(=O)OCC)cc1 1156286785 FPGBERQHRRIJIE-UHFFFAOYSA-N 442.512 4.224 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccnc(Oc4ccccc4F)c3)C2)cc1 1227677107 QSQJUMVZTPKJJA-GOSISDBHSA-N 436.487 4.100 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)OC(C)(C)C)C[C@@H]3C)c2C)cc1 1295953411 CDUPKNNERSCSMC-KRWDZBQOSA-N 427.545 4.184 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(Br)c1N 1297228446 INTCXSLLGUIWMF-UHFFFAOYSA-N 448.361 4.034 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@H]1C 1301628653 UXYOFCIMORROMW-HXUWFJFHSA-N 437.588 4.393 10 10 IICE COc1cnc([C@@H]2CCCN2C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)nc1O 1304660202 JLYPOSDGJTYOTR-SFHVURJKSA-N 426.904 4.229 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCC[C@H](C(F)(F)F)C1 1361095485 JYWJJBDJHAOJJV-SFHVURJKSA-N 446.521 4.485 10 10 IICE Cc1ccc(C(=O)N[C@@H](CC(N)=O)c2ccccc2Cl)cc1-n1c(C)cc(C=O)c1C 1445235743 JRDXWENLZUYZSH-NRFANRHFSA-N 437.927 4.215 10 10 IICE COc1ccccc1-c1cc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)on1 1454086374 FPNUTZXYYYXHMK-UHFFFAOYSA-N 443.503 4.429 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(NCc4nc(C)cs4)c3)C2)cc1 1469281261 CWPLVGBNXDLLKM-SFHVURJKSA-N 436.581 4.329 10 10 IICE CC(C)CN(Cc1ccccc1F)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1470449437 QXSDKUXNMQOSRY-UHFFFAOYSA-N 435.490 4.308 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCc4c3ccc(F)c4Br)C2)cc1 1478634046 CYZFNSQBYDXXQH-YJYMSZOUSA-N 448.336 4.162 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1cc(C(F)(F)F)ccn1 1492780624 VHXMKZOGPATYOY-UHFFFAOYSA-N 444.505 4.480 10 10 IICE CCNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CC1 1502370807 RYGSZLNFRASZEX-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CCO[C@H](CCn1c(-c2cnccn2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1516104660 FSMVZGXMTMPZHK-JOCHJYFZSA-N 436.560 4.063 10 10 IICE O=C(Nc1cccc(N2CCCCC2)c1)c1c(F)ccc(S(=O)(=O)CC2CC2)c1F 1526751428 JDMZXHDJWCKQJI-UHFFFAOYSA-N 434.508 4.391 10 10 IICE Cc1cc(Cl)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 1527480806 ARABBZXAYOOITM-KBPBESRZSA-N 435.883 4.239 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCCCC[C@H]3NC(=O)OC(C)(C)C)C2)cc1 1529411923 NVVQKVOQMIAXNJ-BVYCBKJFSA-N 445.604 4.111 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCOC3(CCCC3)C2)NC(=O)OC(C)(C)C)cc1 1544267796 IIDINVWWJRTRAO-PZJWPPBQSA-N 445.604 4.174 10 10 IICE CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1546002324 HAHNUBOFAYWXDZ-MRXNPFEDSA-N 433.346 4.272 10 10 IICE COC(=O)c1ccc2c(c1)N(C(=O)c1cccc3c1CCN3C(=O)OC(C)(C)C)CCC2 1558158362 SLYBRXMMKUFTEC-UHFFFAOYSA-N 436.508 4.364 10 10 IICE CC(C)Oc1ccc(CCNC(=O)CN2CCCc3cc(OC(F)(F)F)ccc32)cc1 1559609436 FXSICRRMKRDYTA-UHFFFAOYSA-N 436.474 4.484 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1564634580 PRBGSUWNDKAUPO-QHCPKHFHSA-N 432.524 4.095 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@@H](OC(C)(C)C)[C@H]1n1cccn1 1564771469 QYACLCSFFXXKIA-VSKRKVRLSA-N 427.593 4.066 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)COc2ccccc2Br)cc1 1598291092 JSFTVLIYIPNOAB-IBGZPJMESA-N 447.373 4.102 10 10 IICE CCC[C@](C)(O)Cn1c([C@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1614323705 HSMSLUVBMLMWQU-DVECYGJZSA-N 429.609 4.068 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)Cc1cccc2c1CCN(C(=O)OC(C)(C)C)C2 1617048300 XICPLYPFOMMTBY-UHFFFAOYSA-N 437.584 4.213 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3c(C)cc(C)c(Br)c3C)C2)cc1 1617263611 ZNMRYWHCVYXLJD-QGZVFWFLSA-N 431.374 4.321 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(C)n(-c2cnccn2)c1C 1629971667 DRWZQFOPNOLUEX-UHFFFAOYSA-N 429.318 4.015 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc(Br)c(C)c1 1634385294 WOVKHMKJBQHUJB-UHFFFAOYSA-N 448.361 4.155 10 10 IICE Cc1ccccc1-c1cc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)n(CCO)n1 1638279241 BJYIZFJFNFMONJ-UHFFFAOYSA-N 428.536 4.440 10 10 IICE O=C(CN[C@@H](c1ccccc1)C1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 1653800690 PBFUCISDNMWGOU-SANMLTNESA-N 439.575 4.190 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1C 1673745494 VCOQFLNPKKQQDA-IPMKNSEASA-N 432.609 4.031 10 10 IICE Cc1ccc([C@@H](CC(F)(F)F)NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1679851184 UFEDIQWDJUVGOD-OAQYLSRUSA-N 435.490 4.449 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1694338573 NCKIHBVVPDYWBH-JOCHJYFZSA-N 440.636 4.244 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@H]1CCCO[C@H]1C(C)(C)C 1711095221 FKGNUNGEHHRSNL-HYBUGGRVSA-N 449.599 4.447 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCC1CC1 1743817090 FDHOYBAFYALUBY-GOSISDBHSA-N 448.615 4.361 10 10 IICE CC/C=C/Cn1c([C@@H]2CCCCO2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1745095587 GBHUHBZIOOWLBS-LHXJMTLCSA-N 425.577 4.211 10 10 IICE CCN(CC)c1ccc(Cn2c(N(C)Cc3c(C)nn(C)c3C)nnc2C(C)(C)C)cc1 1746093788 OZSMZNOCDMJNLL-UHFFFAOYSA-N 437.636 4.457 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)[C@H]2CCSC2)cc1F 1766909882 VXTCNGFVIFNZBS-INIZCTEOSA-N 446.983 4.189 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@@H]1OCCC1(C)C 1767111919 KFHPBOFMQDOENW-SFHVURJKSA-N 427.936 4.151 10 10 IICE CCO[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1767705130 ZSXBSJNIIVKULC-OAQYLSRUSA-N 443.661 4.182 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@@H]2CCC[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1771166847 UKEVETFXRRNBML-KKLQWCBXSA-N 443.636 4.440 10 10 IICE CCCCOCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C(C)C)C1=O 1873170108 OGUXVHRWIVPFPT-UHFFFAOYSA-N 437.584 4.379 10 10 IICE O=C(N[C@@]1(c2cc(F)ccc2O)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952765812 FXGNSEQKMAVULM-SQJMNOBHSA-N 433.435 4.370 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@@H]2NCc2cc(Br)ccc2O)CC1 2132805280 UYVLTXTXPWHNDB-KRWDZBQOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](C2CC(NCc3cc(Br)ccc3O)C2)C1 2265436244 JUYVBBGGHQSIRC-CBCUQQMYSA-N 425.367 4.280 10 10 IICE CC(C)(C)c1ccc(C(=O)NN2C(=O)C(=Cc3ccccc3C(=O)O)SC2=S)cc1 2314928837 CHRYHTZZXDHWHY-UHFFFAOYSA-N 440.546 4.229 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380747675 WOJBKFKEANDRKV-VLIAUNLRSA-N 441.366 4.163 10 10 IICE Cc1sc2nc(SCC(=O)c3ccc(O)c(O)c3)n(Cc3ccco3)c(=O)c2c1C 19809809 OAJMFGDHCKSVCO-UHFFFAOYSA-N 442.518 4.102 10 10 IICE Cc1ccc(C(=O)NN2C(=O)/C(=C\c3cccc(Br)c3)SC2=S)cc1 33738897 GUMULBSGKTWCED-XNTDXEJSSA-N 433.352 4.304 10 10 IICE O=C(Nc1cccc(N2CCCC2)c1)c1ccc(NS(=O)(=O)c2cccs2)cc1 108027180 VUKOGSCHVIXZRN-UHFFFAOYSA-N 427.551 4.401 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC2(CC2)c2ccccc21 740470445 VZLWIHUUGHFCSH-UHFFFAOYSA-N 431.458 4.303 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 773144909 GIJVLOGVOANDDB-IBGZPJMESA-N 432.612 4.299 10 10 IICE CC[C@H](NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1)c1cc(Br)ccc1O 775486760 FFJHRCUVBGAWRU-DOXZYTNZSA-N 434.378 4.404 10 10 IICE COc1cc(N2CCN(C(=O)Nc3cccc(C(C)(F)F)c3)CC2)cc(OC)c1OC 782085240 LZHKZCVQFYJFGB-UHFFFAOYSA-N 435.471 4.178 10 10 IICE CCN1CC[C@H](NC(=O)NCCCSc2nccs2)[C@@H]1c1cc(F)c(F)c(F)c1 782732849 NMUMRXROTOXIDK-RDJZCZTQSA-N 444.548 4.177 10 10 IICE Cn1ccnc1CN1CCC[C@H](NC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1=O 783033509 JPUBQHPYJIAFQI-FQEVSTJZSA-N 431.500 4.148 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)nc(C(F)F)n4C)cc2F)C[C@@H](C)O1 798400279 ZAPWZXYHWXACSM-OKILXGFUSA-N 446.473 4.194 10 10 IICE Cc1cc(C(=O)N2CCC3(CCN(C)CC3)C2)c(C)n1-c1cccc(Br)c1 819925426 GGDKGYXTFIYLPJ-UHFFFAOYSA-N 430.390 4.415 10 10 IICE CC(C)Cn1cc([C@@H]2N(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC23CCOCC3)cn1 849477652 ALCFZVGMRVIENO-FQEVSTJZSA-N 434.924 4.160 10 10 IICE CCn1cc(N(CC(C)C)C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)cn1 1130440707 DFTRXNLGINHITP-UHFFFAOYSA-N 426.561 4.499 10 10 IICE Cc1cc([C@@H]2CCCN2C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)on1 1141731773 DLYHTJNAKKAGFU-IQFISFIMSA-N 445.541 4.077 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC[C@@H](C2CCC2)C1 1147998584 HRWRMNLDRCVOCR-MCRQTXEHSA-N 432.586 4.456 10 10 IICE Cc1cc(C(=O)NCc2cccc3c2CCOC3)c(C)n1-c1ccc(Br)cn1 1149544163 ZIFOLXLNEQPFFN-UHFFFAOYSA-N 440.341 4.254 10 10 IICE Cc1cc(CNC(=O)c2ccc(I)cc2N)c(C)n1-c1ccccc1 1170859389 UFYZZLYMAPTSIY-UHFFFAOYSA-N 445.304 4.211 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C/c3cc(Cl)cc(Cl)c3)CC2)cc1 1264273701 NXXLILISWTYVAR-FPYGCLRLSA-N 448.394 4.344 10 10 IICE Cc1cc(-c2csc(NC(=O)c3nnn(C)n3)n2)c(C)n1-c1ccc(Cl)c(Cl)c1 1264306276 BHUQNKWZIXUGMV-UHFFFAOYSA-N 448.339 4.300 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CC(C)(C)OC)CC2)cc1 1300247470 LKBGWGXMQCHEJI-UHFFFAOYSA-N 427.593 4.086 10 10 IICE COC[C@@H](C)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1300978670 PVKLJIIEBZGSQE-IBGZPJMESA-N 439.629 4.450 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1 1301092682 GUXSCCWTKFPVKB-WOJBJXKFSA-N 429.536 4.480 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@@H](C)Cc3cccs3)CC2)cc1 1315515889 UNBPXZVTJYOGKU-SFHVURJKSA-N 425.602 4.252 10 10 IICE C[C@H](NC(=O)c1cc(F)cc(Br)c1F)c1ccc(N2CCOCC2)cc1 1357928327 MLFIAVINSYCGMX-LBPRGKRZSA-N 425.273 4.055 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3OCCOc3ccccc3)C2)cc1 1461077400 OUGOSUFBLMZCIA-OAQYLSRUSA-N 446.547 4.409 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 1465969350 LOWIIHHZGOWDBL-SANMLTNESA-N 429.564 4.182 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Sc1ccc(Cl)cc1 1466399414 PXDUUDMVJDUBHU-LBPRGKRZSA-N 428.337 4.381 10 10 IICE CCOc1cccc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1470038053 CIPXTWMUDUZUSP-UHFFFAOYSA-N 443.345 4.018 10 10 IICE Cc1cc(CNC(=O)N2CCN(CCCOC(C)(C)C)CC2)c(C)n1-c1ccccc1 1471037946 WCXGBLPRLZCTQD-UHFFFAOYSA-N 426.605 4.127 10 10 IICE CCS[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473396389 BEKFZUXAONKKLM-UJUVCNOISA-N 436.577 4.443 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@]1(Cc2ccc(Cl)cc2)CCOC1 1478841592 ZLZKCVXOYCEAFG-MHECFPHRSA-N 429.992 4.346 10 10 IICE CN(Cc1nccs1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1503515938 XKMGDBOZSRLTEH-UHFFFAOYSA-N 442.658 4.270 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@@H](OC(C)(C)C)[C@@H]3n3cccn3)ccc21 1521747041 CZTBXYCJHDIWFR-YMPZKCBVSA-N 438.572 4.028 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(NC(=O)C2CC2)s1 1533328777 KWCAAUCKWZRCMW-CQSZACIVSA-N 435.496 4.097 10 10 IICE O=C(CCc1cccc(OC(F)F)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1533992206 LPSVDKNCMYMGIT-UHFFFAOYSA-N 443.538 4.069 10 10 IICE C[C@H]1CCC(F)(F)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1540141155 WMFMVOAVQKPHHM-LQELWAHVSA-N 430.567 4.376 10 10 IICE CC(C)(C)OC(=O)N1CCOc2cc(C(=O)NCc3cc(Cl)ccc3O)ccc2C1 1557387616 XHVNSRRYOAYYBP-UHFFFAOYSA-N 432.904 4.105 10 10 IICE Brc1cc(CNCc2ccc(Cn3cncn3)cc2)ccc1N1CCCCC1 1560489532 RVVXXCGZGCMSOV-UHFFFAOYSA-N 440.389 4.369 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)c(C)n1-c1ccc(F)cc1 1566290469 GNXYZBBKGLZASA-FQEVSTJZSA-N 427.426 4.047 10 10 IICE Cc1cccc([C@@H]2CN(Cc3ccccc3)C[C@H]2C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 1567467787 RKBUPGLXQZPDEO-KSNOWIBYSA-N 444.575 4.369 10 10 IICE CCN1C[C@@H](CN(C)C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)Oc2ccccc21 1587534989 GYYXXBFWQGJYCJ-JOCHJYFZSA-N 433.552 4.462 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)C[C@@H]1CC=CCC1 1611964009 JKQDBHQGFZMSRA-OAQYLSRUSA-N 430.600 4.479 10 10 IICE Cc1ccc(C(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1617797583 QUUISEUXJGDMAB-INIZCTEOSA-N 441.572 4.448 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Br)c(F)c1 1622634771 IGKRPQGZHYRJPX-OAHLLOKOSA-N 441.728 4.342 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@]1(C)C[C@@H](NC(=O)OC(C)(C)C)CCO1 1624553761 DJDAMVDVGGXMIW-NBGIEHNGSA-N 445.604 4.098 10 10 IICE Cc1ccc(C(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)cc1-n1c(C)cc(C=O)c1C 1625188855 DAUUHJHLUWHEPB-UHFFFAOYSA-N 449.595 4.326 10 10 IICE Cc1cc(C(=O)NCCC(=O)Nc2ccccc2)c(C)n1-c1ccc(Br)cn1 1628992353 MMZWJUFGFYDMIC-UHFFFAOYSA-N 441.329 4.010 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1ccc(F)cc1 1635890131 IADSWRVEKPHNAW-UHFFFAOYSA-N 440.494 4.074 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 1635964381 NYIADIYVPOVJNB-HXUWFJFHSA-N 428.573 4.315 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(-c2ccccc2Br)s1 1638348291 QPVFYEGHDDXLMK-NSHDSACASA-N 433.327 4.345 10 10 IICE O=C(NCc1c(O)cccc1O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1 1639296385 SLJHSRNNLDODOV-FCHUYYIVSA-N 436.939 4.283 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(c4ccc(F)cc4)C3=O)cc2Cl)C1 1639534563 QYZCNQCHMGOCSK-OXJNMPFZSA-N 443.950 4.385 10 10 IICE CCOC(=O)c1cc(COC)cc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1641371581 NFGWMIXMKBQURU-UHFFFAOYSA-N 434.492 4.482 10 10 IICE CCCCN(CC(=O)N(C)Cc1cc(Br)cs1)Cc1ccccc1O 1642886787 POHKBHPIWKBWJJ-UHFFFAOYSA-N 425.392 4.477 10 10 IICE COc1ccc(N(CC(=O)N=c2cc[nH]n2Cc2cccc(C)c2)Cc2ccccc2)cc1 1644908422 SCXGMQUELKQUQU-UHFFFAOYSA-N 440.547 4.316 10 10 IICE CC(C)CN1C[C@@H]2CN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CCN2C1=O 1653494493 VPVJAJKXQOBSJG-QFIPXVFZSA-N 434.544 4.118 10 10 IICE COc1ccc(N(C[C@H](O)COc2cc(F)cc(Br)c2)C(C)C)cc1F 1653759445 YZFCXWZGDRYSTG-INIZCTEOSA-N 430.289 4.391 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2Cc1nnnn1-c1ccccc1Br 1653956937 RDCHDSPVAIEXEH-INIZCTEOSA-N 442.361 4.268 10 10 IICE Cn1c(=O)c([N+](=O)[O-])c(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc21 1655198699 NPMAQAITNUWERV-AWEZNQCLSA-N 444.438 4.129 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](C)Cc3ccccc3C(F)(F)F)C2)cc1 1680731170 ATZXYBQAMZPMTR-IRXDYDNUSA-N 435.490 4.471 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)c3ccc(OC(F)(F)F)cc3)CC2)cc1F 1680809626 FGTPKGXQXNTTML-AWEZNQCLSA-N 441.425 4.326 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(Cc4cccc(Cl)c4)CC3)CC2)cc1F 1683038066 UJUOVEBPWQKBAD-UHFFFAOYSA-N 431.939 4.342 10 10 IICE Cc1nnc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)[C@@H](C)CC#N)s1 1707850882 KNRHQCZHBZSXRW-HNNXBMFYSA-N 446.584 4.299 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1709219769 HXWOYKAIMCMBPT-XLIONFOSSA-N 434.588 4.066 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3ccc(Cl)cc3)n2CCCSc2nccs2)C1 1712667503 YMAUHZHRFYHBSY-MRXNPFEDSA-N 436.006 4.463 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2CC(=O)NCC2CC2)c(C)n1-c1ccccc1 1724205854 RJPQBESZRCGBTN-UHFFFAOYSA-N 448.615 4.361 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3Cc3ccc(C)s3)CC2)cc1F 1730180895 VPGMZDUJNMOCPF-UHFFFAOYSA-N 443.592 4.369 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)CCOC(C)(C)C)cc1F 1747572643 NWGBLIKXUWYWJE-HXUWFJFHSA-N 433.572 4.024 10 10 IICE COC[C@H]1CCCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1749476365 RCVUZWITRAILNS-UGKGYDQZSA-N 445.583 4.026 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1(C)C 1752209545 YULMWXMYTDGYPI-IBGZPJMESA-N 425.621 4.333 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](c3nccs3)C2)n1Cc1ccc(N(C)C)c(F)c1 1761926513 VVTPNACBZAZITN-KXBFYZLASA-N 444.580 4.079 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@](C)(O)C1CCCCC1 1764717435 VPXAJFDGVDOODF-RUZDIDTESA-N 425.621 4.408 10 10 IICE CCOC[C@H]1CCCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1766465168 BPSCWKMNMICPAI-IBGZPJMESA-N 429.584 4.442 10 10 IICE CN(C[C@H]1CCOC1)c1nnc(-c2ccccc2F)n1CCCSc1nccs1 1768809157 CGLIGVAARCGQHV-OAHLLOKOSA-N 433.578 4.196 10 10 IICE Cn1nccc1C1CCN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)CC1 1769079108 BLQAEAQPTYVYIQ-UHFFFAOYSA-N 445.662 4.332 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(O)C(=O)N(CCc3c[nH]c4ccccc34)C2=O)cc1 1872956106 DQAGXFQZGAIREL-UHFFFAOYSA-N 425.488 4.456 10 10 IICE O=C(NC[C@H](NCc1cc(Br)ccc1O)C(F)(F)F)OCc1ccccc1 1942702570 XRXODZAAEBGOKR-INIZCTEOSA-N 447.251 4.102 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@](C)(F)[C@](C)(Br)C3)ccc(N)c2C1 2205660030 AMLIGALKLTZPRH-WOJBJXKFSA-N 442.373 4.264 10 10 IICE COCc1cc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)c(O)c2ncccc12 20439842 BFGOXHNTJJACFU-UHFFFAOYSA-N 431.458 4.428 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@@H](C(=O)NCc4ccc(F)cc4)[C@@H]3C2)cc1 104919214 UQCHVMVWXYGEDZ-RSXGOPAZSA-N 445.538 4.018 10 10 IICE CC(C)(CCCC(=O)O)C(=O)Oc1c(-c2ccc(O)c(O)c2)oc2ccccc2c1=O 642881616 QLDQJGLCJYRXNF-UHFFFAOYSA-N 426.421 4.058 10 10 IICE Cn1c(=O)oc2ccc(N[C@@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)cc21 726603956 CUEXZUPDIXMELU-LJQANCHMSA-N 441.447 4.291 10 10 IICE COc1cccc(F)c1[C@@H](C)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 743661191 WIZFBHWYGUAZBM-CQSZACIVSA-N 437.462 4.465 10 10 IICE CN1CCC[C@H](CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)[C@@H]1c1cccs1 745847021 IDJSLBYKRNPDLU-KKLQWCBXSA-N 443.613 4.227 10 10 IICE C[C@H](NC(=O)CSCc1cc(-c2cccs2)on1)c1ccc(N2CCOCC2)cc1 747123802 KJBNGSSGXLWEEX-INIZCTEOSA-N 443.594 4.350 10 10 IICE Cc1nc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(-c2ccccc2)o1 758956337 XDCNQKCZHFWQGO-UHFFFAOYSA-N 445.441 4.435 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 759658114 DMZACCPKZFKGLB-ICSRJNTNSA-N 432.362 4.132 10 10 IICE O=C(NCc1ccccc1O)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 778595424 ODWRYGLFHVOAET-UHFFFAOYSA-N 430.382 4.458 10 10 IICE COc1cnccc1[C@@H](C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 783867524 JGMYRQDJQYNTSK-VVBXCHJUSA-N 447.607 4.011 10 10 IICE COc1cc(C)cc(NC(=O)C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c1C 787469955 RJMGEEXOAYREEJ-UHFFFAOYSA-N 435.524 4.139 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(C)(C)O[C@@]4(CCOC4)C3)cc2Cl)C1 799994578 RJAAMIQPRZLGGJ-HXOBKFHXSA-N 435.996 4.056 10 10 IICE COC(=O)c1cnccc1C(=O)OCC(=O)c1cc(C)n(-c2cccc(SC)c2)c1C 800227865 QZBICASYDLCTKB-UHFFFAOYSA-N 438.505 4.037 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCc1ccc(Cn2ccccc2=O)cc1 919916863 XDMIQDZPQDWWBN-UHFFFAOYSA-N 444.579 4.229 10 10 IICE Cc1ccc(COc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1 1083975315 CKLQLTXVBLXWMV-STZFKDTASA-N 430.435 4.380 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4c(Cl)cncc4s3)cc2F)CC1 1125908343 VAEQCWVMTHGCCA-UHFFFAOYSA-N 432.952 4.161 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2sc(COc3ccc(F)cc3)nc2C)cc1 1130545085 XSJDWVLDUDGQCZ-UHFFFAOYSA-N 443.544 4.387 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1([C@H]2CCCCO2)CCC1 1132710819 JTJPZUIXVZOWRQ-UWXVCKHVSA-N 448.585 4.025 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2ccc3ccccc3c2)cc1 1137389489 LEFDHUANROYZDE-AREMUKBSSA-N 426.516 4.452 10 10 IICE CCOc1ccc(Br)c(C(=O)NCc2cccc(Br)c2O)c1F 1139974567 HDJFWRVNGRQSKR-UHFFFAOYSA-N 447.098 4.385 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)c([N+](=O)[O-])c1 1162949345 NBMJOESYGQDQLM-NCUBBLFSSA-N 439.516 4.331 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccc(C)c1F 1175569936 SBIYOTSUPBQRMP-QZTJIDSGSA-N 431.527 4.030 10 10 IICE Cc1cc(C(=O)N2CCC(CCCN3CCOCC3)CC2)c(C)n1-c1ccc(F)cc1 1295514744 QPMUDFSJGTYIMD-UHFFFAOYSA-N 427.564 4.198 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)c3ccc(N4CCNC4=O)cc3)c2C)cc1 1299808464 ZWPVSBLGZNSPIZ-QGZVFWFLSA-N 432.524 4.123 10 10 IICE Cc1cc(C(=O)N2CCc3cc(Cl)nnc3C2)c(C)n1-c1ccccc1Br 1299897185 RKTNKRYGWWVZJN-UHFFFAOYSA-N 445.748 4.499 10 10 IICE COC(=O)c1cnc([C@H]2CCCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)s1 1301446548 CAIBGOXJMMXVQP-INIZCTEOSA-N 441.528 4.496 10 10 IICE C[C@@]1(c2ccccc2)CCCN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1313304847 MCRJZUUUPZCMPU-HHHXNRCGSA-N 448.611 4.042 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3=Cc4ccccc4O[C@H]3C(F)F)cc2F)C[C@@H](C)O1 1357836128 NXXFIHSQVMGEOU-DOQJBMMISA-N 446.469 4.165 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2[C@@H]2C[C@H]2C)c(C)n1-c1ccccc1 1361045278 SCWMNKVQTNCVJG-IIBYNOLFSA-N 434.588 4.284 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1 1436850601 QHBBLKSJKQKGGA-MRXNPFEDSA-N 431.964 4.028 10 10 IICE Cc1cccc2c1C[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N2C(=O)OC(C)(C)C 1442473160 JHJHSGPUYBZFTK-NRFANRHFSA-N 427.520 4.183 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)Cc2ccccc21 1444697036 GMTZFJOMFVQKBZ-FQEVSTJZSA-N 437.540 4.013 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)[C@H]1CCC[C@H](OC)C1 1452752531 DMZZCNDAPFEWHK-NBHGPNQESA-N 432.948 4.224 10 10 IICE CCOC(=O)c1sc2nc(CN(CC(C)C)c3ccc(OC)cc3)nc(N)c2c1C 1460307922 YVCVHWUCFKZXLW-UHFFFAOYSA-N 428.558 4.430 10 10 IICE COC(=O)c1cnc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C(F)(F)F 1472686944 LSIRBNNAEUWOER-AWEZNQCLSA-N 443.853 4.323 10 10 IICE COC1CCN(c2ccc(CN[C@@H](C)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1473367137 ODVZJXKKMNTHQF-FPOVZHCZSA-N 431.621 4.427 10 10 IICE CC(C)c1ccc(C[C@@H]2CCN(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)C2)cc1 1479185968 XXCQDZMCOITLRU-DEOSSOPVSA-N 434.628 4.336 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(F)(F)C1 1494771623 FFGRERORYMXWAA-JOCHJYFZSA-N 429.515 4.359 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CC[C@H]2COCCO2)c(C)n1-c1ccccc1 1510607438 VGBPHIXLFHLBKR-QFIPXVFZSA-N 437.588 4.250 10 10 IICE C[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)S1 1512458160 NXFQHKREMSUDNT-YRNRMSPPSA-N 433.597 4.103 10 10 IICE C[C@@H](C(=O)Nc1c(Cl)ccc2nonc12)c1ccc(I)cc1 1525322184 JXDMRMXHASHKAN-MRVPVSSYSA-N 427.629 4.223 10 10 IICE CC[C@@H](Oc1ccccc1C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245946 OWDMORDYIXSDTN-HXUWFJFHSA-N 436.474 4.324 10 10 IICE CC(C)n1cc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1529076468 BHDCDQBVBQACMR-KPYNCUPYSA-N 446.573 4.072 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3cccs3)nc3c2c(C)nn3C)cc1 1531375045 PSGDQYMAYRNEAA-UHFFFAOYSA-N 449.580 4.222 10 10 IICE C[C@]1(c2ccccc2)C[C@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1539522156 UTARUZSRNHJJKL-GAFXBCEWSA-N 440.565 4.263 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@@H]2CC2(C)C)c(C)n1-c1ccccc1 1542179772 OVZAIMMJZVQQGO-APWZRJJASA-N 434.588 4.099 10 10 IICE Cc1cc(C(=O)N2CCC(Cc3ncon3)CC2)c(C)n1-c1cccc(Br)c1 1558451418 POSJSBLYLYCOLP-UHFFFAOYSA-N 443.345 4.335 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1564587570 JJWMHFXEABFARE-PZJWPPBQSA-N 440.588 4.459 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@@H]3C[C@@H](Oc4ccccc4)C3(C)C)C2)cc1 1564962435 KZQOHVGBSCPZNN-CTUHWIOQSA-N 437.584 4.409 10 10 IICE CCN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCC(C)CC3)cc2)[C@H]1c1cccc(C)c1 1585545419 RLJFOMGCILSRLG-AOYPEHQESA-N 433.596 4.457 10 10 IICE C[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccc1O 1587445051 SLOIFZSDBKRNLQ-KAECEXQPSA-N 432.592 4.313 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1CN1CC[C@H](O)C1 1612241162 OBAUZPRJSLCYBX-QFIPXVFZSA-N 431.492 4.005 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1 1617522089 SIWWGAJJCCTJHR-MRXNPFEDSA-N 430.597 4.495 10 10 IICE Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1618022241 QSZKEWWNIRZDEU-XMMPIXPASA-N 445.519 4.077 10 10 IICE C[C@H]1CC[C@H](CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)O1 1618369502 WAKGXLWTWBUWRY-DZGCQCFKSA-N 429.318 4.445 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2c(F)ccc(I)c2Cl)c1 1622779283 MTRZVVDJNUUPKJ-MRVPVSSYSA-N 449.647 4.289 10 10 IICE COC(=O)[C@H](C)CN(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CC1 1626559146 WZWSWPDWHVXLDO-CYBMUJFWSA-N 433.346 4.270 10 10 IICE CC(C)C[C@H](CC(=O)NCc1cccc(Br)c1O)NC(=O)OC(C)(C)C 1626822338 NBUKKABSZQRFAA-CQSZACIVSA-N 429.355 4.100 10 10 IICE CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1628102644 VNXOELIXMNKRBH-LJQANCHMSA-N 428.573 4.389 10 10 IICE CCCN(Cc1nc(O)c2ccc(Cl)cc2n1)C(=O)c1ccc(N=NC(N)=O)cc1 1629277061 AYBDMCPIEBOZCJ-UHFFFAOYSA-N 426.864 4.204 10 10 IICE CCN1CC[C@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)[C@@H](C)C1 1629674022 MCKAGEHXDMCUDP-LIRRHRJNSA-N 433.394 4.054 10 10 IICE Cc1cc(OCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc(C)c1Cl 1630257492 YGZOTSZYHXCECB-SFHVURJKSA-N 437.367 4.475 10 10 IICE COC[C@]1(C(=O)NCc2ccc(N3CCCCC3)cc2)CCCCN1C(=O)OC(C)(C)C 1630700605 AZRMOCJUNZQZIC-VWLOTQADSA-N 445.604 4.099 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2CC[C@@H](C(=O)OC(C)(C)C)C2)cc1 1631608349 UNLZWKSAQZCGOQ-TUNNFDKTSA-N 430.589 4.018 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N(C)CCOCCN(C)C(=O)OC(C)(C)C 1633099437 SLTYCHNDXBGTIL-UHFFFAOYSA-N 435.590 4.111 10 10 IICE Cc1cc(C(=O)NCc2ccc3nonc3c2)c(C)n1-c1ccc(Br)cc1 1640215875 UGWRAHMFNYXAQL-UHFFFAOYSA-N 425.286 4.323 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N(C)[C@@H]1CCCC[C@@H]1C 1640759335 PXCPHBYNXWFMPC-FUHWJXTLSA-N 429.586 4.470 10 10 IICE Cc1cc(C(=O)Cn2nnnc2-c2ccccn2)c(C)n1-c1cccc(C(F)(F)F)c1 1640915659 VWRKRRPVEYDYFR-UHFFFAOYSA-N 426.402 4.044 10 10 IICE CC1(c2ccccc2)CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1641080289 QPGPBFFQRQVXPG-CPNJWEJPSA-N 440.565 4.217 10 10 IICE Cc1ccc(-c2csc3ncn(CCC(=O)N[C@H](C)c4ccccc4O)c(=O)c23)cc1 1642824043 CTSXMLNFKDWDBS-MRXNPFEDSA-N 433.533 4.407 10 10 IICE COC(=O)C(C)(C)CN(CC(C)C)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1644496119 MSFDIZJRALYUQP-UHFFFAOYSA-N 426.557 4.133 10 10 IICE O=C(NCc1c(O)cccc1O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 1645360832 LIZXNTQJBCRNES-UHFFFAOYSA-N 441.281 4.043 10 10 IICE C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1648229042 QNZBGQBUVISLAH-CABCVRRESA-N 443.459 4.048 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1cc(F)ccc1N1CCOCC1 1650769077 HQGKPNYKUNBGEY-UHFFFAOYSA-N 435.455 4.414 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccccc3C(=O)N3CCC[C@@H](O)C3)c2C)c1 1651564660 MAUPSTXOQCPZKV-OAQYLSRUSA-N 431.536 4.252 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSC3CCC4(CC3)OCCO4)c2C)cc1 1652097373 GDAQWEHJKUJMAS-UHFFFAOYSA-N 443.565 4.482 10 10 IICE Cc1ccc([C@H](CC(F)(F)F)NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1679851183 UFEDIQWDJUVGOD-NRFANRHFSA-N 435.490 4.449 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 1683166000 INFKWVCVYFMSOS-PZJWPPBQSA-N 427.976 4.437 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC[C@H]1CC 1696322683 VTVSSYCDGXXOIT-RTWAWAEBSA-N 441.620 4.366 10 10 IICE CCN(CC)C1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1746129220 JDALMJMIQXEECU-UHFFFAOYSA-N 442.627 4.500 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1 1748358010 USAJSKHVLCQHGV-UHFFFAOYSA-N 437.588 4.393 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3CCC(C)(F)F)CC2)cc1F 1748849306 LODGHDDDPBYQSL-UHFFFAOYSA-N 437.510 4.455 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1 1766737433 SWBOGEYPJPMLRZ-WTPASJBYSA-N 439.629 4.358 10 10 IICE O=C(OCc1ccccc1)N1C[C@H](NCc2cccc(Br)c2O)C2(CCC2)C1 2028689391 KFOAWSWWHVZCFH-IBGZPJMESA-N 445.357 4.436 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2cc(Br)ccc2OCc2ccc(C)cc2)S1 2293273359 SSHYLKKCVYEJFF-UHFFFAOYSA-N 445.338 4.443 10 10 IICE Cc1cccc(-n2c(C)cc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1 2297352695 MTMVBGOIJKQNEK-UHFFFAOYSA-N 432.553 4.075 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](C)C(=O)Nc3cccc(C)c3)C2=O)ccc1O 2314836297 CKXWPJZVKJWAGF-CQSZACIVSA-N 442.562 4.328 10 10 IICE CCN(C(=O)OC(C)(C)C)C(C)(C)C(=O)NCc1ccc(C)c(Br)c1O 2352942155 AJQWTWKXFCPMBE-UHFFFAOYSA-N 429.355 4.115 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)ccc1OCC(=O)O 16915012 IIXQPXHNXHLMJU-CXUHLZMHSA-N 435.910 4.218 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccccc3O)C2=O)c1 35625015 JDXTWRUONYLZEP-QGOAFFKASA-N 428.535 4.021 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3ccc(OC(F)F)c(OC)c3)CC2)cc1 108432803 AQUNUNIVWHIPAI-VZUCSPMQSA-N 432.467 4.057 10 10 IICE CCOc1ccc(C(=O)N2CCC(NCc3ccc(N(CC)CC)c(F)c3)CC2)cc1 236955878 XUFZJPITULTKOO-UHFFFAOYSA-N 427.564 4.465 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(NC(C)=O)c3)[C@H]2c2ccc(O)c(O)c2)cc1 526392382 MIVGIPXUSCEKFZ-QHCPKHFHSA-N 446.459 4.122 10 10 IICE CCC[C@@H](NC(=O)c1cccc(N2C(=O)/C(=C/c3ccccc3)SC2=S)c1)C(=O)O 606671967 HPUAGKJYLMMMQK-ZCWPUFOUSA-N 440.546 4.076 10 10 IICE Cc1ccc2cccc(NC(=O)C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2n1 727610735 KHTVCAOJFLNYBK-UHFFFAOYSA-N 426.520 4.248 10 10 IICE COc1cc(N(C)CC(=O)Nc2ccc(OCc3ccccc3)cc2)cc(OC)c1OC 741798619 HPHLAEUHDMVFIM-UHFFFAOYSA-N 436.508 4.366 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](OC1CCOCC1)c1ccccc1 759383776 LWMVBMRSUHQVRO-NRFANRHFSA-N 448.357 4.440 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nc(-c3cccs3)no2)C1 769662643 FBHIZYGMPKPCRB-UHFFFAOYSA-N 436.537 4.263 10 10 IICE Cc1cc(Cl)cc(CNCc2cccnc2Oc2cccc(S(C)(=O)=O)c2)c1O 776214135 KFHLGDHQHVPXNW-UHFFFAOYSA-N 432.929 4.235 10 10 IICE CNC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(C(C)(C)C)cc3)cs2)cc1 784069774 OYUOTKFONDWUCM-UHFFFAOYSA-N 429.567 4.268 10 10 IICE CCOC(=O)c1c(NC(=O)COCc2cc(C)no2)sc(C)c1-c1ccc(F)cc1 800820434 JUWFXEQUWRVOCN-UHFFFAOYSA-N 432.473 4.491 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1 806216329 XDUNFYPFIAWVGH-UHFFFAOYSA-N 438.709 4.022 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(C)n1-c1cccc(Br)c1 1137377087 BOMAGGNRVVXMRY-LAUBAEHRSA-N 430.390 4.413 10 10 IICE Cc1nn(C)c(C)c1-c1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)n[nH]1 1155726909 NSZDFJKFZREETI-CQSZACIVSA-N 440.979 4.247 10 10 IICE Cc1ccc(CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccc3c(c2)OCCO3)s1 1191722415 JDLGDUJYXHWXSO-HXUWFJFHSA-N 426.494 4.476 10 10 IICE C[C@@H](N[C@H](CF)c1ccc(F)cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1197135208 IMJMKPNTDOSCSB-JLCFBVMHSA-N 434.442 4.229 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)cc1 1230857929 FXWONPVRNOHTOH-NRFANRHFSA-N 448.567 4.345 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ccc(C)nc1 1305382636 NFAHQHHJIDWCEX-IBGZPJMESA-N 434.588 4.016 10 10 IICE CC(C)CCOc1ccccc1CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1312492862 OYAPLPGSYIWUKX-UHFFFAOYSA-N 447.526 4.226 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCc2ccc(OCc3ccccc3)cc2)N(C)C)cc1 1313086851 QFHCVYHUGHZIHI-SANMLTNESA-N 446.595 4.434 10 10 IICE CN(C[C@H]1CCCO1)c1nnc(Cc2ccc(F)cc2)n1CCCSc1nccs1 1314890966 SFEGRXCZRVAJDQ-GOSISDBHSA-N 447.605 4.262 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2C1 1445883868 OIOPIQBYWAPVAE-DNVCBOLYSA-N 443.975 4.056 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](CO)Cc1cccc(Br)c1 1447667707 RHQMUGOYQUZDDX-KRWDZBQOSA-N 447.398 4.499 10 10 IICE COC(=O)N1CCC(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CC1 1449100300 GDRRRVMFCPQDHE-UHFFFAOYSA-N 448.361 4.065 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)CCN3C(=O)c4ccccc4C3=O)c2C)c1 1466609506 PMZBYKJWVLSKGR-UHFFFAOYSA-N 429.520 4.079 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@H]21 1470555051 ALWKUZUFIWPJKV-MVMQPQNDSA-N 442.401 4.392 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccccc3)[C@H]3COC(C)(C)C3)C2)cc1 1470594033 QLIHDAPXFYGGDD-JTHBVZDNSA-N 437.584 4.301 10 10 IICE COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)COc3ccccc3F)c2C)c1 1472927133 MQLAWDVIFXNGIJ-UHFFFAOYSA-N 439.439 4.068 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(c4nccc(C(C)C)n4)CC3)c2C)c1 1479099256 CTESHFYXQDVLLA-UHFFFAOYSA-N 446.599 4.348 10 10 IICE Cc1cc(-c2nnc(N3CCSC(C)(C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1510618900 LXUXHWLVRQSJIN-UHFFFAOYSA-N 439.629 4.455 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)[C@@H]1c1ccc(Cl)c(F)c1 1528620038 QFBQFSVVNWBXQD-ZHRRBRCNSA-N 449.929 4.299 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C(C)(C)c3cccc(Cl)c3F)cc2F)CC1 1530376707 MPKIPULJFGDNGW-UHFFFAOYSA-N 435.946 4.354 10 10 IICE O=C(CC[C@@H]1CCCCO1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1538918845 GKSNLFODSVJBKE-HNNXBMFYSA-N 429.318 4.447 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H]3CCC[C@@]2(C)C3)n1Cc1ccc(N(C)C)cc1C 1555681354 UVEZWUGYTKRMKN-FHAGJXEFSA-N 441.620 4.194 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1csc(-c2ccccc2Cl)n1 1557113165 BDGNEAQQFHKHRK-UHFFFAOYSA-N 444.940 4.304 10 10 IICE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1558709649 FGUYRNHTVWSDLC-FQEVSTJZSA-N 446.511 4.416 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CC[C@@H](Cc2ccccc2)C1 1564591862 WSOAEIYSOLXBKH-ICSRJNTNSA-N 429.511 4.012 10 10 IICE Cc1cc(CC(=O)N(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)c(C)n1-c1ccccc1 1583181220 YPKMLXQQHFPLPA-OAQYLSRUSA-N 442.968 4.277 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCn3cc(Br)cn3)cc2Cl)C1 1586081180 BJLNKCLYYUTMQP-AWEZNQCLSA-N 439.785 4.242 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 1586800159 NPAIBPAVVUUVGF-UHFFFAOYSA-N 445.563 4.045 10 10 IICE CC[C@H](C)N(CC)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 1587197164 NTOXHZSUAZLWOO-GQVHDAKQSA-N 441.416 4.297 10 10 IICE Cc1ccnc(Nc2cccc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)c2)n1 1596694915 JWQLOMRMKLNTRN-HDICACEKSA-N 449.530 4.211 10 10 IICE CC(C)c1cccc(-n2cc(O)c(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)n2)c1 1597908238 MDNSMORKCKMASZ-SFHVURJKSA-N 434.540 4.029 10 10 IICE Cc1noc(C)c1CN(C)c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1612632676 UZXFXINHALQUPG-MRXNPFEDSA-N 434.591 4.010 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1612952353 DGLTXPDPPJNRQN-RTBURBONSA-N 443.661 4.082 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 1618643052 JIMLURCBGJAESA-AQNXPRMDSA-N 435.490 4.174 10 10 IICE CCOc1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cn1 1627271961 NWCBACRNGIMCKF-UHFFFAOYSA-N 438.285 4.205 10 10 IICE CCOC(=O)C1=CC[C@@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1632879194 NTNDPIYLMVKMFL-MRXNPFEDSA-N 431.330 4.238 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1cccc(Cl)c1 1636130914 IOIXMEGCJBAUDU-LSDHHAIUSA-N 440.931 4.241 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@@H]2C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1641997637 SYMUQFFZCPOOAC-JLTOFOAXSA-N 429.344 4.352 10 10 IICE C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1644766400 APTIFLMMVVACLT-ROUUACIJSA-N 447.982 4.056 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)NCc1cc(C)ccc1O)NC(=O)OC(C)(C)C 1683073939 HCDLPLJHWBCGTN-HXUWFJFHSA-N 427.545 4.328 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCc4c(ccc(Cl)c4Cl)C3)cc2)CC1 1683702053 VFICQXFNZNHJHD-UHFFFAOYSA-N 433.383 4.013 10 10 IICE Cc1cc(CCNC(=O)NCC2(C(=O)OC(C)(C)C)CCC2)c(C)n1-c1ccccc1 1687175907 CHDJAXFMTATISD-UHFFFAOYSA-N 425.573 4.448 10 10 IICE CC(C)c1nnc(N2CCC(C(=O)C(F)(F)F)CC2)n1Cc1ccc2c(c1)CCCN2C 1691746956 MLWAKVSKQBHPTA-UHFFFAOYSA-N 449.521 4.180 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC[C@@H]1CCOC1 1695513323 PQXJSGJOBJWKTH-NRFANRHFSA-N 437.588 4.252 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCCC(=O)NC)n1Cc1ccc(N2CCC(C)CC2)cc1 1743583810 VWZZSYLOZQSEAI-HXUWFJFHSA-N 440.636 4.039 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746941967 NCOAFJYWTOLQHB-NHCUHLMSSA-N 429.584 4.124 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H](C)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1751848668 OAOZTUGRUUSYMT-GOSISDBHSA-N 435.620 4.189 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1cnnn1 1763802405 KCDSAMDKXBFZOQ-GOSISDBHSA-N 447.591 4.054 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CCS1 1765317718 HLCHPVQQJCRRHC-HUUCEWRRSA-N 425.649 4.100 10 10 IICE CCOCc1nnc(N2CC[C@@](C)(CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1766291064 NWGMASVVOITRJK-HSZRJFAPSA-N 429.634 4.043 10 10 IICE CCCC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858591966 DSTCUZHLVUIQRI-OXBCTQFSSA-N 432.336 4.433 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)/C2=C/c2ccccc2C(=O)O)cc1 1865673915 DZSDHZPJFJABKK-KGENOOAVSA-N 430.435 4.363 10 10 IICE COc1ccc(/C=C/C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)c(OC)c1 1865908939 WHISOGCCDYLSID-CJLLUPFQSA-N 437.584 4.126 10 10 IICE COC(=O)c1c(NC(=O)c2cc[n+]([O-])cc2)sc(C)c1-c1ccc(Br)cc1 1866045021 MRBCYLOLYZOZIN-UHFFFAOYSA-N 447.310 4.158 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1O 2227749821 VSLZOYAVJQHLSN-QWHCGFSZSA-N 429.355 4.041 10 10 IICE CCc1cc(C)cc(OCCOc2ccc([N+](=O)[O-])cc2C=C2SC(=S)NC2=O)c1 2293199810 GLQPMZAENAYWCY-UHFFFAOYSA-N 444.534 4.412 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(C3CCCCC3)C2=O)c(C)n1-c1ccc(F)cc1 2296943155 ASXMUTJIDIQDSJ-UHFFFAOYSA-N 425.529 4.193 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCOc3ccc(OC)cc3)C2=O)ccc1OC 2323719365 MQTPEELHORESGE-UHFFFAOYSA-N 445.562 4.383 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1)N2 14549958 ZMAAHQOQRSBLTG-YPIYEQTHSA-N 428.529 4.110 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2cccc(O)c2)SC1=S)Nc1nccs1 15045191 JMWFKZJATYXKRF-QINSGFPZSA-N 433.580 4.249 10 10 IICE COc1ccc(CNC(=O)[C@@H]2Cc3ccccc3CN2Cc2cc(Cl)ccc2O)cc1 35999795 CFXGIXJFTWXUCK-QHCPKHFHSA-N 436.939 4.298 10 10 IICE CCOc1ccc(OCC)c(N2C(=O)N=C(O)/C(=C/c3ccc(OC)cc3OC)C2=O)c1 59104380 NNHVEZRNHXUPBO-BOPFTXTBSA-N 440.452 4.008 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCC(Cc4ccccc4OC)CC3)CC2)cc1 726713634 PCRMSOBYUKLSJH-UHFFFAOYSA-N 437.584 4.337 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Nc1cccc(N2CCOCC2)c1 743114646 HAYFUJCEZYDNOV-UHFFFAOYSA-N 434.334 4.045 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Oc2ccc(NC(=O)C3CC3)cc2)C1 767638443 XNXDQORXKWXOPM-UHFFFAOYSA-N 431.536 4.362 10 10 IICE Cc1nc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cc(C2CC2)n1 769745716 ZOVNNYLVPVYGBD-YBEGLDIGSA-N 444.607 4.344 10 10 IICE C/C(=C/C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 783912170 JASANXVJRKJXHJ-QINSGFPZSA-N 449.429 4.170 10 10 IICE Cc1noc(C)c1COc1ccc(CC(=O)NCc2cc(Br)ccc2O)cc1 804734994 GWLIFGWNTRDALU-UHFFFAOYSA-N 445.313 4.197 10 10 IICE COC(=O)c1cccc(NC(=O)NCc2cc(Br)ccc2O)c1OC(C)C 806509707 FATBRGMAKVIVCS-UHFFFAOYSA-N 437.290 4.050 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc(-n4ccnc4)nc3)no2)C1 809274136 PRCFWBQXCVMNNC-UHFFFAOYSA-N 439.523 4.087 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CCc2ccccc2C1 914439556 KXGGBKPWFBSCSH-FJSNCCPHSA-N 442.631 4.403 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)cc1 915680253 CRDQFRTZSYFUCH-TZYHBYERSA-N 439.987 4.496 10 10 IICE O=C(N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12)c1cnc2sccn2c1=O 1087443204 NIDHHATVVLDPCD-NRFANRHFSA-N 427.485 4.134 10 10 IICE Cc1ccc(Br)c2cc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)[nH]c12 1135732707 CQTYQMZMOAHVAH-UHFFFAOYSA-N 442.357 4.348 10 10 IICE C/C=C/c1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(OC)c1 1136480436 MLFSVPKUZFVLDM-NKOINVLESA-N 438.568 4.381 10 10 IICE CC1(C)C[C@@H](C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc2O1 1150349049 VLZLNZXQQXQOLA-UYAOXDASSA-N 428.960 4.471 10 10 IICE CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H](C)Cc1ccsc1 1169605628 UKTMTXOMUWKUCE-MRXNPFEDSA-N 432.545 4.415 10 10 IICE COc1ccc(N2CCN(CCCNc3cc(SCc4ccccc4)ncn3)CC2)cc1 1184658765 LQCQBUCQEKUOLY-UHFFFAOYSA-N 449.624 4.402 10 10 IICE Brc1cc(CNC2CCN(C[C@H]3CCOC3)CC2)ccc1N1CCCCC1 1200621279 HHAXJXYIDKOBLE-LJQANCHMSA-N 436.438 4.030 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@H]2c2ccc(Br)cc2)N(C)C)cc1 1251501392 QMGJRJLZTNZPAW-LEWJYISDSA-N 445.405 4.274 10 10 IICE C[C@@H]1[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCCN1C(=O)OC(C)(C)C 1252041634 LMBRDFVFPYDDPA-DYESRHJHSA-N 430.593 4.215 10 10 IICE COc1ccc(OC(C)(C)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1265566060 GPZKGMJVMLNBIN-MRXNPFEDSA-N 434.483 4.239 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(OC(F)F)cc1F 1265567687 XECHNJWTNMDDRA-LBPRGKRZSA-N 430.373 4.427 10 10 IICE C[C@@H](CSCc1ccccc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266259034 OOCARKRDRGRWEX-NRFANRHFSA-N 437.653 4.404 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1C[C@H]1c1ccccc1 1277235074 PMPOCPPBGMAVIQ-PTBKXAHWSA-N 440.565 4.337 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)CC2CC(F)(F)C2)cc1F 1298056173 MCFFQTCIRFADOS-LJQANCHMSA-N 437.510 4.255 10 10 IICE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@H](C)c1ccccc1O 1302532438 CDNGMUDDNXUAAZ-IAGOWNOFSA-N 430.504 4.497 10 10 IICE CCCn1nccc1NC(=O)CN(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2 1307530501 XTVPIYCSVXYVMV-RMKNXTFCSA-N 432.524 4.223 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1 1315133663 QAMVSLWIWXWHOD-OAQYLSRUSA-N 437.588 4.393 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CCN(CC(F)(F)F)CC1 1495137520 PRBAHWVGOBRCAM-MRXNPFEDSA-N 439.526 4.408 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1500619374 PWVUZSQAZPHBAC-HXUWFJFHSA-N 437.588 4.394 10 10 IICE Cc1cc(CCNC(=O)c2cc3nccc(C(F)(F)F)n3n2)c(C)n1-c1ccccc1 1534550220 WDDJGRCMQKTGOV-UHFFFAOYSA-N 427.430 4.128 10 10 IICE CCN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1cccc(C)c1F 1536246913 LPCUAHPZBCOPBD-UHFFFAOYSA-N 432.407 4.484 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@H]3CCC[C@H](C(F)(F)F)C3)cc2F)CC1 1537536136 XPPKCTKTJFEKEW-WMZOPIPTSA-N 429.502 4.343 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(Cn4ccccc4=O)o3)cc2Cl)C1 1538421047 ILRFLKGNCDSAHW-KRWDZBQOSA-N 439.943 4.309 10 10 IICE CCc1nc(OC)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1538817597 AHVCMLNSCRONTP-SFQUDFHCSA-N 445.541 4.022 10 10 IICE CCNC(=O)c1ccc(OC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1543572011 NGJKGUBSZPAHKP-UHFFFAOYSA-N 442.313 4.221 10 10 IICE Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1543594109 ONEZCUWPWRTJSR-RUZDIDTESA-N 429.564 4.252 10 10 IICE CC[C@H]1CCC[C@@H]1Cn1c([C@H]2OCC[C@H]2COC)nnc1N(C)Cc1ccccc1O 1546643692 OPPXERJRZLANTB-TWWGPRNNSA-N 428.577 4.170 10 10 IICE CC[C@@H](NC(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1cccc(OC)c1OC 1565240641 DCEAPYKMGPFFJZ-OAQYLSRUSA-N 427.545 4.085 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1C 1565905855 CPEVCFRELOKVSK-LVXARBLLSA-N 431.580 4.422 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1 1566374294 BXHLSCNWGQAKQC-YOKWENHESA-N 448.922 4.369 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1C[C@H]1C1CCN(C(=O)OC(C)(C)C)CC1 1570418008 CDHSATZZAGIVMB-YFXJRYMSSA-N 443.632 4.391 10 10 IICE CCN1CCC(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1586974114 CWUMQAPSWXBYCQ-UHFFFAOYSA-N 433.394 4.103 10 10 IICE CC(C)NC(=O)c1nnc(N2CC[C@H]3CCCC[C@H]3C2)n1CCCSc1nccs1 1608469873 RILJLZXWHSSQDF-SJORKVTESA-N 448.662 4.072 10 10 IICE CC[C@@H]1CCCN1c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1614159862 XZGOOWDIOHUMKK-BWKNWUBXSA-N 441.620 4.120 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@H](C)N(CC)C[C@H]3C)nnc2C(C)(C)C)cc1 1615382536 ZTOMEPKFMZSOIM-VQTJNVASSA-N 426.653 4.389 10 10 IICE CC[C@@H]1CCCN(C(C)(C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)C1 1617184002 AQBZGAYRVATBKO-OAQYLSRUSA-N 438.660 4.425 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)C1 1625057050 ADEBDMXEQVZCEV-MSOLQXFVSA-N 443.548 4.348 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c3c(F)cccc3F)ccc21 1626940737 NSDJJZHZZOAOPJ-NRFANRHFSA-N 445.510 4.229 10 10 IICE CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1629409615 LAPCOUBYSKXXMM-UHFFFAOYSA-N 439.462 4.286 10 10 IICE C[C@@H](NC(=O)c1ccc2c(c1)OCCN(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 1634448208 LZFCMRHALJIMBO-QGZVFWFLSA-N 439.556 4.373 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)c1 1634972060 GORDLLCHZDEELT-HXUWFJFHSA-N 433.552 4.428 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cc(C(F)(F)F)cc(Cl)n3)C2)cc1 1636354317 XEGRNYQHWXSJMI-ZDUSSCGKSA-N 442.869 4.088 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3cc(Br)ccc3[nH]2)N(C)C)cc1 1648478235 WJYLPPIIPHWESS-HXUWFJFHSA-N 429.362 4.029 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3cc(C(F)(F)F)n(C)n3)cc2Cl)C1 1682024813 VIEAPVXOIQPJCK-ZDUSSCGKSA-N 443.901 4.328 10 10 IICE CSCCCN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc2c(c1)CCCN2C 1698426233 GJNHWLZEIUDEPE-OAQYLSRUSA-N 429.634 4.140 10 10 IICE CCc1noc(C)c1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1709174151 JLXGWLDMWFTLIP-UHFFFAOYSA-N 438.919 4.243 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cncn1 1727043076 CRCAHRSEOKBFOJ-SFHVURJKSA-N 432.576 4.127 10 10 IICE C[C@@H]1COCCN1c1nnc(-c2ccc(Cl)cc2)n1CCCSc1nccs1 1743355036 HXLFEAYLAFJVMO-CQSZACIVSA-N 436.006 4.463 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCN(CC)C(=O)C1 1745457758 TYNBECNPAGZQRQ-UHFFFAOYSA-N 434.588 4.211 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)cc1C 1750129306 BYKAJBBQFKOJHY-FTJYFCJYSA-N 441.620 4.050 10 10 IICE CC[C@H](C)N1C(=O)C(NCCCOC(C)C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165281 FZEDUOFDKVCLPL-SFHVURJKSA-N 437.584 4.377 10 10 IICE CCCN1C(=O)C(NCc2ccccc2OC)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165791 VKTZCDQVWJCDLX-UHFFFAOYSA-N 443.547 4.382 10 10 IICE Cc1ccc(Cn2cccc(C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)c2=O)cc1 1890683043 DLVCBEFGDQSBKY-UPVQGACJSA-N 427.548 4.124 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1c(O)cccc1O 1952825541 LRNVROMKKHHBOG-DVECYGJZSA-N 445.471 4.495 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2CCC2)c(CN)c1I 2079004589 ATUUHCYMLVUCDI-OAHLLOKOSA-N 425.314 4.227 10 10 IICE COc1ccc([C@H](n2nc(C3CC3)c(N)c2I)C2(C)CC2)c(O)c1 2080011736 FGTMTZFPAQXECL-INIZCTEOSA-N 439.297 4.051 10 10 IICE CC1=NN(c2ccc(Br)cc2C)C(=O)C1=CNc1ccc2nc(O)[nH]c2c1 2297316918 RUSSKOOTPUGQFB-UHFFFAOYSA-N 426.274 4.058 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N([C@@H](C(=O)O)[C@H](C)CC)C1=O)C(C)=O 2314927360 DNRRYXQCQNBQPB-HNJNHCNJSA-N 435.567 4.134 10 10 IICE COc1ccc(C)cc1N1C(=O)C(=Cc2cc(OC)c(OC)c(OC)c2)SC1=S 2318753347 INDLNJRGTZYKHS-UHFFFAOYSA-N 431.535 4.435 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)C(=Cc3ccc(O)c(OC)c3)SC2=S)c1 2321683343 FLIYWXUOQUWDSD-UHFFFAOYSA-N 435.910 4.247 10 10 IICE Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Cl)c(O)c(Cl)c3)C2=O)cc1Cl 2394209 PIDIMKIDGYLAFM-NYYWCZLTSA-N 425.655 4.327 10 10 IICE COc1ccc(N2CCN(c3cc(C(=O)N4CCC[C@H](C)C4)c4ccccc4n3)CC2)cc1 23336696 VRVCNCSNPWKJJL-FQEVSTJZSA-N 444.579 4.442 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc1OCc1ccc(F)cc1 40006431 MCUPVJRJNSWFLN-ZDLGFXPLSA-N 447.509 4.089 10 10 IICE Cc1cc(C(=O)NCCC(=O)NC2CCCC2)c(C)n1-c1cccc(Br)c1 108874957 NNKAJHVEMJKGQX-UHFFFAOYSA-N 432.362 4.035 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3ccc(CC(=O)O)cc3)C2=O)cc1OC 210168220 MYIKLVLXCOZMHV-WOJGMQOQSA-N 429.519 4.127 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC(C(=O)c3c(F)cc(F)cc3F)CC2)c([N+](=O)[O-])c1 734141682 JDDWSPNYNNTDKJ-HWKANZROSA-N 448.397 4.298 10 10 IICE Cc1ccc(CCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 742749969 KPEWDKDSWCNPOQ-QFIPXVFZSA-N 425.573 4.376 10 10 IICE Cc1ccncc1/C=C/C(=O)NCc1ccc(N(C)C(=O)/C=C/c2cnccc2C)cc1 765477921 IAMVHHNGOLYUMK-JMQWPVDRSA-N 426.520 4.099 10 10 IICE CC(=O)Nc1cccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 770880832 IYXVHQBZLPUPIW-UHFFFAOYSA-N 442.563 4.262 10 10 IICE COc1cc(OC)cc([C@H](NCc2cc(C)cc(Br)c2O)c2nccn2C)c1 781626756 MPZNJSCKIYHBBY-IBGZPJMESA-N 446.345 4.093 10 10 IICE C[C@H]1C[C@H](CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 801782993 DAKITQLDAIGXGH-BJWYYQGGSA-N 425.520 4.150 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1F 804852129 ZZBFUVVPVVPPRU-SFHVURJKSA-N 448.542 4.228 10 10 IICE COc1ccc(COCCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1137438838 WKXXWACZAFBKQB-OAQYLSRUSA-N 446.975 4.132 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3csc(C4CCCCC4)c3)cc2)CC1 1138230405 RDOMJFMCLBSJTG-UHFFFAOYSA-N 425.598 4.394 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@]3(C)CC(c4cccc(Cl)c4F)=NO3)CC2)cc1 1141984990 BDOKCCYLMFFSOI-HSZRJFAPSA-N 445.922 4.110 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cncc(Br)c1C 1149900431 OQFPNBIHIITADB-UHFFFAOYSA-N 428.124 4.283 10 10 IICE CCN(Cc1ccc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1)C(C)C 1152402276 UYBFFIQAHQVKSS-UHFFFAOYSA-N 432.948 4.091 10 10 IICE Cc1cc(C(=O)NCC[C@H](C)N2CCCCC2)c(C)n1-c1ccc(Br)cn1 1154078671 PFNHSYRJRZIAGI-HNNXBMFYSA-N 433.394 4.246 10 10 IICE CC(C)c1ccc2c(c1)[C@H](NC(=O)NCc1ccc(N3CCC(C(N)=O)CC3)cc1)CCC2 1225603307 WTCUESPIVMXPGW-RUZDIDTESA-N 448.611 4.389 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1226235792 OPBHBGLYWKGETD-IEBWSBKVSA-N 440.975 4.181 10 10 IICE CC[C@@H]1[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCN1C(=O)OC(C)(C)C 1253230572 DNCMRYOFFNJMIN-LEWJYISDSA-N 430.593 4.215 10 10 IICE COc1ccc(CNC(=O)N[C@H]2CC3(CCC3)Oc3ccc(Br)cc32)c(O)c1 1255617186 XLWDYJXFGUHGAA-KRWDZBQOSA-N 447.329 4.409 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)c(C)n1-c1ccccc1 1266706993 JIBOKLUEZXWZQP-QFIPXVFZSA-N 439.918 4.351 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCCN3CCN(Cc4ccccc4)CC3)c2C)c1 1290416343 QTHXNGJXBTWMQF-UHFFFAOYSA-N 444.623 4.340 10 10 IICE Cc1nnc(N(C)Cc2cc(Br)cs2)n1Cc1ccc(N(C)C)c(F)c1 1290713158 LISKHXQFDJMNNO-UHFFFAOYSA-N 438.370 4.300 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](OC2CCCC2)C(F)(F)F)cc1 1300504459 XYAAIVWSFCOLAW-OAQYLSRUSA-N 436.474 4.455 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1 1302669134 OXTGWEUUKLTKSE-QFIPXVFZSA-N 436.629 4.485 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)N(C)C(=O)OC(C)(C)C 1302848213 XFDNATZSVGZFIC-QGZVFWFLSA-N 431.581 4.074 10 10 IICE CCOC(=O)CS[C@H](CNC(=O)c1ccc(-n2c(C)ccc2C)cc1)C(F)(F)F 1302854058 NBEWLYYBMYDAKE-QGZVFWFLSA-N 428.476 4.051 10 10 IICE CCCCN(CC(=O)Nc1sc2c(c1C(=O)OC)CCCC2)Cc1ccccc1O 1307721457 JZVPNPHCEZIABT-UHFFFAOYSA-N 430.570 4.360 10 10 IICE CC(C)c1nnc(N2CCN(C3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1359717872 KKDXCAQABOBWSL-UHFFFAOYSA-N 428.600 4.110 10 10 IICE CC(C)(C)OC(=O)N[C@@](C)(C(=O)NCc1cccc(Cl)c1O)c1cccc([N+](=O)[O-])c1 1457037964 TYFISGXJHARZOQ-OAQYLSRUSA-N 449.891 4.010 10 10 IICE CC(C)c1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)nn1-c1ccccc1 1460740581 JIVQXTAWNGQYEG-UHFFFAOYSA-N 440.494 4.041 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(Br)c3Cl)CC2)c(OC)c1 1461977326 LAQIQPBLLCVUFO-UHFFFAOYSA-N 439.737 4.082 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCOCC4)cc3)s2)c(F)c1 1464450566 JFWSQWYHVSUVPN-UHFFFAOYSA-N 425.529 4.333 10 10 IICE CC[C@@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@@H](O)c1c(F)cccc1F 1465917563 DLEQFGKNLMVNLK-NFBKMPQASA-N 430.495 4.425 10 10 IICE CC1(C)CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c2cc(F)ccc21 1469749202 BJVAKJRSVIYZAG-UHFFFAOYSA-N 446.525 4.332 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCC[C@@H]3Cc3ccccc3F)C2)cc1 1470593214 LAUXTLJUFGEEIY-SIKLNZKXSA-N 425.548 4.467 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN([C@H](C)C(F)(F)F)CC3)cc2Cl)C1 1478527433 CBDWORVLCFXHRV-HZPDHXFCSA-N 446.945 4.354 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC[C@H]1CCCCO1 1495756367 YIBMIHLOEODNJZ-AZUAARDMSA-N 445.583 4.225 10 10 IICE CC1CCC(N(C)c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)CC1 1512086940 XTHAVAGZUDVLQW-UHFFFAOYSA-N 448.662 4.054 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)OC)CCO1 1514122852 KEHSGKOXRWPLRB-OAQYLSRUSA-N 437.588 4.393 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3(c4c(F)cccc4F)CCC3)cc2F)C[C@@H](C)O1 1516811676 FKXIPEIBIUBYRX-HZPDHXFCSA-N 432.486 4.456 10 10 IICE Cc1cc(CC(=O)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(C)n1-c1ccccc1 1527656722 RPZYGVXPISWDOP-HXUWFJFHSA-N 448.586 4.405 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CCCCC2 1533785113 ZTBWHIMPFXZVSP-PCKAHOCUSA-N 432.586 4.169 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCCC2(CCOCC2)C1 1542227072 RSENHHAXECGTJJ-UHFFFAOYSA-N 425.621 4.296 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC(F)(F)C(F)(F)F)NC(=O)OC(C)(C)C)cc1 1544269380 SAJLTSNGRDVVEQ-CQSZACIVSA-N 439.425 4.022 10 10 IICE O=C(/C=C/c1ccsc1C(F)(F)F)NCc1ccc(N2CCC(O)CC2)c(F)c1 1544631287 XUXSOULQSNXVEG-DUXPYHPUSA-N 428.451 4.197 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CC1 1556879444 OGZALCZLYHASBR-CALCHBBNSA-N 435.528 4.418 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1565220326 AZPJTOSXFBFWMM-FNLKRUPLSA-N 431.577 4.492 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2N(C(=O)OC(C)(C)C)CC23CCCC3)cc1F 1565688125 KPPXTKPKBKVISZ-FQEVSTJZSA-N 433.568 4.468 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CC(=O)N(c4ccccc4[C@@H](C)CC)C3)CC2)cc1 1566560479 FVFDFABJXWBZLZ-SFTDATJTSA-N 449.595 4.301 10 10 IICE Cc1cc(CC(=O)N[C@@H](CO)c2ccccc2OC(F)(F)F)c(C)n1-c1ccccc1 1568599471 GEWMJPDLHWKOBZ-FQEVSTJZSA-N 432.442 4.385 10 10 IICE COc1cc(N2CCN(C(=O)c3cccc(C)c3C(F)(F)F)CC2)cc(OC)c1OC 1584526066 KHXAUWRWNFMNPX-UHFFFAOYSA-N 438.446 4.002 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)[C@@H](C)c1ccco1 1611964508 ZMUOQINSKPAPOH-IBGZPJMESA-N 430.556 4.477 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3OCCN(C4CC4)[C@@H]3c3ccccc3)cc2)CC1 1614600705 JETWQEAODWZQGS-CLJLJLNGSA-N 433.596 4.144 10 10 IICE C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F)c1ccc(N(C)C)cc1 1616834632 KUIPNUNRTGEAJF-VLIAUNLRSA-N 433.499 4.474 10 10 IICE CC(C)(C)c1cnc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1621898625 SJSBEPWYQBYXHQ-GDNBJRDFSA-N 447.557 4.019 10 10 IICE COc1cc(OCCN(C)C)ccc1NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1626499860 KVQHNPBNYCQCER-UHFFFAOYSA-N 425.504 4.435 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCCCN2C(=O)c3ccccc3C2=O)c1 1628085910 GNIQEJQFTSGPJP-UHFFFAOYSA-N 429.520 4.209 10 10 IICE COCCOc1cc(C)ccc1CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1635500039 AFBWBSJFAPMSSN-UHFFFAOYSA-N 434.536 4.099 10 10 IICE Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1638918008 POGNAMQDHRNPQW-VXKWHMMOSA-N 426.609 4.022 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCOCC2)c(F)c1 1639306285 UGQHCTUVZZSWCX-UHFFFAOYSA-N 435.455 4.414 10 10 IICE Cc1ccc(CNC(=O)N[C@H](CC(C)C)C(=O)NCc2c(O)ccc3ccccc23)cc1 1639383964 DDLWQOWQGODRLS-HSZRJFAPSA-N 433.552 4.384 10 10 IICE CCN(CCC(=O)NCc1ccccc1Cl)Cc1cc(Br)ccc1O 1641892395 DHPCHQGPZAONSH-UHFFFAOYSA-N 425.754 4.337 10 10 IICE O=S(=O)(c1ccc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1)C(F)(F)F 1642227564 WOQIKDIYDMMBSG-MRXNPFEDSA-N 448.894 4.416 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@H](Oc1cccc(Br)c1)c1ccccc1 1643100889 NUNZYFBDQUAGQN-HXUWFJFHSA-N 428.282 4.297 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2[C@@H](C)CN(C)C)c(C)n1-c1ccc(Br)cn1 1647771270 ZLWFHLYGOMZKPC-MGPUTAFESA-N 447.421 4.444 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(C[C@H](C)C[C@@H](C)C4)C3=O)c2C)cc1F 1651884653 AHELPOSPCOOQGB-HUUCEWRRSA-N 439.531 4.471 10 10 IICE COc1ccc([C@H](NC(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)c2ccco2)cc1 1683222025 ZIZAJHPJQPMSPS-KOSHJBKYSA-N 435.524 4.212 10 10 IICE CC(C)c1nnc(N2CCO[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1706320211 RASXMWYOTURWDA-OAQYLSRUSA-N 443.661 4.254 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4cccc(C)n4)n3CCC(C)C)CC2)cc1F 1730179746 DEHWYIUWYQUJBZ-UHFFFAOYSA-N 438.551 4.169 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](c3ccnn3C)C2)n1CCCSc1nccs1 1750740051 ZPKIHJUKDZWASJ-QGZVFWFLSA-N 445.662 4.233 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1763781911 JFWGZEOUSIAUGM-SFHVURJKSA-N 446.603 4.402 10 10 IICE CCC(CC)(Cn1c(C(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1764017002 RHTVQOYXKPJGRQ-UHFFFAOYSA-N 433.572 4.081 10 10 IICE CCN1C(=O)C(Nc2cccc(N(C)C)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422762 NXAKEOUZFCTGPL-UHFFFAOYSA-N 428.536 4.372 10 10 IICE CN[C@@H](c1ccccc1O)[C@@]1(COCc2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1997460414 WSXCTXCXNNSMRE-DHLKQENFSA-N 426.557 4.497 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C)c1O 2227748807 QOVYYJVCDQBLPG-WFASDCNBSA-N 429.355 4.041 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@H](O)c3ccnn3Cc3ccccc3)cc2)CC1 2270556841 LPIWPPGAFHAIMA-DEOSSOPVSA-N 448.567 4.070 10 10 IICE COc1cc(C=C2SC(=S)N([C@@H](C)c3ccccc3)C2=O)ccc1OCC(=O)O 2314931867 INJLIPSNLTZWDJ-ZDUSSCGKSA-N 429.519 4.121 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550798 WQXCMCBHUSCVAL-JQVVWYNYSA-N 427.526 4.452 10 10 IICE Cc1oc2c(CN3CCCOC3)c(O)ccc2c(=O)c1-c1ccc(Br)cc1 94993427 DWZVTSKBSOIDGM-UHFFFAOYSA-N 430.298 4.416 10 10 IICE CCc1c(-c2ccncc2)n[nH]c1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 444127930 DXMKMUSBANOHAX-UHFFFAOYSA-N 442.567 4.394 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H](c2ccc(F)cc2)O1 743554341 BJFZJEFKHPBMCJ-HTAPYJJXSA-N 429.561 4.051 10 10 IICE CN1CCCc2cc(CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccccc3)ccc21 743669606 BEUUHCVHUGRJMX-NRFANRHFSA-N 438.572 4.134 10 10 IICE CO[C@H](C)c1nc(C)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 749371149 JXYDPQISVJRRQO-CYBMUJFWSA-N 425.501 4.159 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3ccc(C(F)(F)F)nc3)n2)cc1[N+](=O)[O-] 782262483 ZGWSQYSWVRXDST-UHFFFAOYSA-N 444.416 4.241 10 10 IICE CCOc1ccccc1CN(C)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 917092708 YCWRDEXRLYWHQG-UHFFFAOYSA-N 440.250 4.309 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1COc2ccc(Cl)cc2C1 1126582293 LAJRYRNFKJVWSP-NVXWUHKLSA-N 436.886 4.278 10 10 IICE Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1C 1130939944 GNRUJQLEYSWRJG-XSFVSMFZSA-N 442.581 4.393 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CN3C(=O)C(F)(F)Oc4ccccc43)c2C)c1 1132044901 ZLHMCTUDWGHEMA-UHFFFAOYSA-N 439.462 4.037 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(Cn2cc(Br)cn2)s1 1135914633 LVDSTXQJYCWXIP-UHFFFAOYSA-N 433.375 4.094 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)[C@H]1OCCc2sccc21 1139584613 HMPOBPCYIYTEJI-QMHKHESXSA-N 444.597 4.387 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2cccc(OC(F)F)c2)cc1 1142713662 YHAIYWLOOXTABX-QFIPXVFZSA-N 432.511 4.494 10 10 IICE Cc1cc(C(=O)NCc2cn(C3CCC3)nn2)c(C)n1-c1ccccc1Br 1144297931 NHYDPYLVZIYWDM-UHFFFAOYSA-N 428.334 4.103 10 10 IICE COC(=O)[C@@H]1CCCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1153968812 ACTPGROMDPLNPO-IBGZPJMESA-N 433.346 4.414 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 1156287726 QXYIUSGLHQDXNM-INIZCTEOSA-N 427.501 4.087 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(OCC(F)(F)F)c4ccccc4n3)C2)cc1 1278860805 BJHHXGNRDZAEPH-OAHLLOKOSA-N 445.441 4.193 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cnc(OC3CCOCC3)c(Cl)c2)cc1 1290323743 GFCUKLFKIVZIAU-UHFFFAOYSA-N 431.964 4.411 10 10 IICE CCN1CCCC[C@@H]1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1313909886 TXCONBDBKXAVFV-HXUWFJFHSA-N 425.602 4.147 10 10 IICE CCCc1ccc(N2C[C@H](C(=O)Nc3sc4c(c3C(=O)OC)CCCC4)CC2=O)cc1 1353964820 OIQIVKIJCCAVBG-MRXNPFEDSA-N 440.565 4.358 10 10 IICE O=C(C[C@H]1CSCCS1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1439873098 MAKFXLWHBSPABK-ZDUSSCGKSA-N 449.399 4.336 10 10 IICE C[C@H](NC(=O)CCCCCCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1442415967 XXVYKKKMWSZXKE-IBGZPJMESA-N 433.593 4.176 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(C(=O)c3ccco3)c2)cc1 1442609953 DFVQSAQLJOLTGW-HSZRJFAPSA-N 432.520 4.398 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cccc(NC(=O)c3ccc(Br)o3)c2)c1 1453653340 UZEZWIRTTGBPPA-UHFFFAOYSA-N 429.270 4.238 10 10 IICE Cc1cc(C(=O)N2C[C@H]3C[C@@H](N(C)C)CC[C@H]3C2)c(C)n1-c1ccc(Br)cn1 1457145008 MHPAXNYGAHKWTJ-SCTDSRPQSA-N 445.405 4.054 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(N4CCCCC4)n3)cc2Cl)C1 1459581448 MMVBDZCRBVTSDQ-KRWDZBQOSA-N 427.980 4.287 10 10 IICE COc1cc([C@H](C)NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc(OC)c1OC 1464234730 MQBQQUIVLGDPSQ-INIZCTEOSA-N 436.508 4.423 10 10 IICE COC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(Cl)c1 1464605321 OHZPEJIHYPFDJF-LJQANCHMSA-N 445.947 4.406 10 10 IICE C[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)(C)c1ccccc1 1473340330 FXSOJIVCHQWWAN-AQNXPRMDSA-N 441.591 4.011 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2cnccn2)cc1 1501834321 KUWKCBHABHMJGJ-UHFFFAOYSA-N 431.544 4.167 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)OC(C)(C)C1 1516727718 OFEBGNOKTAHNQA-IBGZPJMESA-N 437.588 4.393 10 10 IICE COC(=O)CCc1csc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 1525641132 UUSOGZJNLRPZAH-UHFFFAOYSA-N 431.945 4.491 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](NC(=O)c1ccc(Cl)s1)C(C)C 1529278288 PIMFVIDXYZJXFK-FOIQADDNSA-N 436.021 4.278 10 10 IICE O=C(/C=C\c1ccc(Cl)nc1)N(CC1CCOCC1)c1ccc(Br)cn1 1534841189 NMZJLRGSXAHXQG-KXFIGUGUSA-N 436.737 4.366 10 10 IICE COc1ccc(CN2CCCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1540648529 NJWHASLVZZTJFY-UHFFFAOYSA-N 445.563 4.263 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)CC(C)C 1543951289 HXDUJIBCPVROBR-INIZCTEOSA-N 435.362 4.422 10 10 IICE CC[C@@H](C)CN(C)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1545635443 CPCAZUMDMRPPHR-OAHLLOKOSA-N 430.597 4.370 10 10 IICE CSc1cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)ccn1 1546220051 QAWZPDHNUHHVGA-UHFFFAOYSA-N 431.359 4.299 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(=O)NC)C1 1546779954 ASBIAJDSYQXZJS-YSCBJLCGSA-N 446.599 4.281 10 10 IICE O=C(NCc1c(O)cccc1O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 1558533868 MAUUWZRCEJHIIO-UHFFFAOYSA-N 441.281 4.043 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)cc1-n1c(C)cc(C=O)c1C 1566320219 CENXQARLRPKPED-FQEVSTJZSA-N 436.943 4.272 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2scc(Br)c2Br)c1 1566374268 BCDUXPHSNSZJGV-ZETCQYMHSA-N 435.137 4.478 10 10 IICE Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NCc3ccc4c(c3)CCCN4C)c2)cc1 1583628698 ZYDTZRGXJRJFFO-UHFFFAOYSA-N 449.576 4.108 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccnc(OCC(F)(F)F)c1 1596017209 OSZYZWWAZGIERF-UHFFFAOYSA-N 431.414 4.173 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C1 1612673085 XHIDCYWOKDCXAF-IAGOWNOFSA-N 428.631 4.385 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nnc(C(C)(C)C)s1 1613921072 JNYQQAGFAOMNJZ-UHFFFAOYSA-N 439.633 4.274 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)Cc2nccs2)cc1 1615377893 CRVPZTAATONCAD-UHFFFAOYSA-N 433.585 4.328 10 10 IICE Cn1ccc(Nc2nnc(CCc3ccccc3)n2CCCSc2nccs2)n1 1618429976 QBROLCVDWORGNQ-UHFFFAOYSA-N 425.587 4.179 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(-n2cccc2)ccc1Cl 1618648354 PHDREYDJZRYKSQ-UHFFFAOYSA-N 427.907 4.161 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H]1CCCc2cccnc21 1627180057 UGVXPVDFZZFQNQ-YKBBIGDRSA-N 443.619 4.318 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(C(=O)OC(C)(C)C)C(C)(C)C3(C)C)C2)cc1 1638650189 RHIOHFDNEUNZOG-QGZVFWFLSA-N 430.589 4.032 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@@H](c2cccnc2)C1 1639866345 QAFBTWLKCGXUIW-UWCCDQBKSA-N 443.619 4.141 10 10 IICE CCO[C@H]1C[C@@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1642127761 ZOQRFQKAUADLQB-PKTZIBPZSA-N 448.563 4.316 10 10 IICE CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1642459556 PGWAGZVEGBVFTJ-HSZRJFAPSA-N 435.593 4.262 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(C)C[C@]3(O)CCN(Cc4ccccc4)C3)c2C)c1 1642593584 GAFUAAHEXKIRDH-HHHXNRCGSA-N 431.580 4.112 10 10 IICE Cc1cc(CC(=O)NCCCONC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1645687173 XCPGQODCHUIGAP-UHFFFAOYSA-N 435.952 4.253 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4C(C)(C)[C@@H]3C)cc2F)C[C@@H](C)O1 1647754718 NTRPBGMVFXJTDW-OTWHNJEPSA-N 439.575 4.242 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CNC(=O)NCc3ccc(Cl)cc3)c2C)c1 1648611826 QQMHMAVOMRTNIG-UHFFFAOYSA-N 438.959 4.172 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC/C=C/c3ccc(Br)cc3)C2)cc1 1673024854 JEPUUEAIZWKKKL-DCKQQPRJSA-N 444.373 4.297 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3ccc(OC(C)(C)C)cc3)C2)cc1 1679289323 HNWUMPGLTRIKQQ-FQEVSTJZSA-N 425.573 4.241 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](CN(C)Cc3ccccc3)C(C)C)CC2)cc1 1680395159 CFLKWSGMNJTDAF-VWLOTQADSA-N 438.616 4.074 10 10 IICE COC(=O)c1ccc(CCNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c(OC)c1 1681438007 QVWLAIZBFWACEU-UHFFFAOYSA-N 449.551 4.240 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[S@@](=O)C(C)(C)CC3)cc2Cl)C1 1681828338 SMSNQMOHTJVABA-DEXQXJORSA-N 426.026 4.019 10 10 IICE Cc1cccc(C(=O)N2CCCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1683307242 AHYKVUDPTIPBIC-UHFFFAOYSA-N 444.579 4.460 10 10 IICE CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)o1 1684280789 QKPVWBFNEWBZNU-MBSDFSHPSA-N 425.573 4.486 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2Cc2ncn(C)n2)c(C)n1-c1ccccc1 1707252499 MVAQNVAVMGJYRD-UHFFFAOYSA-N 432.576 4.012 10 10 IICE CC(C)C(C)(C)Cn1c(-c2noc3c2COCC3)nnc1N(C)Cc1ccccc1O 1750575055 NHUWSUNGFMUBGD-UHFFFAOYSA-N 425.533 4.030 10 10 IICE CCCCOCCCn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C 1764207559 UKNHUHFJKJWYQF-UHFFFAOYSA-N 447.599 4.257 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)CC2CCCCC2)cc1F 1766912316 UDWCVVPIKATROU-HXUWFJFHSA-N 429.584 4.442 10 10 IICE COc1ccc(OCc2nnc(N3CCC[C@H]3C)n2CCCSc2nccs2)cc1 1770284848 NRAGQFILNRGFHP-MRXNPFEDSA-N 445.614 4.493 10 10 IICE CSCC[C@H](C)N(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1771453587 SFDSYQUQDOSICI-IBGZPJMESA-N 445.677 4.329 10 10 IICE Cc1cc(=O)c(OCC(=O)OC2CCC(C(C)(C)C)CC2)cn1Cc1ccc(N)cc1 1857915113 HARABLPFPHWAGM-UHFFFAOYSA-N 426.557 4.314 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)c1ccccc1C 1857997624 HLSIYYXEZOGPAJ-UHFFFAOYSA-N 429.473 4.418 10 10 IICE CCCC[C@H](NC(=O)/C=C/c1ccc(C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1861943403 CZMJHMDKPJWUNK-CVYRBCPQSA-N 449.595 4.041 10 10 IICE COC(=O)c1c(NC(=O)C2CCNCC2)sc(C)c1-c1ccc(Br)cc1 1865872239 QIFMDNZLNMYKOX-UHFFFAOYSA-N 437.359 4.211 10 10 IICE [N-]=[N+]=NCC1CCN(C(=O)c2cc(I)ccc2Br)CC1 1912190171 ZXWGMNFIVKGAMD-UHFFFAOYSA-N 449.090 4.216 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H]2NCc2ccc(Br)cc2O)C1 1918965354 UJOOTSFELIJUCB-YLJYHZDGSA-N 425.367 4.424 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1ccc(O)cc1O 1952792510 IEFGJZIJCXSPKW-URXFXBBRSA-N 445.471 4.495 10 10 IICE CN(Cc1ccccc1)[C@@H]1CCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2034739813 QJDQSYBNQXCCDN-HXUWFJFHSA-N 436.600 4.273 10 10 IICE Cc1c(C(C)C)nn(Cc2ccc(Br)cc2O)c1I 2079774911 ORSJFJFABJMILA-UHFFFAOYSA-N 435.103 4.436 10 10 IICE CCN(CCCOCc1ccccc1)c1cc2c(cc1Br)[C@H](NC)C(=O)N2 2153185466 MFZPBYPWZRJFQJ-FQEVSTJZSA-N 432.362 4.095 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@@H](NCc1cc(Br)cc(F)c1O)C2 2234536873 OUCWRXNCLXMEIM-DCGLDWPTSA-N 443.357 4.419 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3CCOc3ccccc3C)C2=O)cc1 2296125807 NOXISTCUAACSDW-UHFFFAOYSA-N 443.503 4.104 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc(OC)c(OC)c3)SC2=S)cc1 2314732750 WCGOMKCPBAFDGR-UHFFFAOYSA-N 429.519 4.286 10 10 IICE CCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1OCC 2314768440 HVYLTHRPPKHYTF-UHFFFAOYSA-N 442.562 4.339 10 10 IICE Cc1ccc(C)c(OCCn2cc(/C=C3\C(=O)N(C)C(=S)N=C3O)c3ccccc32)c1 33457921 IUMIWIYBFVUENL-UYRXBGFRSA-N 433.533 4.434 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(Cn3cccn3)cc2)C1 435550539 GEOCGEXKEXYSNI-UHFFFAOYSA-N 427.552 4.291 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(NC(=O)C3CC3)cc2)C1 435653185 FUUYKAFIYLLUQD-UHFFFAOYSA-N 430.552 4.395 10 10 IICE CC(=O)c1cnc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)s1 736151927 FAINLEYBYMUWLD-XYOKQWHBSA-N 437.593 4.027 10 10 IICE CN1CCCc2cc(/C=C3\NC(=S)N(c4ccc(OC(F)(F)F)cc4)C3=O)ccc21 748033336 IFQVPTGRKCAQGQ-ATVHPVEESA-N 433.455 4.230 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 759658115 DMZACCPKZFKGLB-QUCCMNQESA-N 432.362 4.132 10 10 IICE CCCc1ccc(-c2ccc(NC(=O)C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc2)cc1 785296325 CXIWWMQSWLXXPL-QGZVFWFLSA-N 432.520 4.403 10 10 IICE C[C@@H](NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1)c1ccc(N(C)C)cc1 791722123 WZGTYVUUTVEAQI-IERDGZPVSA-N 429.536 4.377 10 10 IICE CCCc1c(NCc2ccc([N+](=O)[O-])c(OC)c2O)cnn1-c1cc(F)c(OC)cc1F 796043555 QECVLXBJUHVRHV-UHFFFAOYSA-N 448.426 4.346 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N1CCCC[C@H]1c1nnc(CC(F)(F)F)o1 812006629 WXBJBUDSENXJLY-KRWDZBQOSA-N 437.466 4.211 10 10 IICE Cc1cc(Br)cc(CN2CCC23CCN(C(=O)OC(C)(C)C)CC3)c1O 812769385 DWDAQEIGRFTZPG-UHFFFAOYSA-N 425.367 4.439 10 10 IICE CCOC(=O)CN(Cc1ccc(F)cc1)C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1125539079 XQQVSKHPOLVJRR-UHFFFAOYSA-N 440.515 4.249 10 10 IICE CC(C)C[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(=O)OC(C)(C)C 1127129048 GGXZBRDGQUDMPH-NRFANRHFSA-N 441.616 4.280 10 10 IICE Cc1cc(CNC(=O)c2csc(I)n2)c(C)n1-c1ccccc1 1132268149 VGOCZTOSJBVAFF-UHFFFAOYSA-N 437.306 4.085 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)cc1 1136185104 OBCYJXVUXPUWCL-UHFFFAOYSA-N 446.866 4.471 10 10 IICE CCC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)c(Cl)c1 1142470000 QIQKNGFLCZXQAM-INIZCTEOSA-N 431.341 4.342 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)CCCC1 1264810318 QCOZHRVTUMNMRR-MRXNPFEDSA-N 435.524 4.141 10 10 IICE C[C@@H](CN(C)c1nnc(CC2CC2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1288591805 BTVNESQIRNHFIJ-HNNXBMFYSA-N 428.581 4.180 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N(Cc2ccnn2C)C2CC2)cc1F 1298062779 YZTNAQHOYQFFTF-UHFFFAOYSA-N 439.583 4.023 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(=O)c3cc(Cl)cc(Cl)c3)cc2F)C[C@H](C)O1 1356036769 ONFCSPPHWJXSHV-STQMWFEESA-N 439.314 4.245 10 10 IICE COc1ccc(N2CCCN(C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 1356397802 SXFPBTDALQGLRQ-NRFANRHFSA-N 447.620 4.309 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1cc(Br)ncc1Br 1436139562 ZFBWSEOVMSXODG-UHFFFAOYSA-N 432.459 4.049 10 10 IICE CC[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccc1F 1437212589 IXCGSWNDAQFAAF-LJQANCHMSA-N 432.407 4.390 10 10 IICE O=C([C@@H]1CCc2cc(Br)ccc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446566418 KUIMKUYVBQJMDJ-AZUAARDMSA-N 430.342 4.392 10 10 IICE CCOC(=O)c1sc2ncnc(NC[C@H]3CCN(c4ccc(OC)cc4)C3)c2c1C 1458443815 VOXRRWMPOOADBT-OAHLLOKOSA-N 426.542 4.123 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3=NN(c4ccccc4)C(=O)CC3)cc2Cl)C1 1459586024 QJPRVGAAJZJYDY-KRWDZBQOSA-N 438.959 4.376 10 10 IICE Cc1cccc(Oc2ccccc2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1462804950 IUPAZTPARLZVMO-UHFFFAOYSA-N 443.547 4.419 10 10 IICE Cc1cc(C(F)(F)F)ccc1CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1469802429 XLYHCRJDBGINLA-UHFFFAOYSA-N 443.416 4.128 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@](C)(O)c1ccsc1 1503488431 UKLKAVZBHRRFIR-QFIPXVFZSA-N 440.594 4.242 10 10 IICE Fc1ccccc1Cc1nnc(N2CCSCC2)n1CCCSc1nccs1 1505313187 TUSREDTUCJBJMI-UHFFFAOYSA-N 435.619 4.200 10 10 IICE CC(C)c1nc(CCn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)cs1 1508896538 PRCBATGNYCKOTF-UHFFFAOYSA-N 448.596 4.429 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCC(=O)NC1CCCCC1 1517146377 FDYIFHKAAVZOQG-UHFFFAOYSA-N 427.593 4.048 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCCO4)n3CCC(C)C)CC2)cc1F 1518309654 GSGKTNBGXURFHV-OAQYLSRUSA-N 431.556 4.040 10 10 IICE CCOc1ccc([C@]2(C(=O)N3CCOc4cc(N(C)C)ccc43)CC2(Cl)Cl)cc1 1523542675 UPEMTWWEOTYIQT-NRFANRHFSA-N 435.351 4.392 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1 1525761409 BFMRSRMBZVLTGZ-MRXNPFEDSA-N 448.032 4.376 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C2=Cc3ccccc3O[C@@H]2C(F)F)cc1 1544529210 AXYIVGQTCCHFKX-OFNKIYASSA-N 442.506 4.370 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccn1[C@@H](C)Cc1ccccc1 1546152089 RXBXMTAEWUEWAV-KRWDZBQOSA-N 440.927 4.466 10 10 IICE CN(CCC1CC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1554267368 PWNLJTBOAJNHCV-UHFFFAOYSA-N 429.584 4.127 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3OCCC3(C)C)CC2)cc1 1554958516 DRGVMYMOZOMWJV-OAQYLSRUSA-N 441.620 4.116 10 10 IICE O=C(NC1(c2ccc(F)cc2)CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1557643471 PEDRIZBGZPTHCA-UHFFFAOYSA-N 446.525 4.203 10 10 IICE COc1ccccc1[C@@H]1CN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CCO1 1557945103 KEGKUIKJAZYUFG-VWLOTQADSA-N 432.520 4.058 10 10 IICE COc1ccc(CCC2CCN(C(=O)N[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2)cc1 1565055863 MHLXYYQUJDHAOR-JOCHJYFZSA-N 437.584 4.337 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(C)(C)C 1566686230 KNYKIXOAJJUUQQ-QUCCMNQESA-N 434.577 4.229 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1567777415 VZZSSGKIMCEIIC-MRXNPFEDSA-N 443.594 4.414 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 1570514567 HIRURTZJGDCTDS-UHFFFAOYSA-N 449.463 4.250 10 10 IICE CNC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)Cc1ccc(F)cc1C 1570690702 ZRNGIFNWRYQFKV-NRFANRHFSA-N 435.543 4.185 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1 1596733603 VMKWCZIRRSSYPF-PMACEKPBSA-N 434.458 4.436 10 10 IICE CCOC[C@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1597059074 QZDQTRYEEWMKGZ-WIZMWCRPSA-N 438.640 4.147 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H](C)c1nccs1 1598413414 KNCUAERLKATCNW-SFHVURJKSA-N 440.617 4.135 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)C[C@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1611935466 RSNXFPXDTOJGPI-OALUTQOASA-N 448.615 4.313 10 10 IICE CCC[C@](C)(O)Cn1c([C@@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1614323704 HSMSLUVBMLMWQU-CYFREDJKSA-N 429.609 4.068 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(C)c3ccc(Oc4ccccc4)cc3)CC2)cc1 1616280667 RCEAUEQEVRADCB-XMMPIXPASA-N 447.579 4.107 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(C)c1O 1622493029 HWYKUCNPKWNPTQ-GZTJUZNOSA-N 430.526 4.378 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C(F)(F)F)OC[C@H]2C)c(C)n1-c1ccc(Br)cn1 1623755826 YGUMIUBLNOWJTL-ABAIWWIYSA-N 446.267 4.043 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@H](C)[S@]1=O 1627248494 AXUAHTFDMJAJLF-BGEIZFTASA-N 437.403 4.228 10 10 IICE CC(C)(C)OC(=O)Nc1cc(F)ccc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1630550844 WUDNSHHFVLKBLZ-UHFFFAOYSA-N 447.482 4.078 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C(C)(C)c3cccc4ccccc34)CC2)cc1 1631442876 LZFIWDYDQSGCDJ-UHFFFAOYSA-N 431.580 4.064 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)Cc2ccc3c(c2)N(C(=O)OC(C)(C)C)CC3)c1 1631543273 SJQIJSHHMNLDRJ-OAHLLOKOSA-N 426.513 4.118 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)COc2cccc(C(F)(F)F)c2)cc1 1631607803 HIWICSWHJLIGOG-NRFANRHFSA-N 436.474 4.358 10 10 IICE O=C(CN(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2)NC(=O)NC1CCCCC1 1642024914 ICNCXUFOHOXFQB-JXMROGBWSA-N 449.551 4.136 10 10 IICE C[C@H](NC(=O)N[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1)c1ccc(N(C)C)cc1 1680281240 WQMDOJLDCLLWQH-IJXRJRJASA-N 430.593 4.148 10 10 IICE CCN(CC)C(=O)OC[C@@H]1CCCCN1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1683254368 PJEGPYBXVADCEP-KNQAVFIVSA-N 432.609 4.035 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCc4c(Cl)cc(Cl)cc4C3)cc2)CC1 1687441412 MDWXYOBZAFGWNR-UHFFFAOYSA-N 433.383 4.013 10 10 IICE C=CCN(CC=C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1705870288 QLUBFMUNGAQIFE-AREMUKBSSA-N 444.583 4.009 10 10 IICE CCc1nnc(N2CC[C@]3(C)[C@@H](C2)C3(Cl)Cl)n1CCCSc1nccs1 1709098871 AGYVIJJNYNJGEL-MLGOLLRUSA-N 432.446 4.500 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C)[C@H](C)C3)n2CCCSc2nccs2)n1 1726061244 YSVMSUGWFBSQMF-HZPDHXFCSA-N 445.662 4.261 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N(C)C)cc1C 1749951844 ZMUTUYCGJJKUBH-LJQANCHMSA-N 429.609 4.051 10 10 IICE CCOC[C@H]1CCCN(c2nnc(CC)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1766469650 LPIAVVWPQUEVLS-QFIPXVFZSA-N 425.621 4.378 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC(CCCO)CC2)cc1 1766612024 ZFOXRRDZBKLYJT-UHFFFAOYSA-N 448.615 4.224 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)cc1OC 1860085400 INMLPEUCAPWCQY-LZYBPNLTSA-N 431.564 4.436 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3CCCN(Cc4ccccc4F)C3)cccc21 1861858148 FQOVHDKHZHIKPF-GOSISDBHSA-N 442.490 4.452 10 10 IICE CN(C)c1ccc([C@H](NC(=O)/C=C/c2ccc(Br)cc2)c2nccn2C)cc1 1866125780 XNVTWUVYHAFDBR-VGZTZGLTSA-N 439.357 4.168 10 10 IICE COc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1-c1ccc(C)cc1 1871333511 ZJCWRDDMJPIVQH-UHFFFAOYSA-N 437.455 4.217 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@@H](F)CNCc2cc(Br)cc(F)c2O)CC1 2163265484 VZFPMGZYOBAHGC-INIZCTEOSA-N 449.336 4.369 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H](C)C2)c1O 2236053847 ATEVMFXMJRFDRM-ZIAGYGMSSA-N 443.382 4.289 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(C(=O)OC(C)(C)C)CC3(CC3)C2)c1O 2236054327 HFHSHZXDSHURAG-CYBMUJFWSA-N 441.366 4.043 10 10 IICE CC[C@H](CCC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2352948748 UBAIHXQVLRXWBJ-CQSZACIVSA-N 429.355 4.163 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccc(F)cc4)C3=O)c2C)c1 16455638 XSZLCXCZNLZGIC-SANMLTNESA-N 447.510 4.500 10 10 IICE COc1ccc(N2CCN(c3cc(C(=O)N4CCC(C)CC4)c4ccccc4n3)CC2)cc1 23336477 KRXLZMILBDWGPI-UHFFFAOYSA-N 444.579 4.442 10 10 IICE COc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(c5ccco5)SC4=NC3=O)c2C)cc1 33447024 BVRSXVUJSRJPBH-ODJOWLHGSA-N 445.504 4.363 10 10 IICE CC(C)[C@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)n1cnc2cc(F)c(F)cc21 109510358 YUMRHDCNCCSENR-HSZRJFAPSA-N 442.510 4.007 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccc(C)cc3)=NC2=O)ccc1OCCC(=O)O 210468818 LOWRWSFOPKRPPZ-UYRXBGFRSA-N 426.494 4.330 10 10 IICE O=C1[C@@H]2[C@@H](ON(Cc3ccccc3)[C@H]2c2cc(Cl)ccc2O)C(=O)N1Cc1ccccc1 248004857 SOATWEQQEKPCOY-RJGXRXQPSA-N 448.906 4.088 10 10 IICE Cc1cc2c(n1-c1cc(I)ccc1Br)CCC[C@H]2N 381777656 CPFKFBDWLRHODK-CYBMUJFWSA-N 431.115 4.489 10 10 IICE CC(C)CN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1cccs1 586214720 MYTREHOQSARRDT-UHFFFAOYSA-N 425.531 4.375 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](CNCc2c(O)cccc2Br)C1 717002267 YKDHSXIXTNHRHU-GFCCVEGCSA-N 435.309 4.137 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N(C)[C@H](C)Cc3ccc(C)cc3)cc2F)CC1 739002911 DEGDXNDVIRXRRI-HXUWFJFHSA-N 426.580 4.049 10 10 IICE CCN(CC1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1)C(=O)OC(C)(C)C 745974290 UOYPYEXXZUNGRD-CSKARUKUSA-N 447.532 4.254 10 10 IICE CO[C@H](C)c1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 751061741 YXGLRMCXFGXCSF-CYBMUJFWSA-N 432.523 4.214 10 10 IICE COCC[C@@H]1CCCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 768327238 PTTRBMGURHFGKI-KRWDZBQOSA-N 425.520 4.105 10 10 IICE CN(C)c1ccc(N2CCC(NCc3ccc(N4CCN(CC5CC5)CC4)cc3)CC2)cc1 773144985 HCGXLDZMYNZJHZ-UHFFFAOYSA-N 447.671 4.043 10 10 IICE Cc1cc(-c2nnc(N3CCC(C(=O)N[C@@H](C)C(C)C)CC3)n2C)c(C)n1-c1ccccc1 800747596 MIHHHZREBPZSKX-IBGZPJMESA-N 448.615 4.267 10 10 IICE CC(C)(C)OC(=O)N1CCC(SCC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 807835262 BZGNWAFEUXZBED-UHFFFAOYSA-N 449.400 4.448 10 10 IICE Cc1cc(-c2ccc(/C=C3/C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)cc([N+](=O)[O-])c1C 1084515064 ULICKNWEWVYFIT-UYRXBGFRSA-N 445.431 4.480 10 10 IICE CCCn1c(=O)n(CCC(=O)NCc2cc(C)n(-c3ccccc3)c2C)c2ccccc21 1132048379 SULDKYMSAZJJJT-UHFFFAOYSA-N 430.552 4.327 10 10 IICE CCCCCC(=O)NC1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CC1 1136469135 QAYCGQUXKBEBKL-UHFFFAOYSA-N 437.584 4.137 10 10 IICE Cc1ccc(C(=O)N2CCC(CC(=O)N3CCCC3)CC2)cc1-n1c(C)cc(C=O)c1C 1141745880 BILMNWWJNXSJAV-UHFFFAOYSA-N 435.568 4.080 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@@H](C(C)C)CC3)CC2)cc(OC)c1OC 1235062325 XYPZEYNBPOIPPR-MOPGFXCFSA-N 433.593 4.149 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1c(C)noc1C 1266353792 COLZQCVLQLPVCY-FEEIMYBTSA-N 447.557 4.289 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(Cl)c2ccccc2c1O 1293975429 HYRQRLFDKWCTOL-UHFFFAOYSA-N 428.891 4.229 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(C)CCOCCNC(=O)OC(C)(C)C)c2C)c1 1302236903 QOLOSZRVRSNGMV-UHFFFAOYSA-N 429.561 4.016 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@H](C(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1305554747 RJUQDKAXYALCDH-APWZRJJASA-N 439.526 4.454 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@@H](C)c3ccc(C(F)(F)F)cc3)CC2)cc1F 1312513801 CLQPCESZZSCEMF-OAHLLOKOSA-N 439.453 4.488 10 10 IICE O=C(COc1cccc(C(F)(F)F)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1355505631 CGFILTYZFXVXIG-UHFFFAOYSA-N 425.362 4.498 10 10 IICE C[C@H](NC(=O)c1nccc2c(Br)cccc12)c1ccc(N2CCOCC2)cc1 1356164557 CZYMNIRQLWWILN-HNNXBMFYSA-N 440.341 4.325 10 10 IICE CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1359816812 MZYNXPKUFVLZQW-VBKZILBWSA-N 434.005 4.106 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C 1360848480 WBSVEGWASQTSTI-LJQANCHMSA-N 431.577 4.342 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H](C[C@H]1CCCO1)C(F)(F)F 1435064450 KORVTTIJIUDRKW-IAGOWNOFSA-N 436.421 4.121 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3c4ccccc4CCN3C(=O)OC(C)(C)C)ccc21 1464512772 PHFKIDFWOYHZSQ-HSZRJFAPSA-N 435.568 4.220 10 10 IICE COC(=O)[C@]12CCC[C@H]1CN(C(=O)c1cc(C)n(-c3cccc(Br)c3)c1C)C2 1471613403 JYVUGIALQJCHAP-AOMKIAJQSA-N 445.357 4.272 10 10 IICE CCCCN(CC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1500438344 LFOIOZOIFPVXFA-JOCHJYFZSA-N 445.583 4.170 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@H](CN(C)C)Oc2ccccc21 1517788648 MNLQKGWCMBUBTE-HJBMFWNLSA-N 431.536 4.393 10 10 IICE COc1ccc(N2CCN(C(=O)C[C@H](C)c3ccc(F)c(Br)c3)CC2)cc1 1518369293 LJCBUPBLPGXXIE-HNNXBMFYSA-N 435.337 4.439 10 10 IICE COC[C@@H](F)Cn1c(-c2cc3c(s2)CC[C@H](C)C3)nnc1N(C)Cc1ccccc1O 1518748339 YPPCXUYRLFJVJX-YJBOKZPZSA-N 444.576 4.458 10 10 IICE Cc1cccc(N2N=C(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CCC2=O)c1 1524937514 SQROCCJNUMIWHN-UHFFFAOYSA-N 444.535 4.366 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCC[C@H]2C(=O)OC(C)(C)C)C1 1535785521 IRRNBFBJIPKBJT-QHCPKHFHSA-N 439.600 4.131 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CCCC[C@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1542171737 YWPBSEIGAJIWFN-BWKNWUBXSA-N 445.604 4.208 10 10 IICE CCOCCC1(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCC1 1544268474 MCBMDJSXGUNTLR-OAQYLSRUSA-N 447.620 4.422 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(CC)(CC)CNC(=O)OC(C)(C)C)CC2)cc1 1545931631 PKTCBQCVGYVDAC-UHFFFAOYSA-N 433.593 4.065 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1547444919 VUFQJCXDDURNOV-XXBNENTESA-N 434.588 4.096 10 10 IICE CN(Cc1ccc(F)cc1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1554157975 GGOPMUYOFTUTPY-UHFFFAOYSA-N 441.561 4.150 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@@H](C)C1 1555537098 YHCKAUGXGUIKTJ-XMSQKQJNSA-N 436.604 4.337 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCC[C@@H]1C(=O)N1c2ccccc2C[C@@H]1C 1556515676 HXFMSPDENKCKIO-SXLOBPIMSA-N 441.568 4.278 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)CCCC1 1557536775 CGHXHLXTJNKZJR-IEBWSBKVSA-N 440.584 4.355 10 10 IICE COc1ccc(N2CCN(CCC(=O)Nc3cc(Cl)ccc3Cl)CC2)c(OC)c1 1560083400 XECRCFJNWIQFAN-UHFFFAOYSA-N 438.355 4.161 10 10 IICE COC(=O)N(C)Cc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1565716296 MPEPIHLDMJQLIG-UHFFFAOYSA-N 433.508 4.286 10 10 IICE O=C(CSCc1cccc(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1583379396 RQQDQGKVORSNNJ-UHFFFAOYSA-N 426.916 4.004 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2C2CCOCC2)c(C)n1-c1ccc(Br)cn1 1597807103 ZKYQIYRDVIRPCA-LJQANCHMSA-N 432.362 4.283 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@@H]3/C=C/c3ccccc3)CC2)cc1 1616321542 DSUUIWYPLJBFHU-GYKJBHARSA-N 449.639 4.136 10 10 IICE Cc1cc(Br)ccc1[C@@H]1CCCN1CC(=O)NCc1ccc(N(C)C)cc1 1620487862 HDVCNDODRSCVAX-NRFANRHFSA-N 430.390 4.277 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 1623366802 BZVYDDLHIFIXMQ-UHFFFAOYSA-N 442.811 4.060 10 10 IICE CCOC(=O)[C@@H]1[C@H](C)C[C@@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)[C@@H]1C 1623486208 AWKHUFKGPBUVIP-HJACJPOJSA-N 440.584 4.353 10 10 IICE Cc1ccc(C(=O)NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1-n1c(C)cc(C=O)c1C 1625096941 SSXXSHWFIQUUNB-BVAGGSTKSA-N 434.511 4.250 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc4c(F)c(Br)ccc4[nH]3)CC2)cc1 1625248014 FCTJJBKXVKVNPR-UHFFFAOYSA-N 446.320 4.431 10 10 IICE O=C(CCCC(=O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1625992014 ZVECDHPXEPGMSI-UHFFFAOYSA-N 434.458 4.211 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 1633864345 LUYBDWICEXJFIE-UHFFFAOYSA-N 446.482 4.458 10 10 IICE Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1634854633 OIWMADQAMKZDNK-XMMPIXPASA-N 443.547 4.088 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](CO)Cc3cc(F)c(F)c(F)c3)c2C)cc1 1639748975 ZDMGJKZMNPKWRO-QGZVFWFLSA-N 446.469 4.101 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](CCO)C2CCCC2)sc(C)c1-c1ccccc1 1648440404 RPRYWHQJOLYAOR-LJQANCHMSA-N 444.597 4.370 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3ccc(-c4ccc(Cl)s4)nn3)cc2)CC1 1651423734 IYIYAHSVXQUZSQ-UHFFFAOYSA-N 427.961 4.172 10 10 IICE CN(C)c1ccc(CN2CCC(Oc3ccccc3I)CC2)cc1 1652662222 OHQCAWLMOHGWQE-UHFFFAOYSA-N 436.337 4.401 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)/C=C1\SCC(=O)N1C 1654253756 YUTFKHHNDNMSMB-QREGZJMFSA-N 449.498 4.345 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCc3ccc(OC(C)(C)C)cc3)C2)cc1 1679289326 HNWUMPGLTRIKQQ-HXUWFJFHSA-N 425.573 4.241 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1692268113 FXKCEOYWWDCQKY-FQEVSTJZSA-N 443.611 4.472 10 10 IICE CO[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1697655384 JTSOTVBEXZANHL-QFIPXVFZSA-N 425.621 4.475 10 10 IICE C#CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@@H]1C 1705605379 JAYXKQLRZXVZSZ-SIKLNZKXSA-N 431.584 4.485 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC[S@](=O)CC)C1 1709288452 IDWKGJNHJPFFFW-PLTNMMHCSA-N 439.629 4.358 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1723496111 WDFKTPKNJALDOR-KRWDZBQOSA-N 444.630 4.230 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCSC1 1749750564 SSCRECZLGVPHLQ-LJQANCHMSA-N 425.602 4.188 10 10 IICE CC(C)CSCCn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750871856 GPYBJDRYJZWNQP-NRFANRHFSA-N 443.661 4.408 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1766611293 AQWLDAOLCDZHMU-IBGZPJMESA-N 436.604 4.182 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)CC(NCc1c(O)cccc1Br)C2 1913377581 DGEKEHOSSZHEKM-UHFFFAOYSA-N 425.367 4.424 10 10 IICE O=C(N[C@H]1C[C@@H](NCc2cc(Cl)cc(Br)c2O)C1)OCc1ccccc1 1977127447 BPDGLFZQJAVBEH-IYBDPMFKSA-N 439.737 4.355 10 10 IICE COc1ccc([C@H](n2nc(C(F)(F)F)c(CN)c2Br)C2(C)CC2)c(O)c1 2079859330 AMMFYSWSUQHPSD-AWEZNQCLSA-N 434.256 4.227 10 10 IICE CC(C)(C)OC(=O)NCC1(NCc2ccc(F)cc2O)CCN(Cc2ccccc2)CC1 2084179731 PQYSEVNLVFMBPL-UHFFFAOYSA-N 443.563 4.180 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1O 2236053995 CUHGDJCKFHSOCU-WMZOPIPTSA-N 433.390 4.411 10 10 IICE COc1ccc(Br)c(CNC[C@]2(C)CCCCN2C(=O)OC(C)(C)C)c1O 2236056351 VGDCIZRPZREYGK-FQEVSTJZSA-N 443.382 4.433 10 10 IICE CC(C)C1=NN2C(=N)C(=Cc3ccc(OCCOc4ccccc4)cc3)C(=O)N=C2S1 2296741711 MUOBWSMMRJNQET-UHFFFAOYSA-N 434.521 4.420 10 10 IICE Cc1[nH]c2ccccc2c1C=Cc1nc2ccc(I)cc2c(=O)n1C 2296753575 HFEVXMSLGWEKPW-UHFFFAOYSA-N 441.272 4.498 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N([C@H]2CC(=O)N(c3cccc(C)c3)C2=O)C1=O 2314833766 VQIDPVVZENGYDS-IBGZPJMESA-N 448.569 4.475 10 10 IICE O=C(O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 2323865504 KMTFPOHDLIZCQG-HNNXBMFYSA-N 434.882 4.275 10 10 IICE O=C1Nc2ccccc2/C1=C\c1ccc(N2CCN(c3ccccc3)CC2)c([N+](=O)[O-])c1 33671476 BAYQPEJHCWBBGE-LTGZKZEYSA-N 426.476 4.414 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccc(F)cc4)C3=O)c2C)c1 59271053 PCDQAZNHXNWCQG-RUZDIDTESA-N 433.483 4.192 10 10 IICE O=C(CN(Cc1cccs1)c1ccc2c(c1)OCCO2)N1CCC[C@@H](C(F)(F)F)C1 727141531 AYVITGREJJILGP-OAHLLOKOSA-N 440.487 4.327 10 10 IICE Cc1c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cnn1-c1ccccc1Cl 735517616 LNXDUTLQPDJKLE-GOSISDBHSA-N 425.916 4.361 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2cnccn2)c(C)n1-c1ccc(OC(F)(F)F)cc1 740968314 WEWULJNCLQIOCZ-BAQGIRSFSA-N 445.397 4.222 10 10 IICE CCOc1ccc(CNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1F 743597432 GWCWRYIDDZWHAC-MRXNPFEDSA-N 437.462 4.294 10 10 IICE Cc1ccc(/C=C/C(=O)N[C@H](C)CN(C(=O)/C=C/c2ccc(C)nc2)c2ccccc2)cn1 754259219 GXCPMOHRTRBMEO-QGMQHRFGSA-N 440.547 4.358 10 10 IICE O=C(NCc1cccc(Br)c1O)Nc1ccc([S@@](=O)C(F)(F)F)cc1 765301137 NEUGXXILHISAGO-RUZDIDTESA-N 437.237 4.104 10 10 IICE C[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1cc(Br)cc(Cl)c1O 765809955 PWWKOIORLXNXGS-NSHDSACASA-N 444.732 4.030 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCC[C@H](Nc2ccccc2)C1 769032916 FWEWADSYVYGIGR-VWLOTQADSA-N 447.627 4.005 10 10 IICE Cc1oc2c(CN3CCN(c4ccc(F)cn4)CC3)c(O)ccc2c(=O)c1-c1ccccc1 774650595 RDTBHJCDFYFTLJ-UHFFFAOYSA-N 445.494 4.330 10 10 IICE COc1ccc(C)cc1-c1csc(NS(=O)(=O)c2cnccc2C(F)(F)F)n1 785544069 PMHNBLQQXQYVGM-UHFFFAOYSA-N 429.445 4.342 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(c2ccc(Br)cc2)CCOCC1 819755008 BQEBHDDYRZAVTH-UHFFFAOYSA-N 439.346 4.005 10 10 IICE Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c2c(C)nn(C)c2n1 899602544 HFMWOSBLQPVXMZ-UHFFFAOYSA-N 434.471 4.171 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CCCN(C(=O)Cc3ccc(F)cc3)C2)cc1 916732263 BRIHAJHQRAXZBB-JOCHJYFZSA-N 439.575 4.112 10 10 IICE O=C(CCOc1cccc(Cl)c1Cl)NCc1ccc(N2CCOCC2)c(F)c1 917708033 BCKPOAAFPLYVJJ-UHFFFAOYSA-N 427.303 4.054 10 10 IICE O=C(COC(=O)c1ccc(-n2cncn2)cc1)Nc1ccc(N=Nc2ccccc2)cc1 921159840 RGMZBDGYYUOWTF-UHFFFAOYSA-N 426.436 4.478 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nnn(-c2ccc(F)c(Cl)c2)c1C 1129973336 HYGCXHXVWVVRMS-CQSZACIVSA-N 429.927 4.104 10 10 IICE CCN1CCN(Cc2ccccc2CNC(=O)c2sccc2-n2c(C)ccc2C)CC1 1136213331 JQQLDGYOPVDIGR-UHFFFAOYSA-N 436.625 4.223 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(-c2ccc(Cl)cc2)c1 1137438830 WDXPEJOBRDJEFY-IBGZPJMESA-N 445.350 4.279 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)CCCNC(=O)OC(C)(C)C 1141403051 HJBPUFDORNTAGM-MRXNPFEDSA-N 427.545 4.330 10 10 IICE Cc1cc(C(F)(F)F)nn1CCNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1233974569 QFPFAILSOLYZQO-UHFFFAOYSA-N 433.478 4.160 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)N(C)C)cc1 1252261757 SOVSQXNWQZRMQS-NMMYMHLASA-N 448.615 4.257 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC3(Cc4ccccc4Br)CC3)C2)cc1 1252925090 ZDHIURARFDQNJF-KRWDZBQOSA-N 444.373 4.111 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCCC2(F)F)n1 1290597811 KKIQLOOFAKEOEC-IBGZPJMESA-N 444.530 4.307 10 10 IICE CN(Cc1ccccc1O)C(=O)c1ccc([C@H]2CCCCN2C(=O)OC(C)(C)C)n1C 1294680558 WQLYMEIIEIIEAH-LJQANCHMSA-N 427.545 4.465 10 10 IICE CC(C)(NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Br)cc1 1313067570 OFNUGDSYWFWXST-UHFFFAOYSA-N 446.389 4.145 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1C 1316261988 CSPAIJLNECSKBW-QUCCMNQESA-N 437.588 4.250 10 10 IICE CCN1CCN(c2ccc(CNC(=O)COc3ccc(C(C)C)c(C)c3)cc2F)CC1 1352960477 LRSLUUCJTJIPPN-UHFFFAOYSA-N 427.564 4.095 10 10 IICE Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)nc1 1355015810 RDMJPEPDHLLKCD-NRFANRHFSA-N 430.552 4.217 10 10 IICE CCC1(CC)[C@@H](OC)[C@H](C)[C@H]1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357950337 JXMURIGKPYKXEL-XYHYBEPMSA-N 425.617 4.364 10 10 IICE CC[C@@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1360528930 SLBHCGZYYDLZGT-OWBBTNHHSA-N 443.569 4.422 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCc2c(C)nc3c4ccccc4nn3c2C)cc1 1437380243 CLHNIMCIRGSGFQ-UHFFFAOYSA-N 445.567 4.035 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCc3nc(-c4ccc(C(C)C)cc4)no3)C2)cc1 1437577038 LADRUEHLXIYHNM-HXUWFJFHSA-N 434.540 4.196 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@](N)(c1cccc(F)c1)C(F)(F)F 1457672735 NXKQWJBUOYCUSI-QGZVFWFLSA-N 449.242 4.059 10 10 IICE Cc1cc(C(=O)N[C@H](CCN(C)C)C(C)(C)C)c(C)n1-c1ccc(Br)cn1 1465069925 IFVHWMYIDGJCPC-GOSISDBHSA-N 435.410 4.348 10 10 IICE CC[C@@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1C(=O)/C=C\c1ccc(O)c(O)c1 1465267165 GQJQZJQBPZYXQQ-TYRWOZPQSA-N 438.524 4.149 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C)C(C)(C)c3ccccc3)cc2F)C[C@@H](C)O1 1473340334 FXSOJIVCHQWWAN-ZCNNSNEGSA-N 441.591 4.011 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)[C@H]4CCCS4(=O)=O)n3)c2C)cc1 1523935780 BBCSHPPFKKZCPM-LJQANCHMSA-N 429.567 4.042 10 10 IICE COc1ccc(CN(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1525298448 SIVCIQVBAGUBJM-UYRXBGFRSA-N 444.553 4.084 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CC[C@H](C)C2 1529700772 HNFRANQGGQSXCD-KBPBESRZSA-N 444.528 4.180 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)cc2Cl)C1 1538420799 DWFKGZLCOUWYQZ-ZDUSSCGKSA-N 432.864 4.323 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2sccc2-n2c(C)ccc2C)cc1 1540493445 WKBONTFJMLVAJV-UHFFFAOYSA-N 445.610 4.116 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cc2cccc(NC(C)=O)c2)cc1 1543115515 PYUPNFQTJUUQEF-UHFFFAOYSA-N 431.536 4.496 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(OCC2CC2)c1 1543233146 FIFRXTWDRGQUOS-IRXDYDNUSA-N 442.531 4.167 10 10 IICE C[C@H]1CCCN([C@H](C)Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)C1 1544077504 IDQGBPPHCNJOJP-VQTJNVASSA-N 425.621 4.473 10 10 IICE COC[C@@]1(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)OCCc2ccccc21 1556850884 ZOTAYKBYBCAGAX-HHHXNRCGSA-N 446.547 4.059 10 10 IICE O=C(C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F)NCc1cccc(Cl)c1O 1558756807 CHGCBZSGVFLKEB-QGZVFWFLSA-N 430.835 4.112 10 10 IICE COc1cccc(CN(C)C(=O)c2c(F)ccc(O)c2O)c1OCc1ccccc1F 1558970266 OXTAKWFJGXVHDG-UHFFFAOYSA-N 429.419 4.236 10 10 IICE COc1ccc(N2CCN(CCNc3nc(-c4cc(Cl)cc(Cl)c4)no3)CC2)cc1 1559085647 UJUDNRQOBATVKK-UHFFFAOYSA-N 448.354 4.286 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1ccc(C)cc1 1595481855 IDPWETQXRPNTFT-UHFFFAOYSA-N 436.531 4.243 10 10 IICE Cc1nc(SC(F)(F)F)sc1CC(=O)NCc1ccc(N2CCSCC2)cc1 1596359469 TVIWOCWKWLLZLJ-UHFFFAOYSA-N 447.573 4.476 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C(\C)c1ccccc1OC(F)F 1597567292 IPSBMIPNAKPVID-UKTHLTGXSA-N 439.842 4.252 10 10 IICE CC[C@H]1CCN(c2nnc(Cc3csc(C)n3)n2Cc2ccc(N(C)C)c(F)c2)C1 1614190898 CPTPCISBZWAGHO-INIZCTEOSA-N 428.581 4.124 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1Cc1ccc(OC(C)(C)C)nc1 1617940672 JRXVJNFRSGHROB-HXUWFJFHSA-N 437.544 4.092 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccncc2C(F)(F)F)C1 1618290041 IJRJCPRHUYPDNX-UHFFFAOYSA-N 430.474 4.138 10 10 IICE CCCOc1ccc(C(=O)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1623164544 GPQGGLNHQISILW-UHFFFAOYSA-N 447.579 4.196 10 10 IICE CC(C)c1ccc([C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2cccs2)cc1 1629122518 HOEZLYKNAIBGMG-OAQYLSRUSA-N 444.578 4.468 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](O)c2cc(Cl)c3c(c2)OCCO3)c1C 1631206855 PZCHXMDECLIITK-OAQYLSRUSA-N 440.927 4.291 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccccn3)C2)c(C)n1-c1cccc(Br)c1 1631987503 UFRUPQLHPNQRGC-GOSISDBHSA-N 439.357 4.260 10 10 IICE Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(=O)c3ccccc32)c(C)n1-c1ccc(Cl)cn1 1641160728 YOJWCGJEJOHNAF-UHFFFAOYSA-N 436.855 4.249 10 10 IICE C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1644766398 APTIFLMMVVACLT-MSOLQXFVSA-N 447.982 4.056 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C3(C(=O)OC(C)(C)C)CCOCC3)c2C)c1 1648612005 UCQNXGAYFBLYHR-UHFFFAOYSA-N 426.557 4.157 10 10 IICE Brc1cc(CNCc2cccc(-n3cncn3)c2)ccc1N1CCCCC1 1655674950 GHWQUKVMEXNZPS-UHFFFAOYSA-N 426.362 4.310 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(=O)N(Cc4ccccc4)C3)cc2Cl)C1 1681828290 RLCLOLNSAXJKTM-GOSISDBHSA-N 440.975 4.088 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](c1nc(-c2cccnc2)no1)C(C)C 1682097049 IDCVHZRIRRCZKP-UWJYYQICSA-N 436.560 4.134 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CCCC2(C)C)cc1 1695624328 KSKWRILYKBVAFP-UHFFFAOYSA-N 435.620 4.413 10 10 IICE CC(C)NC1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1706655120 LXPJJNLPRZZHCN-UHFFFAOYSA-N 442.627 4.231 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1712552681 WJNKCFFMKRPNFG-SFHVURJKSA-N 433.572 4.026 10 10 IICE FC(F)(F)[C@@H]1CCCN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)C1 1712858038 PPDYURFPMHLYLO-UONOGXRCSA-N 447.552 4.200 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1727662485 KODVZNQCVFBDQO-HTAPYJJXSA-N 434.588 4.066 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OCC(C)C)C1 1769853313 PWPABXYRDAIVSB-JOCHJYFZSA-N 437.588 4.250 10 10 IICE CCC1=NN(c2ccc(Br)cc2)C(=O)/C1=C/c1cc(OC)c(O)c(OC)c1 1865680030 SUFPANGIIKRQMD-OQLLNIDSSA-N 431.286 4.368 10 10 IICE C[C@@H](CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1)C(=O)c1cccc(F)c1 1866036881 UVUSCEYJHJLTDK-CYFREDJKSA-N 439.575 4.444 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCOc3ccccc3)C(=O)N(C3CC3)C2=O)cc1 1873164744 PZLXRVTWEZKYON-UHFFFAOYSA-N 441.531 4.005 10 10 IICE COc1ccc(Br)c(CNCc2cnc(NC(=O)OC(C)(C)C)s2)c1O 2227750938 MMGAMFSOMNIURH-UHFFFAOYSA-N 444.351 4.257 10 10 IICE Cc1cccc(-n2c(C)cc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1C 2297352556 APJKGVNMCVGUQM-UHFFFAOYSA-N 446.580 4.383 10 10 IICE COc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(C(F)(F)F)SC4=NC3=O)c2C)cc1 2297469116 JBJVPGLZFCAZKS-UHFFFAOYSA-N 447.442 4.284 10 10 IICE COc1cccc(CNC(C)=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)c1 2313683045 QIBQDDIJKYFKCG-UHFFFAOYSA-N 442.475 4.418 10 10 IICE CN1C(=O)COc2cc(N=NN3CCN(C(c4ccccc4)c4ccccc4)CC3)ccc21 2330245855 DPNJWTYNSMIYGA-UHFFFAOYSA-N 441.535 4.448 10 10 IICE CC1=NN(Cc2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141121 HPSZYMKJDUIISC-UHFFFAOYSA-N 448.262 4.475 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@](NCc3cccc(Br)c3O)(C2)C1 2333128564 BFBIFZRXCDMHCJ-JLTOFOAXSA-N 425.367 4.424 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@H](C)CNC(=O)OC(C)(C)C)c(O)c1Br 2380758299 IGFIBOHNRJIQFZ-ZDUSSCGKSA-N 443.382 4.363 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H]2CC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380761829 JLVNDKYROYUHED-DZGCQCFKSA-N 441.366 4.115 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472446 NTABJDONIMPISH-HFMPRLQTSA-N 434.540 4.493 10 10 IICE COc1ccc([C@H]2Nc3c(C(=O)NC[C@@H]4CCCO4)cccc3[C@H]3C=CC[C@H]32)cc1OC 14479448 IHMYISQGBICZFI-YBJWPOLQSA-N 434.536 4.439 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S 95472017 ZQQSOKUZZXONTN-XMHGGMMESA-N 427.547 4.420 10 10 IICE Cc1csc(CCCCNC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)n1 110513607 OZSLMMVBMWNNLR-UHFFFAOYSA-N 425.554 4.383 10 10 IICE O=C(O)CC[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 226858305 LOAWWKGHFLXCGU-KRWDZBQOSA-N 447.487 4.412 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](NCc1cc(Cl)cc(Br)c1O)C(F)(F)F 708092090 ZWBYXSQNCSWLJT-LLVKDONJSA-N 447.679 4.353 10 10 IICE O=C(NCc1cn2cc(Cl)ccc2n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743546558 OQTDNSYTWLPBQK-HNNXBMFYSA-N 449.889 4.057 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)NC(=O)NCc2cccc(Br)c2O)c(C)c1 765531962 CTBNNUHTGNZSFV-IBGZPJMESA-N 443.345 4.209 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 765539042 XBURNBVWWJKBFX-QGZVFWFLSA-N 433.350 4.343 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ncc(Br)s1 773146975 SIHNWVAYUSSXNC-OAHLLOKOSA-N 435.435 4.288 10 10 IICE COc1c([N+](=O)[O-])ccc(CNCc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)c1O 775038510 TUMPNDMNPKSPKP-CQSZACIVSA-N 431.489 4.185 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C)c1Br 790654224 BAGBUVASMFKPQJ-UHFFFAOYSA-N 431.374 4.205 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H](c1ccc(Cl)cc1)C1CC1 918187230 ZTSUVVHSRBQGNZ-QFIPXVFZSA-N 431.939 4.391 10 10 IICE COc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1125857217 ZWEOUIGTHFPKHV-QFIPXVFZSA-N 435.549 4.257 10 10 IICE CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1128384873 OVUSKUSSKOMVOC-INIZCTEOSA-N 434.989 4.300 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCCOc3cccc(Br)c3)C2)cc1 1130185567 LTKFWYLYOOEYSY-KRWDZBQOSA-N 447.373 4.259 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)N(C)C)cc1 1134882438 PYSCTXJNIAIYCV-LJQANCHMSA-N 446.473 4.459 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCCN3CCN(c4ccccc4)CC3)c2C)c1 1136194718 OZZHIZPXOQDMLK-UHFFFAOYSA-N 430.596 4.345 10 10 IICE CCOC(=O)[C@@H](CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)Cc1ccccc1 1136429775 RQOSDNRZCPIBBP-JOCHJYFZSA-N 436.552 4.056 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccsc2)NC(=O)OC(C)(C)C)cc1 1136903627 IMINRGLHAHTIOA-ZCNNSNEGSA-N 429.586 4.300 10 10 IICE COc1ccc(N(C)CCN(C)CCc2nc(N)c3c4c(sc3n2)C[C@H](C)CC4)cc1 1195788212 GIVIDPCMFSULLI-MRXNPFEDSA-N 439.629 4.018 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@H]1CCCC1(F)F 1288283238 FYVUFAOVABMAAL-RGHBXIHOSA-N 442.528 4.359 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cccc(NCc4nc(C)cs4)c3)CC2)cc1 1292594540 VGCDUKNSEMUBHS-UHFFFAOYSA-N 436.581 4.471 10 10 IICE COc1cc(C2(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)CCCC2)ccc1C 1294824799 WMSDFVHHIBCJMI-UHFFFAOYSA-N 426.532 4.312 10 10 IICE CCOC(=O)[C@@H]1c2ccoc2CCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1300827585 ASBQCKMKPVEBRG-QHCPKHFHSA-N 434.492 4.111 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H](OC)C(C)(C)C 1305526107 JJELAMAHWBAZOQ-UWJYYQICSA-N 447.599 4.327 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C(C)=C\c1cccnc1)CCC2 1435021468 XWFBPUYIXJRFHD-VKAVYKQESA-N 432.476 4.423 10 10 IICE C[C@@H](Cc1cccs1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1445362185 GXQOBHHVUGFNDG-ZDUSSCGKSA-N 436.580 4.019 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCN(CC(C)C)C2)c(C)n1-c1ccc(Br)cn1 1446510675 CBMJTEFKLCMKKM-GOSISDBHSA-N 447.421 4.349 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c(C)n1-c1ccc(Br)cc1 1448920794 JOPOBNSJAUVDNI-YHEJKZAPSA-N 447.373 4.265 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)cc2F)CC1 1456124475 CJICVDMSXZBRES-UHFFFAOYSA-N 448.586 4.234 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCCC34CCCC4)cc2F)C[C@@H](C)O1 1460137817 OGZWMZRTHBSGMM-DNVFCKCGSA-N 431.596 4.148 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc4c(c3=O)CC(C)(C)CC4)c2C)cc1 1473034139 SFAZTECVPFUSPR-UHFFFAOYSA-N 433.552 4.447 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(CCc1ccccc1F)C1CCCC1 1479030629 NIYSBGOZERHXHI-UHFFFAOYSA-N 439.575 4.484 10 10 IICE CCCCN(CC)c1nnc([C@@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1500438436 NUTJXWSPDTUNCA-QFIPXVFZSA-N 438.620 4.140 10 10 IICE Cc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(C)c1Br 1524850965 AEEMLESCZALAHV-UHFFFAOYSA-N 439.300 4.111 10 10 IICE CC(C)(Oc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015494 RGRKEPHSXZFZPB-UHFFFAOYSA-N 442.003 4.346 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(C)(C)Oc3ccc(Br)cc3)C2)cc1 1526246237 GNCVNSZUPVWMES-MRXNPFEDSA-N 447.373 4.258 10 10 IICE C[C@@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Br)s1 1527864680 URHJKXTTWHCRCD-LLVKDONJSA-N 445.329 4.045 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C/c2ccc(I)o2)cc1F 1543251653 WMZKFUSXSSBBTM-JXMROGBWSA-N 442.272 4.199 10 10 IICE Cc1cc(CNC(=O)OC(C)(C)C)oc1C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1543502350 WCAISKLDYTYVAB-UHFFFAOYSA-N 427.545 4.484 10 10 IICE CC[C@H](C)c1nnc(N(C)C[C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1545360799 DRRTVROOMCOWRM-GHTZIAJQSA-N 429.634 4.008 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCc1nccc(C(F)(F)F)n1 1554175155 JBJGNUGEMISRDQ-UHFFFAOYSA-N 446.477 4.329 10 10 IICE COC(=O)c1ccc(F)c2c1CN(C(=O)c1ccccc1-n1c(C)cc(C=O)c1C)CC2 1557506018 IQTCUPGGSAHOPO-UHFFFAOYSA-N 434.467 4.031 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1564555646 WZKANWHFGCUGBF-YQIFXUADSA-N 441.591 4.204 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)NCc2ccccc2O)C1 1565050139 SPFIHITWFXJDKI-WOJBJXKFSA-N 443.519 4.124 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccc4Cl)C3)cc2)CC1 1565662979 GISHUJHZCWGNDF-OAQYLSRUSA-N 439.987 4.241 10 10 IICE CCN(CC)CC(=O)Nc1cccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1570025303 JUXHPCIVFQWRKH-UHFFFAOYSA-N 446.551 4.439 10 10 IICE Cc1[nH]nc2ncc(NC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)cc12 1583290539 IQNGHIPUPMGVJA-UHFFFAOYSA-N 425.290 4.084 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCc3nc(C(C)(C)C)ncc3C2)cc1 1585395412 BURVZULJTKHSNK-UHFFFAOYSA-N 430.552 4.122 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc2c(Br)cnn2c1 1587476036 RPKQPXNOKWJLHW-UHFFFAOYSA-N 427.346 4.359 10 10 IICE CC(C)c1ccccc1N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1618309582 YXGFHNYXUWYUSU-RTBURBONSA-N 427.564 4.315 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H]2CCCN(c3ccccc3)C2)cc1 1626729345 VWDKEOFTQSPQOA-QHCPKHFHSA-N 429.564 4.482 10 10 IICE CCOCCOc1ccc(Br)cc1NC(=O)c1ccc(N=NC(N)=O)cc1 1632740376 VZJLYKMZBDNVOK-UHFFFAOYSA-N 435.278 4.279 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CC3(CNC(=O)OC(C)(C)C)CCCCC3)C2)cc1 1641228241 PUEIHPMVBRVHEQ-LJQANCHMSA-N 445.604 4.255 10 10 IICE CN(CC(=O)Nc1ccc(Oc2ccc(Br)cc2)nc1)Cc1ccccc1O 1642071659 CXORCWKUCZIUDV-UHFFFAOYSA-N 442.313 4.413 10 10 IICE Cc1cc(C(=O)COc2ccc(F)cc2C(N)=O)c(C)n1-c1ccc(Br)cc1 1656729364 XWELSNLGFBAZSH-UHFFFAOYSA-N 445.288 4.356 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)CSc3ccc(C)cc3)CC2)c(OC)c1 1681483719 NEUZTTWJZBDINM-GOSISDBHSA-N 429.586 4.025 10 10 IICE CC(C)SCCn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1692630039 UKRCNPHDBCSWDJ-HXUWFJFHSA-N 429.634 4.160 10 10 IICE C[C@@H]1CCC[C@@]1(O)Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1693645264 BITJTBOBGBUDAX-KBMIEXCESA-N 425.621 4.363 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)Cc1c(C)noc1C 1707305118 QNKOAMUQCKULLL-UHFFFAOYSA-N 431.544 4.004 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1710952486 QCPUMONTGZVDOI-LJQANCHMSA-N 445.677 4.428 10 10 IICE CC(C)Cc1nnc(N2CCN(C3CCC3)C[C@H](C)C2)n1CCCSc1nccs1 1723336942 AHCKOYZALKQURG-SFHVURJKSA-N 448.706 4.426 10 10 IICE CC[C@@]1(C)CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1727303065 UFPVWYFLHMEILB-DEOSSOPVSA-N 429.584 4.226 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)N1CCC(C)CC1 1730964232 HOPONDWEDIOKIN-FQEVSTJZSA-N 436.604 4.471 10 10 IICE CCc1cnc(CN(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)s1 1762687354 NUFDMGYKXSSUMS-UHFFFAOYSA-N 430.597 4.484 10 10 IICE CSCC[C@H](C)N(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)c(F)c1 1770546608 OEUBOGPFYGLOBB-KRWDZBQOSA-N 442.608 4.095 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(c4ccc(CC(=O)O)cc4)C3=O)n12 1860073434 FKGZTVIMHMVDBW-NTUHNPAUSA-N 449.966 4.391 10 10 IICE CN[C@H](C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccc2c(c1)CCN2C 2044754545 MOMUDPASGRTKCQ-DHIUTWEWSA-N 439.600 4.440 10 10 IICE COc1ccc(Br)c(CNCc2cccc(I)c2)c1O 2236052045 AZPVTRRMMUGRGZ-UHFFFAOYSA-N 448.098 4.058 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccc(C(=O)O)cc3)C2=O)cc1 2296881449 IHFNTDQDXPVXQM-UHFFFAOYSA-N 440.546 4.177 10 10 IICE CN1C(=O)/C(=C/c2cn(CCOc3ccc(Cl)cc3)c3ccccc23)C(O)=NC1=S 59182197 WWVPIAKUKXZQBF-LDADJPATSA-N 439.924 4.471 10 10 IICE COc1ccc(OC)c([C@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 108446027 RIBIPTGWUZJFGU-ULQDDVLXSA-N 445.535 4.017 10 10 IICE COCCc1nc2cc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)ccc2o1 444301199 CXKIVOFIZGOYGI-UHFFFAOYSA-N 446.551 4.377 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccccc3F)[C@H]2c2ccc(O)c(O)c2)c1OC 526203086 JCCYOGXYRLEATN-NRFANRHFSA-N 437.423 4.311 10 10 IICE CCCNC(=O)c1ccc(NC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 586692745 NIBIISHUKISQDE-UHFFFAOYSA-N 427.460 4.246 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3ccc(Br)cc3O)C[C@H]2C1 691426240 HRWMMCJJDQILLC-ZOBUZTSGSA-N 425.367 4.280 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2cnccn2)c(C)n1-c1cccc(Br)c1 740966141 QHAGECNOOGTTCS-VOTSOKGWSA-N 440.297 4.086 10 10 IICE CN(Cc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769056889 FRIGGTDZOYIBQJ-UHFFFAOYSA-N 426.992 4.214 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1C(F)F 769146301 DDSBHWQXHGXQBF-GFCCVEGCSA-N 446.420 4.187 10 10 IICE CCC1(CC)CN(C(=O)c2ccccc2SCc2cn3ccccc3n2)CC[S@@]1=O 769632983 PIVFIUNDGVAMQP-PMERELPUSA-N 441.622 4.390 10 10 IICE COc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1Br 806268708 PGHYBBHVOMLTST-UHFFFAOYSA-N 430.096 4.248 10 10 IICE CC(=O)c1ccc(NC(=S)NNc2nnc(-c3ccccc3)n2-c2ccccc2)cc1 915121824 NCGNOPQBXGCYNC-UHFFFAOYSA-N 428.521 4.450 10 10 IICE COC(=O)c1cccc(-c2ccc(/C=C3/C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)c1C 1084251970 ZSPJTUSDBVPZNT-ZHZULCJRSA-N 444.443 4.050 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)sc2c1CCCCC2 1125083593 AZFGTKPYPVHJOS-AWEZNQCLSA-N 444.528 4.243 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(OCc3ccccc3)c(OC)c2)cc1 1130543736 DKWJTTGMOCWNPP-UHFFFAOYSA-N 434.536 4.491 10 10 IICE CSc1ccc(O)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1147507487 RITLZTQVUHDXQV-LJQANCHMSA-N 445.585 4.176 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCc1ccc(OCCN(C)C)cc1 1149900783 UAUFFXMJVFIPBD-UHFFFAOYSA-N 449.389 4.076 10 10 IICE Cc1ccc(C(=O)NC(C)(C)C(=O)NCC2CCCCC2)cc1-n1c(C)cc(C=O)c1C 1150052375 DCAYDOUIAWDWLG-UHFFFAOYSA-N 437.584 4.420 10 10 IICE Cc1cc(C(=O)NC(C)(C)[C@H](O)C(F)(F)F)c(C)n1-c1ccccc1Br 1152629683 MDXZCKFYTZKYGY-INIZCTEOSA-N 433.268 4.288 10 10 IICE Cc1cc(C(=O)N2CCC(CN(C)C(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1292032255 ZUWIFIITXYMQKD-UHFFFAOYSA-N 447.421 4.444 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC(=O)Nc2cccc3ccccc23)c1 1292564734 YYLGMEFAVORJLX-UHFFFAOYSA-N 425.488 4.428 10 10 IICE Nc1ccc(Br)cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294158497 BNRBFHYVIANVIW-CYBMUJFWSA-N 440.288 4.032 10 10 IICE COc1cc(CN2CC[C@@H](NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)cc(OC)c1 1294644650 CQBGKBLNAFMKJM-HSZRJFAPSA-N 447.579 4.045 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC(C)=C(C)C2)n1CCCSc1nccs1 1305748267 MWEDCJBLJKGHBW-UHFFFAOYSA-N 448.662 4.382 10 10 IICE COc1ccc(N(C)C[C@@H](NS(=O)(=O)c2ccc(C)cc2)c2ccccc2)cc1F 1307556375 YNBFRXNHDTVIND-JOCHJYFZSA-N 428.529 4.299 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1313681650 UXBLVXSCKRRORH-YADHBBJMSA-N 441.620 4.275 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1 1315775687 NLKKPPDHQQSGHI-QUCCMNQESA-N 437.588 4.250 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(F)(F)c3c(F)cccc3F)cc2F)C[C@@H](C)O1 1350932240 FAEMVAIQLOSNEA-BETUJISGSA-N 428.401 4.126 10 10 IICE O=C(C[C@@H]1CSc2ccccc2O1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354767409 NZAYCRVZHRVRIY-MAUKXSAKSA-N 434.508 4.316 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccnc2C(F)F)NC(=O)OC(C)(C)C)cc1 1444503561 KBTJCDHUQDELGG-QGZVFWFLSA-N 434.487 4.081 10 10 IICE CCN1CC[C@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C[C@H]1C 1444620135 VWJISIWPEVWEIO-KDOFPFPSSA-N 433.394 4.196 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(OCC3CCCCC3)CC2)N(C)C)cc1 1479532076 AMWGBSTXKYHOQF-DEOSSOPVSA-N 430.637 4.126 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1509256056 RPMAGPRLQMALFI-OAQYLSRUSA-N 436.579 4.390 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1517764138 MFRCDMGEUBKKCR-YLJYHZDGSA-N 425.602 4.329 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc(Cl)cc4ccccc34)CC2)cc1 1531523870 ABSAFBUYQANPCW-UHFFFAOYSA-N 437.971 4.444 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CC3(CC3)c3ccc(Br)cc32)C1 1533189175 FPJGDEAXLRVQAB-OAHLLOKOSA-N 433.346 4.441 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4cccc(F)c4)C3)cc2Cl)C1 1539913926 WQSSEELOQYOYBW-AEFFLSMTSA-N 443.950 4.385 10 10 IICE CC(C)=CCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1541256884 MQYALPRHWGRREN-UHFFFAOYSA-N 446.599 4.093 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1545257432 MDDUWNRGYPWACN-FQRUVTKNSA-N 448.615 4.374 10 10 IICE CC[C@H](C)[C@H](Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C)OC 1545306808 XCZXHLGWBAJMRB-UGKGYDQZSA-N 443.636 4.110 10 10 IICE CC[C@@H](c1ccc(F)cc1)N1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1 1559272234 OOXYOSVUCGDASM-ITJCZCKWSA-N 427.476 4.193 10 10 IICE CCOC(=O)Cc1csc(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 1595589526 VGCUWUDBQPOXLA-UHFFFAOYSA-N 445.972 4.169 10 10 IICE Cc1cc(-c2nnc(N3CCCC3(C)C)n2CCOCCCO)c(C)n1-c1ccccc1 1611935170 JCKDGNRJMBTDIE-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(CC(C)C)CC2)n1Cc1ccc(N(CC)CC)cc1 1613327876 CEPGXDODGMMETF-OAQYLSRUSA-N 426.653 4.464 10 10 IICE CSC[C@H]1CCCN1c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)cc1C 1620257775 QMMXQEHFQHZADD-JOCHJYFZSA-N 436.629 4.018 10 10 IICE Cc1ccc(C(=O)NCc2cccc(C(=O)NC3CC3)c2)cc1-n1c(C)cc(C=O)c1C 1624875239 BUWRXUXLFNICEV-UHFFFAOYSA-N 429.520 4.037 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)c(C)n1-c1ccc(Cl)cc1 1625211925 SKSGELFWYGHSOX-UHFFFAOYSA-N 439.918 4.485 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1c(O)cnc2c(Br)cccc12 1625377100 JXIDVPBMQDIBET-UHFFFAOYSA-N 426.314 4.233 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C(F)(F)F)O[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1629963353 KUCHMLGJXWSPIS-ABAIWWIYSA-N 446.267 4.043 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2ccc(N3CCOC3=O)cc2)cc1 1631239429 QTJFZLUSLOLOGL-SFHVURJKSA-N 445.519 4.283 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](Cc3ccccc3)[C@H](O)C(F)(F)F)c2C)cc1 1636710742 SGHOMOMPQUCYJA-YADHBBJMSA-N 446.469 4.367 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1640088558 SQZCOCNCCDHTRR-SWLSCSKDSA-N 429.355 4.100 10 10 IICE COc1ccc([C@@H](NC(C)C)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1641335327 TYURAARPNMYVBX-PGRDOPGGSA-N 447.526 4.121 10 10 IICE COC(=O)/C=C/c1ccc(N2CC3(CC(OC)(OC)C3)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 1643213455 DHOLGWUUKQLROQ-RSNBEDGSSA-N 438.480 4.112 10 10 IICE Cc1ccc(C(=O)N[C@H](C)c2ccccc2O)cc1S(=O)(=O)Nc1ccc(F)cc1 1648890089 ZBZFTMXWBBEMHW-OAHLLOKOSA-N 428.485 4.132 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccccc2F)c(C)n1-c1cccc(Br)c1 1652030484 PHGKDONQWKCVSI-LJQANCHMSA-N 445.332 4.329 10 10 IICE COC(=O)c1cc(OCC(=O)N2CCCCC[C@H]2c2ccc(OC)cc2)ccc1N(C)C 1656826185 QXSDPIPSBRSMPC-QFIPXVFZSA-N 440.540 4.071 10 10 IICE CN(CCOc1ccccc1C(C)(C)C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1685682279 XPVHVCGFWGIMHO-QHCPKHFHSA-N 440.632 4.373 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)N1Cc2cccc(O)c2C1)NC(=O)OC(C)(C)C 1686673855 UJUZPLKSZMHUMD-HXUWFJFHSA-N 425.529 4.246 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCSC3)n2CCCCCO)c(C)n1-c1ccccc1 1692984012 BLDVNHMDMAOCCT-OAQYLSRUSA-N 439.629 4.457 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)[C@@H](C)c1ccco1 1693005556 JMSOPXVXXZTQKA-IBGZPJMESA-N 430.556 4.477 10 10 IICE CC(C)c1nnc(N2CCN(C3CCCCC3)CC2)n1CCCSc1nccs1 1706317141 YYJCPBYPRPBDCJ-UHFFFAOYSA-N 434.679 4.495 10 10 IICE Cc1ccc(-c2nnc(N3CCN(C(C)(C)C)CC3)n2Cc2ccc(N(C)C)cc2C)o1 1707365286 KKQWWHJVBFCQPU-UHFFFAOYSA-N 436.604 4.190 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCC(C)(C)O)n1 1751603512 AVTDPISNIMUBQM-UHFFFAOYSA-N 434.588 4.046 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc2c(c1)CCCN2C 1763837582 RSDHIZZUFLMARP-HARLFGEKSA-N 441.620 4.058 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1CCc1csc(C(C)(C)C)n1 1768681840 OGGKWEQZPWNREK-QGZVFWFLSA-N 441.601 4.121 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CCCCS3)CC2)cc1F 1768704813 OVPFVIFSTIXPHK-LJQANCHMSA-N 447.624 4.237 10 10 IICE COCC1(C)CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1770812354 BORFTZPGBSFJEJ-UHFFFAOYSA-N 431.600 4.373 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc2c(c1)CCCN2C 1771207713 LFOYVJNEODBPTO-SIKLNZKXSA-N 441.620 4.058 10 10 IICE COc1ccc(C)cc1N1C(=O)/C(=C\c2cc(OC)c(O)c([N+](=O)[O-])c2)SC1=S 1860086822 JQGAJMGKVICGEN-CXUHLZMHSA-N 432.479 4.032 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1cn(-c2ccc(Cl)cc2)c(=O)c2ccccc12 1860289836 QYBJMWWZTISGHH-UHFFFAOYSA-N 434.879 4.028 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cc(O)cc1O 1951862840 GQESUSPRGKSMAW-VWLOTQADSA-N 449.459 4.032 10 10 IICE COc1ccc(O)c([C@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@H]2C(=O)O)c1 1952766993 YXLUWCVAESRSFO-BKMJKUGQSA-N 445.471 4.239 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C(C)C)c(CO)c2I)c(O)c1 2078984005 MNRVVUKAACXGPF-QGZVFWFLSA-N 428.314 4.363 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C2CCC2)c(C=O)c1I 2080022946 RAZIDVGJAABHEP-OAHLLOKOSA-N 440.281 4.281 10 10 IICE COc1ccc([C@@H](n2nc(C(C)(C)C)c(C(N)=O)c2Br)C2(C)CC2)c(O)c1 2080056261 QQQZQQFGEHWLJB-MRXNPFEDSA-N 436.350 4.146 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)CC2(C)C)c1O 2236038077 SXGPGYVNJRSSGI-MRXNPFEDSA-N 443.382 4.289 10 10 IICE O=C1N=C(N2CCN(c3ccccc3F)CC2)SC1=CC=Cc1ccccc1[N+](=O)[O-] 2314557548 NRKQNNHRFUAPPK-UHFFFAOYSA-N 438.484 4.083 10 10 IICE CCCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 33362753 OQCWSRBXJWOSEO-AQTBWJFISA-N 428.535 4.030 10 10 IICE Cc1ccc(N2C(=O)C[C@@H](N3C(=O)/C(=C/C=C\c4ccccc4)SC3=S)C2=O)cc1 33448433 DNRROVRYDPUHRR-VMVCOFHISA-N 434.542 4.085 10 10 IICE Cc1ccccc1/C=C1\SC(=S)N([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 47152391 OIWLZAGZEMUTRM-GPLLRDDGSA-N 427.507 4.132 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@@H](c3cccs3)N3CCC(C)CC3)CC2)cc1 302903328 VKKPIWDQDBMCHK-QFIPXVFZSA-N 442.629 4.062 10 10 IICE COc1cccc(CNC(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)c1O 729567098 HGKHPKKWGBWJDC-UHFFFAOYSA-N 448.306 4.239 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)c1cc(C)n(-c3ccccn3)c1C)O[C@@H](C)C2 730780931 UVLSPEUAWMZJLZ-BUKVSMQUSA-N 431.536 4.497 10 10 IICE COc1ccccc1-c1nn(C)cc1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 740814806 DRHZAXKEQBUXKH-UHFFFAOYSA-N 428.536 4.476 10 10 IICE COc1cc(N(C)Cc2nc(O)c3c(-c4ccco4)csc3n2)cc(OC)c1OC 741798782 MIILTKRMYKDZGZ-UHFFFAOYSA-N 427.482 4.319 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 745808317 DIFPKFMOBWQOHF-FQEVSTJZSA-N 432.609 4.320 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1-c1ccc(Br)cc1 750983323 HDKRETQTLCKFBB-UHFFFAOYSA-N 427.346 4.281 10 10 IICE COc1cc(Br)ccc1CNCc1cc(Br)cc(OC)c1O 778179428 HQCNUNFUOQDAHX-UHFFFAOYSA-N 431.124 4.224 10 10 IICE O=C(CO[C@@H]1CCCc2ccccc21)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 797435430 HQLRLQZKXKJDJO-JOCHJYFZSA-N 448.485 4.252 10 10 IICE Cc1cc(C(=O)NCCNC(=O)c2ccccc2)c(C)n1-c1ccccc1Br 918008369 KUOZFPGAZBUHNE-UHFFFAOYSA-N 440.341 4.016 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1135689325 BUAZCWUIYWYBKZ-FQEVSTJZSA-N 433.499 4.255 10 10 IICE Cc1cc(C(=O)NCc2cccnc2OC(C)C)c(C)n1-c1ccc(Br)cn1 1141722164 UBSPZSIDTMSASU-UHFFFAOYSA-N 443.345 4.364 10 10 IICE CCOCn1nc(C)c(C[C@@H](C)C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1C 1160563793 UGSNNTVUUYKAOK-MRXNPFEDSA-N 432.528 4.021 10 10 IICE COc1c(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cnn1C 1160645155 FLIKKHVRXDAXLM-SFHVURJKSA-N 432.446 4.354 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1 1171730523 XKGPQMWRPQSCKR-UHFFFAOYSA-N 449.517 4.273 10 10 IICE COc1ccc(N(Cc2ccccc2)Cc2cccc(S(=O)(=O)N(C)C)c2)cc1OC 1177021770 FXJGPXZOADMACQ-UHFFFAOYSA-N 440.565 4.161 10 10 IICE CCN(CC)c1nc2sc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)cc2s1 1294823794 PGCOSTHCXMPBIP-UHFFFAOYSA-N 448.589 4.314 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CC4)n3C[C@@](C)(O)CCC(C)C)CC2)cc1 1300247782 PNMPBWSZSPLJAV-VWLOTQADSA-N 441.620 4.068 10 10 IICE Brc1cc(CNc2ccc(N3CCOCC3)cn2)ccc1N1CCCCC1 1308212528 YYQRPMBUUPDVSY-UHFFFAOYSA-N 431.378 4.283 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC(C)(C)C(C)C)CCOC1 1360324250 MZFJFTOMOFRBNB-DEOSSOPVSA-N 430.593 4.343 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2ccc(C(N)=O)cc2-n2ccnc2)c1 1436375414 GBDOFIZEQFPLSQ-UHFFFAOYSA-N 433.899 4.284 10 10 IICE C[C@H]1CCc2ccccc2N1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1440658053 IOUMTTKHXGICCW-AWEZNQCLSA-N 428.535 4.236 10 10 IICE Nc1c(Cl)ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1Cl 1466114381 UNHJUSNMWMRUKY-UHFFFAOYSA-N 433.383 4.038 10 10 IICE O=C(NCCn1ccc2cc(Cl)ccc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 1470089201 ZTFWAPIBYBNREP-FQEVSTJZSA-N 427.932 4.391 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(=Cc4cccc(OC)c4)CC3)C2)cc1 1470594891 XDEBXRWNYUXPGE-JOCHJYFZSA-N 435.568 4.419 10 10 IICE COc1ccc([C@@H](CN(C)C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1470968531 ALXOSTIOKPXCOL-RUZDIDTESA-N 434.584 4.247 10 10 IICE CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1cccc(CSc2ccccn2)c1 1473343719 AIPOKAPLUFTZPI-UHFFFAOYSA-N 434.565 4.277 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CC[C@@H](F)C1 1495755652 WLZZBXLNNBPUAZ-RCCFBDPRSA-N 433.547 4.404 10 10 IICE Cc1nn(C)c(C)c1CN(C)c1nnc(C(C)(C)C)n1CCCSc1nccs1 1511633172 VRSFVQKSFJJUFR-UHFFFAOYSA-N 433.651 4.201 10 10 IICE CCCCN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1514453137 KKCQPIDZPAJFFS-UHFFFAOYSA-N 427.572 4.020 10 10 IICE COc1cc(N2CCN(C(=O)/C=C/[C@]3(C)CC[C@@H](C)C3(C)C)CC2)cc(OC)c1OC 1521501246 JUTDRNXAAYTARX-YLEPIKALSA-N 430.589 4.380 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CC[C@@H](C3CC3)N2C(=O)OC(C)(C)C)C2CC2)cc1 1524793229 CPDUEDSSVDCWGI-FCHUYYIVSA-N 427.589 4.422 10 10 IICE O=C(C[C@]12CCCC[C@@H]1C2(F)F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245790 NPVPHXDWPMNXLH-PKOBYXMFSA-N 432.433 4.374 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c(C)nn(Cc4ccccc4)c3Cl)C2)cc1 1529705898 BURXVNXEZSXMJX-IBGZPJMESA-N 438.959 4.158 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2coc(C(C)(C)C)n2)NC(=O)OC(C)(C)C)cc1 1544268341 KWCMCDUUSKUEOU-KRWDZBQOSA-N 430.549 4.034 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](C[C@@H]3COCCO3)C(F)(F)F)cc2Cl)C1 1556369221 JAEIKASHOFFLFV-DJIMGWMZSA-N 448.913 4.177 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1557139494 FUUQYCLKRLUANN-UHFFFAOYSA-N 432.446 4.225 10 10 IICE CC(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1568604498 JAGUEJODJSKHNW-HNNXBMFYSA-N 429.355 4.100 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2Cl)C1 1586083077 VWPGXLQBTYUUMH-AEFFLSMTSA-N 443.950 4.385 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(F)cc4F)CCCC3)CC2)c(OC)c1 1587487258 XJJVAZDZIRZAIP-UHFFFAOYSA-N 430.495 4.143 10 10 IICE CCNC(=O)COc1cccc(CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1587497555 DRSRAMNMWQAMPC-UHFFFAOYSA-N 439.943 4.192 10 10 IICE Cc1cc(C(=O)NC[C@H](O)C(=O)OCc2ccccc2)c(C)n1-c1cccc(C(C)C)c1 1588481094 KCYUVNMPBCAFJO-DEOSSOPVSA-N 434.536 4.052 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(NCc4ccsc4)cc3)c2)CC1 1616451271 ODISFPJJFZMNAJ-UHFFFAOYSA-N 434.565 4.281 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)CCc2cccs2)cc1F 1617668918 LKISXACDIVJICI-HXUWFJFHSA-N 429.565 4.123 10 10 IICE COCC[C@@H](Cc1cccc(Br)c1)C(=O)NCc1ccc2c(c1)CCCN2C 1626940187 BEXGCJVLTCKZFX-FQEVSTJZSA-N 445.401 4.343 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)C1CCCCCC1 1631069658 KLZINAMWJDKFRN-QFIPXVFZSA-N 445.604 4.003 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3C2=O)c(C)n1-c1ccc(Br)cc1 1631826913 PIJQFOARQOJDJR-LJQANCHMSA-N 439.309 4.230 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCSc3ccccc3Cl)cc2F)CC1 1632994855 WDAZUBBMAFBYIB-UHFFFAOYSA-N 435.996 4.420 10 10 IICE Cc1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c(-n2cc(Cl)cn2)n1 1638692449 UTRHKSUBIINNOL-UHFFFAOYSA-N 447.926 4.379 10 10 IICE Cc1cc(C(=O)N2CCOC23CN(C(=O)OC(C)(C)C)C3)c(C)n1-c1ccc(Cl)cc1 1648121058 ZRCMZNNNJHFIRP-UHFFFAOYSA-N 445.947 4.167 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)C3[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]34)c2C)cc1 1648124384 SMAPZYOQIWHZLB-NHCUHLMSSA-N 439.556 4.040 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](C(C)(C)C)C[C@@H]3C)cc2F)C[C@@H](C)O1 1654615477 PGDJBVVVRTVVRG-HUUJSLGLSA-N 433.612 4.202 10 10 IICE COC1CCN(c2ccc(CN(C)C[C@@H](O)c3cccc(Br)c3)cc2)CC1 1658989385 OKZLHQSTBBEEDV-JOCHJYFZSA-N 433.390 4.230 10 10 IICE C[C@@H](NC(=O)N[C@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2)c1ccc(N(C)C)cc1 1680279977 HCPZNTOSJOGEDK-SEONNTABSA-N 430.593 4.291 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)CCS2 1685660967 NFHDMUXGPXSJLG-SZTYLXMGSA-N 446.613 4.454 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)CCc2nccs2)cc1 1710026165 ZOWZBDPEEIALAO-UHFFFAOYSA-N 447.612 4.370 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1CCc1nc(C(C)(C)C)cs1 1711095821 YZTNKJZESCKTJM-KRWDZBQOSA-N 441.601 4.121 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)Cc2nccs2)cc1F 1729329288 IDMQVNUKTXALCA-UHFFFAOYSA-N 428.581 4.357 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1CCCN(C)C1CCCCC1 1729418645 GBVIZVXYEVITSX-UHFFFAOYSA-N 436.604 4.280 10 10 IICE COCC1(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)CCCCC1 1730517309 GFNKZWFPPWCZBS-UHFFFAOYSA-N 435.572 4.203 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C)NC(=O)OC(C)(C)C)o1 1761738310 UFQZAOXXCRGRHF-OAHLLOKOSA-N 441.532 4.102 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763790669 JQLRRRAXPMPZCR-GOSISDBHSA-N 440.567 4.170 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763825314 BLAPTCBBCJZPMS-QUCCMNQESA-N 429.634 4.008 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1 1770725259 ZUQNQRBXKLVIKY-SFHVURJKSA-N 437.588 4.250 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)cc1OC 1860083894 COKQXFBRRRVEOO-VCHYOVAHSA-N 446.506 4.417 10 10 IICE CCOC(=O)C1CCN(C(=O)c2ccc3[nH]c(-c4ccc(N(CC)CC)cc4)nc3c2)CC1 1873507073 VLOLWFGOKFRONA-UHFFFAOYSA-N 448.567 4.491 10 10 IICE COc1cccc(CNCCCONC(=O)OCC2c3ccccc3-c3ccccc32)c1O 1937209590 KWHYYIKINCVVTI-UHFFFAOYSA-N 448.519 4.351 10 10 IICE O=C(N[C@@]1(c2cccc(F)c2O)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952777026 XXYSIVIKWQCRTK-CJFMBICVSA-N 433.435 4.370 10 10 IICE N=C1/C(=C/c2ccc3c(c2)OCO3)C(=O)N=C2SC(C34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)=NN12 2059072197 HYENIRSLCSHJEO-LCWDKFBISA-N 434.521 4.251 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)ccc2O)[C@H]2CCCC[C@H]21 2122805267 OYSGSWIRNXURCM-IXDOHACOSA-N 425.367 4.422 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccccc1OCc1cccc(F)c1 2313559228 UMRUNQXXCWYTCO-UHFFFAOYSA-N 434.398 4.210 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)C(=Cc3cc(Cl)ccc3O)SC2=S)cc1 2314829001 YEVGWVQLNNGIBZ-UHFFFAOYSA-N 448.953 4.284 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CCNC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2381127651 ZHRIUQQYZKMOAN-HNNXBMFYSA-N 443.382 4.266 10 10 IICE CCOc1ccc(-n2cccc2/C=C2\C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)cc1 20211312 DCGDZUKHTCNDHA-WSJZXGLNSA-N 433.415 4.057 10 10 IICE CCOC(=O)c1[nH]c2ccccc2c1/C=C1\C(=O)N(CCc2ccc(F)cc2)C(=O)N=C1O 38170559 JGAFHXAQMLJZKB-AQTBWJFISA-N 449.438 4.029 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 96748245 DBOYTMSCKNSBLD-HNNXBMFYSA-N 434.492 4.048 10 10 IICE C[C@H]1Cc2ccccc2N1C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 728747850 VFSALWYVIJHWMK-LEWJYISDSA-N 448.611 4.209 10 10 IICE CN(C)c1ccc([C@@H]2C[C@H]2C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742800332 ITWWKDAVAAVBOH-BULFRSBZSA-N 429.511 4.243 10 10 IICE O=C(/C=C\c1ccc(Br)o1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742807305 ZKYRHGMIFTVICS-CHOZFAJLSA-N 441.272 4.442 10 10 IICE CO[C@@H](C)c1nc(C)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 749371150 JXYDPQISVJRRQO-ZDUSSCGKSA-N 425.501 4.159 10 10 IICE Cc1cc(CCNC(=O)N2CCC(OC[C@H]3CCCO3)CC2)c(C)n1-c1ccccc1 751782949 ZWLNMRHXBQEWDR-XMMPIXPASA-N 425.573 4.006 10 10 IICE C[C@@H](NCc1cccc(COC2CCOCC2)c1)c1ccc(N2CCOCC2)c(F)c1 765932100 RIWMJUKIBLCDDU-LJQANCHMSA-N 428.548 4.209 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2nc(-c3ccccc3)no2)c(C)n1-c1cccc(Cl)c1 804122258 AZXRKYDPKVDXCS-FQEVSTJZSA-N 436.899 4.261 10 10 IICE Cc1cc(C(=O)N2CCC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c(C)n1-c1ccccn1 807709941 FDEJZZGOTDYWGQ-VWLOTQADSA-N 438.572 4.352 10 10 IICE CC(C)C(=O)Nc1ccc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 916672340 GVTPICHXLHWLOJ-CALCHBBNSA-N 442.535 4.356 10 10 IICE COCCOc1cc2c(cc1/C=C1\SC(=S)N(c3ccc(C)cc3)C1=O)OCO2 920755848 RZGVNOMMWWRSID-GRSHGNNSSA-N 429.519 4.155 10 10 IICE Cc1cc(CCNC(=O)c2cccnc2I)c(C)n1-c1ccccc1 1161705526 CSPFHPIVZVFURQ-UHFFFAOYSA-N 445.304 4.066 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccccc1OC 1165498300 LOPQMIGYYABOLJ-AUSIDOKSSA-N 444.959 4.450 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(F)c(Br)c1 1167762214 JULZUVTVKBMHSA-HNNXBMFYSA-N 449.364 4.359 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCc2ccc(CNC(=O)OC(C)(C)C)cc2F)c1 1230625556 YASGQKXYNAFURM-AWEZNQCLSA-N 447.507 4.125 10 10 IICE CC[C@]1(c2ccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)cc2)CCC(=O)NC1=O 1292048962 JPFOSIPSYMEIPT-HHHXNRCGSA-N 443.547 4.360 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)c1 1296797517 VOSCAIIPBHLDBX-UHFFFAOYSA-N 435.499 4.266 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ncc(Br)cc3O)cc2Cl)C1 1297010060 LSDQRCQOMSBOOA-LBPRGKRZSA-N 438.753 4.369 10 10 IICE Cc1ccc([C@H](NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)[C@@H](C)S(C)(=O)=O)cc1 1297147341 CQVDHRPFWSPNKR-WZONZLPQSA-N 442.556 4.446 10 10 IICE COc1ccc(N2CCCN([C@@H](C)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1307424485 RXFUMBDYYCEPSY-SFTDATJTSA-N 435.612 4.352 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](C)c3ccc(N4CCNC4=O)cc3)c2C)c1 1312906782 QXLDXSIMYQNLMT-IBGZPJMESA-N 445.567 4.493 10 10 IICE C/C=C/COc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1350761653 RVULEHOOGNTJJT-NSCUHMNNSA-N 448.485 4.356 10 10 IICE Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)cc2)nn1 1355131315 VAXRWTSLLUIEAK-ROUUACIJSA-N 434.515 4.135 10 10 IICE O=C(C[C@H](c1ccccc1)c1ncc[nH]1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444983482 FETGHSSPEYFUAV-WIYYLYMNSA-N 440.494 4.318 10 10 IICE Cc1cc(C(=O)N2CCO[C@]3(CCSC3)C2)c(C)n1-c1ccc(Br)cc1 1452089418 ZHNBFQWRIJFVBF-HXUWFJFHSA-N 435.387 4.205 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C/C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)o1 1466290464 XTRUBZBOBUYKLK-BPOBUFBUSA-N 427.497 4.162 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3Cc3ccnn3C)cc2Cl)C1 1469958487 DQIFVJFDKLHZMZ-PXNSSMCTSA-N 429.996 4.227 10 10 IICE COC(C)(C)c1nsc(NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1472776088 OEOMYASZZJVDCO-MRXNPFEDSA-N 435.594 4.164 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(N(C)C(C)=O)CC1 1514789541 MQXKZDQFMHOLPF-UHFFFAOYSA-N 434.588 4.210 10 10 IICE CCCN1C[C@H](C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)CC1=O 1524673159 QKJOBFBCQBOXKK-QGZVFWFLSA-N 428.554 4.486 10 10 IICE O=C(/C=C\Sc1cc(F)ccc1F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524851556 XZKSZVIEBZUSTI-BAQGIRSFSA-N 426.435 4.002 10 10 IICE COc1ccc([S@@](C)(=O)=NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1535407493 NTUNTIOHGLIXOB-SSEXGKCCSA-N 426.538 4.221 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1535561198 KDVLJOQRAKGTKN-UHFFFAOYSA-N 449.595 4.104 10 10 IICE COc1cc(N)c(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1Br 1543146794 XTAYGSDRLNUIFD-UHFFFAOYSA-N 432.362 4.206 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3c(C)cc(C)cc3C)C2)cc1F 1543248018 RYNUPTIUMLECJJ-HXUWFJFHSA-N 425.548 4.266 10 10 IICE CCC[C@@H]1CCCC[C@@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 1564927238 PJVORPXGTLUWAP-RTBURBONSA-N 433.593 4.151 10 10 IICE Cc1ccc(C(=O)NCc2ccnc(OC3CCOCC3)c2)cc1-n1c(C)cc(C=O)c1C 1565724226 GKJGGQVVERYLOC-UHFFFAOYSA-N 447.535 4.098 10 10 IICE CCC1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)C[C@H](C)C(=O)NC)CC1 1613737071 AKBJVDRZMIOJAP-SFHVURJKSA-N 448.615 4.361 10 10 IICE CCC[C@](C)(NCC(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OCC)C(=O)OC 1615578112 OMPNVYIURRASGO-QHCPKHFHSA-N 446.569 4.160 10 10 IICE Cc1cccc(NC(=O)c2ccccc2NC(=O)CN2CCOc3cc(N(C)C)ccc32)c1 1616891461 CMUDTDWEBWEBRM-UHFFFAOYSA-N 444.535 4.151 10 10 IICE COCC[C@@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1619805884 VCHHPUGLSZOIEO-IBGZPJMESA-N 429.584 4.127 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc2cc(O)c(O)cc2s1 1620752842 BZYOQTMLBJCHBY-CYBMUJFWSA-N 434.464 4.313 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccn4)cc3)cc2F)C[C@@H](C)O1 1625089672 DCMLHCBCGFYTKR-RTBURBONSA-N 449.526 4.343 10 10 IICE Cn1cccc1[C@@H]1CCCN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1628950790 LDDIJABERSBDHY-OWBBTNHHSA-N 443.569 4.119 10 10 IICE O=C(c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1)N1Cc2cccc(O)c2C1 1632708946 IWLJKYYHVSRMBY-UHFFFAOYSA-N 428.897 4.002 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1ccc(OC)c(O)c1 1633328236 ZESCEAPWLGBJLA-HSZRJFAPSA-N 436.508 4.069 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)cc(C)c1N 1635677114 XPUBIRLBZYPNNE-UHFFFAOYSA-N 442.151 4.470 10 10 IICE COc1c(N)c(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc(Cl)c1Br 1638957897 ZTFWAUYMQRGIBQ-JTQLQIEISA-N 426.742 4.250 10 10 IICE CCCc1c(C(=O)NCc2cccc(Br)c2O)cnn1-c1cccc(F)c1 1640084252 PDZCVRQRLKWDNN-UHFFFAOYSA-N 432.293 4.362 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)c2ncnc3c(Cl)cc([N+](=O)[O-])cc23)cc1 1642527796 FZENVQDHGCNDJB-GOSISDBHSA-N 441.919 4.443 10 10 IICE C[C@@H](NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)c1ccccc1O 1642824539 ZSOAVSLTMLLIHS-CQSZACIVSA-N 430.913 4.337 10 10 IICE C[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])c1ccc(N(C)C)cc1 1651762943 HAVCINCEFHRNIX-INIZCTEOSA-N 432.546 4.009 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCCN(Cc3ccccc3)c3ccccc32)cc1 1652801849 FUVWFXQRDUGXRT-UHFFFAOYSA-N 428.580 4.286 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)c1C 1656252943 TYSAANKQXXYEGN-VWLOTQADSA-N 433.483 4.192 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H]3CCN(C(=O)OC(C)(C)C)C3)c2C)c1 1674247258 IUGUUVDDBJYSDN-FQEVSTJZSA-N 426.561 4.211 10 10 IICE Cc1cc(CNC(=O)NCCc2ccc3c(c2)OC(F)(F)O3)c(C)n1-c1ccccc1 1686930708 BERGLHBHVHFTNP-UHFFFAOYSA-N 427.451 4.458 10 10 IICE Cc1cc(CCNC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c(C)n1-c1ccccc1 1687217306 RKBUFJWXILTWEB-UHFFFAOYSA-N 434.496 4.018 10 10 IICE C[C@@H]1N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCOC1(C)C 1708274177 ZGOJKOMXBOLQLC-KRWDZBQOSA-N 429.584 4.268 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1709220957 WODIANOKQBYXHO-XLIONFOSSA-N 434.588 4.114 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncnn1C(C)(C)C 1709912915 KJFIHLXFWGJHTI-UHFFFAOYSA-N 432.576 4.204 10 10 IICE Cc1cccc(-c2nnc(N3C[C@H](C)S[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1724487034 MVYGLGZKEAOLGU-CALCHBBNSA-N 440.592 4.232 10 10 IICE C[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1743084243 RXTVBPSMDFIZEQ-GOSISDBHSA-N 429.584 4.127 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2CCC(C(=O)OC)CC2)cc1 1746090018 LXNZHPGZHFYLPE-UHFFFAOYSA-N 439.604 4.220 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCCN(C(C)(C)C)CC1 1761698100 RCPWQSIVOFSEFJ-UHFFFAOYSA-N 449.647 4.017 10 10 IICE CC[C@H](C)N1C(=O)C(NCc2ccncc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164354 XWJMDDOZMVLRDU-KRWDZBQOSA-N 428.536 4.157 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)cc(F)c2O)[C@@H]2CCC[C@H]21 1925970719 OAJJBPQYELWHOY-CWRNSKLLSA-N 429.330 4.171 10 10 IICE O=C(O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc([N+](=O)[O-])c1O 1951378775 YPMBIDCXILYMMM-HXUWFJFHSA-N 448.431 4.355 10 10 IICE NCc1ccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(F)c1Br 2148937723 ZOTWUZFNMZEIRA-MJGOQNOKSA-N 432.381 4.395 10 10 IICE O=C1NN(c2ccccc2)C(=O)C1=Cc1cc([N+](=O)[O-])ccc1OCc1ccc(Cl)cc1 2294593183 BZDXTLOCRULRDI-UHFFFAOYSA-N 449.850 4.289 10 10 IICE O=C1C(=Cc2ccco2)SC(=S)N1CCC(=O)N1CCCC[C@H]1c1cccnc1 2296331096 PKAJEVRUMGRTJD-KRWDZBQOSA-N 427.551 4.020 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4cccnc4)SC3=NC2=O)c(C)n1Cc1ccccc1 2297468957 LENYWSHTSHUKRW-UHFFFAOYSA-N 440.532 4.216 10 10 IICE CCOc1ccccc1NC(=O)COc1ccc(Cl)cc1C=C1SC(=S)NC1=O 2314488463 XPFCNGONLDFVBX-UHFFFAOYSA-N 448.953 4.245 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3cccc(OC)c3)SC2=S)N(C)C)cc1 2318684213 ULUZAKNTRQBKJN-LJQANCHMSA-N 428.579 4.208 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C2CC2)c(O)c1Br 2352687413 GQYNIUMMIORWMZ-WBVHZDCISA-N 425.367 4.341 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550808 WKGVFLPSQQEGBS-WFXMLNOXSA-N 427.526 4.498 10 10 IICE COc1ccc(N2CCN(CC(=O)N(C)C(c3ccccc3)c3ccccc3)CC2)cc1 68678551 HSQGEJCENFTVKW-UHFFFAOYSA-N 429.564 4.065 10 10 IICE CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OC 98035296 NGGIZIATYFQBTJ-NFECSFHCSA-N 442.562 4.419 10 10 IICE CN(C)c1ccc(/C=C(/C(=O)N2CCC(Cc3ccccc3)CC2)n2ccccc2=O)cc1 101407428 LSHIJLFALJLGCM-QLYXXIJNSA-N 441.575 4.394 10 10 IICE CCCCCCN1C(=O)/C(=C2/SC(=S)N(CCC(=O)OCC)C2=O)c2ccccc21 206838058 IBFRIHCKLPBEIT-VHEBQXMUSA-N 446.594 4.138 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cn(C)nc2-c2ccccc2)C1 436049209 LRZGWHASUCYUED-UHFFFAOYSA-N 441.579 4.125 10 10 IICE CCOc1ccc(O)c(CN[C@H](c2cccc(S(C)(=O)=O)c2)c2cc(F)ccc2F)c1 742384767 MWAGJPMHIJNBKW-HSZRJFAPSA-N 447.503 4.352 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cccc(-c2noc(C3CC3)n2)c1 742580241 BQDSXQBGUAPFCF-UHFFFAOYSA-N 443.551 4.398 10 10 IICE Cc1cccc(CC2CN(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)C2)c1 752962430 RIIRLLZFJOYWQI-UHFFFAOYSA-N 429.511 4.449 10 10 IICE C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 754143816 XEQAZGXVKJHOSR-DAPLNWGVSA-N 427.476 4.067 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cn(C)c2ccccc12 772212208 NSSPIOKZEABKFI-HXUWFJFHSA-N 430.596 4.130 10 10 IICE COc1ccc(O)c(CNC(=O)C(C)(C)[C@@H](O)c2ccc(OCc3ccccc3)cc2)c1 778914898 OECDNRWJYABQOH-DEOSSOPVSA-N 435.520 4.356 10 10 IICE Cn1ccnc1CN1CCC[C@H](NCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1=O 782978003 IKNJMMVTSLYXQD-FQEVSTJZSA-N 426.605 4.002 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C4CC4)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802678974 GLVRPBABJPFSFW-LADGPHEKSA-N 447.583 4.147 10 10 IICE O=C(Nc1ccc(C(=O)NCc2cc(Br)ccc2O)cc1)OCC(F)(F)F 804735488 AZPQZMQYHVSNGE-UHFFFAOYSA-N 447.207 4.196 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c1O 856600025 PRHXAUNPJQDIML-OAQYLSRUSA-N 431.964 4.137 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](Oc4ccc(C5CC5)cn4)C3)ccc21 858074884 LYHUKZIOEXZNOT-JOCHJYFZSA-N 433.552 4.470 10 10 IICE COc1cc(/C=C2\SC(=S)N(CNc3ccc(C)cc3)C2=O)cc(OC)c1OC 1083991805 JUZUXAMNYQZECN-WQRHYEAKSA-N 430.551 4.292 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F 1129661085 FGFBCFDDLGVHBM-DOTOQJQBSA-N 438.877 4.404 10 10 IICE CCOC(=O)Cc1cnc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)s1 1129948577 SGZJQNZQVNHIDH-UHFFFAOYSA-N 431.945 4.491 10 10 IICE O=C(/C=C/c1cnc2ccccc2n1)N(C[C@H]1CCCO1)c1ccc(Br)cn1 1130008424 KHHAWNFNPSKAKE-SYJIQKIWSA-N 439.313 4.013 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C(F)(F)C(F)(F)F)cc3)CC2)c(OC)c1 1132031931 CPVFCGWCYKJWMN-UHFFFAOYSA-N 444.400 4.320 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](N4CCCC4=O)CC3)cc2Cl)C1 1227208506 NOUXDKSDEHTCEK-AZUAARDMSA-N 447.023 4.263 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@@H]1CCC[C@H](OC)C1 1277969459 CGVWMKYOIYADMI-FRGLQRNOSA-N 446.975 4.153 10 10 IICE Cc1cc(CC(=O)N2CSC[C@H]2C(=O)N(C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1290359615 VITWJIURDVRSCM-FQEVSTJZSA-N 434.005 4.058 10 10 IICE CCc1nc(CN(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)cs1 1292734795 OJHQAEAIGMPGCI-HXUWFJFHSA-N 440.617 4.208 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NCc2cccc(Br)c2O)c(Cl)c1 1297439314 GPWKJOOOQWULLU-UHFFFAOYSA-N 427.682 4.307 10 10 IICE CO[C@H](Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1299705838 WAUVQYQXHYWJHD-LJQANCHMSA-N 429.590 4.037 10 10 IICE CC[C@@H](C)N(C)CCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1305609778 FGOGKLWLQOEPBI-OAQYLSRUSA-N 447.631 4.307 10 10 IICE COc1cc(C)c([C@H](C)NC(=O)CN2CCCc3cc(OC(F)F)ccc32)cc1OC 1307536940 HKNGVDYQFLGTKQ-HNNXBMFYSA-N 434.483 4.244 10 10 IICE COc1cccc(C(C)(C)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1350761113 PYMVOGTUWRWKAF-UHFFFAOYSA-N 436.474 4.145 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(Cl)cc3C(F)(F)F)cc2F)C[C@@H](C)O1 1350933271 MAQHCGYFUIAMJZ-TXEJJXNPSA-N 445.844 4.437 10 10 IICE C[C@@H](c1ccccn1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1356590408 PEMZKNXFPCSUHV-RAOBZKRQSA-N 429.542 4.032 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnn(-c3ccccc3)c2N)cc1 1443629575 DEWNRAYPVCBRBC-UHFFFAOYSA-N 441.535 4.376 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H](C[C@@H]1COCCO1)C(F)(F)F 1446799411 FHMVEUOKRQEDEG-AHRSYUTCSA-N 437.458 4.466 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cc(C(F)(F)F)ccc1=O 1446801205 HAVYZHNWNQNWRR-MRXNPFEDSA-N 430.426 4.363 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1448004821 LPMOLWVXNDAYBN-IEBWSBKVSA-N 427.545 4.090 10 10 IICE Cc1cc(Cl)nc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1465324849 JLRIVEVDGBPRBI-GOSISDBHSA-N 432.952 4.105 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCCN(C(=O)OC(C)(C)C)CC3)ccc21 1466953081 IJCYOIJUTFVFOQ-FQEVSTJZSA-N 443.588 4.424 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CCCOc2cc(Cl)ccc21 1469542260 HRGRUDMFYKPUHB-OAQYLSRUSA-N 429.948 4.014 10 10 IICE CC[C@H](NC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)[C@@H](c1ccc(C)cc1)n1cncn1 1470556589 XZKNAHNHVWUTQD-KSNOWIBYSA-N 448.615 4.259 10 10 IICE O=C(NCCNC(c1ccccc1)c1ccccc1)NCc1c(O)ccc2c1CCCC2 1471556243 CKOVHWQPUHGITM-UHFFFAOYSA-N 429.564 4.449 10 10 IICE O=C(NCc1cccc(Br)c1O)NC[C@H]1CCCCN1Cc1ccccc1 1479135901 OWCAKBJQYRRHQH-GOSISDBHSA-N 432.362 4.009 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCOc1ccc(Cl)cn1 1503487237 JNANVUBYUQHLOF-UHFFFAOYSA-N 429.952 4.336 10 10 IICE C[C@H]1CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)CC1(C)C 1512278303 WFNSBBKEFAJACR-INIZCTEOSA-N 448.662 4.025 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnnn1-c1cccc(Cl)c1Cl 1528932291 IAUZJPWHJLLCEH-AWEZNQCLSA-N 432.355 4.310 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(O[C@H]2CC2(F)F)cc1 1533330054 VDGMJPCEOMXEEY-KXBFYZLASA-N 438.421 4.473 10 10 IICE COC(=O)[C@@H](C)[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1534151038 LORZEDUEEAKKEO-GKVSMKOHSA-N 434.536 4.195 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CN(Cc2ccccc2)c2ccccc2)N(C)C)cc1 1537482958 JVWZCIAJIBWDLN-AREMUKBSSA-N 430.596 4.178 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSCc2ccc(Br)cc2)cc1 1538159675 BLXQDTRXXSMMEL-UHFFFAOYSA-N 437.403 4.286 10 10 IICE CCN1CCN(Cc2ccccc2CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 1540774450 DEXHAFVVVIUDIW-UHFFFAOYSA-N 444.623 4.470 10 10 IICE CN1CCCc2cc(CNC(=O)[C@]3(c4ccccc4)CCN(C(=O)OC(C)(C)C)C3)ccc21 1544164389 HSEBLNUYPQIEOC-HHHXNRCGSA-N 449.595 4.264 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)c1 1544818230 ILJNEMPWXUUOPZ-UHFFFAOYSA-N 435.568 4.017 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1COc2ccc(Cl)cc2C1 1545632838 WZKRIWXQLHBOEE-QFBILLFUSA-N 435.351 4.031 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-c2ccc(Cl)s2)on1 1556945945 DADVUPOKCSOZCE-UHFFFAOYSA-N 439.871 4.101 10 10 IICE Cn1c(C(=O)N2Cc3cccc(O)c3C2)ccc1[C@H]1CCCCN1C(=O)OC(C)(C)C 1558035314 GECNBKOOVKDEPT-LJQANCHMSA-N 425.529 4.349 10 10 IICE C[C@@H](NC(=O)NC(C)(C)COc1ncccc1Br)c1ccc(N(C)C)cc1 1564598008 XCFDMBPFOOKIHT-CQSZACIVSA-N 435.366 4.128 10 10 IICE O=C(NCC1(c2c(F)cccc2F)CCC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1564931120 NHEITNYTDBCRRX-SFHVURJKSA-N 430.495 4.483 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)N(c4ccccc4[C@H](C)CC)C3)CC2)cc1 1566560476 FVFDFABJXWBZLZ-NHCUHLMSSA-N 449.595 4.301 10 10 IICE Cc1cccc(Oc2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)nc2)c1 1596683441 BIXLWVDYLQMYBL-UHFFFAOYSA-N 439.462 4.227 10 10 IICE Cc1cc(CNC(=O)OC(C)(C)C)oc1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1597088772 AMZHQKXIFMUXNW-GOSISDBHSA-N 444.528 4.140 10 10 IICE CCOCc1nnc(N(C)[C@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1616668159 DMGUMFCDJZZYNU-KNQAVFIVSA-N 443.661 4.431 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCn3ncc(Br)c3C2)c1 1618486193 PHNXDZCQNDYMEI-UHFFFAOYSA-N 433.737 4.363 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1620254333 FSMICHGEHLJCLX-HZPDHXFCSA-N 439.676 4.490 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cccc(Cl)c4)CC(C)C3)CC2)c(OC)c1 1623764273 LTPYJFFMAXSPAT-UHFFFAOYSA-N 428.960 4.374 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCN2CCN(c3ccccc3)CC2)c1 1624222207 KRULQBSEJLKKDZ-UHFFFAOYSA-N 436.987 4.300 10 10 IICE C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1 1625848205 ZFHNMCZWIIPFRI-PMACEKPBSA-N 449.595 4.167 10 10 IICE COc1ccc(N2CCCN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)CC2)cc1 1630713527 OKXFUFWJURAXGI-HXUWFJFHSA-N 433.593 4.063 10 10 IICE O=C(N[C@@H]1CCc2ncc(Br)n2C1)N(Cc1ccccc1O)C1CCCCC1 1639046153 BSIAWLQRFVNPKF-MRXNPFEDSA-N 447.377 4.211 10 10 IICE CCN(CC(=O)Nc1ccccc1C(=O)NCc1ccccc1)c1ccc(OC)c(OC)c1 1642236467 WRYMXIYLMDWZRX-UHFFFAOYSA-N 447.535 4.099 10 10 IICE C[C@@H](NC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCCC3)c1ccccc1O 1648890082 YXOSDESSWYVIFE-CYBMUJFWSA-N 443.594 4.482 10 10 IICE CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccc(Cl)c(F)c1 1653167012 NRGLSKVZPFLZTC-UHFFFAOYSA-N 436.870 4.325 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N[C@H](C)c2cc(OC)ccc2O)sc2c1CCCC2 1653961808 XRPZYLOZTOFTGI-ZIAGYGMSSA-N 446.569 4.196 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCCNC(=O)c3ccccc3)cc2Cl)C1 1671669489 RZUUNEZFGAUBST-SFHVURJKSA-N 442.991 4.196 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3Cc4cc(Br)ccc4C[C@H]3C)C2)cc1 1682646602 UQWUJVYWOOKYRZ-DNVCBOLYSA-N 444.373 4.193 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1 1683046830 URZNGKKVNQPLNE-QHAWAJNXSA-N 444.620 4.320 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1696700138 RLQMCSDAIWHNFL-UHFFFAOYSA-N 438.582 4.321 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCC[C@@H](C(F)F)C2)cc1 1710026328 DISTWABMHLOANR-RTBURBONSA-N 433.547 4.158 10 10 IICE CCCCCn1cc(Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)c(C)n1 1728019718 TXBHLWJSJHGPTO-UHFFFAOYSA-N 445.571 4.426 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2noc3c2COCC3)n1Cc1ccc(N(C)C)cc1C 1763824015 WYKVMIIUVANKNN-QGZVFWFLSA-N 438.576 4.053 10 10 IICE CCOCc1nnc(N(C)[C@@H](C)C2CCCCC2)n1Cc1ccc(N2CCOCC2)cc1 1766250247 RLFWTSZPEYZUAQ-FQEVSTJZSA-N 441.620 4.105 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)C[C@@H]2CCOC2)cc1 1766614238 NEFNCCHEPZWICK-NRFANRHFSA-N 439.629 4.298 10 10 IICE COc1cc(C(=O)Nc2cccc(C(=O)Nc3cccc(N(C)C)c3)c2)cc(OC)c1OC 1859118963 RSHUNZLJYSFCMC-UHFFFAOYSA-N 449.507 4.283 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cc(Cl)cc(Br)c3O)[C@H]2C1 1965931895 KNSKGXFSJCCLNL-WHOFXGATSA-N 431.758 4.153 10 10 IICE Cc1nn(Cc2cc(Br)ccc2O)c(I)c1C1(C)CC1 2079590024 ABCBNQKIVDUCAV-UHFFFAOYSA-N 447.114 4.364 10 10 IICE CCOC(=O)c1c(C)nn([C@@H](c2ccc(OC)cc2O)C(C)(C)C)c1Br 2079957062 MQJBCUIXOMUWMV-INIZCTEOSA-N 425.323 4.480 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2[N+](=O)[O-])SC1=S 2314769547 RUJKSDAELJNXIB-KRWDZBQOSA-N 428.491 4.100 10 10 IICE Cc1ccc(CNC[C@@H](NC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2327797229 SNOZHGBBFUYMCI-LLVKDONJSA-N 427.261 4.008 10 10 IICE COc1cc(C=C2C(=O)N(Cc3ccc(F)cc3)N=C2C(F)(F)F)cc(OC)c1OC 2332114876 APAQMLOSTARLMH-UHFFFAOYSA-N 438.377 4.196 10 10 IICE COc1ccc(OCC(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1 9569184 BYQCTOJYJCRQOD-AREMUKBSSA-N 445.563 4.060 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccc(C)cc3)C2=O)ccc1O 15045878 WWQGSXDXEFRNCE-VCRXTVNUSA-N 442.562 4.328 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3cn(CCOc4ccccc4C)c4ccccc34)C(=N)N2O1 20236022 CHXAUDRYORUSKR-YUIYYNKLSA-N 426.476 4.479 10 10 IICE C=CCN1C(=O)/C(=C/c2c(NC3CCC(C)CC3)nc3ccccn3c2=O)SC1=S 33507169 CNDAFOJJILBZRT-LGMDPLHJSA-N 440.594 4.072 10 10 IICE CN1C(=O)/C(=C2\SC(=S)N(C3CCCCC3)C2=O)c2cc(Br)ccc21 40845329 REXDOHBBFMARDF-PFONDFGASA-N 437.384 4.330 10 10 IICE Cc1cc(/C=C2\C(=O)N(Cc3ccccc3Cl)C(=O)N=C2O)c(C)n1C[C@@H]1CCCO1 59109292 NMUWFIJAOXMKFK-FUDBJYBQSA-N 441.915 4.440 10 10 IICE Cc1ccc(NC(=O)CN2C(=O)N/C(=C\c3cc(C)n(-c4ccccc4F)c3C)C2=O)cc1 96585826 BAXRLUHLDCRVCH-BKUYFWCQSA-N 446.482 4.073 10 10 IICE O=C1N=C(Nc2cc(C(=O)O)cc(C(=O)O)c2)S/C1=C\C(Cl)=C/c1ccccc1 208341522 AWPYOZVRHVRVIY-ZDWAMTLGSA-N 428.853 4.288 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3OC)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526405467 DJJKQBGLAXGKLL-HSZRJFAPSA-N 449.459 4.181 10 10 IICE Cc1sc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])nc1-c1c(F)cc(F)cc1F 729110684 ZJRFOGZDLYUJBG-UHFFFAOYSA-N 429.401 4.245 10 10 IICE CCn1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccccc3C)c2C)c(=O)c2ccccc21 735727446 LLKYWPYXMYBEBX-UHFFFAOYSA-N 443.503 4.172 10 10 IICE C/C=C\c1ccc(OCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 742805565 LRBLALASPCGZPH-LKIHTYOGSA-N 446.494 4.494 10 10 IICE COc1cccc(F)c1[C@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 743554466 FTZUUDYEPZLZGT-JYJNAYRXSA-N 433.499 4.147 10 10 IICE COc1ccc(N2CCC(NC(=O)Nc3ccc([S@](=O)C(F)(F)F)cc3)CC2)cc1 750617524 KMIMZSIVMBEMEK-PMERELPUSA-N 441.475 4.113 10 10 IICE Cc1ccccc1-n1nccc1[C@H]1OCC[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 753206025 FOZMWDXSYDANLM-CPJSRVTESA-N 431.536 4.159 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COc2ccccc21 754880641 MSBAFMVCYDCOFJ-YRNRMSPPSA-N 431.483 4.121 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C)ccc21 762600658 ZTIGQYXIFSFFLC-HRAATJIYSA-N 443.588 4.280 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CC=C(c4ccc(Cl)nc4)CC3)CC2)cc1 774192196 KCDUBSOWUYWMFC-UHFFFAOYSA-N 426.948 4.211 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cnc(-c4ccc(F)c(F)c4)s3)CC2)cc1 779899363 JRZBNTFAOMLLNO-UHFFFAOYSA-N 429.492 4.496 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CCC(F)(c4ccccc4C(F)(F)F)CC3)cc2N1 798405408 XNGOBTYIWFJSKB-UHFFFAOYSA-N 439.365 4.410 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@H]1CCN(c2cc(OC)cc(OC)c2)C1 802236741 QVZCYDCEEXJAMR-LJQANCHMSA-N 441.572 4.248 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)N(C)C)cc1 1134686583 OZLBNRSDSYYGDK-QFIPXVFZSA-N 440.588 4.157 10 10 IICE C[C@@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1134686729 UGHSPYZJNSPGSW-KKSFZXQISA-N 437.506 4.249 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1=Cc2ccccc2O[C@@H]1C(F)F 1137440442 VRNVOWYOKSHXKA-UTKZUKDTSA-N 448.897 4.236 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CN(Cc3ccccc3)CC[C@@H]2CO)c1C 1150369400 VEMZTPVSGCHATC-ILBGXUMGSA-N 431.580 4.015 10 10 IICE O=C(N[C@@H](C(=O)NCc1ccc2cccnc2c1O)c1ccccc1)OCc1ccccc1 1162607313 NFBITSKABOEVCJ-HSZRJFAPSA-N 441.487 4.224 10 10 IICE Cc1cc(C(=O)NCc2ccc3nonc3c2)c(C)n1-c1ccccc1Br 1180156053 WXOUIUXBMWKDGD-UHFFFAOYSA-N 425.286 4.323 10 10 IICE COc1ccc(N2CCN(CCC(=O)Nc3cccc(C(F)(F)F)c3)CC2)cc1F 1192107605 JSFSWVYWSGINNC-UHFFFAOYSA-N 425.426 4.004 10 10 IICE COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1F 1192625992 HTEJFEUNFFFDHZ-HUUCEWRRSA-N 446.478 4.288 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCc2nc(-c3ccccc3F)cs2)N(C)C)cc1 1248169254 SNJWMLNJWAWVKA-OAQYLSRUSA-N 441.576 4.117 10 10 IICE C[C@@H]1CC[C@H](Cn2c(CNC(=O)c3cccs3)nnc2N(C)Cc2ccccc2O)C1 1291057611 KDYXBAVCYSGYOL-SJORKVTESA-N 439.585 4.048 10 10 IICE CC[C@@H](C)CN(CC)c1nnc([C@@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1291755505 YYYQVYZSWKHKAI-DENIHFKCSA-N 425.621 4.475 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc3ccncc23)NC(=O)OC(C)(C)C)cc1 1293793944 UKCRASCJRIMYJO-JOCHJYFZSA-N 434.540 4.297 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@H]1CCC=CO1 1298314957 MYYICZZSXNGSKV-QFIPXVFZSA-N 439.604 4.032 10 10 IICE CC(C)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1305031132 BFADROZDEQTUMA-FQEVSTJZSA-N 425.621 4.285 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 1305069482 GZQPLZPYQYKNST-UHFFFAOYSA-N 428.876 4.424 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N2CCC(C)CC2)cc1 1305578697 BCQXWUHZNXMHEB-IBGZPJMESA-N 435.620 4.446 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)CCO1 1305882340 AMAZTVLJNHUNEV-DFBJGRDBSA-N 437.588 4.393 10 10 IICE COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1312833153 FVOITCZUQASGTN-ZHRRBRCNSA-N 445.510 4.103 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3ccc(Br)c(C)c3)C2)cc1 1312835122 GYUGPNYTAOOXFR-KRWDZBQOSA-N 432.362 4.092 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC[C@H](C(F)(F)F)C1 1361098566 VVOAAIZGMOSDLY-PKOBYXMFSA-N 437.510 4.331 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1nn(-c2ccc(Cl)cc2)c2c1CCCCC2 1445935471 AVDURHIFUHSSSB-UHFFFAOYSA-N 425.916 4.178 10 10 IICE O=C(NC[C@H](O)c1cccc(OCc2ccccc2)c1)c1cc2cc(O)c(O)cc2s1 1465869085 QPDFQFHOFMHMJI-NRFANRHFSA-N 435.501 4.355 10 10 IICE COc1ccc(OC)c([C@H](O)CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1465901937 OLTBCLXWUITJHM-OAQYLSRUSA-N 428.916 4.228 10 10 IICE C[C@H](CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(C(F)(F)F)cc1 1469819904 XHTFPCNNCQTZPY-IERDGZPVSA-N 436.522 4.477 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCO[C@@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1470774123 WBDBGWCKRQVYTF-WIYYLYMNSA-N 449.473 4.076 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCCO[C@H]3c3ccc(Cl)cc3)CC2)cc1 1471156610 MOAMRDNAUPGXMW-PKTZIBPZSA-N 443.975 4.491 10 10 IICE COc1ccccc1[C@H](NC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)c1ccccn1 1478363619 GGTRMNZKYRIIPX-CLOONOSVSA-N 432.568 4.484 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1 1478840534 DHPLCUYXHGDLSC-WMZHIEFXSA-N 425.573 4.374 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CC(N)=O)CC1 1499799357 IVMXKLGSEROWDW-UITAMQMPSA-N 446.599 4.411 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(N)=O)CC1 1514197273 TUHQMLSLIZUWPM-UITAMQMPSA-N 432.572 4.021 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)O1 1519283113 OWGCLQKDBBJKHS-KAJMWERUSA-N 444.959 4.000 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC(C)(C)O[C@@](C)(C(F)(F)F)C3)ccc21 1527199765 VXVNNMXCDCSNMA-OAQYLSRUSA-N 426.479 4.477 10 10 IICE COC(=O)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1cc(C)cc(C)c1 1539455679 PEWWLPLAVNRIGE-SANMLTNESA-N 447.579 4.055 10 10 IICE Cc1nc(-c2ccccn2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1544523364 AEMRFRKQLFELDU-HXUWFJFHSA-N 436.581 4.401 10 10 IICE C[C@@H](NC(=O)c1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1O)c1ccccc1O 1557966723 OFBVMFYAFSMXOV-CYBMUJFWSA-N 446.912 4.043 10 10 IICE O=C(C[C@](O)(c1nc2ccccc2s1)C(F)(F)F)NCc1cccc(Cl)c1O 1558756806 CHGCBZSGVFLKEB-KRWDZBQOSA-N 430.835 4.112 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(Cc4cc(F)ccc4F)CC3)C2)cc1 1565055642 HTVFGEOUGGTXQW-FQEVSTJZSA-N 429.511 4.216 10 10 IICE CC1CCN(c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c4cccnc34)cc2)CC1 1565663084 MEHDZGAOFPCTMC-UHFFFAOYSA-N 434.496 4.075 10 10 IICE Cc1cc(C(=O)N2CCN(CCOC(C)C)CC2)c(C)n1-c1ccccc1Br 1566221382 ZNGGXSRQHGZYSX-UHFFFAOYSA-N 448.405 4.039 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N1CCSC[C@H]1C1CC1 1583270357 NZJORSNASLSUHJ-CNYBTUBUSA-N 438.665 4.084 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C(C)(C)C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935368 PEEUJKASVWCAGG-HXUWFJFHSA-N 448.615 4.313 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCC[C@H](OC(C)(C)C)C1 1611964075 LAPJPOVTFMGOQD-QFIPXVFZSA-N 425.621 4.437 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1613554047 RXHDWWKXLWFUNW-OXJNMPFZSA-N 444.599 4.075 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1613998451 RPDQCNYGYRHCHS-NRFANRHFSA-N 442.627 4.186 10 10 IICE CC(C)Oc1ccc(N(C)C(=O)c2c[nH]nc2[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 1616199246 SUEJKRZQVDNKTJ-INIZCTEOSA-N 428.533 4.198 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2c2ccnn2C)c(C)n1-c1ccc(Br)cn1 1617453624 ZZRRSQOLPKZYCW-IBGZPJMESA-N 442.361 4.353 10 10 IICE COCC(C)(C)Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1619568157 VCAYKCHIOLSOCO-OAQYLSRUSA-N 441.620 4.081 10 10 IICE Cc1ccc(C(=O)Nc2ccccc2N2CCN(C)CC2)cc1-n1c(C)cc(C=O)c1C 1623858085 DOLJWLGTIBEQLG-UHFFFAOYSA-N 430.552 4.219 10 10 IICE Cc1ccc(C(=O)NCCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c(O)c1 1626169316 SIAHADKGOHLXKX-QGZVFWFLSA-N 443.975 4.027 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@H](O)c3ccc(OCc4ccccc4)cc3)C2)cc1 1629083180 HOGPGTMLLQKWLI-NVQXNPDNSA-N 446.547 4.093 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cn3c(SC(F)F)nc4ccccc43)C2)cc1 1630614157 JHHCRGSZTNOSPL-OAHLLOKOSA-N 446.523 4.002 10 10 IICE Cc1cc(CC(=O)N[C@H]([C@H]2CCCO2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1631196086 TWXYVAXCIWJQQN-FYYLOGMGSA-N 430.976 4.116 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)C[C@H](C)NC(=O)OC(C)(C)C)c1 1638952483 MKKCFKIGGFSSKT-CVEARBPZSA-N 427.545 4.328 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(c3ccccc3)[C@H](C)C3CC3)cc2F)C[C@@H](C)O1 1644153394 FKDPKOIMHNQVOB-VAMGGRTRSA-N 439.575 4.361 10 10 IICE CCN(C)c1ccc(CN2CCC([C@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)CC2)cc1 1646179095 TWAVKVFKBQKFHI-JTHBVZDNSA-N 431.621 4.427 10 10 IICE COC1CCN(c2ccc(CN(C)C[C@H](O)c3cccc(Br)c3)cc2)CC1 1658989386 OKZLHQSTBBEEDV-QFIPXVFZSA-N 433.390 4.230 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](c1nc(-c2ccncc2)no1)C(C)C 1683421288 LIBDOERTDACGJX-LAUBAEHRSA-N 436.560 4.134 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccccc3)C[C@H](O)c3ccco3)C2)cc1 1683503911 FNFDAIVPGCLGOS-URXFXBBRSA-N 449.551 4.060 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCc4cc(Br)ccc43)C2)cc1 1683504606 YGQWXSFFVHZVEY-YCRPNKLZSA-N 444.373 4.271 10 10 IICE CCOCCN(C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)[C@H]1CCc2ccccc21 1685686442 NOSYEOGETKZHHV-LOSJGSFVSA-N 438.616 4.091 10 10 IICE COCCO[C@H](C)c1nnc(N2CC=CCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1698139354 YRHSCDGWYCZQOG-OAQYLSRUSA-N 439.604 4.053 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CC[C@@H](Oc3ccccn3)C2)nnc1C(C)(C)C 1742141773 OCVPDTJHGSGTOZ-OAQYLSRUSA-N 434.588 4.051 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1nnc(C)s1 1743564793 WOOUKTOAZMZJJV-QGZVFWFLSA-N 439.633 4.431 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1746012677 UDBJURPDGBGEBA-AREMUKBSSA-N 448.615 4.313 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CCC(C)CC2)cc1 1746095188 LNRUYROPPMDBDQ-GMAHTHKFSA-N 441.620 4.133 10 10 IICE COCC(C)(C)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1770712568 USNPRNKFMDJRLJ-QFIPXVFZSA-N 441.620 4.429 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1771433580 LYWBKNDUVPDSBA-RBUKOAKNSA-N 447.624 4.147 10 10 IICE CCOC(=O)c1c(C(C)C)nn([C@@H](C)c2ccc(C)cc2O)c1I 2078977387 KSMFDIRQVYLGOJ-LBPRGKRZSA-N 442.297 4.411 10 10 IICE Oc1cc(Br)ccc1CN[C@@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156292644 ONKLYVHDAQVXPV-FQEVSTJZSA-N 431.374 4.068 10 10 IICE CC(C)(C)OC(=O)NC1(c2csc(=NCc3cccc(Br)c3O)[nH]2)CC1 2224315681 WENBNWRZFJIMQD-UHFFFAOYSA-N 440.363 4.159 10 10 IICE Cc1c(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)c2ccccc2n1C 2294095290 NYLJWPNINXLXOG-UHFFFAOYSA-N 428.275 4.460 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1 2296398171 YHQBNCJKHSSODT-UHFFFAOYSA-N 431.404 4.084 10 10 IICE Cc1ccc(C=C2SC(=S)N(CCC(=O)Nc3nnc(CC(C)C)s3)C2=O)cc1 2296882426 UPPGAFNSAZAINS-UHFFFAOYSA-N 446.623 4.275 10 10 IICE COc1cccc2ccc(C=C3SC(=S)N(c4ccc(C(=O)O)c(O)c4)C3=O)nc12 2297500977 ZAXTWEZJSHMDAQ-UHFFFAOYSA-N 438.486 4.053 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 2297535079 OQCWSRBXJWOSEO-UHFFFAOYSA-N 428.535 4.030 10 10 IICE CCOC(=O)c1ccc(N2N=C(C)C(=CNc3c(C)nn(-c4ccccc4)c3C)C2=O)cc1 2313548190 OHYMPUFLQZNKKG-UHFFFAOYSA-N 443.507 4.384 10 10 IICE Cc1ccc(CNC(=O)CC[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380748314 CXKYITVNCRINNX-CTYIDZIISA-N 441.366 4.163 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@@H](C)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2381136030 ZLQCEQBWBDBPJQ-AWEZNQCLSA-N 443.382 4.457 10 10 IICE CC[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381147460 RKHAAOMCUZKPEP-CJNGLKHVSA-N 441.366 4.115 10 10 IICE CCN(CC)c1ccc(CN(C(=O)CC(C)(C)C)C(C)C)c(OS(=O)(=O)CC)c1 6710977 WLWRTGOBRBEYSD-UHFFFAOYSA-N 426.623 4.435 10 10 IICE COc1cc(/C=C2\N=C(c3ccccc3)N(c3ccc(N(C)C(C)=O)cc3)C2=O)ccc1O 33304421 DJQXMDJJOTUQEY-JCMHNJIXSA-N 441.487 4.218 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1\C(=O)N(c2cc(C)cc(C)c2)C(=S)N=C1O 33313587 YQSGGMFIXOWMTI-SXGWCWSVSA-N 426.494 4.001 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCOC[C@@H]3Cc3c[nH]c4ccccc34)ccc21 669516398 KKEQOWMYKWHGAK-QFIPXVFZSA-N 445.563 4.470 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1ccc(N3CC=CC3)cc1)O[C@@H](C)C2 740915405 PPVICHVWXNVLKW-JWNTYJGQSA-N 433.552 4.140 10 10 IICE COC(=O)Cc1sc(NS(=O)(=O)c2cccc(C(C)C)c2)nc1-c1ccccc1 743046983 UGZQYNZXOBCZFE-UHFFFAOYSA-N 430.551 4.450 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3c(F)cc(Br)cc3F)CC2)cc1 743214102 BAWZTDKUMZKENQ-UHFFFAOYSA-N 426.261 4.090 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(-c4nc(=O)cc(C)[nH]4)cc3)c2C)cc1 751372767 MEMUPYRKSDGXKE-UHFFFAOYSA-N 428.492 4.414 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H](c1ccc(F)cc1)C(F)(F)F 792501721 OJOLXFHOFNIXQN-GOSISDBHSA-N 427.467 4.482 10 10 IICE C[C@H](Oc1ccc(F)cc1)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCO1 812264443 JCDFQRJPEODEEJ-JXFKEZNVSA-N 426.492 4.078 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(CN4CCCCC4)cc3)cc2F)C[C@@H](C)O1 1125258125 DWJWBBMWBFQPDF-BGYRXZFFSA-N 439.575 4.355 10 10 IICE C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126658589 TVLNYZOPZIBNCN-VQIMIIECSA-N 430.495 4.329 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1noc2c1CCCC2 1134903381 HSMJGCRORJVRBS-RVDMUPIBSA-N 433.580 4.235 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc3c(s2)CCN(C(=O)OC(C)(C)C)C3)cc1F 1142565918 PGBWGRLYRSBXMB-UHFFFAOYSA-N 433.549 4.176 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(Cc4ccccc4OC)CC3)c2C)cc1 1143651513 YFNJVOAZYWXWAN-UHFFFAOYSA-N 433.552 4.069 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc3c(cc2O)CCCC3)c1 1144735192 APESIGLLIKLFMD-UHFFFAOYSA-N 429.520 4.015 10 10 IICE Cc1cc(C)n2nc(C)c(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)c2n1 1155726406 GTGRGIWWFGYEFP-AWEZNQCLSA-N 425.964 4.474 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3sc4cc(F)ccc4c3C)CC2)cc1 1156700399 OJZANGDTGKUWQN-UHFFFAOYSA-N 441.572 4.300 10 10 IICE CN(CCCC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)C(=O)OC(C)(C)C 1300092921 UZFMHNUXXDVQFS-UHFFFAOYSA-N 431.499 4.291 10 10 IICE CC[C@H]1c2ccc(OC)c(OC)c2CCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 1307158737 SIGBBVPPBJGWNA-DBEXCURXSA-N 426.469 4.312 10 10 IICE CC(=O)c1c(C)cc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1C 1311168150 UKQQAQCBAHQCSM-UHFFFAOYSA-N 434.584 4.360 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1312883689 DZEHMOKJKSOXCH-WMZHIEFXSA-N 425.573 4.088 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1314420466 PXXIUIVAXUIDDB-KRWDZBQOSA-N 444.630 4.232 10 10 IICE CC(C)Cc1nnc(N2CCCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359841013 YOOZFMJJEWIWHE-UHFFFAOYSA-N 425.621 4.114 10 10 IICE CC[C@@H](C(=O)OC)N(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1360192204 PRWWUTRGLCJUPU-QHCPKHFHSA-N 447.579 4.393 10 10 IICE C[C@@H](Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)N(C)C(=O)OC(C)(C)C 1360571256 SREKDXGVCBEAII-KRWDZBQOSA-N 445.608 4.464 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2c(Cl)n[nH]c2C2CC2)NC(=O)OC(C)(C)C)cc1 1444516060 XZRHFXJUAGWNSS-INIZCTEOSA-N 447.967 4.002 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCSC12CCCCC2 1449238539 KTZCSPMOQCSCOK-UHFFFAOYSA-N 438.596 4.104 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1449702096 NRDNXPWCCHOVJP-LSDHHAIUSA-N 446.569 4.422 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](C)[C@@H]1CNC(=O)OC(C)(C)C 1470556402 UFFXMBIDWYMNNS-LZNRXBQRSA-N 446.636 4.327 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cc1 1473250549 MGIQVRADRXDMSY-DEOSSOPVSA-N 443.591 4.387 10 10 IICE CCC[C@@H]1C[C@H]1n1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)CC(N)=O 1501353178 UTMUXVFGSZLWRA-ZWDAVXSWSA-N 434.588 4.414 10 10 IICE COCCO[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(Cl)s1 1504943630 NEVJUFPQQZQJLV-CQSZACIVSA-N 436.965 4.107 10 10 IICE CC(C)[C@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1509072228 QPDCKDIHDICBEO-OAQYLSRUSA-N 440.592 4.171 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1524657065 KGOZHGMSYNPOKV-UHFFFAOYSA-N 425.554 4.377 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-c2ccccn2)ccc1Cl 1524851157 FWWHEXKJMRDKTI-UHFFFAOYSA-N 443.881 4.447 10 10 IICE O=C(COc1ccc(C(F)(F)F)cc1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1539582094 OSHJFVMUUWBJDM-OAHLLOKOSA-N 444.400 4.471 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(CCc2ccccc2)ccc1O 1543233105 DEUDUCVZVVRSHF-UHFFFAOYSA-N 434.511 4.083 10 10 IICE CCOC(=O)c1ccn(-c2cccc(CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)c2)n1 1543698016 JLGDSRWMSQJYKP-UHFFFAOYSA-N 442.519 4.387 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CCC1(F)CCC1 1554160317 WAAJLVYFBBYJFN-UHFFFAOYSA-N 429.584 4.331 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3ccccc3cc2NC(=O)C2CC2)N(C)C)cc1 1558723127 IFTAEDOJKWYTNA-VWLOTQADSA-N 444.579 4.287 10 10 IICE Cc1cc(CN2CC[C@]3(C2)CN(C(=O)OC(C)(C)C)CCO3)ccc1N1CCCCC1 1560142281 OZUGGIQFQVAJDA-VWLOTQADSA-N 429.605 4.197 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc2n(n1)C[C@H](C)N(C(=O)OC(C)(C)C)C2 1568137611 YZMDSGPTIPJNOG-KRWDZBQOSA-N 442.560 4.170 10 10 IICE O=C(C[C@H](c1ccccc1)C(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1584515349 PFLFDTWXAJLJOL-MRXNPFEDSA-N 428.401 4.154 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sccc3-n3c(C)ccc3C)cc2F)CC1 1585403621 JCHYMRVDOZUKGL-UHFFFAOYSA-N 440.588 4.367 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3C[C@H]3c3ccc(Br)cc3)C2)cc1 1585665307 QDTRSHBPUZTLFC-ONGXBYRLSA-N 429.358 4.204 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCN(C(=O)OC(C)(C)C)C3(C)C)ccc21 1597413328 AEPJCMFJLSWQPN-NRFANRHFSA-N 443.588 4.422 10 10 IICE CCCCN1CCCC[C@H]1Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O 1614540874 YGHUHEZEMVBGDQ-RBBKRZOGSA-N 427.593 4.126 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1Cc1sccc1Br 1617940690 JXZBLTMEABCQOK-UHFFFAOYSA-N 433.375 4.445 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2c[nH]c3ccc(Br)cc3c2=O)cc1 1625014609 PYWTUIALGOXOPJ-UHFFFAOYSA-N 428.330 4.067 10 10 IICE CCc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnn1-c1ccccc1 1631426143 YDMSRTLGBKNIMK-IBGZPJMESA-N 438.959 4.188 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2ccc3cccnc3c2O)[C@H]1c1ccc(Cl)c(Cl)c1 1638573406 VVBWRMNTPIIMRY-MGPUTAFESA-N 444.318 4.083 10 10 IICE Cc1cc(C(=O)NCc2nc(C(F)F)no2)c(C)n1-c1cccc(Br)c1 1638589200 DNSWBTOQLKMDID-UHFFFAOYSA-N 425.233 4.107 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)C[C@@H]3CCN3C(=O)OC(C)(C)C)c2C)cc1 1639246417 MDYPGGVQOUZATC-IBGZPJMESA-N 427.545 4.184 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc(-c3nnnn3C(C)C)c2)cc1 1642358500 KYRMKQVWOOUKNK-UHFFFAOYSA-N 442.523 4.322 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CCCOc3cc(Cl)ccc32)N(C)C)cc1 1679471158 MNUOMMMPGVKYFH-SFTDATJTSA-N 430.980 4.222 10 10 IICE COC(=O)c1ccc2c(c1)[C@H](CNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)CCC2 1683252947 AYDNOVJECIKZPQ-GCJKJVERSA-N 437.584 4.198 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(C3CCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1694130187 RBCWWBIKCYLCGK-GOSISDBHSA-N 428.600 4.110 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCCC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1724199329 UQBXVYAZMALECD-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCS[C@@H](C)C2)cc1 1728383141 SEIXUNKJTIDZPI-RXVVDRJESA-N 429.634 4.356 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCN(C(C)=O)C1 1728384692 BGYCCBUXFUGCIV-QFIPXVFZSA-N 448.615 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CC(C)(C)O[C@@]3(CCOC3)C2)cc1 1746086066 ICLFQTQECBWSAB-VWLOTQADSA-N 441.620 4.070 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CC2)nnc1N1CCC[C@H](OCC(F)(F)F)C1 1751433366 XRHXXFWRMYPTEO-IBGZPJMESA-N 437.510 4.126 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CC[C@@H]1CCCCO1 1767111645 ACCJLBNSFGJJIS-SFHVURJKSA-N 427.936 4.295 10 10 IICE CO[C@H]1CCN(c2nnc(-c3ccccc3Cl)n2CCCSc2nccs2)C1 1770290034 FDYFVEFFSRWNCG-AWEZNQCLSA-N 436.006 4.463 10 10 IICE CO[C@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1770604863 KUYCADAGCGSUFS-QHCPKHFHSA-N 425.621 4.376 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@H](C)C1 1771022436 NKPBCJYHPZGRMJ-WOJBJXKFSA-N 437.588 4.393 10 10 IICE COc1ccc(N2CCN(C(=O)CC3(N4Cc5ccccc5C4=O)CCCCC3)CC2)cc1 1860217483 UOCFEJHUFJYNLP-UHFFFAOYSA-N 447.579 4.093 10 10 IICE C[C@H](CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1)C(=O)c1cccc(F)c1 1866036883 UVUSCEYJHJLTDK-NTKDMRAZSA-N 439.575 4.444 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@H](N)c1ccc2c(c1)CCCN2C 2044759499 YYQLBADGRBIYMC-LADGPHEKSA-N 438.616 4.094 10 10 IICE CN(C)c1ccc(C=C2S[C@@]3(C(=O)Nc4ccccc43)N(c3ccc(O)cc3)C2=O)cc1 2297515789 JSOFTMXDNWGVIX-VWLOTQADSA-N 443.528 4.384 10 10 IICE Cc1ccc(COc2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)cc2)cc1 2313558261 WTDDFVHEIMGBTL-UHFFFAOYSA-N 430.435 4.380 10 10 IICE CCOc1cc(C=C2SC(=S)N(Nc3ccccc3)C2=O)ccc1OCCC(=O)O 2314936127 VNPNKNPYSFTBBA-UHFFFAOYSA-N 444.534 4.167 10 10 IICE Cc1ccc(CNC(=O)[C@H](CCC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380720704 HROMNNXSVNCKHL-HNNXBMFYSA-N 443.382 4.409 10 10 IICE CC[C@@H](C)[C@H](C(=O)NCc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2380740727 ZHBBGRRQOCHZMD-MLGOLLRUSA-N 443.382 4.361 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)/C2=C\NCc2ccccn2)cc1 13894617 REFYQLXNPRJQQI-CYVLTUHYSA-N 441.516 4.125 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)cc(Cl)c1OC(=O)c1ccccc1 20236649 DJXQZCQXYUXKAZ-WLNNWNTISA-N 437.839 4.018 10 10 IICE O=C1N=C(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)S/C1=C/c1ccccc1Cl 27515480 DVVXKVIIEMGOKE-QGOAFFKASA-N 428.901 4.041 10 10 IICE COc1ccc(OCCCOc2ccc(/C=C3/C(=N)N4C=CSC4=NC3=O)cc2)cc1 27572549 APIAWDURXYXEER-UPRLQIEJSA-N 435.505 4.320 10 10 IICE CCOC(=O)Cc1sc(NS(=O)(=O)c2cc(C)ccc2OC)nc1-c1ccccc1 71556434 MGNOCJJIZRRLPF-UHFFFAOYSA-N 446.550 4.034 10 10 IICE CN1C(=O)/C(=C\c2ccc(OC(=O)c3ccccc3)c(Br)c2)SC1=S 96640306 NWYHLNKLDWYLBE-XNTDXEJSSA-N 434.336 4.499 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@@H]1N[C@@H](CC)c1cc(Br)ccc1O 380974469 WWSASLYMAMJXGM-ONIAQPFYSA-N 443.382 4.266 10 10 IICE Cc1ccc(C2=C(O)C(=O)N(c3ccc4c(c3)OCCO4)[C@@H]2c2ccc(O)c(O)c2)cc1 526158755 KNGCZHLIHUZGEU-HSZRJFAPSA-N 431.444 4.235 10 10 IICE CC1CCC(OC2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)CC2)CC1 731118139 VZUIAWSEQRQYDL-UHFFFAOYSA-N 447.595 4.056 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2cc3ccccc3nc2O)cc1 767351941 BXNYKTRFXNUMED-HSZRJFAPSA-N 433.552 4.147 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3cnccc3C(F)(F)F)sc2C)cc1 785542567 FNXRTGLBIWIIJU-UHFFFAOYSA-N 429.445 4.342 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cc(F)cc(Br)c1F 786483598 BYNSZFZZNFHXBP-UHFFFAOYSA-N 440.288 4.228 10 10 IICE O=C(N[C@H](c1cc(F)ccc1F)C(F)F)N(Cc1ccccc1O)C[C@@H]1CCCO1 788755217 DMNAOLYYDOBTSS-HNAYVOBHSA-N 426.410 4.367 10 10 IICE Cc1cc(C)c(N2CC[C@H](N[C@@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)c(C)c1 788984199 PMCFIIWKFCQGCF-UGKGYDQZSA-N 425.548 4.044 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)c1 1137696083 NTKCUVUASOIKQE-LJQANCHMSA-N 430.552 4.257 10 10 IICE CC(=O)N1C[C@H](C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)Oc2ccccc21 1137816971 WXUVGEQZEJAOAX-IQGLISFBSA-N 430.504 4.296 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3[C@@H]2O)c(C)n1-c1ccccc1Br 1141668193 AFWSASCIFNTKCA-NQIIRXRSSA-N 441.325 4.081 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c(C)n1-c1cccc(Br)c1 1144656695 JAVOBVLJMNOWAW-FQEVSTJZSA-N 448.405 4.039 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](Oc3ncccc3F)C2)cc1 1156847391 XNUOJKCSIQNODN-JOCHJYFZSA-N 435.499 4.053 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@@H]3c3ccc(Cl)cc3)CC2)cc1 1194348964 TUABJLGMUGNHJH-UKILVPOCSA-N 444.019 4.059 10 10 IICE CSC[C@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1302705987 HKITYRVHQSWZAN-OAQYLSRUSA-N 443.661 4.083 10 10 IICE CC(C)CN(c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1303155361 KPZOKUVUHKFCHU-UHFFFAOYSA-N 448.615 4.020 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCC[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 1312313025 CWABLUFSEGLBDH-GMAHTHKFSA-N 438.616 4.074 10 10 IICE COc1ccc(-c2nnc(N3C[C@H](C)O[C@H](C)C3)n2CCCSc2nccs2)cc1 1315401142 KEFMIJJWJGIEIH-IYBDPMFKSA-N 445.614 4.206 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2ccccc2C1 1350309804 KZKCQBSNXHAJGR-CPNJWEJPSA-N 426.538 4.002 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(O[C@H]4CC4(F)F)cc3)cc2F)C[C@@H](C)O1 1350933540 OUYDISXEVUXHNI-PZPWOCDFSA-N 434.458 4.156 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H](C[C@H]2CCCO2)C(F)(F)F)cc1 1352929392 PQHIONUTXRRYPN-CVEARBPZSA-N 426.401 4.391 10 10 IICE CC(C)(C)OC(=O)CCCCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354755445 RMGDIUBIHWXNSI-MRXNPFEDSA-N 426.504 4.275 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](O)c1cc(Cl)cc(Cl)c1 1445879100 DBMJNLBUKQYHSD-HKUYNNGSSA-N 443.758 4.167 10 10 IICE Cn1cc(CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 1445883255 MTZFQNJIZAABGO-FQEVSTJZSA-N 425.960 4.251 10 10 IICE CC(C)(C)N1C(=O)C[C@@H](C(=O)NCc2c(O)cccc2F)[C@@H]1c1ccc(Cl)c(F)c1 1456031029 WCGQLJUTNONNLX-XCLFUZPHSA-N 436.886 4.328 10 10 IICE O=C(COc1ccccc1C(=O)NCc1cccc(Cl)c1O)Nc1ccccc1F 1457038259 PZDVDTJYGFINMG-UHFFFAOYSA-N 428.847 4.132 10 10 IICE CN(C)c1cc(F)cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1461322946 YAHAPUJHNASPSJ-NVMNQCDNSA-N 447.532 4.261 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCc2ccncc2OCCC(C)(C)C)N(C)C)cc1 1470412122 CTBPJGLJZZXPPA-JOCHJYFZSA-N 441.620 4.065 10 10 IICE CCOCc1nnc(N2CCC[C@@](C)(OC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1516543118 MGOCDKKVLIWQAI-RUZDIDTESA-N 441.620 4.105 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(C(=O)OC(C)(C)C)cn2)cc1 1530324816 FABAQYYODGDYOP-UHFFFAOYSA-N 437.462 4.308 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(-n4nccc4C(F)(F)F)c3)C2)cc1 1537109729 QZWSIQWDANONBT-MRXNPFEDSA-N 444.457 4.156 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC[C@H](C[C@H]2CCOC2)C1 1542224353 DUCJGYUDACUELW-NHCUHLMSSA-N 425.621 4.467 10 10 IICE CC(C)(C)OC(=O)[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(C)(C)C 1545632275 HCXXDDGSIPWTBN-PKOBYXMFSA-N 438.996 4.130 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccccc2SCCC(N)=O)cc1 1546339724 QRRCCSCXFJZRDA-UHFFFAOYSA-N 435.549 4.055 10 10 IICE COCCN1C(=O)CCc2cc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)ccc21 1556296684 HJTFQPJUAAYUQS-UHFFFAOYSA-N 445.519 4.085 10 10 IICE Cc1cc(C(=O)NCC(C)(C)C2(O)CCOCC2)c(C)n1-c1cccc(Br)c1 1557091462 MLNGXWRGFJMNTL-UHFFFAOYSA-N 449.389 4.154 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c1 1557429766 QKMXXAFAYISBSC-JOCHJYFZSA-N 437.971 4.244 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC(c4cccc(C(F)(F)F)c4)C3)C2)cc1 1564962504 LWJJRVXWQBNDNZ-MRXNPFEDSA-N 433.474 4.349 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC[C@@H](C)N(C)C(=O)OC(C)(C)C 1565692317 ARGDKTKLFCKCLL-MRXNPFEDSA-N 427.545 4.282 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(Br)c(C)c1N 1566306291 GXAMUGBCFXSNAG-UHFFFAOYSA-N 442.151 4.470 10 10 IICE Nc1c(Cl)c(F)cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1Cl 1566357167 XYRBZLZUSXWTKJ-LBPRGKRZSA-N 446.737 4.468 10 10 IICE COc1ccc(C(=O)N[C@H](C)c2ccccc2O)cc1S(=O)(=O)Nc1ccc(C)cc1 1587444593 KVDSDGWMBPMQML-MRXNPFEDSA-N 440.521 4.001 10 10 IICE CCC(CC)C(=O)N1CCC(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1596759161 VUEOSBGGYMYQIH-UHFFFAOYSA-N 437.584 4.372 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)Nc2ccccn2)nnc1N(CC(C)C)C(C)C 1611962394 KHUGNVQQIVUCOI-UHFFFAOYSA-N 449.603 4.219 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc([C@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1614108831 LCKAFKCJSWFHFJ-SLYNCCJLSA-N 429.609 4.050 10 10 IICE CN(C)c1ccc(Cn2c(N3CCCN(C4CCCC4)CC3)nnc2C(C)(C)C)cc1F 1617667758 TUURCHQOZKAKCJ-UHFFFAOYSA-N 442.627 4.284 10 10 IICE CSc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1Br 1618539831 VKQKDTBBGBLSCK-UHFFFAOYSA-N 449.414 4.310 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnc(-c2c(F)cccc2F)s1 1629964091 VBIUKYTZLPULOU-UHFFFAOYSA-N 447.482 4.119 10 10 IICE Cn1nc2cc(Br)ccc2c1C(=O)N(Cc1ccco1)Cc1ccccc1O 1631143289 KUTPDGORNRWAFK-UHFFFAOYSA-N 440.297 4.477 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(C(F)(F)F)cc1N 1634385349 YXRYCGUWPCKBLY-UHFFFAOYSA-N 437.462 4.290 10 10 IICE COC[C@@H]1CC[C@@H]([C@@H]2COCCN2C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)O1 1635549809 RLMFKILLZCGFPU-HVCNVCAESA-N 440.584 4.253 10 10 IICE CCc1c(Br)cc(C(=O)NCCc2ccc(O)c(O)c2)cc1Br 1636022296 HKHAPMFWBPCMLA-UHFFFAOYSA-N 443.135 4.158 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CSc3nnnn3-c3ccc(O)cc3)c2C)cc1F 1640657977 YDOYIJKGFJJVMK-UHFFFAOYSA-N 437.500 4.198 10 10 IICE Cc1cc(C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c(C)n1-c1ccc(F)cc1 1649368500 RBZARLZCYIHMBB-SANMLTNESA-N 448.586 4.342 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]2C[C@H](C)O)sc(C)c1-c1ccccc1 1649398804 XTEIPUNFFUPIFZ-YJBOKZPZSA-N 430.570 4.074 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3c(Br)cc(C)cc3C2)c([N+](=O)[O-])c1 1651769886 SRMGYBOAJDYUKE-GQCTYLIASA-N 431.286 4.415 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@](C)(C(F)(F)F)C1 1655517786 DXJGXBKKVHZHFA-XMHCIUCPSA-N 430.426 4.063 10 10 IICE CC(C)(C)OC(=O)N1c2ccccc2CC[C@H]1CCNC(=O)NCc1ccccc1O 1683631454 OXAWMUILNGENKP-IBGZPJMESA-N 425.529 4.338 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)Cc2cscn2)cc1 1746090168 OXVBTFGFUDRARO-UHFFFAOYSA-N 433.585 4.328 10 10 IICE CC(C)[C@@H]1OCCC[C@@H]1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1750692076 CBHCCKVWGKXIQH-QPPBQGQZSA-N 435.572 4.057 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CCSCC2)cc1 1766610299 KOFCEDUHRHBQQM-UHFFFAOYSA-N 443.020 4.441 10 10 IICE CCN1C(=O)CCc2cc(-c3nc(NS(=O)(=O)c4ccccc4)sc3C)ccc21 1859572960 UQXYWMKZMJTOSL-UHFFFAOYSA-N 427.551 4.218 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010402516 RJXKHQGNMQJKPG-MOPGFXCFSA-N 431.537 4.036 10 10 IICE CCOC(=O)c1c(C)nn([C@H](CC)c2cc(C)c(C)cc2O)c1I 2079946404 VLDFKGJGGIGXPQ-CQSZACIVSA-N 442.297 4.295 10 10 IICE CCOc1cc(C=C2C(=O)NN(c3ccccc3)C2=O)ccc1OCCc1ccccc1 2297365852 ISBOEWNGAKERGD-UHFFFAOYSA-N 428.488 4.168 10 10 IICE CC1=NN(c2ccccc2)C(=O)C1=Cc1cc(C)c(OCC(=O)O)c(Br)c1 2297556223 SLCCVDGMGAFLNE-UHFFFAOYSA-N 429.270 4.027 10 10 IICE Cc1ccc(CN2CCC(NC(=O)OCc3ccccc3)CC2)c(O)c1Br 2307569495 JJONEIAWVAFFOC-UHFFFAOYSA-N 433.346 4.354 10 10 IICE Cc1ccc(CNC[C@H]2C[C@@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c(O)c1Br 2352670257 HVJYGLWSTYQGHD-OWCLPIDISA-N 425.367 4.341 10 10 IICE Cc1ccc(CNC[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352953014 RINHQHWHPHJZQP-HUUCEWRRSA-N 427.383 4.492 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C(=N)N12 20114681 JNLFBMZVMCNDKX-CXHQGSNTSA-N 427.467 4.185 10 10 IICE C[C@@H](OC(=O)c1cc2ccccc2[nH]1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 22099056 VHTUBTSOEBRQQR-CQSZACIVSA-N 438.439 4.127 10 10 IICE C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)/C(=C/c2cccs2)SC1=S 33581942 DOIQIEBTJCEUTF-FHNWIRHTSA-N 441.603 4.178 10 10 IICE CCOC(=O)c1[nH]c2ccc(OC)cc2c1N=NN1CCN(c2ccc(F)cc2)CC1 254442869 OZAILRBZZNBKLI-UHFFFAOYSA-N 425.464 4.313 10 10 IICE CC1CCN(c2ccc(CNC(=O)NCc3ccc(Cn4ccccc4=O)cc3)cc2)CC1 731048281 GYLAOJQUXQHPRL-UHFFFAOYSA-N 444.579 4.132 10 10 IICE CC(C)[C@@H](C)CNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 739631755 YNBZWLFAEKVAHC-IYVNWDGISA-N 441.416 4.059 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H](C)c3ccc(F)cc3F)cc2F)C[C@@H](C)O1 743555006 OJADPKOVQKOBKY-ARFHVFGLSA-N 435.490 4.320 10 10 IICE CC(=O)N1CCC[C@H]1C(=O)OCC(=O)c1cc(C)n(-c2ccc(Cl)c(Cl)c2)c1C 750430407 UDNDZYXVMCDIBG-IBGZPJMESA-N 437.323 4.138 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@]2(CC=CCC2)C1 751068282 MNFLJNCXASBWCE-NRFANRHFSA-N 432.567 4.217 10 10 IICE Cc1ccc2c(c1)[C@@H](NCc1ccc(N3CCN(c4ncccn4)CC3)c(F)c1)CCCO2 765279318 DGKLRXJDHUCDOW-QHCPKHFHSA-N 447.558 4.254 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(Cc1ccccc1)CC(F)F 769058606 KNHPRQGNAGHRMF-UHFFFAOYSA-N 442.554 4.196 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Br)cc1 770993083 SGVRKOCULQRBBD-HNNXBMFYSA-N 449.364 4.359 10 10 IICE Cc1nc(SC(F)(F)F)sc1CC(=O)NCc1cc(Br)ccc1O 804737471 IZRWSIZKADZHMR-UHFFFAOYSA-N 441.294 4.390 10 10 IICE O=C(NCc1cccc(COCC(F)(F)F)c1)NCc1cc(Br)ccc1O 805224903 DIHCZKRHUFSRMF-UHFFFAOYSA-N 447.251 4.233 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@H](C(=O)Nc4cccc(C)n4)C3)c2C)cc1 919848667 WAURJHMXBCEYDB-FQEVSTJZSA-N 446.551 4.297 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)cc1 1125964886 XNDHKTOLIJZLPK-UHFFFAOYSA-N 433.474 4.211 10 10 IICE CCOC(=O)[C@H](COC)N(C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1)C1CC1 1128080233 MAIFLEDLRFWVDZ-QFIPXVFZSA-N 438.528 4.351 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3cccc(S(=O)(=O)N4CCCC4)c3)c2C)c1 1135581462 YTEPEJUYHOVYMM-UHFFFAOYSA-N 437.565 4.439 10 10 IICE COc1ccccc1OC[C@H](C)CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1137632352 ARPZJLYZQLHDPI-GOSISDBHSA-N 434.536 4.289 10 10 IICE C[C@H](NC(=O)Cc1csc(NC2(C)CCCC2)n1)c1ccc(N2CCOCC2)cc1 1142503973 KYLFTJKRQONCQA-KRWDZBQOSA-N 428.602 4.144 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1 1142617614 RZECNIVQHYHXET-UHFFFAOYSA-N 425.452 4.027 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2[C@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1159439902 GFZPAOOPBWQLPC-RTBURBONSA-N 432.362 4.425 10 10 IICE Cc1cc(C(=O)N[C@H]2Cc3ccccc3NC2=O)c(C)n1-c1ccccc1Br 1170838591 YSFYBLUYOBIJQS-IBGZPJMESA-N 438.325 4.150 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCC[C@@H]2Cc2cnn(C)c2)cc1 1253222427 WWKJWTJTRZBFQG-QPPBQGQZSA-N 435.572 4.202 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1304196484 LHJJRAMZYPQHLR-UHFFFAOYSA-N 425.602 4.067 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@@H]3CCC[C@H](C2)C3O)n1Cc1ccc(N(CC)CC)cc1 1305419147 TVBUXXPEECQMNX-ZTGNMCTISA-N 425.621 4.283 10 10 IICE CC/C=C/Cn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1306490282 IDBZCEFYYMKQJL-FKSNAJQLSA-N 441.576 4.357 10 10 IICE Cc1cc(C(=O)CSC[C@@H]2CC[C@H]3C[C@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1307377239 OBELHTCHJDQKDF-FGTMMUONSA-N 432.611 4.094 10 10 IICE Cc1cc(CCNC(=O)N2CCC(CO)(c3ccccc3)CC2)c(C)n1-c1ccccc1 1313100100 ICMBOLFTWUXHOF-UHFFFAOYSA-N 431.580 4.372 10 10 IICE CC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccccc1OCC(=O)N(C)C 1354575936 SRHKULAJFVAVOI-XMMPIXPASA-N 447.579 4.371 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(OC(F)(F)F)c1 1435571239 BZNZUVYCQVEULX-UHFFFAOYSA-N 433.474 4.047 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc4c(s3)CCCCCC4)cc2)CC1 1439309461 CKWHVICSVFFHNJ-UHFFFAOYSA-N 425.598 4.039 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCC(Cc2ccccc2)CC1 1464259378 IFZPTFMJNJCDGO-NRFANRHFSA-N 437.653 4.199 10 10 IICE Cc1cc(CCNC(=O)c2ccc(NCCn3ccnc3)cc2)c(C)n1-c1ccccc1 1470849533 IMDNGKSQOCIFGU-UHFFFAOYSA-N 427.552 4.375 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCc2ccc(Cl)c(Cl)c2C1 1470905838 XHEULNAEJXCDRY-UHFFFAOYSA-N 434.367 4.222 10 10 IICE CC[C@H](Nc1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1472518661 XNQLFJUCZVHRFP-VXKWHMMOSA-N 440.588 4.325 10 10 IICE Cc1cc([C@@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c(C)o1 1478527931 JAIZZHVEAUYJCG-WNSKOXEYSA-N 433.980 4.493 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](OCC3CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1495597152 GRUKDGDMYLWTQV-PXNSSMCTSA-N 429.584 4.440 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(F)cccc1-n1cccn1 1524059021 TVLNOIXENUJFGG-OAHLLOKOSA-N 430.430 4.012 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Br)c(Cl)c1 1527864665 TZWTYYNJHZIZTA-UHFFFAOYSA-N 445.691 4.147 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(C)nn(Cc3ccc(C)cc3)c2Cl)cc1 1531375408 XGKBBCCYJPKABJ-UHFFFAOYSA-N 440.975 4.419 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nccc3c(Br)cccc23)cc1 1538161009 UKBFBMRBTJWLRR-UHFFFAOYSA-N 428.330 4.214 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cccc3cnccc23)NC(=O)OC(C)(C)C)cc1 1544269534 TTZVRMQYDDSHAP-QHCPKHFHSA-N 448.567 4.226 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@](C)(O)[C@H](C)CC 1545503422 ABEHNBVKCHUIOX-WZOHSFFVSA-N 443.636 4.314 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc2nc(C(F)F)[nH]c12 1545632054 AAVQMKSTFGYWPB-CQSZACIVSA-N 434.874 4.254 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCCOCC3CC3)CC2)cc1 1554959328 LYMNBZHQOTZRLB-UHFFFAOYSA-N 441.620 4.118 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3CCc3ccc(Cl)s3)CC2)cc1F 1554959519 OABAFGNHCBBJDV-UHFFFAOYSA-N 435.956 4.018 10 10 IICE CCOC(=O)[C@@]1(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CCc2ccccc21 1565793287 CSGZGMNPASMNHI-HHHXNRCGSA-N 444.531 4.350 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CN(C)c2nc3ccccc3s2)cc1 1583919359 PSBUCWSKXYRBQB-FQEVSTJZSA-N 438.597 4.006 10 10 IICE COc1c(C)cccc1CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1584979446 GXNWIEKYCOQXSH-SFQUDFHCSA-N 446.619 4.363 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCC1CCN(CC(F)(F)F)CC1 1587574635 RDHWDIFBFQXCBP-UHFFFAOYSA-N 435.490 4.301 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1ccc(Cl)c(Cl)c1 1595436046 QVUHTQLWSLWVBA-XMSQKQJNSA-N 446.378 4.429 10 10 IICE Cn1cc(CN(C(=O)/C=C\c2ccc(Cl)nc2)c2ccc(Br)cc2)cn1 1596434688 RYNRPAHEEOHYCV-OQFOIZHKSA-N 431.721 4.478 10 10 IICE CN1CCN(c2ccc(CNC(=O)C(C)(C)Cc3ccc(Br)cc3)cc2)CC1 1598276677 GJRXQWNLXBCZIK-UHFFFAOYSA-N 444.417 4.086 10 10 IICE Cc1cc(-c2nnc(N3CC[C@](C)(C(N)=O)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1611935859 YBCXKHSELOKEGG-SANMLTNESA-N 448.615 4.491 10 10 IICE Cc1cccc(C(=O)N2CCCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1624130770 OTGYHLYRGKYXSU-UHFFFAOYSA-N 443.547 4.203 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)COC[C@@H](C)c1ccccc1 1626512206 XJQAWYMRLXZXEE-LJQANCHMSA-N 426.557 4.195 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C 1627029366 ZNMJHBCAUBQUPN-UHFFFAOYSA-N 426.538 4.347 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSc2nc(-c3cccc(OC)c3)no2)cc1F 1633258971 FNBRLOONIGEZDB-UHFFFAOYSA-N 444.532 4.139 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H](C)N1CCc2ccccc21 1634385088 RMORAMYTVKXSFQ-LJQANCHMSA-N 437.584 4.216 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)cc1F 1642235536 GGFUSEXZUUTMHF-CYBMUJFWSA-N 426.319 4.290 10 10 IICE C[C@@H](NCC1CCN(C(=O)OCc2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 1653133528 LQOXZAHXRFMVSX-OAQYLSRUSA-N 437.584 4.223 10 10 IICE CC(C)Cc1ncnc(NCc2ccc3c(c2)CCCN3C)c1I 1655035875 HYAGRSOGFUEDRF-UHFFFAOYSA-N 436.341 4.274 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O 1672983621 HCSYEWJZPOISQY-LAUBAEHRSA-N 427.520 4.205 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CCO)c3ccc(Cl)c(Cl)c3)C2)cc1 1683782117 ITJMVBWCXSFOGA-FOIQADDNSA-N 438.355 4.004 10 10 IICE CC(C)CN(CCc1ccc(F)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1685608777 GVQNUJRXQRVZAR-XMMPIXPASA-N 428.596 4.405 10 10 IICE CCN(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1686826804 PWEIUYCZBDSHPH-GHTZIAJQSA-N 432.609 4.033 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3nccc(C(C)C)n3)CC2)c(C)n1-c1ccccc1 1687216673 FSMPITUWOGEXHJ-UHFFFAOYSA-N 446.599 4.082 10 10 IICE C[C@H]1CCN(c2nnc(COc3ccc(F)cc3)n2CCCSc2nccs2)C1 1726626806 DIWMDZWSWAMREN-HNNXBMFYSA-N 433.578 4.481 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(N(C)C)CCSC1 1728273269 XXJSAWQRCGQRHT-XMMPIXPASA-N 438.645 4.246 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cn3ccccc3n2)nnc1N(C)CCC(C)C 1742141718 MEXDHFHYJZSMAD-UHFFFAOYSA-N 445.615 4.422 10 10 IICE CC[C@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1744932894 ZXYFXJQDPNVUMO-UXHICEINSA-N 425.621 4.285 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@](C)(O)C1CCCCC1 1764717436 VPXAJFDGVDOODF-VWLOTQADSA-N 425.621 4.408 10 10 IICE COCCC1(Cn2c(C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCCCC1 1770991340 NXIMWANSFHOZKK-UHFFFAOYSA-N 441.620 4.299 10 10 IICE CN(C)c1ccc([C@H](NC(=O)/C=C/c2ccc(-c3cccnc3)cc2)c2nccn2C)cc1 1866181818 WFYYUTARGZZMMR-UFCYUWOPSA-N 437.547 4.467 10 10 IICE CN(C)c1ccc(C=C2SC(N3CCN(c4cccc(Cl)c4)CC3)=NC2=O)cc1 2053511796 JKBBJCCRWAEVGM-UHFFFAOYSA-N 426.973 4.199 10 10 IICE CC[C@H](NCCCOCCNC(=O)OC(C)(C)C)c1cc(Br)ccc1O 2111840562 HJQZXNXDKFCNBH-INIZCTEOSA-N 431.371 4.127 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCCCCN2C(=O)OC(C)(C)C)c1O 2236054755 MHKFJDGJKADODK-AWEZNQCLSA-N 443.382 4.433 10 10 IICE COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)C1=Cc1ccc(Br)cc1 2294028559 WACCQTDADAICJE-UHFFFAOYSA-N 428.282 4.335 10 10 IICE Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(O)cc1 2296233785 ZPSIRJQUNGELAK-UHFFFAOYSA-N 435.867 4.120 10 10 IICE C[C@H](C(=O)Nc1ccc2oc(=O)ccc2c1)N1C(=O)C(=Cc2cccs2)SC1=S 2296559509 JHZHTICGCAJFBX-LLVKDONJSA-N 442.543 4.083 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)cc1OC 2296664667 VUTRZRBGTZNAGK-UHFFFAOYSA-N 430.507 4.056 10 10 IICE Cc1nn(-c2ccccc2)c(Cl)c1C=C1SC(=S)N(NC(=O)CC(C)C)C1=O 2314716647 BMIQQMLMTFFAAR-UHFFFAOYSA-N 434.974 4.113 10 10 IICE COc1cc(C=C2SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1ccccc1C 2314736508 LXUFSNCISQCTNZ-UHFFFAOYSA-N 443.546 4.259 10 10 IICE Cc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)C23CCC3)c(O)c1Br 2352672209 QJPQRBVUDMXIMX-HNNXBMFYSA-N 425.367 4.485 10 10 IICE CC(C)(C)c1ccc(C(=O)NN2C(=O)/C(=C\c3ccc(C(=O)O)cc3)SC2=S)cc1 13343067 JQZOHQJNDIQVRG-SFQUDFHCSA-N 440.546 4.229 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCC(=O)Nc3ccc(F)cc3)C2=O)ccc1O 15037598 LWPYIKNNLVXPRT-PDGQHHTCSA-N 446.525 4.160 10 10 IICE COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C2\C(=N)N3C=C(C)SC3=NC2=O)c1C 33335041 DQIVLLOVUOIWJI-FYVIMBDTSA-N 437.481 4.178 10 10 IICE COc1cc(/C=C2/SC(Nc3ccc(Cl)c(C(=O)O)c3)=NC2=O)cc(OC)c1OC 33691777 QMWLRUKTKBGSRH-LZYBPNLTSA-N 448.884 4.146 10 10 IICE CCOc1ccc(/C=C2\C(=O)N(c3ccc(Br)cc3)C(=O)N=C2O)cc1OC 59198205 CYIPAOBSLPDQBT-GDNBJRDFSA-N 445.269 4.363 10 10 IICE COc1ccc(OCC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)c(C(N)=O)c1 748032461 ATXYVWNDXSNGMU-UHFFFAOYSA-N 444.434 4.065 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C)c3ccc(Cl)s3)cc2F)C[C@@H](C)O1 754595624 FPHJAUKKNDDKNP-ZNMIVQPWSA-N 439.984 4.121 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3)cc2C(F)(F)F)C[C@@H](C)O1 779515415 WBJSRKZMGCXADS-RNABNYGGSA-N 436.430 4.382 10 10 IICE C[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1cncc(F)c1 782067144 JJPUGBJEPHSMJN-PFSWGADMSA-N 435.571 4.141 10 10 IICE CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C[C@]2(CCOC2)O1 799995235 VMSHSRZWVMGQCR-BOCKYXSRSA-N 435.996 4.056 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2Cl)C1 800719839 ODFZDUUXZZSOLX-SFHVURJKSA-N 447.023 4.120 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1 1125251099 LNFKDJCLUJTXCH-JTHBVZDNSA-N 443.385 4.474 10 10 IICE Cc1ccc(C(=O)Nc2ccc(CN3CCOCC3)cc2)cc1-n1c(C)cc(C=O)c1C 1135767184 ZZVOEFLOKLXJSR-UHFFFAOYSA-N 431.536 4.300 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CCC(F)(F)CC1 1144101035 MDCZANVXFRDPKU-GFCCVEGCSA-N 444.525 4.198 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N(CCN2CCOCC2)CC2CC2)cc1 1148694492 MSTKSWKEEODGJE-UHFFFAOYSA-N 435.572 4.352 10 10 IICE CC1(C)C[C@H](C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc2O1 1150349047 VLZLNZXQQXQOLA-QUCCMNQESA-N 428.960 4.471 10 10 IICE COc1cccc(N(CC(=O)NCc2c(O)ccc3c2CCCC3)C(=O)OC(C)(C)C)c1 1150387509 QOVJGSXWTVOKGG-UHFFFAOYSA-N 440.540 4.338 10 10 IICE Cc1cc(CC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)c(C)n1-c1ccc(Cl)cc1 1154331499 HMAQJCIFYMSTCH-UHFFFAOYSA-N 439.899 4.488 10 10 IICE CCOC(=O)c1ncc(Br)c(N2CC=C(c3c(C)[nH]c4ccccc34)CC2)n1 1185881027 JGFWHDRCGVADJM-UHFFFAOYSA-N 441.329 4.499 10 10 IICE C[C@@H](c1nc2ccccc2s1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229773226 SQUWEDOKFGGYOS-AWEZNQCLSA-N 446.523 4.314 10 10 IICE COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 1253509586 AMEXYMCYRBPGDZ-NRFANRHFSA-N 437.584 4.136 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4cccc(Cl)c4)CCC3)CC2)cc1F 1254355103 KYMRGVUXRGUKDC-UHFFFAOYSA-N 431.939 4.441 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4ccccc4C)c3C(F)(F)F)C2)cc1 1278861479 JIMNPPHWCAJMCB-MRXNPFEDSA-N 444.457 4.217 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2cccs2)n1Cc1ccc(N2CCOCC2)cc1 1291446329 FODZCVVLEQSKOB-GOSISDBHSA-N 425.602 4.374 10 10 IICE O=C(COc1ccccc1C(=O)NCc1ccc2cccnc2c1O)Nc1ccccc1F 1299721169 DOCAIWKYQVBUGM-UHFFFAOYSA-N 445.450 4.027 10 10 IICE Cc1nnc(N2CCC(C(F)(F)F)(C(F)(F)F)C2)n1Cc1ccc2c(c1)CCCN2C 1304816797 QOSAGNVAVBAVRO-UHFFFAOYSA-N 447.427 4.338 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3cccc(Oc4ccccc4)c3)CC2)cc1F 1307574150 NJVYCLUPVGKTKM-UHFFFAOYSA-N 435.499 4.387 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)C[C@@H]2CC=CCC2)cc1 1313674867 LVOPGHXBFZGCBE-HXUWFJFHSA-N 438.620 4.103 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)sc2c1CCCC2 1349326861 FYRSLGVNNYGLGI-CYBMUJFWSA-N 446.956 4.449 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC1(C(F)(F)F)CCC1 1360954813 AYKLMVAJVKNFRZ-ZRDIBKRKSA-N 434.530 4.331 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3ccc(C(C)C)c(C)c3)cc2F)CC1 1435073619 GEWBKIJKDWBGPL-FQEVSTJZSA-N 441.591 4.483 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nnn(Cc4ccc(F)cc4)c3C)c2C)c1 1438304487 QNCDNQJEQZGZJA-UHFFFAOYSA-N 431.515 4.420 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@H](CO)Cc1ccncc1Cl 1458463752 LXXYVUUYYBTBEK-OAHLLOKOSA-N 425.872 4.137 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(Br)cncc3s2)N(C)C)cc1 1463281489 MBHBVNCUQDQKJS-QGZVFWFLSA-N 447.402 4.158 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](c3ccc(F)cc3)N3CCOCC3)c2C)c1 1463831719 WFHSBRCMBPRFEU-VWLOTQADSA-N 435.543 4.345 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1470556539 XEOJDQNUNXYUOK-RUOSDFBUSA-N 444.620 4.079 10 10 IICE CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)N[C@H](C)c3ccccc3O)c2)cc1 1471195370 FPXHBZFZLLOJMD-MRXNPFEDSA-N 440.521 4.083 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)Nc1ccccc1C(=O)c1ccccc1 1473262438 KHWVKWBUDUZERC-QFIPXVFZSA-N 444.531 4.243 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC(C)CC2)n1CCCSc1nccs1 1496818624 CCZVGHNCHLVPQX-UHFFFAOYSA-N 436.651 4.072 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Cl)c(OCC(C)C)c(OC)c3)C2)cc1 1528317225 CILKGDNDYBBVGY-QGZVFWFLSA-N 432.948 4.401 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)cc(N4CCCC4)c3)CC2)cc1 1534017763 NITLACIBWQXSJX-UHFFFAOYSA-N 444.373 4.020 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCc3ccccc3NC(=O)OC(C)(C)C)C2)cc1 1538748026 XKKJTGRGWYVWFR-IBGZPJMESA-N 439.556 4.370 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1C[C@H](C)C(F)(F)[C@H](C)C1 1542226923 NCBLESWBOFSHPT-HDICACEKSA-N 440.542 4.490 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H]2CCOC2)c(C)n1-c1cccc(Br)c1 1558606339 RYTCOHJYUMZTPV-XLIONFOSSA-N 447.373 4.124 10 10 IICE O=C(NCc1c(O)cccc1F)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 1564602473 CQTUIKTWRCLNLO-IBGZPJMESA-N 444.304 4.472 10 10 IICE COc1cc(C[C@@H](CO)CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc(OC)c1 1566387648 RIDLQVYLOWGYOR-OAQYLSRUSA-N 436.552 4.001 10 10 IICE CN(c1ccc(CNC(=O)CN2CC[C@@H](c3ccccc3)NC2=O)cc1)C1CCCCC1 1583698876 BYBVNJHBIMQELA-DEOSSOPVSA-N 434.584 4.228 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)CC1CC1 1583724283 XDUYZOZYLLPOGT-MRXNPFEDSA-N 433.346 4.176 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)c3cccc(C(=O)c4ccccc4)c3)C2)cc1 1585988137 KAONAAVOYQSLAT-WMZHIEFXSA-N 428.532 4.425 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3C[C@H]2O)c(C)n1-c1ccc(Br)cc1 1588308931 ZLEWAQCPPYKLCF-NHCUHLMSSA-N 425.326 4.245 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(OC)cc3OCCC(C)C)CC2)cc1 1596732932 LEGQOCXNJUDNQX-UHFFFAOYSA-N 426.557 4.481 10 10 IICE CC(C)Cc1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCSCC2)cc1 1603342271 UBWFFEPUCRQOCR-UHFFFAOYSA-N 441.567 4.467 10 10 IICE C[C@H]1[C@H](C)CCN1c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N(C)C)c(F)c1 1612838627 SARQRKFFLMMCRS-CABCVRRESA-N 428.943 4.482 10 10 IICE CCc1nnc(N(CC)Cc2ccc(Cl)s2)n1Cc1ccc(N2CCOCC2)cc1 1613936083 XQXUVOHAWYGUFP-UHFFFAOYSA-N 446.020 4.467 10 10 IICE Cc1cc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)ccc1N1CCN(C)CC1 1624918008 UJIPQOSFAGKXIL-UHFFFAOYSA-N 430.552 4.219 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1 1634009522 VADYHWBFDRVZKQ-IBGZPJMESA-N 444.597 4.398 10 10 IICE O=C(CC1CCN(CC(F)(F)F)CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1634753840 SDPOMBMPDAHJHM-MRXNPFEDSA-N 449.464 4.037 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Oc2ccc(Cl)cn2)cc1 1638529817 WXNGMCLKARREGI-UHFFFAOYSA-N 440.883 4.438 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c1 1638870097 YUXMTPPSBWOBRX-UHFFFAOYSA-N 449.502 4.235 10 10 IICE COc1ccc(N(C)CCN(C)Cc2csc(CC(=O)Nc3ccc(C)cc3)n2)cc1 1646621091 RRLMVLLKIFRDFV-UHFFFAOYSA-N 438.597 4.210 10 10 IICE CC(C)(C)OC(=O)N1CCOc2ccccc2[C@H]1C(=O)NCc1cccc(Cl)c1O 1648608865 OQHZWWJTROMYBE-SFHVURJKSA-N 432.904 4.033 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)N(C)C)cc1 1653421826 SQKFDUVRESIUEU-NHCUHLMSSA-N 448.652 4.143 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@]3(C)Cc3ccc(F)cc3)C2)cc1 1683504567 XJHSIBVRQMTZPG-CJFMBICVSA-N 425.548 4.467 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3c[nH]c4cc(F)c(Cl)cc34)CC2)cc1F 1684331425 NQMQFMBTLUFJEO-UHFFFAOYSA-N 448.901 4.182 10 10 IICE CN(Cc1cc(Br)cs1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684608069 ZTJQZOSTSBJPTP-SFHVURJKSA-N 439.423 4.021 10 10 IICE C[C@H](NC(=O)NC[C@]1(C(F)(F)F)CCCN1C(=O)OC(C)(C)C)c1ccccc1O 1685394746 LXMAOUAXVUFHIE-DJJJIMSYSA-N 431.455 4.084 10 10 IICE CCN(c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1695562214 TWUHVTVHXXMDIZ-UHFFFAOYSA-N 436.629 4.100 10 10 IICE Cc1csc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)n1 1707732559 USDLCSMREJWBHP-YLJYHZDGSA-N 441.601 4.352 10 10 IICE C[C@H]1CCC[C@@H](N(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1726519846 AHTFNOKOCKQGRY-JKSUJKDBSA-N 429.619 4.389 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CCc1nc(C(C)(C)C)cs1 1729420814 WRWGZLWRVPSSNU-GOSISDBHSA-N 441.601 4.468 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCC(C)(F)F)CC2)cc1F 1730180437 QAQPUUDOCSLUQE-UHFFFAOYSA-N 425.499 4.095 10 10 IICE CC(C)CN1CCC[C@H](Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1741556059 LRONUWKTQMKYIJ-FQEVSTJZSA-N 434.588 4.050 10 10 IICE Cc1ccoc1Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1742079281 KAVMHIXKNYNHOT-UHFFFAOYSA-N 437.588 4.289 10 10 IICE CS[C@H](C)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750241088 TWAKOYDDRFMDGK-LJQANCHMSA-N 436.629 4.252 10 10 IICE CC(C)c1nc(CCn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)cs1 1750600695 JENAYPGAFPHXLH-SFHVURJKSA-N 441.601 4.337 10 10 IICE Cc1ccc(CN(C)c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)o1 1761775253 VHISEHMAFDDAGW-UHFFFAOYSA-N 441.551 4.038 10 10 IICE CC[C@H](CO)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 1858590227 CQOGKOMEWLHNSJ-XNHPLOEXSA-N 429.563 4.246 10 10 IICE O=C(CNCc1ccc(Cl)c(Cl)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1860718273 IUGWHDOIZVNUDC-UHFFFAOYSA-N 439.298 4.497 10 10 IICE Cc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2C[C@H](C)OCC2(C)C)n1 1868478478 AXSUPPFWRIMHTJ-HNNXBMFYSA-N 442.519 4.308 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@H]1CN(Cc2ccccc2)CC(F)(F)C1 2127793945 BXTBHVNHPCERHP-MRXNPFEDSA-N 429.280 4.293 10 10 IICE CC[C@H](N[C@@H]1CCO[C@@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2154211689 LLAUWAQHBZMPJF-INMHGKMJSA-N 443.382 4.268 10 10 IICE O=C1C(=CN2CCOCC2)SC(=S)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 2313608935 ATCNEYDMGGFHOW-UHFFFAOYSA-N 442.406 4.263 10 10 IICE Cc1ccccc1NC(=O)[C@H](C)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314836537 GLXCJURTHRUXAS-ZDUSSCGKSA-N 427.507 4.132 10 10 IICE CCCCN(CC(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2380787038 PLMMIJCQNFJSJB-UHFFFAOYSA-N 443.382 4.459 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCCCCC4)C3=O)c2C)cc1 8658529 JLJZBYOCKWNNCD-UHFFFAOYSA-N 437.540 4.320 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCn4c(nc5ccccc54)C3)c2)cc1OC 19855283 DSKLGCBUJAOMLQ-UHFFFAOYSA-N 428.492 4.326 10 10 IICE Cc1ccc(COc2ccc(/C=C3\C(=O)N(C)C(=S)N=C3O)cc2Br)cc1 96466422 KIFVNAKTHZZTMB-DHDCSXOGSA-N 445.338 4.433 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@]23CCCC[C@H]2N(CCc2ccccc2)C(=O)CC3)cc1 169755902 SZJOGBATTXYCIP-SHQCIBLASA-N 433.596 4.163 10 10 IICE CN(C)c1ccc(CN2C[C@@H](O)C[C@@H]2c2nc(-c3ccc(C(F)(F)F)cc3)no2)cc1 209367171 XBZOHASLKVUNOC-RBUKOAKNSA-N 432.446 4.129 10 10 IICE CCCCCSc1nc(O)c2[n+](n1)[C@H](c1ccccc1O)N(C(C)=O)c1ccccc1-2 261365536 SZKKYTRLDWWYJV-JOCHJYFZSA-O 437.545 4.038 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)c(Br)c1 705882444 JDAPJTRHTHXLKY-DYQZNNLLSA-N 426.402 4.255 10 10 IICE COc1ccc(O)c(CNC(=O)C2(c3ccc(OCc4ccccc4)cc3)CCOCC2)c1 769531145 VCLVULHPPFKGTI-UHFFFAOYSA-N 447.531 4.344 10 10 IICE C[C@H](NC(=O)c1c(F)ccc(Br)c1F)c1ccc(N2CCOCC2)cc1 782868093 BBMJRHFCPBJBQU-LBPRGKRZSA-N 425.273 4.055 10 10 IICE CCCc1cc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)ccc1Cl 788102163 CZGLKFZOBSUPCA-UHFFFAOYSA-N 432.948 4.281 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@]3(C)[C@@H](C2)C3(Cl)Cl)C1 791191265 FJJXODUYRBPEOX-IFMALSPDSA-N 434.411 4.450 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3ncc(C(F)(F)F)s3)cc2F)C[C@H](C)O1 801751346 OWUSEMGMBVQKGE-QWRGUYRKSA-N 432.443 4.236 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(Br)c2)n1C[C@H]1CCCO1 812307414 RQLAAGRTNZRBQW-GOSISDBHSA-N 443.345 4.229 10 10 IICE COc1ccc2c(CC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)coc2c1 917712286 WLBYIHJKLNYKNE-IYBDPMFKSA-N 426.488 4.053 10 10 IICE O=C(CN1CCC(c2nnc3n2CCC3)CC1)Nc1ccc(N=Nc2ccccc2)cc1 918187095 UDPCCQUVGNFYHW-UHFFFAOYSA-N 429.528 4.458 10 10 IICE Cc1cc(Oc2ccccc2)ccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1125325807 QNNXBLHJQJQYHN-NRFANRHFSA-N 443.547 4.419 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cc1 1139740233 TWQPOUQJVWOVHN-OALUTQOASA-N 446.551 4.096 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)c1 1140930540 SWQNGSMGWWOPOR-VJBWXMMDSA-N 434.540 4.030 10 10 IICE O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1cc(Cl)cc(Cl)c1O 1141737618 BFXYMFJBLZIGJE-UHFFFAOYSA-N 429.303 4.412 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn(-c2ccc(Br)cc2)c1C 1157102059 IGIVRWQCYSYCIH-UHFFFAOYSA-N 435.318 4.065 10 10 IICE CCc1ccc([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1157398973 XEUVAWOBFLVAHP-HXUWFJFHSA-N 442.357 4.277 10 10 IICE CCC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccccc1 1192858454 LFLSOUIPUGYPHD-YDHSSHFGSA-N 427.564 4.187 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCN3CCc4ccccc43)cc2Cl)C1 1235832408 FHMNZKFAEFKYNY-SFHVURJKSA-N 426.992 4.438 10 10 IICE O=C(NCc1c(O)cccc1F)NCc1c(-c2ccc(F)cc2)nc2ccc(F)cn12 1255790454 MGGWHJQZHBZWFO-UHFFFAOYSA-N 426.398 4.124 10 10 IICE Cc1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)nn1C(C)C 1276348901 OGIVFILPMJDCFC-PTNGSMBKSA-N 434.612 4.454 10 10 IICE C[C@H]1COCCN1c1nnc(CCCc2ccccc2)n1CCCSc1nccs1 1291306064 REXITFJTNJKBJM-SFHVURJKSA-N 443.642 4.317 10 10 IICE COC(=O)[C@@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@H]1c1ccc(Br)cc1 1307861418 RPWOECHIFMRPCE-VQTJNVASSA-N 431.374 4.212 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)CC2CCOCC2)cc1 1313681706 WRWDBWNXUJMURL-HSZRJFAPSA-N 441.620 4.277 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CC[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1436972474 QVMZPWOJEWJPBI-VQTJNVASSA-N 445.604 4.065 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Sc1ccc(Cl)cc1 1466399413 PXDUUDMVJDUBHU-GFCCVEGCSA-N 428.337 4.381 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H](CO)Cc3ccncc3Cl)c2C)c1 1467677548 PQGXABZLDLPRHS-IBGZPJMESA-N 425.960 4.340 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccn1 1469179290 GTINDSCHYUFDGQ-OKSBFYSISA-N 429.542 4.080 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C[C@H](C)O1 1494394280 HNBGGEXKXNOJER-HOTGVXAUSA-N 447.605 4.261 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3[C@H]4C[C@H]4CN3C(=O)OC(C)(C)C)cc2Cl)C1 1519549811 FBSFAXZVECZBET-QUJKESNLSA-N 448.007 4.448 10 10 IICE C[C@]1(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC1(Cl)Cl 1525997217 HSRGGIYSNYLQPU-MSGBMKDASA-N 447.384 4.117 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 1539336428 IWRMDUNTTURZPD-HSZRJFAPSA-N 435.568 4.294 10 10 IICE CO[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1Br 1541080370 GSWNFOYSFDJCPW-LJQANCHMSA-N 435.387 4.006 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C)CN2CCCCC2)n1 1542563460 BEGXIGMZFGIKOA-IBGZPJMESA-N 434.588 4.113 10 10 IICE COc1ccc(-c2cncc(C(=O)N3CCN(c4ccc(OC)cc4OC)CC3)c2)c(C)c1 1543632874 RHJNELNKYYRXBM-UHFFFAOYSA-N 447.535 4.045 10 10 IICE CC(C)c1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cn1 1544269032 OVQRDJSXQPRQNQ-OAQYLSRUSA-N 426.561 4.267 10 10 IICE CC[C@@H](C)[C@H](Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C)OC 1545306806 XCZXHLGWBAJMRB-KNQAVFIVSA-N 443.636 4.110 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1C[C@H]1CCCO[C@H]1C(C)(C)C 1554175992 DJLUOXCFTNCKPR-HMXCVIKNSA-N 428.577 4.313 10 10 IICE O=C(Cc1ccc(I)cc1)NCc1cc(Cl)cc(Cl)c1O 1556884604 FSDCROARJOALLB-UHFFFAOYSA-N 436.076 4.163 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)CC2)cc1F 1595482674 PWDXFUHANYPTLO-UHFFFAOYSA-N 443.519 4.168 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(C(C)(C)C)c(Cl)c3)CC2)cc1 1598028284 IHASLPOWLULWAV-UHFFFAOYSA-N 429.992 4.198 10 10 IICE Cc1csc(CNc2cccc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)c2)n1 1625882447 ITOSZPGWHPTFHX-GOSISDBHSA-N 436.581 4.391 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1nn(-c2ccccc2C(F)(F)F)cc1O 1629758574 NHCCRZLWQLWLKW-UHFFFAOYSA-N 430.430 4.127 10 10 IICE Cc1cc(CNC(=O)Cc2csc(SCCN(C)C)n2)c(C)n1-c1ccccc1 1631794872 YKNAOGRBSJPCNB-UHFFFAOYSA-N 428.627 4.063 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCC3(c4ccc(F)cc4Cl)CC3)C2)cc1 1633907305 MXGFTAYMSCXIRS-MRXNPFEDSA-N 431.939 4.345 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc4c3O[C@H](C)C(=O)N4)cc2Cl)C1 1635126155 JJEPHTROOVGNER-HUUCEWRRSA-N 427.932 4.226 10 10 IICE Cc1ccc(C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1635456794 VVADUVLLMDCDMD-AHWVRZQESA-N 446.547 4.180 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nc(C(F)(F)F)n2c1CCCC2 1635676525 FNSKSFGDIBPHSH-UHFFFAOYSA-N 446.267 4.369 10 10 IICE CCC[C@@H](C(=O)OCC)n1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1641094702 PDWGQJQTWKQHQU-NRFANRHFSA-N 436.512 4.260 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N(C)Cc2ccccc2O)sc2c1CC[C@H](C)C2 1657599119 DILOAXKSVSBPOB-LSDHHAIUSA-N 430.570 4.214 10 10 IICE CC(C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(F)c1 1659506852 LDUXJNGSJIIZHB-HDICACEKSA-N 431.527 4.110 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(c2cccc(F)c2)CC1 1681849981 MAMXAJLOJMBDTC-UHFFFAOYSA-N 433.474 4.030 10 10 IICE Cc1cc(-c2nnc(N3CCC(C#N)CC3)n2CCCCCO)c(C)n1-c1ccccc1 1707272937 NIXOXXYAFLOJHQ-UHFFFAOYSA-N 432.572 4.255 10 10 IICE CCO[C@@]1(c2nnc(N3CCC(C)CC3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1710455046 XTQYDMHSZWGBTI-VWLOTQADSA-N 441.620 4.061 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCCOCC(C)C)CC2)cc1 1711865131 JRVHSTYDMMDXLZ-UHFFFAOYSA-N 443.636 4.364 10 10 IICE CC1CCN([C@@H](C)Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CC1 1726591464 FLZXWTFOEIZYLQ-IBGZPJMESA-N 439.629 4.393 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCN1CC 1743727118 YZQQCVRCWLTXPC-IFMALSPDSA-N 440.636 4.001 10 10 IICE O=C(O)[C@@H](Cc1ccc(O)cc1)N1C(=O)/C(=C\c2cccc3ccccc23)SC1=S 1858592559 SNCOKPNDGYYCHC-CVNFFVDQSA-N 435.526 4.443 10 10 IICE CCCOc1cccc(/C=C2/SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)c1 1860073442 FYEWYHPELAZRLT-CAOOACKPSA-N 443.502 4.278 10 10 IICE COc1cc(C(=O)Nc2ccc(C(=O)Nc3cccc(N(C)C)c3)cc2)cc(OC)c1OC 1860879662 IALWFUJQIKQKBY-UHFFFAOYSA-N 449.507 4.283 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3cccnc3)C(=O)N(C3CCCC3)C2=O)cc1 1873163972 GBJDJZOUWMOXME-UHFFFAOYSA-N 440.547 4.301 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCCN(C)C)C(=O)N(C3CCCCC3)C2=O)cc1 1873165536 NDGBFXMKLYSRGV-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CC(C)N(Cc1ccc(N)cc1)c1ncc(I)cc1Br 2189909774 YEVZGQGARUBQKN-UHFFFAOYSA-N 446.130 4.446 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccc4c(c3)OCO4)C2=O)cc1 2296881402 FMVYPNQMOQMKMI-UHFFFAOYSA-N 440.546 4.208 10 10 IICE Cc1ccccc1C=C1SC(=S)N([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 2314837109 OIWLZAGZEMUTRM-CYBMUJFWSA-N 427.507 4.132 10 10 IICE CC(=O)Nc1ccc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)cc1 2321743503 WKVLJNASNJWWEV-UHFFFAOYSA-N 428.564 4.377 10 10 IICE COc1ccc(CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1 5098630 MHSIIGJDALWDMY-AREMUKBSSA-N 429.564 4.224 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@H]2c3ncccc3C(=O)N2c2ccc(Cl)cc2)cc1 65307568 AOHISTNLXQPTST-NRFANRHFSA-N 434.927 4.209 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CCCCCC(=O)OC)C2=O)cc1OCC 206709231 MXPLSKIXLIIUCY-NBVRZTHBSA-N 437.583 4.419 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3cc(OC)ccc3OC)[C@H]2c2ccc(O)c(O)c2)c1 526144356 CFMQEHVBBNNFGP-HSZRJFAPSA-N 449.459 4.181 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC[C@@H](CCNCc2cc(Br)cc(F)c2O)C1 715813147 MGOPGZCXMDOELE-SWLSCSKDSA-N 431.346 4.467 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3ccc(-c4cccnc4)cc3)CC2)cc1F 753939020 FZUAOQKQUWCDAE-GOSISDBHSA-N 434.515 4.489 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc([C@@H]3CCCOC3)c2)c1 766447743 NOJUBAYYANYDNX-HSZRJFAPSA-N 443.547 4.325 10 10 IICE COC(=O)c1ccncc1C(=O)OCC(=O)c1cc(C)n(-c2cccc(SC)c2)c1C 771384323 VSGWHFFESZOQDO-UHFFFAOYSA-N 438.505 4.037 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCN(C[C@H]3CCCCN3C)CC2)cc1 772688115 NZFWPFDYVKCNGI-HSZRJFAPSA-N 448.615 4.410 10 10 IICE C[C@@H](c1ccccc1)N(CC(=O)NCc1cnn(-c2ccccc2)c1)Cc1ccccc1O 776004379 ORSWGZPTMLRSKC-NRFANRHFSA-N 440.547 4.458 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NCc1cc(Br)ccc1O)O[C@H](C)C2 804734487 NKBIJNZDMFPQSR-PZPSRYQVSA-N 446.341 4.297 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)NC(=O)NCc2cc(Br)ccc2O)c(C)c1 807007780 NTDSEQZXUIZYPV-IBGZPJMESA-N 443.345 4.209 10 10 IICE CCOC(=O)c1c(NC(=O)CO[C@@H](C)c2nccn2C)sc(C)c1-c1ccc(F)cc1 808054834 BCINCNUCASHAPY-ZDUSSCGKSA-N 445.516 4.489 10 10 IICE COc1ccccc1-c1ncc(CN[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 813772959 WLZMTJYKGLPMKQ-HXUWFJFHSA-N 438.959 4.265 10 10 IICE Cc1cc(C(=O)COC(=O)[C@H]2CCNC(=O)CC2)c(C)n1-c1ccc(Cl)c(Cl)c1 815419626 ANBLPKZMLOOCID-CQSZACIVSA-N 437.323 4.043 10 10 IICE COC(=O)/C=C/c1ccc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c([N+](=O)[O-])c1 917087286 WNQTTZSARQSLAK-OFVOXDDOSA-N 443.475 4.146 10 10 IICE COc1ccc2c(/C=C3/SC(=S)N(c4ccccc4F)C3=O)c(C(=O)O)[nH]c2c1 1081156749 CFLYAXMXIKOPBK-CXUHLZMHSA-N 428.466 4.420 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@]3(C(=O)OC(C)(C)C)CC=CCC3)cc2F)C[C@@H](C)O1 1125188855 VVLBKDYTOOGWQJ-QJMRKGMQSA-N 446.563 4.124 10 10 IICE CC(C)N(CC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)C(=O)OC(C)(C)C 1125893623 RTUUGWNCVXENEH-UHFFFAOYSA-N 431.499 4.289 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCc3ccc(OCCN(C)C)cc3)c2C)cc1 1136724496 NFLGLRKAJKHGCP-UHFFFAOYSA-N 435.568 4.016 10 10 IICE CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NCc1c(O)ccc2c1CCCC2 1137443347 MFYCOSXFFAZDDC-MHZLTWQESA-N 444.575 4.424 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccccc1CCNC(=O)OC(C)(C)C 1142419094 NCWLRTLQMSHMJK-IBGZPJMESA-N 439.600 4.489 10 10 IICE O=C(N[C@@H](CCO)c1cccc(OC(F)(F)F)c1)c1cc2cc(O)c(O)cc2s1 1143074202 RFKUFHPHRBRXKG-ZDUSSCGKSA-N 427.400 4.065 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCO[C@H](CCc3ccccc3)C2)cc1 1153859692 WDBZTRQCISLLTA-AREMUKBSSA-N 430.548 4.309 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4ccc(F)c(F)c4)CC3)C2)cc1 1252117056 URFCBHYXYABTSO-HXUWFJFHSA-N 443.538 4.464 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1293414414 GWSZEMHUIAMLIU-HXUWFJFHSA-N 434.588 4.210 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCS[C@H](C(C)C)C2)cc1 1295420523 RJHCABHIFFUTDZ-UNMCSNQZSA-N 443.661 4.254 10 10 IICE Cc1cccc(-n2ncc(C(=O)NCc3ccc4cccnc4c3O)c2C(F)(F)F)c1 1299722087 YLQFANOKVOWGOT-UHFFFAOYSA-N 426.398 4.383 10 10 IICE CCS[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307700564 SHXXTUJVZPZNBA-MFMILTCTSA-N 436.577 4.443 10 10 IICE C[C@H](Cc1cccc(F)c1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307830130 XKEYAAUNSPUILH-MRXNPFEDSA-N 430.479 4.103 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2C(F)(F)F)c1O 1308072841 AQYMMMFBWZRYSN-RTBURBONSA-N 426.866 4.401 10 10 IICE CCN(CC(=O)Nc1ccccc1OC)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1351649529 HETSXZWXIURCTI-UHFFFAOYSA-N 449.551 4.025 10 10 IICE Cc1cc(CC(=O)Nc2nc(CN3C[C@H](C)O[C@@H](C)C3)cs2)c(C)n1-c1ccccc1 1357327507 OLOOUYODWBFWDF-ROUUACIJSA-N 438.597 4.341 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1450720822 DKGUTKFOCQCNKL-HZMBPMFUSA-N 433.332 4.076 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1464977399 HAXLSNVCTFRLNX-LJQANCHMSA-N 441.572 4.480 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1 1464987063 CWNWMGCOJZTPLQ-IBGZPJMESA-N 439.556 4.236 10 10 IICE CN1CCCN(C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)c2cc(F)ccc21 1465330139 FAAOFNREIFUACP-UHFFFAOYSA-N 426.492 4.005 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(C(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 1465841012 NINDTRYLPDBXMH-UHFFFAOYSA-N 432.492 4.253 10 10 IICE C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1469492471 VVOYDCQDTGFWJY-GOSISDBHSA-N 444.576 4.218 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)NCc2cccc(Cl)c2O)CC1 1471582993 KAMOMQFUWHJTNP-OAHLLOKOSA-N 425.957 4.272 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1503150021 BETGBAIPTBUFHB-QGZVFWFLSA-N 444.630 4.150 10 10 IICE CCOCCCCn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1503174016 PLPLYMZIDWWIKC-UHFFFAOYSA-N 441.620 4.478 10 10 IICE C[C@H](NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1)c1ccc(N(C)C)cc1 1523638148 AFDPHMUCDZUEIZ-ZCNNSNEGSA-N 437.584 4.412 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cc(Br)c(C)cc3OC)c2)CC1 1523931709 YWYPEYHNLPUSOR-UHFFFAOYSA-N 432.362 4.160 10 10 IICE CC1(c2nccc(NC(=O)CCCN3C(=O)/C(=C\c4cccs4)SC3=S)n2)CC1 1525404615 HJEASDULFCDZAK-WYMLVPIESA-N 444.607 4.210 10 10 IICE C[C@@H](NC(=O)CC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1535557639 CJXINIFYDYMJBP-WOJBJXKFSA-N 445.604 4.128 10 10 IICE Cc1cccc(CN(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)c1 1542191361 UKZUBTIDEKFXAC-UHFFFAOYSA-N 439.614 4.262 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cccn4C)n3CCC=C(C)C)CC2)cc1 1554958482 BYFKCKMXFZROQE-UHFFFAOYSA-N 434.588 4.365 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(CCc2ccccc2)ccc1O 1557115320 SHCWJNCTPGYEFR-UHFFFAOYSA-N 433.504 4.089 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)Cc3cc(Br)cn3C)c2C)cc1 1566411072 VHHMPDHDUONADS-UHFFFAOYSA-N 430.346 4.476 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3[C@@H](CCCN3C)C2)c(C)n1-c1ccccc1Br 1587989989 JPKOGANRWOXUCS-PXNSSMCTSA-N 430.390 4.413 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CCc4cc(Br)ccc43)CC2)cc1 1596732689 GBVFRLUNWRNBHQ-NRFANRHFSA-N 429.358 4.226 10 10 IICE CCC(CC)c1cc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)on1 1613524684 KTRHGRMJKGETEA-OAQYLSRUSA-N 425.533 4.412 10 10 IICE CC[C@@H]1CCC[C@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@@]1(OC(C)C)CCOC1 1614134702 BDXRHQBCGWSQKG-OHUGHZGNSA-N 442.604 4.487 10 10 IICE CCCCCn1cc(Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)c(C)n1 1614478034 TZDZVXKECVLVME-UHFFFAOYSA-N 433.560 4.359 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@](C)(CC)CC(=O)OC)sc(C)c1-c1ccccc1 1616058822 BJJZTANGMAFYRZ-QHCPKHFHSA-N 446.569 4.160 10 10 IICE CCOC(=O)[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1624060551 JPAJRJJJMMTVLV-INIZCTEOSA-N 433.346 4.272 10 10 IICE Cc1ccc(C)c(C2=NO[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)C2)c1 1626106354 NYDTZGQHNWLHPJ-WIOPSUGQSA-N 435.568 4.070 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(C(F)(F)F)c3O)cc2F)C[C@@H](C)O1 1626159318 VWZJVEMEKWMGBW-CHWSQXEVSA-N 426.410 4.094 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC1CCCCC1)C(=O)NCc1ccc(N2CCOCC2)cc1 1626693589 PLEQFPFGGIXNNV-JOCHJYFZSA-N 445.604 4.003 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1 1636771672 QYVKOSCUPKBDJR-JOCHJYFZSA-N 444.453 4.318 10 10 IICE COc1c(C)[nH]cc(CN(C)C(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)c1=O 1641707771 IUJGBQJMNSNQTE-UHFFFAOYSA-N 433.512 4.446 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCc3c(C)nc4c(c(O)nn4C)c3C)c2C)c1 1648612021 UQCNGHUIPUHCTL-UHFFFAOYSA-N 445.567 4.256 10 10 IICE Cc1ccccc1[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CC1 1653026503 DDUDTBPHMMFQKO-LZJCXSABSA-N 439.575 4.105 10 10 IICE CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1F 1654166646 ATXCWSBGGUNRKS-GAKIBJFNSA-N 445.554 4.182 10 10 IICE CC(=O)c1cc(F)cc(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@H](c3ccccc3F)C2)c1O 1658989308 MRGIBZDUHVHMLA-PZJWPPBQSA-N 446.494 4.366 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(-c4ccco4)cc3F)CC2)cc1F 1680813211 PGUUNEQGRUPJFB-UHFFFAOYSA-N 427.451 4.265 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1C[C@H]1C 1694301945 BMZXZGFJDONDCW-QUCCMNQESA-N 438.620 4.089 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1727660693 DPDYOPSEKKOVIG-JTSKRJEESA-N 434.588 4.114 10 10 IICE CC[C@@H](Cn1c([C@H](C)CC)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1744114585 LUIWIFVPRZEQQH-AEFFLSMTSA-N 431.581 4.437 10 10 IICE COCCO[C@@H](C)c1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1749940018 QATPTGOPHSJLDS-ICSRJNTNSA-N 443.636 4.297 10 10 IICE CCC[C@@](C)(O)Cn1c(Nc2cnn(C)c2)nnc1-c1cc(C)n(-c2ccccc2)c1C 1765469573 PXPSFYBXHWWNKH-XMMPIXPASA-N 433.560 4.381 10 10 IICE CCN(CC)CCN1C(=O)C(NC2CCCC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165295 GOIOILOHBHSBSR-UHFFFAOYSA-N 448.611 4.048 10 10 IICE O=C(N[C@]1(c2cccc(F)c2O)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952777029 XXYSIVIKWQCRTK-NLFFAJNJSA-N 433.435 4.370 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010390457 DPKVWSKHRLGYFE-UHOSZYNNSA-N 431.537 4.034 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)C[C@H]2CCCO2)c(Br)c1 2152214440 FCUXXGFFYWEQMH-HXUWFJFHSA-N 433.390 4.371 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](C(=O)OC)c3ccccc3)C2=O)ccc1OC 2314767007 CLTFUXCCOOTLHA-LJQANCHMSA-N 443.546 4.209 10 10 IICE C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S 2314837859 XPZYBIXKJMXWAV-LLVKDONJSA-N 447.925 4.477 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(c3ccccc3F)C2=O)cc1 2321606815 ARXOHIFBXHMXSB-UHFFFAOYSA-N 444.553 4.479 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3)C(=O)C2=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 2332144808 PAZFTRGJGVJTRW-UHFFFAOYSA-N 429.432 4.139 10 10 IICE Cc1ccc(CN[C@H]2CCC23CC(NC(=O)OC(C)(C)C)C3)c(O)c1Br 2352693093 OHNLTQOKYYSRHE-CHWWFWEZSA-N 425.367 4.389 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2ccccc2F)c1C 1053694 IHHLMAHPYOQRDU-XAJRUKRBSA-N 438.499 4.085 10 10 IICE CCN1C(=O)/C(=C2/SC(=S)N(Cc3ccco3)C2=O)c2cc(Br)ccc21 2509058 ILLGGPXKVAGYKF-CCEZHUSRSA-N 449.351 4.180 10 10 IICE Cc1cc(C(=O)Nc2ccccc2CN2CCC[C@@H](C(N)=O)C2)c(C)n1-c1ccccc1F 109890982 VIKOGPUWHFZNOC-HXUWFJFHSA-N 448.542 4.183 10 10 IICE CCC(=O)c1ccc(OCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726566612 WHDUXEKMAORFJM-UHFFFAOYSA-N 432.467 4.045 10 10 IICE CC1CCN(c2ccc(CNC(=O)NCC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 731049532 AJNINYWLLONDDV-OAQYLSRUSA-N 444.620 4.369 10 10 IICE COc1cc2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)[nH]c2cc1OC 735653372 FARJPJRTOFZKSR-UHFFFAOYSA-N 445.466 4.185 10 10 IICE Fc1ccc([C@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c2cnccn2)cc1 753698279 KEQIVFOZVCPNHX-SANMLTNESA-N 431.559 4.027 10 10 IICE C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754660442 GPRHVNXDRUPSCD-FUHWJXTLSA-N 433.499 4.235 10 10 IICE COCCCOc1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 775140025 QYAGGHQZDHZILR-UHFFFAOYSA-N 439.946 4.075 10 10 IICE CC(=O)[C@H](C)CCCCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 783222749 PSLAEILMGXMKSL-WBVHZDCISA-N 449.503 4.118 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1Cl 814319863 CUYPDWDNOWTWAE-UHFFFAOYSA-N 428.838 4.134 10 10 IICE CCN(C)Cc1cc(O[C@H]2CCN(Cc3ccc(N(C)C)cc3C(F)(F)F)C2)ccn1 856551692 XWEZMJJGDQXBQE-NRFANRHFSA-N 436.522 4.271 10 10 IICE CS(=O)(=O)c1ccccc1S(=O)(=O)Nc1nc(-c2ccc3ccccc3c2)cs1 873993147 DYPDIVWLWWLFLG-UHFFFAOYSA-N 444.559 4.168 10 10 IICE COC(=O)[C@H]1CCN(Cc2c(O)ccc3c(=O)c(-c4ccccc4Cl)c(C)oc23)C1 917478715 CCVFEWXNFUTUTR-AWEZNQCLSA-N 427.884 4.122 10 10 IICE CCOc1ccccc1CN(C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918219921 QYOLUJLFQQNYGV-HDICACEKSA-N 429.536 4.180 10 10 IICE CC(=O)c1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1124133687 BGZYASRLYYYRKG-PDGQHHTCSA-N 428.510 4.258 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)NCCc1cccc2cccnc12 1167755326 MFLMSROSENTMIA-UHFFFAOYSA-N 429.442 4.245 10 10 IICE C[C@H](NC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl)c1ccccc1O 1171730616 QQZMBGYIFOAXJV-JTQLQIEISA-N 427.238 4.405 10 10 IICE COc1cccc2c1OCCC[C@@H]2NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1176408809 XZQOWKLHNFHKAP-QHCPKHFHSA-N 432.520 4.488 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1265457571 OJQBGPGKCDRHAA-NRFANRHFSA-N 437.540 4.360 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CCCC2CCCC2)CCOC1 1296546490 REMKYDMHRRQSHV-DEOSSOPVSA-N 428.577 4.243 10 10 IICE COC[C@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1301324757 QJAFBZDGNKDYKN-QFIPXVFZSA-N 425.621 4.234 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)CCC(C)C)nnc1[C@@]1(OC(C)C)CCOC1 1304240314 JSMAOPIQPLHQMA-RUZDIDTESA-N 443.636 4.224 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C23CCC3)C2CC2)cc1 1313013885 XQTLZGOFPFOPGK-NRFANRHFSA-N 442.604 4.359 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1355878932 OSTOHBLIDKTZMH-AVRDEDQJSA-N 431.939 4.160 10 10 IICE Cc1cc(CC(=O)NCCNC(=O)CC2CCCCC2)c(C)n1-c1ccc(Cl)cc1 1357579532 WGGLQDGUTPGCAB-UHFFFAOYSA-N 429.992 4.493 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2Cc2nncn2C)c(C)n1-c1ccccc1 1361045951 PQQFWCRNYHATLZ-UHFFFAOYSA-N 432.576 4.012 10 10 IICE Cc1ccc(C(=O)Nc2ccc(Br)c(I)c2)c(O)c1O 1443125133 ZHAVLTKCWVOAGG-UHFFFAOYSA-N 448.054 4.026 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1 1463775133 GKOGMBUFTPWEGY-JTHBVZDNSA-N 427.976 4.364 10 10 IICE CCn1c(=O)n(CC(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)c2ccccc21 1466399953 ZHUBZKGCTKAKPP-IBGZPJMESA-N 429.520 4.319 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1 1471004846 OZELABTUPSQLIX-IBGZPJMESA-N 430.955 4.500 10 10 IICE CCOc1ccc(C(C)(C)C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OCC 1518368555 ILMGDYYZQUDOQJ-UHFFFAOYSA-N 426.557 4.119 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3cc(OC)ccc3OC(F)F)ccc21 1519092666 SKZNEUINNGDWON-UHFFFAOYSA-N 432.467 4.445 10 10 IICE COCCO[C@H](C)c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)cc1C 1519257872 YHSYCVRVJYYMSF-LJQANCHMSA-N 429.609 4.194 10 10 IICE CN1CCN(c2ccc(CNC(=O)Cc3csc(-c4ccc(Cl)s4)n3)cc2)CC1 1536924116 CKEBNSXOCLCNJL-UHFFFAOYSA-N 447.029 4.136 10 10 IICE CSc1cc(Br)ccc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1539707745 SGOCIXASMJUKBU-SFHVURJKSA-N 436.419 4.270 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(C)(C)c1ccccn1 1541326149 YEGIXWGAMUCSJB-UHFFFAOYSA-N 448.615 4.247 10 10 IICE Cc1ccc(-c2nnc(N3C[C@H](C)S[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1542316275 CBYPYXUEMLDZAA-HOTGVXAUSA-N 429.565 4.430 10 10 IICE CN(C)c1ccc(CNC(=O)c2c(NC(=O)c3ccco3)sc3c2CCC3)cc1F 1542430458 WJZIVSSZGACOIV-UHFFFAOYSA-N 427.501 4.217 10 10 IICE CC(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1543098662 FWQVPRMZGCPKSV-FQEVSTJZSA-N 435.634 4.186 10 10 IICE CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1544721624 UKXRHTITNKGQHC-OPXMRZJTSA-N 427.633 4.209 10 10 IICE COc1ccc(N(CC2CC2)C[C@H](O)c2ccc3c(c2)CN(C(=O)C(F)(F)F)CC3)cc1 1559848107 JVYFAIHXKGWITF-QFIPXVFZSA-N 448.485 4.092 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@H]3C[C@@H](Oc4ccccc4)C3(C)C)C2)cc1 1564962438 KZQOHVGBSCPZNN-VEXUSMLFSA-N 437.584 4.409 10 10 IICE O=C(N[C@@H]1CCCC[C@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O)c1ccccc1 1565099871 GGRQKWJPXNGODN-DHIUTWEWSA-N 447.535 4.438 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2CCCN(C(C)(C)C)C2=O)cc1 1565656188 RWDZEPOFAKNEPY-QHCPKHFHSA-N 437.584 4.332 10 10 IICE CSC[C@@H]1CCCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1569556315 SNTKHNINDXFRAA-QJISPJEISA-N 438.615 4.019 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccccc2S(N)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1569590289 VTIRVVRIFSUKJY-UHFFFAOYSA-N 439.581 4.137 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2c[nH]c3c(Cl)cccc3c2=O)cc1 1583918556 IORGIBXFYASZGQ-GOSISDBHSA-N 439.943 4.069 10 10 IICE COC(=O)[C@H](C)CN(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CC1 1584448454 NXFDPUGRJHMUFX-CYBMUJFWSA-N 433.346 4.270 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@@H](C)C(=O)c3ccc(Cl)cc3)cc2F)CC1 1585404106 SPDBQCBITRZTLA-QGZVFWFLSA-N 445.966 4.146 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Oc2ccc(Cl)cn2)cc1 1585536010 MZUPTHKYBCTWOB-UHFFFAOYSA-N 437.927 4.418 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C\[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 1585698404 OEBQIYGBIVFTFV-FWFZHJKVSA-N 433.568 4.491 10 10 IICE CCN(CC)C(=O)CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC 1615311264 JMIKRBFGVCHFOO-UHFFFAOYSA-N 436.604 4.457 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)c(OC)c1 1623764107 IZRQOPJTCSCICZ-IEBWSBKVSA-N 432.923 4.339 10 10 IICE Cc1cc(C(=O)N[C@@H](CCC(C)(C)C)C(N)=O)c(C)n1-c1cccc(Br)c1 1634166398 VVPZMWYRPROPEL-SFHVURJKSA-N 434.378 4.267 10 10 IICE Cc1cc(CC(=O)Nc2ccc(C3CC(=O)NC(=O)C3)cc2)c(C)n1-c1ccc(Cl)cc1 1636768926 RVBHRSJFJGLEHG-UHFFFAOYSA-N 449.938 4.449 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1 1639522784 VDIOMBPALFRHQF-DEOSSOPVSA-N 428.504 4.272 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)c1 1639700623 ARLZQGWZWLHOJU-IIBYNOLFSA-N 439.556 4.424 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(c3c(C)cc(Br)cc3C)C2)c(O)c1O 1640279056 RZCHJFNIEJBSRX-INIZCTEOSA-N 433.346 4.184 10 10 IICE COC1CCN(c2ccc(CN[C@H]3CCN(C(=O)OC(C)(C)C)C34CCC4)cc2)CC1 1647801222 BSRBAMRMWUHYSN-QFIPXVFZSA-N 429.605 4.324 10 10 IICE C/C(=C\c1ccccc1OC(F)F)CNCc1ccc(N2CCC(C(N)=O)CC2)cc1 1663292484 PFFHVESPWSTKDL-SAPNQHFASA-N 429.511 4.183 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@@H]3CCO[C@@H](c4ccc(F)cc4)C3)C2)cc1 1673822767 HJSPAELTHTWAMA-IHLLOCCUSA-N 441.547 4.222 10 10 IICE C[C@@H](NC(=O)NC[C@](C)(C(=O)OC(C)(C)C)c1ccccc1)c1ccc(N(C)C)cc1 1681778358 ALJCZHBTXVOUBK-CJAUYULYSA-N 425.573 4.412 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)Cc3ccc(F)cc3)cc2Cl)C1 1681828579 UPBXWSXNKPEJOD-OXJNMPFZSA-N 433.955 4.118 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@@H]3C[C@@H](O)c3ccco3)c2C)c1 1683302826 BXOKALVVUDPAFK-XZOQPEGZSA-N 437.540 4.030 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)Cc3cn(C)nc3C(F)(F)F)c2C)c1 1684600049 OJKBCGWFSICRNJ-UHFFFAOYSA-N 433.478 4.496 10 10 IICE Cc1nnc(N2CCC[C@@H](c3noc(C(C)C)n3)C2)n1CCCSc1nccs1 1693494905 KHZADAZDWZLFBY-OAHLLOKOSA-N 433.607 4.116 10 10 IICE CCCCN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1695196460 MSLOENBURLJXMC-UHFFFAOYSA-N 425.602 4.052 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CCC(C)CC2)cc1 1695617666 GQNBDQFNFWYHLF-UHFFFAOYSA-N 447.587 4.056 10 10 IICE CCOCc1nnc(N(C)[C@H]2CC[C@@H](SCC)C2)n1Cc1ccc2c(c1)CCCN2C 1710641437 XGKTYCPHLYJSLC-LEWJYISDSA-N 443.661 4.356 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCS[C@H](C(C)C)C1 1724237345 ZEAQAOSTNAUTKD-QFIPXVFZSA-N 438.645 4.284 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1Cc1nccc(C(F)F)n1 1729420319 MYENGJYTZUZVMO-UHFFFAOYSA-N 428.487 4.129 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C)[C@@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742697355 HWHOCVCGJOWRKA-HKUYNNGSSA-N 435.620 4.045 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCOC1CCCCC1 1763070973 QWKYUOIZVOURFU-UHFFFAOYSA-N 441.620 4.305 10 10 IICE Cc1cc(Br)c(N)c(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1866210601 AUDBMSZLGYXIEP-UHFFFAOYSA-N 435.277 4.367 10 10 IICE O=c1cc(CNc2ccc(Nc3ccccc3)cc2)n(Cc2ccncc2)cc1OCCO 1870790446 ZPACWEYPTRGDLB-UHFFFAOYSA-N 442.519 4.018 10 10 IICE Cc1cc(C)n(CC(C)C)c(=O)c1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874180028 WFTGLTSTKIHDIF-UHFFFAOYSA-N 428.488 4.149 10 10 IICE O=C(NOCCCNCc1c(O)cccc1F)OCC1c2ccccc2-c2ccccc21 1958762602 IQMNURWQQIXGPT-UHFFFAOYSA-N 436.483 4.481 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(CNCc2ccc(Br)cc2O)CC12CCC2 1967859064 ZROJYMVXFKLAEL-HXUWFJFHSA-N 425.367 4.329 10 10 IICE COc1ccc([C@@H](C2CC2)n2nc(C(C)(C)C)c(N)c2I)c(O)c1 2079849356 VZCWSIJWYWNCQG-OAHLLOKOSA-N 441.313 4.081 10 10 IICE CC(C)[C@@H]1[C@H](NCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2126372081 OSSSSTGQLLVFOX-HZPDHXFCSA-N 431.346 4.417 10 10 IICE COCCCN1C(=O)C(=Cc2cc(C)n(-c3ccc(C)cc3C)c2C)C(C(=O)OC)=C1C 2294082117 CIVVLXOLYOVAAF-UHFFFAOYSA-N 436.552 4.420 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)cc1 2294133944 OJCQEFCIVGVPAC-UHFFFAOYSA-N 430.435 4.380 10 10 IICE CCC1=NN2C(=N)C(=Cc3ccccc3OCCOc3ccccc3C)C(=O)N=C2S1 2297306526 SQGRARVLDXSCPQ-UHFFFAOYSA-N 434.521 4.482 10 10 IICE CCOC(=O)COc1ccc(C=C2SC(=S)N(C3CCCCC3)C2=O)cc1OC 2297350562 AOQAJFPKIMYJGO-UHFFFAOYSA-N 435.567 4.171 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3CC[C@H]2CN3C(=O)OC(C)(C)C)c(O)c1Br 2352685899 ZHILCSYFBZRSMX-ARFHVFGLSA-N 425.367 4.341 10 10 IICE O=C(NN1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S)c1cccc(O)c1 16929632 KQZNWNVBRGVOAQ-AUWJEWJLSA-N 425.318 4.245 10 10 IICE O=C1N=C(O)/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)C(=O)N1c1ccc2c(c1)OCO2 33316247 KDTGYMDKPQOJTL-YBEGLDIGSA-N 447.359 4.090 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccc(C(F)(F)F)cc4)c3N)CC2)cc1 40727915 XMTVKGADACQQTL-UHFFFAOYSA-N 444.461 4.156 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@H]3c3nnc4n3CCCCC4)c2C)cc1 106017009 LBSLRDYVPLJWEX-QFIPXVFZSA-N 433.556 4.398 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)ccc1O 210690027 NIQGVQMUCLTAGZ-QGOAFFKASA-N 428.535 4.021 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2CNCc1cc(Br)ccc1O 703955052 NGNMHIQTTAXKNO-HNNXBMFYSA-N 425.367 4.282 10 10 IICE O=C(NCCCSc1nccs1)c1csc(-c2cnn(-c3ccccc3)c2)n1 733972846 NGSFJJLCQGRVDO-UHFFFAOYSA-N 427.580 4.365 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cnn(-c4cccc(C(F)(F)F)c4)c3)CC2)cc1 741398046 YOFCPVSHCXTQEE-UHFFFAOYSA-N 445.445 4.254 10 10 IICE CCOCCOc1ccccc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742797790 GQMOWWGNVPHAPC-KRWDZBQOSA-N 434.483 4.102 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1CN1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761506964 XFXJEPYEBPJQNY-UHFFFAOYSA-N 438.915 4.319 10 10 IICE CCOC(OCC)c1nnc(SCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)n1C 775180303 POFOHLKVCXGAPO-UHFFFAOYSA-N 446.548 4.408 10 10 IICE CC[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)c(Cl)c1O 775513509 KHQGAXSAXXDWKE-QKLQHJQFSA-N 448.394 4.339 10 10 IICE Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 789434516 OWFHADOWMIZTLP-UHFFFAOYSA-N 437.544 4.065 10 10 IICE CN1CCN(c2ccc(CNc3nnc(SCc4ccc(F)cc4)s3)cc2)CC1 790517237 DRPHMXYPDPSLKQ-UHFFFAOYSA-N 429.590 4.333 10 10 IICE C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457207 GPNVUJBMLGDJBN-WZONZLPQSA-N 425.548 4.470 10 10 IICE O=C(Cc1cscc1Br)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 814412975 ZDWOXDNHZXIUJZ-ZDUSSCGKSA-N 445.329 4.440 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)/C=C/c2ccc(Cl)cc2)cc1F 1125465344 VIRYVWUHGYANMF-SNMYMPMCSA-N 443.950 4.256 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)C2)cc1 1131029767 GIJYCAIRJKXIIY-WMZHIEFXSA-N 448.485 4.058 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H](CN(C)C(=O)OC(C)(C)C)C3)cc2)CC1 1190760886 MASOCRBUSRDHLS-OAQYLSRUSA-N 431.621 4.381 10 10 IICE C[C@@H](NC(=O)NC[C@](O)(c1ccccc1Cl)C(F)(F)F)c1ccc(N(C)C)cc1 1234554791 FIQRFJQMVVAHHN-YJYMSZOUSA-N 429.870 4.216 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CSC[C@H]2C(=O)NCCC(C)C)c1 1264970121 NUBKVCHHANWXIT-FQEVSTJZSA-N 434.005 4.425 10 10 IICE CN1CCCc2cc(CNC(=O)[C@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)ccc21 1292207293 SQTPBDKIXKRYEO-QHCPKHFHSA-N 431.502 4.140 10 10 IICE CCN(CC(C)C)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1295274019 YVKQVYNZHIOVEC-UHFFFAOYSA-N 440.636 4.183 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)Cc3cc(Cl)cc4ccccc34)cc2)CC1 1296400441 RMNNYEIKUJPJCR-UHFFFAOYSA-N 435.955 4.021 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCc1nc2cc(Br)ccc2s1 1297562929 SSSQFAHCPKQDSL-UHFFFAOYSA-N 440.359 4.499 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1305388030 HBOMOSUMBJHQAX-SFHVURJKSA-N 425.602 4.374 10 10 IICE Cc1ccc(S(=O)(=O)CCC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1 1350078101 YNHLTCZJGDTCRM-UHFFFAOYSA-N 440.565 4.047 10 10 IICE COc1cc(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1F 1437345363 DVMCMOAZAQKMHX-LICLKQGHSA-N 435.473 4.170 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCCN1Cc1ccc(Cl)cc1 1441631638 OFQRBRVYUFAHAJ-QFIPXVFZSA-N 430.017 4.174 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(Cl)c1 1444662921 MTCOPVHMLOJWHE-UHFFFAOYSA-N 445.947 4.047 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(O[C@@H]2CC2(F)F)cc1 1445879668 FFKLCKXKMARQTH-FXAWDEMLSA-N 436.886 4.226 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(O)c(Cl)c2)NC(=O)OC(C)(C)C)cc1 1465324872 JPPNQJBEWDJHBB-IBGZPJMESA-N 447.963 4.036 10 10 IICE O=C(N[C@@H]1CCCc2c(F)cccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1468553607 HMRKFRRLVHCCPB-GOSISDBHSA-N 446.525 4.201 10 10 IICE COc1cc2c(cc1OC)CCN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)CC2 1470968951 NAGUVOUULCTOGO-UHFFFAOYSA-N 447.579 4.464 10 10 IICE CCN(Cc1c[nH]c2ccccc12)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786726 UEQCDKIHRHYKJP-UHFFFAOYSA-N 428.483 4.014 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1479241085 OUENGBJLIQYUHW-PXDATVDWSA-N 444.620 4.464 10 10 IICE Cc1ccccc1Cc1nnc(N2CCCO[C@@H](C)C2)n1CCCSc1nccs1 1492586032 VOZHXEYCFHWVPT-SFHVURJKSA-N 443.642 4.431 10 10 IICE C[C@@H]1CN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)CC(C)(C)C1 1512437077 HWTQAFHRXBOXIA-HNNXBMFYSA-N 431.635 4.190 10 10 IICE CC(=O)c1cc(F)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1535361755 LQYWIVKKLVJLOY-VCHYOVAHSA-N 446.500 4.397 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(CC)CCCC2)CCOC1 1547866040 JYNWFWRUBJGZQL-XMMPIXPASA-N 428.577 4.243 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1CCCc1nc2c(s1)CCCC2 1548084767 BMIHJDDXCVRYEB-UHFFFAOYSA-N 441.601 4.125 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCCC[C@]3(C)NC(=O)OC(C)(C)C)C2)cc1 1557133382 JXBYQCKOKQVRRM-JYMRHQFYSA-N 445.604 4.111 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2C[C@H](C(=O)OC(C)(C)C)c3ccccc32)c1 1565007493 PLPCKTIHERAGQE-PNHOKKKMSA-N 426.513 4.331 10 10 IICE CCCc1cc(=O)oc2c(CN(CCOC)C[C@H]3CCCN4CCCC[C@@H]34)c(O)ccc12 1565538911 DVXFOPIDPZWHRF-OFNKIYASSA-N 442.600 4.164 10 10 IICE CCc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nnn1Cc1ccc(F)cc1 1595949817 IQFQKXDRRGZPTM-UHFFFAOYSA-N 445.542 4.408 10 10 IICE COc1cc(NC(=O)C(C)(C)C)c(C(=O)NCc2c(O)ccc3ccccc23)cc1OC 1597736669 HZDHVAGJPOHGLE-UHFFFAOYSA-N 436.508 4.477 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1n[nH]c(C)n1 1614486074 QMILSXLCJNNGIO-UHFFFAOYSA-N 432.576 4.258 10 10 IICE CCC[C@@H](C)N1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CC1=O 1616620599 WUXQDJDRTISGPL-CTNGQTDRSA-N 437.584 4.332 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@H]1CCSC1 1617940619 ISDMHYUJQADGLI-YVWKXTFCSA-N 430.618 4.292 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2nc3ccccc3s2)NC(=O)OC(C)(C)C)cc1 1618253471 NXBXXZPEWFPFMG-SFHVURJKSA-N 440.569 4.358 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CCO[C@@H]2CNC(=O)OC(C)(C)C)cc1)C1CCCCC1 1625904864 DEZDQJNHZCGJIA-FCHUYYIVSA-N 445.604 4.002 10 10 IICE Cc1cc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CCCC2)c(C)n1-c1ccccn1 1634251349 NFGJILVUCBQPOV-HXUWFJFHSA-N 426.561 4.302 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(I)c(Cl)c2)c1 1636061249 KVVUIPRMIRGOFI-SECBINFHSA-N 431.657 4.150 10 10 IICE Cc1cc(CCNC(=O)N(C[C@H](O)COc2ccccc2)C(C)C)c(C)n1-c1ccccc1 1637410512 OJMNEVHBGXCQJK-VWLOTQADSA-N 449.595 4.497 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c1 1639700624 ARLZQGWZWLHOJU-KKSFZXQISA-N 439.556 4.424 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3nc(N)sc3C2)c(C)n1-c1ccc(Br)cc1 1640504057 ONLIEBCTWSCJET-AWEZNQCLSA-N 445.386 4.183 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1 1643518687 QKQAHNLGLXVRJW-UHFFFAOYSA-N 428.838 4.095 10 10 IICE Cc1ccccc1OCCCN(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1653182280 SUEZQPKPYHLSKZ-UHFFFAOYSA-N 442.515 4.110 10 10 IICE C[C@@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1681827274 DVZFCKADIDTIGP-QZTJIDSGSA-N 435.012 4.024 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CC(C)(C)OC(C)(C)C2)cc1 1695627635 XNWNHGIHWLSDPV-OAQYLSRUSA-N 441.620 4.418 10 10 IICE C[C@H]1C[C@H](Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CCO1 1707990890 LZUBQNSEVXDDOX-XHYAQGIWSA-N 442.604 4.354 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)N1CCC[C@@H](C)C1 1712655370 KQICPYAGRJXATC-UYAOXDASSA-N 436.604 4.471 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](N3CCCC3)C2)n1CCCSc1nccs1 1743703984 ZLIBKTQLJIFLHF-QZTJIDSGSA-N 434.679 4.495 10 10 IICE CCCCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1 1745537474 OKZZSLSVWCLTEW-UHFFFAOYSA-N 437.588 4.396 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1747310359 QSCBTBSGAXRPIE-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CC(C)c1nnc(N2CCN(c3ccc(O)cc3)CC2)n1CCCSc1nccs1 1760930981 UAEZNLOVLUBHDF-UHFFFAOYSA-N 444.630 4.073 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CCOc1ncccc1Cl 1767113908 YNBHAHLIBNVFME-UHFFFAOYSA-N 441.963 4.480 10 10 IICE CO[C@H](C)c1nc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)cs1 1768002362 NZNBGOBHXXQHPO-OAHLLOKOSA-N 429.590 4.421 10 10 IICE COc1ccc(CNC[C@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)cc1C 2084723330 XABXURSPHUEQIV-QHCPKHFHSA-N 439.600 4.215 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@H](F)CNCc2cc(Br)ccc2O)CC1 2106958414 FIQVOYWTOHYEPZ-MRXNPFEDSA-N 431.346 4.230 10 10 IICE Cc1ccc(CN(C)CC2CN(C(=O)OCc3ccccc3)C2)c(O)c1Br 2307466276 NBDBCNONZLRONL-UHFFFAOYSA-N 433.346 4.164 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)C2=C(C)NC[C@@H]2CCCO2)cc1 2313683388 YWYVEMBZYCRXLA-SFHVURJKSA-N 448.548 4.098 10 10 IICE COc1ccc(CCN2C(=O)C(=CC3=Cc4cccc(OC)c4OC3)SC2=S)cc1 2314450526 BDULHFZAVFBCRO-UHFFFAOYSA-N 439.558 4.467 10 10 IICE CCCN(CCC)C(=O)COc1ccc(C=C2C(=O)N(CCC)N=C2CC)cc1OC 2332139164 BIWFGPOHGKVZLL-UHFFFAOYSA-N 429.561 4.124 10 10 IICE COc1ccc(NC(=O)c2c(C)oc3ccc(O)c(CN(C)C4CCN(C)CC4)c23)cc1 8717864 BMYKPFYRXDRVHZ-UHFFFAOYSA-N 437.540 4.234 10 10 IICE CCN1C(=O)/C(=C\c2cn(CCOc3ccc(OC)cc3)c3ccccc23)C(O)=NC1=S 33387825 JHSJVVFLYOZRRN-ZHZULCJRSA-N 449.532 4.216 10 10 IICE Cc1cc(C(=O)Nc2cccc(CN3CCC(C(N)=O)CC3)c2)c(C)n1-c1ccccc1F 108628341 RATAMGRQBAXDEX-UHFFFAOYSA-N 448.542 4.183 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CNCc1cc(Cl)cc(Br)c1O 723835777 DFASBHUPOPSYJJ-AAEUAGOBSA-N 433.774 4.401 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCOC2)no1 752845686 OIHQMSTVIMDZGB-FQEVSTJZSA-N 446.555 4.322 10 10 IICE O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)N(Cc1ccccc1O)C[C@H]1CCCO1 764764602 ZRYVUPHFOWVFRQ-YADHBBJMSA-N 438.572 4.472 10 10 IICE COC(=O)c1ccc(C)c(NC(=O)C(=O)N(c2ccc(N)cc2)[C@H](C)c2ccccc2)c1 783484508 DMBPQEFQPCKDIY-QGZVFWFLSA-N 431.492 4.097 10 10 IICE OC1CCN(c2ccc(CNc3ccc(-c4nnc(Br)o4)cc3)cc2F)CC1 784571197 IHBLNDIQSHQSDS-UHFFFAOYSA-N 447.308 4.211 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Nc1ccc2ccc(=O)n(C)c2c1 786008740 MRDPTZVJFPZRON-UHFFFAOYSA-N 430.302 4.061 10 10 IICE O=C(CCc1nc(-c2ccc(Cl)cc2)no1)NCc1cc(Br)ccc1O 804734255 GSKLERIGXLFJME-UHFFFAOYSA-N 436.693 4.107 10 10 IICE O=S(=O)(Nc1nc(-c2cc(F)ccc2F)cs1)c1c(Cl)nc2ccccn12 917848039 ZJANDYVRUMXJTF-UHFFFAOYSA-N 426.857 4.190 10 10 IICE CCc1ccc(C(=O)CCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 918140384 MJRIYSJYPZLKCX-HDICACEKSA-N 426.532 4.281 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)cc1 1124951950 MRUOFEIPZZYKLL-QHCPKHFHSA-N 439.462 4.346 10 10 IICE Cc1cc(CC(=O)N2CCNC(=O)[C@@H]2c2cccs2)c(C)n1-c1ccc(Cl)cc1 1126584935 CMAQLZJHRGOPFZ-NRFANRHFSA-N 427.957 4.051 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(Cl)cc2NS(=O)(=O)c2ccccc2)cc1 1135642506 IVNZYKDIRSQNPY-UHFFFAOYSA-N 443.956 4.137 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCc2ccc(N3CCCC3)cc2)cs1 1141538010 GISTUYSRYXKABO-HNNXBMFYSA-N 430.574 4.259 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H](C)CC(=O)c3ccc(F)cc3)cc2F)C[C@@H](C)O1 1141901654 JUFMGSRMOPBJEX-YESZJQIVSA-N 430.495 4.104 10 10 IICE Cc1cc(C(=O)NCc2ccc(-c3nncnn3)cc2)c(C)n1-c1cccc(C(C)C)c1 1144644818 AKKGGJXYKMMDNV-UHFFFAOYSA-N 426.524 4.395 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Br)cn(C3CC3)c2=O)cc1 1290323848 IDAZQWGTJXREJR-UHFFFAOYSA-N 432.362 4.064 10 10 IICE CN(C)c1ccc(CNC(=O)CC[C@H](NC(=O)OCc2ccccc2)C(F)(F)F)cc1 1355879078 QAENNXOLVDAAHZ-IBGZPJMESA-N 437.462 4.006 10 10 IICE CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357641659 WEDMBDAVVLFZDY-DWXRJYCRSA-N 437.559 4.439 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2c3ccoc3CCN2C(=O)OC(C)(C)C)cc1 1357724379 SQEUVILRQQNUIO-OAQYLSRUSA-N 427.545 4.277 10 10 IICE Cc1cc(CC(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)c(C)n1-c1ccc(Cl)cc1 1435519297 KDSHKOMJKITWQW-HSZRJFAPSA-N 444.362 4.460 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1451108617 KJTYFBUKOPDULR-IEBWSBKVSA-N 443.548 4.491 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@@H]1CCCC1(F)F 1460197399 BLYWYNBXRFPTEP-GVIGZQTCSA-N 430.567 4.281 10 10 IICE CC(C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1473271124 SESFDJFTFODWKN-HDICACEKSA-N 431.527 4.110 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C2CCC2)cc1 1473789707 QAWWHOQADYVXSA-BGYRXZFFSA-N 439.575 4.423 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCOCCOC 1499518436 GBOKCINKUGEZMZ-OAQYLSRUSA-N 437.588 4.394 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1occc1CS(=O)(=O)c1ccccc1 1523553521 KDAVDLVUCBPABQ-UHFFFAOYSA-N 438.549 4.126 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(OC(C)C)c1 1526002763 IMOFYPSSKRTMNY-IAGOWNOFSA-N 430.520 4.165 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(Oc4ccccc4OC)cn3)C2)cc1 1529411543 HFCNOYCXJDIOKI-GOSISDBHSA-N 433.508 4.147 10 10 IICE COc1cccc(/C(C)=C\C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1534122978 CBZKJHABOQNHAO-VBKFSLOCSA-N 434.458 4.270 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 1540488045 APOXCTUWWCSCLK-NRFANRHFSA-N 427.589 4.425 10 10 IICE Cc1cc(-c2nnc(N3CCC(C)(C)CC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1542182928 ZDVBKYJLYOCWHM-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CN(CCCCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)C(=O)OC(C)(C)C 1542490620 SWCOJXIYBJMNGV-JOCHJYFZSA-N 447.620 4.297 10 10 IICE Cc1nn(C)c(C)c1[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C(F)(F)F 1545132795 WNDSXXBMOWXDPU-QFIPXVFZSA-N 446.473 4.219 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCOCC4(CCC4)C3)nnc2C(C)(C)C)cc1 1547448097 KCGWZQBCAXNKCK-UHFFFAOYSA-N 425.621 4.477 10 10 IICE COC1CCN(c2ccc(CN(C[C@@H](O)COc3cccc(C)c3)C(C)C)cc2)CC1 1559561769 NWZQEYJWOFFNRE-XMMPIXPASA-N 426.601 4.261 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@H](C(=O)NCCCSc2nccs2)C1 1565620219 MPGPRWXDKPHOBB-QGZVFWFLSA-N 433.599 4.276 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3sc(SC(F)(F)F)nc3C)C2)cc1 1627154493 RTNUZCXDWVCUPG-ZDUSSCGKSA-N 445.532 4.257 10 10 IICE CCn1c(SCC(=O)N(C)Cc2ccc(N3CCCC3)cc2)nnc1-c1cccs1 1628951438 XWROYGRFJDHYOQ-UHFFFAOYSA-N 441.626 4.377 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3[nH]c(-c4cccc(C(F)(F)F)c4)nc3C)C2)cc1 1629084845 VEPIMJAHCJXESQ-KRWDZBQOSA-N 444.457 4.421 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1634218728 JCPBFRMGXQKUGJ-NQIIRXRSSA-N 441.330 4.411 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3-c3ccccc3C)cc2)CC1 1638587440 OKLOXQFRSUDEBH-UHFFFAOYSA-N 427.548 4.261 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)N(C)C)cc1 1638917093 DFPZOYCYSGXKDD-HSZRJFAPSA-N 436.556 4.066 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]2COc2ccc(Br)cc2)cc1 1645807256 UYOMWDMCWIXMBE-INIZCTEOSA-N 431.290 4.295 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCc2ccc(N3CCN(C)CC3)cc2)c1C 1649008066 IPHRPXKAJWMPHV-UHFFFAOYSA-N 430.596 4.127 10 10 IICE C[C@H](NC(=O)N1CC[C@@]2(CCCCN2C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671852179 SHMYBQZZOONZPF-UUOWRZLLSA-N 430.593 4.389 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 1682101671 UJKOQNJHYRMJJR-MISYRCLQSA-N 432.609 4.127 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCO)c3ccc(Cl)c(Cl)c3)C2)cc1 1683782120 ITJMVBWCXSFOGA-YWZLYKJASA-N 438.355 4.004 10 10 IICE CCOCc1nnc(N2CCC[C@H](OC(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1696315629 UDQZLFKJOUIRCT-NRFANRHFSA-N 441.620 4.029 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccco1 1696699460 BYSGOVLPCXMAHM-UHFFFAOYSA-N 428.290 4.019 10 10 IICE CN(CCC1CCOCC1)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1696793689 YWHVVCBGKLZWIG-UHFFFAOYSA-N 444.630 4.232 10 10 IICE CC(C)c1ncc(CN(C)c2nnc(C(C)C)n2Cc2ccc(N(C)C)c(F)c2)cn1 1706272382 ZFVOZVNXMJZOPH-UHFFFAOYSA-N 425.556 4.205 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1710026103 XIBPWUSHBCYQKC-CVDCTZTESA-N 434.588 4.096 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1710773425 LWADENWPJORXFN-TZIWHRDSSA-N 437.588 4.250 10 10 IICE CC[C@H](C)[C@@H](Cn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1726860234 OZPZAMIVQLPHDI-WMZHIEFXSA-N 441.620 4.017 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)cc1C 1743641183 LBXIMQRXLFHPHV-PGRDOPGGSA-N 425.621 4.467 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746931085 UMNJAZYKBWEBJB-SFTDATJTSA-N 440.567 4.166 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@@H](C)c3nccs3)CC2)cc1F 1748849762 XPAQRKAZYZNMMQ-MRXNPFEDSA-N 444.580 4.136 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCc1nc(C)no1 1752610335 WQGHBLLUGVWUPF-SFHVURJKSA-N 437.592 4.352 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763825698 GJJXKKVQLYMIQL-XMSQKQJNSA-N 445.583 4.169 10 10 IICE CCN(Cc1cccs1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1766744003 JLBZJHLPOHTALQ-UHFFFAOYSA-N 445.643 4.406 10 10 IICE O=S(=O)(c1ccc(Br)cc1)N1CCn2c3c(c4ccccc42)CCC[C@H]31 1858183454 CIAZCFKDAKZWKW-LJQANCHMSA-N 431.355 4.486 10 10 IICE COc1ccc2[nH]cc(/C=C3/SC(=S)N(CCc4nc5ccccc5[nH]4)C3=O)c2c1 1860086857 LIMIEVUUMADQKZ-VXLYETTFSA-N 434.546 4.497 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)c(C)n1-c1ccccc1F 2297470441 ZAFDDZDGKWXIIV-UHFFFAOYSA-N 435.406 4.415 10 10 IICE Cc1cccc(S(=O)(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc3C2)c1 17135497 WXNUBKBLBLMUSL-SANMLTNESA-N 449.620 4.139 10 10 IICE Cc1ccc(OCCn2cc(/C=C3/C(=O)NN(c4ccccc4)C3=O)c3ccccc32)cc1 33340816 NITBRSIPCGWGSJ-ULJHMMPZSA-N 437.499 4.490 10 10 IICE Cc1ccccc1C1=NN2C(=N)/C(=C\c3cccc(Br)c3)C(=O)N=C2S1 102447005 QEJUIGCTPYMWER-GDXBMZNVSA-N 425.311 4.425 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(N/C=C2\C(=O)N(c3ccc(C)cc3C)N=C2C)cc1 103883809 RSFZMSLAKLJFGQ-QNGOZBTKSA-N 440.569 4.052 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sc4nccc(C)c4c3C)cc2F)CC1 730194198 ZUWMPVPPJPNARA-UHFFFAOYSA-N 426.561 4.124 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccco2)c(-c2ccco2)s1 731051669 PYYUKIWGLCXVRO-UHFFFAOYSA-N 447.450 4.381 10 10 IICE CO[C@H](C)CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(C)C 740804260 WUXGZOZKADPANK-DSQDWWTGSA-N 426.629 4.001 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@@H]3CCCN(C)[C@H]3c3cccs3)CC2)cc1 745847382 JKHNVGGGOBTOOI-WMZHIEFXSA-N 442.629 4.062 10 10 IICE CO[C@@H](C)c1noc(CN(C)CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 747967824 QUTLMVZIIAJDQR-HNNXBMFYSA-N 448.470 4.101 10 10 IICE O=C(NCc1cccc(Br)c1O)Nc1ccc([S@](=O)C(F)(F)F)cc1 765301140 NEUGXXILHISAGO-VWLOTQADSA-N 437.237 4.104 10 10 IICE c1cc(OC[C@@H]2CCCO2)ccc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768669902 JCIVLERBACCUDF-MHZLTWQESA-N 435.612 4.066 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](C(F)(F)F)C(C)(C)C3)cc2F)CC1 790305585 NWUTWUPTQPSWTJ-IBGZPJMESA-N 444.517 4.088 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccc2c(c1)nc(O)n2C1CCCC1 804737877 SIGLYRFYSLOSCU-UHFFFAOYSA-N 430.302 4.255 10 10 IICE C[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(N2CCCOC2=O)cc1 814451380 ZNHWRXZVRDTCQD-ZDUSSCGKSA-N 448.317 4.062 10 10 IICE Cc1cc(C(=O)CSc2nnc3c(=O)[nH]c4ccccc4n23)c(C)n1-c1ccc(F)cc1 916615638 DPKWUZDYZKGOIY-UHFFFAOYSA-N 447.495 4.092 10 10 IICE CN(C)C[C@H](Cc1ccccc1)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 919655065 QNNQTUUEVXTKPU-QHCPKHFHSA-N 434.584 4.230 10 10 IICE Cc1cnc(OC(C)C)c(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 1129291788 SSPIIXUGNVKIOG-UHFFFAOYSA-N 445.431 4.113 10 10 IICE Cc1csc(-c2cccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)c2)n1 1129549998 ZYYNYQJHQJSSPG-UHFFFAOYSA-N 429.492 4.163 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/c3cccc(OC4CCCC4)c3)CC2)c(OC)c1 1131806322 GDNPLYHFGBKNDO-JLHYYAGUSA-N 436.552 4.387 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1cccc(Cl)c1 1135718035 JDZSTXULAKWFHV-HSZRJFAPSA-N 437.971 4.378 10 10 IICE COc1ccc(CN2CC[C@@H]2C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1139138610 KODKOLMCIZJOPF-HOYKHHGWSA-N 442.003 4.476 10 10 IICE CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1142782647 MRTXMZVZPZYUNO-RTBURBONSA-N 439.600 4.072 10 10 IICE COCC[S@](=O)Cc1cccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1146915535 QRHWTCRBAWLIFC-HKBQPEDESA-N 438.549 4.054 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CSc1nncn1-c1cccc(Cl)c1 1162106762 ADMXHYJPNVCBTJ-INIZCTEOSA-N 444.004 4.135 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@](C)(C(F)F)C2)c(C)n1-c1ccc(Br)cn1 1167341453 HMPLPJNACBDIFV-BLVKFPJESA-N 442.304 4.136 10 10 IICE CCOc1ccc(N2CCN(Cc3csc(-c4cccc(C(=O)OC)c4)n3)CC2)cc1 1168332358 WWGUEIOFBAYZFM-UHFFFAOYSA-N 437.565 4.318 10 10 IICE CCc1ccc([C@@H]2CCCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1229780673 IFSITHFRZSZAJV-OAQYLSRUSA-N 443.538 4.453 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)Cc2cn(C)c3ccc(F)cc23)cc1 1251848639 FTMOJWKTSBUVCP-QGZVFWFLSA-N 426.536 4.035 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)c2cc(OC)ccc2O)sc2c1CC[C@H](C)C2 1307628324 HTQPFNWIWYTAAY-UONOGXRCSA-N 446.569 4.053 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3ccc(Oc4cccc(C)c4)cc3)CC2)cc1 1309323295 VGEPQTKWXQGVPE-UHFFFAOYSA-N 438.549 4.307 10 10 IICE COC(=O)CC[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1312591562 XXAMYICJEVDOBW-MSOLQXFVSA-N 435.996 4.451 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3(O)CCCCCC3)CC2)cc1 1315515939 WRUHMCSJLHFOFS-UHFFFAOYSA-N 441.620 4.212 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C3CC3)c2C)cc1 1447126506 HDILOLDYAOOAQD-NRFANRHFSA-N 427.545 4.136 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3cccc(C(F)(F)F)c3nc2O)N(C)C)cc1 1456929095 GHUPWYZGLBIVFJ-LJQANCHMSA-N 446.473 4.058 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCN2CCN(c3cccc(Cl)c3)CC2)cc1 1464290134 BRRFEFVYFFCSFZ-UHFFFAOYSA-N 429.008 4.015 10 10 IICE CC(C)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@H](O)c1ccccc1 1467625622 KXLUPWGERIYJJS-KAYWLYCHSA-N 433.596 4.282 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NCc2cc(Cl)ccc2O)c1 1469874091 KGXAKBTXSZQEQR-UHFFFAOYSA-N 444.940 4.393 10 10 IICE CC[C@@H]1CCN(c2nnc(C(=O)Nc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1514085009 NTRIGGWYLWKUAN-LJQANCHMSA-N 447.587 4.056 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CSCN3C(=O)C(C)(C)C)cc2Cl)C1 1524245940 UGAJMJOFDBPWES-DNVCBOLYSA-N 438.037 4.140 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)cc2Cl)C1 1524702607 CLMGGUOVFGGIOM-GHTZIAJQSA-N 439.987 4.241 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cnc1Cl 1531909036 UHXKJUNRFWDIJR-OQLLNIDSSA-N 435.933 4.413 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccn1 1543715013 IQHWTYKEFZVYCC-DTQAZKPQSA-N 445.635 4.219 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1545642529 OROQSXXPDDOLIV-GOSISDBHSA-N 446.603 4.402 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](OC)CC[C@@H]2C)sc(C)c1-c1ccccc1 1560063965 PQRXTGYETSFDBC-MAUKXSAKSA-N 430.570 4.338 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@@H]2CSCCN2Cc2ccccc2)C2CC2)cc1 1564552668 YIABBULDDJCMNX-XMMPIXPASA-N 438.641 4.044 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(Br)sc1Br 1568736045 SOLBYEBWXNXADR-UHFFFAOYSA-N 440.153 4.394 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)C2CCCCC2)cc1 1583622338 PXNAWNXJUBGYPS-OAQYLSRUSA-N 433.593 4.063 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCCc3nc(-c4ccc(Cl)cc4)no3)C2)cc1 1587112325 DRGPADOZWYRWCC-GOSISDBHSA-N 440.931 4.116 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(C)CCCC1 1608235009 GXAZWKBIHLJPRU-UHFFFAOYSA-N 438.620 4.233 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(Cc3ccccc3)C(C)(C)C)cc2F)C[C@H](C)O1 1616214703 HRLFIQMKKKPBHF-PMACEKPBSA-N 441.591 4.356 10 10 IICE CCO[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1616585661 PNOQCYHEPBRNGP-OAQYLSRUSA-N 429.634 4.008 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(o2)CCCC3)NC(=O)OC(C)(C)C)cc1 1618252173 AVNOSMNJMYBTCD-LJQANCHMSA-N 427.545 4.220 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@H]2CCC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1618254198 YJKXTTMMHXYVEI-UXHICEINSA-N 433.593 4.030 10 10 IICE O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634768 IFTWFUCJDAQTBZ-GOSISDBHSA-N 426.866 4.388 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@](C)(Cc2ccccc2)[C@@H](C)O)CCCC1 1623463174 GXZLPLDFTVYVFB-WINIVTDRSA-N 434.580 4.275 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncc(Cc2ccccc2)o1 1629055249 GACCNKVWLDOWKO-KRWDZBQOSA-N 427.451 4.266 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1 1630324330 UIDVYMHZRFJCAJ-FQEVSTJZSA-N 448.542 4.018 10 10 IICE Cc1cc(C(=O)N[C@@H](CCO)c2cccc(OC(F)(F)F)c2)c(C)n1-c1ccccn1 1630871731 VMCYFPJWABCMPH-IBGZPJMESA-N 433.430 4.241 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)C2CCN(C(=O)c3ccccc3)CC2)c1 1632273850 WRYSIIIIFSRREV-UHFFFAOYSA-N 443.547 4.283 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)N3CSCCSC3)cc2Cl)C1 1635126504 MFNCZZBQCLARNP-JKSUJKDBSA-N 428.067 4.278 10 10 IICE CCn1c(CNC(=O)c2cc3cc(O)c(O)cc3s2)nc2cc(Br)ccc21 1635963137 QUFPTGRYGASMJB-UHFFFAOYSA-N 446.326 4.375 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)cc1 1637435059 WKJBKENICJNASS-VXKWHMMOSA-N 438.528 4.161 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CC(=O)NCc2ccc3cccnc3c2O)c2ccccc21 1638573241 OGGCWISKIKJXDP-SFHVURJKSA-N 433.508 4.486 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1csc(Nc2cc(F)cc(F)c2)n1 1646435238 OIOPNMMCYRYULD-UHFFFAOYSA-N 444.507 4.056 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@]3(C)CN(C(=O)OC(C)(C)C)CCO3)c2C)c1 1651517136 SJIHRIKVRGDDDT-VWLOTQADSA-N 441.572 4.158 10 10 IICE COc1ccc(N(CC(=O)Nc2nc(CN3CCC(C)CC3)cs2)CC2CC2)cc1 1653650224 WZTSEJFADYHWLF-UHFFFAOYSA-N 428.602 4.239 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCC1(Cc2cccc(Cl)c2)CC1 1673472683 VLHZOAJFDYYDHZ-UHFFFAOYSA-N 449.929 4.277 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1COc2cccc(Br)c2C1 1683253603 IYHXYIIPBZZESM-DOTOQJQBSA-N 446.389 4.057 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C)[C@H](Cc4ccccc4)C3)c2C)c1 1683303315 MCPNAYUXBFAIOD-AREMUKBSSA-N 430.596 4.471 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@]3(O)CCCC3(C)C)CC2)cc1 1697470134 CMCUORBLOATXRN-VWLOTQADSA-N 441.620 4.068 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2C[C@@H](C)CC[C@H]2C)cc1 1710023805 DHUHDIQGYYVMSS-VQTJNVASSA-N 438.620 4.033 10 10 IICE CC(C)CCN(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N2CCC(C)CC2)cc1 1741511736 ZDNZACVBPJNWCE-UHFFFAOYSA-N 435.620 4.446 10 10 IICE CC1(C)CN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)CCS1 1742005964 RCHPDPPBJMFLLI-OAHLLOKOSA-N 439.676 4.143 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc2c(c1)CCCN2C 1771207712 LFOYVJNEODBPTO-KNQAVFIVSA-N 441.620 4.058 10 10 IICE COc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccccn2)c(C)c1 1858055623 RYCLRXWFWFOODM-UHFFFAOYSA-N 430.913 4.392 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)C3CCN(C(=O)c4cccs4)CC3)cccc21 1860587424 QSQGJGZJTKGORH-UHFFFAOYSA-N 444.512 4.014 10 10 IICE COC(=O)c1c(NC(=O)C(=O)NCc2ccc(C)cc2)sc(C)c1-c1ccc(C)cc1 1860760973 KLZFRDPVUYISID-UHFFFAOYSA-N 436.533 4.382 10 10 IICE CC1(c2nn(Cc3cccc(F)c3O)c(I)c2C(F)(F)F)CC1 2079714944 UPDJAQFSMHEJBO-UHFFFAOYSA-N 440.178 4.451 10 10 IICE COC(=O)c1c(C(C)C)nn([C@H](C)c2cc(C)c(C)cc2O)c1I 2079956723 HNZWBNLGIFICDR-GFCCVEGCSA-N 442.297 4.329 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)cc1 2293161000 IPHNRQGIGSLTBJ-UHFFFAOYSA-N 446.434 4.080 10 10 IICE CCCN(CCC)c1nc2ccccn2c(=O)c1C=C1SC(=S)N([C@H](C)CC)C1=O 2296546340 VJPJIKOJOFDNSY-OAHLLOKOSA-N 444.626 4.321 10 10 IICE O=C(CCN1C(=O)C(=CC=Cc2ccccc2)SC1=S)Nc1ccc(C(=O)O)cc1 2297351153 SXEBXUSHYQFNOY-UHFFFAOYSA-N 438.530 4.171 10 10 IICE O=C1C[C@@H](N2C(=O)C(=Cc3ccc(F)cc3)SC2=S)C(=O)N1c1ccc(Cl)cc1 2297464236 JTXFAFAIAQZWRA-OAHLLOKOSA-N 446.912 4.012 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)ccc1O 2321734558 YTUZVZLNOOMPQF-UHFFFAOYSA-N 442.562 4.033 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(CCNCc3c(O)cccc3Br)CC[C@H]1C2 2338290065 HPNJJVWIEKOUDF-VBKZILBWSA-N 425.367 4.424 10 10 IICE Cc1ccc(CN(C)c2ccc(N)cc2I)c(O)c1Br 2380780004 HJGCJUMCTAJYJZ-UHFFFAOYSA-N 447.114 4.286 10 10 IICE CCCOC(=O)CN1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 1809489 JDQFZSCRJVAJJP-UYRXBGFRSA-N 427.547 4.420 10 10 IICE CCOC(=O)CN1C(=O)/C(=C/c2cn(Cc3ccccc3)c3ccccc23)SC1=S 1810101 YLWJRFYTLJVAGY-NDENLUEZSA-N 436.558 4.454 10 10 IICE Cc1ccc(CN(C)C(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)o1 11642706 QUIMTJHDNJGVIX-IBGZPJMESA-N 425.554 4.381 10 10 IICE CCCCc1nnc(NC(=O)CCN2C(=O)/C(=C\c3ccccc3)SC2=S)s1 13306739 LRUYEYPEMVNNJG-WYMLVPIESA-N 432.596 4.111 10 10 IICE CC(C)CCN1C(=O)/C(=C/c2cc3ccccc3nc2N2CCOCC2)SC1=S 40562451 KZBBFWMXFTWVEG-RGEXLXHISA-N 427.595 4.319 10 10 IICE CN1CCN(Nc2ncnc(Nc3ccc(/N=N/c4ccccc4)cc3)c2[N+](=O)[O-])CC1 40623500 ATCDJMGCXSOHNG-OCEACIFDSA-N 433.476 4.118 10 10 IICE CCOc1ccc(-n2cccc2/C=C2/C(=O)N(c3ccc(OC)cc3)C(=O)N=C2O)cc1 96462391 ISNPFOYWBXQCAP-RCCKNPSSSA-N 431.448 4.391 10 10 IICE CCCCOc1ccc(/C=C2/SC(Nc3ccc(C(=O)O)c(O)c3)=NC2=O)cc1OC 210538831 IIZQWNBRVVEJDD-YBFXNURJSA-N 442.493 4.360 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(Oc2ccncc2)c1 768913616 MGHZKHQJSQKGTA-UHFFFAOYSA-N 442.563 4.336 10 10 IICE COc1ccccc1NC(=O)C1CCN(Cc2cc(C)cc(Br)c2O)CC1 781900182 IJWXQDTWILJHDO-UHFFFAOYSA-N 433.346 4.322 10 10 IICE CCN1CC[C@@H](NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1cc(F)c(F)c(F)c1 782391248 JYBHWYWWQCAPDL-OFNKIYASSA-N 437.481 4.005 10 10 IICE CC1CCN(c2ccc(CNC(=O)CCCCN3C(=O)c4ccccc4C3=O)cc2)CC1 792594567 UXXZTILQDHQCOC-UHFFFAOYSA-N 433.552 4.006 10 10 IICE O=C(Cc1c(F)ccc(Br)c1F)NCc1cc(Br)ccc1O 804735883 KSLXOFQTZSPHSB-UHFFFAOYSA-N 435.062 4.054 10 10 IICE Cc1cc(CCNC(=O)/C=C\c2cc3cnn(C(C)C)c3[nH]c2=O)c(C)n1-c1ccccc1 899596005 VDDMXLIHRRWDRH-KHPPLWFESA-N 443.551 4.085 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917030276 GHARQSNOUBPSNR-IXDOHACOSA-N 433.955 4.060 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)Nc1nc2c(s1)CCC2 917205827 IIAZAVGUICMBCK-MRXNPFEDSA-N 440.594 4.405 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1 1124549648 NXZHFYIJTOACOK-GGAORHGYSA-N 425.960 4.118 10 10 IICE CCc1ccc(-n2nc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c3c2CCC3)cc1 1134681845 KAPXXDJHJXLZSR-VWLOTQADSA-N 445.611 4.022 10 10 IICE O=C(Cc1csc(COc2ccccc2)n1)NCc1ccc(N2CCSCC2)cc1 1136282519 NKRRSYXPMTUYLG-UHFFFAOYSA-N 439.606 4.134 10 10 IICE Cc1cc(C(=O)NCC(=O)Nc2ccc(-n3cccn3)cc2)c(C)n1-c1cccc(Cl)c1 1136522022 ZUEISUHXXUYBIQ-UHFFFAOYSA-N 447.926 4.302 10 10 IICE Cc1cc(C(=O)N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)c(C)n1-c1ccccn1 1137148681 OMADWYYMOLKXKB-KRWDZBQOSA-N 442.441 4.043 10 10 IICE O=C(Nc1ccc(-c2ccon2)cc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1156504532 NNRSAJVYVZMUIZ-UHFFFAOYSA-N 441.490 4.162 10 10 IICE CCCc1noc2nc(C3CC3)cc(C(=O)NCc3cccc(Br)c3O)c12 1156793529 YVXINCMKIXQLSF-UHFFFAOYSA-N 430.302 4.451 10 10 IICE Cc1ccc([C@](O)(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C(F)(F)F)o1 1160564028 VLULUKFWPCVYFH-HXUWFJFHSA-N 430.386 4.076 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)cc1 1162149127 ORKUDPWUJFNABC-DYESRHJHSA-N 438.568 4.275 10 10 IICE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1180100005 RQNPBMGGUXYGQQ-NRFANRHFSA-N 434.540 4.466 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1C[C@@H](OCC)C12CCCC2 1233605517 XKIBLWPNHWOZHD-DNQXCXABSA-N 443.632 4.307 10 10 IICE CC1=Nc2ccccc2C12CCN(C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)CC2 1256236715 KIFLIJWYTURLOU-XMMPIXPASA-N 433.600 4.205 10 10 IICE CC(C)C[C@H](CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)NC(=O)OC(C)(C)C 1264822421 QFYFQGNOFNEDPD-AZUAARDMSA-N 433.593 4.030 10 10 IICE CC(C)=CCCn1c(C2CCN(c3ncccn3)CC2)nnc1N(C)Cc1ccccc1O 1287107846 NDSHYIRRGDHROL-UHFFFAOYSA-N 447.587 4.150 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2CCCCCO)c(C)n1-c1ccccc1 1289356789 YCFPUDIROOFULY-UHFFFAOYSA-N 434.544 4.140 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](COC)C1)OC 1292174886 OUJAFEVHLJQVPB-IRLDBZIGSA-N 437.588 4.250 10 10 IICE CCc1nnc(N2CCN(c3cccc(C)c3C)CC2)n1CCCSc1nccs1 1293097406 JLBWYMSNOIVHDK-UHFFFAOYSA-N 442.658 4.423 10 10 IICE Cc1cccc(OC[C@@H](O)CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1294565354 UKWHDZAZSZJTJX-QFIPXVFZSA-N 426.944 4.155 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Cc1ccc(OC)c(OC(F)F)c1 1294685402 PLAXGFIUWZIJSA-UHFFFAOYSA-N 444.272 4.356 10 10 IICE CCc1ccccc1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1360913887 LSNQIQKYPXLXQN-UYRXBGFRSA-N 428.554 4.296 10 10 IICE Cc1nc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(C)s1 1435570907 CJRFPAIZFDKQND-CXUHLZMHSA-N 436.555 4.234 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccn(CC(F)(F)F)n2)cc1 1443637538 ZDJLLEJEEXJDQE-UHFFFAOYSA-N 432.446 4.367 10 10 IICE COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1448687201 YXXTXFXWIPNQAJ-ZEQRLZLVSA-N 430.504 4.426 10 10 IICE C[C@@H]1Oc2ccccc2N(CCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1=O 1464536193 JKRLDNFZLDXARJ-IBGZPJMESA-N 435.568 4.276 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCCCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1499052865 WALSPIUDDZVPHH-QFIPXVFZSA-N 438.664 4.356 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@@H]1C 1502259102 IIJYZGPSPHSWFN-SFTDATJTSA-N 438.664 4.352 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)cc2Cl)C1 1519550135 GPDCERVHHHHMFX-ZDUSSCGKSA-N 427.892 4.291 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)cc2Cl)C1 1524702695 CLMGGUOVFGGIOM-NQIIRXRSSA-N 439.987 4.241 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(F)ccc3N3CCOCC3)cc2Cl)C1 1524703949 OGXOUEOPRMNQHO-KRWDZBQOSA-N 445.966 4.482 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 1525106813 MPZQHGOKXTVLSU-XXBNENTESA-N 443.950 4.257 10 10 IICE CC(C)(C)OC(=O)/C=C/c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)co1 1541081441 YVJDLQFWOADEQA-CMDGGOBGSA-N 428.554 4.118 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3CCCC[C@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1542171738 YWPBSEIGAJIWFN-OFVILXPXSA-N 445.604 4.208 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCOC3(CCC3)C2)c(C)n1-c1ccc(Br)cn1 1556686119 BQOZMEXVGYLPKR-INIZCTEOSA-N 432.362 4.331 10 10 IICE CC[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)C(=O)NCc1cccs1 1570703645 WBNMNFDSKDSKBX-OAQYLSRUSA-N 437.565 4.101 10 10 IICE Cc1ccccc1CN1CCO[C@@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)C1 1587573500 MGVNUFCMRIHOAM-DEOSSOPVSA-N 435.543 4.172 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccc(Cl)s3)cc2F)C[C@H](C)O1 1596695242 OBKHRJSALMQPDZ-STQMWFEESA-N 448.951 4.474 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1612952352 DGLTXPDPPJNRQN-OALUTQOASA-N 443.661 4.082 10 10 IICE Cc1nnnn1-c1ccc(C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)c(F)c1 1623926339 YIYLBTMBXVQOBH-MRXNPFEDSA-N 431.471 4.219 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCC2(c3cccc(Br)c3)CCOCC2)cc1 1625245123 XQQUJEPVNZUQMX-UHFFFAOYSA-N 445.317 4.090 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3nc[nH]n3)c2)CC1 1634112279 CAANHLYBWOBATI-UHFFFAOYSA-N 438.513 4.353 10 10 IICE CCN(C(=O)/C=C\[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1634247966 SWYOVOBMCNXCNF-VPLQDYMCSA-N 443.588 4.079 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCCC[C@H]2c2ccc(Cl)cc2)c1 1635284201 KXZVRLWFEGTZHM-HKUYNNGSSA-N 436.961 4.263 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc(C(=O)Nc2ccccc2)nn1 1639622067 FKOGZROKXSZRNP-UHFFFAOYSA-N 427.302 4.224 10 10 IICE O=S(=O)(c1ccc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1)C(F)(F)F 1642227563 WOQIKDIYDMMBSG-INIZCTEOSA-N 448.894 4.416 10 10 IICE CCOC(=O)c1sc2nc(CN(C)C)nc(N[C@H](C)c3ccc(N(C)C)cc3)c2c1C 1650986894 WJEGAVBLKQZZQM-OAHLLOKOSA-N 441.601 4.477 10 10 IICE C[C@H](NCC(=O)NCC1(c2ccccc2)CCCCC1)c1ccc(N2CCOCC2)cc1 1658065984 AAKADAMUZFLSTI-QFIPXVFZSA-N 435.612 4.192 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(Cc4ccc(F)c(F)c4)CC3)C2)cc1 1683946036 YWJBZIINNBJEFL-LJQANCHMSA-N 429.511 4.216 10 10 IICE CCS[C@@H]1CC[C@H](N(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1696546761 VQZLVIZDGPQDNJ-ILWGZMRPSA-N 443.661 4.315 10 10 IICE CC(C)(C)c1nnc(N2CCCCCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1706113026 XHFNVUSHVPLADJ-UHFFFAOYSA-N 429.584 4.370 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710767708 VBRSKSYYCNPOEZ-SIKLNZKXSA-N 445.583 4.026 10 10 IICE CNC(=O)[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(C)CC1 1711296647 MKNYBTRIEZOEKW-SFHVURJKSA-N 448.615 4.361 10 10 IICE Cc1nnc(CCCn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)s1 1726278405 HMVGHOCXMJJAKX-UHFFFAOYSA-N 426.590 4.146 10 10 IICE CC[C@H](C)c1nnc(N2CCC([C@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)cc1C 1743642800 YPHSGCUTBQODJQ-AVRDEDQJSA-N 425.621 4.467 10 10 IICE CCN(CC)c1ccc(Cn2c(Nc3ccn(C)n3)nnc2-c2ccc(Cl)nc2)cc1 1764940929 BWDPMPJZMHHVSG-UHFFFAOYSA-N 436.951 4.365 10 10 IICE CCN(CC)C1CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1766644152 LGKTWYTZPOQAAD-UHFFFAOYSA-N 438.664 4.218 10 10 IICE CCOc1cc(/C=C2/C(=O)N(Cc3ccccc3F)N=C2C)cc(Br)c1O 1865667479 YMODUJQAMILVSY-OVCLIPMQSA-N 433.277 4.494 10 10 IICE CCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccc(OC)cc2)C1=O 1873164621 KATXQLHVEFSFMZ-UHFFFAOYSA-N 443.547 4.382 10 10 IICE COc1ccc(Br)c(CNC[C@]2(C)CN(Cc3ccccc3)C[C@H]2C)c1O 2236051176 PETGHGXDWMHSQX-OPAMFIHVSA-N 433.390 4.411 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12 2296474101 UAOZOIQHISAKDT-UHFFFAOYSA-N 427.504 4.484 10 10 IICE COc1cc(C=C2SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)ccc1OC(C)C 2314764623 HXIIBTLMQUTBRT-UHFFFAOYSA-N 442.562 4.337 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2C[C@@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380756405 KVXGVNREBFIGCR-ZIAGYGMSSA-N 441.366 4.115 10 10 IICE CCc1ccc(N2C(=O)/C(=C\c3ccc(OC)c(OC)c3C(=O)O)SC2=S)cc1 16906181 KBIUAVAULQQLQX-LFIBNONCSA-N 429.519 4.370 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cccc(Cl)c4)c3[N+](=O)[O-])CC2)cc1 40611196 LPEXVGVLVIFZOI-UHFFFAOYSA-N 440.891 4.117 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C/c2cc(Br)ccc2OCC)SC1=S 40888828 SLZYWKUWJGZWOQ-UVTDQMKNSA-N 444.372 4.002 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@@H]32)c1O 226707600 LVGUFMFPNVUCGP-HYFFOGBASA-N 426.538 4.012 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 731184217 SZXUNCCQPITWEG-XMMPIXPASA-N 429.564 4.305 10 10 IICE COc1cccc(F)c1[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 741988990 MLKCYHJEONMBON-LBPRGKRZSA-N 448.406 4.009 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H](O)c1ccc(Br)cc1 743871136 RZBCJYHEZNTNMT-QGZVFWFLSA-N 429.152 4.473 10 10 IICE C[C@@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Br)cc1O 757637847 MVSXXJLIKHZLHP-WBMJQRKESA-N 431.309 4.218 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1cccc(COC2CCOCC2)c1 769697259 CYKQULTVFKQSBQ-UHFFFAOYSA-N 428.492 4.344 10 10 IICE C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 780840403 GXINXPVQVBDKES-PXNSSMCTSA-N 438.538 4.091 10 10 IICE CCN(Cc1ccccc1)c1ccc(CN2CCC(C(=O)Nc3nncs3)CC2)cc1 809734079 UUZOXYJTJPUNRQ-UHFFFAOYSA-N 435.597 4.415 10 10 IICE CC(C)Cn1cc([C@@H]2N(Cc3cc(Br)ccc3O)CC23CCOCC3)cn1 849479643 TVZRPIHTZLJIRU-FQEVSTJZSA-N 434.378 4.361 10 10 IICE CS(=O)(=O)c1ccccc1S(=O)(=O)Nc1nc(-c2cccc3ccccc23)cs1 873997192 RDMXRJVNJHKVQT-UHFFFAOYSA-N 444.559 4.168 10 10 IICE Cc1ccc(C(=O)Nc2cccc(N3CCCCC3)c2)cc1S(=O)(=O)NC1CCCC1 1125462186 HSTIDNUWOFNVMP-UHFFFAOYSA-N 441.597 4.459 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@@]2(C)CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1136903509 FRSLBFJJURMOMH-JXFKEZNVSA-N 444.403 4.409 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)Cc1cc(=O)oc2cc(CC)c(Cl)cc12 1195359295 USPUNZNQGPFPND-UHFFFAOYSA-N 429.900 4.280 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)SCc1nc(O)c2ccccc2n1 1264442598 LIFRSFUUGIDEIH-QGZVFWFLSA-N 438.597 4.460 10 10 IICE Cc1cc(CC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1293168198 SGAATIUYMKZXGC-HXUWFJFHSA-N 425.573 4.400 10 10 IICE CCCN(CC)c1nnc(C2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1294490962 QAYPZKKNWNEAPH-UHFFFAOYSA-N 425.621 4.429 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCS[C@H](C(C)C)C2)cc1 1295420521 RJHCABHIFFUTDZ-IRLDBZIGSA-N 443.661 4.254 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(O)(Cc3ccccc3F)CC2)cc1 1297198473 GHXVEPCHMWQEME-UHFFFAOYSA-N 448.538 4.184 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)S[C@@H](C)C1 1301818661 RELPJXPBOFHOCB-ROUUACIJSA-N 425.602 4.329 10 10 IICE Cc1cc(CN2CCN(c3ccccc3OCCN(C)C)CC2)ccc1N1CCCCC1 1307556383 YPAHQORYPZYAMO-UHFFFAOYSA-N 436.644 4.248 10 10 IICE CCS[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307700565 SHXXTUJVZPZNBA-NYSBEXSLSA-N 436.577 4.443 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCN(C(C)(C)CC(C)(C)C)CC3)C2)cc1 1312902684 OGOSOKAIIRAUFB-HXUWFJFHSA-N 430.637 4.064 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC3(OC)CCCC3)CC2)cc1 1315515049 DOSDACOOXOQAOL-UHFFFAOYSA-N 441.620 4.260 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cc(C)on1 1316020916 DTQFYVHKPOKNDO-UHFFFAOYSA-N 434.544 4.170 10 10 IICE CN(C)c1ccc(CNC(=O)Cc2ccc(Br)c(Br)c2)cc1 1351266069 OQUYAXSJJQKRQI-UHFFFAOYSA-N 426.152 4.137 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(F)cc(N3CCOCC3)c2)cc1 1353014561 ZACPSQRLIBWPFH-UHFFFAOYSA-N 437.515 4.164 10 10 IICE CCOC(=O)c1c(NC(=O)/C=C/c2cnc(OC)nc2)sc(C)c1-c1ccc(F)cc1 1353964603 JNGJSDKPDJLCFO-BJMVGYQFSA-N 441.484 4.490 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cccc(OCCF)c1 1355829956 CCTAIRIMGZUVRT-PDGQHHTCSA-N 448.516 4.404 10 10 IICE CCOC(=O)CN(CCc1ccccc1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1359957018 GULPGYQFHGXBJX-UHFFFAOYSA-N 448.563 4.163 10 10 IICE CCC1CCC(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)(C(=O)OC)CC1 1435401325 HJKCQCOWBWHHBR-UHFFFAOYSA-N 439.600 4.036 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(O[C@H]3CC3(F)F)cc2)cc1 1442613890 KKOGMLRUUFAOFQ-YADHBBJMSA-N 430.495 4.360 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2ccc(F)cc2)[nH]n1 1444993183 ZDMIQDRJYJUNGN-MRXNPFEDSA-N 430.430 4.216 10 10 IICE Cc1cc(C(=O)N[C@H](C)C[C@H](O)c2ccco2)c(C)n1-c1ccc(Br)cn1 1445498603 VMEJTOPWVIZWCT-PXAZEXFGSA-N 432.318 4.087 10 10 IICE CN(OCc1ccccc1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1446532562 TXAFAPLXTDLSEB-QGOAFFKASA-N 430.526 4.007 10 10 IICE CCN(CC(C)C)c1nc(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cs1 1446567536 MMWFFHIXVZMWAE-HXUWFJFHSA-N 431.602 4.081 10 10 IICE Cc1ncccc1[C@H](C)OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1461686753 CMZKRKPOBPCBCU-QCUKBLKESA-N 430.526 4.425 10 10 IICE CC(=O)[C@H]1CC(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)=NN1c1ccccc1 1464534365 AJFFWPICFLYDKJ-RUZDIDTESA-N 432.568 4.296 10 10 IICE CCCN(C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)[C@@H](C)CC(=O)Nc1ccccc1 1470771301 CJKWNZIBXBFNAJ-FPOVZHCZSA-N 438.572 4.113 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCC3CCOCC3)CC2)cc1 1504293005 XCUNSXHJCSGERF-UHFFFAOYSA-N 441.620 4.019 10 10 IICE CC(C)[C@@H]1CCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C1 1509066095 SYIHJOCXDJDAIY-QGZVFWFLSA-N 428.631 4.385 10 10 IICE CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1519574892 KCLIDASQZMCQQZ-UHFFFAOYSA-N 429.542 4.458 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](C(=O)OC(C)(C)C)c2ccnn2C)c1 1530752889 UCUWCRJUOZQLLR-FQEVSTJZSA-N 442.947 4.294 10 10 IICE CC(C)C(=O)c1ccc([C@H](C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1535346396 VENRYRBYUULYMX-INIZCTEOSA-N 430.495 4.060 10 10 IICE COC(=O)C[C@](C)(NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1cccc(OC)c1 1544911113 GZWWMBSDUKRQED-SANMLTNESA-N 434.536 4.240 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCO[C@@H]2C(C)C)c(C)n1-c1ccc(Br)cn1 1544926914 BVFIAXUZXIONEX-OXQOHEQNSA-N 434.378 4.433 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nn1-c1ccc(F)cc1 1545632056 ABYQTRNJCXOQNI-LJQANCHMSA-N 442.922 4.073 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CC4)n3CCCCOC(C)C)CC2)cc1 1554959121 IVMMZRJGWVIMPB-UHFFFAOYSA-N 427.593 4.086 10 10 IICE CCCN(Cc1ccccc1O)[C@H](C(=O)OCC)c1nc(Br)sc1C 1559570446 VEAZHHREAYOMHJ-INIZCTEOSA-N 427.364 4.436 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H](NC(=O)OC(C)(C)C)[C@@H]4C[C@H]34)cc2)CC1 1565663552 HEWHJDXPEABOOU-LNRXMEIDSA-N 427.589 4.088 10 10 IICE O=C(/C=C\c1csc(C(F)(F)F)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1586864628 NESJWNDCLLFWLM-RQOWECAXSA-N 428.451 4.197 10 10 IICE CSc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccn1 1587778269 MPRPJAKXWXVRIH-GDNBJRDFSA-N 433.555 4.173 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 1595427310 SSMMPEUCUIHBSD-DFBJGRDBSA-N 429.564 4.228 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 1595435627 IRIIEWIVVYASTH-QHCPKHFHSA-N 435.568 4.438 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC([C@H]3CCCO3)CC2)nnc1C(C)(C)C 1611963814 BMBNGDHUOIMTGN-JOCHJYFZSA-N 425.621 4.394 10 10 IICE CC[C@H](Cc1ccccc1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1615678782 JTFHSEMYBOWHJA-HXUWFJFHSA-N 426.516 4.354 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc(NCCc4ccccn4)cc3)c2)CC1 1633444711 XDAIINBXYKKQMH-UHFFFAOYSA-N 429.568 4.130 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C(CNC(=O)N(Cc3ccccc3O)C3CCCCC3)[C@H]2C1 1638218434 QDPCEVQPTZNQIN-NHCUHLMSSA-N 443.588 4.349 10 10 IICE CC[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cccc([N+](=O)[O-])c1 1642518912 VLRQNYRMHFJYSB-JOCHJYFZSA-N 443.459 4.050 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3nc(C(F)F)nc4ccc(F)cc34)cc2)CC1 1643194002 LTZSSYMPOWJAQD-UHFFFAOYSA-N 429.446 4.020 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1648636713 NENMBCFKDMOSDA-CBQOVEMMSA-N 437.540 4.177 10 10 IICE Cc1cc(C(=O)CSC2CCC(F)(F)CC2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1656927698 QOYGMDGZSOXVEQ-UHFFFAOYSA-N 442.553 4.235 10 10 IICE Cc1cc(CCNC(=O)N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c(C)n1-c1ccccc1 1674925013 YMJJBWPSWOUDFP-AHWVRZQESA-N 435.543 4.146 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCCCCN(Cc3ccccc3)C2)cc1 1675151240 SEPVZKPVXXOXIH-HSZRJFAPSA-N 438.616 4.218 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3ccc(F)cc3Br)C2)cc1 1682646724 UYWGJUHPRJGMGL-MRXNPFEDSA-N 436.325 4.017 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Oc4cc(C)ccc4C)CC3)C2)cc1 1683336784 LCKUGGDUPPBUBC-OAQYLSRUSA-N 437.584 4.391 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1([S@@](C)=O)CCC1 1693994036 ANSIHLFHXGNQNI-FZYZMVIOSA-N 443.661 4.329 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@@H]1C 1695815310 WWYKQJVOPNYNKR-PMACEKPBSA-N 438.664 4.216 10 10 IICE CCN1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)CC1=O 1695859636 XLOPTILDHQLLHN-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CON(C)c1nnc(-c2cccc(Br)c2)n1CCCSc1nccs1 1712654729 DFYKWBYNBAWBEX-UHFFFAOYSA-N 440.392 4.344 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCSC(C)(C)C1 1724234482 IDTCUOZTOWAITB-UHFFFAOYSA-N 436.629 4.018 10 10 IICE COC[C@@H]1CCCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1730547511 UIIYKIBCILDONV-OFNKIYASSA-N 441.620 4.195 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccnc(OCC(F)(F)F)c1 1750610768 CMAJZOMSPOJIEQ-UHFFFAOYSA-N 435.450 4.128 10 10 IICE Cc1nnc(N2CCO[C@@H](CCc3ccccc3)C2)n1CCCSc1nccs1 1772848482 BNUCLQGBIYQZOH-IBGZPJMESA-N 429.615 4.063 10 10 IICE COc1cc(C=C2C(=N)N3N=CSC3=NC2=O)cc(Cl)c1OCc1ccc(F)cc1 2297461267 DHGAOQMPNWGTLN-UHFFFAOYSA-N 444.875 4.316 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1ccc(OC)cc1 2313499063 GZEVEIYDDOOXFH-UHFFFAOYSA-N 428.282 4.335 10 10 IICE COc1ccc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1Cc1ccccc1 2313560053 HQBCREPSXVMIBI-UHFFFAOYSA-N 446.503 4.256 10 10 IICE Cc1ccc(CNC(=O)C(C)(C)CCCNC(=O)OC(C)(C)C)c(O)c1Br 2380744185 CESJOXZTQOJVGQ-UHFFFAOYSA-N 443.382 4.410 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)F)c(O)c1Br 2380788213 ZMGWUILZXXEMOF-OAHLLOKOSA-N 447.345 4.063 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@H]32)ccc1O 14459035 VYITUVMZDWJWNS-GLDPYIMESA-N 440.565 4.402 10 10 IICE CCN(CC)c1ccc(N2C(=O)/C(=C\c3cccc(OCC(=O)O)c3)SC2=S)cc1 16909564 KOHXBCFGLJEPFC-CPNJWEJPSA-N 442.562 4.402 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3ccc(OCc4cccnc4)cc3)CC2)cc1 108427204 DVZROFGASOQWCD-VGOFMYFVSA-N 443.547 4.421 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C(C)(c1ccccc1)c1ccccc1 729757223 FVYRXWFMXIIYLH-UHFFFAOYSA-N 430.548 4.260 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N[C@H](c3ccccc3)c3ccco3)cc2F)CC1 730116537 RCPKUGKAJABPPP-XMMPIXPASA-N 436.531 4.149 10 10 IICE O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N(Cc1ccco1)Cc1ccccc1O 735927763 ZKVQHVVTPAHJIJ-UHFFFAOYSA-N 439.411 4.121 10 10 IICE O=S(=O)(Nc1nc(-c2sccc2Br)cs1)c1cncc(Cl)c1 754692726 BHVLYRLVGGNVRM-UHFFFAOYSA-N 436.765 4.483 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1 771560228 NQPZJKBGHGWUHH-MRXNPFEDSA-N 443.407 4.131 10 10 IICE Cc1ccc(Cc2ccccn2)cc1NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 801905140 CRCFBEJGBWHXOT-UHFFFAOYSA-N 430.552 4.481 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(CCC(=O)N2CCCC2)cc1 806229180 ATNYVNJEKBYUSI-UHFFFAOYSA-N 446.345 4.031 10 10 IICE C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126658587 TVLNYZOPZIBNCN-QFBILLFUSA-N 430.495 4.329 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccc(CN3CCNC3=O)cc2)c1 1132341156 NMEVSDHFSVUNCN-UHFFFAOYSA-N 436.943 4.203 10 10 IICE Cc1cc(CC(=O)N2CCCS(=O)(=O)C[C@H]2c2ccccc2)c(C)n1-c1ccccc1 1134441568 IHYWABMIMNUDLA-DEOSSOPVSA-N 436.577 4.025 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1 1135733086 SPRCJXDJSVWVTG-QGZVFWFLSA-N 431.939 4.337 10 10 IICE O=C(c1ccc(S(=O)(=O)C2CCC2)cc1)N(Cc1ccco1)Cc1ccccc1O 1137343668 YDPNZDWWEPTGRO-UHFFFAOYSA-N 425.506 4.154 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1c[nH]c2nccc-2c1 1154590554 KFUNFPRVGSKUHS-GDNBJRDFSA-N 428.564 4.196 10 10 IICE Cc1cc(C(=O)[C@H](C)n2nnc(C(F)(F)F)n2)c(C)n1-c1ccc(OC(F)F)cc1 1190097935 ZJHVYJJRGHEQGX-NSHDSACASA-N 429.349 4.145 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN2C[C@@H](C)C[C@H](C)C2)n1 1289918434 DLTLCKSQAIIKJC-PMACEKPBSA-N 448.615 4.359 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CC[C@H](CC(C)C)C1 1304238875 YAGUPPZFYMMDTG-IRLDBZIGSA-N 425.621 4.467 10 10 IICE C[C@H]1CCCCN1CCCCn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1O 1305013947 OAUGXYDLKBEPAV-FQEVSTJZSA-N 434.588 4.337 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1nnc2n1CC[C@@H](C(F)(F)F)C2 1307208554 IXTSYWIUHPKBMQ-CQSZACIVSA-N 445.401 4.154 10 10 IICE CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Oc2ccccc2)cc1 1307573682 JHKZPLOQJWBKHV-UHFFFAOYSA-N 449.526 4.207 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@H]2C(=O)Nc3c(F)cccc32)sc2c1CC[C@H](C)C2 1348718351 FYIORFPMSUXFKJ-SMDDNHRTSA-N 430.501 4.253 10 10 IICE Cc1cc(CC(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)c(C)n1-c1ccc(Cl)cc1 1435364915 WAFGZWZOYBURMG-JOCHJYFZSA-N 444.984 4.192 10 10 IICE CCc1c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cnn1C(CC)CC 1435573809 SQZPBWVSAJCCLY-UHFFFAOYSA-N 437.632 4.269 10 10 IICE CCn1cc(-c2nn(C)cc2C(=O)N2CC(C)(C)c3cccc(Br)c32)cn1 1438189669 MVBDLCHZKDBNHM-UHFFFAOYSA-N 428.334 4.004 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(-c3nc[nH]n3)c2)cc1 1443635752 OMBRTGGVQCWCDO-UHFFFAOYSA-N 427.508 4.393 10 10 IICE Cc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2)c(C)n1-c1ccc(Br)cn1 1444168532 GEPDZZPDSMIRBZ-UHFFFAOYSA-N 429.274 4.090 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ccc(-c3ccc(Cl)cc3)cc2F)c1 1445598696 SWVKJQAAUBQDBB-UHFFFAOYSA-N 448.903 4.153 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(N2CCCCCC2)nc1 1445883808 OBCHHIADJQSJBF-OAQYLSRUSA-N 442.991 4.215 10 10 IICE COc1cccc(CNC(=O)c2cc(Nc3nccc(C(F)(F)F)n3)ccc2C)c1O 1445967295 KIALWUOGBJWATF-UHFFFAOYSA-N 432.402 4.192 10 10 IICE CN1CCN(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c2ccc(F)cc21 1457145003 RGYRQVQXVRVFEB-UHFFFAOYSA-N 425.504 4.216 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(-c2ccccc2Cl)c1 1465951098 IUWRTBSRLPMWPB-SFHVURJKSA-N 445.350 4.279 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H](O)C(F)(F)C(F)(F)F)cc1 1471525447 KFVKCWARICHRQX-INIZCTEOSA-N 430.377 4.456 10 10 IICE CC(=O)c1ccc(CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1477736672 HNEXMOBKMJGDIY-UHFFFAOYSA-N 431.483 4.001 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@H]1CCCCC1(F)F 1503488001 QHAXNRYDIKIXTO-LJQANCHMSA-N 427.499 4.431 10 10 IICE CN(CCc1ccccc1F)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1517264592 ABTUHOVAUNENPY-QGZVFWFLSA-N 447.605 4.239 10 10 IICE C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524851400 PXMYRZZFZRHALB-CQSZACIVSA-N 442.428 4.315 10 10 IICE COCCOc1cc(C)ccc1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1543859624 CWDWPTGVWMCJAK-UHFFFAOYSA-N 449.595 4.058 10 10 IICE C/C(=C/C(=O)N(Cc1ncc[nH]1)c1ccc(Br)c(Cl)c1)c1cnccn1 1544408349 CENKBHZSFZYXRM-WQLSENKSSA-N 432.709 4.252 10 10 IICE O=C(Nc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1544861274 YRVXHWPTZUHKNK-UHFFFAOYSA-N 438.427 4.420 10 10 IICE Cc1noc(COc2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc2)n1 1586201133 OXUGIGOCDKEWQW-UHFFFAOYSA-N 430.464 4.429 10 10 IICE COc1ccccc1Nc1ccc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1589178369 BKOCXJRZWXEWQG-UHFFFAOYSA-N 430.552 4.121 10 10 IICE C[C@@H]1CC(=O)CC[C@@H]1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616573086 QVJNDWUQAFISEG-DOMZBBRYSA-N 427.302 4.103 10 10 IICE COc1c(C)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1C 1618253401 NJAVXINLMHYQPL-NRFANRHFSA-N 441.572 4.374 10 10 IICE Cc1cc(C(=O)Nc2ccc(C(=O)N(C)C)cc2)c(C)n1-c1ccc(Br)cn1 1623617949 FBKJEMJCOLHDOO-UHFFFAOYSA-N 441.329 4.206 10 10 IICE Cc1cc(C(=O)Nc2ccc(I)cc2O)c(C)n1-c1ccccn1 1625021977 PHIHOQKESJGELR-UHFFFAOYSA-N 433.249 4.052 10 10 IICE Cc1ccc(C(=O)NCCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c(O)c1 1626169315 SIAHADKGOHLXKX-KRWDZBQOSA-N 443.975 4.027 10 10 IICE Cc1ccc(C(=O)NCc2ccc(-n3ccnc3C)nc2)cc1-n1c(C)cc(C=O)c1C 1626266118 KJLLQPBNKWSLDQ-UHFFFAOYSA-N 427.508 4.034 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](C)Cc3ccc(Br)cc3)CC2)cc1 1630992420 OSHCLLXJJBHFGZ-QGZVFWFLSA-N 431.374 4.375 10 10 IICE CC(C)(C)OC(=O)Nc1ncc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 1632399320 QQQVFTLJIYIPRP-HNNXBMFYSA-N 433.530 4.017 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ncc(C(F)(F)F)cn3)cc2Cl)C1 1634720006 MRZGXGKTCUTAAD-CYBMUJFWSA-N 441.885 4.385 10 10 IICE C[C@]1(Cc2cccs2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635996506 CNXVQZJPCSWFTG-JOCHJYFZSA-N 435.540 4.170 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2n[nH]c(C)c2I)c1C 1639298399 RYGAYSUGOSHNAP-UHFFFAOYSA-N 434.281 4.291 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(C)c(OCc3cccnc3)c(C)c2)cc1 1640771792 SIYYFRBHNYYEKZ-UHFFFAOYSA-N 433.552 4.494 10 10 IICE CNC(=O)c1cccc(N(C)C(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1645009911 JOPFKTHNFSPBNC-UHFFFAOYSA-N 440.341 4.493 10 10 IICE Cc1cc(C(=O)NCC2(c3ccccc3)CC(O)(C(F)(F)F)C2)c(C)n1-c1ccccn1 1648411603 TVASCPPATLTQNC-UHFFFAOYSA-N 443.469 4.244 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)[C@H](C)C1 1652402757 ZALAVMXPMCCCSL-CZUORRHYSA-N 433.346 4.270 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3ccc(SC(C)C)cc3)CC2)cc1 1653010974 HFWOTMDYXGACNO-REWPJTCUSA-N 443.657 4.029 10 10 IICE COC(=O)c1c(NC(=O)CN(C)c2ccc(OC)c(Cl)c2)sc2c1CC[C@H](C)C2 1653680065 KEGSZQLMIDWWSI-LBPRGKRZSA-N 436.961 4.396 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1 1685758432 LEDOWKPUAWANJF-IAGOWNOFSA-N 435.565 4.188 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(CC)C1 1709899169 MGHPHKRBGGSPIB-AREMUKBSSA-N 448.615 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1728382421 NKKFXPVMNZFBOU-PZJWPPBQSA-N 441.620 4.070 10 10 IICE CCOCC(C)(C)Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1746999767 KUTRTWJMMGFAAM-OAQYLSRUSA-N 441.620 4.081 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OCCOC)C1 1765770695 XBFMSJQDHANCNR-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCCN(C)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc2c(c1)CCCN2C 1772870716 XKWQKTBPTBABSU-UHFFFAOYSA-N 443.393 4.313 10 10 IICE CCN1C(=O)Cc2cc(-c3nc(NS(=O)(=O)c4ccc(Cl)cc4)sc3C)ccc21 1859572272 VWJAEHPTIBESRB-UHFFFAOYSA-N 447.969 4.482 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(Cc4cccc(C(=O)O)c4)C3=O)n12 1860825263 WJMZFUYXJGKKQF-AWNIVKPZSA-N 449.966 4.457 10 10 IICE CCCOc1c(Br)cc(/C=C2/C(=O)N(c3ccccn3)N=C2C)cc1OC 1865667812 QRZLZLYKUCSCIE-XNTDXEJSSA-N 430.302 4.448 10 10 IICE CC(C)CN1C(=O)c2ccc(C(=O)Nc3ccc(Cc4ccc(N)cc4)cc3)cc2C1=O 1865877214 ADQCEDJNHDSZHR-UHFFFAOYSA-N 427.504 4.364 10 10 IICE COC(=O)c1c(NC(=O)[C@@H](N)Cc2ccc(F)cc2)sc(C)c1-c1ccc(C)cc1 1866005193 MSBDQRGYUWAXLA-SFHVURJKSA-N 426.513 4.466 10 10 IICE COc1ccc(OC)c(-c2cc(C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)n[nH]2)c1 1891674449 NDJOZGOFZCCUSK-HKUYNNGSSA-N 432.524 4.013 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1cc(I)ccc1Br 2225798355 GEEQCNNXUVBYMY-WDEREUQCSA-N 435.063 4.015 10 10 IICE COc1ccc(Br)c(CN[C@H](CNC(=O)OC(C)(C)C)CC(C)C)c1O 2227747569 CAHMTFKOJNYROE-ZDUSSCGKSA-N 431.371 4.192 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1cccc(C(=O)O)c1 2297578889 LBKIOVMMGNFVOJ-UHFFFAOYSA-N 444.534 4.378 10 10 IICE O=C(O)CCCCCN1C(=O)C(=Cc2cccn2-c2ccc([N+](=O)[O-])cc2)SC1=S 2314489276 RRPAACUBLOVYGQ-UHFFFAOYSA-N 445.522 4.232 10 10 IICE COc1ccc(OCCCOc2c(/C=C3\SC(=S)N(C)C3=O)cccc2OC)cc1 2882657 SNDPVGABKAPNLO-RGEXLXHISA-N 445.562 4.383 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@H]3C=CC[C@@H]32)ccc1O 14459079 GJYFVXFYCNPAAU-HOIFWPIMSA-N 428.554 4.304 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1 33423904 RRCYDNLIQKPQRI-RVDMUPIBSA-N 443.843 4.303 10 10 IICE CCN1C(=O)/C(=C\c2cn(CCOc3ccccc3OC)c3ccccc23)C(O)=NC1=S 34798248 XLKVECIYEUVCOE-JXAWBTAJSA-N 449.532 4.216 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccc(C)cc3)C2=O)ccc1O 210713056 HMPLPWOVCWTNGS-CPNJWEJPSA-N 442.562 4.329 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\NC1=CC=C[C@@H]2C(=O)c3ccccc3C(=O)[C@@H]12 229873525 AAUDKFJWTSXTGY-UCDXKKFVSA-N 437.499 4.265 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(C(=O)c3cc(C)n(-c4cccc(Br)c4)c3C)[C@H]2C1 755202205 KDLZZTUHKTXBRI-HLAWJBBLSA-N 447.373 4.265 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)N(C)Cc2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1 783320172 LZICWBOSIRTONL-NQIIRXRSSA-N 433.911 4.077 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(=O)N2CCCC2)C1 801843188 HUCSONTWECUUGV-OAQYLSRUSA-N 446.599 4.211 10 10 IICE O=C(N[C@@H]1CCCC[C@@H]1c1ccccc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 803131967 VJWULWCOTOMDQP-DHIUTWEWSA-N 432.520 4.357 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC[C@@H](CNC(=O)CC(F)(F)F)C1 804201788 GUGNAPSHOPZLHO-HNNXBMFYSA-N 427.492 4.076 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)cc3Cl)CC2)c(OC)c1 1131804795 PVPZFXVIPOLHBA-UHFFFAOYSA-N 439.737 4.082 10 10 IICE COC(=O)[C@@H](F)CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 1133717194 IXFUUJDJKBLGQQ-UEBLJOKOSA-N 447.510 4.029 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1nnn(-c2ccccc2)c1C(F)F 1135744758 PQRKUMWIEGQZMC-UHFFFAOYSA-N 425.483 4.467 10 10 IICE CSc1ccc(N2C[C@@H](C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CC2=O)cc1 1135964484 CJYVIMKMZUXXIE-FQEVSTJZSA-N 437.609 4.410 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1nc([C@H](C)OCC(C)C)no1 1136968324 JIKWZPZWJABTKI-SFHVURJKSA-N 438.528 4.295 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1F 1144979137 ZUMSSXJHUXFLGJ-VWLOTQADSA-N 441.547 4.337 10 10 IICE C[C@H]1[C@H](c2ccc(Br)cc2)OCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1146538239 CUUBYCVRSRGGPO-YVEFUNNKSA-N 431.290 4.214 10 10 IICE Cc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc(O)c2ccccc12 1150353771 GSYILRHABJEZLP-KRWDZBQOSA-N 425.916 4.002 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3Cl)C3CCCC3)nc12 1167354017 WALOEXJLIKUIEM-UHFFFAOYSA-N 428.920 4.210 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)Nc2ccccc2Sc2ccccc2)cc1 1193293718 QFBWLGVBRAXYQC-UHFFFAOYSA-N 436.533 4.465 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(Cc4ccccc4)CCCC3)CC2)c(OC)c1 1225148478 VAPGQFPYYKMYCZ-UHFFFAOYSA-N 437.584 4.339 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCOc4c3ccc(Cl)c4Cl)C2)cc1 1248489893 IICQKEIUQGHMEV-UGSOOPFHSA-N 436.339 4.404 10 10 IICE CC(C)CCCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1287558324 RUJBZLOIWDEGJQ-UHFFFAOYSA-N 434.588 4.249 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@H]1[C@@H]1CCCO1 1289423171 HDYRXNOTRNSKHK-VXKWHMMOSA-N 425.621 4.437 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 1292931971 ASYCXRSZPFIHRP-QHCPKHFHSA-N 429.564 4.201 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccc(F)cc1 1293846248 PNERUVONCFIQAB-UQBPGWFLSA-N 435.543 4.253 10 10 IICE Cc1cc(C(=O)Nc2cncnc2N2CCCC2)c(C)n1-c1ccccc1Br 1294685855 GNODVTRWZQDIMU-UHFFFAOYSA-N 440.345 4.499 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(OC)c(OC2CCCC2)c1 1295590886 RIISGMBXRFCNRC-UHFFFAOYSA-N 447.915 4.191 10 10 IICE CCn1cc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CCCOC)cn1 1295920255 QIWPSHAWBLIPKJ-UHFFFAOYSA-N 447.587 4.090 10 10 IICE Cc1cc(C(=O)N2CC[C@@]3(CCCN(C)C3)C2)c(C)n1-c1ccc(Br)cc1 1298520334 WXXOKRLRPWGTNR-JOCHJYFZSA-N 430.390 4.415 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)C[C@H]1C 1306459984 DBRDYNJGPSEMCN-RVPHRTOXSA-N 446.599 4.376 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@H](CC)C2 1348205196 JXPTVOQFXZYMHW-GJZGRUSLSA-N 432.586 4.169 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4cc(Cl)ccc4s3)cc2)C1 1356434730 VBZLWUHDHPZSQD-OAHLLOKOSA-N 427.957 4.186 10 10 IICE CON(C)C(=O)c1cc(F)ccc1NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1449162163 IIAGXUIOYSNEQY-UHFFFAOYSA-N 437.471 4.240 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2cccc(F)c2)c(O)c1O 1453116189 QOSMVQFODVUYKD-IEBWSBKVSA-N 444.503 4.068 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@@H]3CC(=O)NC(=O)N3)cc2)c(C)n1-c1ccc(Cl)cc1 1453976490 KDVLGUVKUBWAGR-FQEVSTJZSA-N 436.899 4.270 10 10 IICE O=C(NC[C@@H](O)c1cccc(OCc2ccccc2)c1)c1cc2cc(O)c(O)cc2s1 1465869086 QPDFQFHOFMHMJI-OAQYLSRUSA-N 435.501 4.355 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccccc1Br 1469557695 KKMCXXAHSVQRAG-YESZJQIVSA-N 448.405 4.084 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC[C@H]1CCCCO1 1495638872 HRFBXWRSYLHRLX-NZQKXSOJSA-N 441.620 4.476 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H]3CCC[C@H]32)n1Cc1ccc(N(CC)CC)cc1 1496787478 HMRSQNUQJYQLKT-SIKLNZKXSA-N 438.620 4.080 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)CN(C)C(=O)OC(C)(C)C 1509138253 NLNFSQHHNWKBCI-SFHVURJKSA-N 445.608 4.322 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)c3ccc(Br)c(C)c3)C2)cc1 1528317884 PKWPPPASTFWKAV-QGZVFWFLSA-N 431.374 4.439 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](C[C@@H]1CCCO1)C(F)(F)F 1531503081 JPWKFUZSCBRIEN-XOKHGSTOSA-N 436.421 4.121 10 10 IICE CC(C)(CCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)NC(=O)OC(C)(C)C 1534009236 MSMYMQVNTKPUAC-UHFFFAOYSA-N 436.508 4.484 10 10 IICE Cc1cc(CC(=O)N(C)C2CCN(C(=O)c3ccccc3)CC2)c(C)n1-c1ccccc1 1536890182 VXQBGRYWQWWKFT-UHFFFAOYSA-N 429.564 4.400 10 10 IICE CCO[C@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NCc2ccc(N(CC)CC)cc2)C1(C)C 1542089498 QETINRLZZMUMLH-CPJSRVTESA-N 447.620 4.248 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CCN(C(C)C)C[C@@H]3c3cnn(C)c3)c2C)c1 1544079321 FIYAOORLHPVTGC-CLJLJLNGSA-N 447.627 4.266 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C2=Cc3ccccc3O[C@H]2C(F)F)cc1 1544529208 AXYIVGQTCCHFKX-NZQKXSOJSA-N 442.506 4.370 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCCOC4)n3CCCC(C)C)CC2)cc1 1554958471 BQAMYMLATIWDJO-NRFANRHFSA-N 441.620 4.334 10 10 IICE C[C@@H](NC(=O)c1cccn1-c1cccc(I)c1)c1ccccc1O 1557966479 CZKAUNQUVBRGKJ-CYBMUJFWSA-N 432.261 4.279 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ccc3c(c2)OC(F)(F)O3)cc1 1583252208 AZJMJIWKJOERMS-UHFFFAOYSA-N 440.446 4.130 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3cc(F)cc(F)c32)c(C)n1-c1ccc(Br)cn1 1611533842 LUVOLIURPMTDEU-MRXNPFEDSA-N 448.267 4.393 10 10 IICE Cc1cc(C)n([C@@H]2CCCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)cc3C)C2)n1 1612472635 ASMDBULJMFSSGR-HSZRJFAPSA-N 435.620 4.479 10 10 IICE CCCCNC(=O)NC(=O)CSc1ncc(-c2ccc(Br)cc2)n1CC 1613370904 ZKVKVMOLPKFLPW-UHFFFAOYSA-N 439.379 4.051 10 10 IICE CC(=O)c1ccc(N(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1625061364 OVDOSFCQGWSQDZ-CPNJWEJPSA-N 442.537 4.283 10 10 IICE CC(C)C[C@H](CNC(=O)OC(C)(C)C)CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1625883382 XTUZZJIAZFPMFP-UXHICEINSA-N 447.620 4.278 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2c(C)nc3ccc(Br)cn23)cc1F 1627604161 AVNHPKZYRDVUKZ-UHFFFAOYSA-N 433.325 4.321 10 10 IICE COc1ccc(Br)cc1C(=O)CCC(=O)NCc1cc(Cl)ccc1O 1628666598 GQZMSTUJUGVKMR-UHFFFAOYSA-N 426.694 4.096 10 10 IICE CC(C)CCc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n[nH]1 1631145021 NPQZPKUNHWRFKU-GZTJUZNOSA-N 446.573 4.367 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)c(F)cc1N 1631167271 OKTBRCQPCOKFBM-UHFFFAOYSA-N 446.114 4.301 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](Cc3ccccc3)[C@H](O)C(F)(F)F)ccc21 1633190237 YQMDFWSXWJUUEF-IRLDBZIGSA-N 448.485 4.169 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@@H](C)N(C(=O)c1cc(C)n(-c3ccc(Cl)cc3)c1C)C2 1635117718 ZRKUDWHJNWIJID-OAHLLOKOSA-N 440.931 4.165 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)cc1 1635677197 ZOTHMNODZGCFLR-IYBDPMFKSA-N 447.373 4.431 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC(C(C)(C)CN(C)C)CC2)C1 1636974628 AUHQNKPCBTZJEZ-UHFFFAOYSA-N 438.660 4.234 10 10 IICE CC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(OC)cc1 1645125434 SMZXHPLYZRAUSU-OAQYLSRUSA-N 428.488 4.150 10 10 IICE CC[C@@H]1CN(Cc2ccc(N3CCC(OC)CC3)cc2)CC[C@H]1NC(=O)OC(C)(C)C 1645160968 VSDYSHHQFKUDKK-NFBKMPQASA-N 431.621 4.427 10 10 IICE CCOC(=O)CN(CC(=O)Nc1c(Cl)cc(Cl)cc1Cl)Cc1ccccc1O 1653969620 FHHKGCXZAXFMSN-UHFFFAOYSA-N 445.730 4.356 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccc(Cl)c(C(F)(F)F)c1 1674712023 FZDOXODMOYTBLY-UHFFFAOYSA-N 441.881 4.319 10 10 IICE CCN(CC)CCO[C@H]1CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1675107606 ARUGRTACZJGZMM-DEOSSOPVSA-N 426.605 4.045 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](NC4CCOCC4)C3)cc2Cl)C1 1682024556 UHTFVIIVACRFOK-WIYYLYMNSA-N 449.039 4.019 10 10 IICE CC(C)(C)OC(=O)NCC12CCC(CC1)N2C(=O)NCc1cc(Cl)cc(Cl)c1O 1687272953 OHZKAAFPWKCXJO-UHFFFAOYSA-N 444.359 4.430 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)[C@H]1CCSC1 1693005244 GBZLFVPSRMGVOH-FQEVSTJZSA-N 427.643 4.295 10 10 IICE CC[C@H](C)[C@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1708372071 VPYYXSXAFOFGDU-CVDCTZTESA-N 441.620 4.080 10 10 IICE CC[C@@H](C)[C@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1708380291 ACADNIFFBHSIFR-PTUXOGIPSA-N 441.620 4.427 10 10 IICE CCCC(=O)N[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)C1 1709410592 WQYPICSXRNFIQT-OAQYLSRUSA-N 440.636 4.181 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710612469 YKKGTXOQFORLDQ-SFHVURJKSA-N 427.524 4.105 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3Cc3c(C)coc3C)CC2)cc1F 1711866286 VBXUBEKTPKAWQD-UHFFFAOYSA-N 427.524 4.134 10 10 IICE COC[C@H]1CCN(c2nnc(-c3cccc(OC)c3)n2CCCSc2nccs2)C1 1712260621 YLXRGUDUHRZSRD-INIZCTEOSA-N 445.614 4.065 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H]4OCCC[C@@H]4C3)nnc2C(C)(C)C)cc1 1728383677 RDJDCFAKAKEYOQ-IFMALSPDSA-N 425.621 4.475 10 10 IICE Cc1occc1CN(C)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1751353974 JAKXXLZPZDPGMV-UHFFFAOYSA-N 428.587 4.460 10 10 IICE C[C@@H]1C[C@H]1Cn1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1762764797 KCLHHVIXOUAWLN-NEWSRXKRSA-N 441.576 4.348 10 10 IICE CC[C@H](C)c1nnc(N2CCC([C@@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1763603220 WLAGIJGTVAGBMV-FXAWDEMLSA-N 429.584 4.298 10 10 IICE CCOCc1nnc(N2CCC([C@H]3CCCO3)CC2)n1Cc1ccc(N(CC)CC)cc1 1767830001 WQCTXRGGGNAVMM-HSZRJFAPSA-N 441.620 4.105 10 10 IICE CCCN1N=C(c2ccc(OC)cc2)/C(=C\c2cc(Br)cc(OC)c2O)C1=O 1865671916 HLQNACUYJCZRJH-GZTJUZNOSA-N 445.313 4.212 10 10 IICE COCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCC2=CCCCC2)C1=O 1873165048 FSHDXUXPFATARP-UHFFFAOYSA-N 447.579 4.301 10 10 IICE COCCNCc1ccc(N(CCC(C)(C)O)Cc2ccccc2)cc1Br 1915788964 RPZUHMZBROKCHW-UHFFFAOYSA-N 435.406 4.353 10 10 IICE O=C(OCc1ccccc1)N1C[C@@H](NCc2ccc(Br)cc2O)C2(CCC2)C1 2028695844 YWHAYVBPBYZWEM-HXUWFJFHSA-N 445.357 4.436 10 10 IICE CCN1CCc2cc([C@@H](NC)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044754977 RSVJHOMFXVIURK-ISKFKSNPSA-N 439.600 4.440 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(Cc3ccccc3)CC(F)(F)C2)c1O 2236056726 XGMMEVFZMGGFNG-HNNXBMFYSA-N 441.316 4.163 10 10 IICE COC(=O)C1=C(C)N(C)C(=O)C1=Cc1cc(C)n(-c2cccc(Br)c2)c1C 2294034627 NPGGAKOJVGBFGE-UHFFFAOYSA-N 429.314 4.159 10 10 IICE Cc1ccc(CNC[C@]2(F)C[C@@H](CNC(=O)OC(C)(C)C)C2)c(O)c1Br 2352677138 XCJWGMLMPLXKER-XVDXERDNSA-N 431.346 4.196 10 10 IICE C[C@@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)C1=O 11635436 DRHYTFFWRZTPRP-QMMMGPOBSA-N 446.406 4.228 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@H]3C=CC[C@@H]32)cc1O 14457159 ZOVVGTLONBBCFS-HOIFWPIMSA-N 428.554 4.304 10 10 IICE COc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c(OC)c1OC 28614380 AERPCVOIAWQLNX-UHFFFAOYSA-N 441.455 4.299 10 10 IICE Cc1ccc(N2C(=O)/C(=C\c3cc(Br)ccc3O)C(O)=NC2=S)cc1C 34138524 ZTYWHIBEBXJZFY-DHDCSXOGSA-N 431.311 4.443 10 10 IICE COc1cccc([C@@H](c2c(NC(=O)c3ccco3)sc(C)c2C)N2CCOCC2)c1O 34967071 RTEWFSSOZIPJOO-FQEVSTJZSA-N 442.537 4.346 10 10 IICE COc1ccc(N2CCN(c3ncnc(NCCC4=CCCCC4)c3[N+](=O)[O-])CC2)cc1 40611157 UVPGIQYQTNLLSF-UHFFFAOYSA-N 438.532 4.022 10 10 IICE CCN(C)c1cccc(NC(=O)c2cc(OC)c(OC)cc2I)c1 110146442 LULLELAAIKYAPZ-UHFFFAOYSA-N 440.281 4.017 10 10 IICE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(\C)Nc1cccc2ccccc12 205948012 OOHXBUBNNRRTBA-HZHRSRAPSA-N 444.447 4.400 10 10 IICE CCOc1cc(/C=C\C(=O)NC2CCN(c3ccc(OC)cc3)CC2)ccc1OC(F)F 207257863 GCVOWDBALKWKPQ-WZUFQYTHSA-N 446.494 4.494 10 10 IICE O=C(Nc1ccc(N2CCCC2)nc1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726608967 HHDJSVZVWWDIFS-UHFFFAOYSA-N 431.487 4.074 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)c3cc([N+](=O)[O-])cnc3C)c2C)cc1 730014633 FVVHOBGLLVYCEI-UHFFFAOYSA-N 437.452 4.144 10 10 IICE Cc1cc(C(=O)COC(=O)c2cccn(C)c2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 733502983 GVLCRWUPSAQDEJ-UHFFFAOYSA-N 433.291 4.139 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3CCN(C(=O)c4ccccc4)CC3)c2C)cc1 737991420 YELNFYFQGFBWDQ-UHFFFAOYSA-N 445.563 4.385 10 10 IICE CCOC(=O)c1csc(C2CCN(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)n1 758367997 KWCNKQBRKZHPCP-UHFFFAOYSA-N 442.585 4.009 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C 764545988 CSQHYQUKZVOMPY-GHTZIAJQSA-N 432.609 4.318 10 10 IICE COCC[C@H]1CCCCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 768327240 PTTRBMGURHFGKI-QGZVFWFLSA-N 425.520 4.105 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CC[C@@H](c2ccc(F)cc2)C1 769057443 ULRHOKSOKRFSKX-HSZRJFAPSA-N 436.575 4.057 10 10 IICE Cc1cc(C)c(N2CC[C@@H](N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)c(C)c1 788983946 PMCFIIWKFCQGCF-DENIHFKCSA-N 425.548 4.044 10 10 IICE CCN(C)Cc1cc(O[C@@H]2CCN(Cc3ccc(N(C)C)cc3C(F)(F)F)C2)ccn1 856551693 XWEZMJJGDQXBQE-OAQYLSRUSA-N 436.522 4.271 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(F)cc4)c3C(F)(F)F)CC2)cc1 887511370 BTGASMWNIGYKNX-UHFFFAOYSA-N 448.420 4.001 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@H](C)C2 1124130758 YMVHLCZZOYOVIB-LSDHHAIUSA-N 426.538 4.041 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)CC2)cc1 1125250630 AQEGLTOFZLXTRF-UHFFFAOYSA-N 439.556 4.419 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C(C)(C)Oc3ccc(Cl)cc3)cc2F)CC1 1125976244 RORQMEWLIJUWCP-UHFFFAOYSA-N 433.955 4.095 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)C2)cc1 1131029766 GIJYCAIRJKXIIY-CVDCTZTESA-N 448.485 4.058 10 10 IICE CCN(CC)CCCN(CC)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1138296829 GOFBPCFBECTGTH-UHFFFAOYSA-N 435.410 4.446 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 1138333039 XPNRZVSDHXIOAU-WOJBJXKFSA-N 439.556 4.472 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(F)c(Cl)c(N)c3Cl)cc2F)C[C@@H](C)O1 1141901564 IKANPGXOABEVGT-GHMZBOCLSA-N 444.309 4.397 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cccc2cc[nH]c12 1154344304 BYUWOQGMZRVRPC-LDADJPATSA-N 439.537 4.215 10 10 IICE O=C(CCSCc1nc(O)c2c3c(sc2n1)CCCC3)NCc1c(O)cccc1F 1178409258 CFCBDEGTQLICKJ-UHFFFAOYSA-N 447.557 4.060 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cccc(Br)c2Cl)cc1 1230120497 QZCCAKWCNMNQPW-UHFFFAOYSA-N 440.769 4.389 10 10 IICE CCN(C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)[C@@H](C)Cc1ccc(OC)cc1 1251501080 NHUASMCHSBEYSR-CYFREDJKSA-N 426.605 4.027 10 10 IICE Cc1cc(C(=O)COC(=O)[C@H]2CC(=O)N(C)c3ccccc32)c(C)n1-c1ccc(F)cc1 1251836888 MAJGGOSKUNAESE-NRFANRHFSA-N 434.467 4.109 10 10 IICE C[C@@H](OC(=O)CC1(C(F)(F)F)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1258296344 DMRNFPYBUVHEEB-GFCCVEGCSA-N 445.393 4.065 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCC(C)(C)c3cccc(Cl)c3F)cc2)CC1 1312565099 SCNGSKUZQQWULL-UHFFFAOYSA-N 432.971 4.008 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)C2CC2)cc1 1354143167 XALVYDQDHWXZBD-XXBNENTESA-N 443.950 4.256 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCC[C@@H]3N3CCCC3=O)cc2Cl)C1 1436046288 CLUGFSFGRYJSMI-DSKINZAPSA-N 432.008 4.374 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1449406666 HMIZNQTUXMGKOW-FDDCHVKYSA-N 432.520 4.057 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCN([C@@H](C)c4ccc(Cl)cc4)CC3)C2)cc1 1470772359 JWPDDKKLOTZGNB-RXVVDRJESA-N 442.991 4.016 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1CC 1501187446 XEZJPRYSBRFDHJ-FQEVSTJZSA-N 434.588 4.258 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(N(C)C)nc1 1501451594 HVPRWVGGWUVWTD-UHFFFAOYSA-N 429.572 4.318 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1512599057 WWZUUMDLGGZEIO-JKSUJKDBSA-N 446.671 4.233 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)SC)C1 1519478090 RWVRDAOKODLSEY-FXAWDEMLSA-N 425.602 4.329 10 10 IICE Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)N(C)Cc3ccc(N4CCCC4)cc3)C2)c1 1523554292 SXOZKSBZPNCSGM-HSZRJFAPSA-N 433.596 4.414 10 10 IICE COc1ccc(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)nn2C)cc1OC 1524894713 LJVQXAQPDPRQTO-UHFFFAOYSA-N 436.556 4.221 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4cccc(F)c4)c3C(F)(F)F)CC2)cc1 1526036598 QOQLHDQNTRIVNX-UHFFFAOYSA-N 448.420 4.001 10 10 IICE C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261432 KUBYWLROFFTNCK-CQSZACIVSA-N 442.428 4.315 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccnc2C(=O)OC(C)(C)C)C1 1532213907 ZVYNIZLMCIRGDZ-UHFFFAOYSA-N 448.567 4.397 10 10 IICE Cc1cccc(OCc2nnc(N3CCO[C@H](C)C3)n2CCCSc2nccs2)c1 1542686358 MIMWRNAKWMFJJZ-QGZVFWFLSA-N 445.614 4.030 10 10 IICE C[C@H]1[C@H](C)CCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1544410403 HZRNANUHOYARKI-MSOLQXFVSA-N 429.584 4.125 10 10 IICE C[C@@H]1SCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)[C@H]1C 1545157156 RJCSMMAAIZWUSD-GJZGRUSLSA-N 432.644 4.309 10 10 IICE CCOC(=O)N1CCC([C@@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1556307693 HFCGXLXVGGKYEH-GOSISDBHSA-N 439.556 4.202 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H]2CCOC2)c(C)n1-c1cccc(Br)c1 1558606337 RYTCOHJYUMZTPV-FXAWDEMLSA-N 447.373 4.124 10 10 IICE COc1cccc(CNC(=O)NCC2(c3ccc(Br)cc3Cl)CC2)c1O 1564815533 CSZOZYYUTONSIM-UHFFFAOYSA-N 439.737 4.348 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@@H]3C[C@H](Oc4ccccc4)C3(C)C)C2)cc1 1564962437 KZQOHVGBSCPZNN-FOVJLYNBSA-N 437.584 4.409 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)cc1 1586000058 WXSVNKUNLRHNKU-JOCHJYFZSA-N 427.508 4.486 10 10 IICE CCn1c(=O)n(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c2ccccc21 1586082417 POZYEOPWDYVQIZ-KRWDZBQOSA-N 440.975 4.029 10 10 IICE CCOC(=O)N[C@@H]1CCCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1596063227 OVLOJUXAULMOMH-QGZVFWFLSA-N 448.361 4.207 10 10 IICE C[C@@H]1CC[C@@H](CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)O1 1618369503 WAKGXLWTWBUWRY-HIFRSBDPSA-N 429.318 4.445 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CCc2nccc(C(F)(F)F)n2)CCCC1 1623377666 ACCFYYZGMGHZBU-UHFFFAOYSA-N 446.473 4.039 10 10 IICE Cc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(C)n1-c1ccc(F)cc1 1626055883 KDXHKRXPQMXENH-UHFFFAOYSA-N 443.469 4.278 10 10 IICE O=C(NCCCCCc1ccccc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1626742622 KOYHNARHFLCQLZ-UHFFFAOYSA-N 444.578 4.397 10 10 IICE CCOc1ccc(C[C@H](CNC(=O)c2sccc2-n2c(C)ccc2C)C(=O)OC)cc1 1626803356 WUTJMGZQVBXHAO-LJQANCHMSA-N 440.565 4.316 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnc(F)c(Br)c1 1629968892 MGEOZANBRVYJIC-UHFFFAOYSA-N 432.087 4.114 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3cccc(OC4CCCC4)c3)CC2)cc1F 1631377089 HRFROOGDFNELFN-UHFFFAOYSA-N 426.532 4.437 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCC(=O)c2cncc(Br)c2)c1 1631952439 ZRXJSECOGOOOKL-UHFFFAOYSA-N 426.314 4.173 10 10 IICE C[C@H](CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1634128105 OLCGTGNZGKJWNV-OAHLLOKOSA-N 430.551 4.178 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CC1 1638273345 WFKWVJRKCFTLJI-QGZVFWFLSA-N 435.528 4.372 10 10 IICE Cc1ccccc1NS(=O)(=O)c1cc(C(=O)NCc2c(O)cccc2F)ccc1Cl 1638866678 JASRJPNRXKVJDA-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC[C@@H]([C@@H](O)c3ccc(Br)cc3)C2)c1O 1654609286 SIHQREIZQIHTML-QRWLVFNGSA-N 436.321 4.442 10 10 IICE Brc1cc(CN2CCN(Cc3ccccn3)CC2)ccc1N1CCCCC1 1659280519 NEIKBGHCSVFSBV-UHFFFAOYSA-N 429.406 4.152 10 10 IICE C[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1cccc(OC(F)(F)F)c1 1685090945 OJJJDEUVTQEVCO-YWZLYKJASA-N 438.494 4.314 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(NC(=O)OC(C)(C)C)c3)C2)cc1 1687023835 WMZKCYITDQRICF-IBGZPJMESA-N 440.544 4.120 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1694800032 KUNIAVVVGKTSJV-LRXVAGHRSA-N 429.609 4.050 10 10 IICE CCN(CC(C)C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1695575246 MJJNXNBYUCIDPX-UHFFFAOYSA-N 427.637 4.315 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN3CCCC[C@H]3C2)cc1 1710026696 NKGUJPGNRKWBNZ-QHCPKHFHSA-N 438.664 4.436 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCSC(C)C 1723271694 UJYZLTDTMZWXNK-UHFFFAOYSA-N 431.650 4.091 10 10 IICE CCOCc1nnc(N(C)Cc2cc(C)on2)n1Cc1ccc(N2CCC(C)CC2)cc1 1747038218 FERDGZRDGRMXJN-UHFFFAOYSA-N 438.576 4.032 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763854765 LLGGWDKDMHFBBI-XMSQKQJNSA-N 445.583 4.026 10 10 IICE COc1ccc(Cl)cc1NC(=O)CNCc1cc(Cl)cc(Br)c1O 1860721597 XNAWSLLGLBPERL-UHFFFAOYSA-N 434.117 4.198 10 10 IICE COc1ccc(Cl)cc1S(=O)(=O)Nc1sc2c(c1C(=O)NC(C)C)CCCC2 1871343483 OLFSTMMNDIKKPF-UHFFFAOYSA-N 442.990 4.228 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CC[C@H]2NCc2cc(Br)cc(F)c2O)C1 1962831811 XSPBZPZBGYWMMR-SGIREYDYSA-N 429.330 4.029 10 10 IICE CCCCc1nnc(NC(=O)CCN2C(=O)C(=Cc3ccccc3)SC2=S)s1 2053494130 LRUYEYPEMVNNJG-UHFFFAOYSA-N 432.596 4.111 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1CO 2079952637 KYHJAQQIHSIGOF-KRWDZBQOSA-N 428.314 4.110 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2(NCc3cc(Br)ccc3O)CC2)C1 2097027670 PEYFEHZBWRILJU-OAHLLOKOSA-N 425.367 4.424 10 10 IICE COCCNCc1ccc(N(C)C2CC(OCc3ccccc3)C2)cc1Br 2156445167 LELWVZCQDCYIOJ-UHFFFAOYSA-N 433.390 4.369 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1cc(Br)ccc1I 2225801244 TYAVGHZLQXCXPK-GHMZBOCLSA-N 435.063 4.015 10 10 IICE COc1ccc(Br)c(CNC2CCC(C)(NC(=O)OC(C)(C)C)CC2)c1O 2236051904 ZCXDAQDVUIWHCH-UHFFFAOYSA-N 443.382 4.479 10 10 IICE COc1ccc(Br)c(CNC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C(C)C)c1O 2236054370 HPPXQFHYCOBGHV-XJKSGUPXSA-N 445.398 4.438 10 10 IICE CC(C)Oc1ccc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1Br 2294095310 PGADWBXQAGHHTF-UHFFFAOYSA-N 447.260 4.042 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C=C3NC(=O)N(Cc4ccc(F)cc4)C3=O)c2C)cc1 2297358338 RIWYEYBKNLEYID-UHFFFAOYSA-N 447.466 4.113 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)C2=O)cc1 8644073 IOQMMDSFLHWGEF-RUZDIDTESA-N 433.483 4.192 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1cc(Cl)ccc1O)C[C@H](c1ccccc1O)N2 15830176 VCVCJAGXEZAHKD-GOSISDBHSA-N 443.931 4.224 10 10 IICE biogenic Cc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)c(C)n1-c1ccc2c(c1)OCCO2 28272835 NOPGCASTCSTZAX-UHFFFAOYSA-N 445.563 4.260 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@]2(C)OCCc3sccc32)C1 574845511 CQZAXYXLTFSUMZ-RUZDIDTESA-N 437.609 4.074 10 10 IICE COc1cc(C)c(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1OC 726693548 CYQLKPVLKSAMLZ-UHFFFAOYSA-N 435.471 4.404 10 10 IICE C[C@H](CNC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1F 743555007 OJADPKOVQKOBKY-BZUAXINKSA-N 435.490 4.320 10 10 IICE COc1ccc(Cn2nc(C)c(/C=C3/SC(=S)N(c4cccnc4)C3=O)c2C)cc1 767341005 MOWJPDYOPAIOLQ-RGVLZGJSSA-N 436.562 4.358 10 10 IICE Cc1cn(-c2ccccc2)nc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768893497 SEOAPRVQBWHSNK-UHFFFAOYSA-N 444.583 4.034 10 10 IICE O=C(CC1CCCC1)NC1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769389260 MMNVXZHXYQZLJG-UHFFFAOYSA-N 428.577 4.246 10 10 IICE Fc1ccc([C@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C2CC2)cc1 774389588 KZQJTWJSWYXTPQ-XMMPIXPASA-N 435.522 4.322 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(Cc2ccccn2)n1C[C@@H]1CCCO1 802689046 JGLSTXKHZFCZSD-DEOSSOPVSA-N 446.599 4.070 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N1CCOc2ccccc21 915149701 ZXRJHCNZFFFNSD-LGMDPLHJSA-N 430.576 4.155 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CCC(=O)N(c3cccc(F)c3)C2)cc1 1124884350 DLFCWYISYVMYRG-HXUWFJFHSA-N 449.526 4.457 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC(C)(C)CCNC(=O)OC(C)(C)C)ccc21 1129838528 CTKXHKXJXWCTDD-UHFFFAOYSA-N 431.577 4.328 10 10 IICE CN1CCN(c2ccc(CNC(=O)C3(c4cccc(OC(F)(F)F)c4)CCC3)cc2)CC1 1133123765 WZKRGCRGYZVFJU-UHFFFAOYSA-N 447.501 4.075 10 10 IICE CC(C)Oc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)ccc1[N+](=O)[O-] 1136480607 RRGQGSJANYWQPE-NRFANRHFSA-N 441.528 4.269 10 10 IICE O=C(NCc1c(O)cccc1O)[C@H](Oc1ccc(Br)cc1)c1ccccc1 1156881152 RJVGNBMIBRZJLT-HXUWFJFHSA-N 428.282 4.297 10 10 IICE Cc1cc(CC(=O)Nc2cccc(C3CC(=O)NC(=O)C3)c2)c(C)n1-c1ccc(Cl)cc1 1159016225 DAJRFJNQRYMTJA-UHFFFAOYSA-N 449.938 4.449 10 10 IICE COC1CCN(c2ccc(CN[C@@H](C)c3cc(F)ccc3N3CCC(O)CC3)cc2)CC1 1192557886 ZVUDXGYLNFMKTN-IBGZPJMESA-N 441.591 4.253 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4cccc(Cl)c4)CCC3)CC2)c(OC)c1 1235140584 CQXUZGHORSKRED-UHFFFAOYSA-N 443.975 4.311 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3C[C@H]3c3cccc(Br)c3)C2)cc1 1245988062 LWQKLZOANXNQLB-GQWLDOHISA-N 444.373 4.139 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCOc2cccc(Br)c2C1 1251988497 JYGDREMRHPIPRD-MRXNPFEDSA-N 446.389 4.359 10 10 IICE Cc1cc(C)c(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c(C)c1 1266484855 LNABOLUGSSJKKD-UHFFFAOYSA-N 442.471 4.268 10 10 IICE Cc1cc(CC(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1266756514 SOGXMYPYXHWINF-ICSRJNTNSA-N 425.573 4.398 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3ccc(C)cc3F)c3c2CCC3)cc1 1278288412 KCUARBNDPIVDHQ-UHFFFAOYSA-N 436.531 4.026 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@@H]3C)n2CCCCCO)c(C)n1-c1ccccc1 1289360973 QLHSUGPLUJTOKA-IBGZPJMESA-N 439.629 4.457 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccccc3Cl)n2CCCSc2nccs2)CCO1 1291227288 WNWQDVKVRKODDW-CQSZACIVSA-N 436.006 4.463 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)cc2C1 1292382881 WMDCAFHFWGQIQW-PGRDOPGGSA-N 437.584 4.190 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(F)cc(Br)c3C)CC2)cc1F 1294825578 ZLCMSXKUDJIORY-UHFFFAOYSA-N 425.273 4.007 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)c1 1295774442 JJOKMPMFSCMVCQ-ROUUACIJSA-N 439.556 4.377 10 10 IICE CN(c1nnc(-c2ccc(Cl)cc2)n1CCCSc1nccs1)[C@H]1CCOC1 1298130659 LXJNUFVAOVYEFB-INIZCTEOSA-N 436.006 4.463 10 10 IICE C[C@@H]1CSCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1305237347 LNKMPWCAOUTHEC-GOSISDBHSA-N 445.702 4.410 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c(C)n1-c1ccccc1 1312710784 ZUXKCRSFZFHUQC-UXHICEINSA-N 444.579 4.302 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c(C)n1-c1ccccc1 1312710789 ZUXKCRSFZFHUQC-WOJBJXKFSA-N 444.579 4.302 10 10 IICE CCCOc1ccc(C(C)(C)NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1312834439 YXDPZFXXFNXLFS-UHFFFAOYSA-N 447.526 4.325 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnn(CCOC)c1 1313685058 MJJAFILNVBSEOR-UHFFFAOYSA-N 447.587 4.090 10 10 IICE CN(CC1CCCCC1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1314796505 FDAKWOOWAIODEM-UHFFFAOYSA-N 429.619 4.391 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 1351110889 KVTBEIGISSXLMK-SFTDATJTSA-N 449.595 4.301 10 10 IICE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1438900050 KDEYVPCVXVQIKW-BMRADRMJSA-N 433.474 4.057 10 10 IICE Cc1cc(C(=O)NC[C@@H](C2CCCCC2)N(C)C)c(C)n1-c1ccc(Br)cn1 1440998589 IHYGXJFJDITAGT-FQEVSTJZSA-N 447.421 4.492 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@]1(Cc2ccc(Cl)cc2)CCOC1 1478841590 ZLZKCVXOYCEAFG-HOYKHHGWSA-N 429.992 4.346 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C1 1518588282 ZUMGTORYRQGNSV-HNNXBMFYSA-N 433.578 4.338 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1519289204 ALNIDFVQTVTVQZ-QUCCMNQESA-N 429.609 4.051 10 10 IICE CCCCNC(=O)C1(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CCCCC1 1519994139 YGIHRLILRRCBES-UHFFFAOYSA-N 427.589 4.254 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)C)c(C)n1-c1ccc(Cl)cc1 1520926266 CXHGMRUJOYXEGK-QHCPKHFHSA-N 437.971 4.106 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCO[C@H](c3ccnn3C)C2)c(C)n1-c1ccc(Cl)cc1 1525878392 NKUPKDIVBDIVSD-KNQAVFIVSA-N 426.948 4.060 10 10 IICE Cc1cccc(C)c1CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1526634115 OWFVLLZVERMATF-XDHOZWIPSA-N 428.554 4.350 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](C(C)C)N3C(=O)c4ccccc4C3=O)c2C)c1 1531612578 SXNSICIHGZBBID-DEOSSOPVSA-N 443.547 4.340 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Br 1533991636 CHMKEMUARYFCKT-UHFFFAOYSA-N 442.401 4.220 10 10 IICE COc1ccc([C@H]2[C@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC(=O)N2C)cc1 1535136460 OTDYWCATMGKRFM-RSXGOPAZSA-N 445.563 4.247 10 10 IICE CCOc1ccc(C[C@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1545632279 HFVVAXGIJIPZPV-LAUBAEHRSA-N 430.976 4.404 10 10 IICE CCc1ccccc1-n1cnnc1SCC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1557063453 OUKRKKRZNVGBBY-SFHVURJKSA-N 437.613 4.044 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cccc(I)c3O)c2)CC1 1565860078 UZPSIQPTDZQZHX-UHFFFAOYSA-N 436.293 4.485 10 10 IICE Cc1cc(CC(=O)NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)c(C)n1-c1ccccc1 1566334533 HBKYNTBSCBXENT-OAQYLSRUSA-N 446.469 4.212 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(F)c(NC(=O)OC(C)(C)C)c3)C2)cc1 1584231065 WWBFQEZWFQHLLM-MRXNPFEDSA-N 429.492 4.190 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)CN1CCCCC1=O 1610123605 RRACMJHKQXIPJN-LJQANCHMSA-N 433.474 4.311 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N(C)C[C@H](C)c1nccs1 1611964503 ZKMXCMLNSVQTCC-FXAWDEMLSA-N 440.617 4.249 10 10 IICE C[C@H]1CN(C(=O)CSc2ncc(-c3ccccc3)n2Cc2ccco2)CC(C)(C)O1 1613438297 OYZOMMVINBQECS-KRWDZBQOSA-N 425.554 4.309 10 10 IICE CCCO[C@H]1CCCN(c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)CC1 1615035059 VOKVEYNIFIIQTI-QFIPXVFZSA-N 443.661 4.228 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CC1([S@@](C)=O)CCC1 1617893153 IKVCOBIGYBBGEG-WJOKGBTCSA-N 443.661 4.113 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Br)cc([N+](=O)[O-])c2N)cc1 1623451687 NFCAVBPHGWPUJD-UHFFFAOYSA-N 435.322 4.058 10 10 IICE COCc1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)s1 1627272151 UVIFQRFGFXKFIT-UHFFFAOYSA-N 444.314 4.014 10 10 IICE CCOC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1629013396 NWWQYGBRZPOWGU-IBGZPJMESA-N 447.535 4.336 10 10 IICE Cc1cc(C(=O)N2CCC(C3(C)OCCO3)CC2)c(C)n1-c1cccc(Br)c1 1630968793 XWCXQBOFGDUJQE-UHFFFAOYSA-N 447.373 4.472 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1ccc(O)cc1O)c1cccc(Br)c1 1638353003 YSGZEFZRRXCJAU-UHFFFAOYSA-N 441.281 4.043 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)C[C@H]4CCCS4(=O)=O)n3)c2C)cc1 1650661040 MLMMIOMQYLCXAE-GOSISDBHSA-N 443.594 4.432 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3C3CCCCC3)cc2F)C[C@@H](C)O1 1653176140 ZANJSRBFOJIQPB-YYDVJCTNSA-N 431.596 4.100 10 10 IICE O=C(NCc1cc(Cl)ccc1O)NCc1c(F)c(F)c(Br)c(F)c1F 1686856720 UCXVMYOIYOWCJE-UHFFFAOYSA-N 441.606 4.364 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2cccs2)cc1 1695624929 LNKPYCYPIBIPKW-IBGZPJMESA-N 425.602 4.374 10 10 IICE C=CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCN1CCOCC1 1705811995 PCQLMRNJPHPUCR-UHFFFAOYSA-N 448.615 4.087 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@@H]2[C@H]2CCCO2)cc1F 1711006458 JMFZUDNMKRKCJD-NHCUHLMSSA-N 429.584 4.268 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CC(F)(F)F)CC2)cc1 1730180375 NUTVHWMUXPLZHY-UHFFFAOYSA-N 425.499 4.154 10 10 IICE CC[C@H](C)c1nnc(N(C)C2CCC(NC(C)=O)CC2)n1Cc1ccc(N(C)C)cc1C 1752617446 SQTCAGDOIUJLTC-YTXWROIDSA-N 440.636 4.098 10 10 IICE CC(C)NC(=O)c1nnc(N2Cc3ccccc3[C@@H]2C)n1CCCSc1nccs1 1761210351 VLJLLOUKJDPMOV-HNNXBMFYSA-N 442.614 4.136 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@@H]3CCCO[C@@H]3C(C)(C)C)CC2)cc1 1768703570 OTRRSGLXEMFPAZ-REWPJTCUSA-N 441.620 4.153 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2cc(C)ccn2)sc(C)c1-c1ccc(F)cc1 1860747166 XLYZKTCYATXFQR-UHFFFAOYSA-N 441.484 4.320 10 10 IICE CC(=O)Oc1ccc(C=C2C=C(c3ccc(Br)cc3)OC2=O)c(OC(C)=O)c1 2294728474 IAYOKSBXFAPKSE-UHFFFAOYSA-N 443.249 4.281 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Cl)cc(Br)c2O)[C@@H]2C[C@@H]21 2309984482 YMZBWWSVDWVNGH-CFVMTHIKSA-N 431.758 4.296 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(CCc3ccccc3)C2=O)c1)C(=O)O 2314930435 DCDSYDDSQHGBPM-SFHVURJKSA-N 427.547 4.373 10 10 IICE NC(=O)c1ccc(N2C(=O)C(=Cc3ccc(F)c(Br)c3)SC2=S)cc1 2321570368 ZDAGFDJIELOGSU-UHFFFAOYSA-N 437.315 4.093 10 10 IICE CCCNc1nc2c(C)cccn2c(=O)c1/C=C1/SC(=S)N(C2CCCCC2)C1=O 33436255 YUPUBLDAPQVCIV-GHRIWEEISA-N 442.610 4.359 10 10 IICE Cc1cc(Br)cc(/C=C2\C(=O)NN(c3cc(Cl)cc(Cl)c3)C2=O)c1O 59183930 SLQBECIOEYGIRA-LNKIKWGQSA-N 442.096 4.231 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cccn1-c1ccc(Cl)cc1 59250075 AWHYCUISUFJWDV-PDGQHHTCSA-N 426.259 4.451 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)NC(C)=O 728264377 DHFLLOJGBZQWDC-RUZDIDTESA-N 447.579 4.419 10 10 IICE Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 735828280 MQOFXFVTBQUILE-UHFFFAOYSA-N 443.613 4.180 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(N2CCCC2=O)ccc1F 743807216 DITGOJOINAMJIR-UHFFFAOYSA-N 435.293 4.083 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1cc(Br)ccc1F 804908660 JBRHAUZQEJTEDK-UHFFFAOYSA-N 432.087 4.056 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)/C=C/c3ccc(Br)o3)cc2F)C[C@@H](C)O1 917709420 IADAURYTEFPHDY-CSEUZHBESA-N 437.309 4.124 10 10 IICE CCOc1cc(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)cc(Cl)c1OCC 1084653987 YZEUCBVRYKELBF-LCYFTJDESA-N 448.903 4.108 10 10 IICE CC[C@](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)(C(=O)OC)c1ccccc1 1129793456 VNBSRGPYOZHVMX-HHHXNRCGSA-N 448.563 4.166 10 10 IICE CC1(C)C[C@H](NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CCS1 1134406227 NWELEKKBVVDKIA-DFSFMLJYSA-N 438.615 4.207 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(-c4ccc(OC(F)(F)F)cc4)[nH]n3)ccc21 1136437163 YEZAPFXNHCWLBV-UHFFFAOYSA-N 430.430 4.288 10 10 IICE CCOc1cc(O)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1138206513 KPXXUOLVBBCICU-WQRHYEAKSA-N 446.525 4.160 10 10 IICE CSCC[C@@H](CC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)NC(=O)OC(C)(C)C 1162113436 GWMAJDVOZOJVPQ-HKUYNNGSSA-N 437.650 4.145 10 10 IICE Cc1cc(C(=O)CSc2nncn2CCc2cccs2)c(C)n1-c1ccc(F)cn1 1188558192 ZUCFGYNFVZXLRT-UHFFFAOYSA-N 441.557 4.499 10 10 IICE CN(CC(=O)NCc1ccccc1Cn1cccn1)c1ccc(OCc2ccccc2)cc1 1193460630 LULHTGPNAYPOLW-UHFFFAOYSA-N 440.547 4.263 10 10 IICE CC[C@@H](C)N(CCc1ccccc1F)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229782601 XCPSEWMBMGZZFO-QGZVFWFLSA-N 449.517 4.493 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@H](Cc3ccccc3)C(C)C)CC2)c(OC)c1 1234520199 FQESODLFAOJRFM-NRFANRHFSA-N 425.573 4.050 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2nn3c(c2Br)CCC3)cc1 1264452360 LEMCHWCIYSWEDN-UHFFFAOYSA-N 443.345 4.093 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cnccc1OC 1291442652 IYOLZNXPJIAQNP-LJQANCHMSA-N 434.588 4.480 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)cc21 1291755640 IMICHWSIHVSMPN-IYBDPMFKSA-N 440.519 4.006 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NOCCCC(F)(F)F 1302859159 LRCOCBNDXBMHOX-BENRWUELSA-N 438.518 4.120 10 10 IICE COC(=O)/C=C\c1ccc(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c([N+](=O)[O-])c1 1306983334 WZGAVASGRQAMAC-XKGFZTIGSA-N 447.438 4.463 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@H](CC(C)C)N(C)C)CC2)cc1 1315515249 IHOWXQGSBPFHRQ-JOCHJYFZSA-N 442.652 4.103 10 10 IICE Cc1cc(Br)c(O)c(CNCCNC(=O)c2ccccc2C(F)(F)F)c1 1337519366 LMMQQSZMCCNBBI-UHFFFAOYSA-N 431.252 4.002 10 10 IICE Cc1cccc(CO[C@@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1354783555 ALQMSYGPPSVYER-KRWDZBQOSA-N 436.474 4.072 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(C2CCOCC2)cc1 1354785072 TUXRNXTYTLWNGV-UHFFFAOYSA-N 448.485 4.366 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1ccc(Cl)nc1 1360469209 CXAXMAGHIIKTMQ-DHDCSXOGSA-N 436.917 4.209 10 10 IICE COC(=O)Cc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1440899772 MVPCZQNRMIMQGX-UHFFFAOYSA-N 442.313 4.219 10 10 IICE C[C@H](NC(=O)C1(N(C(=O)OC(C)(C)C)C2CC2)CCC1)c1ccc(N2CCOCC2)cc1 1442414546 VGIWKTQVSTVUNX-SFHVURJKSA-N 443.588 4.023 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSc3ncnc4sc(C)c(C)c34)CC2)cc1 1446415664 LRRNRLYNNVKXGO-UHFFFAOYSA-N 442.610 4.148 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 1451953034 KPSHSACBRQXKSA-JOCHJYFZSA-N 429.442 4.011 10 10 IICE Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NCc3cc(Cl)ccc3O)c2)c1 1452947383 RBIUDTRIQBKBFW-UHFFFAOYSA-N 444.940 4.393 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2=O)cc1 1461076863 LJCJYJAIXIFIAD-VXKWHMMOSA-N 449.595 4.033 10 10 IICE CN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1470449253 KTXSJQCNHSVKDQ-UHFFFAOYSA-N 443.416 4.162 10 10 IICE Cc1ccc(C(=O)C2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)CC2)c(C)c1 1479031193 YSPCQIKIWDVVIY-UHFFFAOYSA-N 449.595 4.069 10 10 IICE CO[C@]1(C)CCCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1504028506 NAQROAKPGNRDBE-RUZDIDTESA-N 425.621 4.303 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3ccc(C)cc3Br)C2)cc1 1526246200 FPUWASAJEWFDTF-QGZVFWFLSA-N 431.374 4.341 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)COc3cccc(NC(=O)C4CC4)c3)c2C)c1 1534760062 QJGMJGFRAGSNQC-UHFFFAOYSA-N 431.536 4.446 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCC(OC(C)C)CC1 1542226639 DUMUFEIGNPCFMX-QHCPKHFHSA-N 441.620 4.336 10 10 IICE CCC(C)(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1545194665 HWWFCFRGQOSIQV-NRFANRHFSA-N 445.583 4.430 10 10 IICE COC(=O)[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)C1 1554527851 PEGCPLRZWOUIIS-HXUWFJFHSA-N 435.572 4.398 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H](OC)C3CC3)CC2)cc1 1554959711 PXUOVXAAGRYDCR-QFIPXVFZSA-N 441.620 4.017 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(Cc2cccc(OCc3ccccc3)c2)CC1 1557876105 NMNOHFJGLJWEPZ-ZRDIBKRKSA-N 444.531 4.034 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccnc(-c3ccccn3)n2)cc1 1565656299 WMIUMYLTTWGKFZ-UHFFFAOYSA-N 439.519 4.460 10 10 IICE CN(Cc1ccccc1O)C(=O)c1c[nH]cc1-c1cc(Br)c2c(c1)OCCO2 1566303958 MBVVKLYQHNZYOE-UHFFFAOYSA-N 443.297 4.193 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1 1585264261 POMYTHCOUDQYAC-HXUWFJFHSA-N 442.625 4.285 10 10 IICE C[C@@H](Cc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1586054453 ISSPTSZTQANQMX-KKSFZXQISA-N 432.406 4.113 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@H]3CN(Cc4ccccc4)C[C@H]3CC(C)C)C2)cc1 1587112104 AZBHMQFHKJOJMA-JQYIIUTOSA-N 435.612 4.184 10 10 IICE Cc1cc(-c2csc(NC(=O)C[C@H]3CCC(=O)NC3)n2)c(C)n1-c1ccc(F)cc1 1609791657 IUJGPCRMMXAWCG-OAHLLOKOSA-N 426.517 4.212 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(CCN(C)Cc4ccccc4)CC3)c2C)c1 1627321789 RSKDXFNUXVSJGS-UHFFFAOYSA-N 444.623 4.292 10 10 IICE COCN1C(=O)CCc2cc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)ccc21 1633223958 XHBIMRHMERVIRF-UHFFFAOYSA-N 445.519 4.350 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)c2)CC1 1633444695 WJHQRJXHFARQRD-UHFFFAOYSA-N 430.552 4.301 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@](O)(CC)c1ccccc1 1634385254 VAPDKYAOJAIHFP-VWLOTQADSA-N 426.557 4.063 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)C[C@H]1CCC(=O)NC1 1638241817 XHSOBWCISQIYLM-DNVCBOLYSA-N 433.474 4.214 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 1646431894 TYMHEZUVWSTUJD-UHFFFAOYSA-N 447.491 4.278 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1Cl)NCc1ccc(N2CCC(OC)CC2)cc1 1647967864 NUWLECJZLDZBMJ-HSZRJFAPSA-N 430.976 4.219 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1)c1ccccc1O 1648891556 BNFHLUKHIVKRTN-AWEZNQCLSA-N 430.913 4.337 10 10 IICE CCOC(=O)c1c[nH]nc1[C@@H]1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1659613649 WXHJIOHJAFTDCG-QGZVFWFLSA-N 446.511 4.430 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H](c4ccc([N+](=O)[O-])cc4)C3)C2)cc1 1682188666 XXKYGJAYFIGPHK-QUCCMNQESA-N 438.528 4.019 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1c(F)c(F)c(Br)c(F)c1F 1682192027 IMVVDKAHHIWKMW-UHFFFAOYSA-N 448.258 4.413 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccn(C)n1 1686035268 ANYZMUBOGCOFIY-GAJHUEQPSA-N 439.991 4.468 10 10 IICE C[C@H]1CN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CCc2ccc(Cl)cc21 1687807832 WIYMDEPQOCTDHK-GAJHUEQPSA-N 429.008 4.380 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@H](C)[C@@H]3CCCC[C@H]32)n1CCCSc1nccs1 1692511979 SSZXXILNVYRYFC-YESZJQIVSA-N 448.662 4.070 10 10 IICE CC[C@H](C)[C@@H](Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C)OC 1693974214 MOMJNQPNJTYVDA-SIKLNZKXSA-N 443.636 4.362 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](N3CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694100701 ZVYQHEVIIVLLIA-AZUAARDMSA-N 428.600 4.110 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2Cc2ccn(C)n2)c(C)n1-c1ccccc1 1724200212 YOVYQKFHXJXWFA-UHFFFAOYSA-N 443.477 4.133 10 10 IICE CCCCN(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1728033039 YGSSGXZDEIPFGJ-HXUWFJFHSA-N 429.634 4.010 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N2CCN(C(C)(C)C)CC2)cc1F 1729329692 LPFUINZXILDCQI-UHFFFAOYSA-N 442.627 4.185 10 10 IICE CCC1(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)CCOCC1 1762542510 LWPLBDYRJQSPOP-UHFFFAOYSA-N 441.601 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@@H](CCOC)C2)cc1 1764936011 VPJSPSOKSHQXHQ-QFIPXVFZSA-N 448.615 4.406 10 10 IICE CN1CCc2nc3ccccc3c(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c2C1 1874179023 IFNYTVFHIDERCW-UHFFFAOYSA-N 447.494 4.250 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C(C)(C)C)c(CN)c2I)cc1C 2080042961 NTEXIRIHMJKKRE-GFCCVEGCSA-N 427.330 4.176 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@]21CNCc1ccc(Br)cc1O 2089363627 VRUXHRNBFICGKS-YWZLYKJASA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](NCc1cc(Br)cc(F)c1O)C2 2193314635 UOMXYRQLWGYAND-TUUVXOQKSA-N 447.320 4.262 10 10 IICE COc1ccc(Br)c(CNCCCN(C(=O)OC(C)(C)C)C(C)C)c1O 2227753038 ZKBSAXDJXPADCT-UHFFFAOYSA-N 431.371 4.289 10 10 IICE COc1ccc(Br)c(CN[C@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)c1O 2236054174 FNQDIQGHGUOIIK-UZLBHIALSA-N 441.366 4.185 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)C3(CCC3)C2)c1O 2236054784 MJJWBYMCRZLTFJ-ZDUSSCGKSA-N 441.366 4.185 10 10 IICE CNCc1ccc(N(C)Cc2ccc(I)cc2)cc1Br 2280272291 GAYKQMAZMMPCIP-UHFFFAOYSA-N 445.142 4.410 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3cccc(OC)c3)C2=O)cc1)C(=O)O 2314929607 PBOIEBDWZUPSRK-QGZVFWFLSA-N 429.519 4.343 10 10 IICE CCOc1ccc(N2C(=O)/C(=C/c3cc4c5c(c3)CCCN5CCC4)C(O)=NC2=S)cc1 2371035 GJRXANRCAKBTGI-RCCKNPSSSA-N 447.560 4.456 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(CC)cc3)C2)sc2c1CCCC2 21449837 LAZMISYKOYTSEY-INIZCTEOSA-N 440.565 4.358 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3coc4ccc(Br)cc34)CC2)cc1 39882607 NKPSTNSZOOJLJD-UHFFFAOYSA-N 429.314 4.095 10 10 IICE CC(C)[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)n1cnc2cc(F)c(F)cc21 109510355 YUMRHDCNCCSENR-QHCPKHFHSA-N 442.510 4.007 10 10 IICE COc1cc(C2(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)CC2)ccc1C 116382495 MCHMYXUBQCMRIF-ROUUACIJSA-N 426.532 4.104 10 10 IICE Cc1ccc(N=Nc2cc(C)ccc2NC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 255379767 FJWWOGGCKSBMAG-ZCVTWQBDSA-N 428.492 4.464 10 10 IICE O=[N+]([O-])c1cc(I)ccc1NCc1cc(Br)ccc1O 692108431 SWGGPHUFNXXNBX-UHFFFAOYSA-N 449.042 4.280 10 10 IICE Cc1noc(CCNC(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 725870154 BBXZGXCXRXYMCK-GOSISDBHSA-N 447.461 4.415 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc4nc(Cl)ccc4c3)cc2F)CC1 730287983 PTILXTZHFOORQK-UHFFFAOYSA-N 426.923 4.099 10 10 IICE CC1CCN(c2ccc(CNC(=O)NCC3CCN(C(=O)c4ccccc4)CC3)cc2)CC1 738472950 VYFOTLPNXQIBPK-UHFFFAOYSA-N 448.611 4.275 10 10 IICE NC(=O)c1ccc(N2C(=O)/C(=C/c3ccc(-c4ccncc4)cc3F)SC2=S)cc1 751527286 SNQGDOQYRFGSLH-UNOMPAQXSA-N 435.505 4.392 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCCC[C@@H]1c1ccc(F)cc1 752897082 ZFYNCUNCJUNSJD-JOCHJYFZSA-N 429.511 4.363 10 10 IICE C[C@H](N[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cc([N+](=O)[O-])ccc1O 756646233 KAQUSHFCIPJBOL-CMPLNLGQSA-N 430.814 4.297 10 10 IICE COc1cc(N2CCN(Cc3nc(-c4ccsc4)oc3C)CC2)cc(OC)c1OC 759878685 MPUASCMITBPRTK-UHFFFAOYSA-N 429.542 4.060 10 10 IICE COc1ccccc1C/C(C)=C/C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768913656 NNIGNMWGHJJJNZ-DYTRJAOYSA-N 433.596 4.032 10 10 IICE C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1Cl 773062217 BMPLWXNWISTZOW-XOBRGWDASA-N 439.781 4.323 10 10 IICE Fc1ccc(C2CC(NCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)C2)cc1 783548762 BQLOWHWMMSSHTR-UHFFFAOYSA-N 435.522 4.117 10 10 IICE Cc1ccc(C(=O)C2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)cc1 920866477 FPTIALAXMQIKKE-FQEVSTJZSA-N 435.568 4.197 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@@H](O)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1137700518 RQFUXIBDIVUDON-DLBZAZTESA-N 445.279 4.384 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-c2nnc(C)o2)cc1 1139585945 YSGYVDBINOADAW-UHFFFAOYSA-N 436.512 4.047 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2)c(C)n1-c1ccccn1 1161275540 FUJZTHRTOQFUFQ-HSALFYBXSA-N 438.572 4.255 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3C[C@H]4CC[C@@H]3N4C(=O)OC(C)(C)C)ccc21 1180486452 DPDBDIRHEJIUHT-CBQOVEMMSA-N 441.572 4.175 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCc3nnc(-c4ccccc4)o3)c2C)c1 1224548225 DLDWFYMKEAZHRI-UHFFFAOYSA-N 429.524 4.494 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccncc3OCCC(C)(C)C)CC2)cc1F 1229601229 ZLPNLKJDLIORBS-UHFFFAOYSA-N 444.551 4.076 10 10 IICE C[C@@H](NC(=O)NCc1cc(Cl)ccc1I)c1ccccc1O 1252909166 VBCKESWFUJUXFD-SNVBAGLBSA-N 430.673 4.211 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CC(C)C)c3ccccc3C)CC2)cc1 1293385572 HBROEGRNNJZQCE-AKNQKSQZSA-N 449.595 4.112 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCCCC[C@H]2NC(=O)OC(C)(C)C)cc1 1300281488 RZSADVMPWHWNTC-FCHUYYIVSA-N 447.620 4.454 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1305483910 YLDVNUOZCLHNAD-HKUYNNGSSA-N 439.583 4.163 10 10 IICE CC[C@H]1CCC[C@H]1Cn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccccc1O 1306306605 KSKFYXXJJOJWEE-ROUUACIJSA-N 434.544 4.094 10 10 IICE CCCn1c(-c2ccc(Cl)nc2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1307017912 VPFLOWSLLIQGHS-UHFFFAOYSA-N 426.952 4.129 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)nc12 1307761540 TVNBTYFCNILAAX-HNNXBMFYSA-N 448.445 4.010 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)C2)cc1C 1312571329 NIATXQAQVGXPQE-JOCHJYFZSA-N 438.572 4.183 10 10 IICE CN(C[C@H]1CC=CCC1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1314796216 WGCYKQBNWBJMFU-INIZCTEOSA-N 429.619 4.110 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CC[C@@H](C)C2 1349304820 JYFYWNXNIMDIEL-KGLIPLIRSA-N 444.528 4.180 10 10 IICE Cc1cccc(Oc2ccccc2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 1358168036 LJZIEMBZNVRVOT-NRFANRHFSA-N 443.547 4.419 10 10 IICE C[C@@H]1CC(F)(F)CCN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1438485994 PIHSLWGZALFUMJ-DYTQJMLRSA-N 428.501 4.063 10 10 IICE CSc1cc(Br)ccc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1440675055 WPPSDXQVAIKGNF-UHFFFAOYSA-N 435.387 4.280 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1-c1ccc(Cl)cc1 1465381056 HHNYUBBUNARQPK-QGZVFWFLSA-N 439.903 4.377 10 10 IICE CC(=O)c1cc(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccc1C 1466957814 KYLPNEBLSLIYIG-UHFFFAOYSA-N 435.446 4.375 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@@H]1CCN(c2ccc(F)cc2)C1=O 1473158048 DOUCMMCMDZOPGU-JOCHJYFZSA-N 439.531 4.409 10 10 IICE CC1CCN(c2ccc(Cn3c([C@H]4CCCO4)nnc3N(C)CC(F)(F)F)cc2)CC1 1493872877 HEROUBJQUWJYBD-LJQANCHMSA-N 437.510 4.413 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@](C)(O)CCC(C)C)cs1 1511518271 JAMTYVGKDOCGOW-QHCPKHFHSA-N 443.617 4.163 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@@H]2CCOC[C@@H]2OC)sc(C)c1-c1ccc(F)cc1 1531749819 NVLAHPQGFZBKBM-RDJZCZTQSA-N 435.517 4.419 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@]12C[C@H](NC(=O)OC(C)(C)C)C[C@H]1C2 1540543546 RMZNHZKUMNIFRW-WZOHSFFVSA-N 427.589 4.329 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)c1 1540549217 GJBRHFIWMMSDCQ-UHFFFAOYSA-N 444.535 4.248 10 10 IICE Cc1cc(NC(=O)c2ccc(N=NC(N)=O)cc2)n(-c2cccc(Br)c2)n1 1542661984 IOSTZLHDGFISEG-UHFFFAOYSA-N 427.262 4.358 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)CC(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543033262 HSYUMGBECLKCRQ-SFHVURJKSA-N 449.647 4.435 10 10 IICE CCc1nc2ccccc2n1CCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1544677089 PJMNFAVJBBMPPY-ROUUACIJSA-N 438.547 4.058 10 10 IICE CCC[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1546955559 YFXWXIIDBYWWQR-FYYLOGMGSA-N 441.620 4.072 10 10 IICE Cc1cc(C(=O)N(CCN2CCOCC2)[C@H]2CCSC2)c(C)n1-c1ccc(Cl)cc1 1556834663 PWSGCRGJRIQCKP-NRFANRHFSA-N 448.032 4.027 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Br)C(=O)NCc1ccc2cccnc2c1O 1557120368 BMNXIYNGUBSECL-NSHDSACASA-N 435.705 4.440 10 10 IICE CN(CCS(=O)(=O)c1cccc(Br)c1)c1ccc(-c2nccs2)cc1 1559897112 YFNSCDRLWPRMHX-UHFFFAOYSA-N 437.384 4.483 10 10 IICE CCCn1cc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cn1 1585834557 HJPLJCOHKFHSTJ-UHFFFAOYSA-N 425.290 4.018 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3cc(Cl)ccc3Br)C2)cc1 1598363868 JUYNAYSOHSISMT-CQSZACIVSA-N 437.765 4.296 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N1CC=CCC1 1611963253 LDJCRHXFQCCAJF-UHFFFAOYSA-N 441.377 4.225 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(N=S(C)(C)=O)cc1 1622327946 GSKJVWPZCGOECM-UHFFFAOYSA-N 425.348 4.176 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(N(C)S(C)(=O)=O)cc3)c2C)c1 1628330718 JVCWXQBMMIOOOR-UHFFFAOYSA-N 439.581 4.037 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(NCCN2CCOCC2)c(Cl)c1 1634012946 ZKPQPLAJURCTTE-UHFFFAOYSA-N 445.991 4.232 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(CC(C)C)C[C@H](O)c3ccc(F)cc3)C2)cc1 1636353648 GBEXXNNDVQIQMY-CYFREDJKSA-N 443.563 4.062 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3sc(C)cc3Br)C2)cc1 1636354510 ZCZVZWVNLCDWER-AWEZNQCLSA-N 438.391 4.153 10 10 IICE Cc1cccc(C)c1[C@H]1CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638483668 AHOYXDIICGKMKF-HSZRJFAPSA-N 434.584 4.052 10 10 IICE O=C(Nc1sc2c(c1C(=O)NCc1c(O)cccc1F)CCCC2)c1cccnc1 1645047942 DXFHDFZCQBVGDP-UHFFFAOYSA-N 425.485 4.049 10 10 IICE Cc1cc(C(=O)N[C@H](C)CN2CCC(C)CC2)c(C)n1-c1ccc(Br)cn1 1645404654 ZJEFTQJOOOEWMZ-OAHLLOKOSA-N 433.394 4.102 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC(=O)N1CCCCc2ccccc21 1648160767 ICKHKOLWYSWVSH-UHFFFAOYSA-N 429.520 4.006 10 10 IICE COC(=O)c1cccc(OCCN(Cc2cccs2)c2ccc3c(c2)OCCO3)c1 1657566760 HAOMNRAZXOOANF-UHFFFAOYSA-N 425.506 4.392 10 10 IICE CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1671424418 BUMRXAQEMSNVHT-NOZRDPDXSA-N 448.611 4.147 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H](CN(C)C(=O)OC(C)(C)C)C1 1683253296 GTTWMGLTAQYSLS-WOJBJXKFSA-N 446.636 4.281 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C[C@H](C)O1 1694950779 QEMXIBISYOEBGW-GVDBMIGSSA-N 437.635 4.162 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CC[C@@H](F)C1 1708396092 AYCMAIBEICBLSX-SESVDKBCSA-N 429.584 4.403 10 10 IICE CCc1nnc(N2CCC(Oc3ncccc3F)CC2)n1CCCSc1nccs1 1727564350 GGLGCBJOJDPVIV-UHFFFAOYSA-N 448.593 4.061 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cscn1 1729831598 QOMOHXPWSVQNIV-QGZVFWFLSA-N 436.585 4.480 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@@H]3CCC(F)(F)C3)CC2)cc1F 1768705245 ZNAGQDAQQOEESO-MRXNPFEDSA-N 437.510 4.311 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCS1 1769752909 BYNCEJYXIBIZFV-HXUWFJFHSA-N 425.602 4.331 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4ccncc4)n3CCCC(C)C)CC2)cc1 1770259465 XTYUGCBDAMXGPJ-UHFFFAOYSA-N 448.615 4.425 10 10 IICE CCS(=O)(=O)c1ccc(O)c(N=c2cc(C(C)(C)C)[nH]c(-c3ccc(OC)cc3)n2)c1 1859833060 ZKOOMJUUCHJZDC-UHFFFAOYSA-N 441.553 4.114 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1ccc(N2CCCCC2)o1 2313560239 NQLZVYQEOFNFGB-UHFFFAOYSA-N 434.279 4.243 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cccc(Br)c1 2313682372 BDVZRUUNVNENCX-UHFFFAOYSA-N 428.286 4.101 10 10 IICE COc1cc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 2314837254 QDIAGCMGBWVRDA-LLVKDONJSA-N 448.953 4.283 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3cccc(O)c3)C2=O)cc1OC)C(=O)O 2314932917 PWXDVCBYTCELQB-OAHLLOKOSA-N 445.518 4.049 10 10 IICE Cc1ccc(CNC(=O)CC2(NC(=O)OC(C)(C)C)CCCC2)c(O)c1Br 2381132835 GUKGANAZBRENKY-UHFFFAOYSA-N 441.366 4.307 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc(Br)ccc1O)N2 14460954 GVDHMLUQYWVWLX-STXHMFSFSA-N 449.370 4.232 10 10 IICE Cc1cccc(C(=O)NN2C(=O)/C(=C/c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c1 40844779 XBLVFZQKVVETBJ-DHDCSXOGSA-N 433.898 4.103 10 10 IICE CCCCOc1ccc(/C=C2\SC(=S)N(CCCC(=O)OC)C2=O)cc1OCC 40938588 HNWPOKSYRHSCBY-JXAWBTAJSA-N 437.583 4.419 10 10 IICE O=C(CN1C(=O)/C(=C\c2cccc(O)c2)SC1=S)Nc1cccc(C(F)(F)F)c1 210673614 ZWDXXTRUYZQCOL-OVCLIPMQSA-N 438.452 4.251 10 10 IICE CC(=C\c1ccccc1)/C=C1/SC(=S)N(CCCCCC(=O)N2CCOCC2)C1=O 211906553 OGRWYVPGNJOZLY-JEEWHQRCSA-N 444.622 4.253 10 10 IICE Cc1c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cnn1-c1ccccc1Cl 735517618 LNXDUTLQPDJKLE-SFHVURJKSA-N 425.916 4.361 10 10 IICE Cc1cc(C(=O)[C@@H](C)OC(=O)/C=C\c2cnccn2)c(C)n1-c1ccc(OC(F)F)cc1 735936734 TXMZDGLTTUOHJI-VCELZJIISA-N 441.434 4.313 10 10 IICE Cc1oc2c(CN3CC(=O)N(C(C)C)C(C)(C)C3)c(O)ccc2c(=O)c1-c1ccccc1 743380314 NENDBCLKEBTWIR-UHFFFAOYSA-N 434.536 4.305 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCC[C@@H]1CCCCO1 754774020 DIGNBMCPGSSMBT-DSDLTIFZSA-N 425.597 4.232 10 10 IICE Cc1cc(C(=O)[C@H](C)OC(=O)/C=C/c2ccncn2)c(C)n1-c1ccc(OC(F)F)cc1 754921556 GUJUYYDMLNUOHF-UFNQUYMESA-N 441.434 4.313 10 10 IICE C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(Br)cc(Cl)c1O 756561559 DXYDNCVVLHAATO-SJKOYZFVSA-N 425.754 4.158 10 10 IICE COc1ccc(N2CCN(C(=O)CSCc3sc(C)nc3C(F)(F)F)CC2)cc1 759052385 ZROBYSUVUBHJSJ-UHFFFAOYSA-N 445.532 4.061 10 10 IICE O=C(NCc1cccc(Br)c1O)Nc1ccc(OCc2cccnc2)cc1 765275701 CDJBATZXWSKJMZ-UHFFFAOYSA-N 428.286 4.450 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)C1 768021935 FBDOKRFPMBQOIT-UHFFFAOYSA-N 446.595 4.008 10 10 IICE CCCN(CCC)c1ccc(CNCc2ccc(N3CCCS3(=O)=O)c(F)c2)cc1 775358319 NAAXBUHCEHKHHZ-UHFFFAOYSA-N 433.593 4.282 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccccc3C)cs2)c(F)cc1Cl 795548974 OBRNRHBGUYABNZ-UHFFFAOYSA-N 440.905 4.498 10 10 IICE CC(C)C(=O)c1ccc([C@@H](C)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 801915723 MWRYIRRAKGXMOO-QGZVFWFLSA-N 426.532 4.045 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C/c2cccc(OCC(F)(F)F)c2)SC1=S 917620045 QNNTTXWFQZVVFV-UVTDQMKNSA-N 433.473 4.474 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C[C@H]2CCC3(CCOCC3)CO2)cc1 1125963831 MMHLQDSSIHBMMR-LJQANCHMSA-N 428.495 4.009 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccnc(Oc4ccc(F)cc4F)c3)C2)cc1 1130827153 URWCNNHNOUAKBR-QGZVFWFLSA-N 425.435 4.169 10 10 IICE Cc1ccccc1Nc1scnc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1136960722 DGLTUWWLMCSCDO-UHFFFAOYSA-N 436.581 4.334 10 10 IICE COc1ccc(N2CCC(NC(=O)c3nccnc3SCc3ccccc3)CC2)cc1 1143190349 CAOCQRSYOXTWOS-UHFFFAOYSA-N 434.565 4.176 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccccc3)CN3CCOCC3)c2C)c1 1147418495 QARBOXNUMVFPTO-VWLOTQADSA-N 445.607 4.384 10 10 IICE C[C@H](Oc1ccc(F)cc1Cl)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348681 QSLCYYSGMNSTAG-SUMWQHHRSA-N 441.330 4.386 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](CC(C)C)C(=O)OC(C)(C)C)cc1 1150446316 XMSWJHUQZRFBRI-JOCHJYFZSA-N 426.557 4.322 10 10 IICE CCNS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)cc1 1152394654 ICRCLJKUZWJVJZ-SFHVURJKSA-N 438.549 4.094 10 10 IICE COc1ccc(N(C)CCN(C)[C@@H](C)C(=O)Nc2ccc(Br)c(C)c2)cc1 1171728744 CDTRDZLGAOSPLA-INIZCTEOSA-N 434.378 4.161 10 10 IICE CCCCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1270432848 RPNGWPIUAVYWAO-UZLBHIALSA-N 438.037 4.284 10 10 IICE Cc1cc(-c2nnc(N(C)C3CC3)n2CCSCCCO)c(C)n1-c1ccccc1 1289352993 KZXAJYKGYDNKSQ-UHFFFAOYSA-N 425.602 4.067 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(Cn2ccccc2=O)cc1 1292106865 ZTGSLMRVWDAJRQ-UHFFFAOYSA-N 439.515 4.047 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2C(=O)N2CCOCC2)c(C)n1-c1cccc(C(C)C)c1 1292758735 SWTGGTFCGCUDTJ-XMMPIXPASA-N 437.584 4.071 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1293586899 LLQBARVVHKRKBM-WWPVKYPJSA-N 441.620 4.418 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)C(C)C)CC1 1294262393 XHOAJXFTDUUNIS-UHFFFAOYSA-N 448.615 4.457 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1 1296599906 IVPCURMLWZEXNE-HXUWFJFHSA-N 425.529 4.036 10 10 IICE Cn1cc(Nc2nnc(CCc3ccccc3)n2CCCSc2nccs2)cn1 1298836277 PUKPOSFMWIUXOI-UHFFFAOYSA-N 425.587 4.179 10 10 IICE Cc1cc(C(=O)N[C@@H]2C[C@H](N(C)C)C23CCC3)c(C)n1-c1ccccc1Br 1301549170 RHBMWLLPDYKXKG-UXHICEINSA-N 430.390 4.459 10 10 IICE C[C@H](NCCC(=O)NC(c1ccccc1)c1ccccc1)c1ccc(N2CCOCC2)cc1 1307643724 VORFTQTYVFEMCT-QFIPXVFZSA-N 443.591 4.470 10 10 IICE CC[C@@H](c1ccccc1OC)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307813333 ZISUYSQXANZFMF-QHCPKHFHSA-N 442.515 4.492 10 10 IICE COc1cc(CCCNC(=O)N(Cc2ccco2)Cc2ccccc2O)cc(OC)c1O 1313089980 RMBFAMVDOJRETP-UHFFFAOYSA-N 440.496 4.053 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)N(C)C)cc1 1313419944 WGQQAPRUFHIJDD-SQJMNOBHSA-N 433.600 4.426 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@H](CC)C2 1348205200 JXPTVOQFXZYMHW-LSDHHAIUSA-N 432.586 4.169 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)cc2)c(I)cc1Cl 1353504814 UVAQONOKLFOJTO-UHFFFAOYSA-N 428.701 4.249 10 10 IICE C[C@H](c1ccccn1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1356590410 PEMZKNXFPCSUHV-VVTMIQRTSA-N 429.542 4.032 10 10 IICE Cc1cc(CN(C)c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)no1 1361063135 FVAPPIJNERQKKO-UHFFFAOYSA-N 436.585 4.286 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1C[C@H](C)C(F)(F)[C@H](C)C1 1361095547 MMQBGZVGLUKMJI-HDICACEKSA-N 440.542 4.490 10 10 IICE Cc1nc2ccnn2c(C)c1CCC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1436049950 YEBALQVHTOXAEL-MRXNPFEDSA-N 439.991 4.485 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)cc1-n1c(C)cc(C=O)c1C 1443529296 CNLNBKHRZDNVPG-SFHVURJKSA-N 439.556 4.296 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 1444636466 IZIWMTYQHMGSQR-MRXNPFEDSA-N 439.903 4.377 10 10 IICE CC(C)(C)N1C(=O)C[C@@H](C(=O)NCc2c(O)cccc2F)[C@H]1c1ccc(Cl)c(F)c1 1456031033 WCGQLJUTNONNLX-ZUOKHONESA-N 436.886 4.328 10 10 IICE CC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)cc1 1466320438 ASUZJQZWGRSBIG-KRWDZBQOSA-N 434.514 4.275 10 10 IICE CC(C)(C)OC(=O)N1CCC(CCNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 1478901955 BDWFOSHIPUGYLS-UHFFFAOYSA-N 431.577 4.107 10 10 IICE CN(CC1CC1)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCCSc1nccs1 1503526891 SJXNTKMRBWVNDA-UHFFFAOYSA-N 430.559 4.338 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCC1(C)C 1516568243 WSSISDMGZKURJQ-FQEVSTJZSA-N 441.620 4.366 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)[C@@H](Cc3ccccc3)C(=O)OC)ccc21 1525821931 KXGZVBSAPHQLJR-FDDCHVKYSA-N 436.552 4.055 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(I)ccc1F 1528924121 JLHBLHXQTUNNNY-CYBMUJFWSA-N 440.300 4.166 10 10 IICE CC1(C)[C@@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1(F)F 1533331762 CYCCXGPIPIAKEB-CNELAYHGSA-N 430.567 4.137 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Oc1cccc2c1OCCC2 1537468876 SXWKQJLXGCICEN-AQTBWJFISA-N 443.521 4.348 10 10 IICE C[C@@H](Cn1ccc2ccccc21)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1541097175 KOXJPUHOZDERCM-KRWDZBQOSA-N 445.485 4.449 10 10 IICE Cc1ccc([C@H]2COCCN2C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)o1 1543586005 VREUPUQTILXPKP-GOSISDBHSA-N 444.329 4.367 10 10 IICE CC[C@H](C)c1nnc(N(C)CCC2CCOCC2)n1Cc1ccc2c(c1)CCCN2C 1545351988 GURIXEIXMVYHLB-IBGZPJMESA-N 425.621 4.475 10 10 IICE Cc1cc(C(=O)Nc2nnc3ccc(Br)cn23)c(C)n1-c1ccc(F)cc1 1556659527 IVGVGBTUDBRHOP-UHFFFAOYSA-N 428.265 4.291 10 10 IICE Cn1c(C(=O)N2Cc3cccc(O)c3C2)ccc1[C@@H]1CCCCN1C(=O)OC(C)(C)C 1558035313 GECNBKOOVKDEPT-IBGZPJMESA-N 425.529 4.349 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(C(F)(F)F)cc1 1566023053 KMJQWYZNNSPZPT-UHFFFAOYSA-N 438.465 4.400 10 10 IICE CNS(=O)(=O)Nc1ccc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1 1568267973 SOJUPVZLXMXJCB-UHFFFAOYSA-N 440.569 4.346 10 10 IICE Cc1ccc(C(=O)N(C)[C@H](c2ccccc2)c2nc[nH]n2)cc1-n1c(C)cc(C=O)c1C 1570180552 PCBNBYQBNSWKSQ-HSZRJFAPSA-N 427.508 4.195 10 10 IICE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1587885780 DIWQYDFWVCXCSX-XMMPIXPASA-N 431.536 4.024 10 10 IICE CC[C@H](C)c1nnc(N(C)CC(=O)NC(C)(C)C)n1Cc1ccc(N(CC)CC)cc1 1613158987 HFXWRLVHBKXRBL-SFHVURJKSA-N 428.625 4.037 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1 1617048617 ZCDOSJMZWVLPOI-UHFFFAOYSA-N 449.642 4.054 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C(C)=C/c3c(Cl)cccc3Cl)CC2)cc1 1625952014 SQLRBYOKGXXIDX-WUKNDPDISA-N 448.394 4.344 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccc1 1628627327 SDGTTYGAAXGACZ-VGSWGCGISA-N 425.573 4.398 10 10 IICE Cc1ccc(C)c(OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1629679123 LJPFLCMHHWCHEU-NRFANRHFSA-N 441.572 4.130 10 10 IICE O=C(NCC1(C(=O)NCc2c(O)ccc3c2CCCC3)CCCC1)OCc1ccccc1 1630277719 GYIAUFORFAFPJP-UHFFFAOYSA-N 436.552 4.374 10 10 IICE CC1(C)[C@@H](c2ccc(F)c(F)c2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1637228875 PXRBURVFKJQQPQ-OAQYLSRUSA-N 443.538 4.404 10 10 IICE CCS(=O)(=O)c1ccccc1Oc1ccc(NC(=O)c2c(F)ccc(O)c2O)cc1 1638394406 WVZGJSFVUXIMMB-UHFFFAOYSA-N 431.441 4.075 10 10 IICE CCOC(=O)C[C@H]1CCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1639234584 MSBVYYYIWQYTNW-QGZVFWFLSA-N 433.346 4.414 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cnnn1-c1c(Cl)cccc1Cl 1643394263 CSYORHDAZGCZJG-UHFFFAOYSA-N 430.339 4.494 10 10 IICE CCOC(=O)[C@@H](c1ccc(Br)cc1F)N1CCOc2cc(N(C)C)ccc21 1653144830 OEOAGNNIKSMKLT-LJQANCHMSA-N 437.309 4.157 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1676549973 QRTSWKGBLZUSIZ-JWQCQUIFSA-N 431.584 4.034 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1683425368 OBDWOFJSKLWFKU-MOPGFXCFSA-N 446.636 4.327 10 10 IICE O=C(NCCc1ccc2c(c1)OC(F)(F)O2)N(Cc1ccco1)Cc1ccccc1O 1683535714 BFCOPKCAAMUQKP-UHFFFAOYSA-N 430.407 4.261 10 10 IICE CC(C)CN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)c(F)c1 1692406132 SCZAGULJCRRCQQ-UHFFFAOYSA-N 443.592 4.047 10 10 IICE CC(C)(C)c1nnc(N2CCC(O)(C(F)(F)F)CC2)n1CCCSc1nccs1 1706110104 URLMHVKIHGRFBF-UHFFFAOYSA-N 449.568 4.108 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCOC(C)C 1726986197 LYBPTBCVSGCDAZ-HXUWFJFHSA-N 429.609 4.332 10 10 IICE CC(C)Cc1nnc(N2CCS[C@H](C(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1761045136 SEDBCEMFKXFQOA-QFIPXVFZSA-N 427.662 4.485 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1766514528 QITHXUZXXBVUIP-QFIPXVFZSA-N 437.588 4.394 10 10 IICE C[C@H](c1ccccc1O)N(C)C(=O)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2010160077 YDRYHTCTSUAGRI-YLJYHZDGSA-N 428.529 4.022 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2(C)CC2)c(C(=O)O)c1I 2079016939 VHMLCVJMFYPGGG-LBPRGKRZSA-N 440.281 4.251 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C3(C)CC3)c(CO)c2I)c(O)c1 2079025241 KWXUJUDADVPNCH-INIZCTEOSA-N 438.309 4.045 10 10 IICE CCOC(=O)c1c(C(F)F)nn([C@@H](CC)c2ccc(OC)cc2O)c1Br 2079879811 JCNBKPRVCVIXSV-NSHDSACASA-N 433.249 4.474 10 10 IICE Oc1c(Br)cccc1CN[C@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156277241 ISUFCJTYSQOJSM-KNQAVFIVSA-N 431.374 4.068 10 10 IICE COCCNCc1ccc(N(C)[C@H]2CC[C@H]2OCc2ccccc2)cc1Br 2156444828 KJLPZILIZROKMM-FCHUYYIVSA-N 433.390 4.369 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1O 2236053579 WYPADIUTVIIDJX-ZIAGYGMSSA-N 443.382 4.289 10 10 IICE CCOC(=O)C1=C(C)N(CCOC)C(=O)C1=Cc1cc(C)n(-c2ccccc2Cl)c1C 2294033999 GNDJOTGWJMTSFX-UHFFFAOYSA-N 442.943 4.457 10 10 IICE COc1ccc(C=C2C(=N)N3C(SCc4ccccc4)=NSC3=NC2=O)cc1OC 2294593334 HRUKXBQILQUJLR-UHFFFAOYSA-N 438.534 4.214 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1C=C1SC(=S)N(CCC)C1=O 2314414667 IGIDYTAIRQICNT-UHFFFAOYSA-N 430.599 4.216 10 10 IICE COc1cc(C=C2C(=O)N(Cc3ccccc3F)N=C2C(F)(F)F)cc(OC)c1OC 2332115094 QMOYPBRWELDRAE-UHFFFAOYSA-N 438.377 4.196 10 10 IICE CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352942886 MDFSGXNGIXVSGB-IAQYHMDHSA-N 429.355 4.019 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H](C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2352945792 BESIJYYOEZEFHG-CYBMUJFWSA-N 429.355 4.067 10 10 IICE COc1ccc(-n2c(C)cc(CNS(=O)(=O)c3cc(Cl)ccc3OC)c2C)cc1 9527514 BHVYVYZOAMVZDN-UHFFFAOYSA-N 434.945 4.243 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459365 FRKPVXNEQIVIQP-OLWVPUELSA-N 428.554 4.304 10 10 IICE C[C@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)/C(=C/C=C/c2ccccc2)SC1=S 15047302 XEQBBNFFVROLEV-NSGXCFGBSA-N 438.530 4.169 10 10 IICE CCCCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 33362743 OAHKYJHFXCNIMK-RGEXLXHISA-N 442.562 4.420 10 10 IICE CC[C@H](C)N1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(CC)c2N2CCCCC2)SC1=S 33468573 JIYPRXFTGAEKJO-QCUKBLKESA-N 444.626 4.038 10 10 IICE CC(=O)NC1(c2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)CCCCC1 576192065 NPFZBZHVZVOOQN-UHFFFAOYSA-N 435.572 4.135 10 10 IICE C[C@@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](c2ccccc2)O1 726720657 ZAABRHCFAIRIPT-VGOFRKELSA-N 445.510 4.428 10 10 IICE CCOc1cccc(CN[C@H](c2cccc(S(C)(=O)=O)c2)c2cc(F)ccc2F)c1O 742385294 VZARCFMSFBWGSU-JOCHJYFZSA-N 447.503 4.352 10 10 IICE COc1cc(/C=C2\SC(=S)N([C@H]3CCOc4ccccc43)C2=O)cc2c1OCCO2 743284435 MRUWETFTNWANRI-CCRNYGKSSA-N 441.530 4.191 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](CN[C@H](C)c3ccc(Br)cc3O)C2)c1 756648934 BIDWIVUGLFOHRW-CABCVRRESA-N 435.362 4.349 10 10 IICE Cc1ccc(C(=O)N(Cc2ccccc2)C[C@H](O)c2cccc(OC(F)F)c2)c(O)c1O 771668912 SKYAJGMTJSPJNZ-FQEVSTJZSA-N 443.446 4.384 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H](C)c2ccc3c(c2)CC(=O)N3)C1 774062953 HFNSUUBPLNOXAE-QGZVFWFLSA-N 431.536 4.207 10 10 IICE Cc1cc(Br)c(O)c(CN[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1 786841592 SEBVDWCMBSTRSU-SFHVURJKSA-N 439.300 4.022 10 10 IICE C[C@H](N[C@H](C)c1ccc(N2CCOCC2)cc1Cl)c1ncc(Br)cn1 815634384 JTZJHJKWXYWELD-OLZOCXBDSA-N 425.758 4.141 10 10 IICE Cc1cccc(-c2nnc3n2C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC3)c1 1124872649 POBSFMRMPPESFR-JOCHJYFZSA-N 431.584 4.319 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(SC(F)(F)F)nc3)cc2F)C[C@@H](C)O1 1125187974 MIDQHAGMSXQZGU-CHWSQXEVSA-N 443.466 4.376 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC[C@@H](C)N(C)Cc2ccccc2)C1 1126867651 FPWUVBHJFCWPKE-JOCHJYFZSA-N 446.639 4.435 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccsc2)NC(=O)OC(C)(C)C)cc1 1136903626 IMINRGLHAHTIOA-XUVXKRRUSA-N 429.586 4.300 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)NCc2ccc(O)c(O)c2)C1 1137443698 ZQDNLWGVZHVTPO-MSOLQXFVSA-N 446.931 4.018 10 10 IICE CC(C)CCN1CCC(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CC1 1148808866 LOUHEDIDCFGVIS-UHFFFAOYSA-N 438.660 4.282 10 10 IICE CCOC(=O)[C@H](CC1CC1)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1154182950 MGWZMTFXKFABAT-SFHVURJKSA-N 433.346 4.318 10 10 IICE COc1ccc([C@H]2CN(C(=O)c3sccc3-n3c(C)ccc3C)CCO2)cc1OC 1159571014 YAZJMGAJBDDBLM-OAQYLSRUSA-N 426.538 4.387 10 10 IICE CN(C)c1ccc([C@@H](CNc2ncc([N+](=O)[O-])cc2Cl)NC(=O)OC(C)(C)C)cc1 1163224264 GPUNGGQIFPFOSN-QGZVFWFLSA-N 435.912 4.387 10 10 IICE CC(C)(CCc1ccccc1)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1167325831 GEUIVPJCHXSFLO-UHFFFAOYSA-N 426.516 4.402 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@H]3c3cccc(C(F)(F)F)c3)nc12 1193704885 ZTUVELJWBAAVHO-SFHVURJKSA-N 448.445 4.358 10 10 IICE COc1cc2c(cc1OC)[C@@H](NC(=O)NCc1cccc(Br)c1O)CCCC2 1246270420 SQYZJIAVNOGZLT-KRWDZBQOSA-N 449.345 4.439 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCc4cc(Br)cc(C)c4C3)C2)cc1 1252924797 UKVKELNAMCRNFM-SFHVURJKSA-N 444.373 4.113 10 10 IICE CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1287659685 APEWPNNAVXAWIS-CRAILRFSSA-N 425.598 4.277 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](CN(CC)CC)C2)n1Cc1ccc2c(c1)CCCN2C 1291501778 VZOPDHDKTPLZRP-IRLDBZIGSA-N 438.664 4.390 10 10 IICE CC[C@@H](C)CN(CC)c1nnc([C@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1291755506 YYYQVYZSWKHKAI-KNQAVFIVSA-N 425.621 4.475 10 10 IICE CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)N2Cc3cccc(O)c3C2)CC1 1302786906 LAYKPHVDIMWFAV-UHFFFAOYSA-N 437.540 4.116 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)N[C@@H](C)c2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1312364909 JRPAZZGNZBBDNG-NVMYHKGLSA-N 433.911 4.296 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3ccc(OC(F)(F)F)cc3)C2)cc1 1312903354 XVJZKSKZXFVTAM-QGZVFWFLSA-N 437.462 4.262 10 10 IICE COc1cccc(CNC(=O)N[C@@H]2CC3(CCC3)Oc3ccc(Br)cc32)c1O 1313320266 NWPYGGNULKBEOP-MRXNPFEDSA-N 447.329 4.409 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@]3(C)CCCS3(=O)=O)n2)c(C)n1-c1ccc(F)cc1 1357975627 PFVGSVAPEQUNBE-NRFANRHFSA-N 447.557 4.263 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c(Cl)c1 1436973064 UNFUIMPURQJHOQ-HNNXBMFYSA-N 431.920 4.173 10 10 IICE CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1442312845 GVNDIRPZAJMRDZ-PXNSSMCTSA-N 425.573 4.260 10 10 IICE COC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1N 1448579948 AJWYCXOKLRUTGA-UHFFFAOYSA-N 442.313 4.478 10 10 IICE C[C@@H]1COCCN1C1CCN(C(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CC1 1450523862 LLULXJCWLVAJQL-LJQANCHMSA-N 435.572 4.493 10 10 IICE COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 1459178911 RBPCCGHTAKTGCP-HTAPYJJXSA-N 441.572 4.074 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C[S@](=O)c2ccc(Cl)cc2)cc1 1464073637 MEABOOUXTQANBK-LJAQVGFWSA-N 430.957 4.336 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cc2ccccc2o1 1466912364 KFPQBCQNXSAKSA-ZDUSSCGKSA-N 442.518 4.492 10 10 IICE COc1ccc(CNC(=O)N[C@H](Cc2cccc(Br)c2)CC2CC2)c(O)c1 1478456111 KPAJDLFHTKPHRY-SFHVURJKSA-N 433.346 4.374 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2CSC)n1Cc1ccc(N2CCC(C)CC2)cc1 1503091771 QUBWAFKUABOMSD-JOCHJYFZSA-N 443.661 4.431 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(C)OC[C@@H]1C 1503928230 DBDQEAQIRWCRAK-OALUTQOASA-N 437.588 4.391 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC[C@H]3C[C@H](F)C3)CC2)cc1 1518306803 APYLJKSGDNCGDD-MXVIHJGJSA-N 429.584 4.340 10 10 IICE CSC1(Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CCOCC1 1520007032 VBTZHLILCFQKLX-UHFFFAOYSA-N 430.618 4.265 10 10 IICE COc1ccc(N2CCCN(C(=O)c3c(C)ccc(Br)c3OC)CC2)cc1 1526237864 TZRQOFDZYKTMSY-UHFFFAOYSA-N 433.346 4.127 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cnc(-c4ccccc4F)s3)cc2F)CC1 1528702126 YWSNTRJKYLQFGT-UHFFFAOYSA-N 442.535 4.160 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C[C@H]3COCCN3C(=O)OC(C)(C)C)c2C)c1 1531612278 NWCIEQFTHAHITH-QFIPXVFZSA-N 441.572 4.045 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(OCc4ccccc4)cs3)CC2)c(OC)c1 1543632003 IOPLFMTZRXWNJE-UHFFFAOYSA-N 438.549 4.307 10 10 IICE CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1544402306 QZKHHSOBLHKWBW-NRFANRHFSA-N 436.512 4.438 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1oc(C2CC2)nc1C(F)F 1545632768 VMDXXYPQEYBROF-CQSZACIVSA-N 425.863 4.243 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(F)F 1555264400 HCJDWGDNCZQHOE-QGZVFWFLSA-N 435.494 4.429 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c(C)n1-c1cccc(C(C)C)c1 1556288614 BNVQTZJSIKFTJJ-GOSISDBHSA-N 435.490 4.358 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](CC)Oc1ccccc1F 1556426605 UBIJKGBCRXLKCJ-OAQYLSRUSA-N 430.520 4.372 10 10 IICE CCOC(=O)[C@]1(COC)CCCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1567940051 YWEJHFGJNANASQ-HSZRJFAPSA-N 432.948 4.179 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CCCCN1C(=O)OC(C)(C)C 1583853545 QFPHGGQNQVUDSU-FQEVSTJZSA-N 439.556 4.426 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)CCCc2nc3ccccc3[nH]2)cc1 1583933475 HWGCSUXIXBSZSG-UHFFFAOYSA-N 428.536 4.417 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(Cn3ccc(C(F)(F)F)n3)cc2)cc1 1585450681 WRYHQSFDZHCQEV-UHFFFAOYSA-N 446.473 4.167 10 10 IICE Cc1cc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccc(Cl)cc1 1587443876 LZHUZGGEVSYHFO-QHCPKHFHSA-N 437.971 4.378 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2csc(CCNC(=O)OC(C)(C)C)n2)cc1 1587460318 VEULGOWKPRYSIW-UHFFFAOYSA-N 446.617 4.329 10 10 IICE COC(=O)C1(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCCCC1 1596900421 NNTFYDXONFIKDC-UHFFFAOYSA-N 433.346 4.462 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CCN2CCCCC2)sc(C)c1-c1ccccc1 1619307953 GDPJJTHZXOQWSA-UHFFFAOYSA-N 443.613 4.256 10 10 IICE COC(=O)CCC1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1621401665 QKTNLMMFZNBULK-UHFFFAOYSA-N 448.361 4.057 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1626722731 HBVDRPKGNPKILS-WIYYLYMNSA-N 429.605 4.145 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C 1630181023 RCXJHBNZOCVQEG-XXBNENTESA-N 425.573 4.059 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CSCc1ccc(Cl)cc1 1631531237 LIHGOLZZHNVDPJ-UHFFFAOYSA-N 428.337 4.134 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2 1633340553 JCDUIBQSDQHPIH-UHFFFAOYSA-N 429.586 4.346 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1c(O)cccc1O)c1cccc(Br)c1 1635842977 DFXVCQRKRMAEJG-UHFFFAOYSA-N 441.281 4.043 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1638244242 SHPGRGJHUGXXNR-AWEZNQCLSA-N 434.462 4.040 10 10 IICE CC(C)(NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc2ccccc2c1 1638484088 HALIUJDYBQXUNT-UHFFFAOYSA-N 444.579 4.276 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F 1639341618 WVNPISSHGGFOLB-XXBNENTESA-N 429.555 4.266 10 10 IICE COC(=O)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1cccc(F)c1 1639436863 FGNFYHBENWYFEB-GOSISDBHSA-N 436.439 4.409 10 10 IICE Cc1cnc(OC2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)nc1 1644115966 AIMJOARFDGKHLM-UHFFFAOYSA-N 438.959 4.458 10 10 IICE CC(C)Oc1ccc(N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1645278953 VWTNFQHDRFVTNN-UHFFFAOYSA-N 428.488 4.324 10 10 IICE CC(=O)c1cc(F)cc(CN[C@@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c1O 1658788512 CBMCXBMYIJMXHU-XUZZJYLKSA-N 439.458 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1C 1673745492 VCOQFLNPKKQQDA-FHWLQOOXSA-N 432.609 4.031 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CC1(N2CCSCC2)CCCC1 1706379033 APQUCDFSIOFHAF-UHFFFAOYSA-N 443.661 4.180 10 10 IICE CCc1nnc(N2CC[C@H](OCc3ccccc3)C2)n1CCCSc1nccs1 1727564943 PGGKVTJMTPTCLY-SFHVURJKSA-N 429.615 4.275 10 10 IICE CCOCc1nnc(N2CC(C)(C)OC(C)(C)C2)n1Cc1ccc(N(CC)CC)cc1 1747059257 HYXUVJXJCGAXIT-UHFFFAOYSA-N 429.609 4.103 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC(OC(C)(C)C)CC1 1751432794 MWVFZPDVCPVTHT-JOCHJYFZSA-N 441.620 4.336 10 10 IICE CC[C@H](C)[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1)OC 1763437409 NFLBJHHHZNDFSF-FDDCHVKYSA-N 437.588 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1766614649 OAEZHYKUFKXKIG-UGKGYDQZSA-N 441.620 4.418 10 10 IICE CN(C)c1ccc(Cn2c(Cc3cn4ccccc4n3)nnc2N(C)CC(C)(C)C)cc1F 1766911567 AXJMNOAZXSDWBX-UHFFFAOYSA-N 449.578 4.252 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CCSC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1767763135 FQJDSWKQOGCTQF-OAQYLSRUSA-N 429.634 4.041 10 10 IICE CCCN(CCC)C(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860344754 DHXPOFKXTBWJFZ-UHFFFAOYSA-N 428.536 4.223 10 10 IICE CC(C)[C@@H](C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1)N1C(=O)c2ccccc2C1=O 1865901530 GOFYHJQCHPHHLB-QFIPXVFZSA-N 429.476 4.320 10 10 IICE C[C@@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010390315 BPELSOIYJUJUEI-VQIMIIECSA-N 431.537 4.034 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C3CC3)c(CN)c2I)c(O)c1 2079006787 IDKXLDDMRHRGOL-QGZVFWFLSA-N 425.314 4.083 10 10 IICE COc1ccc(Br)c(CN[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)c1O 2220461993 FIPRAUUJSNELQR-NRFANRHFSA-N 449.345 4.054 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@@H](NCc1cccc(Br)c1O)C2 2232282625 QFAWNNVFZYQQAK-ZFZWDLNGSA-N 425.367 4.326 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1O 2236053992 CUHGDJCKFHSOCU-AEFFLSMTSA-N 433.390 4.411 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)cc1 2296943349 NZHBUYHJVBOUPZ-UHFFFAOYSA-N 429.476 4.078 10 10 IICE CNCc1cnc(Sc2cc(I)ccc2Br)s1 2300804111 WVYGEGFDBMNNBT-UHFFFAOYSA-N 441.157 4.381 10 10 IICE O=C1C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)SC(=S)N1Cc1ccc2c(c1)OCO2 2323756287 GWWCRIRLEPXSEU-UHFFFAOYSA-N 434.882 4.378 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1cc(Br)ccc1O)[C@@H]2F 2333284370 GPUMEUHDJGZBDH-AESZEHBQSA-N 429.330 4.123 10 10 IICE Cc1ccc(CNC[C@@H]2[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)c(O)c1Br 2352944279 FXUZSQWHUKZVRG-XHSDSOJGSA-N 425.367 4.056 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)OC(C)(C)C)c1O 2358678272 SBCNLKOBROFBCV-ZENOOKHLSA-N 441.366 4.041 10 10 IICE COc1ccc(Br)cc1/C=C1\C(=N)N2N=C(c3cccs3)SC2=NC1=O 101431397 XNVJYOUKVFSSMJ-IBGHGUAHSA-N 447.339 4.187 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC=C(c3ccc(O)cc3)CC2)C1 435618523 UCMXQNRABYTODA-UHFFFAOYSA-N 429.564 4.429 10 10 IICE Cc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1C(=O)NC(C)C 435857271 SGYIIVNCGQABNQ-UHFFFAOYSA-N 446.595 4.493 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526176228 TZHDTQLIVIGKSN-JOCHJYFZSA-N 437.423 4.311 10 10 IICE COC(=O)c1cccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526469022 LFJJZNJXYZSBAS-NRFANRHFSA-N 435.407 4.081 10 10 IICE CCOC(=O)c1ccccc1N1C(=O)C(O)=C(c2cccs2)[C@H]1c1ccc(O)c(O)c1 526527235 ONIQJZGQGIXMIT-HXUWFJFHSA-N 437.473 4.393 10 10 IICE CCOC(=O)c1sc(NS(=O)(=O)c2cccc3ncccc23)nc1-c1ccccc1 727244841 IWCCAZKIINAWON-UHFFFAOYSA-N 439.518 4.336 10 10 IICE CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 729174923 QYZVQACDEWZYKR-VWLOTQADSA-N 433.596 4.243 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1nc2ccc(F)cc2[nH]1 785875919 JLBNIGZQSOZLKW-XNTDXEJSSA-N 446.554 4.384 10 10 IICE Cc1nn(Cc2ccc(F)cc2)c2n[nH]c(NC(=O)c3cc(C)n(-c4ccccn4)c3C)c12 917180136 KZZFAEZGTGYKOR-UHFFFAOYSA-N 443.486 4.310 10 10 IICE C[C@H](NC(=O)NCc1ccccc1CN1CCCCC1)c1ccc(N2CCOCC2)cc1 920871675 NBXDVKPEEKVYMB-NRFANRHFSA-N 436.600 4.070 10 10 IICE CO[C@@H](C(=O)Nc1c(-c2ccccn2)nc2ccccn12)c1ccccc1Br 1126783652 LYVGSZPTRZAORQ-LJQANCHMSA-N 437.297 4.485 10 10 IICE CC(C)(C)c1cnc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1127622540 WEKLVYXELSMJLG-XNTDXEJSSA-N 448.541 4.446 10 10 IICE Cc1cc(C(=O)COc2ccc(C(N)=O)cc2F)c(C)n1-c1ccc(Br)cc1 1166950391 IJDGGQRRWQVJMD-UHFFFAOYSA-N 445.288 4.356 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1180410528 RIIHEYVKYTZWIJ-ADYPVZHUSA-N 433.335 4.410 10 10 IICE COc1ccc(N2CCN(c3c([N+](=O)[O-])cnc4cc(Br)ccc34)CC2)cc1 1185744136 CCWFCNCEWJHTSW-UHFFFAOYSA-N 443.301 4.241 10 10 IICE COc1ccc(N(CC(=O)N[C@@H]2CCOc3ccccc32)Cc2ccccc2)cc1OC 1198838121 STEQNPBRDLFKQR-JOCHJYFZSA-N 432.520 4.350 10 10 IICE O=C(NCc1cccc(Br)c1O)NCc1c(Cl)cccc1OC(F)F 1234633958 NYIUWCNXWFKMBN-UHFFFAOYSA-N 435.652 4.409 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(c2cccc(Br)c2)C1 1246371857 NUWYLSFIXMWLTD-IBGZPJMESA-N 445.405 4.326 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(C(=O)c4ccco4)c3)cc2F)C[C@@H](C)O1 1264688949 FAWUWUMBOPRFOF-CALCHBBNSA-N 436.483 4.193 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1266756516 SOGXMYPYXHWINF-UYAOXDASSA-N 425.573 4.398 10 10 IICE Cc1cc(C)cc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1293792869 KQXRFXVUCBTARF-QFIPXVFZSA-N 425.573 4.294 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C 1297793009 JJWQVVWFXCSLBA-ZQHDKMAOSA-N 425.602 4.110 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC(F)(F)C1 1302575818 RPMKCSGMQHMETF-IBGZPJMESA-N 433.547 4.310 10 10 IICE CN(CC(C)(C)C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1314713929 UEOWJQAKRQXBPW-UHFFFAOYSA-N 425.621 4.378 10 10 IICE COc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc(OC)c1 1352878645 UEYSAPRSHGMCLX-NVMNQCDNSA-N 446.525 4.073 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)cc1 1354389993 ZWOPLSZGXXEAMH-QFIPXVFZSA-N 431.536 4.037 10 10 IICE Cc1cc(CCNC(=O)C[C@H](C)n2cc(Br)cn2)c(C)n1-c1ccccc1 1438180005 UGGUQTLSLLATLD-HNNXBMFYSA-N 429.362 4.363 10 10 IICE Cc1ccc(CN2CCO[C@@H](CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)cc1 1454866320 GBGVXPYRXRIKNS-DEOSSOPVSA-N 431.580 4.342 10 10 IICE CC/C(=C/C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(OC)cc1 1456126836 GQYMIDXURCRJAH-JZJYNLBNSA-N 425.548 4.086 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1nnn(-c2ccccc2Br)c1C 1464509219 YLLLZGFOUYLAPA-UHFFFAOYSA-N 442.361 4.067 10 10 IICE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1466399247 PCSGJALXPIZLSW-UTKZUKDTSA-N 428.529 4.022 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1470539492 NLSRNFGOZUYFKZ-MJGOQNOKSA-N 443.544 4.390 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC([C@H](O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])c1 1472803278 CJZDOINICPYBCL-RJOTYRNVSA-N 432.423 4.009 10 10 IICE C[C@@H](CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1478449652 HQKHSCWPJKHJHQ-INIZCTEOSA-N 435.490 4.269 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CCN(CC(F)(F)F)CC1 1495137519 PRBAHWVGOBRCAM-INIZCTEOSA-N 439.526 4.408 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(N(C)C)CCC1 1495639078 KNTRWGWBFIZHRF-FQEVSTJZSA-N 440.636 4.001 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)C[C@@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1496759620 CUWZUJZBOUCWIS-APWZRJJASA-N 444.599 4.075 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c(-c2ccccn2)nnc1N(C)Cc1ccccc1O 1500532702 UYCPGJMAKZDXBI-OAQYLSRUSA-N 434.588 4.337 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCC(COC)CC2)cc1 1501838417 LLYQBUFGBLPCSJ-UHFFFAOYSA-N 448.615 4.406 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@]3(CCCOC3)C2)cc1 1515532600 RPXBWRRBEVOTLD-VWLOTQADSA-N 425.621 4.378 10 10 IICE COCC1CCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC1 1518888982 GQRBYYRTBSXJLP-QGZVFWFLSA-N 437.635 4.021 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CCCCC[C@H]3NC(=O)OC(C)(C)C)C2)cc1 1529411924 NVVQKVOQMIAXNJ-YUXAGFNASA-N 445.604 4.111 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)sc2nc(C(F)(F)F)ccc12 1533683398 IJSJPPFLMJKLQN-UHFFFAOYSA-N 448.514 4.305 10 10 IICE Cc1ccc(NC(=O)c2cccc(O)c2O)cc1S(=O)(=O)Nc1cccc(Cl)c1 1540277218 BFIALKPJFSBOKE-UHFFFAOYSA-N 432.885 4.113 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(Cn2cc(Br)cn2)s1 1540729007 DYSLJAYVNSUPNE-UHFFFAOYSA-N 445.386 4.286 10 10 IICE Cc1cc(CNC(=O)OC(C)(C)C)oc1C(=O)NCc1ccc(N2CCSCC2)cc1 1541080114 CRFAKQUYVBISSG-UHFFFAOYSA-N 445.585 4.096 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 1542473481 WRKCHJPHWQWRMA-NRFANRHFSA-N 427.545 4.098 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1542490028 AVLQDIKLGKQFNU-UXHICEINSA-N 430.980 4.199 10 10 IICE CC1CCN(c2cccc(NC(=O)c3ccc(I)cc3O)c2)CC1 1544209386 FEAJFYMQMBJVOL-UHFFFAOYSA-N 436.293 4.485 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccn2)cc1 1547444951 XASMGKSINCZHAJ-UHFFFAOYSA-N 427.556 4.266 10 10 IICE C[C@H](NC(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1556261070 ZCPQUHCOGDAJCF-RXVVDRJESA-N 425.573 4.456 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCCCC[C@@H]1NC(=O)OC(C)(C)C 1568737665 IAISXSKUCDUYOY-SJORKVTESA-N 425.566 4.358 10 10 IICE CCOC(=O)c1cccc(NC(=O)c2cccc(NC(=O)c3ccc(C)c(O)c3O)c2)c1 1569945270 ZQENDFKMJROTBR-UHFFFAOYSA-N 434.448 4.088 10 10 IICE O=C(NC1CCCCC1)OC[C@H]1CCCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1570019022 GHGRYBGYGPQXAF-MRXNPFEDSA-N 432.542 4.366 10 10 IICE Cc1cc(CC(=O)N[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c(C)n1-c1ccccc1 1570531981 VMDWDRSKKGZDMN-RTWAWAEBSA-N 425.573 4.445 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)N(C)CCN(C)c2ccc(OC)cc2)c1C(F)F 1585450763 YIZPSWKOLZZNPJ-UHFFFAOYSA-N 434.409 4.076 10 10 IICE O=C(CCc1cccc(OC(F)F)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595583934 KGHSTRGNRVJBSU-SFHVURJKSA-N 438.902 4.360 10 10 IICE CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1624069957 MMSFJCHGLKZWEK-AREMUKBSSA-N 442.563 4.247 10 10 IICE Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)NCc2ccc(N3CCCC3)cc2)cc1 1624321675 GVMXQGVYVVCPRD-HXUWFJFHSA-N 441.373 4.199 10 10 IICE COc1ccc(Cn2nnc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c2C)cc1 1627006563 RCEVHYNBFMOUFB-UHFFFAOYSA-N 447.583 4.342 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C)n(-c2ccon2)c1C 1634385233 URDWHSSBLAYHBM-UHFFFAOYSA-N 438.528 4.084 10 10 IICE O=C(N[C@@H]1c2ccccc2CC[C@H]1F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1636613441 OUHKWSQOVBTPNQ-YLJYHZDGSA-N 446.525 4.010 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3cccc(F)c3)C[C@@H]2C)cc1 1638376008 JDHFEQXHBDAWHR-IBGZPJMESA-N 433.527 4.326 10 10 IICE CCC1CCC(N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C2CC2)CC1 1652305784 XUJKEGNFCFHZHH-NDUMYTTKSA-N 445.623 4.489 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N([C@H](C)c4ccccc4)C3=O)c2C)c1 1652595848 QXWKVPIUBQGUJT-GOSISDBHSA-N 443.503 4.137 10 10 IICE COc1cc(Br)cc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)c1 1675900195 BJFHQBPQJDDYDS-UHFFFAOYSA-N 434.117 4.470 10 10 IICE CCN(CC)C(=O)OC[C@H]1CCCCN1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1683254369 PJEGPYBXVADCEP-SIKLNZKXSA-N 432.609 4.035 10 10 IICE COc1ccc([C@@H]2CN(Cc3ccccc3)C[C@H]2NC(=O)N[C@H](C)c2ccccc2O)cc1 1684483661 WPZONXOWLPWGBX-BTZRARBUSA-N 445.563 4.429 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(F)c2ccccc12 1686658384 FNHJTUIBQIDZFQ-KRWDZBQOSA-N 448.542 4.241 10 10 IICE C[C@H]1CCCC[C@@H]1OCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1693651616 SRACJSPJJPVWEB-CVDCTZTESA-N 435.572 4.201 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1)OC 1695114733 OMXYDILBWHDLFU-YADHBBJMSA-N 437.588 4.393 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2CCc2cn[nH]c2)c(C)n1-c1ccccc1 1742117578 OZIGIDGOWUTFPA-UHFFFAOYSA-N 443.477 4.317 10 10 IICE CCC(C)(C)Cn1c(-c2ccccn2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1752496303 VMBQYQOZJWTGPJ-UHFFFAOYSA-N 438.551 4.251 10 10 IICE CCCCCN(c1nnc([C@H]2CCC(=O)N2)n1Cc1ccc2c(c1)CCCN2C)C(C)C 1763988035 MRHMCPHQWPNLMN-OAQYLSRUSA-N 438.620 4.065 10 10 IICE CCCOc1ccccc1NC(=O)CNCc1cc(Cl)cc(Br)c1O 1860720899 AJTNGSLNLYJVGJ-UHFFFAOYSA-N 427.726 4.325 10 10 IICE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)OCc1ccccc1 2044755261 VXXBCNDUBDPENG-GKVQRAMASA-N 439.600 4.438 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)cc(OC)c1OC(C)=O 2296453357 UDNTWTOSTVIYAP-UHFFFAOYSA-N 433.482 4.174 10 10 IICE O=C1C(=Cc2cccc(F)c2)SC(=S)N1CC(=O)N1CCCC[C@H]1c1cccnc1 2297471073 WNZTTXMNTGEIAJ-SFHVURJKSA-N 441.553 4.176 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(c3ccc4c(c3)OCO4)C2=O)c1)C(=O)O 2314932597 XDOVFERYLZAQGD-HNNXBMFYSA-N 443.502 4.063 10 10 IICE COc1ccc(C)cc1N1C(=O)C(=Cc2cc(OC)c(O)c([N+](=O)[O-])c2)SC1=S 2321721453 JQGAJMGKVICGEN-UHFFFAOYSA-N 432.479 4.032 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(-c4ccccc4)cc3)CC2)cc1 9919421 BXLOEKNSFHOQAW-UHFFFAOYSA-N 429.564 4.304 10 10 IICE CC1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@H](c2ccc(O)cc2O)N3)CC1 13639871 HAEWHHKKTAJPCU-AXHZCLLHSA-N 440.565 4.345 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccccc1 15039088 CQIMTRHNBFSVSO-LGMDPLHJSA-N 427.507 4.215 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1c(O)ccc3c1CCCC3)O[C@H](C)C2 743600233 SLBUEKXICUJSEG-MPHOGZCYSA-N 436.552 4.348 10 10 IICE Clc1cc(I)ccc1CNCc1ccc(N2CCOCC2)cc1 793382997 FNKGRGMCKYPGPK-UHFFFAOYSA-N 442.728 4.071 10 10 IICE Cc1cc(COc2ccc(C=O)cc2)oc1C(=O)NCc1cc(Br)ccc1O 804739483 ZNHCOJUSEVYLQH-UHFFFAOYSA-N 444.281 4.378 10 10 IICE O=C(NCc1ccnc(Oc2ccc(F)cc2)c1)NCc1cc(Br)ccc1O 805033145 GQAUBEBZCRFVCW-UHFFFAOYSA-N 446.276 4.481 10 10 IICE COc1ccc(CNCc2cc(Br)ccc2O)c(OCc2cccnc2)c1 809713385 NZLVRWACZCTPMR-UHFFFAOYSA-N 429.314 4.427 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@@H](C)c3ncc(Br)cn3)cc2)CC1 814298124 PLPVTGJTJJTQAA-HNNXBMFYSA-N 432.366 4.036 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3C[C@@H]3c3ccccc3OC(F)(F)F)C2)cc1 1129993184 KIWQYOGHZOZBRZ-YSGRDPCXSA-N 434.458 4.340 10 10 IICE COc1ccccc1-c1noc([C@@H](C)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1137105967 OUYNUYIQLIWQOZ-MRXNPFEDSA-N 444.491 4.456 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc(Br)c1F 1147838428 WDRYOCPGFXOZDE-UHFFFAOYSA-N 435.337 4.035 10 10 IICE Cc1cc(C(=O)NCC(=O)OC2CCCCC2)c(C)n1-c1ccccc1Br 1149257682 RRVLRZAHZNMQGJ-UHFFFAOYSA-N 433.346 4.462 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c1C 1150860133 GQVLHZFFEZQTOR-QHCPKHFHSA-N 429.564 4.366 10 10 IICE O=C(N[C@H]1CCN(c2cccc(Br)c2)C1)c1cc2cc(O)c(O)cc2s1 1155813725 LZPMNQHQHNZZKE-ZDUSSCGKSA-N 433.327 4.084 10 10 IICE Cc1ccc(-n2ccnc2SCC(=O)NCc2cccc(Br)c2O)cc1C 1156792419 NANZVYJOOMUHAT-UHFFFAOYSA-N 446.370 4.366 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Br)c(Cl)c1 1162539633 JNKGRJXJCFKXNA-UHFFFAOYSA-N 426.694 4.014 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN([C@@H](C)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 1185519304 XXFMDZHQSHCPCE-WJXUGBSRSA-N 429.904 4.318 10 10 IICE Brc1cc(CNC2CCN(C[C@H]3CCCO3)CC2)ccc1N1CCCCC1 1200376419 BVSMUJJKIIFHCO-HXUWFJFHSA-N 436.438 4.172 10 10 IICE CCCCc1nc(C)c(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1 1264688858 BLXFTKRFLZHCFU-IYBDPMFKSA-N 433.593 4.406 10 10 IICE CC(=O)c1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1OC(C)C 1264689573 XPZIVWVRBXRBNB-IRXDYDNUSA-N 442.531 4.359 10 10 IICE Cc1ccc(-c2nnc(N3CCC(CCCO)CC3)n2Cc2ccc(N(C)C)cc2C)o1 1289570710 QNVARXVMJVAAKG-UHFFFAOYSA-N 437.588 4.258 10 10 IICE CN(c1ccc(CNC(=O)Cn2cc(C=O)c(-c3ccccc3)n2)cc1)C1CCCCC1 1292258942 WJWHCIUUNKOMNO-UHFFFAOYSA-N 430.552 4.448 10 10 IICE Cc1cc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc(N2CCCC2)n1 1298838640 BKDDUVVYPYCCQQ-UHFFFAOYSA-N 430.552 4.069 10 10 IICE CC[C@H](C)CN(CC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1305611483 WBTVWCUKMGYXSJ-REWPJTCUSA-N 441.620 4.277 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4ccccc4F)CC3)C2)cc1 1312902501 LYEPMNMWBKZDEX-HXUWFJFHSA-N 425.548 4.325 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1313679467 KFEDZOJCSPFMJR-QHCPKHFHSA-N 448.615 4.404 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(=O)c(OCc2ccc(F)cc2)co1 1354324643 WGVOFKPSTJVVPL-UHFFFAOYSA-N 438.499 4.475 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3coc4c(F)c(F)ccc34)cc2F)C[C@@H](C)O1 1355129270 DYBZCQNJHFASJI-ZIAGYGMSSA-N 432.442 4.323 10 10 IICE Cc1nn(-c2ccccn2)c(C)c1CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1461962999 HJCLWSCEMDLKAF-UHFFFAOYSA-N 427.552 4.193 10 10 IICE Nc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc(Cl)c1Cl 1465951391 LVKVHIUWMZFJKV-ZDUSSCGKSA-N 428.747 4.329 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCc1cc(OC)c(O)cc1Br 1478924773 XGKZBYHMWIFEKL-UHFFFAOYSA-N 437.334 4.381 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1494794586 IMMVSHCCNHAJSE-RUZDIDTESA-N 434.588 4.046 10 10 IICE CNC(=O)[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC1(C)C 1503701955 BEDGZCASQRGTCR-PXNSSMCTSA-N 448.615 4.217 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1 1505259185 KSSLPHKZPFNASJ-UHFFFAOYSA-N 449.628 4.476 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1515529961 APZMVASBAKSBDF-DHLKQENFSA-N 441.620 4.420 10 10 IICE COc1cc(N2CCN(C(=O)C[C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)cc(OC)c1OC 1521836735 LABNXLUWNKTPLO-CVEARBPZSA-N 444.494 4.120 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3coc(-c4ccc(Cl)cc4)n3)C2)cc1 1529709289 WGJIXQOKKVXSJA-MRXNPFEDSA-N 425.916 4.189 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(CC(=O)Nc4ccccc4)CC3)c2C)c1 1539886936 OBXDYIAUFFUHCI-UHFFFAOYSA-N 444.579 4.107 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1540718135 IAPKLHUYCIWXFC-KDURUIRLSA-N 427.545 4.178 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccc(C)o1 1554479177 GZVJKTUTDZBOPO-UHFFFAOYSA-N 446.555 4.027 10 10 IICE Cc1cc(CNC(=O)N2CCC[C@@H](NC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1565193310 VFDHNXGXRKNXKK-HSZRJFAPSA-N 430.552 4.198 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 1568735949 OXTMBSIGZRTFAD-OXQOHEQNSA-N 433.545 4.396 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)cc1)C1CCCCC1 1597949814 HIXQPTNKVPUBJW-SFHVURJKSA-N 441.522 4.403 10 10 IICE CN1CCC[C@@H](c2cccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c2)C1 1610276615 BQAYZSVMYPQWFO-HXUWFJFHSA-N 443.538 4.496 10 10 IICE C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1C 1612829255 OOIWSFHCLFHDLH-MSOLQXFVSA-N 429.584 4.082 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncccc1NCC1CCC1 1620754266 RNLRNDBHELENLJ-QGZVFWFLSA-N 430.499 4.294 10 10 IICE COc1ccc(NS(C)(=O)=O)cc1NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1624675448 DFRQNJUPKBCGLY-UHFFFAOYSA-N 441.553 4.343 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3cc4ccccc4[nH]3)cc2Cl)C1 1626168782 FRFKSZHVODYMCD-MRXNPFEDSA-N 438.959 4.104 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cccc(NCC(C)(C)C)c3C)CC2)cc1 1631442572 CBSBLDXHFUACPH-UHFFFAOYSA-N 438.616 4.014 10 10 IICE Cc1sc2ncc(C(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)c(=O)n2c1C 1631531653 XSSJNGMGDUOSPI-MRXNPFEDSA-N 433.533 4.482 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c1C 1632748196 WRHMDSPDFAVEOA-XMMPIXPASA-N 431.580 4.289 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 1635947226 RNSCDQQDLLMLMZ-AWEZNQCLSA-N 442.274 4.141 10 10 IICE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1638306365 YDXMZBGQGJYLFK-JTQLQIEISA-N 438.336 4.286 10 10 IICE Cc1ccc(C(=O)c2ccccc2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1C 1646431821 QRZGRKANVKGRRK-UHFFFAOYSA-N 442.559 4.426 10 10 IICE O=C(CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)NCc1ccc(F)cc1 1653578857 ZOGIFLYANBTHHI-DAXSKMNVSA-N 432.495 4.433 10 10 IICE COc1ccc(CNC(=O)NC(Cc2ccccc2F)Cc2ccccc2F)c(O)c1 1670739545 TUAIJVWQFGLBHN-UHFFFAOYSA-N 426.463 4.332 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)C1(c2ccccc2)CCCC1 1681478927 JCIAFQUBKIQYFG-HXUWFJFHSA-N 448.611 4.088 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H]2CCC(C)(C)CN2C(=O)OC(C)(C)C)c1 1684682563 UOYJDMMWDYFJNO-JKSUJKDBSA-N 435.565 4.187 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1697962992 FEEPTMLIXFHQBZ-HXUWFJFHSA-N 437.588 4.394 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@@]1(O)CCCC1(C)C 1729419347 SHKQACMAARATJB-QHCPKHFHSA-N 441.963 4.277 10 10 IICE Cc1cc(-c2nnc(N(C)CCC3CC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1742116965 DYZMHAFXOJTZOR-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C[C@H](C)O1 1745001414 JHMDYKIQIZSUII-CNNODRBYSA-N 437.588 4.391 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1770539334 AGXXYMNEXDAJKJ-QGZVFWFLSA-N 442.608 4.480 10 10 IICE COc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCCC(=O)N4)c(C)s2)cc1 1859571241 ABWYHOXXLQBPBZ-UHFFFAOYSA-N 443.550 4.203 10 10 IICE CCOC(=O)c1c(NC(=O)C2CCN(C(=O)C3CC3)CC2)sc(C)c1-c1ccccc1 1860627352 FLVXDNXQGZHAOA-UHFFFAOYSA-N 440.565 4.487 10 10 IICE CC(=O)c1cccc(NC(=O)CCNCc2cc(Cl)cc(Br)c2O)c1 1860715032 JVIYIGNYRNRKSW-UHFFFAOYSA-N 425.710 4.129 10 10 IICE Cc1cc(Cl)cc2c(O)cc(C(=O)N[C@H](c3ccc(N(C)C)cc3)c3nccn3C)nc12 1866511241 OXWQXWCZBSQNAP-JOCHJYFZSA-N 449.942 4.221 10 10 IICE CC[C@H](NC[C@]1(C)CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2143387430 OYWSHBIOAQLZNN-OXJNMPFZSA-N 443.382 4.221 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2352638365 WGSHWVUHGUEZGH-CQSZACIVSA-N 429.355 4.019 10 10 IICE Cc1ccc(CNC2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2)c(O)c1Br 2352944642 KMJYTFFWFJCFGW-HUUCEWRRSA-N 425.367 4.198 10 10 IICE CCn1c(SCC(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)nc2ccccc21 98080365 YGMLLVROIDRCFT-UHFFFAOYSA-N 434.569 4.098 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccccc2Cl)cs1 727241899 LKKKUYDOJDDWIO-UHFFFAOYSA-N 426.903 4.261 10 10 IICE CC(=O)Nc1ccc(OC[C@@H](O)CN2CCCc3cc(OCc4ccccc4)ccc32)cc1 734486411 LNKLCMFOJWLZMK-DEOSSOPVSA-N 446.547 4.417 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 745318196 ZJHKCWAAZXPOIN-CQSZACIVSA-N 444.333 4.028 10 10 IICE COC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)cc1 747857286 LKVYUJSQUHZUIB-AWNIVKPZSA-N 444.534 4.114 10 10 IICE COc1ccc(Br)cc1[C@H](NCc1ccc(N2CCCCC2)cc1)C(=O)O 756377925 AWJCMCJEERKYMZ-FQEVSTJZSA-N 433.346 4.364 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC2(CCCC2)c2cccc(F)c21 764229096 SXHGVQKGYUMHHZ-UHFFFAOYSA-N 441.522 4.468 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1 775182436 FGHJRHQFPLYTBF-HUUCEWRRSA-N 433.346 4.325 10 10 IICE CC[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)c(Cl)c1O 775513511 KHQGAXSAXXDWKE-ZWOKBUDYSA-N 448.394 4.339 10 10 IICE Cc1nn(C)c(C)c1[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)C(F)(F)F 782797153 ZGKDEPOPICAQGZ-IBGZPJMESA-N 425.499 4.327 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3CCC(C(=O)N4CCCC4)CC3)c2C)cc1 800743825 SDNKPVXYGNBYOY-UHFFFAOYSA-N 437.584 4.010 10 10 IICE CN(C)c1ccc(CN(C(=O)Cn2c(-c3cscn3)nc3ccccc32)C2CC2)cc1 914438322 PMOKTLPWRXAGOF-UHFFFAOYSA-N 431.565 4.417 10 10 IICE O=C(O)CN1C(=O)/C(=C\c2csc(-c3ccc(C(F)(F)F)cc3)n2)SC1=S 918735267 GTFRGZLKAUXFEC-VZUCSPMQSA-N 430.454 4.115 10 10 IICE Cc1cc(I)cc(C(=O)Nc2c(Cl)ccc3nonc23)c1C 1128704508 NDVRLCPEAULEMZ-UHFFFAOYSA-N 427.629 4.350 10 10 IICE Cc1noc(C)c1CCCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1150468828 SRJHWXVXSWMPTG-UHFFFAOYSA-N 431.334 4.219 10 10 IICE C[C@H](N[C@@H](C)c1c(F)cccc1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1197979139 RRNFXGVKKGZOFZ-KBPBESRZSA-N 434.442 4.418 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CCC(=O)O2)sc(C)c1-c1ccc(Cl)cc1Cl 1264454286 UJMCYSHYRDYVPM-GFCCVEGCSA-N 428.293 4.461 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4cccc(C)c4)n3C)cc2F)CC1 1265011778 APSPAIFCISHPGM-UHFFFAOYSA-N 434.559 4.212 10 10 IICE CN(C)c1ccc(N(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1274329813 MYCNZOBHLQMCPQ-RGEXLXHISA-N 443.569 4.146 10 10 IICE CCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccc(Cl)cc1 1276832499 WKAFBXQHONNMSU-QGZVFWFLSA-N 438.959 4.353 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1 1290370325 RLAOVHHCDLVVHA-UHFFFAOYSA-N 436.455 4.289 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC(NC(C)C)CC2)cc1 1295416299 XZWGNMXGDZNZSH-UHFFFAOYSA-N 435.620 4.135 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)s1 1298978318 JHMRHLKSZLCVLW-UHFFFAOYSA-N 441.528 4.044 10 10 IICE CCCOc1c(Cl)cc(C(=O)N(CC(=O)OCC)Cc2ccccc2O)cc1OC 1299698283 AUKBQFHRIJERGI-UHFFFAOYSA-N 435.904 4.049 10 10 IICE CC(C)Oc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1[N+](=O)[O-] 1350934114 YHZUMKRBDCAMGF-IYBDPMFKSA-N 445.491 4.065 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(Br)cnc3C3CC3)CC2)cc1 1352536445 AMDMIKCHTJIFMR-UHFFFAOYSA-N 430.346 4.129 10 10 IICE COc1nn(C)cc1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1355166719 BZLFOOBBYTVMMO-UHFFFAOYSA-N 425.489 4.351 10 10 IICE O=C(CCC1CCCCCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1358430341 XGMKGCVGLGVSID-UHFFFAOYSA-N 439.579 4.309 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2C[C@H]2CCC(=O)N2)c(C)n1-c1ccccc1 1361045813 LBBSMVRKZJRPGZ-HXUWFJFHSA-N 434.588 4.114 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@@H]1CCC(F)(F)C1 1439996187 LSWGVKTVISWMHU-LUYJPIOASA-N 442.528 4.359 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC(C)CC2)n1Cc1ccc(N(CC)CC)cc1 1496818430 AAVCQZCHUNXXGP-UHFFFAOYSA-N 440.636 4.327 10 10 IICE CCOc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 1515746280 CSIQCGQNJZCPPN-UHFFFAOYSA-N 435.568 4.132 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cc2ccccc2N2CCCC2=O)cc1 1520970230 VKXPFDVKFMJUDE-UHFFFAOYSA-N 433.474 4.013 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Sc3ccc(Br)cc3)CC2)cc1 1526035202 CNXMRRZSRDRBGJ-OAHLLOKOSA-N 435.387 4.287 10 10 IICE C[C@H]1C/C(=C/c2ccc(N(C)C)cc2)c2nc3ccccc3c(C(=O)N[C@@H](C)C(N)=O)c2C1 1528585332 YWOFPSKISCVVDK-CRMQVRLHSA-N 442.563 4.027 10 10 IICE COC(=O)c1ccc2c(c1)N(C(=O)c1ccccc1CCN(C)C(=O)OC(C)(C)C)CC2 1540103424 SPOSHUMULICJFL-UHFFFAOYSA-N 438.524 4.086 10 10 IICE Cc1cccc(-c2nc(C)c(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)[nH]2)c1 1544676447 KDLJYSFDRXFHKP-IRXDYDNUSA-N 436.531 4.376 10 10 IICE CC(=O)c1ccc(O)c(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1 1567049504 LSWLRUBGUROHTJ-BOPFTXTBSA-N 446.575 4.276 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 1568137538 WESKICVKZKFIIU-RDPSFJRHSA-N 442.556 4.251 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1586060942 LFJOBYREEKSNMS-FQEVSTJZSA-N 432.952 4.007 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccccc2NS(=O)(=O)C(F)(F)F)cc1 1587460513 YPNOVWXLEPUVGR-UHFFFAOYSA-N 443.491 4.067 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1C[C@H]1c1ccsc1 1588136425 JJZUSCCOZLZZOB-UEIWIWDKSA-N 434.633 4.463 10 10 IICE CCc1cnc(CN(C)c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)s1 1613842578 XIYFRSZIDOHLEE-UHFFFAOYSA-N 442.658 4.097 10 10 IICE CC(C)N(Cc1ccc(N2CCOCC2)cc1)C[C@H](O)COc1cccc2ccccc12 1615444871 IYVLQFLTRUMXLY-VWLOTQADSA-N 434.580 4.327 10 10 IICE CN(C)c1ccc(CNC(=O)c2c[nH]cc2-c2cc(Cl)c3c(c2)OCCO3)cc1F 1627046312 QNNXRUGFTVGUCI-UHFFFAOYSA-N 429.879 4.241 10 10 IICE COc1ccc(F)c2[nH]c(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc12 1631425690 MKYCCFRISBVDPR-HNNXBMFYSA-N 431.895 4.069 10 10 IICE CCN(CC)[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1 1631425697 MODSQJGVPGKGML-JTHBVZDNSA-N 429.992 4.209 10 10 IICE COc1ccc([C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)c2ccc(OC)cc2OC)cc1 1633647804 VZZVVOCYZIKGQP-JOCHJYFZSA-N 448.479 4.394 10 10 IICE Cc1cccc(C[C@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1 1638631188 HFUBQHGZQGDRDA-HXUWFJFHSA-N 441.369 4.498 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc2cncc(Br)c2n1 1639735020 NBCBTVYMAXEURC-UHFFFAOYSA-N 425.330 4.313 10 10 IICE O=C(c1c(F)ccc(O)c1O)N1CCN([C@@H](c2ccccc2)c2ccccc2Cl)CC1 1641228331 HGNKTMVSJNYZHJ-QFIPXVFZSA-N 440.902 4.438 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3cccc(SC(F)(F)F)c3)nc12 1644566409 HWAGMQODZKTQOB-NSHDSACASA-N 440.447 4.074 10 10 IICE Cn1c(C(=O)NCc2c(O)cccc2F)ccc1[C@H]1CCCCN1C(=O)OC(C)(C)C 1645050300 GOIABERHCQXSSQ-GOSISDBHSA-N 431.508 4.262 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@H](C)N(CC(=O)Nc1ccc(N=Nc3ccccc3)cc1)C2 1648364171 SGFHDPQBBCRFNF-KRWDZBQOSA-N 446.511 4.318 10 10 IICE C[C@H](NC(=O)c1c(F)ccc(O)c1O)c1cccc(NC(=O)Cc2ccccc2F)c1 1648464923 JYWHPTBPQJDLMK-ZDUSSCGKSA-N 426.419 4.048 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 1685676240 XHBMRBKKVQFNFV-GOSISDBHSA-N 445.604 4.498 10 10 IICE CNC(=O)CC1(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCCCC1 1686268917 INCCTIUWMVYLIY-GOSISDBHSA-N 449.039 4.462 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1706303034 GPCAIWMLFCYLIS-HXUWFJFHSA-N 429.584 4.298 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)CC1CCOCC1 1707306266 XMCYEQDSQDYZAV-UHFFFAOYSA-N 439.629 4.216 10 10 IICE Cc1cccc(-c2nnc(N3C[C@@H](C)S[C@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1707591608 XUWMUFXWHUQZJH-RTBURBONSA-N 436.629 4.401 10 10 IICE CC[C@@]1(C)CC[C@H](Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)O1 1708829373 MMZCWANFULJXCU-RDGATRHJSA-N 441.620 4.222 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1Cc1ccnc(C(F)(F)F)c1 1711095725 WGLWLRPIUIIOAN-GOSISDBHSA-N 447.461 4.324 10 10 IICE Cc1c(CN(C)c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)cnn1C 1742064997 HWXUKJANARKMCI-UHFFFAOYSA-N 449.647 4.440 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1761024685 PQLQEDUFZWATER-NRFANRHFSA-N 443.611 4.373 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)C2CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1764076462 GBXXQFJLEKSDRF-UHFFFAOYSA-N 438.620 4.080 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cncn1 1766529536 LVENFLGGJDNHEZ-UHFFFAOYSA-N 432.576 4.127 10 10 IICE C[C@@H]1CCCC[C@H]1NC(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860344974 LLYPJCPFUNCICU-DYESRHJHSA-N 440.547 4.269 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2cc(Br)ccc2O)C1 1952459880 RRXKASSNZPPKMB-YOEHRIQHSA-N 434.286 4.329 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2044630307 DLHJEWXAGQLILY-INIZCTEOSA-N 446.592 4.056 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2ccc(Br)cc2O)CC12CC2 2115364488 GUKUIDCSEXDGCB-AWEZNQCLSA-N 425.367 4.424 10 10 IICE CCC[C@](C)(NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352637289 QJNRULRSIAXKIA-IBGZPJMESA-N 429.355 4.163 10 10 IICE Cc1ccc(CN(C)C(=O)CN(C(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2352945275 TVZKCOZHPBEFSN-UHFFFAOYSA-N 429.355 4.067 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2380756526 LXKRRRVTPJBCNX-SWLSCSKDSA-N 443.382 4.409 10 10 IICE CCN1C(=O)/C(=C2/SC(N3CCC(Cc4ccccc4)CC3)=NC2=O)c2ccccc21 33315714 VBIQQIFNSKPYNX-QURGRASLSA-N 431.561 4.348 10 10 IICE CCc1ccc(Nc2ncnc(N3CCN(c4ccc(OC)cc4)CC3)c2[N+](=O)[O-])cc1 40587236 GMXKMMVQPBFMCI-UHFFFAOYSA-N 434.500 4.026 10 10 IICE CCOc1ccc(N2C(=O)/C(=C3\C(O)=Nc4ccc([N+](=O)[O-])cc43)SC2=S)cc1 83302528 MFEAJTOQHIGAEQ-FOCLMDBBSA-N 427.463 4.371 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(OC)c(O)c1)N2 226669115 HMRJNLLOXFBFOO-IEGUWTFLSA-N 428.554 4.258 10 10 IICE COc1ccc(Cl)cc1NC(=O)CN(C)C(=O)c1ccc(-n2c(C)ccc2C)cc1 248027638 SLKRVKJWRCRRJM-UHFFFAOYSA-N 425.916 4.467 10 10 IICE CC(C)c1ccc(OC[C@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 256038577 PXFXXUAWMHLLQR-AOYPEHQESA-N 426.601 4.297 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3cc(OC)ccc3OC)[C@@H]2c2ccc(O)c(O)c2)c1 526144357 CFMQEHVBBNNFGP-QHCPKHFHSA-N 449.459 4.181 10 10 IICE C[C@@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Br)cc1O 757637843 MVSXXJLIKHZLHP-MLGOLLRUSA-N 431.309 4.218 10 10 IICE C[C@@H]1C/C(=C\c2ccc(N(C)C)cc2)c2nc3ccccc3c(C(=O)N3CC(CO)C3)c2C1 773957526 VEFORKKRLPZRES-ALDSOSFCSA-N 441.575 4.488 10 10 IICE C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 775940088 FUITZYQPBPKAIE-SMDDNHRTSA-N 448.488 4.058 10 10 IICE CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C[C@@]2(CCOC2)O1 799995236 VMSHSRZWVMGQCR-GEQKSPFYSA-N 435.996 4.056 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 813807798 DIZGPVKIXCJKMR-FQEVSTJZSA-N 431.577 4.494 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2CCc3nnc(C4CC4)n3C2)cc1 815548460 YHUIGCWILOEEDS-HXUWFJFHSA-N 445.567 4.026 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)NCc1ccc(N3CCSCC3)cc1)O[C@H](C)C2 918618115 XTHIOPUODROOPC-OTIVFRFGSA-N 438.593 4.292 10 10 IICE CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661616 QCNQBQYGGUSMPU-NRFANRHFSA-N 438.902 4.175 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2-c2cn[nH]c2)NC(=O)OC(C)(C)C)cc1 1136903384 CMVAPEUMMCRSKN-QFIPXVFZSA-N 449.555 4.139 10 10 IICE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(=O)N1c2ccccc2C[C@H]1C 1228460210 RREPUIUVENQOMP-WOJBJXKFSA-N 434.584 4.185 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)sc2c1CCCC2 1264066893 DZFSQRFNSPJWCY-GFCCVEGCSA-N 448.491 4.073 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)sc2c1CCCC2 1264290590 OFIZHJKNYFLXRK-GFCCVEGCSA-N 432.929 4.059 10 10 IICE CCN(CC)CCN(CC(C)C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1264519238 KCRLQGQCVSQUTN-UHFFFAOYSA-N 426.649 4.234 10 10 IICE COc1ccnc(N2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)c1 1265020497 LJHDLLLUOQENQU-UHFFFAOYSA-N 438.959 4.042 10 10 IICE O=C(Nc1cccc(N2CCCCCC2)c1)c1ccc(Br)cc1-n1cnnn1 1265298002 DCPQEYZGDBVWRA-UHFFFAOYSA-N 441.333 4.058 10 10 IICE CC(C)Cc1ccc(CCCC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1288912793 MWGPGAASZTTZRR-UHFFFAOYSA-N 435.612 4.226 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCOC(C)(C)[C@@H]1C 1289422704 CIEHNTKHTGULHX-SFHVURJKSA-N 439.629 4.357 10 10 IICE CCOC(C)(C)Cn1c([C@@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1314045655 RUTSPCNPCJCJNO-KRWDZBQOSA-N 433.572 4.081 10 10 IICE CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1350627641 CDFZEZYTKMGSAP-UHFFFAOYSA-N 447.512 4.288 10 10 IICE CCC1(CC)[C@H](NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)[C@H](C)[C@H]1OC 1357950327 JXMURIGKPYKXEL-PISWEHOVSA-N 425.617 4.364 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnc2c(cnn2Cc2ccccc2)c1 1436851270 HSLFSRFJXMTZJP-IBGZPJMESA-N 427.552 4.215 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1noc2ccccc12 1439195606 RFVKAEDQMKWECE-GZTJUZNOSA-N 443.575 4.187 10 10 IICE CC[C@@H]1CCCC[C@@H]1OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1444501309 HRXXBBQKBCGJBK-COPCDDAFSA-N 447.620 4.420 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)OCCc1ccccc1 1467632189 SEZKSNVIERNBCS-LJQANCHMSA-N 426.557 4.023 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](OC(=O)N(C)C)C2)c(C)n1-c1ccccc1Br 1468207263 ZIAPCQKFRPBQEG-INIZCTEOSA-N 448.361 4.159 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCSC[C@H]2C)cc1 1501839469 SIMGBRIDDDJTSA-LJQANCHMSA-N 436.629 4.485 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)CCC2CCOCC2)cc1F 1503393784 LIIDBNCGGUQLQS-UHFFFAOYSA-N 431.600 4.373 10 10 IICE CC(C)CN(c1nnc(-c2cccnc2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1509374508 YHBXQWDVLMPIQH-UHFFFAOYSA-N 434.588 4.096 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1 1527715536 XTTKIBPGIPOHLK-UHFFFAOYSA-N 431.920 4.270 10 10 IICE CC(C)n1cc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1529076470 BHDCDQBVBQACMR-XKYMITNMSA-N 446.573 4.072 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](CC)N2CCCC2=O)sc(C)c1-c1ccc(F)cc1 1531739933 LGAVXTNNCVIOFP-INIZCTEOSA-N 432.517 4.379 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)c2C)cc1 1543856574 CJKRCAMVRDWOCK-MRXNPFEDSA-N 429.561 4.336 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccccc3CNC(=O)OC(C)(C)C)CC2)cc1 1545931600 OAGLPPYFHODRGS-UHFFFAOYSA-N 439.556 4.072 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc([C@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1546590176 DBTBIIGXPSDPQD-CNNODRBYSA-N 441.620 4.058 10 10 IICE COC[C@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1555332690 RGZNATWBQQTIQV-NRFANRHFSA-N 443.661 4.256 10 10 IICE FC(F)[C@H]1CCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1555975212 ZYKAIACFINDKSN-UONOGXRCSA-N 429.562 4.250 10 10 IICE C[C@H]1CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC[C@H]1c1ccccc1 1564895863 XNSGHHWJMCOWPS-FXAWDEMLSA-N 429.511 4.137 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)c2C)c1 1565193011 MHCKHYMRCAGLRR-MXVIHJGJSA-N 426.561 4.257 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@]2(C(=O)OC(C)(C)C)CCOC2)cc1 1585619239 JTULGUJVLXFXGB-XMMPIXPASA-N 438.528 4.399 10 10 IICE CCc1nnc(N(Cc2cccs2)C(C)C)n1Cc1ccc(N2CCOCC2)cc1 1613938900 GJALMWWBMLIBEY-UHFFFAOYSA-N 425.602 4.202 10 10 IICE CCN(CCC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1615604584 IEZQIKGAZPEWCW-UHFFFAOYSA-N 429.584 4.226 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4SC[C@H]3C)cc2F)C[C@@H](C)O1 1615994933 NLGUFJBZSQOJKN-KZNAEPCWSA-N 443.588 4.056 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(Br)cnc3O)cc2Cl)C1 1626169087 NLRPNYAQEBPVQG-GFCCVEGCSA-N 438.753 4.369 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1631840283 MAVRBCGRHGDGMB-XMMPIXPASA-N 443.547 4.136 10 10 IICE COc1ccc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)cc1 1635820653 IGVQXAXGIRDESU-NRFANRHFSA-N 443.341 4.329 10 10 IICE CC[C@H](NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)c1ncc(-c2ccccc2)[nH]1 1636353542 DFRQQRBXEIJNQH-AVRDEDQJSA-N 433.556 4.362 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc([C@]3(C)COC(=O)N3)c2)cc1 1636867843 UZUYSHWUXOWJHN-VWLOTQADSA-N 431.492 4.043 10 10 IICE CC(C)C[C@H](CNC(=O)OC(C)(C)C)CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1636951448 SOOOJZVMXIKIDR-FPOVZHCZSA-N 448.604 4.477 10 10 IICE CCN(C(=O)NCc1cc(C)n(-c2ccccc2)c1C)[C@@H]1CCN(c2ccccc2)C1=O 1637581289 IXIUXSDJCNCOLP-XMMPIXPASA-N 430.552 4.431 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](Cc2ccccc2)c2nccn2C)cc1 1640682953 MDVASUYFZGMENE-RUZDIDTESA-N 440.547 4.283 10 10 IICE O=C(CN[C@H](C(F)F)C1CCCCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1643888535 GRQNXUBZQUTJJE-NRFANRHFSA-N 426.463 4.204 10 10 IICE Cc1cc(C(=O)N2CCC(c3ncon3)CC2)c(C)n1-c1cccc(Br)c1 1645023385 PEJAMXUHMZMUOJ-UHFFFAOYSA-N 429.318 4.259 10 10 IICE Cc1cc(C(=O)NCCc2ccccc2S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1645026763 BVRZMPFJKXKHHJ-UHFFFAOYSA-N 430.957 4.124 10 10 IICE CCN1CCO[C@H](C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)C1 1648493753 LDHGOUYDPBQLFS-CTNGQTDRSA-N 435.490 4.019 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCN(CC4CC4)C3)cc2Cl)C1 1672137464 SIOCSNTWZRCAHS-GHTZIAJQSA-N 433.040 4.498 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC(Cc4ccc(C(F)(F)F)cc4)C3)C2)cc1 1674326375 IQANLEGOHJPXSJ-IBGZPJMESA-N 433.474 4.177 10 10 IICE Cc1cc(CNC(=O)NCc2nc(Cc3ccccc3F)no2)c(C)n1-c1ccccc1 1675116098 ZJDFOJHWQDQNKJ-UHFFFAOYSA-N 433.487 4.206 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3csc(Br)c3)C2)cc1 1682187970 BTSWULXTMQQPBW-AWEZNQCLSA-N 438.391 4.187 10 10 IICE CN(C)CC(C)(C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1747582933 FAYLBEIMTCULDV-UHFFFAOYSA-N 447.631 4.165 10 10 IICE CO[C@]1(C)CCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1748472895 JZOOPQUASKEYGX-OXJNMPFZSA-N 437.635 4.164 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2Cc2ccsc2)c(C)n1-c1ccccc1 1751416987 SJXZUNMNNMRXEG-MRXNPFEDSA-N 448.596 4.163 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCC[C@@H](COC)C2)cc1 1766611635 NCSWYYCLSUUSBJ-JOCHJYFZSA-N 448.615 4.406 10 10 IICE CCc1sc(NS(=O)(=O)c2cc(OC)ccc2OC)nc1-c1ccc(OC)cc1 1858034191 DPUNQFAXYKZMBC-UHFFFAOYSA-N 434.539 4.199 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@@H](C)[C@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 1858588402 DABHEVGAQJTHJY-XGCBPCLTSA-N 434.539 4.335 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3CCCN(Cc4ccccc4F)C3)cccc21 1861858149 FQOVHDKHZHIKPF-SFHVURJKSA-N 442.490 4.452 10 10 IICE CCCC1=NN(CC)C(=O)/C1=C/c1ccc(OCC(=O)N(CCC)CCC)c(OC)c1 1865675514 LTXLDCTVPQRJGR-XDJHFCHBSA-N 429.561 4.124 10 10 IICE COC(=O)c1ccc(OCc2ccc(C(=O)Nc3cccc(N(C)C)c3)cc2)c(OC)c1 1872869313 VODUEZXFQJVMKM-UHFFFAOYSA-N 434.492 4.379 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCCc4ccc(F)cc4)cc3)CC2)cc1 1872884139 MSDGYHCIVXCWQZ-UHFFFAOYSA-N 447.554 4.129 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC(C)C)C(=O)N(CCc3cccs3)C2=O)cc1 1873166717 FSINZIGUHBADRR-UHFFFAOYSA-N 433.577 4.476 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(=O)n(Cc2ccccc2Cl)c1 1891430794 VODCDGOOFAENDH-CVDCTZTESA-N 447.966 4.469 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@@H](F)CNCc2cc(Br)ccc2O)CC1 2106958413 FIQVOYWTOHYEPZ-INIZCTEOSA-N 431.346 4.230 10 10 IICE CN(C)c1ccc([C@H](N)c2ccc(Br)cc2I)cc1 2142282439 DHONHWITTRDMEO-HNNXBMFYSA-N 431.115 4.168 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)c1ccc(I)c(Br)c1 2225802094 XNTAVXYXBZRHTD-QWRGUYRKSA-N 435.063 4.015 10 10 IICE CC[C@@H](C)NCc1ccc(N(CC(=O)N(C)C)Cc2ccccc2)cc1Br 2240018323 CDBHZCXWKNTITG-QGZVFWFLSA-N 432.406 4.432 10 10 IICE CCN1C(=O)C(=C2SC(=S)N(CC(C)C)C2=O)c2cc(Br)ccc21 2296711365 RKGYEWVICRHMSD-UHFFFAOYSA-N 425.373 4.043 10 10 IICE Cc1ccc(CN[C@@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)c(O)c1Br 2352691470 GASRIXIQHDPCBS-MGPUTAFESA-N 425.367 4.485 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)C)cc3[C@@H]3C=CC[C@@H]32)cc1OC 14479392 HVVPXQSGBOCGRG-STSQHVNTSA-N 428.554 4.217 10 10 IICE Cc1cccc(N2C(=O)N=C(O)/C(=C/c3cc4c(cc3Br)OCO4)C2=O)c1C 59860106 GLZXBFXJKFYHOM-MLPAPPSSSA-N 443.253 4.301 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](c3c(C)nn(C)c3C)C(F)(F)F)ccc21 471095043 LCYHASUAKYSEJX-HXUWFJFHSA-N 436.478 4.288 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)cc1Br 705883918 UDGKUCKUXPJMKO-LPOZWGFCSA-N 426.402 4.255 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@H]2CCN(C)[C@@H](C)C2)sc(C)c1-c1ccccc1 741790129 CTDRERGNQPOQTH-QFBILLFUSA-N 443.613 4.253 10 10 IICE CC[C@H]1CN(C(=O)/C=C/c2cc3cnn(C(C)C)c3[nH]c2=O)c2cccc(Cl)c2O1 753054798 WBCASZBUEWCOLQ-FDMDGMSGSA-N 426.904 4.176 10 10 IICE O=C(N[C@H]1CCN(c2c(F)cccc2F)C1)N(Cc1ccco1)Cc1ccccc1O 756103271 BCFUHZRAGYKWSO-KRWDZBQOSA-N 427.451 4.254 10 10 IICE Cc1ccc(C(=O)CCCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 766136862 NXVMPXQZCBMKBF-OALUTQOASA-N 426.532 4.417 10 10 IICE COC(=O)[C@@H](NCc1cc(Br)cc(OC)c1O)c1ccc2ccccc2c1 779177537 FDKLUHUSNCOIBY-IBGZPJMESA-N 430.298 4.320 10 10 IICE O=C(NCCc1cccc2[nH]ccc12)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 799889165 WHEWICHDZKCUBT-UHFFFAOYSA-N 446.473 4.065 10 10 IICE Cc1cc(-c2nnc(N3CCC4(CCO4)CC3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802685820 PBFHPHYUVLWJMU-QFIPXVFZSA-N 447.583 4.291 10 10 IICE O=Cc1cccc(OCc2ccccc2C(=O)NCc2cc(Br)ccc2O)c1 804736592 XZXODURJBBGDRM-UHFFFAOYSA-N 440.293 4.476 10 10 IICE CN(c1ccc(CNC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1)C1CCCCC1 810244685 WZSMZBKAEMSBFZ-OAQYLSRUSA-N 433.568 4.277 10 10 IICE CCOc1ccc(Br)c(C(=O)N(C)CCN(C)c2ccc(OC)cc2)c1F 1130548277 WHKPYLHMUUGNDN-UHFFFAOYSA-N 439.325 4.204 10 10 IICE C[C@@H](NC(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1138364799 ZCPQUHCOGDAJCF-WIYYLYMNSA-N 425.573 4.456 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(OC)c(OC)c1C 1139585401 RJXGDUGESMPVBB-UHFFFAOYSA-N 428.529 4.014 10 10 IICE O=C(CCc1cccc(F)c1Br)NCc1cccc(Br)c1O 1139974876 OWAPIKLUJCVYAR-UHFFFAOYSA-N 431.099 4.305 10 10 IICE C[C@@H](C(=O)NCc1ccc2cccnc2c1O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 1142728201 ODXWFLRFHCVWCQ-UZLBHIALSA-N 435.524 4.459 10 10 IICE CSc1nc(O)cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 1143612708 KOOLKYXNECPHJK-UHFFFAOYSA-N 447.358 4.004 10 10 IICE Cc1cc(C(=O)N[C@H](C)CCc2cccn2C)c(C)n1-c1ccc(Br)cn1 1146677488 CSVFYBUQOWTFKJ-CQSZACIVSA-N 429.362 4.341 10 10 IICE COC(=O)[C@H]1CN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c2ccc(F)cc2O1 1164340072 ZELOVTODZVSHQG-HSZRJFAPSA-N 436.483 4.431 10 10 IICE C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229782676 YNIOKQHIGZMLJF-VGOFRKELSA-N 429.511 4.279 10 10 IICE CC[C@H]1c2ccc(OC)c(OC)c2CCN1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1230859275 VMLXEXHQXCTIQI-JTSKRJEESA-N 439.556 4.010 10 10 IICE Cc1cc(-c2nc(C)c(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)s2)ccc1F 1288334963 VHYGWMCLHWRCDI-UHFFFAOYSA-N 438.572 4.248 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3cccnc3)nc3ccccc23)N(C)C)cc1 1289600216 NJTBJQPXJWHLEY-AREMUKBSSA-N 439.563 4.396 10 10 IICE Cc1cc(C(=O)N[C@H](CC(N)=O)C2CCCCC2)c(C)n1-c1ccccc1Br 1294351675 FYNDGLNLBVNIKT-LJQANCHMSA-N 446.389 4.411 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@H]1Cc1ccccc1 1294481914 OVTWOKCKAUCNJC-AZGFIHASSA-N 440.565 4.261 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCc1cc(F)ccc1[N+](=O)[O-] 1294685034 KOWRLFHIYOLYHT-UHFFFAOYSA-N 425.254 4.183 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1 1297563085 WAIBROOKWXVFSI-UHFFFAOYSA-N 437.471 4.195 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCCO1 1305185661 NFGXMDRZTSUOII-LJQANCHMSA-N 443.661 4.083 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC(C)(C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1305551786 HRQPMUDJPJIUOD-RTBURBONSA-N 443.661 4.397 10 10 IICE COc1ccc2c(c1)[C@@H](C(=O)NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CCC2 1354783762 DFWJAACMDWQXGZ-FQEVSTJZSA-N 448.485 4.287 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1(Cc2ccccc2)CCOCC1 1360045386 DOCGMYXGYXFYFY-UHFFFAOYSA-N 444.522 4.413 10 10 IICE CS[C@@H]1CCC[C@@H](NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1435165207 IBGTVHSVPFVSBQ-QZAYQTGJSA-N 438.615 4.207 10 10 IICE CCc1nccc(C)c1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1440035548 SCMHZMGYBAASDZ-SFQUDFHCSA-N 429.542 4.322 10 10 IICE Cc1ccc(C(=O)Nc2ccc(C(N)=O)cc2OC(C)C)cc1-n1c(C)cc(C=O)c1C 1451857661 UNMUINXYLWUZPB-UHFFFAOYSA-N 433.508 4.353 10 10 IICE CCOC(=O)c1cccc2nc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)[nH]c12 1456994760 TZZWIKRHHMZXNS-UHFFFAOYSA-N 444.491 4.141 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4ccccc4)cc3)CC2)c(OC)c1 1460648357 ATVQFWAPZKKETI-UHFFFAOYSA-N 431.536 4.278 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN2Cc3ccccc3OC2=O)cc1 1464999519 FVJFPLAOCPOHCX-UHFFFAOYSA-N 445.519 4.309 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 1471425296 XWPQULCQNJNNRX-VQTJNVASSA-N 432.609 4.366 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)c(C)n1-c1ccccc1 1479064295 OYIMVBIMOQGTQI-VWLOTQADSA-N 435.568 4.457 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1C 1493971217 FNHUUZNZAPCALR-OALUTQOASA-N 443.611 4.373 10 10 IICE CC(C)CN(c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1)C1CCCC1 1509373125 PCRIQRWKACLGJZ-LJQANCHMSA-N 429.584 4.440 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C2CCCC2)n1CCOCC(F)F 1517119589 ICZBCXADIVBDFJ-UHFFFAOYSA-N 433.547 4.454 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCCC(F)(F)C1 1525799007 HNURRTHYCFHGHL-GWQWUEFDSA-N 428.501 4.111 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3csc(-c4cnn(C)c4)n3)cc2Cl)C1 1530423135 AFXYXXNIQFEKDP-CQSZACIVSA-N 429.977 4.363 10 10 IICE CCOC(=O)c1c(NC(=O)c2cn3c(n2)COCC3)sc(C)c1-c1ccc(F)cc1 1531749481 JGGLRJDYENWTKJ-UHFFFAOYSA-N 429.473 4.018 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@]3(C)CCN(C(=O)OC(C)(C)C)C3)ccc21 1533082353 UBGXYZQFMHVKRX-DEOSSOPVSA-N 429.561 4.034 10 10 IICE C[C@H]1CCCCN1CCCCn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O 1544017793 RRHPDFUGUDYKRI-FQEVSTJZSA-N 436.604 4.280 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(F)cc(Br)c1 1545632749 UUEPDYYYOIIRDN-KRWDZBQOSA-N 441.728 4.342 10 10 IICE CN1CCCc2cc(Cn3c(-c4cccnc4)nnc3N(C)CCOC(C)(C)C)ccc21 1554359654 GQBNLSAHDUUJKY-UHFFFAOYSA-N 434.588 4.022 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1CC[C@@H](Cc2ccccc2)C1 1564591861 WSOAEIYSOLXBKH-AZUAARDMSA-N 429.511 4.012 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Nc4ccccc4Cl)CC3)C2)cc1 1564963115 TTXRKVFWZYWKNK-GOSISDBHSA-N 442.991 4.461 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)c2cccc(O)c2)NC(=O)OC(C)(C)C)cc1 1586620543 YZHAKBMSWUQZDF-NRFANRHFSA-N 441.572 4.118 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 1595427307 SSMMPEUCUIHBSD-CLOONOSVSA-N 429.564 4.228 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)CC(C)C 1597133168 BMTVDWNMNUEWMS-RUZDIDTESA-N 428.573 4.260 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCOCC1)C(C)C 1615201529 IZGCBPCIKACNIO-UHFFFAOYSA-N 437.588 4.129 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1CCCCCN1CCCCC1 1617940746 QWMQMDRLWFLATN-UHFFFAOYSA-N 436.604 4.282 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(Br)cc2C(N)=O)c1 1618192990 LOPJUIGMEMSNFS-UHFFFAOYSA-N 440.297 4.020 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc2cccnc2c1O)c1cccc(Cl)c1 1630532065 FUEYHYVTUQWKAZ-LJQANCHMSA-N 441.915 4.476 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)cc2Cl)C1 1634720176 PVGRSEUAGSVIEX-IERDGZPVSA-N 447.023 4.023 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3cc(Cl)cc(C(=O)OC)c3O)ccc21 1635040555 SVZXGSNWMPLWAA-UHFFFAOYSA-N 430.888 4.302 10 10 IICE C[C@@H]1CCc2ccccc2[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1637301325 WBBGTCJLFPEPTG-SZNDQCEHSA-N 442.562 4.308 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1637410025 GOLDOUIBVCKUHS-OAQYLSRUSA-N 425.573 4.400 10 10 IICE Cc1ccc(CNC(=O)N[C@@H](CC(C)C)C(=O)NCc2c(O)ccc3ccccc23)cc1 1639383965 DDLWQOWQGODRLS-QHCPKHFHSA-N 433.552 4.384 10 10 IICE Cc1cc(CN2CCC([C@@H]3OCCC[C@@H]3NC(=O)OC(C)(C)C)CC2)ccc1N(C)C 1643326392 UOAJWLHXOGYGBQ-GMAHTHKFSA-N 431.621 4.345 10 10 IICE CS(=O)(=O)c1cccc(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)c1 1643615327 GUEZIFKCEUUTKX-IBGZPJMESA-N 428.579 4.425 10 10 IICE CC[C@@](O)(CCC(F)(F)F)CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1645753536 KDCYWXWUVRGPGA-OAQYLSRUSA-N 426.479 4.129 10 10 IICE C[C@@H]1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C[C@@H]1NC(=O)C(F)(F)F 1655187115 MHXVICCGCYVFEG-BEFAXECRSA-N 447.461 4.429 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O 1673046639 RLMCXHVYDKNXCG-UWJYYQICSA-N 427.520 4.205 10 10 IICE CCCN(C[C@@H]1COc2ccccc2O1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1673745897 YOGSARNDDIAEDG-SIKLNZKXSA-N 425.573 4.254 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1683425369 OBDWOFJSKLWFKU-OALUTQOASA-N 446.636 4.327 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1709480726 JUFRIMMDRCSVAY-HFJWLAOPSA-N 448.615 4.456 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1Cc1ccc(Cl)s1 1711095238 FTCRZFBYJIJKDH-UHFFFAOYSA-N 425.945 4.369 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCSC(F)(F)F 1767770016 MHFNICQMUNTKGO-UHFFFAOYSA-N 443.539 4.304 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3Cc3sccc3C)CC2)cc1F 1768704437 DVQSYALZENQPJC-UHFFFAOYSA-N 443.592 4.369 10 10 IICE COc1ccccc1-c1nnc(N2CCCO[C@H](C)C2)n1CCCSc1nccs1 1768886521 JSFHNXCXOBAUCK-MRXNPFEDSA-N 445.614 4.208 10 10 IICE CC(C)(C)C(=O)Nc1cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccn1 1860499946 CETIXFVXLKFGJB-UHFFFAOYSA-N 427.460 4.094 10 10 IICE CCC(CC)C(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1860548594 RBKJJHDPPNYVMR-UHFFFAOYSA-N 441.487 4.484 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2C(=O)CSC2=S)sc(C)c1-c1ccccc1 1865767924 IMQNAUHPODMNKM-UHFFFAOYSA-N 448.591 4.089 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCc4ccccc4F)cc3)CC2)cc1 1872884497 VMQBKNMFSKNYJQ-UHFFFAOYSA-N 433.527 4.087 10 10 IICE CC(C)Cc1cc(I)n(Cc2c(O)cccc2Br)n1 2070028955 YLIDRDFPTWFXBZ-UHFFFAOYSA-N 435.103 4.203 10 10 IICE Cc1ccc([C@H](C2CCC2)n2nc(C(F)F)c(CO)c2I)c(O)c1 2079052008 PCHHJJYIINBOQJ-HNNXBMFYSA-N 448.251 4.321 10 10 IICE CNCc1nn(Cc2cc(C(F)(F)F)ccc2O)c(C(F)(F)F)c1Br 2079236091 NJFHUNDPEFEWLX-UHFFFAOYSA-N 432.162 4.157 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@H](NCc3cc(Br)cc(F)c3O)[C@H]2C1 2149375969 QXPFXORXDDSZMH-YLQAJVPDSA-N 443.357 4.419 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(C(C)=O)c3)C2=O)cc(OC)c1OC 2296883584 ZYIOXNXNSTUCKI-UHFFFAOYSA-N 429.519 4.321 10 10 IICE O=C1NC(=S)SC1=Cc1ccc(OS(=O)(=O)c2ccc3ccccc3c2)cc1 2297331692 KPUFSNNHTLPDAU-UHFFFAOYSA-N 427.528 4.096 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccc(C)cc1C 2297347518 DDVLFBJXEWYUKK-UHFFFAOYSA-N 447.491 4.220 10 10 IICE CC1CCN(c2cc(N3CCC(C)CC3)c([N+](=O)[O-])cc2C=C2SC(=N)NC2=O)CC1 2297531787 IYJHEEWGTKMVMU-UHFFFAOYSA-N 443.573 4.206 10 10 IICE O=C1C(=Cc2ccc(Br)cc2F)SC(=S)N1CCCn1ccnc1 2323840292 JKFJVEBJLILZNR-UHFFFAOYSA-N 426.336 4.076 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CNC(=O)C=Cc3ccccc3[N+](=O)[O-])cc2)c1 2328618977 HGUKDPJMHBZTSA-UHFFFAOYSA-N 444.491 4.243 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)C=CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2381137474 NVXRBORQBQKCDQ-HXUWFJFHSA-N 439.350 4.035 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471750 NBKUNXBYLPWQOX-IPJJNNNSSA-N 427.526 4.452 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3cccc(O)c3)SC2=S)cc1 15047531 DPKQKPVESCFNCU-CYUIRQCWSA-N 428.535 4.019 10 10 IICE COc1cccc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 207112848 KAUUZBNYSWQHIQ-PDGQHHTCSA-N 431.510 4.169 10 10 IICE CCCCOc1ccc(/C=C2/SC(Nc3ccc(O)cc3C(=O)O)=NC2=O)cc1OC 210536186 UXUGNCMSRKZKFF-YBFXNURJSA-N 442.493 4.360 10 10 IICE CCCCc1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n[nH]1 224385480 APRBMRSWZRFTFG-QINSGFPZSA-N 434.612 4.434 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(Br)cn2)C1 435659366 IXZYAUQDQLPRHT-UHFFFAOYSA-N 427.346 4.204 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3[nH]c4ccc(Cl)cc4c3Cl)CC2)cc1 742919023 AAJNSDHMPBWNOY-UHFFFAOYSA-N 447.366 4.035 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3cccc(Cl)c3)cc2F)C[C@@H](C)O1 753779117 LEOKRAIAOBXCLM-BRWVUGGUSA-N 433.955 4.060 10 10 IICE Cc1coc(-c2cccc(NC(=O)C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2)n1 759023871 YNKQGEUTVZOQIJ-UHFFFAOYSA-N 442.519 4.355 10 10 IICE COc1cc(NC(C)=O)ccc1[C@H](C)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 773145677 LOJGUIFNKAMYRI-IBGZPJMESA-N 436.600 4.036 10 10 IICE C[C@@H]1CN(Cc2cccc(N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)c2)C[C@@H](C)O1 777226456 FOZVRYKMPIDOOI-VAMGGRTRSA-N 427.564 4.445 10 10 IICE COc1cc(Br)ccc1/C=C1/SC(=S)N(CCc2cccnc2)C1=O 781550229 PACNELSFBICCJU-CXUHLZMHSA-N 435.368 4.297 10 10 IICE CC(=O)[C@@H](C)CCCCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 783222746 PSLAEILMGXMKSL-DOTOQJQBSA-N 449.503 4.118 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H](c1ccc(F)cc1)C(F)(F)F 792497762 YVOOZMZADTVUGL-HXUWFJFHSA-N 439.453 4.137 10 10 IICE COc1ccccc1[C@H](O)CNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799993270 FNUBQBGTWNEDJS-HRAATJIYSA-N 431.964 4.118 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ncc(Cc4ccc(F)cc4)s3)CC2)cc1 915320739 XBIGELYIXYWFJX-UHFFFAOYSA-N 426.517 4.236 10 10 IICE Cc1ccc([C@@H]2CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1C 920812903 ZWUWLCLSXCJXGK-QHCPKHFHSA-N 425.548 4.450 10 10 IICE O=C(COc1cccc(C(F)(F)F)c1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657950 NEIAXIHEXUZANH-HNNXBMFYSA-N 444.400 4.471 10 10 IICE CCOC(=O)c1cccc2nc(NC(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)[nH]c12 1134937419 PJOIAGSDGQMOPE-UHFFFAOYSA-N 434.496 4.210 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N=[S@@](C)(=O)c2ccccc2F)C1 1135036815 KBDTUIRWFMDMBO-PMERELPUSA-N 427.545 4.230 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2-c2cn[nH]c2)NC(=O)OC(C)(C)C)cc1 1136903383 CMVAPEUMMCRSKN-JOCHJYFZSA-N 449.555 4.139 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3Nc3ccc(C)cc3)cc2)CC1 1154271964 WZXCHGNARKSLLQ-UHFFFAOYSA-N 442.563 4.337 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)C2(OC)CCC2)sc(C)c1-c1ccccc1 1171208093 KEAUVOFHWMEEJR-MRXNPFEDSA-N 430.570 4.386 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCOc3ccc(Cl)c(Cl)c3)C2)cc1 1251498944 OQBZSHLPESWIRX-OAHLLOKOSA-N 438.355 4.207 10 10 IICE Cc1cc(CNC(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)c(C)n1-c1ccccc1 1254078684 DKMGWLLPFQTZRF-IBGZPJMESA-N 436.600 4.274 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)COc3ccccc3OCc3ccccc3)C2)cc1 1276832661 YOJSXYBOHPTXOC-JOCHJYFZSA-N 446.547 4.296 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCSC[C@@H]3c3ccc(C)cc3)C2)cc1 1312903057 TZLLCCFJCCSGAA-WMZHIEFXSA-N 425.598 4.330 10 10 IICE CCOCCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1314461233 MFIWJPDRJBFXBV-JOCHJYFZSA-N 427.593 4.183 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cc(=O)c(OCc3ccc(F)cc3)co2)C2CC2)cc1 1354143215 XNJLBODBIYDUQR-UHFFFAOYSA-N 436.483 4.229 10 10 IICE CCOC(=O)C1CCC(CC(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CC1 1435072907 CLQWBJJGTDKNJA-UHFFFAOYSA-N 428.495 4.403 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(-c3cn[nH]c3)cc2)NC(=O)OC(C)(C)C)cc1 1444503204 JRTCMVGDDXAYHY-JOCHJYFZSA-N 449.555 4.139 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3sc(-c4ccc(C)cc4)nc3C)cc2)CC1 1447710393 KAZCLZQTNLDVTC-UHFFFAOYSA-N 448.592 4.025 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N1C2CCC1(CNC(=O)OC(C)(C)C)CC2 1471020745 KZQURNLILNDCFL-UHFFFAOYSA-N 430.593 4.216 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CCCN2CC(F)(F)F)cc1 1471281903 MUHIHTKNDWTJIL-IBGZPJMESA-N 438.494 4.084 10 10 IICE COc1ccc(N2CCN(C(=O)COc3cc(C(F)(F)F)ccc3Cl)CC2)cc1 1472941968 KXJZXTMUNWAIHU-UHFFFAOYSA-N 428.838 4.095 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCC2(NC(=O)OC(C)(C)C)CC2)cc1 1479437214 YHUVFCXGNHJROE-UHFFFAOYSA-N 442.560 4.115 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)O[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1509156662 JSGSVFGNSBZCBB-UONOGXRCSA-N 449.568 4.272 10 10 IICE CCC(CC)N1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)CC1=O 1515517922 DAPOLPNJUDKJLS-CABCVRRESA-N 434.602 4.414 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1516370784 BVDQKTIRJZGWAP-PKTZIBPZSA-N 448.615 4.403 10 10 IICE Cc1cc(CC(=O)Nc2ccc(Br)cc2C(N)=O)c(C)n1-c1ccccc1 1534432426 AZNWEOSYFVOFDQ-UHFFFAOYSA-N 426.314 4.137 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@H](NC(=O)OC(C)(C)C)c2ccccc2)cc1 1538161337 VKATZUXVVBZTTI-QFIPXVFZSA-N 441.572 4.246 10 10 IICE COc1ccc(O[C@H](C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1539633456 BFPURQBDDFTZNK-LJQANCHMSA-N 435.568 4.000 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C)CC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1542183971 LDUFVYLLJGAVPK-SFHVURJKSA-N 434.588 4.067 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1C[C@@H](C)S[C@H](C)C1 1542227024 QISJRCFLHVBRCB-RTBURBONSA-N 436.629 4.017 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H]3CCCCS3)CC2)cc1 1554958764 FYNKCSJHWRKNAJ-OAQYLSRUSA-N 429.634 4.413 10 10 IICE Cc1ccc(C(=O)N[C@H](C)c2ccc(N3CCNC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1557150770 PBGRTNWXRXWAIA-GOSISDBHSA-N 444.535 4.236 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C2CC2)cc1 1564378595 QMVIYHREQLGPAW-INIZCTEOSA-N 444.938 4.025 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3cc(C(F)(F)F)cc(Cl)n3)CC2)cc1 1584360889 DDIBWHDEICHDET-UHFFFAOYSA-N 427.854 4.090 10 10 IICE CC(C)(C)c1cc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)no1 1585681555 IMTBEXNGIKTUDI-YBEGLDIGSA-N 448.541 4.446 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)C2)cc1 1587112568 HBHWKUZPIJLBHA-UUOWRZLLSA-N 438.474 4.489 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2CON(C(=O)OC(C)(C)C)C2)cc1 1602848753 XAMJQTCHSUYHNU-KRWDZBQOSA-N 439.516 4.449 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2CCn2cncn2)c(C)n1-c1ccccc1 1611934631 PHIWDIUCMHDTRQ-UHFFFAOYSA-N 432.576 4.127 10 10 IICE Cc1cc(C(=O)COc2cc(F)cc([N+](=O)[O-])c2)c(C)n1-c1ccc2c(c1)OCCO2 1613654843 LRQCPVACSXZMDS-UHFFFAOYSA-N 426.400 4.174 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(O[C@H](C)C(F)(F)F)nc3C)CC2)cc1 1623429674 LORVDHAJCJDSJY-MRXNPFEDSA-N 437.462 4.081 10 10 IICE CN(C)c1ccc(CN(C)C(=O)[C@]2(c3ccccc3)C[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1624479954 QSDYEAOVWJJQAE-WVPZODRTSA-N 437.584 4.336 10 10 IICE CN(C(=O)OC(C)(C)C)[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1ccccc1 1625101994 HQNDBKQFUYHRDW-LJQANCHMSA-N 439.516 4.057 10 10 IICE CCCCn1nc(C)c(-c2cc(C(=O)NCc3cccc(Br)c3O)n[nH]2)c1C 1626821761 FCXOZJYJXQFBDZ-UHFFFAOYSA-N 446.349 4.088 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)C2CC2)cc1 1634218899 LJCWGJXUWNERDV-AZGAKELHSA-N 439.575 4.340 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3ccc(F)cc3F)CC[C@H]2C)c([N+](=O)[O-])c1 1640452695 GNWZOFINAFLWFC-SGJXGLNRSA-N 431.439 4.164 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2oc(COc3ccc(C=O)cc3)cc2C)cc1 1644437442 CVXIOJDTTVLPIW-UHFFFAOYSA-N 436.508 4.197 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3c(-c4ccc([N+](=O)[O-])cc4)noc3=O)c2C)cc1C 1651789306 FURBTXIZXXJWMS-UHFFFAOYSA-N 446.463 4.319 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)c1O 1658608030 OVHGYODDHGGWOL-NRFANRHFSA-N 428.960 4.352 10 10 IICE CCc1ccc([C@H](CNC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)N(CC)CC)cc1 1673207231 BWPNMOXGVFCRRZ-RDGATRHJSA-N 438.616 4.219 10 10 IICE Cc1cc(CCNC(=O)NCC2CCN(CC(F)(F)F)CC2)c(C)n1-c1ccccc1 1681608976 GAVHTRJYWPQRAF-UHFFFAOYSA-N 436.522 4.210 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CC[C@@H](c2ccc(Cl)cc2)C1 1683014251 NVMIPNNNXQIPST-QGZVFWFLSA-N 435.902 4.154 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@H]1CCCCCN(Cc2ccccc2)C1 1683333666 QVFDEZHLHKVQOH-IBGZPJMESA-N 446.389 4.399 10 10 IICE CC1CCN(c2ccc(Cn3c(-c4ccccn4)nnc3N(C)CCCCCO)cc2)CC1 1708103795 DZTSLJWONZMNCQ-UHFFFAOYSA-N 448.615 4.224 10 10 IICE FC(F)(F)[C@@H]1CN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CCO1 1712859175 UUVHVTUHWQWHCW-AWEZNQCLSA-N 447.552 4.342 10 10 IICE C[C@H]1CN(C(C)(C)Cn2c(C3CCCC3)nnc2N(C)Cc2ccccc2O)C[C@H](C)O1 1726646420 WHMIWTPYADYJNY-OALUTQOASA-N 441.620 4.166 10 10 IICE COCC1=CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC1 1730534808 SJAOSKAFDHMWNG-UHFFFAOYSA-N 447.655 4.352 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC)C1CCCC1 1745933359 AKUAUNNSMZIWOW-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CC[C@@H](F)C1 1747719889 DEBZSBYOSNTCTF-WOJBJXKFSA-N 429.584 4.187 10 10 IICE COc1cc(/C=C2/SC(=S)N(Cc3ccccc3Cl)C2=O)cc([N+](=O)[O-])c1O 1858591261 HHCZZOLQUCHDDW-OVCLIPMQSA-N 436.898 4.364 10 10 IICE CCN[C@H](c1ccc(I)c(Br)c1)c1ccccc1O 2090045807 RJLMODMUMLUWRK-OAHLLOKOSA-N 432.099 4.458 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c1O 2236056769 XIWOKXYAUMSXSK-KGLIPLIRSA-N 443.382 4.146 10 10 IICE O=C1N=C(N2CCN(c3ccccc3[N+](=O)[O-])CC2)SC1=Cc1ccc(Cl)cc1 2296758984 QTKYMZFFZYMFMJ-UHFFFAOYSA-N 428.901 4.041 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1ccc(C(=O)O)cc1 2297578921 RUFCPHKILFLFAS-UHFFFAOYSA-N 444.534 4.378 10 10 IICE Cc1ccc(CN(C)[C@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(O)c1Br 2307568094 AERHTNWOLNVEEH-ROUUACIJSA-N 433.346 4.352 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(Br)o2)SC1=S)c1cccc(Cl)c1 2314764973 QLIXTXCYLNSNMA-UHFFFAOYSA-N 443.731 4.242 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3cccc(O[C@@H](C)C(=O)O)c3)SC2=S)cc1 2314932224 ULNWWMWAUZZIMB-ZDUSSCGKSA-N 427.503 4.147 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(Nc3ccccc3)C2=O)cc1OC)C(=O)O 2314933657 WVUNJVNVVCOFOJ-HNNXBMFYSA-N 444.534 4.166 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccc(F)cc3)C2=O)ccc1O 15039509 INOPYHOYXKNSQH-PDGQHHTCSA-N 446.525 4.160 10 10 IICE O=C(O)c1ccc(-n2cccc2/C=C2\C(=O)N(c3ccc(Cl)cc3)C(=O)N=C2O)cc1 33436727 IIMNLYQSKKPLHX-PDGQHHTCSA-N 435.823 4.336 10 10 IICE C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)/C(=C\c2ccccc2)SC1=S 33558481 RTIAZHYTOJDMRG-NPRIEWAGSA-N 435.574 4.117 10 10 IICE COCCN1C(=O)/C(=C/c2nc(-c3ccc(C)cc3)nn2-c2ccccc2)SC1=S 103802631 CXGQNAWWPZLBJJ-JXAWBTAJSA-N 436.562 4.090 10 10 IICE O=C(CCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1nc2ccccc2s1 206726113 SEQRJSODDQDNAX-XNTDXEJSSA-N 445.616 4.266 10 10 IICE CC(=O)Nc1cccc2c1CCCN2C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435569812 ZEOOVYCPSKSFOG-UHFFFAOYSA-N 444.579 4.346 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)C3CCN(CC(F)(F)F)CC3)ccc21 527310705 QZUQIVLNNQTTNM-INIZCTEOSA-N 439.522 4.297 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccc(COC2CCOCC2)c1 732475348 BIWMNCDGIBHQRD-UHFFFAOYSA-N 425.573 4.180 10 10 IICE Nc1ccc(Cc2nc(C(=O)OCCCc3nc(-c4cccs4)no3)cs2)cc1 751931974 RDMKUJMBXNDNHQ-UHFFFAOYSA-N 426.523 4.217 10 10 IICE O=C(/C=C/c1ccnc2ccccc12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768542040 DKPQHWDEMCHTLS-FMIVXFBMSA-N 426.564 4.096 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1sc([C@H](C)OC)nc1C 791246234 KERUVEAOBLVHHM-HNNXBMFYSA-N 433.574 4.161 10 10 IICE O=S(=O)(/C=C\c1ccc(Br)cc1)NCc1cc(Br)ccc1O 796191275 IOLQWHWKZLWKRA-FPLPWBNLSA-N 447.148 4.008 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 802005581 NXJKNMCXZBCABE-LJQANCHMSA-N 443.485 4.051 10 10 IICE Cc1ccc(/C=C/C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Br)c1 920881891 SQSLFMPXJIVRNU-JEJOPICUSA-N 429.358 4.485 10 10 IICE CCOC(=O)[C@H](C(C)C)N1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1081156840 KWMCGNCXTRKJAY-SSUFTNFISA-N 428.373 4.238 10 10 IICE CC[C@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N(C)C(=O)OC(C)(C)C 1136546811 XZBCDHIFOXQIJV-GOSISDBHSA-N 441.519 4.019 10 10 IICE Cc1cc(C(=O)Nc2cc(C3CCOCC3)[nH]n2)c(C)n1-c1ccc(Br)cn1 1137055277 JHLSFVBQJXSELO-UHFFFAOYSA-N 444.333 4.121 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1 1140885576 TUYHCMMGZTYGQZ-LJQANCHMSA-N 433.499 4.469 10 10 IICE O=C(Cc1scnc1-c1ccccc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150346860 CETZTGCRMAOLDZ-IBGZPJMESA-N 441.984 4.492 10 10 IICE COc1ccc(CNC(=O)c2nn(-c3cc(Cl)c(Cl)cc3Cl)cc2O)c(O)c1 1183275876 PEEHWHQXYBRWIE-UHFFFAOYSA-N 442.686 4.182 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1c2ccc(Br)cc2nn1C 1276284523 UPIPIYMTIPINDK-AWEZNQCLSA-N 429.362 4.071 10 10 IICE CC(C)(C)c1nnc(N2CCCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1287006680 YBGAEXWMSSOPAJ-UHFFFAOYSA-N 425.621 4.213 10 10 IICE COc1cc2c(cc1OC)CCN(C(=O)c1ccccc1-n1c(C)cc(C=O)c1C)CC2 1292038373 WNCKELXCCSSRBS-UHFFFAOYSA-N 432.520 4.165 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CC3)nnc2N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)cc1 1295414379 GSEKPXYYJIIVFM-DNVCBOLYSA-N 437.510 4.206 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1cccs1 1304237924 HEJSXHOZOQBIPC-LJQANCHMSA-N 425.602 4.293 10 10 IICE CCN(CCCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1352461658 KOIJGHXNBXXJBR-UHFFFAOYSA-N 432.612 4.441 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1361048674 FZPNTYWDXPZKIU-RTBURBONSA-N 448.615 4.313 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Cc1cccs1 1435332613 MCNPOKQVWOHRHB-CRRKTRLDSA-N 448.610 4.474 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/c3ccsc3C(F)(F)F)CC2)c(OC)c1 1438184965 IVQCQEKVZZQWPL-ZZXKWVIFSA-N 426.460 4.146 10 10 IICE Cc1cc(C(=O)NCC(=O)c2cccc(F)c2F)c(C)n1-c1ccc(Br)cn1 1454407362 HUAOGQDEYJDEKI-UHFFFAOYSA-N 448.267 4.143 10 10 IICE Cc1cc(C(=O)CSc2nncn2-c2ccccc2F)c(C)n1-c1ccc(F)cn1 1458824010 BPRMQEAIEBUXDU-UHFFFAOYSA-N 425.464 4.323 10 10 IICE C[C@H](NC(=O)CCOc1ccccc1I)c1ccc(N(C)C)cc1 1459175866 ABFAKLHJKGTGJB-AWEZNQCLSA-N 438.309 4.004 10 10 IICE Cc1cc(C(=O)N[C@H](CO)Cc2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1467690365 PNELETFBSSFDQK-IBGZPJMESA-N 445.332 4.329 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2c(O)ccc3ccccc23)[C@@H]1c1ccc(Cl)c(F)c1 1472085259 NVBGCYZAZHWYAI-ZHRRBRCNSA-N 426.875 4.174 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@@H](O)c2cc(F)ccc2F)CC1 1478840793 HRMZTFNKQHDNJA-MZNJEOGPSA-N 445.554 4.425 10 10 IICE COC(=O)c1ccc(F)c2c1CN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)CC2 1479064545 RVEQDBHSPLNQCW-UHFFFAOYSA-N 449.526 4.330 10 10 IICE C[C@@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)N(C)C 1510101234 AQHNDUYHVJMAPM-IBGZPJMESA-N 438.645 4.117 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccccc3OCc3ccc(F)cc3)cc2)CC1 1536925097 QEFONKOOUIUVGN-UHFFFAOYSA-N 433.527 4.087 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)cc1 1540459301 AVOMZOLXGOSTBB-GOSISDBHSA-N 443.975 4.206 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c1 1543808804 IRQUNUVGDDDUCZ-GOSISDBHSA-N 435.568 4.017 10 10 IICE COc1cc(Br)cc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 1565323817 CPSFXQHIJMRACX-SFHVURJKSA-N 449.345 4.054 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCSc1nccs1)c1c(F)cccc1F 1565620023 HYPQQSHHFJSGRV-OAHLLOKOSA-N 443.541 4.286 10 10 IICE C[C@H](c1ccc(Br)cc1)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1586006089 PXWXNXWFMSOFLD-CQSZACIVSA-N 444.333 4.131 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2[C@H]3c4ccccc4C[C@H]32)NC(=O)OC(C)(C)C)cc1 1586620242 UUBYHFOZARKVCR-WZYRSQIMSA-N 435.568 4.021 10 10 IICE C[C@]1(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C[C@@]1(F)Cl 1586777704 KWKAAVSHARYUEQ-GPZRBPIUSA-N 444.956 4.238 10 10 IICE CC1(C)CO[C@H](CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1597742065 CFKDAGHWQGLRAJ-VQCBNXJZSA-N 438.640 4.051 10 10 IICE CC(C)NC(=O)c1nnc(N2CC[C@@H]3CCCC[C@@H]3C2)n1CCCSc1nccs1 1608469870 RILJLZXWHSSQDF-DLBZAZTESA-N 448.662 4.072 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1615768707 MUPYZXKXXWZUEB-ZWKOTPCHSA-N 430.616 4.039 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3cccc(Cl)c3)cc2F)C[C@H](C)O1 1616714085 IEDRRXZHEMYACZ-IRXDYDNUSA-N 447.982 4.234 10 10 IICE C[C@H](NC(=O)[C@@H]1C[C@H](C(F)(F)F)CN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1625544172 QPMZZIMRLMHGRS-QRTARXTBSA-N 429.483 4.118 10 10 IICE COc1ccccc1[C@@H](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)N1CCCC1 1628258536 AHFHXPPOOIBVJE-RUZDIDTESA-N 445.563 4.482 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@]2(c3ccccc3)CCN(C(=O)OC(C)(C)C)C2)c1 1630365692 DCTYQYQKOXCCBE-SSOJOUAXSA-N 440.540 4.157 10 10 IICE CC1(CC(F)F)CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1630922200 UXVMNVVZYJEYCU-MDWZMJQESA-N 430.567 4.233 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H](O)c2cc(Cl)c3c(c2)OCCO3)c1C 1631206854 PZCHXMDECLIITK-NRFANRHFSA-N 440.927 4.291 10 10 IICE Cc1cc(C(=O)N(CCO)CCOCC(F)(F)F)c(C)n1-c1cccc(C(C)C)c1 1632104511 WKUMWYSEPCWSHI-UHFFFAOYSA-N 426.479 4.231 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1 1632133774 HMUUSHWQMAEOFC-GOSISDBHSA-N 437.565 4.252 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cc2)cc1 1634448519 TVGISHNKJUPUBN-SFHVURJKSA-N 437.565 4.353 10 10 IICE CCOC(=O)c1nc(NCc2ccc(N3CCSCC3)cc2)ccc1Br 1639296121 UGABDZQACPIVTJ-UHFFFAOYSA-N 436.375 4.186 10 10 IICE CCN(C(=O)OC(C)(C)C)C1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1 1640548858 GZILZUPKUGJNNJ-CSKARUKUSA-N 433.505 4.007 10 10 IICE Cc1cc(C(=O)N2CCO[C@](C)(C(F)F)C2)c(C)n1-c1cccc(Br)c1 1641017817 UAHBBDRUXBBGCN-IBGZPJMESA-N 427.289 4.353 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCCC(=O)c3ccc(Br)cc3)C2)cc1 1641228486 VHRIVRGWYIONCU-SFHVURJKSA-N 445.357 4.206 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](C)Sc4ccc(Cl)cc43)nc12 1642211792 SKDYKVZJOYZVOF-LBPRGKRZSA-N 432.933 4.156 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3ccc(Cl)c(F)c3)C[C@H]2C)c([N+](=O)[O-])c1 1655537079 GUZSYHNVSRVPMY-SMGNDMQFSA-N 433.867 4.289 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccccc2)c1 1683747492 NAWWCOFOSFIKTG-NHCUHLMSSA-N 439.556 4.293 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 1684387503 ZYMLPJMAJAVXLT-FQEVSTJZSA-N 430.593 4.074 10 10 IICE COCCN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1698021699 GJMZJXAFXQCYOQ-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCO[C@@H](C)C1 1708508434 GWGFASMKXLGIKS-ACRUOGEOSA-N 441.620 4.332 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C1 1728409945 ONNQAJITWMXVFR-QGZVFWFLSA-N 436.695 4.383 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CN(C(=O)OC(C)(C)C)C1 1763506826 MVCDVDFLNUYJCG-INIZCTEOSA-N 429.565 4.001 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1763606595 JTZBDXAPGKXAQZ-PXNSSMCTSA-N 429.584 4.298 10 10 IICE CCN(CC)c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc(-c2cccc(OC)c2)n1 1867992347 BCYXJLMLCVPPGK-UHFFFAOYSA-N 447.583 4.334 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCCCc4ccccc4)cc3)CC2)cc1 1872883887 BQJMSPKAFKBDKB-UHFFFAOYSA-N 443.591 4.380 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC12CC(NCc1cc(Cl)cc(Br)c1O)C2 1965973250 WYNWFHOWCDBGGO-FHBSJOOWSA-N 431.758 4.344 10 10 IICE N=C1/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)N=C2SC(C34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)=NN12 2059072239 VGHZHEQHCWDTCO-HHIUSEMDSA-N 435.509 4.430 10 10 IICE Cc1cc(O)c([C@H](C2CCC2)n2nc(C)c(C(=O)O)c2I)cc1C 2079931603 HBBMUBYOGQRCLA-INIZCTEOSA-N 440.281 4.206 10 10 IICE Cc1cc(O)c([C@H](n2nc(C)c(CN)c2I)C(C)(C)C)cc1C 2079939722 RITUQODQDKVKKG-INIZCTEOSA-N 427.330 4.213 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3cccc(Br)c3O)CCC[C@H]12 2087283117 VBQQKEBABXIVNR-OXJNMPFZSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@H]2NCc2cc(Br)ccc2O)CC1 2132805281 UYVLTXTXPWHNDB-QGZVFWFLSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1O 2227749811 VSLZOYAVJQHLSN-CHWSQXEVSA-N 429.355 4.041 10 10 IICE CCCNC(=O)[C@@H](C(C)C)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2297580178 XUGHMYKZIYLHOF-OAHLLOKOSA-N 441.416 4.201 10 10 IICE CCCCCN1C(=O)C(=Cc2c(N3CCCCC3)nc3ccccn3c2=O)SC1=S 2314414581 DRISZKNJQGSWKZ-UHFFFAOYSA-N 442.610 4.076 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475872 AWNWHHYDURMGII-VWKPWSFCSA-N 443.525 4.204 10 10 IICE CN(C)c1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)COc2ccccc2C=O)cc1 72413074 MQTXVSKLWDFTBC-XMMPIXPASA-N 427.504 4.322 10 10 IICE COc1ccc(N2CCC(NC(=O)NC3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)CC2)cc1 732250160 XPCQDVBTFDXKPC-WINZOAQQSA-N 448.611 4.159 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)C1 766709624 JHVJVXXTIRASND-FQEVSTJZSA-N 446.595 4.272 10 10 IICE CC(C)c1noc(-c2ccnc(NCc3ccc(N4CCN(CC5CC5)CC4)cc3)c2)n1 768528802 YWKAQTJKPPCLTI-UHFFFAOYSA-N 432.572 4.399 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1N1CCCC1 768847227 QHBATIIZAVMNOG-UHFFFAOYSA-N 433.600 4.141 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc(Cl)c3)cs2)cc1 917887036 BQGOIRUZTQMWAS-UHFFFAOYSA-N 442.971 4.058 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H]3Cc3cccc(F)c3)cc2F)C[C@@H](C)O1 918081259 MSXGVMPUNDLOCA-SVMVAKDDSA-N 443.538 4.495 10 10 IICE Cc1ccc(-c2nc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cs2)cc1 919969057 DOPYMZZNKGNASI-UHFFFAOYSA-N 425.529 4.149 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1C1CCOCC1 1136311120 GWAJAEXGJCYOCI-HDICACEKSA-N 443.563 4.139 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C(=O)OC)ccc1Cl 1139585247 OAQMFXIWNHISTK-UHFFFAOYSA-N 446.931 4.129 10 10 IICE O=C(N[C@H](CCO)c1cccc(OC(F)(F)F)c1)c1cc2cc(O)c(O)cc2s1 1143074201 RFKUFHPHRBRXKG-CYBMUJFWSA-N 427.400 4.065 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(F)cc1 1147362147 YMHVCDMKIPWYFL-NRFANRHFSA-N 425.891 4.422 10 10 IICE CC1(C)C[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2cc(F)ccc2O1 1230648300 JNNKYCMHWHQMNC-QFIPXVFZSA-N 441.547 4.136 10 10 IICE Cc1cnn(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)c(N)cc2F)c1 1290756777 JFKUIJMPDZGUBS-UHFFFAOYSA-N 447.514 4.404 10 10 IICE CCOCn1nc(C)c(C[C@@H](C)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1C 1293146944 XDRAAKQKYXSRDF-LJQANCHMSA-N 426.605 4.225 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC[C@H]3[C@H](C2)C3(F)F)NC(=O)OC(C)(C)C)cc1 1293791452 BQCFZOKUHHRDJA-BVBHFADKSA-N 437.531 4.116 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCN(C(=O)CCc4ccccc4)C3)c2C)c1 1295040822 AKSXPFPFWCQKPT-QHCPKHFHSA-N 429.564 4.366 10 10 IICE CCOC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(N=NC(N)=O)cc1 1295163733 XFMIPBLVLWWYJE-UHFFFAOYSA-N 434.250 4.432 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1nc(C2CC2)cs1 1295352465 JINBAJJLDYVJKX-CXUHLZMHSA-N 447.582 4.067 10 10 IICE Cc1cc(C(=O)NC[C@@](C)(O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cn1 1295923985 SCJJPPKAYFFANA-OAQYLSRUSA-N 446.320 4.028 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C(N)=O)C3)n2CC(C)(C)C(C)C)c(C)n1-c1ccccc1 1304194937 FRQDPAYDWXTIPG-HXUWFJFHSA-N 448.615 4.346 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H](C)CC3)n2CCCSc2nccs2)n1 1304755598 DIFPAKMMZXBOJR-MRXNPFEDSA-N 445.662 4.405 10 10 IICE CCOC(=O)c1c(NC(=O)COCc2nc(CC)no2)sc(C)c1-c1ccc(C)cc1 1355898384 JTNAXQLUQSNZBY-UHFFFAOYSA-N 443.525 4.309 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCSC1(C)C 1359681081 OJHOYEYDDODCGF-HXUWFJFHSA-N 443.661 4.406 10 10 IICE CC(C)[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)N1Cc2ccccc2C1=O 1435072392 AKPOEOZTCDILIH-NRFANRHFSA-N 447.501 4.324 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccc(Cl)cc2)C(N)=O)c(C)n1-c1ccc(Cl)cc1 1436169432 ZJCNLUWGICQWEI-NRFANRHFSA-N 444.362 4.156 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1F 1443772496 QFSXOEGIUPIGOZ-GOSISDBHSA-N 433.568 4.325 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1447566092 WPUZYLJLQYMKHE-DNVCBOLYSA-N 426.513 4.027 10 10 IICE CC(=O)c1cccc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1 1450161033 YLKMGSWFFQKPBY-LDADJPATSA-N 444.603 4.249 10 10 IICE COC(=O)C[C@H]1CN(C(=O)c2ccccc2CCNC(=O)OC(C)(C)C)c2ccccc21 1455097108 YLZAAYMQOLCWKV-SFHVURJKSA-N 438.524 4.061 10 10 IICE COc1ccc([C@@H]2CCCN2C(=O)CN2CCCc3cc(OC(F)F)ccc32)c(OC)c1 1459678326 TYYGAQJMTMPDAT-NRFANRHFSA-N 446.494 4.422 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 1460336265 PTNUPMXNCCSVND-UHFFFAOYSA-N 429.870 4.374 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2 1460981561 HMYTYWFTDDZWNF-WNSKOXEYSA-N 444.000 4.391 10 10 IICE COc1ccc(OCCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1463781588 COSDSLYBUQUSTB-UHFFFAOYSA-N 444.329 4.069 10 10 IICE O=C(NCC[C@H]1CCC2(CCOCC2)CO1)N(Cc1ccco1)Cc1ccccc1O 1471328046 MFARYWVQDJLLBP-HXUWFJFHSA-N 428.529 4.063 10 10 IICE CC[C@H](Nc1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1472518659 XNQLFJUCZVHRFP-FCHUYYIVSA-N 440.588 4.325 10 10 IICE COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1473843155 QQUMGIVKJOCUBU-SJORKVTESA-N 442.515 4.457 10 10 IICE C[C@@H](NC(=O)N1CCC(Oc2ccc(C(F)(F)F)cn2)CC1)c1ccc(N(C)C)cc1 1478470812 JWIXZHHWJUUAHS-OAHLLOKOSA-N 436.478 4.480 10 10 IICE Cc1noc([C@@H]2CCCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)cc3C)C2)n1 1493103910 UNBDGPFVODXULF-LJQANCHMSA-N 437.592 4.074 10 10 IICE CCOC(C)(C)Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1516090274 VBLUHPGXJKPNCS-NRFANRHFSA-N 441.620 4.224 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cncc(-c4cccc(C)c4)c3)cc2F)CC1 1528701937 SSUAMQNTFJBXDV-UHFFFAOYSA-N 432.543 4.268 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(OCC(=O)OC(C)(C)C)cc1 1528932242 GXTGKKOFRIVXMB-SFHVURJKSA-N 426.557 4.143 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CCCN2CC(F)(F)F)c(C)n1-c1ccc(Cl)cc1 1534401534 XMONDONWTBSCMI-IBGZPJMESA-N 427.898 4.433 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC(=O)N3CCCCc4ccccc43)ccc21 1538780532 JGLGSJOKDUUPJE-UHFFFAOYSA-N 433.552 4.004 10 10 IICE CC(C)(C)Cc1nnc(N2CCN(C(C)(C)C)CC2)n1CCCSc1nccs1 1541183594 KCWDISSLRAVHAP-UHFFFAOYSA-N 436.695 4.426 10 10 IICE CCCCN(C)C(=O)C1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1542126588 HYBCMHWCCZJDLT-UHFFFAOYSA-N 437.584 4.326 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)c(OC)c1 1543632624 OAFVIWVRTDSVQK-UHFFFAOYSA-N 428.838 4.338 10 10 IICE Cc1ccc(C(=O)NCCC(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)c(O)c1 1546150429 OCIANYGBBGWCHM-IBGZPJMESA-N 432.520 4.316 10 10 IICE CC[C@H]1CCC[C@H]1Cn1c([C@H]2OCC[C@H]2COC)nnc1N(C)Cc1ccccc1O 1546643690 OPPXERJRZLANTB-JEEBJRHZSA-N 428.577 4.170 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1 1555467048 WDIFUZAXQOONON-QFIPXVFZSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(C3CC3)[C@@H](C)c3ccccc3Cl)CC2)cc1 1559525392 LUDJCQSEZJQAGB-UGKGYDQZSA-N 444.019 4.057 10 10 IICE CCOc1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(F)c1 1570446945 SXQHEBHWQSCSNO-UHFFFAOYSA-N 436.486 4.045 10 10 IICE COc1ccc(-c2n[nH]c(CNC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)n2)cc1 1627486713 XMRLJVJDBXCKON-UHFFFAOYSA-N 449.942 4.400 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)CCCC1 1628179763 JRHMYOOAMHRHDR-KRWDZBQOSA-N 443.588 4.148 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](C(=O)NCc2cccc(Br)c2O)c2ccccc21 1634724648 DTQPGLPGSLUVLH-HNNXBMFYSA-N 447.329 4.310 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3N(C)C(=O)c3cccs3)C2)cc1 1638647009 YBOGJUIZULDNFJ-GOSISDBHSA-N 449.576 4.290 10 10 IICE C[C@@H]1CN(c2ccc(NC(=O)CN(C)c3ccc(-c4nccs4)cc3)cc2)C[C@@H](C)O1 1643359738 BAQRQCYRPYLPRT-QZTJIDSGSA-N 436.581 4.499 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1644808636 UHTWBULBFURASZ-CALCHBBNSA-N 433.955 4.235 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](CCO)C2CCCC2)sc(C)c1-c1ccccc1 1648440403 RPRYWHQJOLYAOR-IBGZPJMESA-N 444.597 4.370 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3c(=O)ncn3-c3cc(C)ccc3C)c2C)cc1 1651885130 SCIUDNXXJGMQCX-UHFFFAOYSA-N 444.535 4.340 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NCc1ccc(Br)cc1O 1660092553 XKFICJIMDXIZEC-IEBWSBKVSA-N 433.346 4.435 10 10 IICE COc1cc(OC)c(C[C@H](C)NC(=O)NCc2cc(Cl)cc(Cl)c2O)c(OC)c1 1672868199 XVACBXDHTRGALR-NSHDSACASA-N 443.327 4.155 10 10 IICE Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1681850009 NAUXPENUKVABKF-YLJYHZDGSA-N 429.511 4.197 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(C)CCNC(=O)OC(C)(C)C)cc2Cl)C1 1682023431 FSEODBXTAAUYCT-INIZCTEOSA-N 439.000 4.242 10 10 IICE COc1ccc(OC2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1682097316 PWDQGXIXRSOZIP-IBGZPJMESA-N 425.573 4.254 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3Cc4cc(Br)ccc4C[C@@H]3C)C2)cc1 1682646604 UQWUJVYWOOKYRZ-KXBFYZLASA-N 444.373 4.193 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2(C)C)cc1 1683446437 FKHFPJFZBKDVMB-DZFGPLHGSA-N 447.620 4.165 10 10 IICE COC(=O)CC1(CNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CCCC1 1685532997 GUUDFXDCLRWUNR-UHFFFAOYSA-N 427.545 4.181 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC(C)(C)O1 1693813819 JYQGOZICDYWUFF-SFHVURJKSA-N 425.621 4.301 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H]([C@@H]3CCCO3)C2)n1Cc1ccc(N(CC)CC)cc1 1708559985 RCMLGSUGLCIBRR-VJBMBRPKSA-N 441.620 4.070 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1727049679 RNHPUCPANZYQKB-KRWDZBQOSA-N 441.551 4.353 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1742333356 CBBIPSZAAMQOTQ-RBUKOAKNSA-N 436.629 4.401 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCOC3CCCC3)CC2)cc1 1770257550 DMGMSPXWFIPDKG-UHFFFAOYSA-N 441.620 4.476 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2cccnc2)sc(C)c1-c1ccc(F)cc1 1860746812 FYUDYSVNTYGWCF-UHFFFAOYSA-N 427.457 4.012 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c2nccn2C)cc1 1865858790 NSPUTQYVGWERDU-HXUWFJFHSA-N 426.948 4.203 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)O)sc(C)c1-c1ccc(Br)cc1 1865946489 RRLXLRXIGOPPSL-UHFFFAOYSA-N 440.315 4.466 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc([N+](=O)[O-])c2Cl)N2CCCCC2)cc1 1866140574 LMEJCVMTQVUFMT-FQEVSTJZSA-N 430.936 4.271 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@@H]1c1cc(Br)cc(F)c1O 1952850192 CSUJEDLWBQBODS-CJNGLKHVSA-N 438.249 4.078 10 10 IICE COc1ccc(O)c(Cn2nc(C(C)C)c(C3(C)CC3)c2I)c1 2079732280 ZCDZCAVKMYJKEM-UHFFFAOYSA-N 426.298 4.425 10 10 IICE CC(C)(C)OC(=O)NCC[C@@H]1CC[C@@H](NCc2cc(Br)cc(F)c2O)C1 2098526364 WISGEQKAQXHWGE-SWLSCSKDSA-N 431.346 4.467 10 10 IICE CN1C(=O)C(=Cc2cn(Cc3ccc(Cl)c(Cl)c3)c3ccccc23)C(=O)NC1=S 2313656678 WXZDQQFKLPUULS-UHFFFAOYSA-N 444.343 4.253 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(c2ccc(C(=O)O)cc2)C1=O)C(=O)O 2314928551 XXWPYRDFHUCDNM-OAHLLOKOSA-N 443.502 4.033 10 10 IICE CN1C(=O)/C(=C\c2cc(Br)ccc2OCc2ccc(Cl)cc2)NC1=S 6574807 SJASCKZHVAIXFJ-OQLLNIDSSA-N 437.746 4.369 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C(=N)N12 104372525 JNLFBMZVMCNDKX-VOPKFQMRSA-N 427.467 4.185 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)C1 436036494 XYYMWWINKWZNCX-ZBLYBZFDSA-N 431.580 4.302 10 10 IICE Cc1cc(C)n2ncc(-c3noc(Cn4c5c(c6ccccc64)CN(C(C)C)CC5)n3)c2n1 436105751 FCUBNZGOXXXWPW-UHFFFAOYSA-N 441.539 4.166 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC3(CC2)C[C@@H](Oc2ncccn2)CCO3)cc1 675022550 PLCPHPATCLJNKB-QHCPKHFHSA-N 446.551 4.117 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)Nc1ccc(OCc2cccnc2)cc1 728690998 ISLQLCYYWRTRMA-UHFFFAOYSA-N 446.551 4.191 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)c1 731972789 JSYNKQOLVJPYCU-YIALFULDSA-N 435.471 4.391 10 10 IICE CCOC(=O)c1cnc(N2CCN(Cc3cc4oc5ccccc5c4cc3O)CC2)s1 743385774 NHEUKSPEAMQQLM-UHFFFAOYSA-N 437.521 4.247 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)cccc4[nH]3)CC2)cc1F 753738358 PBQZHVTZULNFAY-UHFFFAOYSA-N 432.293 4.041 10 10 IICE C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 754143484 ZLKVKDNTKJMZMY-QINSGFPZSA-N 449.429 4.170 10 10 IICE O=C(CCCn1ccc2cc(Cl)ccc21)NCc1ccc(N2CCOCC2)c(F)c1 760375815 BHLOAPJYYWMNHL-UHFFFAOYSA-N 429.923 4.367 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2ccccc2Br)n1C 773751727 VBKSJNZYLRMWAR-CYBMUJFWSA-N 429.314 4.227 10 10 IICE COCc1nc(C(=O)OCC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)co1 775089450 SLJUBJVEIBDZAW-UHFFFAOYSA-N 436.386 4.287 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)/C=C\c3ccc(Br)o3)cc2F)C[C@@H](C)O1 917709423 IADAURYTEFPHDY-WNFXYAGKSA-N 437.309 4.124 10 10 IICE CC(C)(C)c1ccc2[nH]c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)cc2c1 1136340400 OPNRDWJENOBHMM-SFHVURJKSA-N 432.568 4.097 10 10 IICE O=C(N[C@H]1CCN(c2ccc(Br)cc2)C1)c1cc2cc(O)c(O)cc2s1 1136639781 ZGFBHTMJCYAZTO-ZDUSSCGKSA-N 433.327 4.084 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N(Cc1ccccc1)C[C@@H](O)c1ccccc1C(F)(F)F 1138155015 WLINYLNTJHJJJY-JOCHJYFZSA-N 445.437 4.422 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(OCCN(C)C)cc3OC)ccc21 1142220243 MZUVEBXSPARCBZ-UHFFFAOYSA-N 439.556 4.106 10 10 IICE COc1ccc(N(C)C(=O)c2c[nH]nc2[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1Cl 1150045987 KCEPADITPGCOFG-ZDUSSCGKSA-N 434.924 4.073 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3CC[C@@H](N(C)C)C3)cn2)cc1-n1c(C)cc(C=O)c1C 1151424215 UXUYAPYZRDCTOR-HSZRJFAPSA-N 445.567 4.003 10 10 IICE CCN(CC)C(=O)OC[C@H]1CCCCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1157025556 PBMAPTJMVRMMKB-HSZRJFAPSA-N 439.556 4.380 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](CC(C)(C)C)c3ccc(F)cc3)CC2)cc1 1168593953 OEVWNQSIVMLXLA-NOZRDPDXSA-N 443.607 4.084 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C3)ccc21 1265185912 ZXRTXRPEGYZTMB-IAGOWNOFSA-N 443.588 4.374 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)CC2)cc1 1266268307 FBKGKZIKENKUFI-UHFFFAOYSA-N 433.464 4.358 10 10 IICE Cc1cc(CCNC(=O)Cc2ccc(NC(=O)C(F)(F)F)cc2)c(C)n1-c1ccccc1 1287468796 MTTIURNUEBSLLH-UHFFFAOYSA-N 443.469 4.496 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1 1299700128 YZGRGFLNULRFIO-UHFFFAOYSA-N 448.306 4.090 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3cc(Cl)ccc3Cl)CC2)c([N+](=O)[O-])c1 1307158952 WJHKMQSLVNKBGK-XVNBXDOJSA-N 436.295 4.414 10 10 IICE C[C@@H]1[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1313127549 JFJPKSNCXVAFPS-RZXSNQJFSA-N 430.593 4.071 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cc2ccccc2N2CCCC2=O)cc1 1350088844 WTRHRZHPHFSSIG-UHFFFAOYSA-N 431.536 4.244 10 10 IICE Cc1cccc(CO[C@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1354783559 ALQMSYGPPSVYER-QGZVFWFLSA-N 436.474 4.072 10 10 IICE CN(c1ccc(CNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)cc1)C1CCCCC1 1442447217 KDCPBIUSBULPRI-UHFFFAOYSA-N 433.512 4.479 10 10 IICE Nc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880191 FUTCOJNLJNHUHU-HNNXBMFYSA-N 427.854 4.041 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1454468781 DMWBVSWPGALZCF-FQEVSTJZSA-N 429.586 4.063 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnn2c(C(F)F)cc(C)nc12 1465851564 XFVWGEPZPHLUFE-UHFFFAOYSA-N 439.260 4.106 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3ccc(Cl)c(Cl)c3C2)N(C)C)cc1 1471547483 MCHSWNYACHJXFP-HXUWFJFHSA-N 435.399 4.430 10 10 IICE CCCN(c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 1472689009 SOKYFFRVDVATAV-PXAMLJHWSA-N 433.505 4.007 10 10 IICE COc1ccc2cc(CN(C)C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)ccc2c1 1479532221 BNIZHBWQDDMKDG-RUZDIDTESA-N 434.584 4.359 10 10 IICE COC[C@@H]1CCN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C1 1504703570 FHLWOGSRTKDHPB-MRXNPFEDSA-N 447.605 4.120 10 10 IICE CCc1nc(OC)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1538817596 AHVCMLNSCRONTP-ATVHPVEESA-N 445.541 4.022 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)n1 1542560402 RRSHCXPFKWKEIR-UHFFFAOYSA-N 434.519 4.440 10 10 IICE CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1542873085 YYTXWAGYPYQLMM-UHFFFAOYSA-N 444.509 4.468 10 10 IICE COc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1NC(=O)c1ccc(Cl)cc1F 1543301855 MUJYWAGBGULYQE-UHFFFAOYSA-N 444.846 4.332 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)[C@H]1CC 1546780796 PHZBLMXAXHDYAN-WMAYMBLKSA-N 432.572 4.034 10 10 IICE O=C(Cc1ccc(Br)cc1Cl)NCc1cccc(Br)c1O 1556481383 RQBCKVNJLADHHQ-UHFFFAOYSA-N 433.527 4.430 10 10 IICE Cc1cc(C(=O)N[C@H](Cc2ccccc2)c2nc(O)n[nH]2)c(C)n1-c1cccc(Cl)c1 1557911917 QRSYAZAHRFUYCA-HXUWFJFHSA-N 435.915 4.285 10 10 IICE Cc1cc(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)ccc1I 1564596720 FZVACDOYCMSEFS-AWEZNQCLSA-N 437.325 4.226 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1c1nc(C(=O)NCc2c(O)ccc3c2CCCC3)co1 1566359365 AZFJNGLUNDBETM-IBGZPJMESA-N 441.528 4.261 10 10 IICE Cn1cnnc1Sc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1Cl 1583874705 KTBAGWYJOFHZGK-UHFFFAOYSA-N 432.914 4.498 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c(Cl)c3)CC2)c(OC)c1 1587487001 OKNKNAPVVPWYAZ-UHFFFAOYSA-N 439.737 4.082 10 10 IICE CCC(CC)[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)N1CCOCC1 1587767510 OIFFNZPUGNEXDH-RUZDIDTESA-N 439.600 4.082 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(Oc2ccccc2)cn1 1595584036 LIUUTMXSOZKWPE-GOSISDBHSA-N 438.915 4.022 10 10 IICE CCOC(=O)c1c(NC(=O)CSC[C@@H](C)C(=O)OC)sc(C)c1-c1ccccc1 1613556281 JGNZXZNEYULIQG-CYBMUJFWSA-N 435.567 4.381 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C3)c2C)c1 1621985027 OGSJEDIIRDEPID-AVRDEDQJSA-N 441.572 4.157 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1628932417 VSRKYTKIZCVPCA-JOCHJYFZSA-N 425.573 4.495 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3cccc(CN4CCCS4(=O)=O)c3)c2C)c1 1629089815 XPNUVXZXHAYUQP-UHFFFAOYSA-N 437.565 4.190 10 10 IICE C[C@H](NC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1)c1ccccc1O 1632250252 NVZVMTQBWHZAKV-HNNXBMFYSA-N 433.464 4.088 10 10 IICE Cc1cc(C(=O)Nc2cnn([C@H]3CCCCO3)c2)c(C)n1-c1ccc(Br)cn1 1634071341 FGVOGNUHOALZOK-LJQANCHMSA-N 444.333 4.400 10 10 IICE CCOC(=O)Cc1csc(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)n1 1643491323 OIHOROHINSMBRE-UHFFFAOYSA-N 433.530 4.165 10 10 IICE Cc1cc(C(=O)Cn2ccnc2[C@H](O)c2cccs2)c(C)n1-c1ccc(Cl)cn1 1643993680 WSYWUQAXRPSNGP-HXUWFJFHSA-N 426.929 4.365 10 10 IICE CCOC(=O)c1c(C)nc(O)nc1SCC(=O)c1cc(C)n(-c2ccccc2)c1C 1656848476 DFZWRNUJEDWHSB-UHFFFAOYSA-N 425.510 4.050 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H]3COc3ccc(Cl)cc3)C2)cc1 1682188010 DBZZAKLJKAFAHD-WIYYLYMNSA-N 443.975 4.428 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1ncccc1C 1694137656 ZEJHRMQQNRGYOF-QGZVFWFLSA-N 438.551 4.018 10 10 IICE CCn1cc(C2CCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)cc3C)CC2)cn1 1695773647 CYPZXZHRNDEQMZ-UHFFFAOYSA-N 435.620 4.425 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H](C)CN1CCCC1 1706378784 QGNHWQLPXSYLNT-QFIPXVFZSA-N 438.664 4.445 10 10 IICE CCOCc1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1710661872 XQFZRCZDGABCRU-IBGZPJMESA-N 443.661 4.289 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)C2CCC2)cc1F 1711006379 YCIQOTUMKUHJGX-WIYYLYMNSA-N 429.584 4.439 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CC1(C)CCOCC1 1711096309 GMWWLFIQEYVNDQ-TZIWHRDSSA-N 442.604 4.355 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCN1CCC(C)CC1 1760994270 URYGTTZZBSLKTN-UHFFFAOYSA-N 438.664 4.445 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(C(=O)OC)cc3)C2=O)ccc1OC 1860086338 ZRWYYQIFEFLRBB-LDADJPATSA-N 429.519 4.286 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C2CC2)c(I)c1C(=O)O 2079945778 LVLQWRDVPMKSQV-INIZCTEOSA-N 440.281 4.070 10 10 IICE Cc1cccc(N2CCN(C3=NC(=O)C(=Cc4c[nH]nc4-c4ccccc4)S3)CC2)c1 2296139043 NIODHFWLUWHXCB-UHFFFAOYSA-N 429.549 4.178 10 10 IICE N=C1C(=Cc2ccc(-c3cccc(C(=O)O)c3)o2)C(=O)N=C2SC(c3cccs3)=NN12 2297499228 IEKJBZGHYSCTTQ-UHFFFAOYSA-N 448.485 4.374 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccccc3F)SC2=S)cc1 2314837961 YZLRGYISSHDSDR-ZDUSSCGKSA-N 430.526 4.453 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccccc3OC)C2=O)cc1)C(=O)O 2314929135 HVDWUPDZFIWKIG-MRXNPFEDSA-N 429.519 4.343 10 10 IICE CSc1ccc(C=C2SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 2323809180 HIHLACLDTLMZCW-MRXNPFEDSA-N 431.560 4.011 10 10 IICE CCc1sc(NC(=O)C=CC(=O)O)c(C(=O)OC)c1-c1ccc(Br)cc1 2326433198 ZOGDTWJWVGFMSB-UHFFFAOYSA-N 438.299 4.106 10 10 IICE CCCN(CCC)c1ccc([C@@H]2N=C(N)Nc3nc4cc5c(cc4n32)OCCCO5)cc1 27866022 CBUIWTLQZHRMRJ-JOCHJYFZSA-N 434.544 4.111 10 10 IICE COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 773145679 LOJGUIFNKAMYRI-LJQANCHMSA-N 436.600 4.036 10 10 IICE C[C@@H](C1CC1)n1nccc1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 776021568 AXGUFJRSJZFSBH-AWEZNQCLSA-N 437.466 4.031 10 10 IICE CCOC(=O)C1(COC)CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)CC1 794334543 LAVADADTCLYDAU-UHFFFAOYSA-N 432.948 4.179 10 10 IICE Cc1ccnc(C(=O)O[C@@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 795798599 VKKIKOIMBJTNNG-HNNXBMFYSA-N 429.423 4.222 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CSCc3coc(-c4ccccc4)n3)C2)cc1 1129991525 QMMXMEZLQXXESL-SFHVURJKSA-N 437.565 4.226 10 10 IICE Cc1cc(C(=O)NCCC(=O)NC2CCCCC2)c(C)n1-c1cccc(Br)c1 1136340441 QBDRLPQGERZCDS-UHFFFAOYSA-N 446.389 4.425 10 10 IICE Cc1cc(C(=O)NCc2ccnc(OCCN(C)C)c2)c(C)n1-c1ccc(C(C)C)cc1 1137945606 VABMHILQEXGFBZ-UHFFFAOYSA-N 434.584 4.483 10 10 IICE CCN(CC)c1ccc(CNC(=O)COc2ccccc2OCC(F)(F)F)cc1F 1144977133 BVJQMVUDCQLQQQ-UHFFFAOYSA-N 428.426 4.308 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCC(=O)c2cccs2)NC(=O)OC(C)(C)C)cc1 1147505807 LGFSDRYPEPQFNZ-GOSISDBHSA-N 445.585 4.159 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c1 1150241318 XPHMWRHZSIHWLX-UHFFFAOYSA-N 445.519 4.068 10 10 IICE C[C@@H](NC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(N(C)C)cc1 1154667931 ADCWZVZLQTUEGU-GOSISDBHSA-N 443.547 4.469 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@]2(CC)CO)sc(C)c1-c1ccccc1 1193562725 DIRHJGGHXLWIRO-HSZRJFAPSA-N 430.570 4.076 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](N4CCCC4=O)CC3)cc2Cl)C1 1227208514 NOUXDKSDEHTCEK-ICSRJNTNSA-N 447.023 4.263 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)s2)cc1 1264688100 XEIYTLXTWHRKHT-UHFFFAOYSA-N 425.529 4.333 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc4ccccc4c3C(F)(F)F)CC2)c(OC)c1 1287479049 YKFPDGBUSHXHNV-UHFFFAOYSA-N 445.441 4.233 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)OCCO3)c(C)n1-c1ccc(Br)cn1 1290108894 ZBFRZTXSTSGGJC-UHFFFAOYSA-N 428.286 4.275 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)c2C)cc1 1295098084 KELSXYBZVPALJD-XMMPIXPASA-N 431.536 4.024 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2c3ccoc3CCN2C(=O)OC(C)(C)C)C2CC2)cc1 1358207513 YJGPSQFOEZGAOR-QFIPXVFZSA-N 439.556 4.371 10 10 IICE CC(C)COc1cccc(OCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1361064049 VZJPIQMHTNTRJB-SFHVURJKSA-N 448.510 4.487 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1scc(C)c1I 1436849787 OJQZOJNSXBWTDD-ZDUSSCGKSA-N 442.366 4.397 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3=Cc4ccccc4O[C@@H]3C(F)(F)F)CC2)cc1 1446418859 KGCXUKUNMHZSOJ-NRFANRHFSA-N 432.442 4.141 10 10 IICE C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1)c1ccc(N(C)C)cc1 1459178657 OZEUAHLFVUZZKQ-CDNPAEQRSA-N 434.609 4.302 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1NC1CCCCC1 1468816550 JYHCLMVJIPXMNY-UHFFFAOYSA-N 429.511 4.476 10 10 IICE CC(C)(C)OC(=O)NC1CC2(CC(NC(=O)NCc3cc(Cl)cc(Cl)c3O)C2)C1 1471608000 OXRBTYPDNGNDBC-UHFFFAOYSA-N 444.359 4.334 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3cc(-c4ccccc4)oc3C2)N(C)C)cc1 1479535275 RLVPLHUUJAEUOL-HSZRJFAPSA-N 432.568 4.383 10 10 IICE CCC(O)(CC)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1497457837 IUUVXOJQXTXBCE-UHFFFAOYSA-N 448.615 4.052 10 10 IICE CCC[C@H](Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1500136975 VSEIGOWTIQNZDB-JOCHJYFZSA-N 429.609 4.017 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1515530519 CJMMRGDCEQZPNY-GMAHTHKFSA-N 441.620 4.277 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccccc2Br)C1 1524910361 YNCUTNBGCAYAOC-UHFFFAOYSA-N 440.385 4.487 10 10 IICE CCO[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)c1ccc(-n2c(C)ccc2C)cc1 1536528591 HCRUMJVPMWUBLU-AOYPEHQESA-N 431.580 4.361 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)c(C)n1-c1ccccc1 1543594141 OXCCEQCCCWBINC-LJQANCHMSA-N 437.490 4.084 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O 1544093727 HPEIYXOFDXLRAK-RUZDIDTESA-N 427.548 4.498 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncsc1Nc1cccnc1 1545043321 XYYJVIAMZWSJTE-HNNXBMFYSA-N 445.495 4.282 10 10 IICE CCOCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C)COC1 1548257296 RPNOHXYRRUEGCS-UHFFFAOYSA-N 437.588 4.252 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1-n1c(C)cc(C=O)c1C 1556639518 GYDNRMJLPQEIDH-OALUTQOASA-N 443.547 4.311 10 10 IICE COC(=O)C[C@@H]1CN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ccccc21 1558060067 LWGNZRNQEXAJHM-HXUWFJFHSA-N 430.504 4.143 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCN(c3cc(F)ncn3)CC2)cc1 1569405488 MAFRTCSFTVROHZ-UHFFFAOYSA-N 433.491 4.060 10 10 IICE Cc1cccc(COc2cccc(CC(=O)NCc3ccc(N4CCN(C)CC4)cc3)c2)c1 1596523999 ZNWSGXLWGGQWRA-UHFFFAOYSA-N 443.591 4.185 10 10 IICE CCC[C@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CCN1CCOC 1596605002 LEEFVMCODCKRHH-QHCPKHFHSA-N 432.008 4.249 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2cccc(F)c2)c(C)n1-c1cccc(Br)c1 1597357472 YLQYKZWJCJWCOT-FQEVSTJZSA-N 431.305 4.459 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1 1598022238 KTAMUYODUZMNRZ-FXAWDEMLSA-N 439.556 4.282 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)[C@@H](C)c2ccco2)cc1 1615376088 QCRIMTFOQUWBGO-SFHVURJKSA-N 438.576 4.101 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCc3cccc(Br)c3O)cc21 1623364427 RANKSDQEMVTZFE-UHFFFAOYSA-N 447.329 4.382 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2c3c(nn2C)CCSC3)cc1 1627425872 QWMJHOAWQWWNOE-UHFFFAOYSA-N 436.581 4.131 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 1627980123 GUOGVAQSPMJKOF-KRWDZBQOSA-N 429.520 4.211 10 10 IICE Cc1cc(C(=O)NC[C@@H](Cc2ccccc2Cl)C(N)=O)c(C)n1-c1cccc(Cl)c1 1629352224 PXXQBFKEGWGHLD-QGZVFWFLSA-N 444.362 4.475 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(N4C[C@H](C)O[C@@H](C)C4)nc3)c2C)cc1 1634526126 NLTKSHLTKOHRTA-ROUUACIJSA-N 434.540 4.364 10 10 IICE CNc1cc(I)ccc1C(=O)NCc1c(O)ccc2ccccc12 1635969530 SAYUFYZBMKAQOV-UHFFFAOYSA-N 432.261 4.122 10 10 IICE Cc1cc(CC(=O)NCCc2ncn(C)c2Br)c(C)n1-c1ccc(Cl)cc1 1636157145 QKSGORXXCBIMSK-UHFFFAOYSA-N 449.780 4.145 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NN2Cc3ccc(Br)cc3C2=O)c1 1645711904 LWUMVWQECNHTAK-UHFFFAOYSA-N 438.325 4.466 10 10 IICE Cc1ccc(C(=O)N2CCCSC[C@H]2c2cnn(C)c2)cc1-n1c(C)cc(C=O)c1C 1647949168 QFWZPNIOBDWUJT-QHCPKHFHSA-N 436.581 4.269 10 10 IICE COC(=O)/C=C/c1ccc(OC)c(OCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)c1 1652813297 AEZVNXYPYCNMFF-UXBLZVDNSA-N 438.455 4.085 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(OC(F)(F)F)c1 1684142042 QJVUBQJUUDEAOL-OAHLLOKOSA-N 437.462 4.107 10 10 IICE CC(C)c1nnc(N2CCO[C@@H](c3nccs3)C2)n1CCCSc1nccs1 1691895975 CNWHDMMTTFZVSW-CQSZACIVSA-N 436.632 4.075 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1scnc1C 1693005643 JZYIMIXIEXDJGQ-FQEVSTJZSA-N 440.617 4.344 10 10 IICE CCC[C@H](C)CN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1709467937 JBLSEFJZEDSVMP-SFHVURJKSA-N 431.600 4.472 10 10 IICE CSc1cc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)ccn1 1712766538 YJMSSMQURKMLHE-IBGZPJMESA-N 425.558 4.027 10 10 IICE CC[C@]1(C)CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1727303066 UFPVWYFLHMEILB-XMMPIXPASA-N 429.584 4.226 10 10 IICE Cc1ccc(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)s1 1742233700 AJXGTZKSUCITFF-UHFFFAOYSA-N 425.583 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@H](c3cnn(C)c3)C2)cc1 1746091395 AIHNJOAWSGJFGD-NRFANRHFSA-N 449.647 4.489 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CC1 1750299909 QFOPVVFUELASJW-QGZVFWFLSA-N 439.629 4.455 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1765169059 ILMLKMVZERJFRX-OAHLLOKOSA-N 428.943 4.483 10 10 IICE CCOCc1nnc(N(C)CC(F)(F)F)n1Cc1ccc(N2CCC(C)CC2)cc1 1767767644 ZJEAWDAXHJUZHR-UHFFFAOYSA-N 425.499 4.098 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(CCc3ccc(OC)c(OC)c3)C2=O)c1O 1858589984 SIFAJFBSRRRCDN-CPNJWEJPSA-N 445.562 4.252 10 10 IICE CCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1-c1ccc(OCC)cc1 1862361119 VIHHWVYFYHHPRS-UHFFFAOYSA-N 448.567 4.330 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)/C2=C/c2ccccc2C(=O)O)cc1 1865673923 FMJOQMRXGWOLOD-HYARGMPZSA-N 430.435 4.363 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2010402518 RJXKHQGNMQJKPG-RBUKOAKNSA-N 431.537 4.036 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)[C@H](F)C1 2029903616 KFAMUBKMHVINAJ-KGLIPLIRSA-N 437.737 4.245 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C(F)(F)F)c(C(=O)O)c2Br)c(O)c1 2079844686 OJGQEQUHGMXLBP-ZDUSSCGKSA-N 449.223 4.466 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NCc2cc(Br)ccc2O)C12CCC2 2118417017 BHBGDEYKTUBNDF-WMLDXEAASA-N 425.367 4.328 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C2=O)cc1C 2294131078 YBMHZNCDKVHKCP-UHFFFAOYSA-N 445.431 4.446 10 10 IICE N=C1C(=Cc2ccccc2OCc2ccccc2)C(=O)N=C2SC(C(F)(F)F)=NN12 2295914237 YQGBREQHKUSBEC-UHFFFAOYSA-N 430.411 4.447 10 10 IICE CCOC(=O)CCCN1C(=O)C(=Cc2cc(Br)ccc2OC)SC1=S 2314760823 LSQSMKWWFDCNEQ-UHFFFAOYSA-N 444.372 4.002 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)ccc1O[C@H](C)C(=O)O 2314932125 KROOYNSYQXQTTH-LLVKDONJSA-N 433.482 4.092 10 10 IICE Cc1ccc(CNC(=O)CC2=CCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2381135988 YVNVFCCKIKAGCL-UHFFFAOYSA-N 439.350 4.037 10 10 IICE CN1CCCc2cc([C@H](CNC(=O)COc3ccc(Cl)cc3)N3CCCCC3)ccc21 9137382 MHAJJVVCACWGRK-DEOSSOPVSA-N 442.003 4.445 10 10 IICE C[C@H](Oc1ccc(/C=C2/C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1)c1ccccc1 12383922 HXGJYYUVDGIFGQ-PAJXCOJRSA-N 426.472 4.489 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@H]32)c1O 14459685 AFGIGDYJTCHWBK-YZZKKUAISA-N 440.565 4.402 10 10 IICE CNS(=O)(=O)CCCSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 110999764 OSRGWQMEPLCUEE-UHFFFAOYSA-N 436.002 4.283 10 10 IICE CC(C)[C@H](C(=O)O)N1C(=O)/C(=C\C(Cl)=C\c2ccc([N+](=O)[O-])cc2)SC1=S 136903472 PRYFAIRNMBRKEO-YGWXXFFRSA-N 426.903 4.028 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(S(=O)(=O)C[C@@H]3CCCO3)cc2)cc1 731336797 SNSFPEGCVZSGJV-QFIPXVFZSA-N 438.549 4.299 10 10 IICE COC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(-c3cc(C)ccc3OC)cs2)cc1 747858245 QZCTUFLHIWYMBA-YRNVUSSQSA-N 444.534 4.114 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCCO3)n2C[C@H]2CCOC2)c(C)n1-c1ccccc1 752832296 FGFGDXVJBSXVGY-IRLDBZIGSA-N 435.572 4.004 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(N2CCOC2=O)c1 773145660 KTWFCPSPKLMIKT-HXUWFJFHSA-N 434.584 4.026 10 10 IICE COC(=O)c1ccc([C@H](NC(=O)NCCCSc2nccs2)C(F)(F)F)cc1 776019757 LGVIWDZWFCDDJE-ZDUSSCGKSA-N 433.477 4.015 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc([C@H]3CCCOC3)cc2)c1 779916392 RIMKNOZXGNFQFV-QHCPKHFHSA-N 443.547 4.325 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCc3ccc(-c4ccccc4)o3)cc2F)CC1 1125904344 RZIMDLXXHPOWEZ-UHFFFAOYSA-N 435.543 4.477 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(Cc4ccccc4)C[C@H](C)C3)ccc21 1128961597 VIIKMNPIYNBAQL-FQEVSTJZSA-N 433.596 4.499 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@](C)(CNC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1130185444 HXXASIJHWAEVCW-KBMIEXCESA-N 447.620 4.215 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N=[S@](C)(=O)c3ccc(N(C)C)cc3)ccc21 1132067051 XKKZRYKMRKDZCS-SSEXGKCCSA-N 427.570 4.268 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(Cn3ccnn3)cc2)cc1 1136698594 PGKFNETWVNMMQO-UHFFFAOYSA-N 441.535 4.248 10 10 IICE CCN(CC)c1ccc(CNC(=O)CC(C)(C)NC(=O)OCc2ccccc2)cc1F 1136730256 ISGWAODFDGADOY-UHFFFAOYSA-N 429.536 4.383 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCOc2cccc(C(F)(F)F)n2)cc1 1153519345 NPZMZULFDJDYFM-UHFFFAOYSA-N 445.441 4.058 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NC(C)(C)C)c(C)n1-c1cccc(Br)c1 1156296407 JKKNHXJAIYHNQS-LJQANCHMSA-N 446.389 4.376 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]([C@@H](O)c3ccc(Br)cc3)C2)cc1 1160290191 JRUMDCSSXYDIIW-YJBOKZPZSA-N 445.317 4.197 10 10 IICE Cc1ccc(Nc2scnc2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1161181789 QIHATCKRTQBMDE-UHFFFAOYSA-N 444.507 4.240 10 10 IICE Cc1ccc(CN2CCCN(C(=O)CN(Cc3ccccc3O)C3CCCC3)CC2)cc1 1190903795 FBMGGGIUDABHNM-UHFFFAOYSA-N 435.612 4.180 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@@H](C)C[C@H]1CNC(=O)OC(C)(C)C 1230196287 XQEJMTIPXBYRLO-JUXOCIIHSA-N 446.636 4.327 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC(NCc3cc(Br)ccc3O)CC2)C1 1257753897 HAQYINPTBHZZTF-UHFFFAOYSA-N 425.367 4.424 10 10 IICE C[C@@H](NC(=O)[C@H]1CCc2cc(Br)ccc21)c1ccc(N2CCOCC2)cc1 1264822418 QEDYRHODKRNNFX-VFNWGFHPSA-N 429.358 4.193 10 10 IICE CCCc1c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccccc1C 1264822444 QZROGOZKOZSSPY-FQEVSTJZSA-N 432.568 4.461 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc([C@@]4(C)NC(=O)NC4=O)cc3)c2C)c1 1290886190 WNWHWOSVVVVALC-RUZDIDTESA-N 430.508 4.018 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(O)c(Br)c2)c1 1294877423 RAVFDIZMDXWAEY-UHFFFAOYSA-N 427.298 4.305 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H]([C@@H]4CCOC4)C3)nnc2C(C)(C)C)cc1 1295420428 ZYPAVJHZFFSDEN-NHCUHLMSSA-N 425.621 4.333 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N(C)Cc1nnc2n1CCC[C@@H]2C(F)(F)F 1303525859 SECNRYFXQDJYRJ-AWEZNQCLSA-N 437.491 4.459 10 10 IICE CC[C@H](C)N(C)CCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1305609772 FGOGKLWLQOEPBI-NRFANRHFSA-N 447.631 4.307 10 10 IICE CN(C[C@H]1CCOC1)c1nnc(Cc2ccsc2)n1CCCSc1nccs1 1314813832 ONFKPAOOPICLGS-MRXNPFEDSA-N 435.644 4.042 10 10 IICE C[C@@H]1[C@@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1350627955 DPWICQYLFDLOOO-ZBFHGGJFSA-N 434.492 4.046 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@@H]32)sc2c1CC[C@@H](C)C2 1353908377 VPLWLFKXICIVQT-MUIFIZLQSA-N 432.586 4.072 10 10 IICE O=C(Nc1ccc(C(=O)NCc2ccc(O)cc2O)c(O)c1)c1ccc(Cl)c(Cl)c1 1451770619 QEIGVJUBJYUGBJ-UHFFFAOYSA-N 447.274 4.293 10 10 IICE O=C(CCCOc1ccc(Cl)cc1Cl)NCc1ccc(N2CCC(O)CC2)cc1 1453979985 CBYOMLVMNPPKNS-UHFFFAOYSA-N 437.367 4.430 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H](c3c(F)cccc3Cl)N3CCCCC3)C2)cc1 1461496106 OIELHJTVGADREB-GAJHUEQPSA-N 445.966 4.410 10 10 IICE Cc1cc(CCNC(=O)C(=O)c2ccc(Br)s2)c(C)n1-c1ccccc1 1461965054 FAMXHAOEBSZHQH-UHFFFAOYSA-N 431.355 4.460 10 10 IICE C[C@H](Nc1ccc(C(=O)NCc2cc(Cl)ccc2O)cc1[N+](=O)[O-])c1ccccn1 1469875472 ZUMYFBDAPKZSQY-ZDUSSCGKSA-N 426.860 4.452 10 10 IICE COc1cc(N2CCN(C(=O)c3csc(C4CCCCC4)n3)CC2)cc(OC)c1OC 1521836554 JMUGGOPNPGCXDY-UHFFFAOYSA-N 445.585 4.179 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1ccccc1Cl 1522184855 JOHUNXKFQMADPI-BOPFTXTBSA-N 434.945 4.387 10 10 IICE CCOC(=O)c1c(NC(=O)c2cnn3c2OCCC3)sc(C)c1-c1ccc(F)cc1 1525141491 QIUILCVEBHDFRL-UHFFFAOYSA-N 429.473 4.271 10 10 IICE C[C@]1(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1(Cl)Cl 1533029872 QIOWREDRHXHQSI-FQEVSTJZSA-N 447.274 4.074 10 10 IICE CCN(CC)CC(=O)Nc1cccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1556883092 JMSSONGIAPIVAI-UHFFFAOYSA-N 446.551 4.439 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c(C)n1-c1ccccc1Br 1565611583 KZIBPJNURCOAOR-ZBFHGGJFSA-N 446.389 4.376 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1=O 1565958922 ZFXYGDNQYKHHRC-OAQYLSRUSA-N 449.938 4.485 10 10 IICE C[C@@H](NC(=O)[C@H]1Cc2ccc(O)cc2N1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1567777341 SXDRWSJBPMUHNW-QVKFZJNVSA-N 425.529 4.002 10 10 IICE Cc1nc2cc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)ccc2s1 1597141952 UQPIEBNOTYNQAM-UHFFFAOYSA-N 445.547 4.425 10 10 IICE COC1CCN(c2ccc(CN3CCN(c4ncc(Cl)cc4Cl)CC3)cc2)CC1 1615188318 VUDXKMQTSVLHHK-UHFFFAOYSA-N 435.399 4.326 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCC[C@H](OC)C2)cc1 1615379288 FNPLEOSMGZKAKV-QFIPXVFZSA-N 434.588 4.158 10 10 IICE C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)/C(=C\C=C\c2ccccc2)SC1=S 1615399167 UZXSDVFZPWHSEK-TVWPQIEVSA-N 439.518 4.379 10 10 IICE Cc1ccccc1[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 1616786497 JDPDZTKEEFOWJX-BVFVYWQFSA-N 441.591 4.351 10 10 IICE CCOCc1nnc(N2CCCC[C@@H](SC)C2)n1Cc1ccc(N(CC)CC)cc1 1616880934 UUPUSBOEIGIMPS-OAQYLSRUSA-N 431.650 4.431 10 10 IICE COc1ccccc1-c1nnc(Nc2ccn(C)n2)n1CCCSc1nccs1 1619401457 AURSRCQUBFXVII-UHFFFAOYSA-N 427.559 4.070 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)[C@@H](O)c3cc(Cl)cc(Cl)c3)CC2)cc1 1622438386 RJCFKQUWOIGOON-FQEVSTJZSA-N 437.367 4.410 10 10 IICE Cc1ccccc1C1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 1626483351 FMWPMEPYRJLJHY-UHFFFAOYSA-N 442.562 4.025 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CC(=O)NCc1ccc3cccnc3c1O)C2 1627072858 GFNNSHQTQYTKQA-OALUTQOASA-N 425.529 4.125 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CN(Cc4ccccc4)CC[C@H]3CO)c2C)c1 1631430506 VBTAYWFAEMYNTC-IGKIAQTJSA-N 445.607 4.324 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC(Cc2ccco2)C1 1632870953 JQGYPRXJYLZJMP-BOPFTXTBSA-N 432.592 4.024 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C)[C@H]2C(F)(F)F)c(C)n1-c1ccc(Br)cn1 1641813571 JSGKTRPQIVWWCF-LRDDRELGSA-N 446.267 4.043 10 10 IICE Cc1cc(CNC(=O)[C@@]2(C)C[C@@H](NC(=O)OC(C)(C)C)CCO2)c(C)n1-c1ccccc1 1643369371 CRHDDPOJLZDUPQ-NBGIEHNGSA-N 441.572 4.173 10 10 IICE Cc1ccc(F)c(CN(C)[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1645447862 SWPLMZMMSGMELH-INIZCTEOSA-N 430.479 4.369 10 10 IICE Cc1cc(C(=O)NC[C@H]2OCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1648042652 SCURJTBZCLADEM-LJQANCHMSA-N 426.314 4.253 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3cnc(C4CC4)cc3=O)c2C)ccc1Br 1652269549 FWBVQXDFBMUMKQ-UHFFFAOYSA-N 440.341 4.482 10 10 IICE C[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1654751278 YISHASSTZOWSIH-GJZGRUSLSA-N 443.459 4.048 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C(C)C)cc1 1657673114 SVVYHEZHKANSRZ-BGYRXZFFSA-N 427.564 4.279 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(CC(F)(F)C(F)F)CC3)c2C)c1 1675109235 UJHLXAUUAUKGKP-UHFFFAOYSA-N 440.485 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C 1683252997 CHRBJQIWEOCXAY-NLWGTHIKSA-N 432.609 4.079 10 10 IICE CC(=O)N1CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC12CCCCC2 1684600593 VVIWLNYQXFKWCC-UHFFFAOYSA-N 436.600 4.479 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1708062221 WWRRHXBSPLBTNP-FQEVSTJZSA-N 448.615 4.116 10 10 IICE CCCN(CCC)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1728108282 HQORQBZRGDRSJH-UHFFFAOYSA-N 439.629 4.442 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1745007104 VUJRVZLDMUIXLR-KNQAVFIVSA-N 434.588 4.238 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2[C@@H]2C[C@H]2C)c(C)n1-c1ccccc1 1751408817 OISKPMSRVUPFMU-VGOFRKELSA-N 434.588 4.142 10 10 IICE CC[C@@H](Cn1c(CC2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1762381443 LROXOCPSRIGUDT-QFIPXVFZSA-N 441.620 4.161 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@H]3CCCO[C@H]3C(C)(C)C)CC2)cc1 1768703467 OTRRSGLXEMFPAZ-NFBKMPQASA-N 441.620 4.153 10 10 IICE CCCCC(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 1860547322 IAWHZMSOXRVAAE-UHFFFAOYSA-N 427.460 4.238 10 10 IICE CCN1C(=O)C(Nc2ccc(N(C)C)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422833 RLDLKIJYDWFOAH-UHFFFAOYSA-N 428.536 4.372 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2c(O)cccc2Br)C1 1952578444 PHXUTDKMIZYVIC-GOEBONIOSA-N 434.286 4.329 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)c1ccc2c(c1)CCCN2C 2044730428 OIXBSIVGNREZCO-UPVQGACJSA-N 439.600 4.128 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3cc(Br)cc(F)c3O)C(C)(C)[C@@H]21 2175899880 CQMWMAMDFGECCH-XOKHGSTOSA-N 443.357 4.417 10 10 IICE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=Cc1ccccc1OCc1ccccc1F 2297341192 VPGQSDKIFDDXQS-UHFFFAOYSA-N 434.398 4.210 10 10 IICE CC(Nc1ccc(Cn2cnnc2)cc1)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 2313682991 PETRHZXMFGWGAU-UHFFFAOYSA-N 434.503 4.463 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380745204 HQGMCDBBXJXYNV-AWEZNQCLSA-N 441.366 4.117 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC3(CC3)N2C(=O)OC(C)(C)C)c(O)c1Br 2381137095 LFKRFLJKSIFETR-CQSZACIVSA-N 439.350 4.011 10 10 IICE CCCn1c(N2CCCC2)c(/C=C2\SC(=S)N([C@@H](C)CC)C2=O)c(C)c(C#N)c1=O 39990008 JERMEKGZYCIIJK-HIXWQLQUSA-N 444.626 4.038 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccc(OCC)cc1)C[C@@H](c1ccccc1O)N2 65297905 OUBNMWSWVYDQIG-QFIPXVFZSA-N 437.540 4.263 10 10 IICE biogenic CCCCOc1ccc(/C=C2/SC(Nc3ccc(O)c(C(=O)O)c3)=NC2=O)cc1OC 210541163 PKPPGXJWIMJENX-YBFXNURJSA-N 442.493 4.360 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 743289045 QTDGTXSRTDFVPT-OAQYLSRUSA-N 425.573 4.237 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(NC(=O)C4CCCCC4)CC3)c2C)cc1 744013863 DSTOWVWCEGTBFX-UHFFFAOYSA-N 437.584 4.404 10 10 IICE COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 756648680 YDPCFTNNDAUYMX-FZMZJTMJSA-N 443.853 4.176 10 10 IICE COc1ccc(N2CCCN(C(=O)c3c[nH]c4cccc(Br)c34)CC2)cc1 758003429 MTODIJJLUVYUPR-UHFFFAOYSA-N 428.330 4.292 10 10 IICE Cc1ccc(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)c(OC[C@H]2CCOC2)c1 766557800 SFWHUWJARKWWRS-PMACEKPBSA-N 428.548 4.237 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2noc(-c3cccs3)n2)C1 769664798 JUWCCESRCAPMDY-UHFFFAOYSA-N 436.537 4.263 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(OCC4CCCCC4)cc3)cc2)CC1 1133626595 QSBJQDNLGXTMOT-UHFFFAOYSA-N 449.595 4.277 10 10 IICE CC(C)C[C@@H](CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)NC(=O)OC(C)(C)C 1136443100 QFYFQGNOFNEDPD-QUCCMNQESA-N 433.593 4.030 10 10 IICE Cc1cc(CC(=O)N2CCC(N3CCCOCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1141869514 MMGIEHLJSKZIGB-UHFFFAOYSA-N 429.992 4.003 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3C[C@@H](OCc4ccccc4)C3(C)C)C2)cc1 1235188390 WYSJGZKRPIGLEI-AGILITTLSA-N 437.584 4.205 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3c3cccc(Cl)c3)cc2)CC1 1251103755 HLUWRCUWQBQUSI-JOCHJYFZSA-N 440.975 4.088 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(CC2CC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1291401067 GBTYLLFLIFGDNR-CLOONOSVSA-N 425.621 4.264 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)C)C1 1301296395 LEFBVRRROGQPDL-OAQYLSRUSA-N 437.588 4.250 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)c2C)c1 1303085495 RALGHKPDEMCLEX-UHFFFAOYSA-N 430.596 4.393 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCN(C(C)(C)CC(C)(C)C)CC3)C2)cc1 1312902683 OGOSOKAIIRAUFB-FQEVSTJZSA-N 430.637 4.064 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cccc(Br)c3C)C2)cc1 1312902771 OKUBYMCJDXLKPW-MRXNPFEDSA-N 432.362 4.092 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H]3c3ccc(OC)c(F)c3)C2)cc1 1312903363 XYWCGPCIZCTQDE-JTSKRJEESA-N 427.520 4.216 10 10 IICE CCCNC(=O)C1CCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)CC1 1313468383 LQRFIZFKOXCEIQ-UHFFFAOYSA-N 440.636 4.039 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC[C@H](C)N(C)Cc2ccccc2)cc1 1445358655 NJQLPQFXWGNLHH-FQEVSTJZSA-N 431.580 4.476 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1c(C(F)F)nc2n1CCCC2 1445658930 SBCIGGAPNRPRRB-UHFFFAOYSA-N 428.277 4.287 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3nnc4ccc(Cl)cc4c3=O)c2C)c1 1459137272 MSTCMLNACNCRSR-UHFFFAOYSA-N 438.940 4.457 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Nc2ccccc2Cl)CC1 1470905761 VKRLYTXCOWWHJZ-UHFFFAOYSA-N 442.991 4.087 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCO[C@](C)(C3CC3)C2)sc(C)c1-c1ccccc1 1473637628 JJBFGBMBJQWUHG-DEOSSOPVSA-N 442.581 4.340 10 10 IICE C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478785953 CBPLHLJAFLALQO-KRWDZBQOSA-N 429.511 4.312 10 10 IICE COC(=O)c1cccc2c1CCN(C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)C2 1479100492 UZYDKDIWYJCPEO-UHFFFAOYSA-N 431.536 4.457 10 10 IICE CO[C@@H](Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1503994609 OGDCLNBWHQRFGU-GMAHTHKFSA-N 441.620 4.080 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)Cc1nccs1 1510684917 YJEKLNOTMBQSGY-UHFFFAOYSA-N 438.626 4.446 10 10 IICE CC[C@@H]1CCCN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)C1 1514064423 ILHPHYRQFAVKFO-GOSISDBHSA-N 445.662 4.405 10 10 IICE CC[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1514103342 IJBZSASUBBCQDY-FQEVSTJZSA-N 439.648 4.360 10 10 IICE COCCN(Cc1ccc(C)o1)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)cc1C 1519147906 NKKBIIYHERRPBT-UHFFFAOYSA-N 448.571 4.250 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cnc(-c2cccc(Cl)c2)s1 1526002451 CJZUKPZBEZGZJK-UHFFFAOYSA-N 431.920 4.369 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2C[C@H]2CC2(C)C)c(C)n1-c1ccccc1 1542179774 OVZAIMMJZVQQGO-QFBILLFUSA-N 434.588 4.099 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C)CC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1542183970 LDUFVYLLJGAVPK-GOSISDBHSA-N 434.588 4.067 10 10 IICE CN(c1ccc(CNC(=O)[C@@H](C[C@H]2COCCO2)C(F)(F)F)cc1)C1CCCCC1 1542412361 XRRFEMKNJFTPAQ-VQTJNVASSA-N 428.495 4.056 10 10 IICE CN1CCCc2cc(CNC(=O)c3cccc4c3CCN(C(=O)OC(C)(C)C)C4)ccc21 1544165306 WRNYIJJGMQKSDK-UHFFFAOYSA-N 435.568 4.292 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1COC(=O)c1cccc(NC(=O)c2cc(O)cs2)c1 1544925884 UQMXDKFLVNMNKS-INIZCTEOSA-N 446.525 4.262 10 10 IICE CCn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(C(C)(C)C)cc4)c3C)cnc21 1559409233 GFOSRFBJAQKDHI-UHFFFAOYSA-N 431.540 4.201 10 10 IICE Cc1cc(CCNC(=O)NC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)c(C)n1-c1ccccc1 1565162097 LSHJDDCQJDBXNL-RSXGOPAZSA-N 435.543 4.241 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(NC(=O)Cc4cccnc4)cc3)cc2)CC1 1565663927 QUUPCKSRMUGUIV-UHFFFAOYSA-N 442.563 4.429 10 10 IICE CC[C@@H](Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1613636901 OBWQDDJKDOKBNJ-FCHUYYIVSA-N 427.593 4.181 10 10 IICE CCc1nnc(N2CCN(Cc3ccccc3C)CC2)n1CCCSc1nccs1 1614034961 INMILJGEWTZFBJ-UHFFFAOYSA-N 442.658 4.110 10 10 IICE CN(CCC1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1)C(=O)OC(C)(C)C 1623171289 SABCDHSRPVCDRY-UHFFFAOYSA-N 434.558 4.422 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)CC2)c(OC)c1 1623759546 HMKHVMMSBFZAMG-RBUKOAKNSA-N 435.351 4.463 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](NC(=O)OC(C)(C)C)C3CCCCC3)C2)cc1 1627153949 CZPHVGCZGUPPOZ-PGRDOPGGSA-N 445.604 4.111 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2cc(Cl)ccc2I)cc1 1632774486 CVDGNRUGHKFZMU-UHFFFAOYSA-N 442.644 4.037 10 10 IICE Cc1cc(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)c(C)n1-c1ccc(Cl)cc1 1636397286 TUHGNXVNBTZVRX-UHFFFAOYSA-N 431.005 4.387 10 10 IICE Cc1cc(CCNC(=O)N2CCCC[C@H]2COC(=O)NC(C)C)c(C)n1-c1ccccc1 1637410881 TWJSABVBLXMEQT-QHCPKHFHSA-N 440.588 4.335 10 10 IICE O=C(CCc1ncc(-c2ccccc2Cl)o1)NCc1ccc(N2CCC(O)CC2)cc1 1641201502 WDUABWSKTVHJAQ-UHFFFAOYSA-N 439.943 4.205 10 10 IICE Cc1cc(C)c(C(=O)CCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(C)c1 1642297589 JYKQOAWCBPWUTD-UHFFFAOYSA-N 444.522 4.396 10 10 IICE CCc1nc(-c2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)cc2)n[nH]1 1644031329 UXJZITDDMPXOHH-UHFFFAOYSA-N 431.462 4.305 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1cccc(C(F)(F)F)c1 1651377609 DUZCKHNIVBDTOS-IBGZPJMESA-N 431.414 4.152 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1657875753 GSBWUGWVPQGDRQ-SFTDATJTSA-N 435.612 4.352 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2CC(=O)NCc1ccc(CN2CCCC2)cc1 1659084303 PGYBIPNARKDWMB-XMMPIXPASA-N 435.612 4.242 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@H](c4cccc(Cl)c4)C3)CC2)c(OC)c1 1681848175 MYOXWOXAGQANMJ-UAPYVXQJSA-N 429.948 4.135 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1687056386 XNNVJVMACSTOOJ-HXUWFJFHSA-N 430.593 4.216 10 10 IICE Cc1cnc(OC2CCN(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2)nc1 1687286440 IGOJXDYFQVQWJE-UHFFFAOYSA-N 433.556 4.254 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cncn1 1695078648 VRVXNQIQQFGKRF-GOSISDBHSA-N 432.576 4.269 10 10 IICE Cc1cnn([C@@H]2CCCN(c3nnc(CC(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)c1 1707703167 UYQBBWZUOXVODR-HXUWFJFHSA-N 439.583 4.076 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H]3C(C)C)n2CCCSc2nccs2)n1 1707829372 FILXJRBJBGUKIQ-GOSISDBHSA-N 445.662 4.403 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCOCC1 1709591778 NNKCJFQHTNTEJY-UHFFFAOYSA-N 437.588 4.130 10 10 IICE Cc1cc(-c2nnc(N3CCCOCC3)n2CCCCCCO)c(C)n1-c1ccccc1 1724197163 DTWGCXKXMRAENP-UHFFFAOYSA-N 437.588 4.132 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1C[C@@H]1CCCC1(C)C 1729418626 FVQKLNKEECPORO-SFHVURJKSA-N 434.544 4.094 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)=C(C)C1 1745789902 HFIFLYRDBHDAHT-UHFFFAOYSA-N 446.599 4.425 10 10 IICE CC(C)(C)Cc1nnc(N2CCN(CC3CC3)CC2)n1CCCSc1nccs1 1750474052 GGUSDLLKFOINLN-UHFFFAOYSA-N 434.679 4.038 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(F)cc2)nc1-c1ccc2c(c1)CCCC(=O)N2 1859571507 LZKJKPNKVVZCKI-UHFFFAOYSA-N 431.514 4.333 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1cc(Br)ccc1I 2225801245 TYAVGHZLQXCXPK-MNOVXSKESA-N 435.063 4.015 10 10 IICE O=C(CCN1C(=O)C(=CC=Cc2ccccc2)SC1=S)Nc1cccc2nonc12 2296594527 QTBQKYNWNGMOCZ-UHFFFAOYSA-N 436.518 4.009 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(NC(=O)c2ccc([N+](=O)[O-])cc2)C1=O 2296763937 IHPZFENKKAZOAP-UHFFFAOYSA-N 425.491 4.087 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCCCOc1ccccc1OC 2297347288 NBYOLUVFGNUYRC-UHFFFAOYSA-N 445.562 4.431 10 10 IICE CC[C@H](NC(=O)C=Cc1ccc(C(C)C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 2330398758 LTBUKWPUUIVTDN-VWLOTQADSA-N 449.595 4.075 10 10 IICE Cc1ccc(CN[C@@]23CCC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352690518 BVMQWDWMOGZUGG-MGPUTAFESA-N 425.367 4.342 10 10 IICE COCCN1C(=O)/C(=C\c2ccc(OCc3ccc(F)cc3)c(OC)c2)SC1=S 6581391 DHSCLVVQSZDOAR-XDHOZWIPSA-N 433.526 4.261 10 10 IICE CC(=O)N1c2ccc(N/N=N/c3ccc4c(c3)N(C)[C@H](C)CC(=O)N4)cc2NC(=O)C[C@@H]1C 8755040 BUYYLRRXTCBAKH-KGLIPLIRSA-N 449.515 4.048 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478075 OSCRUMCLLZLPJU-VWKPWSFCSA-N 427.526 4.498 10 10 IICE COc1ccc(C2=NC3(CCN(C)CC3)N[C@H](c3cc(Br)ccc3O)C2)cc1 65298098 QYKKQVXOEFLKML-FQEVSTJZSA-N 444.373 4.109 10 10 IICE biogenic COc1ccc(N2CCN(c3nccc(-c4cn(-c5cccc(F)c5)nc4C)n3)CC2)cc1 72462118 DKPCUCDCBJGVHU-UHFFFAOYSA-N 444.514 4.112 10 10 IICE CN(C)c1cccc(NS(=O)(=O)c2cc(Br)ccc2Br)c1 161408408 FJLSYAFCQAOGLC-UHFFFAOYSA-N 434.153 4.078 10 10 IICE CCc1ccc(NC2=NC(=O)/C(=C/c3ccc(OCCC(=O)O)c(OC)c3)S2)cc1 210449870 NVOUTMATGSWMIL-UYRXBGFRSA-N 426.494 4.194 10 10 IICE COc1ccccc1N1CCC(NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 215640321 YWYAHZZROKZMQT-UHFFFAOYSA-N 436.600 4.496 10 10 IICE COc1ccc(NC(C)=O)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435495810 HVANYTQXOJYYOX-UHFFFAOYSA-N 434.540 4.014 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)NCCCSc1nccs1 753056796 LKWKTIZBRCNFPY-ICSRJNTNSA-N 442.610 4.322 10 10 IICE CCS(=O)(=O)c1ccc(CCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 756895105 HTYLOJOEZZMAFN-UHFFFAOYSA-N 438.593 4.179 10 10 IICE C[C@@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)cc(F)c1O 757639031 UGWHHISQSHRFKI-ABAIWWIYSA-N 449.299 4.357 10 10 IICE COc1cccc([C@@H]2[C@H](NC(=O)c3cc(C)n(-c4ccccn4)c3C)CCN2C2CC2)c1 778494439 NNWYJSDFECIQFD-ILBGXUMGSA-N 430.552 4.206 10 10 IICE CC(C)(C)OC(=O)NC[C@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(F)cc1 792056086 BLFVIRJUNOHWEJ-QFIPXVFZSA-N 441.547 4.351 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(-c2ccccn2)n1C[C@H]1CCCO1 802696766 VVKWZUNQCQDZCY-JOCHJYFZSA-N 432.572 4.146 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@H](C)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 812251922 JRXQKVXMNBXILT-KNQAVFIVSA-N 435.572 4.147 10 10 IICE CC1CCN(c2ccc(CNC(=O)C=C3CCN(C(=O)OC(C)(C)C)CC3)cc2)CC1 815523865 ZQBSWKMAROYMDS-UHFFFAOYSA-N 427.589 4.496 10 10 IICE CN(C)c1ccc(CNC(=O)NC2CCN(Cc3cccc(C(F)(F)F)c3)CC2)cc1 917999757 DDAFOTQYOMMPRK-UHFFFAOYSA-N 434.506 4.235 10 10 IICE COc1ccc(OC)c(CCCNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1127698821 QIAQARJSHUPHAI-UHFFFAOYSA-N 436.552 4.295 10 10 IICE Cc1cc2c(N3CCC[C@H]3C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)ncnc2s1 1129820040 QJHKPXJFHCWALP-IERDGZPVSA-N 437.613 4.090 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4ccc(C)cn4)cc3)CC2)c(OC)c1 1132036262 MTLOLHHYBCUDTI-UHFFFAOYSA-N 433.508 4.162 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C[C@@H](C)S(=O)(=O)c3ccc(F)cc3)c2C)c1 1132264460 SGVZYABOGWMEBC-GOSISDBHSA-N 442.556 4.410 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@](C)(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 1135745937 IBWLBWXYUYKLMK-OFVILXPXSA-N 445.604 4.050 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)c1ccc(N2CCOC2=O)cc1 1142389488 GOCBSRQPLAFVSI-QGZVFWFLSA-N 431.492 4.354 10 10 IICE C[C@@H](CC(=O)NCc1ccc2cccnc2c1O)C1CCN(C(=O)OC(C)(C)C)CC1 1142727984 JFANPVKMTHUJDY-INIZCTEOSA-N 427.545 4.230 10 10 IICE O=C(NCc1c(O)cccc1F)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 1178410294 PQNZTKGSSBIPIL-UHFFFAOYSA-N 431.817 4.131 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2[C@H](C)O)sc(C)c1-c1ccccc1 1190865567 XKEIMISQLXNBSU-YJBOKZPZSA-N 430.570 4.074 10 10 IICE O=C(CN1CCC(CC(F)(F)F)CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1194252152 VCISJJMBLMJFNE-UHFFFAOYSA-N 430.426 4.065 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)sc(C)c1-c1ccccc1 1194487020 AXRZCQZSDVIAMK-ZLGUVYLKSA-N 442.581 4.242 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)c1 1295918700 OBHPFDMTXKFYSZ-NRFANRHFSA-N 430.426 4.389 10 10 IICE CCN1C[C@H](C)N(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@H]1C 1295985277 QYZYFYJDHBYUPM-CVEARBPZSA-N 446.646 4.404 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@](C)(O)CCC(C)C)CC2)cc1 1300246404 AEFVRGFOPNRADR-VWLOTQADSA-N 443.636 4.314 10 10 IICE COCCN(c1nnc(-c2cccnc2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@H](C)C1 1316080422 MECKWSPRELNAIW-CYFREDJKSA-N 448.615 4.404 10 10 IICE COc1ccccc1-c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)s1 1351136109 WIVUCXUOVUONAM-GOSISDBHSA-N 449.576 4.055 10 10 IICE CN(C)c1ccc(CN(C(=O)C[C@H]2C(=O)Nc3ccc(Br)cc32)C2CC2)cc1 1355435580 CDMSLQSLEXXXGN-LJQANCHMSA-N 442.357 4.132 10 10 IICE COc1ccc(/C=C(/C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1F 1356037030 RUPUHPBCEZNKFE-FDUJEISQSA-N 430.495 4.307 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)c3cccc(Br)c3)cc2F)CC1 1435072872 DFGPIWNHVPXPMU-MRXNPFEDSA-N 448.380 4.150 10 10 IICE CC(C)COc1ccc(CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1435571284 CUAYMEZLAOCZTQ-UHFFFAOYSA-N 435.612 4.112 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl 1451668361 MBXUTEKMMNYMDO-CABCVRRESA-N 436.383 4.234 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(F)F)CC2)c(C)n1-c1ccc(Br)cc1 1454619259 XEWMYFDHTYSXQR-KRWDZBQOSA-N 427.289 4.353 10 10 IICE COc1cccc(C2(NCc3ccc(N4CCC(OC)CC4)cc3)CCOCC2)c1F 1460027305 FMTDVTSBBXFAJQ-UHFFFAOYSA-N 428.548 4.245 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3ccccc3F)c3c2CCCC3)cc1 1461333363 CCHLDQXBVNEXLT-UHFFFAOYSA-N 436.531 4.107 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H]2NC(=O)N(Cc1ccco1)Cc1ccccc1O 1471516101 WLJHRBIVVONHKM-RLLQIKCJSA-N 441.528 4.237 10 10 IICE CC(C)(C)c1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n[nH]1 1472394183 UIWNFHRUZNFOBF-JLHYYAGUSA-N 434.612 4.389 10 10 IICE CC(=O)c1ccc(Cl)c(S(=O)(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 1475549582 NEFXSUGLGOWWAE-UHFFFAOYSA-N 430.957 4.471 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)C[C@H]2CCCOC2)cc1 1501844229 MHLBPLVWUDYUAF-HSZRJFAPSA-N 448.615 4.021 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCOCC(F)F)o1 1510764182 GPCTYDRSWWCFCF-UHFFFAOYSA-N 445.514 4.365 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1515276820 WNGNNVNLTKMJEB-MRXNPFEDSA-N 429.565 4.143 10 10 IICE CCN(CC)[C@H](C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1515521415 OMQRSEPMKIXYSK-NFBKMPQASA-N 440.636 4.097 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccncc2)cc1 1525918247 FECMOKQNROOIDN-RRPNLBNLSA-N 442.607 4.460 10 10 IICE CO[C@@H](C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)c1ccc(Br)s1 1529277052 CXQVVXJQLORFJY-SCLBCKFNSA-N 425.392 4.320 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(Oc4cccc(OC)c4)cn3)CC2)cc1 1529804451 PRIIZVKEFMMDHZ-UHFFFAOYSA-N 433.508 4.290 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)ccc1NC(=O)OC(C)(C)C 1539234798 GPMLMUBNXAXHPL-JOCHJYFZSA-N 440.588 4.441 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1540518670 XMGBPFMXRVOLNR-HXUWFJFHSA-N 433.499 4.255 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc4nc(C(F)F)[nH]c34)cc2F)C[C@@H](C)O1 1543233712 QQPDAZCRBFXIHS-CHWSQXEVSA-N 432.446 4.183 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCN(C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1544304378 WJOBZODSZJIKFX-KRWDZBQOSA-N 433.394 4.102 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnc1Br 1566154771 HRSUUGDDIYQLCA-AWEZNQCLSA-N 440.288 4.153 10 10 IICE Cc1cc(I)cc(C(=O)NCCCSc2nccs2)c1C 1585222571 PBKWPUPJABYQMN-UHFFFAOYSA-N 432.352 4.277 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1noc2ccc(Br)cc12 1585263725 GZFDOCXAJMHCCM-AWEZNQCLSA-N 430.346 4.255 10 10 IICE Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1596523094 HOTPOJKBSPIEKD-UHFFFAOYSA-N 441.000 4.454 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@@H](F)C3)n2CCN(C)C(C)C)c(C)n1-c1ccccc1 1611936268 UWWJHVOZJAXEOQ-JPYJTQIMSA-N 438.595 4.487 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cccc(I)c3)cc2)CC1 1616686546 BIKHEMYGYSOPDE-UHFFFAOYSA-N 434.321 4.458 10 10 IICE Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NCc1c(O)ccc2c1CCCC2 1622664129 ICPXSKGEXIBGHZ-UHFFFAOYSA-N 440.341 4.458 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F 1623550164 SAXQPLFHGKMGTE-UHFFFAOYSA-N 432.446 4.177 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C\C(=O)NCc2ccc(N3CCSCC3)cc2)C1 1625970297 YEIFFJJZHYPSNL-WUQYLLKWSA-N 445.629 4.059 10 10 IICE Cc1cc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)ccc1N1C(=O)CCC1=O 1629228125 IQJMHERYXKHKCP-UHFFFAOYSA-N 429.476 4.121 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc3ccccc3c2O)c1 1633079388 GVNDVLKJKCGOEB-UHFFFAOYSA-N 425.488 4.290 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn3c(C(F)F)cc(C4CC4)nc23)cc1F 1633263325 FHLQNLVKQPMJCF-UHFFFAOYSA-N 431.462 4.460 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@H](c4ccc(F)c(Cl)c4)C3)C2)cc1 1636354440 XQWFPGUBVSABQQ-ZHRRBRCNSA-N 447.938 4.097 10 10 IICE COc1ccc(N2C[C@@H](NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2=O)cc1 1645152313 QXKCPDXHJYNNOL-FQEVSTJZSA-N 431.536 4.255 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3ccccc3C(=O)c3ccccc3)CC2)cc1 1652964930 QQTDODXUDOFINB-UHFFFAOYSA-N 443.547 4.077 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCO[C@H](C(C)C)C2)sc(C)c1-c1ccccc1 1653877195 DCIVRTLBNNGVHJ-SFHVURJKSA-N 430.570 4.196 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N[C@H](C)c2ccccc2O)sc2c1CC[C@@H](C)C2 1655349813 UJTKOMOQWSCXNV-KFWWJZLASA-N 430.570 4.433 10 10 IICE Cc1cc([C@@H]2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)C2)c(O)cc1Cl 1685686637 NWMIASYWBXJMKF-GCJKJVERSA-N 445.007 4.222 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCN(CC(C)C)CC2)cc1 1695619119 GTATYCPCSWCKOC-UHFFFAOYSA-N 447.631 4.013 10 10 IICE CCC[C@@H](C)N(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1709492500 DWGYCWPTHAOFHR-QGZVFWFLSA-N 427.572 4.018 10 10 IICE CCOCc1nnc(N2C[C@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1710664509 DKCTWSDTCMMKOB-BGYRXZFFSA-N 443.661 4.429 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc2c(c1)CCCN2C 1712525288 MUNQEPPGHRNCKI-LJQANCHMSA-N 441.620 4.059 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(C)(C)SC 1727001307 HHEAMTSZFFPWKM-INIZCTEOSA-N 435.613 4.408 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1 1748357389 KKMBXNQBNPAKNB-LJQANCHMSA-N 437.588 4.393 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2CCN(C)C(C)C)c(C)n1-c1ccccc1 1761675700 USBQTOHZGAXQKV-UHFFFAOYSA-N 447.587 4.317 10 10 IICE CCCCN1CCCC[C@H]1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1764149659 PNQGESCCHCQCGW-QHCPKHFHSA-N 448.615 4.261 10 10 IICE Nc1ccc(N(CCc2c[nH]c3ccccc23)S(=O)(=O)c2ccc3nc(O)oc3c2)cc1 1857992241 OUVBGRMSQBKPEX-UHFFFAOYSA-N 448.504 4.035 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)cc1OC 1860084402 NMXZVMSGWMLXPN-VCHYOVAHSA-N 446.506 4.417 10 10 IICE CCCCn1cc(OCC(C)C)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870435244 WZXBMQUXEQKFBL-UHFFFAOYSA-N 427.589 4.014 10 10 IICE CC1(C)C[C@H](CNCc2cc(Br)cc(F)c2O)N(C(=O)OC(C)(C)C)C1 1965977221 WZXNMDZHUXPORM-CQSZACIVSA-N 431.346 4.419 10 10 IICE Cc1ccc([C@H](n2nc(C(C)C)c(CN)c2I)C2(C)CC2)c(O)c1 2078982459 AXMVNIVXNVTWSU-KRWDZBQOSA-N 439.341 4.473 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C3(C)CC3)c(N)c2I)cc1C 2080012704 SOXATUMUGYKEGG-INIZCTEOSA-N 437.325 4.443 10 10 IICE C[C@H](O)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)cc1Br 2144886991 YFOMGCKAANEUMC-SFHVURJKSA-N 433.390 4.231 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@H](NCc1cc(Br)cc(F)c1O)C2 2241053528 CLTRIGBHPLJMLF-HYEYJGRESA-N 443.357 4.465 10 10 IICE CN1C(=O)C(=Cc2ccc(C(=O)NCCc3c[nH]c4ccc(F)cc34)cc2)SC1=S 2296552146 LRTHIVCTBPKWNQ-UHFFFAOYSA-N 439.537 4.111 10 10 IICE COc1ccc(Br)c(CNC[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1O 2336897001 IXURDUQNTIKVQR-OAHLLOKOSA-N 431.371 4.192 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@H]3[C@H]2CCN3C(=O)OC(C)(C)C)c(O)c1Br 2352947304 RFELEVNRMAJEKF-JYJNAYRXSA-N 425.367 4.198 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@H](Cc1cccc(Br)c1)NC(=O)OC(C)(C)C 2362990613 RYQZBZBLMFJUSV-HNNXBMFYSA-N 440.342 4.044 10 10 IICE CC(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)NC(=O)CO4)cs2)cc1 11857561 PWVKYGWPALOSKG-UHFFFAOYSA-N 429.523 4.065 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(-c4noc(C5CCC5)n4)cc3)CC2)cc1 21353923 KVGRPULTAQNUQF-UHFFFAOYSA-N 433.512 4.367 10 10 IICE CC[C@H](C)Oc1ccccc1/C=C1\SC(=S)N(NC(=O)c2ccc(OC)cc2)C1=O 33770866 SMZFDYCPGXNEMF-QIQQCEGHSA-N 442.562 4.419 10 10 IICE CCCN(CC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OC)Cc1ccccc1O 110729608 BVRXFOXYOQLGQG-UHFFFAOYSA-N 425.312 4.336 10 10 IICE Cc1nc(-c2cccc(NC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)no1 743125873 NHBWHGATYIXZBD-KRWDZBQOSA-N 443.454 4.437 10 10 IICE Cc1cc(C(=O)NCCc2cnc(C3CC3)nc2)c(C)n1-c1ccc(Br)cc1 756087699 PWGCNRRIONQFCD-UHFFFAOYSA-N 439.357 4.497 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C\c2ccnc(Cl)c2)NC(=O)OC(C)(C)C)cc1 761776675 SZAOLEJDFYVQQH-LFIXQJEJSA-N 444.963 4.196 10 10 IICE CCc1ncc(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)s1 763495409 ULJWIPUSHNRNBI-UHFFFAOYSA-N 436.403 4.454 10 10 IICE CC(C)NC(=O)c1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 766397613 DSVXZVOUOZHDGY-UHFFFAOYSA-N 432.568 4.185 10 10 IICE COc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(Cl)c1OC 768670899 RZTPGJANFIZBAK-UHFFFAOYSA-N 429.992 4.179 10 10 IICE c1ccc(OCc2ccncc2)c(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768670918 SSGQJHMMTSTEDN-UHFFFAOYSA-N 442.607 4.482 10 10 IICE Cc1ccc(-n2nnc([C@H](C)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)c2C)cc1 773143643 BYLFPDYPIYXFEP-NRFANRHFSA-N 444.627 4.267 10 10 IICE CN1CCN(c2ccc(CN3CCC([C@@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2)CC1 775678135 AMOJWBRBDXGUTL-DEOSSOPVSA-N 439.003 4.040 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3c(C)ccc(C)c3[N+](=O)[O-])n2)cc1OC 790639966 VNEAPQYZZOMKBZ-UHFFFAOYSA-N 449.510 4.153 10 10 IICE COC(=O)CCSc1cccc(NC(=O)NCc2cc(Br)ccc2O)c1 806368926 SJPZEDOETZPRFL-UHFFFAOYSA-N 439.331 4.132 10 10 IICE COc1cc(CNCc2cc(Br)ccc2O)c([N+](=O)[O-])cc1OCC(F)F 809712092 BIYIEKWJVZGTPI-UHFFFAOYSA-N 447.232 4.005 10 10 IICE CCOc1ccc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)c(O)c1 809758131 DNLZGRZLOKMGBE-UHFFFAOYSA-N 425.447 4.259 10 10 IICE Cc1c(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cccc1N1C(=O)N[C@H](C)C1=O 811538576 XNXBWLTWNCNCQP-OAHLLOKOSA-N 434.471 4.239 10 10 IICE COc1ccc(N2CCCN(C(=O)C3(c4cccc(OC(F)(F)F)c4)CC3)CC2)cc1 1125322679 IGFVPYGTSHZQDY-UHFFFAOYSA-N 434.458 4.364 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC(C)(C)c2cn(-c3ccccc3)nn2)c1 1137330153 DKHMDMNTCQACLO-UHFFFAOYSA-N 427.508 4.152 10 10 IICE CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N(CC)Cc1cc(Br)ccc1O 1137349347 PUVQOEPVQBNCPA-LJQANCHMSA-N 447.373 4.031 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)Cc4ccccc4)CC3)c2C)c1 1139804456 DZUHFMSGZYMDFA-UHFFFAOYSA-N 429.564 4.238 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1 1152396195 VAYXAICBSXGNSH-GBXCKJPGSA-N 443.547 4.429 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3C[C@H](OC(C)(C)C)[C@@H]3n3cccn3)c2C)cc1 1158289803 YOSVBQKOLAJLPG-XPWALMASSA-N 436.556 4.226 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc4cccc(Cl)c4s3)cc2)CC1 1288916588 WIHPCYNVYXHIJK-UHFFFAOYSA-N 427.957 4.186 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN2C[C@H](C)C[C@@H](C)C2)n1 1289918435 DLTLCKSQAIIKJC-WOJBJXKFSA-N 448.615 4.359 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1291102788 SRMSVABIZBFTTN-IBGZPJMESA-N 434.588 4.193 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CC=C(C(C)(C)C)CC2)cc1F 1298056183 MMFBIIOASSOTRQ-SFHVURJKSA-N 427.568 4.218 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c2ccc(F)cc2O1 1300194503 LBBGDZVCXOOWHE-NRFANRHFSA-N 442.874 4.467 10 10 IICE COc1cccc(-n2nc(C)c([C@H]3COCCN3Cc3ccc(N(C)C)c(C)c3)c2C)c1 1307681347 YNOGGRVNLKEQOP-RUZDIDTESA-N 434.584 4.446 10 10 IICE CN(Cc1cccc(Cl)c1Cl)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1313305061 NPQBNTDTZOBHDF-UHFFFAOYSA-N 449.382 4.037 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CN(Cc4ccccc4)CCO3)cc2Cl)C1 1436046198 AVUKQKYGVWZOPT-NTKDMRAZSA-N 442.003 4.094 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](Cc1ccccn1)NC(=O)OC(C)(C)C 1441918606 SEMXKSPVYNWWQG-JOCHJYFZSA-N 440.588 4.021 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccc3c(c2)CCCN3C)cc1 1442402943 UFUSNUSMDYJOAR-UHFFFAOYSA-N 449.576 4.108 10 10 IICE Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)c(C)n1-c1ccc(Br)cn1 1447260888 GMCAUOZFKLOYSE-UHFFFAOYSA-N 431.246 4.118 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc([C@]4(C)NC(=O)N(C)C4=O)cc3)c2C)c1 1452492067 ZQKHSPKUDUPWOD-VWLOTQADSA-N 430.508 4.052 10 10 IICE CCC(CC)(C(=O)CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)C(=O)OC 1458907952 JDCKZGZXXSTKBX-GOSISDBHSA-N 430.570 4.370 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(Cl)cc4)C3)cc2)CC1 1464963788 ZKTWJMBRLIMVFU-LJQANCHMSA-N 425.960 4.246 10 10 IICE COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1470594465 TZDWBZQXBCROTQ-JTSKRJEESA-N 431.964 4.204 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@@H]2CC)n1Cc1ccc(N(C)C)cc1C 1496812693 NFRWKILFSPMSDB-JTSKRJEESA-N 440.636 4.244 10 10 IICE CCN(CC(C)C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1501717666 JSUXHGWKJJXDRB-UHFFFAOYSA-N 431.600 4.373 10 10 IICE CC(C)CCn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1509314428 KQOGYCIXJQIBAN-UHFFFAOYSA-N 439.629 4.450 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1514324374 YCPHXDZWFWEJGR-PZJWPPBQSA-N 443.661 4.398 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(F)cc(Br)c3F)CC2)cc1 1517327904 KGSUCYCSTAXVRG-UHFFFAOYSA-N 425.273 4.088 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC1(c2ccccc2)CC1 1524064366 ZHVXLCWXUIAEQQ-RGEXLXHISA-N 440.565 4.265 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3-c3nc(C(C)(C)C)no3)C2)cc1 1526246105 BTFLZYVTYRCXTB-QGZVFWFLSA-N 434.540 4.299 10 10 IICE CC(C)(C)OC(=O)NCCn1cc(C(=O)Nc2ccc(N=Nc3ccccc3)cc2)nn1 1529620267 KYVYIINICDVTAS-UHFFFAOYSA-N 435.488 4.471 10 10 IICE O=C(/C=C\c1cncc(F)c1)N1CCOc2c1cc(Br)cc2C(F)(F)F 1530622876 KUSVSDMZNANMSZ-UPHRSURJSA-N 431.183 4.441 10 10 IICE Cc1cc(C(=O)NCc2cccnc2N2CCN(C)CC2)c(C)n1-c1ccc(C(C)C)cc1 1542471483 XOLZQPSMHICANZ-UHFFFAOYSA-N 445.611 4.294 10 10 IICE CC[C@@H](C)CN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1545627870 BRWLHFXNOHHBCS-GOSISDBHSA-N 429.584 4.442 10 10 IICE C[C@]1(C(=O)NCc2ccc(N3CCCCC3)cc2)CCN(C(=O)OCc2ccccc2)C1 1557139717 KSPTXHJJKVJONU-SANMLTNESA-N 435.568 4.342 10 10 IICE Cc1cc(CC(=O)N[C@@H](CO)c2cccc(Br)c2)c(C)n1-c1ccccc1 1566769866 RDNCZCCDWOZUKV-NRFANRHFSA-N 427.342 4.249 10 10 IICE Cc1cccc(C)c1NC(=O)CN(C)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1588177365 PYCUEYZGCIOJON-UHFFFAOYSA-N 431.536 4.163 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@]3(C)CC(c4cccc(Cl)c4F)=NO3)CC2)cc1 1596733232 OIIAYTWDPVQACC-HSZRJFAPSA-N 445.922 4.110 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 1597088744 AGFCALLOSKGZTO-FPOVZHCZSA-N 446.588 4.327 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1611255470 MRSGQOZLZLHZKG-AWEZNQCLSA-N 429.575 4.108 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCSC(C)(C)C1 1611963767 ZVNAVMACBRTCNC-FQEVSTJZSA-N 429.634 4.274 10 10 IICE CC[C@@H](C)c1nnc(N(CC)CC2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1613191634 UMELGDMURFZXLU-GOSISDBHSA-N 429.584 4.442 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CC1(N(C)C)CCCC1 1617940322 MVFRORYUUQMGIR-UHFFFAOYSA-N 440.979 4.210 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1623946997 DMQRXXXBHFESBC-YADARESESA-N 446.547 4.365 10 10 IICE Cc1cc(C(F)(F)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cnc1Cl 1627205374 PGBNGWGCAXOXSF-IBGZPJMESA-N 437.918 4.409 10 10 IICE Nc1cc(I)ccc1C(=O)N(Cc1ccco1)Cc1ccccc1O 1631143000 DFAHUUVLEPOAHM-UHFFFAOYSA-N 448.260 4.015 10 10 IICE Cc1cc(CC(=O)N[C@@](C)(CO)c2ccc(Br)cc2)c(C)n1-c1ccccc1 1631163232 KVHSUVIBYQGBOU-QHCPKHFHSA-N 441.369 4.423 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)Cc1cccc(C)c1 1633115431 SYVFYVSLXZOIOJ-OAQYLSRUSA-N 434.536 4.173 10 10 IICE CCCCN(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)c1ccccc1 1634241994 MHPHTIDNOGYNKU-SRNWCRMJSA-N 449.595 4.290 10 10 IICE CCN(Cc1nc2c(s1)C[C@H](C)CC2)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1636354502 YZUNBSWRWFZETM-QZTJIDSGSA-N 442.629 4.335 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2C[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1637410260 KGRSDJNBLWTIEE-XUTJKUGGSA-N 440.588 4.239 10 10 IICE CC(=O)c1cccc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1O 1638108938 GBIZBTDLDOMDIH-LFIBNONCSA-N 446.575 4.276 10 10 IICE COc1cc(C(=O)NCc2cccc(Cl)c2O)c([N+](=O)[O-])cc1OCc1ccccc1 1640405479 VHMSHEBIWCYOCN-UHFFFAOYSA-N 442.855 4.471 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1 1641766647 OBESYMSLSPUKRC-UHFFFAOYSA-N 436.986 4.403 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@H]1CN(c2ccccc2)C(=O)O1 1644585255 YUZFTDAOLVHKHU-NRFANRHFSA-N 437.540 4.489 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]3COCC[C@H]32)sc(C)c1-c1ccccc1 1644947171 QLJSVCWTRYMDIH-RTBURBONSA-N 442.581 4.340 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]2c2ccc(Br)c(F)c2)cc1 1658454266 KWMBCWXRFWJTBO-HXUWFJFHSA-N 434.353 4.108 10 10 IICE CC(=O)N1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC12CCCCC2 1687216540 ACNBWNHHQSGZIJ-UHFFFAOYSA-N 436.600 4.213 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1CCc1nc(C(C)(C)C)cs1 1711095822 YZTNKJZESCKTJM-QGZVFWFLSA-N 441.601 4.121 10 10 IICE COC(=O)c1c(C(F)F)nn([C@H](c2ccc(OC)cc2O)C2(C)CC2)c1Br 2079877294 WCZDWALVMXVRON-CQSZACIVSA-N 445.260 4.474 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C)c([N+](=O)[O-])c4)o3)C2=O)cc1 2294124671 TUJZBCBYSOLHBZ-UHFFFAOYSA-N 445.431 4.392 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3ccccc3OCCC(=O)O)SC2=S)c1 2314934438 ZTCKTPLXWUEXRQ-UHFFFAOYSA-N 427.503 4.149 10 10 IICE O=C(O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 2323865505 KMTFPOHDLIZCQG-OAHLLOKOSA-N 434.882 4.275 10 10 IICE CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352673620 RTHLCXUDYTZUOS-AWEZNQCLSA-N 429.355 4.115 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550796 WQXCMCBHUSCVAL-IPJJNNNSSA-N 427.526 4.452 10 10 IICE CCCN1C(=O)/C(=C\c2c(Oc3cccc(C)c3)nc3ccccn3c2=O)SC1=S 39835602 NXCSNLZADBLNMB-GHRIWEEISA-N 437.546 4.406 10 10 IICE CCOc1cc2c(cc1/C=C/C(=O)NC1CCN(c3ccc(OC)cc3)CC1)O[C@H](C)C2 110358174 DPGWCIFGPWUITF-YPHWWSSASA-N 436.552 4.216 10 10 IICE COC(=O)CCCCCN1C(=O)/C(=C\c2ccc(OC(C)C)c(OC)c2)SC1=S 206709184 HTCNTDXZWQVQQI-QGOAFFKASA-N 437.583 4.417 10 10 IICE CC(=O)c1ccc2c(c1)CCN(C(=O)Cn1c3c(c4ccccc41)CN(C(C)C)CC3)CC2 435903888 TZPXZCNMXVLLMR-UHFFFAOYSA-N 443.591 4.238 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)C3CCN(CC(F)(F)F)CC3)ccc21 527310706 QZUQIVLNNQTTNM-MRXNPFEDSA-N 439.522 4.297 10 10 IICE C[C@H]1Cc2ccccc2[C@@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732241462 JQWLOBZCAQHXPS-YCRPNKLZSA-N 433.474 4.275 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCO[C@@H]2c2cnn(-c3ccccc3F)c2)cc1 752827696 WZVVUTQBYPNQRI-XUZZJYLKSA-N 436.531 4.252 10 10 IICE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 761973187 NNKYAPDPNOKMHP-UHFFFAOYSA-N 446.551 4.045 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)C[C@@H](O)c2ccc(F)cc2)C1 768070179 FYXUMVVMJQHORV-AVRWGWEMSA-N 437.559 4.175 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 783524665 JBAFWTWRJDSZTN-QHCPKHFHSA-N 442.648 4.098 10 10 IICE CCCN(CCc1ccccn1)c1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 785836270 VMXMNXLHTIASMD-UHFFFAOYSA-N 439.266 4.128 10 10 IICE COc1cc(O)c(CNc2ccc3c(c2F)CCN(C(=O)OC(C)(C)C)C3)cc1OC 793610310 SVKARPBJINZPNT-UHFFFAOYSA-N 432.492 4.454 10 10 IICE CCN(CC)[C@H](CNC(=O)NCc1cc(Br)ccc1O)c1ccsc1 804913100 DJPDCLNJOCCLFY-MRXNPFEDSA-N 426.380 4.099 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1sc(C(C)(C)OC)nc1C 810456699 UHIBIQVXAOJMNN-UHFFFAOYSA-N 427.364 4.463 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 812444825 NSLSCBHNRZWGIW-UHFFFAOYSA-N 435.528 4.451 10 10 IICE CC(C)N(C)Cc1cc(O[C@H]2CCN(Cc3cccc(Br)c3O)C2)ccn1 856558759 BITXNHMNQCFVLH-IBGZPJMESA-N 434.378 4.043 10 10 IICE O=C(Cc1ccc(OC(F)(F)F)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472661 NNFUVUZOOZDYCE-KRWDZBQOSA-N 442.865 4.268 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](c3nccc(C(F)(F)F)n3)C2)c(C)n1-c1ccccc1 1134541192 YOLLZALWQKHQLZ-KRWDZBQOSA-N 428.458 4.462 10 10 IICE Cc1cc(C(=O)N2CCc3ccc(O)cc3C2)c(C)n1-c1ccc(Br)cn1 1150493968 OVBHZSGKMZBWCZ-UHFFFAOYSA-N 426.314 4.156 10 10 IICE CN(CC(=O)NCc1cnn(-c2ccccc2)c1)c1ccc(OCc2ccccc2)cc1 1169340935 CFHDPIVQGJLNHE-UHFFFAOYSA-N 426.520 4.204 10 10 IICE CCOC(=O)C1(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CCCC1 1179688392 TVSRVGBAZDMCCB-UHFFFAOYSA-N 448.361 4.105 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1225137495 RPIQQAFNMRPVRB-HXUWFJFHSA-N 449.382 4.396 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@H]3C[C@@H]3CCCO3)cc2Cl)C1 1235832009 BWRPTYACZCQAKC-RLLQIKCJSA-N 435.996 4.056 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC[C@@H]1C 1287363537 JLXKHFQFGFJUOA-UNMCSNQZSA-N 425.621 4.386 10 10 IICE CCOc1cccc2c1OCC(C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)=C2 1292382421 RQKQQPFXVFSAOZ-HSZRJFAPSA-N 436.552 4.135 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCSC[C@@H]2C)cc1 1295415232 OVZGINHWGVBANJ-RXVVDRJESA-N 429.634 4.356 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1C[C@H](c2ccccc2)C1 1297207799 BNEJOHZILCEKLU-ZDZWXYPCSA-N 440.565 4.479 10 10 IICE CC[C@@H]1CCCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1306331049 SMMHZWYWMWNQNB-WOJBJXKFSA-N 429.609 4.051 10 10 IICE Cc1cc(CCNC(=O)N2CCN(CCc3cccs3)CC2)c(C)n1-c1ccccc1 1313100935 PDUYNHRPTBJOSE-UHFFFAOYSA-N 436.625 4.268 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3cc(F)cc(F)c3)CC2)N(C)C)cc1 1313409268 BMVSLPUMCKDYDP-DEOSSOPVSA-N 444.570 4.298 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1(c2ccc(C(F)(F)F)cc2)CC1 1343161917 LJMPGQZWBFNACH-UHFFFAOYSA-N 432.486 4.262 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CC[C@H](C)C2 1349304819 JYFYWNXNIMDIEL-KBPBESRZSA-N 444.528 4.180 10 10 IICE COc1ccc(CCCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1OC 1350628834 OCCSYXGPNLSMFX-UHFFFAOYSA-N 429.472 4.441 10 10 IICE COc1ccccc1-c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)s1 1351136110 WIVUCXUOVUONAM-SFHVURJKSA-N 449.576 4.055 10 10 IICE COC(=O)CC[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1359943575 GLOAANQDYGEKPP-JOCHJYFZSA-N 434.536 4.339 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CC=CCC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1361045692 GANXYPUWDPGRED-OAQYLSRUSA-N 446.599 4.233 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncoc1CCC(F)(F)F 1361062913 IAYJYKXJVJAIPA-LBPRGKRZSA-N 433.377 4.170 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCNc3ncc(Cl)cc3Cl)ccc21 1441477177 XVNGBBGPPCTQJX-UHFFFAOYSA-N 435.355 4.448 10 10 IICE Cc1cc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2=O)c(C)o1 1458936087 ONWWXCOAPVSDFR-VWLOTQADSA-N 433.508 4.262 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@H](c3c(F)cccc3Cl)N3CCCCC3)C2)cc1 1461496111 OIELHJTVGADREB-HXOBKFHXSA-N 445.966 4.410 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)cc1C 1502137380 KMFNHKTUJRKUKP-QFIPXVFZSA-N 439.629 4.358 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@@H](NC(C)=O)Cc2ccccc21 1519477614 HNVOIYLEBUIEPR-MLUDITRGSA-N 429.520 4.131 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccc2ccccc12 1526260384 XUPPKDRUPBGSAS-NRFANRHFSA-N 429.564 4.136 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(-c4cc(OC)ccc4Cl)no3)C2)cc1 1531740849 LMNDEETZIBOTKV-CQSZACIVSA-N 427.888 4.021 10 10 IICE COCCn1ncc2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc21 1544074863 UNNALXIXZREVCG-UHFFFAOYSA-N 430.508 4.084 10 10 IICE COc1ccc(-c2cc(C(=O)N(Cc3ccco3)Cc3ccccc3O)n[nH]2)c(OC)c1 1545496263 DZSFHVPGUXSWLT-UHFFFAOYSA-N 433.464 4.235 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(CC(C)C)n1Cc1ccc(N2CCSCC2)cc1 1547554480 PIEUQKTZLZBIRT-QFIPXVFZSA-N 443.661 4.083 10 10 IICE C[C@@H](NC(=O)[C@@H](NCC(F)(F)F)c1cc(Br)cs1)c1ccccc1O 1557966628 KZECJNVFEKCEAP-OTYXRUKQSA-N 437.281 4.287 10 10 IICE COc1cc(OC)c2c(=O)c(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c[nH]c2c1 1583700075 QFKZROLOHVWDBE-UHFFFAOYSA-N 449.551 4.244 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC2CCN(CCC(C)C)CC2)CCCC1 1587388977 QXOAHBBMLYIOQJ-UHFFFAOYSA-N 425.617 4.403 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3CCOCC3)nc2C)cc1-n1c(C)cc(C=O)c1C 1588281746 TVZMYZUYPXCAKM-UHFFFAOYSA-N 432.524 4.007 10 10 IICE CCN(CC)c1ccc2cc(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)c(=O)oc2c1 1597801168 YOBNPKVVQKQSNL-SFHVURJKSA-N 435.568 4.375 10 10 IICE CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1=O 1608448682 XAKPLFHCYJRPDK-AREMUKBSSA-N 444.535 4.213 10 10 IICE C[C@H](CN(C)C(=O)OC(C)(C)C)Cn1c(CC2CC2)nnc1N(C)Cc1ccccc1O 1611438973 VNBUXFZEYBSBKO-QGZVFWFLSA-N 443.592 4.076 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC(C(F)(F)F)CC1 1611963104 HHWIZRGHQZZANH-UHFFFAOYSA-N 432.494 4.475 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@]34C[C@H]3CCCN4C(=O)OC(C)(C)C)cc2)CC1 1616693963 CNSSAJJHXICWEB-NLFFAJNJSA-N 427.589 4.329 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](CS(C)(=O)=O)c3ccccc3)cc2Cl)C1 1617899463 AAJJGWMUZNZYRP-PXNSSMCTSA-N 449.016 4.021 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1C[C@@H]2CC[C@H](C1)S2 1627074472 FVSCYLXABVXQCS-GNURVDRSSA-N 438.665 4.272 10 10 IICE Cc1ccc(C(=O)Nc2ccn(CCc3ccncc3)n2)cc1-n1c(C)cc(C=O)c1C 1627174334 VWQYITLQRBEDKT-UHFFFAOYSA-N 427.508 4.302 10 10 IICE COc1ccc(N2CCN(C(=O)/C(F)=C/c3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1631372784 YUEYVSZIHKJSNO-AQTBWJFISA-N 438.421 4.382 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cccc(C(F)(F)F)c4nc3O)CC2)cc1F 1631381272 WTXXYAPZOQDZOC-UHFFFAOYSA-N 449.404 4.069 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)cc2Cl)C1 1634720231 RHHJJWPGNMMPLM-HZPDHXFCSA-N 439.000 4.289 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cccn2-c2cccc(I)c2)c1 1640796665 KCTWESGHJOZNAX-UHFFFAOYSA-N 432.261 4.026 10 10 IICE COc1ccc(-c2n[nH]c(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)n2)cc1 1651502976 CIRZDCGHXXWQRO-UHFFFAOYSA-N 429.436 4.232 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@H](CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)[C@H]2C1 1652207365 MHMNGRXJPCFSGS-OWZKRDHZSA-N 437.496 4.351 10 10 IICE CCCN(Cc1cc(I)cc([N+](=O)[O-])c1)Cc1ccccc1O 1653476196 RPVWFYFLXBQOCG-UHFFFAOYSA-N 426.254 4.317 10 10 IICE CCO[C@@H]1C[C@@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1653657507 SYLFOHGMKIUTJO-FGZHOGPDSA-N 448.563 4.316 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2nc(-c3ccc(C)c(C)c3)cs2)cc1 1654947844 TVNKUQBMFWWCNW-UHFFFAOYSA-N 438.597 4.442 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1)c1ccc(N(C)C)cc1 1671851653 HSWVVQPAAXVEKD-MAUKXSAKSA-N 431.378 4.154 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@H]3CCO[C@@H](c4ccc(F)cc4)C3)C2)cc1 1673822769 HJSPAELTHTWAMA-RVSNTGDXSA-N 441.547 4.222 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(Cc3cccc(C)n3)Cc3cccc(C)n3)C2)cc1 1682645809 JUOHUJPPVMSJDA-HSZRJFAPSA-N 445.567 4.093 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4cc(Br)ccc43)C2)cc1 1683787922 SFBRDVHFRVNIHS-OXJNMPFZSA-N 430.346 4.023 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)Cc1c(C)noc1C 1693005682 KRVKLTAVTBGOAL-UHFFFAOYSA-N 431.544 4.004 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)[C@H](C)S(C)(=O)=O 1695341445 GGZNEYZQGNVQRK-MJGOQNOKSA-N 443.617 4.020 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(O)CCC1 1697979508 GYTFQSOIOHTXLX-UHFFFAOYSA-N 437.588 4.130 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@H](C(C)C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1725296663 HBMLJHVQRUWJBY-SFHVURJKSA-N 442.608 4.370 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cccn4C)n3CCC(C)(F)F)CC2)cc1 1730181931 VYASEOCBKOWJMT-UHFFFAOYSA-N 444.530 4.054 10 10 IICE CC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)C1 1744885822 KVQJMRVVXXNJKR-NRFANRHFSA-N 448.615 4.457 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCC2(C)C)CCOC1 1746657518 DYDWMTGOFZLJHI-DVECYGJZSA-N 428.577 4.099 10 10 IICE COCCCCCn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1749657424 SBGODBZJJXAGBA-UHFFFAOYSA-N 441.620 4.478 10 10 IICE CCS[C@H]1CCCCN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768381951 CJTAJBIMBSVKKO-MOPGFXCFSA-N 447.624 4.147 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)C[C@H]2CC=CCC2)cc1F 1768496985 VTNMKVYRGCXVRJ-IBGZPJMESA-N 434.563 4.310 10 10 IICE COCCC1(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)CCCCC1 1769601228 AYSXCFOWZLJDSC-OAQYLSRUSA-N 428.577 4.459 10 10 IICE Cc1ccc2nc(-c3ccc(NC(=O)c4nnn(-c5ccc(N)cc5)n4)cc3)sc2c1 1857878523 FWIYWLPZMLIYHO-UHFFFAOYSA-N 427.493 4.082 10 10 IICE COC(=O)c1c(NC(=O)C2CCN(C(C)=O)CC2)sc(C)c1-c1ccc(C)c(C)c1 1860627017 ZMXLCHWKBUIQOO-UHFFFAOYSA-N 428.554 4.324 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)C1CN(c2nc3ccc(F)cc3s2)C1 1891476592 CLUDVBIQEXOCLO-JXFKEZNVSA-N 436.556 4.177 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@@H](CN[C@@H]2CCc3cccc(O)c32)C1 2084722314 OUAOOGCWCULYKX-FCHUYYIVSA-N 437.584 4.091 10 10 IICE CN(C)c1ccc([C@@H](O)c2ccc(I)c(Br)c2)cc1 2106802052 RXKIUHFVPTZKAQ-OAHLLOKOSA-N 432.099 4.201 10 10 IICE CN(C[C@@]1(Br)CC1(F)F)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2202538870 WTWRIMFAUBLKCB-SFHVURJKSA-N 446.336 4.171 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccc(C(=O)O)cc1 2293039526 IJMKESOCHONJBW-UHFFFAOYSA-N 432.548 4.066 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3cccc(OC)c3OC)SC2=S)cc1OC 2297554596 JQQSBESBXCQRQF-UHFFFAOYSA-N 445.562 4.165 10 10 IICE COC(=O)CCCN1C(=O)C(=Cc2ccc(OCCC(C)C)c(OC)c2)SC1=S 2314760383 ISAJDWZMBCXAMH-UHFFFAOYSA-N 437.583 4.275 10 10 IICE Cc1ccc(CN(C)C(=O)[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380758021 GZJJQZGAZQYNQD-HXUWFJFHSA-N 441.366 4.069 10 10 IICE CC[C@@H]1SC(=S)N(CCC(=O)Nc2ncc(Cc3ccc(Cl)cc3)s2)C1=O 11635794 MPNARMMFYNWGON-AWEZNQCLSA-N 440.015 4.355 10 10 IICE COc1cc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 15046042 QDIAGCMGBWVRDA-VBYYMIJXSA-N 448.953 4.283 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(NC(=O)C(C)C)cc4nc(C)ccc34)CC2)cc1 65136025 OLOQHCYZGYXWED-UHFFFAOYSA-N 446.551 4.109 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 110145135 FHGKJELCVLRWPF-PUZWTLIVSA-N 435.568 4.169 10 10 IICE CC(C)COC1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726720550 XIPFVYQZWCWFKK-UHFFFAOYSA-N 425.520 4.103 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N3CCCCC3)CC2)c(C)n1-c1cccc(F)c1 763578452 ORMCTMHLMMHSOV-UHFFFAOYSA-N 425.548 4.140 10 10 IICE Cc1cc(Br)c(O)c(CNCc2csc(CNC(=O)c3ccccc3)n2)c1 781633048 OQYJHZOVBSZMCA-UHFFFAOYSA-N 446.370 4.139 10 10 IICE CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C[C@@]2(CCOC2)O1 799995238 VMSHSRZWVMGQCR-LYHRCORUSA-N 435.996 4.056 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2cccc(Br)c2O)[C@@H](c2cccnc2)C1 800532811 XOSFFMYGMNWOOC-GOSISDBHSA-N 448.361 4.344 10 10 IICE COc1cc(O)c(CN[C@@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)cc1OC 814178231 IJOODWMQWWWKJT-DFBJGRDBSA-N 439.483 4.089 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(Br)c1F 1127268359 YSVLOACMHLZDGG-UHFFFAOYSA-N 446.364 4.050 10 10 IICE CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1128138408 WVLILKYPVQTFSS-AFMDSPMNSA-N 431.580 4.467 10 10 IICE CSc1ncc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)n1-c1ccc(F)cc1 1129814459 GWEZPQMZKBPPPV-MRXNPFEDSA-N 426.561 4.469 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(-c2cccc(Cl)c2F)no1 1148706411 WGIPKGHOFISRTP-UHFFFAOYSA-N 429.879 4.025 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](O)COc1ccc(C(F)(F)F)cc1 1150146446 NQSOQKAUAARPEJ-INIZCTEOSA-N 438.471 4.344 10 10 IICE O=C(N/C(=C\c1cccnc1)C(=O)N1CCc2c(Br)cccc21)c1ccccc1 1162451703 UCCGYPPGXCRSCR-ZHZULCJRSA-N 448.320 4.204 10 10 IICE CCOC(=O)c1c[nH]nc1[C@@H]1CCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1 1168482942 KKXDHAQZSVPAGW-LJQANCHMSA-N 434.540 4.240 10 10 IICE CCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1181746959 KZCNKGOTDJGJDR-IBGZPJMESA-N 426.561 4.351 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)[C@H]1Oc1ccccc1 1234567694 ZJSLWWBLXKQPJL-WXFUMESZSA-N 425.573 4.298 10 10 IICE COc1ccccc1[C@H](CNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)OC(C)C 1235033765 VXISWMLXPIBFAU-DVECYGJZSA-N 427.589 4.466 10 10 IICE Cc1cc(C(=O)N(C)C2CCN(C(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1290535007 PEPHAQAPHCZRBK-UHFFFAOYSA-N 433.394 4.196 10 10 IICE O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 1313149849 YMDUOKITOJEJTG-SJBKTWHCSA-N 430.932 4.266 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC[C@@H]1CC[C@@H](C(F)(F)F)O1 1313268647 KPLVUKBKXXUCET-ZFWWWQNUSA-N 439.272 4.186 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1CCCN(C)C1CCCCC1 1314752546 ALTQEFCUIGEKBA-UHFFFAOYSA-N 448.615 4.261 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)c1ccccc1C(F)(F)F 1446818600 XBFQQPWNCMTQFL-GFCCVEGCSA-N 429.822 4.370 10 10 IICE CC(C)C[C@H](CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)CC(=O)OC(C)(C)C 1470871678 WBVOERKJWXEDJB-NRFANRHFSA-N 447.620 4.059 10 10 IICE CC(=O)c1cc(F)cc(CN(Cc2cnn(C)c2)c2ccc(Br)cc2)c1O 1473783300 INIJCBPWEZXTIW-UHFFFAOYSA-N 432.293 4.437 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@H]1CSCCS1 1503488324 SQBVLUFTMBPLND-INIZCTEOSA-N 448.017 4.184 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(CC)C[C@@H]2CCCO2)cc1 1515532511 RANXDYWMOACBPU-GGAORHGYSA-N 441.620 4.072 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4ccccc4Cl)CCC3)cc2F)CC1 1537534529 CRROJYKHZUROHQ-UHFFFAOYSA-N 429.967 4.359 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCO[C@](C)(CC)C2)cc1 1547446920 KQMDEFOELNOSBE-PXDATVDWSA-N 441.620 4.072 10 10 IICE Cc1ccc(C(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1556639520 GYDNRMJLPQEIDH-RTBURBONSA-N 443.547 4.311 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3nc4c(Br)cccc4s3)cc2)CC1 1559281816 MXRMHGGXIGVLRM-UHFFFAOYSA-N 445.386 4.373 10 10 IICE COc1ccc(N(C)CC(=O)N2N=C(c3ccc(C)cc3)C[C@@H]2c2ccco2)c(OC)c1 1559666675 UINBNHBSIBNNSC-JOCHJYFZSA-N 433.508 4.419 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc3c(nc2O)CCC[C@@H]3O)cc1 1565655812 AYZIKYIVVJJAFO-DEOSSOPVSA-N 447.535 4.079 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(Br)c(F)ccc3[nH]2)cc1 1583621278 FJZOLHNJEMIIIY-UHFFFAOYSA-N 434.309 4.287 10 10 IICE COC(=O)NCCCC(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1610121932 DUCLFOBGSHPQIR-SFHVURJKSA-N 437.462 4.434 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OCCOC)c3ccccc3n2)cc1F 1628769591 BRMKSCLZFPPLRC-UHFFFAOYSA-N 425.504 4.175 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)cc1 1630950594 IZMVSXZQBHTJRE-DLBZAZTESA-N 441.572 4.257 10 10 IICE O=C(CSc1ccc(F)c(F)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1631425975 UNNJTPSGNFIHNG-OAHLLOKOSA-N 426.916 4.197 10 10 IICE Cc1ccc(C(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1634312687 VPKJCSBWKSYVKZ-QFIPXVFZSA-N 443.547 4.340 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F 1639341616 WVNPISSHGGFOLB-CVDCTZTESA-N 429.555 4.266 10 10 IICE CC(C)C[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1641822577 LMERFTOOMNSTKF-SJBKTWHCSA-N 433.612 4.346 10 10 IICE Cc1cc(CC(=O)N[C@](C)(CO)c2cccc(Br)c2)c(C)n1-c1ccccc1 1647008602 IZSPUWYTAAATFH-HSZRJFAPSA-N 441.369 4.423 10 10 IICE NS(=O)(=O)c1cc(CSC2=NC(=O)/C(=C/c3csc4ccccc34)S2)co1 1656597619 WYBGZVMZNDPDNW-NSIKDUERSA-N 436.561 4.045 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCCCc3c(Cl)cccc3Cl)cc2)CC1 1673990557 GWKJALCPXBXYFJ-UHFFFAOYSA-N 435.399 4.177 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O 1682824611 PNNWLNWWGPRLAG-FDDCHVKYSA-N 440.563 4.175 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC[C@H]2CCO[C@@H](C)C2)cs1 1693373658 BGXBOMPHIXZDBN-WMZOPIPTSA-N 441.601 4.181 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](N3CCCCC3)C2)n1CCCSc1nccs1 1694061244 GOTSYFXTBLKQBE-MSOLQXFVSA-N 434.679 4.495 10 10 IICE CNC(=O)[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1[C@@H]1C[C@H]1C(C)C 1696901634 HBVXEOLAQQRFHR-FRGLQRNOSA-N 448.615 4.388 10 10 IICE C#CCN(CC#C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nc(C)cs1 1705575263 ZZDNXCBYFGGKJH-UHFFFAOYSA-N 440.576 4.239 10 10 IICE CC(C)N(CCn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)C(C)C 1723542451 VYLAHIMJCYKFGC-UHFFFAOYSA-N 427.618 4.391 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)[C@H]1C 1726599877 YSSAYVDGYXYCLY-OALUTQOASA-N 425.621 4.067 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1728383041 RCNQVCKRFLJUCS-SIKLNZKXSA-N 441.620 4.418 10 10 IICE CC(C)(C)c1nnc(N2CCOC[C@@H](C3CCC3)C2)n1CCCSc1nccs1 1741175033 UAJCSDJTBFBCOH-KRWDZBQOSA-N 435.663 4.467 10 10 IICE Cc1ncsc1CN(C)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1742061964 RTIIHFPLRPISKI-UHFFFAOYSA-N 445.643 4.324 10 10 IICE CC[C@@H](C)N(C)CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763897436 WOMXZQUNEPLXAT-MRXNPFEDSA-N 428.968 4.066 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCC1CC1 1765963038 VCNOZZFGTKDCMY-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CN(CC(C)(C)C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1767023937 IEUBGXZWVACPGV-UHFFFAOYSA-N 436.629 4.424 10 10 IICE COCC[C@@H]1CCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1769627522 SZVPJMMBELHHPP-DLBZAZTESA-N 437.635 4.021 10 10 IICE CCCN(CC)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1772873265 GDEWIDATBSVIFS-UHFFFAOYSA-N 448.615 4.142 10 10 IICE CCOCCCN1C(=O)/C(=C\c2cc(Cl)cc(Br)c2O)SC1=S 1858589943 QDQDCWHWQTUKJR-KPKJPENVSA-N 436.780 4.436 10 10 IICE C[C@@H](C(=O)O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951904172 ZSIPUMNIWPINFS-QRQCRPRQSA-N 447.487 4.268 10 10 IICE CC[C@@H](CN(C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2)NC(=O)OC(C)(C)C 2053090984 LKVDIWSEQXPBSM-INIZCTEOSA-N 448.608 4.302 10 10 IICE CCOC(=O)c1c(CC)nn([C@@H](c2ccc(OC)cc2O)C2(C)CC2)c1Br 2079982705 XHIJCQFBBCMXRW-KRWDZBQOSA-N 437.334 4.488 10 10 IICE CC1=NN2C(=N)C(=Cc3ccc(OCCOc4cc(C)cc(C)c4)cc3)C(=O)N=C2S1 2293453468 PXXVFALUNLCSDZ-UHFFFAOYSA-N 434.521 4.400 10 10 IICE CCOc1ccc(C=C2C(=O)N(c3ccccc3)N=C2C)cc1I 2293674591 QQGBEZPMDNEKBF-UHFFFAOYSA-N 432.261 4.496 10 10 IICE CCOc1ccc(-n2cccc2C=C2C(=N)N3N=C(c4ccco4)SC3=NC2=O)cc1 2297346880 UWHALSUGFQSROZ-UHFFFAOYSA-N 431.477 4.136 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)ccc1OCCC(C)C 2313549346 UDRCXCPAJDDVRU-UHFFFAOYSA-N 436.508 4.403 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3ccccc3F)nc3c(C)cccn3c2=O)SC1=S 2314507038 IEVDXUZRBLFZPK-UHFFFAOYSA-N 441.509 4.155 10 10 IICE CCCOC(=O)CCCN1C(=O)C(=Cc2ccc(OCCC)c(OC)c2)SC1=S 2314759668 FWXURLANTXDFIY-UHFFFAOYSA-N 437.583 4.419 10 10 IICE Cc1nc2scc(C)n2c1C=C1SC(=S)N(CCc2nc3ccccc3[nH]2)C1=O 2318753414 WHJCEHOVVHHCHH-UHFFFAOYSA-N 439.591 4.333 10 10 IICE CN(Cc1ccc(I)c(Br)c1)Cc1ccccc1O 2349828600 LZEQSMVJKXRJFF-UHFFFAOYSA-N 432.099 4.391 10 10 IICE Cc1ccc(CNC(=O)[C@@H](C)CCCNC(=O)OC(C)(C)C)c(O)c1Br 2352636816 NKOVPRIZSJMCNX-ZDUSSCGKSA-N 429.355 4.020 10 10 IICE CC[C@@H](N[C@]12CO[C@H](C1)[C@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2359243389 IWCCMSNPVTUPKI-YVTWGWGSSA-N 441.366 4.020 10 10 IICE CSC1=NSC2=NC(=O)/C(=C\c3ccc(OC(=O)c4ccc(C)cc4)cc3)C(=N)N12 20114638 ULJJPJQFVCKCDY-HJMKZUPFSA-N 436.518 4.154 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCc3[nH]c4ccccc4c3C2)c([N+](=O)[O-])c1Br 22085133 AYEJSUJMQHXJFV-UHFFFAOYSA-N 447.245 4.318 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)Nc3ccc(F)cc3)c3ccco3)CC2)cc1 38637894 OCTVHVJDYPBDDW-JOCHJYFZSA-N 438.503 4.112 10 10 IICE CC1=NN(c2ccc(C)cc2)C(=O)/C1=C\Nc1c(C)nn(-c2ccc([N+](=O)[O-])cc2)c1C 59858620 FECPUPPQWYPURN-BKUYFWCQSA-N 430.468 4.424 10 10 IICE Cc1cc(C(=O)N[C@@H](c2nc(C3CC3)no2)C(C)C)c(C)n1-c1ccc2c(c1)OCCO2 110698272 JQLQMLSKDRZHNZ-OAQYLSRUSA-N 436.512 4.253 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@H]2c2ccc(O)c(O)c2)c1 526282180 JXYPWSJAJJCVGG-QFIPXVFZSA-N 429.432 4.040 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NCc2ccc(N(C)C)c(F)c2)cc1 763634979 GSUMUZIYQMIATD-MRXNPFEDSA-N 444.551 4.477 10 10 IICE Cc1c(Br)cc(S(C)(=O)=O)cc1C(=O)Nc1cccc(N2CCCC2)c1 767299581 RJGHTPSYUFCJNX-UHFFFAOYSA-N 437.359 4.014 10 10 IICE COc1ccc(Cn2nc(C)c(CN(Cc3ccccc3O)C[C@@H]3CCCO3)c2C)cc1 768503956 AHKOOVAZPUNYNR-DEOSSOPVSA-N 435.568 4.444 10 10 IICE O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 778927897 VTQVVMJOVWCIOZ-PUHATCMVSA-N 444.531 4.341 10 10 IICE CC(C)(C)OC(=O)N1CCC(SCC(=O)NCc2c(O)ccc3c2CCCC3)CC1 779002645 ZLGCMWOCENOUGQ-UHFFFAOYSA-N 434.602 4.020 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)nc(C(F)F)n4C)cc2F)C[C@H](C)O1 798400278 ZAPWZXYHWXACSM-KBPBESRZSA-N 446.473 4.194 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](c4cccc(O)c4)C3)n2C)c(C)n1-c1ccccc1 809872557 HHCLFFQEDYGBHJ-QHCPKHFHSA-N 429.524 4.173 10 10 IICE COc1ccc(N(CC(=O)N2[C@H](C)CCC[C@H]2C)CC(=O)N2[C@H](C)CCC[C@H]2C)cc1 914866982 CNMYTDJSDXBLNF-XRXFAXGQSA-N 429.605 4.081 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1nc(-c2cccc(Br)c2)cs1 917844803 HJJWOMWKYFUVRD-UHFFFAOYSA-N 447.767 4.069 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCN(C)Cc2ccccc2)C1 1124560465 SHYNGHSBUJLSPJ-UHFFFAOYSA-N 432.612 4.046 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1([C@@H]2CCCCO2)CCC1 1132710812 JTJPZUIXVZOWRQ-DNKLCNGGSA-N 448.585 4.025 10 10 IICE Cc1nc(-c2ccc(F)cc2)sc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1134882244 NJUYADUQPMYRJY-HXUWFJFHSA-N 426.561 4.356 10 10 IICE CC(C)NS(=O)(=O)c1cccc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c1 1136446392 HCHNKGMBIDAFDW-UHFFFAOYSA-N 443.613 4.072 10 10 IICE Cc1cccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)nc2)c1 1136984533 NKPXCMBATNWVPI-UHFFFAOYSA-N 435.499 4.213 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@](C)(O)c3ccc(F)c(Br)c3)cc2)CC1 1144772784 KMFQILNPEZXJIF-QFIPXVFZSA-N 449.364 4.348 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H]3C[C@H](c4ccc(C(F)(F)F)cc4)C3)cc2)CC1 1246325050 XMKDLRNNJKIZGI-XUTJKUGGSA-N 446.517 4.203 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c2c1 1264992993 VCSVCFMKHBPMQW-UHFFFAOYSA-N 445.441 4.388 10 10 IICE COc1ccccc1[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1nccn1C 1290520780 RPZLYLSPRPUJEF-XMMPIXPASA-N 442.519 4.168 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](COC)C1)OC 1292174888 OUJAFEVHLJQVPB-UNMCSNQZSA-N 437.588 4.250 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](C)c1nc(C)cs1 1306178276 CAJUJCQEWRCHQO-QGZVFWFLSA-N 440.617 4.134 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCC(C)(C)C 1314391234 POHISBIYTSIGDE-UHFFFAOYSA-N 433.572 4.115 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1C[C@H](C)C(F)(F)[C@H](C)C1 1361097875 KGHUOVSOMSLGSZ-NSHGMRRFSA-N 447.574 4.322 10 10 IICE Cc1cc(CCNC(=O)C[C@@H](C)n2cc(Br)cn2)c(C)n1-c1ccccc1 1438180008 UGGUQTLSLLATLD-OAHLLOKOSA-N 429.362 4.363 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cnc(-c2c(F)cccc2F)s1 1463780725 YIXVKUPNLNCGNG-UHFFFAOYSA-N 429.492 4.197 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)c1ccc(Br)cc1 1466398740 QXGCGQVTAQAMJM-LBPRGKRZSA-N 440.721 4.113 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc3c(c2)NC(=O)CCS3)cc1 1469612605 KPCXNJRAAWNBAY-UHFFFAOYSA-N 437.487 4.392 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N(C)CCOCCN(C)C(=O)OC(C)(C)C)c1 1470195897 JHWYMNMYGOWOIL-UHFFFAOYSA-N 443.588 4.358 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)Cc3ccc(S(C)(=O)=O)cc3)c2C)c1 1471033809 IAMBGXOZPTWJRJ-UHFFFAOYSA-N 439.581 4.148 10 10 IICE CC[C@@H]1c2ccccc2CN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1472273874 QVOSADCZDUWOJZ-GOSISDBHSA-N 428.535 4.362 10 10 IICE CSc1ncc(I)c(NCc2cc(Cl)cc(Cl)c2O)n1 1472798224 BYNXDEFCXGEFJQ-UHFFFAOYSA-N 442.109 4.428 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@@H]1CCCCC1(F)F 1503488000 QHAXNRYDIKIXTO-IBGZPJMESA-N 427.499 4.431 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCOCC2)c(F)c1 1513135483 PVIGMACPACLTMD-SFHVURJKSA-N 440.567 4.170 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCSC1(C)C 1513905023 XSKSFQJCWYAHSV-GOSISDBHSA-N 429.634 4.098 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)C(=O)NC)C1 1514089422 LVLRALQJABWIEO-HXUWFJFHSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CCO[C@H](C)C2)cc1 1515527756 MDIZLXMHWWVJCN-QGZVFWFLSA-N 440.979 4.113 10 10 IICE COCCOc1ccc(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1524705655 YGQVIJHEDIVXES-SFHVURJKSA-N 430.976 4.460 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C(C)(C)c3cccc4ccccc34)CC2)cc1 1524982188 KXHAHRYPEBXRBP-UHFFFAOYSA-N 445.607 4.455 10 10 IICE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccc(O)c(O)c1 1545639184 FGOLPJODFKPXKD-UHFFFAOYSA-N 446.503 4.031 10 10 IICE COC(=O)/C=C\c1ccc(N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c([N+](=O)[O-])c1 1559156693 HHDVRNVGWBVAPK-DXAOBPHNSA-N 439.512 4.033 10 10 IICE Cc1nn(-c2ccccc2)c2nc(C(=O)NCc3cccc(Br)c3O)ccc12 1568606158 XWSORJZXJIDDPN-UHFFFAOYSA-N 437.297 4.127 10 10 IICE COc1ccc(N2CCC(NC(=O)c3oc(CNC(=O)OC(C)(C)C)cc3C)CC2)cc1 1584361025 GVCJDNDTSBLWLN-UHFFFAOYSA-N 443.544 4.020 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C(=O)OC)[C@@H]4CCCC[C@@H]43)ccc21 1585636323 JJZZFOATPMAZIU-ONTIZHBOSA-N 426.557 4.098 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(-c2cccc(OC)c2)[nH]n1 1588193431 SWJDQMSKOFCWKS-UHFFFAOYSA-N 430.302 4.216 10 10 IICE CC(C)c1nnc(N2CCCN(C3CCCC3)CC2)n1CCCSc1nccs1 1602766847 PNQCMVLHIZETRS-UHFFFAOYSA-N 434.679 4.495 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1-n1c(C)cc(C=O)c1C 1618783917 NVYRLGQXHLWBIW-GOSISDBHSA-N 439.556 4.296 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]2C)c(C)n1-c1ccccc1 1624064403 FMVJPEJGOYMKBW-RTBURBONSA-N 425.573 4.493 10 10 IICE Cc1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)c(C(=O)NCC(F)(F)F)cc1F 1625427674 ZCNJGGWTUALLLW-UHFFFAOYSA-N 442.390 4.304 10 10 IICE CN(c1ccc(CNC(=O)c2ccc(I)cn2)cc1)C1CCCCC1 1625905438 RURUHBKDHSGYGA-UHFFFAOYSA-N 449.336 4.385 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C2CN(C(=O)OC(C)(C)C)C2)cc1 1627421512 ROUMBDJDCDDXJU-UHFFFAOYSA-N 439.556 4.161 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)N(Cc3ccccc3)[C@H]2c2ccccc2)c1 1633282947 QJNFVZQKHBEBQI-BVAGGSTKSA-N 428.532 4.497 10 10 IICE C[C@@H](c1ccccc1Br)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1638007443 NCBKDKNXUWTMKL-KRWDZBQOSA-N 445.405 4.104 10 10 IICE COC(=O)[C@@]1(C)CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@@H]1C 1642664248 NEBAUFYZDNXWDP-ZSEKCTLFSA-N 433.346 4.128 10 10 IICE CC(=O)N1CCN(c2ccc(CNc3nc(C)nc4scc(CC(C)C)c34)cc2)CC1 1651042362 RDMZGBIJFHLCEA-UHFFFAOYSA-N 437.613 4.479 10 10 IICE COc1ccc(Cl)cc1CNC(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1652745859 QHTLBWPDKRQMKD-UHFFFAOYSA-N 428.838 4.316 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1[C@H]2Cc3c(Br)cccc3[C@H]21 1686827268 ZJZVINBFHGSLBW-WQAOKWJOSA-N 442.401 4.392 10 10 IICE Cc1nnc(N(C)Cc2nc(C(F)(F)F)cs2)n1CCCSc1nccs1 1693462242 IDEXRBZJAHQXMD-UHFFFAOYSA-N 434.538 4.337 10 10 IICE CC(C)Cc1nnc(N2CC=C(C(F)(F)F)CC2)n1Cc1ccc(N(C)C)c(F)c1 1741444265 DJIGRAIXSMVSIM-UHFFFAOYSA-N 425.474 4.429 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](OC)[C@H](OC)C1 1745075604 LVKYBLBLFHBVOI-QRVKQSDOSA-N 435.572 4.169 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1749649428 VPRPMPYTWSDISF-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CC[C@@H](C)c1nnc(N(C)C[C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763515225 BHDSOIOQGMKIPQ-TZIWHRDSSA-N 443.661 4.256 10 10 IICE CN(C)c1ccc(Cn2c(N3CCO[C@](C)(C(C)(C)C)C3)nnc2C(C)(C)C)cc1F 1768498915 SHLXSNIYVWWLQC-DEOSSOPVSA-N 431.600 4.470 10 10 IICE Oc1c(Cn2nc(I)cc2C(F)(F)F)cccc1C(F)(F)F 2079170977 HQIUKMKBMSXWMP-UHFFFAOYSA-N 436.093 4.279 10 10 IICE CCc1nn([C@H](CC)c2cc(C)c(C)cc2O)c(I)c1C(=O)O 2079945270 FFQMGOLMWZDYHM-CYBMUJFWSA-N 428.270 4.070 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)C[C@@H]21 2137342843 FHHSXHYOHXYJCL-HPGNRBDVSA-N 429.330 4.075 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1cc(Br)ccc1I 2225801247 TYAVGHZLQXCXPK-WDEREUQCSA-N 435.063 4.015 10 10 IICE CC[C@@H](N[C@@]12CO[C@@H](C1)[C@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2281189063 IWCCMSNPVTUPKI-RNKNFESXSA-N 441.366 4.020 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@@H](O)c3occc3Br)cc2)CC1 2286067722 LXDMKWYRHLCVMM-QGZVFWFLSA-N 437.334 4.181 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2380718999 BNBXDLZJMRZVMS-CQSZACIVSA-N 443.382 4.409 10 10 IICE Cc1ccc(CN(C)C(=O)CN(CC2CC2)C(=O)OC(C)(C)C)c(O)c1Br 2380793477 RRIXDDULXJRLCN-UHFFFAOYSA-N 441.366 4.069 10 10 IICE C[C@H](SCC(=O)Nc1ccnn1Cc1ccc(N(C)C)cc1)c1nc2ccccc2[nH]1 98080429 DWCWLYOOMLQDNK-INIZCTEOSA-N 434.569 4.307 10 10 IICE CC1=NN(c2ccc(Br)cc2C)C(=O)/C1=C\NC(=O)Nc1ccc(F)cc1 101350126 LZRZKTCFMSVOKI-YBEGLDIGSA-N 431.265 4.325 10 10 IICE CC1=NN(CCOC(=O)Nc2ccccc2)C(=O)[C@H]1N=Nc1ccc([N+](=O)[O-])cc1Cl 256003027 TVLFDYXFHZZILW-KRWDZBQOSA-N 444.835 4.167 10 10 IICE C[C@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1cccnc1 742754943 SETJLVSRAOBJON-DYESRHJHSA-N 426.561 4.023 10 10 IICE COCCc1cc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n(C)n1 769320068 XISDAQDAWLOBEY-UHFFFAOYSA-N 431.334 4.031 10 10 IICE COc1ccc(Nc2ccccc2C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 781270381 JNSDJWMJNIIBGP-UHFFFAOYSA-N 444.535 4.360 10 10 IICE CNC(=O)C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)c1ccccc1 800717783 RNHUSYMETNFQJQ-UTKZUKDTSA-N 442.991 4.253 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2ccoc2)n1Cc1cccs1 802698845 XRIHLWJSCOQVTJ-UHFFFAOYSA-N 435.553 4.121 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccc(C(=O)NCc3cc(Br)ccc3O)cc2C1 804740185 BASCZHYUWHHSDZ-UHFFFAOYSA-N 447.329 4.335 10 10 IICE Cc1cc(Oc2ncccn2)ccc1NC(=O)NCc1cc(Br)ccc1O 806233088 KJQRBVICHYSMSH-UHFFFAOYSA-N 429.274 4.367 10 10 IICE CSc1nc2ncn(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)c(=O)c2s1 917247785 QAFHPIUCXPOQPD-UHFFFAOYSA-N 428.514 4.004 10 10 IICE O=C(/C=C\Sc1cc(F)ccc1F)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127181933 QEHCUHVMNXLROA-ZROIWOOFSA-N 443.563 4.419 10 10 IICE Cc1cc(=O)c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nn1-c1ccccc1F 1131781526 BTBFXCVTRNIXMQ-UHFFFAOYSA-N 444.510 4.060 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CN(Cc3ccccc3)C[C@@]23CCOC3)cc1 1135946257 LOVWJVYBRWZBLD-AHKZPQOWSA-N 435.612 4.030 10 10 IICE CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(N=NC(N)=O)cc3)n2)c(F)c1 1137529269 FSPFCXNUKYWVLN-UHFFFAOYSA-N 426.433 4.322 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1ccccc1OC1CCCC1 1137817729 GTKLLIPEKLRLCU-UHFFFAOYSA-N 431.916 4.111 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3coc(Sc4ncccn4)n3)cc2Cl)C1 1155727232 QMKORTZEJVFSPR-AWEZNQCLSA-N 443.960 4.436 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1Cl 1167881685 OSDQQKUFCOEPKQ-UHFFFAOYSA-N 434.879 4.199 10 10 IICE COC(=O)CCn1nc(C)c(NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1C 1169031511 YWFYTAPOESCPNL-UHFFFAOYSA-N 428.920 4.376 10 10 IICE Cc1cc(CCNC(=O)NCCNc2ccc(C(F)(F)F)cn2)c(C)n1-c1ccccc1 1253807389 ARROEOZKAFKUSI-UHFFFAOYSA-N 445.489 4.462 10 10 IICE CCc1c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)nnn1-c1ccc(OC(C)C)cc1 1264286915 CTPLIDQTUOTDOE-UHFFFAOYSA-N 447.583 4.489 10 10 IICE CC[C@@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccccc1OCC(=O)N(C)C 1264673784 MJYKMLJLAMGRPX-HSZRJFAPSA-N 433.552 4.442 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccccc3OCCOc3ccccc3)C2)cc1 1278861073 GGEUNWDEZHEEDG-HXUWFJFHSA-N 432.520 4.162 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCO[C@@H]2C(C)C)cs1 1290392773 QQTKQVFHWJYDBT-PGRDOPGGSA-N 441.601 4.037 10 10 IICE Cc1ccc([C@@H](NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)[C@@H](C)S(C)(=O)=O)cc1 1297147337 CQVDHRPFWSPNKR-JPYJTQIMSA-N 442.556 4.446 10 10 IICE C[C@@H]1CCCC[C@H]1OCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1305005001 PNXQSZFJSFYCRB-AUSIDOKSSA-N 435.572 4.201 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1ccsc1 1305525563 IHSSFYCIGITSRK-MRXNPFEDSA-N 429.565 4.376 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@H]1CCCCN(C(=O)OC(C)(C)C)C1 1307538645 CGCPYZDRMSPSRF-MRXNPFEDSA-N 440.968 4.058 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1cc(Cl)cc(Cl)c1F 1313211479 FXZSWOUKEQMUNG-AWEZNQCLSA-N 439.362 4.445 10 10 IICE COc1ccc(/C=C(/C)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1F 1356037035 RUPUHPBCEZNKFE-JWULFMQYSA-N 430.495 4.307 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cc2ccc3c(c2)OC(F)(F)O3)cc1 1358432832 IAWVNXZOAWCBFK-UHFFFAOYSA-N 428.435 4.439 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@]1(N(C)C)CCSC1 1359680480 SHHGSSHBZWDNEE-XMMPIXPASA-N 442.677 4.075 10 10 IICE Cc1ccc2cc(Cl)cc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)c2n1 1436624022 LEWDLOAZJRBHHY-UHFFFAOYSA-N 431.870 4.241 10 10 IICE Cc1cc(CCNC(=O)[C@]2(C)CCCN2C(=O)c2ccccc2)c(C)n1-c1ccccc1 1438179466 NWYQYNFMPVQGAK-MHZLTWQESA-N 429.564 4.448 10 10 IICE CCCN(CC(=O)Nc1ccc(Cl)cc1)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 1458277389 QCTCDTSBXHLSIO-VZUCSPMQSA-N 431.876 4.290 10 10 IICE Cc1cc(CC(=O)N2CC(=O)Nc3ccc(Br)cc32)c(C)n1-c1ccccc1 1458452671 DREXEINTQHLTJP-UHFFFAOYSA-N 438.325 4.384 10 10 IICE COc1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)ccc1Cl 1465325712 XTYWEQYNYCLTEZ-IBGZPJMESA-N 447.963 4.410 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1C1CCCC1 1467841274 VNYDIFYUZOYKFF-FCHUYYIVSA-N 427.585 4.433 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC2(CCCC2=O)CC1 1470549817 DVJPABSBRRRYSD-JQIJEIRASA-N 448.635 4.091 10 10 IICE C[C@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)c2ccccc2N1Cc1ccccc1 1473394518 YWCADPLCURPGKG-NRFANRHFSA-N 428.580 4.284 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@H](c3ccc(F)cc3)CC2)N(C)C)cc1 1479533625 HSXZHRTUIFXOEA-NTKDMRAZSA-N 426.580 4.474 10 10 IICE Cc1csc(CN(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)c1 1511458379 FAVKRKAUPKYJBP-UHFFFAOYSA-N 439.629 4.467 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1C)OC 1518718367 DPKLQFCCURHNCJ-KPLVRAHFSA-N 437.588 4.249 10 10 IICE CCO[C@H]1C[C@@](NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1522685938 GXNLMAQVNGILEL-GBXCKJPGSA-N 446.975 4.153 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@H](C)C2 1525452643 DENUVMRZYMAFIU-HOTGVXAUSA-N 440.565 4.430 10 10 IICE O=C(CCCOc1ccc2c(c1)CCCC2)NCc1cc(F)c(N2CCOCC2)c(F)c1 1527864276 MDYRVBCMAHSLQZ-UHFFFAOYSA-N 444.522 4.156 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2 1533458426 UCEANSXWJYOKPJ-CUZNSMAMSA-N 440.512 4.206 10 10 IICE CC(C)Cc1coc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1538227993 YKJLTQRQLAUVOV-YBEGLDIGSA-N 433.530 4.242 10 10 IICE C[C@@H]1C[C@H](C(F)F)n2ncc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)c2N1 1540717965 AETJDGNYGFZRRP-FOIQADDNSA-N 443.498 4.395 10 10 IICE Cc1cccc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1C 1543316526 FOMZPOFCOGGFHL-OAHLLOKOSA-N 430.551 4.362 10 10 IICE Cc1ccc(O)c(CNC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c1 1557552363 CYSIMUIBYXNZJC-UHFFFAOYSA-N 426.542 4.466 10 10 IICE CCC[C@H]1CCCC[C@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 1564927236 PJVORPXGTLUWAP-OALUTQOASA-N 433.593 4.151 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1565701667 JXHMCVAGEWUHHZ-FQEVSTJZSA-N 433.499 4.221 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](CO)Cc2ccccc2Br)cc1 1567579610 ZEYCKZIFDVEYRD-SFHVURJKSA-N 441.369 4.438 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1587552583 VQZVSZYPUAOSPB-FXAWDEMLSA-N 431.577 4.006 10 10 IICE CCN(CC)S(=O)(=O)c1cccc(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1587886941 YFKRTDAKQHZQFY-UHFFFAOYSA-N 439.581 4.055 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1)C1CCCC1 1594973803 KWLZOOLAXIZOAE-APWZRJJASA-N 432.561 4.424 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3cscn3)n2Cc2ccc(N(C)C)cc2C)n1 1612188049 FFUXYPVHKJGMMS-UHFFFAOYSA-N 433.585 4.164 10 10 IICE Cc1cccc(-c2nnc(N(C)CCC3CCOCC3)n2Cc2ccc(N(C)C)cc2C)n1 1612190734 VRPQESIBRHDXQP-UHFFFAOYSA-N 448.615 4.324 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3sc4ccccc4c3C)CC2)cc1 1617031192 QUWDVAIYURPSEZ-CTNGQTDRSA-N 439.625 4.052 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 1618643064 JIMLURCBGJAESA-ZCNNSNEGSA-N 435.490 4.174 10 10 IICE CSCCCn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1620289664 GSPJUJXRHWCUAF-UHFFFAOYSA-N 436.379 4.131 10 10 IICE O=C(Cc1cc(C(F)(F)F)ccn1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1620740507 YBBWMZWLSIEPDR-AWEZNQCLSA-N 429.389 4.030 10 10 IICE O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1623543481 OBPMYCASIOIHOL-HRCADAONSA-N 434.583 4.343 10 10 IICE O=C(CCOc1ccc(Cl)cc1Cl)NCc1cc(F)c(N2CCOCC2)c(F)c1 1626055908 MAZKNUSLWILOGJ-UHFFFAOYSA-N 445.293 4.194 10 10 IICE Cc1cc(C(=O)N2CCN(CCC(C)(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1626401927 FQXBMTVEMFHXGE-UHFFFAOYSA-N 447.421 4.446 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4cccc(F)c4F)CC3)c2C)cc1 1626700029 NATDDUDPUIZLOV-UHFFFAOYSA-N 425.479 4.343 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(-c3ccc(OC)cc3OC)[nH]n2)cc1F 1627604631 MDAURBMRFPSGQB-UHFFFAOYSA-N 426.492 4.009 10 10 IICE COC(=O)c1nc(CNC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)ccc1Cl 1628925556 IHYBURKCQYEEKS-UHFFFAOYSA-N 425.916 4.476 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3nc4ccccc4[nH]3)cc2Cl)C1 1634719859 IHXCHKHBOCMBDG-MRXNPFEDSA-N 425.964 4.495 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H]1C[C@]1(C)c1cccc(Br)c1 1638529337 MDOUNEARQBISGH-XMSQKQJNSA-N 446.341 4.024 10 10 IICE Cc1ccc(CN(CC(=O)Nc2ccccc2[N+](=O)[O-])c2ccc3c(c2)OCCO3)s1 1642089936 ZYXXNKDAKBKSTE-UHFFFAOYSA-N 439.493 4.381 10 10 IICE CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccc(F)c(Cl)c1 1654142473 LGRKBBLVRFYINO-UHFFFAOYSA-N 436.870 4.325 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC(Cc3nc4c(s3)CCC4)CC2)c([N+](=O)[O-])c1 1655917090 AGQOKDNVNURUOG-VURMDHGXSA-N 427.526 4.185 10 10 IICE CCc1nc(N)nc(SCC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 1656431450 KLKBIQKQCFRTIN-UHFFFAOYSA-N 446.374 4.161 10 10 IICE C[C@H](NC(=O)NCc1ccn(-c2ccc(Br)cc2)n1)c1ccc(N(C)C)cc1 1681552567 PDNGQJBLWCVFAH-HNNXBMFYSA-N 442.361 4.261 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3CCCCc3nc(C)cs3)CC2)cc1 1697470074 AJDHRCKYMMBYEG-UHFFFAOYSA-N 440.617 4.100 10 10 IICE CCC(CC)[C@@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)N1CCOCC1 1708692303 AHJOJAIWLSAVNN-JOCHJYFZSA-N 441.620 4.025 10 10 IICE CC(C)Cc1nnc(N(C)CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1723267782 WYYASANOBTWCHN-UHFFFAOYSA-N 427.637 4.216 10 10 IICE C[C@@H]1CCCN([C@H](C)Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1762883765 HIYLLKSRSTVHTJ-RTBURBONSA-N 439.629 4.393 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N(C)C)c(F)c2)C12CCC2 1767670334 MUNRDGNLBOGGNH-SFTDATJTSA-N 429.584 4.439 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3cc(OC)c(OC)c(OC)c3)SC2=S)cc1OC 1860085523 PPFSBMRRJCDUFH-VCHYOVAHSA-N 447.534 4.135 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)[C@@H](C)C(=O)NC2CCCC2)sc2c1CC[C@@H](C)C2 1866236148 DFOXYRBDPSRGDV-RBSFLKMASA-N 434.602 4.319 10 10 IICE CCc1c(C2CC2)nn(Cc2cccc(Br)c2O)c1I 2079826822 ZWOIHJIOTKIWFV-UHFFFAOYSA-N 447.114 4.444 10 10 IICE Cc1cc(O)c([C@@H](n2nc(C)c(CN)c2I)C(C)(C)C)cc1C 2079939723 RITUQODQDKVKKG-MRXNPFEDSA-N 427.330 4.213 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NCc2c(O)cccc2Br)C1 2092936941 OQRNBOIVJVUPIL-YSVLISHTSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@@H]2NCc2ccc(Br)cc2O)CC1 2132777536 NXSJJNQCRZCSMC-KRWDZBQOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@H](O)c3occc3Br)cc2)CC1 2286067720 LXDMKWYRHLCVMM-KRWDZBQOSA-N 437.334 4.181 10 10 IICE CCN1C(=O)C(=Cc2c(Sc3ccccc3)nc3c(C)cccn3c2=O)SC1=S 2296707892 WHNBAOXMTYKNSA-UHFFFAOYSA-N 439.587 4.375 10 10 IICE CCCCCCOc1ccccc1C=C1SC(=S)N([C@@H]2CCS(=O)(=O)C2)C1=O 2296712143 BDABQPPRZAPDNE-MRXNPFEDSA-N 439.624 4.034 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccc(OC)cc3)C2=O)cc1)C(=O)O 2314929088 GXVSWMHTTXDFSB-KRWDZBQOSA-N 429.519 4.343 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c(O)c1Br 2380782701 SSYUSPHPSACGED-INIZCTEOSA-N 441.366 4.067 10 10 IICE N=C1/C(=C\c2ccc(-c3cccc(C(=O)O)c3)o2)C(=O)N=C2SC(c3ccccc3)=NN12 33419648 ZERBJZQVEPIGAX-HGPWHKJCSA-N 442.456 4.312 10 10 IICE Cc1nc(-c2cccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)c2)n[nH]1 435557832 CCOUFVXECKVZSB-UHFFFAOYSA-N 428.540 4.140 10 10 IICE COc1cccc(F)c1[C@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 743554469 FTZUUDYEPZLZGT-XHSDSOJGSA-N 433.499 4.147 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3COc4c3ccc(Cl)c4Cl)CC2)cc1 743681711 FBZVKCPZRKRPGI-GOSISDBHSA-N 436.339 4.357 10 10 IICE C[C@@]1(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCN1C(=O)c1ccccc1 754546890 QQBWRAFDKXODKI-MHZLTWQESA-N 438.483 4.095 10 10 IICE CN(C)c1ccc(CN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C2CC2)cc1 914439896 PMPSPHLAZKMQBC-UHFFFAOYSA-N 427.548 4.341 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)Cc3ccc(C4CCCCC4)cc3)cc2)CC1 1133847416 NMQPJXNNENYXJA-UHFFFAOYSA-N 433.596 4.295 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)c(O)c3)cc2F)C[C@H](C)O1 1141901356 GFCHRAYBIILTCX-STQMWFEESA-N 426.410 4.094 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 1162539627 JDMAMPJSZFTCCS-UHFFFAOYSA-N 442.899 4.225 10 10 IICE COc1cc(N2CCC[C@H]([C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1186469722 FQZBGMXQJFSTOU-HOTGVXAUSA-N 435.521 4.085 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@H]3COc3ccc(Cl)cc3)C2)cc1 1230859244 UVFKPFJBZISXOG-ICSRJNTNSA-N 429.948 4.180 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cnn1-c1cccc(C)c1 1301350626 RTACQOCKMARZOL-UHFFFAOYSA-N 432.568 4.024 10 10 IICE O=C(CN1CCN(C(=O)c2ccccc2O)CC1)Nc1ccc(N=Nc2ccccc2)cc1 1307545704 BCOVGYITXZPJLN-UHFFFAOYSA-N 443.507 4.204 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CC[C@H](C)C2 1348721127 WVTNNZHFJCQRBP-DOTOQJQBSA-N 440.565 4.037 10 10 IICE CCc1cc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1Cl 1350934145 ZFLZODWIMUSRIU-HOTGVXAUSA-N 434.939 4.350 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCN2C(=O)Cc3ccccc32)cc1 1357799012 RELKTKMKWXKLDE-UHFFFAOYSA-N 427.508 4.487 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(OC(F)F)c(Br)c3)C2)cc1 1437575650 IDWBEIJEYVFIRP-CYBMUJFWSA-N 441.272 4.068 10 10 IICE Cc1cc(C(=O)Nc2cnn(-c3ccccc3)n2)c(C)n1-c1ccc(Br)cn1 1466112887 CUFRQJCCFDXMFJ-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2[nH]c3c(c2c1)C[C@H](C)CC3 1466397898 BUZDDLYNNSPTPN-CQSZACIVSA-N 440.927 4.467 10 10 IICE COC(=O)[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)c(C)c1 1466689365 KDKUXXQJCOPJOP-HSZRJFAPSA-N 436.483 4.307 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CC[C@H](F)C1 1495755650 WLZZBXLNNBPUAZ-KSZLIROESA-N 433.547 4.404 10 10 IICE CCCN(CCC)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1514743765 CWYGMWUPHXXBIP-UHFFFAOYSA-N 448.615 4.224 10 10 IICE Cc1cc(N2CCC[C@@H](NC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)n(C)n1 1530830476 PJJNIPGKWRKFTD-OAQYLSRUSA-N 439.991 4.117 10 10 IICE CCc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nnn1Cc1ccccc1 1534549686 OQZFJYABJLFSLN-UHFFFAOYSA-N 427.552 4.269 10 10 IICE CC1=C(C)CN(c2nnc(Cc3csc(C)n3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1542044530 DGOOCBYGAYBEAF-UHFFFAOYSA-N 440.592 4.434 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)CC2)cc1 1545556713 VRNMEFGVLSVSGF-UHFFFAOYSA-N 428.247 4.012 10 10 IICE CCO[C@]1(c2nnc(N3CC[C@@H](CC)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1547892599 KUVAMMCBYRIVDN-CJFMBICVSA-N 441.620 4.061 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1548052904 CETALLPIBPNTDF-PKTZIBPZSA-N 441.620 4.420 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl 1557387883 ZIWYBDWTMRQXNE-UHFFFAOYSA-N 431.201 4.229 10 10 IICE Cc1[nH]c2ccccc2c1SCCNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1565452915 NXYJGOWQPQEFMQ-JOCHJYFZSA-N 439.629 4.237 10 10 IICE Cc1cc(C(=O)NCC2([C@@H](C)CCO)CCC2)c(C)n1-c1ccc(Br)cn1 1566884340 JRYDAWBQLYOKHX-AWEZNQCLSA-N 434.378 4.170 10 10 IICE Cc1cc(C(=O)NC[C@@]2(O)CCc3ccccc32)c(C)n1-c1ccccc1Br 1597080299 HLEOTWJOKMOLHR-QHCPKHFHSA-N 439.353 4.420 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1C 1598229231 YYASJDBBCBYWLZ-XMMPIXPASA-N 429.564 4.366 10 10 IICE CCNc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1 1602723348 AMSCCUISMZWXFG-RVDMUPIBSA-N 432.596 4.195 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1)OC 1619593560 KODIVOLJPIWAIR-AVRDEDQJSA-N 437.588 4.250 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1620752772 BDUQAYIEOSVWJT-YJBOKZPZSA-N 434.458 4.421 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(OCCC(C)C)c(OC)c3)CC2)cc1F 1622563856 HOWAOQGBCHLFOJ-UHFFFAOYSA-N 430.520 4.230 10 10 IICE CN1CCCc2cc(CNC(=O)[C@]3(c4ccccc4)C[C@@H](NC(=O)OC(C)(C)C)C3)ccc21 1625851695 DWQPVFHNAZEKFQ-MGFGWZDJSA-N 449.595 4.310 10 10 IICE CCOC(=O)N1[C@H](C(=O)N(CC)Cc2ccc(N(C)C)cc2)CC[C@@H]1c1ccc(C)o1 1626885963 TUHTYWGDZRDDEB-RTWAWAEBSA-N 427.545 4.365 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(C)cc(Br)c1N 1629972602 VHZBXOVZGCZBOG-UHFFFAOYSA-N 442.151 4.470 10 10 IICE COc1cc(CNC(=O)c2sccc2-n2c(C)ccc2C)ccc1OCCN(C)C 1632707919 MFKURUDATGHCSX-UHFFFAOYSA-N 427.570 4.035 10 10 IICE CCCCN1C(=O)C[C@@H](C(=O)NCc2ccc(N(C)C)cc2C)[C@H]1c1ccc(OC)cc1 1633340147 CDHNYFGMFZREAS-ILBGXUMGSA-N 437.584 4.076 10 10 IICE Cc1ccc(C2=NO[C@@H](CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)cc1C 1633765614 RZPWNCWUZBASDN-JOCHJYFZSA-N 429.520 4.446 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccsc1Br 1635940781 JDJMIXXSTPCOSA-CYBMUJFWSA-N 429.767 4.264 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC2(c3cccc(OC(F)(F)F)c3)CCOCC2)cc1 1639772224 GSRWUASDSHDQEV-UHFFFAOYSA-N 436.390 4.183 10 10 IICE C[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)(C)c1ccccc1 1653136474 VMADWZJYRYBOAL-QGZVFWFLSA-N 426.516 4.356 10 10 IICE COc1ccc2cc(CN(C)C(=O)NCc3ccc(N4CCC(O)CC4)cc3)ccc2c1 1674713359 WKKIXAKLCOQVKR-UHFFFAOYSA-N 433.552 4.151 10 10 IICE COc1cccc(CNC(=O)N[C@H](Cc2cccc(Br)c2)CC2CC2)c1O 1681709011 XBWLBABYBHEWPD-SFHVURJKSA-N 433.346 4.374 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2cscn2)n1Cc1ccc(N2CCSCC2)cc1 1694004827 HWJKETJTLZWJHI-QGZVFWFLSA-N 442.658 4.486 10 10 IICE CCc1nnc(N(C)Cc2cc(C)cs2)n1Cc1ccc(N2CCSCC2)cc1 1709034214 ZDXUIFRIQGDTAD-UHFFFAOYSA-N 427.643 4.448 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCC[C@H](C(F)F)C1 1742139180 KXSRJWBWIJIXQZ-SFHVURJKSA-N 426.515 4.244 10 10 IICE COc1ccc(Cn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)cn1 1748829928 WXTOTBDHEIFXOR-UHFFFAOYSA-N 434.588 4.264 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1750326295 FXQXMQDRLDFTMS-FQEVSTJZSA-N 425.602 4.331 10 10 IICE CC[C@H](C)c1nnc(N2CCc3c(ccnc3O)C2)n1Cc1ccc(N(CC)CC)cc1 1752731065 YZEQCQATVDDUNR-SFHVURJKSA-N 434.588 4.349 10 10 IICE CC(C)Cc1nnc(N2CCCN(C(C)(C)C)CC2)n1CCCSc1nccs1 1761028751 NVOZINXTLLIIJC-UHFFFAOYSA-N 436.695 4.426 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCO[C@H](C)C2)cc1 1764937271 OLBHCBUEGNADOI-GOSISDBHSA-N 425.602 4.050 10 10 IICE CO[C@H](CCn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)C(F)(F)F 1768068590 RLQLSCCBZRWMMZ-GOSISDBHSA-N 426.483 4.320 10 10 IICE CCN(C[C@H](C)NC(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044743307 LXPHGDJPFDKOFT-INIZCTEOSA-N 448.608 4.302 10 10 IICE C[C@@H]1C[C@@](CN)(N(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)CN1Cc1ccccc1 2074363419 DLOOKSOZJSCXIK-IBVKSMDESA-N 438.616 4.139 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1CN 2079953975 FWMBVYQOYICLNB-QGZVFWFLSA-N 427.330 4.077 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NCc3c(O)cccc3Br)CCC[C@H]2C1 2092936939 OQRNBOIVJVUPIL-LXZKKBNFSA-N 425.367 4.280 10 10 IICE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2ccc(Br)cc2I)C1 2207276808 ZWPLFNRLWWLAQX-VIFPVBQESA-N 449.090 4.216 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccccc3)C2=O)ccc1OCC(=O)OC 2295196135 XEBDXICTABNSOF-UHFFFAOYSA-N 443.546 4.039 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)cc1 2314926140 BTJRHFFXLRHKSG-UHFFFAOYSA-N 443.502 4.278 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2cccc(O[C@H](C)C(=O)O)c2)SC1=S 2314931587 PDMRQJQRYXGRJQ-CYBMUJFWSA-N 429.519 4.343 10 10 IICE CC[C@H](CC(=O)N(C)Cc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2352659782 BUPJSXUVCWNREJ-CQSZACIVSA-N 429.355 4.115 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)Nc3ccc(C)cc3)c3ccco3)CC2)cc1 38637888 LIUPVFXBVYZCCA-HSZRJFAPSA-N 434.540 4.282 10 10 IICE COc1ccc(CNc2ccc(Br)c(I)c2)c(O)c1 311713872 KMOMHHBOLHUDLT-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC(C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1nc(C2CC2)no1 435732653 RDGLUKNPVAFOET-QHCPKHFHSA-N 435.572 4.182 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526175987 NKSJAECHIYVRDV-QFIPXVFZSA-N 437.423 4.311 10 10 IICE COc1ccccc1C[C@H]1CCCN1C(=O)NCc1ccc(N2CCSCC2)cc1 746724592 PYRGOSLFAHBJPW-JOCHJYFZSA-N 425.598 4.165 10 10 IICE COC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3Cl)cs2)cc1 747854103 UPBRLTIYWKONAB-DHZHZOJOSA-N 434.926 4.451 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2CCC(F)(F)CC2)NC(=O)OC(C)(C)C)cc1 759188193 YGTDMXWMJAQZSG-SFHVURJKSA-N 425.520 4.260 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3c3ncccn3)cc2)CC1 764099737 SSMFMSVYRXYZGS-XWGVYQGASA-N 433.600 4.167 10 10 IICE CCN1CCN(c2ccc(CN[C@H](C)c3ccc(-n4cncn4)cc3Cl)cc2F)CC1 765851419 GAGBATSTTXLBHP-QGZVFWFLSA-N 442.970 4.053 10 10 IICE FC(F)(F)COc1ccccc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768670941 TXAWQBGINUFNAF-UHFFFAOYSA-N 433.518 4.450 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCOc2c(Cl)cccc21)c1ccc(N2CCOCC2)cc1 775729249 SLRWEIDAPANYHA-KKSFZXQISA-N 429.948 4.451 10 10 IICE COc1ccc(CNC(=O)N[C@H](c2ccc(Cl)cc2)C2C[C@@H]3CC[C@H](C2)N3C)c(O)c1 801804489 MXLVNNUXMWEMPT-DBKAOBCCSA-N 443.975 4.468 10 10 IICE CC1(C)CC(=O)c2cc(NC(=O)NCc3ccc(N4CCSCC4)cc3)ccc2O1 806552566 WPVAEZGUKXVDBU-UHFFFAOYSA-N 425.554 4.305 10 10 IICE Cc1cc(Br)cc(CN[C@](C)(CO)c2ccc(Br)cc2)c1O 809695268 FKRZOBKZXWWOAL-QGZVFWFLSA-N 429.152 4.223 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)NCc1ccc(N3CCSCC3)cc1)O[C@@H](C)C2 918618114 XTHIOPUODROOPC-KKMIYCERSA-N 438.593 4.292 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4ccccc4n3CC(F)(F)F)C2)cc1 1130185835 SMLIHNRKRPFXMD-INIZCTEOSA-N 431.458 4.469 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1 1142419385 QARZABRPSULROS-GBXCKJPGSA-N 439.600 4.449 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)CC1CC1 1144992869 NRQLZOFHGRBYPO-MRXNPFEDSA-N 433.346 4.176 10 10 IICE COc1ccc(C)cc1NC(=O)[C@H]1CCCN1Cc1ccc(N2CCC(OC)CC2)cc1 1167778246 DCEARTMGQRJJEG-XMMPIXPASA-N 437.584 4.222 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H](C(=O)Nc4ccc(Cl)cn4)C3)cc2)CC1 1168052795 LBUPLZZQCIZXTI-IBGZPJMESA-N 442.991 4.201 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cc(F)c(C(F)(F)F)cc3F)C2)cc1 1248501550 OCEWCPYYARKEPN-ZDUSSCGKSA-N 443.416 4.318 10 10 IICE CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1253807787 IFMWZFVNPRFLCF-CVDCTZTESA-N 438.616 4.363 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N=[S@](C)(=O)c2cccc(F)c2)C1 1289035886 MQCVAOQURQUYJR-SSEXGKCCSA-N 427.545 4.230 10 10 IICE Cc1cccc(C)c1CN(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1289322978 KDVBATGYWSRBRU-UHFFFAOYSA-N 428.444 4.259 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCN(Cc2cccs2)CC1 1289419897 KZIKZZJQTKSFGA-UHFFFAOYSA-N 438.645 4.208 10 10 IICE O=C1CC(C(=O)NCc2cc(Cl)cc(Cl)c2O)(c2cccc(Br)c2)C1 1298841233 LEYTZNFEOSCMPT-UHFFFAOYSA-N 443.124 4.379 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCCC[C@H]1c1ncc(Br)cn1 1303806904 RZFLQORUSCTVEW-LBPRGKRZSA-N 434.315 4.232 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@H]3C)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1304197093 XQSAPQRUVGHWJM-AZUAARDMSA-N 448.615 4.456 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1306621718 ZPPZFHZTCYKEMW-GOSISDBHSA-N 427.524 4.105 10 10 IICE C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1312363172 CRDKCQNLRVCHKA-IERDGZPVSA-N 436.522 4.305 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](C)c3ccc(N4CCNC4=O)cc3)c2C)c1 1312906784 QXLDXSIMYQNLMT-LJQANCHMSA-N 445.567 4.493 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@H]3CCCN3C[C@H]2C)cc1 1313678041 BBRZGJRXTUIVFG-NFBKMPQASA-N 438.664 4.434 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1Cc1cccnc1OCC(F)F 1314753000 JRNDWWZSAGPIRR-UHFFFAOYSA-N 445.514 4.296 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(F)cc4)no3)cc2F)C[C@@H](C)O1 1350931752 CHIYINKTZSEVFC-HUUCEWRRSA-N 427.451 4.163 10 10 IICE Cc1cc(CC(=O)NCC(=O)N2CCCc3ccccc32)c(C)n1-c1ccc(Cl)cc1 1361093769 NZGDLVOYUQGPGS-UHFFFAOYSA-N 435.955 4.386 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CC2(NC(=O)OC(C)(C)C)CC2)cc1 1435078195 VDJUZZNKXBPNJY-UHFFFAOYSA-N 429.483 4.091 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@]3(C)CC(c4cccc(Cl)c4F)=NO3)C2)cc1 1452033484 UPVYCOKLYURBFD-CMJOXMDJSA-N 445.922 4.014 10 10 IICE CCOC(=O)CN(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(C)cc1 1459386938 XMKJBVATXDCUQY-UHFFFAOYSA-N 447.579 4.313 10 10 IICE C[C@@H]1CC[C@H](C(F)(F)F)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1459928840 DCSCQAPXWHVKDY-KGLIPLIRSA-N 430.426 4.063 10 10 IICE CCCOc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(OC(C)C)c1 1460739679 GNEQATWYNKLGSC-UHFFFAOYSA-N 448.510 4.307 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc2n1CCN(C(=O)OC(C)(C)C)[C@H]2C 1465028173 FMIGGHSQGPWLRR-KRWDZBQOSA-N 426.561 4.104 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1CC(c2ccccc2)C1 1467479966 BNEJOHZILCEKLU-UDWIEESQSA-N 440.565 4.479 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1470539488 NLSRNFGOZUYFKZ-HKUYNNGSSA-N 443.544 4.390 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@]1(C)OCCc2ccccc21 1471190937 XAIDPHCPDRBBET-NRFANRHFSA-N 433.346 4.174 10 10 IICE Cc1cc(C(=O)NCc2cc3cnccc3o2)c(C)n1-c1ccc(Br)cn1 1471383652 RQZGPFVXUVCOMT-UHFFFAOYSA-N 425.286 4.323 10 10 IICE C[C@H]1C[C@]2(CC[C@@H](CNC(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)O2)CO1 1478529202 XGSDAWMMONZNQX-GNVZTASGSA-N 435.996 4.102 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CCCNC(=O)OC(C)(C)C 1503489362 RDWLJQFMKZZKBY-UHFFFAOYSA-N 443.592 4.268 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)Cc2cc(C)on2)cc1 1515525464 JQLFFDJSDIPSSN-UHFFFAOYSA-N 433.560 4.111 10 10 IICE Cc1cc(CC(=O)Nc2ccc(NC(=O)[C@H](C)n3cncn3)cc2)c(C)n1-c1ccccc1 1525154464 GIWKNPKJOMJOCY-IBGZPJMESA-N 442.523 4.067 10 10 IICE COc1cccc(-c2cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)on2)c1 1527481315 JAMAOJQJKJKHHO-IYBDPMFKSA-N 439.487 4.033 10 10 IICE CCCCN1C(=O)C[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1c1ccc(OC)cc1 1540518304 JNPLLFNFUWERHM-ILBGXUMGSA-N 437.584 4.110 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3ccc(Br)cc3)CC2)c(OC)c1 1563631148 WCXBOBPTPXOOCX-OAHLLOKOSA-N 448.361 4.059 10 10 IICE C[C@@H]1O[C@H](C)[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)[C@@H]1C 1585834657 LYZANRHNSYIKSK-IPJQOSJUSA-N 429.318 4.157 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cnn(CCN(C)C)c2-c2ccccc2)cc1 1587459555 ASEOGCJDVPSZEM-UHFFFAOYSA-N 433.600 4.230 10 10 IICE CCCN(CC(N)=O)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 1595569868 ZTNJQXUFXUTXSQ-KNTRCKAVSA-N 442.563 4.125 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)COC[C@@H]1CCCO1 1610121320 CDYNOSJPWILAME-AZUAARDMSA-N 436.474 4.494 10 10 IICE Cc1ccc(NC(=O)c2nnc(N3CCCC3)n2CCCSc2nccs2)cc1C 1612106923 OGMTZJATYIVUPN-UHFFFAOYSA-N 442.614 4.386 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC(F)(C2CC2)CC1 1616431690 JOIGBKKLZUXGRT-LGMDPLHJSA-N 436.549 4.158 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1617528405 SHOAKQGAWBEFBU-UYAOXDASSA-N 431.650 4.173 10 10 IICE C[C@@H]1CC[C@H](CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)O1 1618369504 WAKGXLWTWBUWRY-UKRRQHHQSA-N 429.318 4.445 10 10 IICE CCOC(=O)COc1ccc(CCNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1620463982 AVICGBNWCZYHSW-UHFFFAOYSA-N 434.536 4.317 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C[C@H]1CCCO1)C(F)(F)F 1626510934 CVNDVUVSMCEUQE-QZTJIDSGSA-N 444.494 4.123 10 10 IICE Cc1nc(SC2CCCC2)sc1CC(=O)NCc1ccc(N2CCOCC2)cc1 1626693161 IHAALECJFYHZNF-UHFFFAOYSA-N 431.627 4.182 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630263255 VIIYWVCXAAQMKN-MGPUTAFESA-N 432.923 4.174 10 10 IICE COc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)s2)cc1 1630283776 WNGMBWJBUKBLDY-UHFFFAOYSA-N 437.565 4.018 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)C[C@H](C)NC(=O)OC(C)(C)C)cc1 1630950596 IZMVSXZQBHTJRE-IRXDYDNUSA-N 441.572 4.257 10 10 IICE C[C@H](CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)c1cccc(F)c1 1631425750 NJHQNTIWNLZDSJ-FOIQADDNSA-N 432.923 4.174 10 10 IICE C[C@H](NC(=O)N[C@@H]1C[C@H]2CC[C@@H]([C@@H]1C)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634434690 FIZLWBQCRCLZAV-FVESOWDASA-N 430.593 4.289 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC[C@@H](CNC(=O)OC(C)(C)C)C3)c2C)c1 1637577357 CGJILTHBUSYEAS-FQEVSTJZSA-N 440.588 4.459 10 10 IICE CCN(CC(=O)Nc1sc2c(c1C(=O)OC)CC[C@@H](C)C2)c1ccc(OC)c(OC)c1 1644917481 SANKRZPTAONNIG-CQSZACIVSA-N 446.569 4.142 10 10 IICE O=C(NCc1c(O)cccc1O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 1645360702 FVOPYOXMCYUGIR-UHFFFAOYSA-N 427.844 4.202 10 10 IICE Cc1cc(CC(=O)N2CCC(CO)(C(F)(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 1648169083 DVLOTIVJRQTVIM-UHFFFAOYSA-N 428.882 4.453 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccsc4)C3=O)c2C)cc1F 1652633226 ZMTMXBUSNOAQGD-QHCPKHFHSA-N 439.512 4.253 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCN(CC4CC4)C3)cc2Cl)C1 1672137466 SIOCSNTWZRCAHS-RXVVDRJESA-N 433.040 4.498 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](C)c1ccc(N2CCCOC2=O)cc1 1682890129 VCHMZDHLPZSYND-MOPGFXCFSA-N 438.572 4.399 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)Cc3nc(O)c4ccccc4n3)c2C)c1 1684599673 HMGWWHQSGBIDMW-UHFFFAOYSA-N 429.524 4.393 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(CCc3ccc(Cl)cc3)CC3CC3)cc2)CC1 1684875073 ZDJBZYKRXBTSJA-UHFFFAOYSA-N 441.019 4.256 10 10 IICE C[C@@H](NC(=O)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(N(C)C)cc1 1686173135 CCUITRPNQJHPIJ-QGZVFWFLSA-N 434.506 4.360 10 10 IICE CC[C@@]1(C)CC[C@@H](Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)O1 1694426694 IUHVOLJDTDLCHU-DHLKQENFSA-N 441.620 4.475 10 10 IICE COc1ncccc1Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1697636726 AWHCVEYKKRDFCC-UHFFFAOYSA-N 434.588 4.165 10 10 IICE Cc1cc(-c2nnc(N3CCCC3)n2CCNC(=O)C(C)(C)C)c(C)n1-c1ccccc1 1707274901 VOTJVBLNQOJATL-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCSC1 1726877433 MXBKTLDHZHZEPW-ICSRJNTNSA-N 429.634 4.018 10 10 IICE CC[C@]1(C)CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)cc2C)C1 1744256948 OTNPRTYWNJUATL-RUZDIDTESA-N 435.620 4.189 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1[C@H](C)CCN1C(=O)OC(C)(C)C 1750611051 JUUDFDOKXFWUGI-MJGOQNOKSA-N 443.592 4.389 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCCN(C)C(=O)OC(C)(C)C 1763506750 LGOADOIVDIQZPD-KRWDZBQOSA-N 431.581 4.391 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@H]2CCCCO2)n1CCC(C)(F)F 1767081413 ZOFKHBAFUPQGNZ-HXUWFJFHSA-N 449.546 4.038 10 10 IICE COC(=O)c1cccc(N2C(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c1 1860086843 KLDXVGSXBLAAKH-OVCLIPMQSA-N 434.882 4.441 10 10 IICE Cc1cc(I)ccc1NC(=O)CCNCc1cc(Cl)ccc1O 1860715319 TYCQJZUURIUMBO-UHFFFAOYSA-N 444.700 4.077 10 10 IICE Nc1ccc(Oc2ccc(NC(=O)c3nn(-c4ccc(Cl)cc4)c(=O)cc3O)cc2)cc1 1866269399 KOFIUMJFICNALT-UHFFFAOYSA-N 448.866 4.218 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(CNCc2cc(Br)cc(F)c2O)CC12CCC2 1966053863 WMPCFKLEZLZFHC-FQEVSTJZSA-N 443.357 4.469 10 10 IICE COc1ccc(C=C2C(=N)N3N=C(SCc4ccccc4)SC3=NC2=O)c(OC)c1 2293465060 QQXNXVGOLNBUDR-UHFFFAOYSA-N 438.534 4.214 10 10 IICE CCCOc1cc(N(CC)CC)ccc1C=C1C(=O)NN(c2ccc(Cl)cc2)C1=O 2295157499 PNWVLGMADZQHID-UHFFFAOYSA-N 427.932 4.436 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(c2ccc(OC)cc2)C1=O)C(=O)O 2314933455 WBUNRQNKUFDRJU-MRXNPFEDSA-N 429.519 4.343 10 10 IICE CC[C@H](NC[C@H]1[C@@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2333093374 YZEGDZOJHWIRRX-ISWURRPUSA-N 425.367 4.451 10 10 IICE Cc1ccc(CNC(=O)CC[C@H](C)CNC(=O)OC(C)(C)C)c(O)c1Br 2352943401 SRGUCDLGVJCTBT-LBPRGKRZSA-N 429.355 4.020 10 10 IICE CSC1=NSC2=NC(=O)/C(=C\c3ccc(OCc4ccccc4F)cc3)C(=N)N12 20114582 TZYMUYHRLVNMIO-QNPDVEALSA-N 426.498 4.344 10 10 IICE Cc1cc(C)c(NC(=O)CNC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)c(C)c1 29008381 FAOAATRVEUYUQB-UHFFFAOYSA-N 447.535 4.159 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)ccc1OCC(=O)OC 33441527 XEBDXICTABNSOF-UNOMPAQXSA-N 443.546 4.039 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@@H](C(=O)Nc4cccc(OC)c4)[C@H]3C2)cc1 245279494 GGUIXYXQANMOBO-AOYPEHQESA-N 443.547 4.210 10 10 IICE CCCNC(=O)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435547688 IROIDTXGOLCMBP-UHFFFAOYSA-N 432.568 4.186 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@H]3CCCN(C)[C@H]3c3cccs3)CC2)cc1 745847378 JKHNVGGGOBTOOI-AUSIDOKSSA-N 442.629 4.062 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(F)cc1F 769281412 ALABGPVIJLEERJ-RVHYNSKXSA-N 428.479 4.102 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)n1 771269721 PZOUDLYLGUACER-AWEZNQCLSA-N 429.571 4.294 10 10 IICE COc1ccc(N2CCCN(C(=O)C3(c4ccccc4Br)CC3)CC2)cc1 788777137 KAOKZKHOUQSYPC-UHFFFAOYSA-N 429.358 4.228 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cn(-c4ccc(C)cc4)nc3C(C)(C)C)C2)cc1 1130826961 OPSTYEDRJJJJBX-IBGZPJMESA-N 432.568 4.496 10 10 IICE O=C(Cc1ccc(OCc2ccccc2)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 1136960632 BJXBJIZPJYCYOS-UHFFFAOYSA-N 444.575 4.333 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)COc1ccc(Cl)c2ccccc12 1137816480 IEBRPCKXXKNDGU-UHFFFAOYSA-N 448.302 4.433 10 10 IICE CCCn1ccc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1 1138192669 YUZBTBPEDYCWML-ATVHPVEESA-N 433.624 4.257 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1147888877 XMSUBEGCBCMBRS-QGZVFWFLSA-N 437.540 4.407 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)/C=C\c1ccc(I)o1 1155704393 JYEZLMFUPKTYLK-LUAWRHEFSA-N 425.266 4.432 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)NCCc1nc2ccccc2s1 1167755104 AWARNLREGGOVSV-UHFFFAOYSA-N 435.471 4.306 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3ccc(Br)cc3F)C2)cc1 1229413016 ITRURXDFXPKQSL-DZGCQCFKSA-N 436.325 4.236 10 10 IICE COc1cc(Br)ccc1CCCNC(=O)N(C)Cc1ccc(N(C)C)cc1 1230779339 PXKJJKZGLWXKBN-UHFFFAOYSA-N 434.378 4.298 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(F)(F)c3ccc(Br)cc3)C2)cc1 1276832017 LHRHOHGMBSYNHT-CQSZACIVSA-N 439.300 4.192 10 10 IICE CC(C)Cc1nnc(Nc2cnn(CC3CCC3)c2)n1Cc1ccc(N(C)C)c(F)c1 1287506979 WXHQKXMSIKDZDX-UHFFFAOYSA-N 425.556 4.470 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc4cccc(Cl)c4s3)CC2)cc1 1292281375 DIFSMHOWEDOCPY-UHFFFAOYSA-N 429.973 4.115 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1294860181 RUCJXRUSQWSZKV-KRWDZBQOSA-N 449.910 4.148 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(Nc3cccnn3)CC2)n1Cc1ccc(N(C)C)cc1C 1305452850 AQDVLCCXQBUZDH-GOSISDBHSA-N 448.619 4.085 10 10 IICE C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)c1ccc(N(C)C)cc1 1306829456 FSLCGHDQVMOYHJ-NLFFAJNJSA-N 445.563 4.468 10 10 IICE CCOCc1nnc(N(C)C[C@@H]2CCCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1314313391 YBSFJBYKRJWOCG-QHCPKHFHSA-N 441.620 4.105 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(OC(F)(F)F)c(Cl)c3)c2)CC1 1354023904 RIPCTZPGMZPNAN-UHFFFAOYSA-N 441.837 4.193 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(OC)c(OC(F)F)c2)CCCC1 1355949465 DHWABHLMGHDDDI-UHFFFAOYSA-N 444.478 4.455 10 10 IICE CC(C)(C)OC(=O)CCC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1439876193 VZIXPLSLNINOQM-UHFFFAOYSA-N 445.317 4.219 10 10 IICE Cc1cc(C(=O)Nc2cccc(-n3cnnn3)c2)c(C)n1-c1ccccc1Br 1440709138 ZZJJZCUOWWIRMW-UHFFFAOYSA-N 437.301 4.085 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@H]2CCCCN2C(=O)C(F)(F)F)c1 1452189945 MKEAGPPYGOJELP-MRXNPFEDSA-N 441.881 4.421 10 10 IICE CCOC(=O)c1c(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)n[nH]c1C 1458912805 RCCLISGXMXODME-KRWDZBQOSA-N 426.542 4.230 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3=NN(c4ccccc4)C(=O)CC3)cc2Cl)C1 1459586046 QJPRVGAAJZJYDY-QGZVFWFLSA-N 438.959 4.376 10 10 IICE O=C(CN1CCCCC[C@@H]1C(F)(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1460773123 NPUVHLDWFNKFKX-LJQANCHMSA-N 430.426 4.207 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@@H]1Oc1ccccc1 1467367747 QHYITCAJVDWATM-SLQPCKNISA-N 446.547 4.190 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCN3CC(F)(F)F)cc2Cl)C1 1469959674 LXCOPJSMGGWZLK-WBVHZDCISA-N 446.945 4.402 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3c(C)nn(Cc4ccc(Cl)cc4)c3C)C2)cc1 1470020206 NEPOZIQYPNEQJJ-FQEVSTJZSA-N 438.959 4.219 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC3(CCOCC3)CO2)c(C)n1-c1ccc(Br)cc1 1471227261 OFSUXQODXYXCOU-LJQANCHMSA-N 447.373 4.172 10 10 IICE CC/C=C\Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@@]1(OCC)CCOC1 1514217006 FWQXCNSZMFTUTR-CVUHLLMESA-N 439.604 4.133 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(Cc4ccccc4)C(=O)C3(C)C)ccc21 1523679555 UUCLCCYBZFDKKL-UHFFFAOYSA-N 447.579 4.168 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COCC[C@@H]1c1ccccc1 1524070142 SEPORMMORVTWKD-STZQEDGTSA-N 430.495 4.193 10 10 IICE C[C@@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)[C@H]1CCCO1 1538920460 TWFAVMJSGSCPST-XJKSGUPXSA-N 429.318 4.303 10 10 IICE C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C 1544410404 HZRNANUHOYARKI-QZTJIDSGSA-N 429.584 4.125 10 10 IICE CCCCn1c(-c2ccc(Cl)nc2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1547023368 OXWGBLILCJTHRE-UHFFFAOYSA-N 444.942 4.268 10 10 IICE COC1(C)CN(c2nnc(-c3cccc(Cl)c3)n2CCCSc2nccs2)C1 1554699776 HGTLLBSABGVKTI-UHFFFAOYSA-N 436.006 4.463 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@H](C)C1 1555540538 OJRVEXWMIFROEW-MBSDFSHPSA-N 425.621 4.295 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](CCNC(=O)OC(C)(C)C)C2)c1 1558640524 UYMKTINCRJOIRQ-LJQANCHMSA-N 439.556 4.284 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@@H]3c3cccc(C)c3)CC2)cc1 1559553539 FYDMLIKHDINBKG-AHKZPQOWSA-N 437.628 4.104 10 10 IICE CCN(C)c1ccc(CN(CCC(C)C)c2c(O)nc(=O)n(Cc3ccccc3)c2N)cc1 1559639260 FWKUWUAYUBULHE-UHFFFAOYSA-N 449.599 4.088 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(C)n(-c4nc(C)cc(C)n4)n3)c2C)c1 1587880745 HKTMCNHZWKXVCB-UHFFFAOYSA-N 428.540 4.234 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(F)c(F)c4)C3)c2C)c1 1587880885 LWSFHUWAEIAYRE-LJQANCHMSA-N 437.490 4.350 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C[C@H](C)O1 1614232975 FOIXPUAQTSKGKD-DLBZAZTESA-N 444.630 4.291 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H]3C(=O)Nc4ccc(F)cc43)cc2Cl)C1 1617901182 PZNUBVGIXIDCTE-RDTXWAMCSA-N 429.923 4.458 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C=C(\C)c3cccc(C(F)(F)F)c3)CC2)cc1 1625951933 QBDLFHCAVMOBCA-FBMGVBCBSA-N 447.501 4.056 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1C 1627157258 OAGWBWFZSVNMOT-VWLOTQADSA-N 435.543 4.345 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cncc(Cl)c1 1627271857 JYPMPISYKFWBOM-UHFFFAOYSA-N 428.677 4.460 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H]3CCCCN3C(=O)C(F)(F)F)c2C)c1 1627381110 HCFPQHLNJPGOLO-GOSISDBHSA-N 435.490 4.384 10 10 IICE C[C@@H](CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCc2ccccc21 1629055438 JHOJDPXBBVTBAB-PKOBYXMFSA-N 429.511 4.214 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](C(=O)OC)C3CCCCCC3)ccc21 1646216396 VUDLZZKHESLPKO-JOCHJYFZSA-N 428.573 4.394 10 10 IICE CC(C)c1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)ccc1O 1650918184 OLHRZYVCPZPABA-UHFFFAOYSA-N 432.523 4.336 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3CCCCC[C@H]3c3ccc(Cl)cc3)nc12 1653588177 HIBPNBXHDPYUOI-ICSRJNTNSA-N 442.947 4.471 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3nc(-c4ccc(Cl)cc4)no3)C2)cc1 1682645336 CXXTWSZVKLBJFF-RHSMWYFYSA-N 441.919 4.038 10 10 IICE C[C@@H](c1nc2ccccc2s1)N(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684607353 PXBGSODQYGOISO-JXFKEZNVSA-N 425.602 4.368 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)cc1 1687652678 PUNYRSORMWFFIC-UYAOXDASSA-N 432.609 4.177 10 10 IICE CC[C@H](Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)N1CCCC1 1708768335 GLWRVCUIJOABED-OAQYLSRUSA-N 440.636 4.001 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2C[C@H](C)C(F)(F)[C@H](C)C2)cc1 1710026442 ICONVYOZBVYMIN-NSHGMRRFSA-N 447.574 4.404 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@@](C)=O)CCC1 1728273592 ZZCSDQDDAKZQGI-SSEXGKCCSA-N 425.602 4.110 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H](c3nccs3)C2)n1Cc1ccc(N(C)C)cc1C 1763810971 WPCDWRPJZWLPAH-OXJNMPFZSA-N 440.617 4.249 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@](=O)CC)C1CC1 1766433208 QAAGGADTDIEBAL-SSEXGKCCSA-N 425.602 4.110 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](SC)C(C)(C)C)CCOC1 1767394843 XBKWPSKKVAEBKX-XXBNENTESA-N 448.633 4.050 10 10 IICE Cc1cc(=O)c(OCc2ccc(Br)cc2)cn1CCOc1ccc(N)cc1 1857916903 RVNXICWOHOGRSO-UHFFFAOYSA-N 429.314 4.159 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccc(C(=O)O)cc2)cc1 1865675367 DPFIEFJAYOCUCR-PXLXIMEGSA-N 428.444 4.237 10 10 IICE O=C(N[C@@H](CCc1cccc(O)c1O)C(=O)O)OCC1c2ccccc2-c2ccccc21 1951401119 CIAMLDJAHYZELY-NRFANRHFSA-N 433.460 4.022 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)c1ccc(N2CCCC2)cc1 2044730826 RKDMDGBOSPOCLR-DNQXCXABSA-N 439.600 4.346 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](NCc2cccc(Br)c2O)(C(F)(F)F)C1 2103576907 DNXHUCRHYPZGPB-MRXNPFEDSA-N 439.272 4.186 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@H](NCc1c(O)cccc1Cl)CO2 2160179991 GBRMFXPEPBJQND-SFHVURJKSA-N 430.932 4.096 10 10 IICE COc1ccc(Br)c(CN[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)c1O 2236048496 DEYDKDQOOWNIGV-ZDUSSCGKSA-N 443.382 4.289 10 10 IICE CN(C)c1ccc(C=C(NC(=O)c2ccccc2)C(=O)NCc2ccccc2Cl)cc1 2297550435 SWHCTEKROVNPMI-UHFFFAOYSA-N 433.939 4.493 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3cccc(C)c3)C2=O)ccc1O 2314836296 CKXWPJZVKJWAGF-AWEZNQCLSA-N 442.562 4.328 10 10 IICE COc1cccc(OCCn2cc(/C=C3/C(=N)N4OC(C)=CC4=NC3=O)c3ccccc32)c1 20236026 UFADHPBXNGWCRY-AFKZWVQSSA-N 442.475 4.179 10 10 IICE Cc1sc(-c2cc(C(F)(F)F)on2)cc1S(=O)(=O)NCc1ccc(N(C)C)cc1 33299302 POHIKHLTUOXPKV-UHFFFAOYSA-N 445.488 4.275 10 10 IICE CCCOc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 71963989 RPBPVNYEUNMTOY-UHFFFAOYSA-N 426.582 4.308 10 10 IICE COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C/c1ccc(OC)c(OC)c1OC 96736617 AKMNOLURYMQWPH-WBFOAEISSA-N 437.492 4.146 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCC(=O)Nc3ccc(C)cc3)C2=O)ccc1O 210692384 ZRCQIGWXCLDWPN-CPNJWEJPSA-N 442.562 4.329 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)N2CCCc3cc(OCc4ccccc4)ccc32)c1 734342860 QNDKSKWTRCNFIG-XFXZXTDPSA-N 427.504 4.013 10 10 IICE CCN(CC)C(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 799995530 NCKUEMSZBUSTHZ-GOSISDBHSA-N 449.039 4.366 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(N2CCCCC2)cc1 857473273 VVPNSDUCXXVUCE-OAQYLSRUSA-N 427.976 4.430 10 10 IICE O=C(CSC(F)(F)F)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1134541960 BGRUVEHZWWSWHG-UHFFFAOYSA-N 431.237 4.350 10 10 IICE CCNC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1135645507 DRIHGSBIOHSDQE-UHFFFAOYSA-N 441.329 4.254 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccccc2C(=O)N2CCCC2)cc1 1136148461 XALOTIQQAABXSN-UHFFFAOYSA-N 429.520 4.324 10 10 IICE Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NCc3ccc4c(c3)CCCN4C)c2)c1 1142465722 NWQAWHJELRHLPW-UHFFFAOYSA-N 449.576 4.108 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H](CCNC(=O)OC(C)(C)C)C3)c2C)cc1 1157845378 VPFJBZOFJMHFJL-LJQANCHMSA-N 441.572 4.480 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC(C)(C)[C@H]2C)sc(C)c1-c1ccccc1 1191539162 DRFDDMQQBGSLQQ-MRXNPFEDSA-N 430.570 4.338 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1CCCc2ccc(Cl)cc21 1229782141 SQMKQWXHJGDPQX-HXUWFJFHSA-N 435.902 4.332 10 10 IICE O=C(NCc1c(O)cccc1F)NCC1(c2ccc(Br)cc2Cl)CC1 1251370693 DCWBROPKDVABIF-UHFFFAOYSA-N 427.701 4.478 10 10 IICE CCn1c([C@H]2CCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)nc2ccccc21 1256231658 AJCIXVMDDAGZTP-DNQXCXABSA-N 448.615 4.272 10 10 IICE Cc1occc1C(=O)Nc1nc(CC(=O)N(C)Cc2ccc(N3CCCC3)cc2)cs1 1264287179 MKIUAMPZVIBACV-UHFFFAOYSA-N 438.553 4.098 10 10 IICE CC(C)c1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCSCC2)cc1 1287182316 DSSACLDEHOCVTP-UHFFFAOYSA-N 427.540 4.392 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N(C)C[C@@H](C)c1nccs1 1289424474 VWGWJKGAKNDZLG-QGZVFWFLSA-N 435.601 4.392 10 10 IICE C[C@@H]1CCC[C@](Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1291066146 KBYZLXQFBIEWSK-CLOONOSVSA-N 434.588 4.193 10 10 IICE CCOc1ccc(N2CCN(C(=O)C[C@@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1295275111 GGKAOCLORLGDIM-LJQANCHMSA-N 433.593 4.063 10 10 IICE Cc1cc(C(=O)N2CC[C@]3(CCCN(C)C3)C2)c(C)n1-c1ccc(Br)cc1 1298520336 WXXOKRLRPWGTNR-QFIPXVFZSA-N 430.390 4.415 10 10 IICE CCOC(=O)[C@H]1c2ccoc2CCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1300827569 ASBQCKMKPVEBRG-HSZRJFAPSA-N 434.492 4.111 10 10 IICE Cc1cc(C(=O)N2CC3(CCCC3)OC[C@H]2CN(C)C)c(C)n1-c1cccc(Cl)c1 1301430838 GAZVPUYABSJRHJ-OAQYLSRUSA-N 429.992 4.463 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1306426815 CVEVOSAUMJDWLL-FCHUYYIVSA-N 427.593 4.029 10 10 IICE COc1cccn2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(Cl)c(Cl)c4)c3C)nc12 1307358729 RTOLZZAPYHTAMF-UHFFFAOYSA-N 445.306 4.102 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2cc(OC)ccc2O)sc2c1CC[C@@H](C)C2 1307628323 HTQPFNWIWYTAAY-KGLIPLIRSA-N 446.569 4.053 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N(CC)CC)cc2)[C@H]1Oc1ccccc1 1312537586 VBKOYNAZFHVKQQ-WXFUMESZSA-N 425.573 4.299 10 10 IICE CC1(C)CC[C@H](CNC(=O)NCc2cc(Cl)ccc2O)N(C(=O)OC(C)(C)C)C1 1313146264 INARWYHGTKRRGK-MRXNPFEDSA-N 425.957 4.271 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](CCc1ccccc1)c1ccccn1 1313154447 DOCUAYHMWZVZNL-AREMUKBSSA-N 444.579 4.434 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C[C@H]3OCc4cc(Cl)ccc43)cc2F)C[C@@H](C)O1 1350931709 BVFNOCAPIWFPHW-DOQJBMMISA-N 432.923 4.371 10 10 IICE CC(C)CCn1nccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1352510480 ODYOOGUNDRCXDC-GHRIWEEISA-N 446.573 4.298 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)c3ccc(C(F)(F)F)cc3)cc2F)CC1 1352968934 DOAHHKZNFYCGSJ-MRXNPFEDSA-N 437.481 4.406 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@](C)(CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1355032538 WAXWNGQDRFQAEF-RUZDIDTESA-N 447.620 4.311 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)c(Cl)c1 1436973065 UNFUIMPURQJHOQ-OAHLLOKOSA-N 431.920 4.173 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C1CCN(Cc2nccn2C)CC1 1446806112 QGXDAXOQCJLCBU-HXUWFJFHSA-N 432.568 4.128 10 10 IICE COc1ccc(O)c(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 1446822448 FVVBGBHEUGRQSN-UHFFFAOYSA-N 431.536 4.018 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCCC34CCCC4)cc2F)C[C@@H](C)O1 1460137822 OGZWMZRTHBSGMM-SELNLUPBSA-N 431.596 4.148 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 1470555088 AYCRVZXZZGMKOM-GHTZIAJQSA-N 425.548 4.436 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@@H]3c3ccc(Br)cc3)C2)cc1 1478861303 XWCBUDQFHGAYAS-HRAATJIYSA-N 444.373 4.441 10 10 IICE Cc1csc(CN(C)c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)c1 1492647493 NHPAEWBRSLQQOS-OAHLLOKOSA-N 435.644 4.427 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H]3C(C)C)n2Cc2ccc(N(C)C)c(F)c2)n1 1492750405 XFMAZBSVEMGZAN-OAQYLSRUSA-N 439.583 4.018 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1505229836 FXOCJKBISQSQCL-LJQANCHMSA-N 443.661 4.398 10 10 IICE COC(=O)[C@@H](COC1CCC1)N(C)C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1517712665 VQIIUULEMCQTCJ-JOCHJYFZSA-N 438.528 4.351 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1N(C(=O)OCc2ccccc2)CC1(C)C 1540488567 VVJOOSCNKFMEHG-HSZRJFAPSA-N 435.568 4.292 10 10 IICE CC(C)[C@@H](Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1541307505 HDPQVKANIYTKNA-FGZHOGPDSA-N 435.572 4.349 10 10 IICE CC[C@H](C)c1nc(C)c(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)n1 1542490211 HOALLWSVNKWETG-MBSDFSHPSA-N 438.616 4.423 10 10 IICE COC(=O)[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccc(Cl)c(F)c1 1545874906 GLXRLTWEUOLGJB-NRFANRHFSA-N 442.874 4.343 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1cc(C)ccc1C(C)C 1546151907 LGNHBYNXQSFMGM-INIZCTEOSA-N 433.932 4.447 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1564800804 BXKCFHGOOJFDSQ-QZTJIDSGSA-N 444.576 4.359 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(CC(F)(F)C(F)F)CC3)c2C)c1 1565766681 DGAXKCIXYXVNQJ-UHFFFAOYSA-N 425.470 4.369 10 10 IICE COc1ccccc1CCNC(=O)CNC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1568421751 PULNJARADLMEOM-UHFFFAOYSA-N 447.579 4.315 10 10 IICE CCS(=O)(=O)c1ccccc1CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1586081186 BKYMMYIVIZXNMP-QGZVFWFLSA-N 449.016 4.229 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCOC[C@H]3CC(=O)c3ccccc3)c2C)cc1 1588015563 WVAPNFSYNDXRNO-JOCHJYFZSA-N 432.520 4.217 10 10 IICE Cn1c(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)nc2ccccc21 1597275539 WKCXETXDOOUUJC-FOWTUZBSSA-N 442.591 4.255 10 10 IICE CCOC(=O)N1[C@H](C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC[C@H]1c1ccc(C)o1 1597800732 OMYACGGLIWUYOQ-WTNAPCKOSA-N 441.572 4.372 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ncsc1C1CC1 1610994782 HOHXMXODLIRDOR-ZROIWOOFSA-N 433.555 4.390 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)cc(C=O)c1 1629971832 JFRQDSXKQWEESM-UHFFFAOYSA-N 441.119 4.392 10 10 IICE Cc1c(Cl)cccc1-n1ccnc1SCC(=O)NCc1ccc2cccnc2c1O 1630528751 VSFXMDHFOYDFPD-UHFFFAOYSA-N 438.940 4.496 10 10 IICE O=C(N(Cc1ccccc1O)C[C@H]1CCCO1)C(F)(F)c1ccccc1Br 1632398190 DBENBGWMVUTDQX-OAHLLOKOSA-N 440.284 4.454 10 10 IICE COc1ccc(CCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1OC 1635945963 DMYOVJCNVLUWNN-HXUWFJFHSA-N 446.975 4.166 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H](CC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1636353641 FVYGKYCRQMHHNY-UXHICEINSA-N 447.620 4.215 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Nc3nccs3)cc2F)N(C)C)cc1 1637004617 IMKFJRNVIYYWGG-HXUWFJFHSA-N 427.549 4.125 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](C)CCCNC(=O)OC(C)(C)C)CCCC1 1637533429 NOISIRRGWJYLST-KRWDZBQOSA-N 443.588 4.338 10 10 IICE COc1ccc([C@@H]2COCCN2C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1650824592 UBWDYKZCNJQXAG-VWLOTQADSA-N 432.520 4.437 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)c1O 1652293869 QLLBMMSOOJVQEB-UHFFFAOYSA-N 440.849 4.225 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)cc1 1653258841 NNVKJDOFYQNLNB-NRFANRHFSA-N 430.520 4.107 10 10 IICE C[C@@H](Sc1ncc(Cl)s1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 1656767436 VVROYVRIBGENEC-GFCCVEGCSA-N 446.019 4.090 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1657875751 GSBWUGWVPQGDRQ-NHCUHLMSSA-N 435.612 4.352 10 10 IICE COc1ccccc1NC(=O)c1ccc(NC(=O)CCN[C@@H](C)c2ccccc2O)cc1 1659815670 QEUFASVLYXLPDK-KRWDZBQOSA-N 433.508 4.333 10 10 IICE COc1ccccc1N1CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1675107796 FKJKOJUYNGVRQS-UHFFFAOYSA-N 432.568 4.443 10 10 IICE C[C@H](NC(=O)NC[C@@](C)(C(=O)OC(C)(C)C)c1ccccc1)c1ccc(N(C)C)cc1 1681778356 ALJCZHBTXVOUBK-AVRWGWEMSA-N 425.573 4.412 10 10 IICE CCO[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C12CCCCC2 1685681204 BZKWKWIIJGVHKO-YTFSRNRJSA-N 430.637 4.125 10 10 IICE CN1CC[C@H](CNC(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1685956538 ZRINDWOVWHMQIJ-YJYMSZOUSA-N 426.319 4.330 10 10 IICE Cc1cc(CNC(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1687286242 AHFUKVPFDSEJML-QFIPXVFZSA-N 444.579 4.446 10 10 IICE Cc1ccc(-c2nnc(N(C)C[C@H]3CCCOC3)n2CCCSc2nccs2)o1 1707348017 KFOIVQSQWZFHJC-MRXNPFEDSA-N 433.603 4.348 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)cc1C 1731107757 NSIJGTDSPDTTBH-UYAOXDASSA-N 431.650 4.173 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)Cc2ncc(Cl)n2C)nnc1C(C)(C)C 1742141201 BAEXDKIIBONWMS-UHFFFAOYSA-N 430.000 4.022 10 10 IICE C[C@@H]1CCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C[C@@H]1C 1752244929 DAGHOAIPARDXJK-SJORKVTESA-N 428.631 4.385 10 10 IICE CN(C[C@H]1CCOC1)c1nnc(Cc2ccc(F)cc2)n1CCCSc1nccs1 1768812991 PSPIVWUHMSQDMZ-QGZVFWFLSA-N 447.605 4.120 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC(C)(C)C1 1769320413 MURNBENMROENOR-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COc1ccc(CC(=O)N(c2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)cc1OC 1859889480 LQZHSLNPLGJABI-UHFFFAOYSA-N 443.499 4.463 10 10 IICE C[C@H]1CCCC[C@@H]1NC(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860344977 LLYPJCPFUNCICU-UWJYYQICSA-N 440.547 4.269 10 10 IICE CCOc1cccc2c(O)cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)nc12 1866507012 WOGCVBJFRXKSJB-UHFFFAOYSA-N 438.439 4.367 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C(C)C)c(CO)c2I)cc1C 2079955889 GLOBOTAXQXCWPR-GOSISDBHSA-N 440.325 4.425 10 10 IICE O=C(NN1C(=O)C(=Cc2ccccn2)SC1=S)c1ccc(OCc2ccccc2)cc1 2296235666 OZCXTBFHYOSLPW-UHFFFAOYSA-N 447.541 4.207 10 10 IICE N=C1C(=Cc2ccc3c(c2)OCO3)C(=O)N=C2SC(C34CC5CC(CC(C5)C3)C4)=NN12 2297630489 HYENIRSLCSHJEO-UHFFFAOYSA-N 434.521 4.251 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)cc1 2321609742 SLMLRINTUDBCBU-UHFFFAOYSA-N 444.553 4.479 10 10 IICE CC(C)(C)OC(=O)N1CCCN(N=Nc2ccc(I)cc2)CC1 2330186065 CWYFWEFRCNURTQ-UHFFFAOYSA-N 430.290 4.233 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CC[C@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2381136475 GSQUWSSWMKHZBU-PMACEKPBSA-N 441.366 4.163 10 10 IICE Cc1ccc(Sc2ccc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)o2)cc1 20356221 PBEJTPRRTYCLOA-ISFDWQSPSA-N 437.550 4.412 10 10 IICE C[C@@H](C(=O)Nc1ccc2oc(=O)ccc2c1)N1C(=O)/C(=C\c2cccs2)SC1=S 33585390 JHZHTICGCAJFBX-YAFRSCOQSA-N 442.543 4.083 10 10 IICE Cc1cccc2oc(CCNC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)nc12 409640676 UMICVLJDTDHJKM-UHFFFAOYSA-N 430.552 4.216 10 10 IICE COc1ccc(N2CCN(C(=O)C3=C(C)NC(=C4C=C[C](Cl)C=C4)S3)CC2)cc1 606676210 VHFBIBXYWJFGPN-UHFFFAOYSA-N 428.965 4.020 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 731184215 SZXUNCCQPITWEG-DEOSSOPVSA-N 429.564 4.305 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCO3)n2C[C@H]2CCOC2)c(C)n1-c1ccccc1 752841952 FGFGDXVJBSXVGY-IFMALSPDSA-N 435.572 4.004 10 10 IICE O=S1(=O)CCN(c2ccc(CN[C@@H]3CC4(CCCCC4)Oc4ccccc43)cc2)CC1 753947584 QCZSPCOKUKCZHM-HSZRJFAPSA-N 440.609 4.238 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCO[C@H](C3CCCCC3)C2)c([N+](=O)[O-])c1Br 754124009 POXNJKBSLYGBBA-AWEZNQCLSA-N 444.282 4.060 10 10 IICE COc1ccc(S(=O)(=O)Nc2cccc(CN[C@@H](C)c3cc(F)cc(F)c3O)c2)cc1 756582358 HQLVXKACCQHDPF-AWEZNQCLSA-N 448.491 4.331 10 10 IICE CCOC(=O)c1c(NC(=O)CCN[C@@H]2CCOC[C@H]2C)sc(C)c1-c1ccccc1 763921592 VGFMAKKUMOLXDB-CRAIPNDOSA-N 430.570 4.243 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)NC(=O)OC(C)(C)C)cc1 796731036 UUQDDACJADCQIB-RYRKJORJSA-N 443.510 4.413 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(NC(=O)C(F)(F)F)cc2)nc1-c1ccccc1 917846858 DUVJDCXRBRMVQD-UHFFFAOYSA-N 441.456 4.420 10 10 IICE Cc1ccc(C)c(C2=NO[C@H](C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2)c1 1126657519 JLTIFDFQRKGNCY-JTSKRJEESA-N 443.494 4.183 10 10 IICE COc1ccc(-c2nc(C)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)s2)cc1 1134681570 APDXYWHXEOXWCL-NRFANRHFSA-N 438.597 4.226 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCO[C@H](CNC(=O)OC(C)(C)C)C3)c2C)c1 1138305855 XPHLZAFCPZJEHK-OAQYLSRUSA-N 441.572 4.077 10 10 IICE CCOC(=O)CCN(C[C@H]1CCCN1CC)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1142138367 SJYNVPNPKAVLJU-JOCHJYFZSA-N 443.563 4.113 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CNC(=O)c2cc(C)cc(C)c2)cc1 1144704579 PLUKWSKBQMGJGF-UHFFFAOYSA-N 445.563 4.341 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)Cc2ccccc21 1144740873 NFVQOPIPAKKOPD-OAHLLOKOSA-N 440.521 4.409 10 10 IICE CCOC(=O)c1cccc2nc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)[nH]c12 1158873453 KFPWLSBHCGNGMM-UHFFFAOYSA-N 432.480 4.408 10 10 IICE CC1(C)[C@H](C(F)(F)F)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1169300558 NCFSDWYDQUMGOD-QGZVFWFLSA-N 430.426 4.063 10 10 IICE CCOC(=O)Cc1csc(CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)n1 1177640052 NKRUXODXQFDAPO-UHFFFAOYSA-N 431.945 4.240 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)c2cccnc2)c(C)n1-c1cccc(Br)c1 1180217902 ZHPILVXVEQOOAK-FQEVSTJZSA-N 428.330 4.057 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc([N+](=O)[O-])ncc3Br)c2C)c1 1184116218 CMKBBGSIOFQJBC-UHFFFAOYSA-N 443.301 4.398 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(C)Cc3nnc4n3CCCCC4)cc2Cl)C1 1227206896 BCOFMBNOQIVZKY-KRWDZBQOSA-N 445.011 4.236 10 10 IICE CC1(C)CC[C@@H](CNC(=O)NCc2cccc(Cl)c2O)N(C(=O)OC(C)(C)C)C1 1234515291 LEMMAKWRFDFRCG-HNNXBMFYSA-N 425.957 4.271 10 10 IICE CN=[S@@](C)(=O)c1cccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1272547304 ICHWALKFMAVVCX-PMERELPUSA-N 425.554 4.254 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(NC(=O)N(C)C)c2)C1 1273009566 PQRAPMBCWFQIQQ-UHFFFAOYSA-N 433.556 4.140 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc([C@@]4(C)NC(=O)NC4=O)c3)c2C)c1 1290915275 ZRQLVZBTLXWFOL-RUZDIDTESA-N 430.508 4.018 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CC(C)C)c3ccccc3C)CC2)cc1 1293385574 HBROEGRNNJZQCE-KMAVEXBHSA-N 449.595 4.112 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(C)ccc(Br)c3OC)CC2)cc1 1295275094 FSATVLKZEFRLDE-UHFFFAOYSA-N 433.346 4.127 10 10 IICE CCCN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CCc2ccccc2C1 1312833459 ITJHCECLOJAFGU-NRFANRHFSA-N 443.538 4.281 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C1 1314271274 DJCBFRIDMROZTM-FYYLOGMGSA-N 441.620 4.072 10 10 IICE Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1355131592 XPLNBRAVGZOJFH-YESZJQIVSA-N 434.939 4.485 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359837186 ZYWQIYVORZBUJZ-XMMPIXPASA-N 439.648 4.358 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F 1361102418 QXAXRTZOIOROCC-UHFFFAOYSA-N 434.393 4.135 10 10 IICE CCSc1nc(C)c([C@@H](CC)C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 1441796215 XGNBMBGBXNNZGY-MRXNPFEDSA-N 437.606 4.349 10 10 IICE C[C@@H]1C[C@H](C(F)(F)F)n2ncc(C(=O)N(Cc3ccco3)Cc3ccccc3O)c2N1 1445637773 GSWZXGNDZIPYOF-FZKQIMNGSA-N 434.418 4.332 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCNC(=O)[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 1458482552 QAMZWJDXHZJJJQ-NRFANRHFSA-N 441.453 4.426 10 10 IICE CC(C)c1ccc(CN2CCN(C(=O)CN(Cc3ccc(N(C)C)cc3)C3CC3)CC2)cc1 1459350395 NWTAAOWCGKQQOM-UHFFFAOYSA-N 448.655 4.185 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCCS(=O)(=O)C[C@@H]2C2CC2)cc1 1463130089 UXOAHMUWOCPSGL-JOCHJYFZSA-N 440.569 4.207 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-c2ccccc2Cl)on1 1466398503 PQTAHPSNHCGEAX-UHFFFAOYSA-N 435.263 4.169 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N2CCC[C@@](C)(OC)CC2)cc1 1501839890 VYBCNFHPKQNGIM-RUZDIDTESA-N 449.603 4.025 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1513096516 AEJMHHVSVCPTNX-KRWDZBQOSA-N 432.576 4.012 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)cc(Cl)c3F)cc2F)CC1 1521015299 FKFZWQIJHLMVEK-UHFFFAOYSA-N 428.310 4.344 10 10 IICE COc1ccccc1C(F)(F)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1531502502 HADNWPALHAJXRR-AWEZNQCLSA-N 426.410 4.174 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ncc(F)cc2Br)C1 1532397648 OGHXTFFDXJURCU-UHFFFAOYSA-N 445.336 4.343 10 10 IICE CCCOc1cncc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1532678889 JTPILWYWTNMYQW-ZDLGFXPLSA-N 445.541 4.240 10 10 IICE Cc1ncc(/C=C\C(=O)N2C[C@@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)s1 1538218508 NOJNIQHZFIGRLT-DDJMYBDESA-N 431.533 4.334 10 10 IICE CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1542410718 ORXIEJIKQBGGBN-MOTLMKGSSA-N 429.630 4.330 10 10 IICE CCN(CC)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1547467644 QCJLFQJMZVZXNR-IFMALSPDSA-N 425.621 4.474 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3NC(=O)OC(C)(C)C)C2)cc1 1557133312 HJSMVTYODWFMQK-KRWDZBQOSA-N 425.529 4.299 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1557646567 BKQZZNNPZSEIFW-INIZCTEOSA-N 427.545 4.200 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccccn2)c1C)Cc1cccc2ccccc12 1565704841 UVQCMWUNUOAPDJ-QFIPXVFZSA-N 441.531 4.404 10 10 IICE CC(C)(C)c1ccc(C2(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)CCCC2)cc1 1566462386 PVVWXCXBXITAIE-UHFFFAOYSA-N 430.570 4.261 10 10 IICE COc1cc(C)c(Br)cc1C(=O)NCc1ccc(N2CCSCC2)cc1 1596359462 SXTVTRHGAHFMKS-UHFFFAOYSA-N 435.387 4.249 10 10 IICE COC(=O)[C@](C)(Cn1cnc2ccccc21)NC(=O)c1cc(C)n(-c2ccccc2C)c1C 1597943293 DRKMNXRKOCYFLA-SANMLTNESA-N 444.535 4.114 10 10 IICE CC(C)[C@@H](Cc1ccccc1)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1616359755 UGPSYJCLXJRPNK-OAQYLSRUSA-N 442.471 4.367 10 10 IICE CN(Cc1ccccc1)Cc1cccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1616858904 UVYFWVHSGDOVAZ-HHHXNRCGSA-N 444.623 4.417 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1 1617264630 BNAFOVRXRKKAQR-UHFFFAOYSA-N 444.579 4.480 10 10 IICE CCCN(CC)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 1622635156 RQNNFCJQGHPALW-HXUWFJFHSA-N 430.980 4.071 10 10 IICE COC(=O)c1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)ccc1N1CCCCC1 1626833841 NFJMLWQTXXJNBO-UHFFFAOYSA-N 426.494 4.342 10 10 IICE COC(=O)c1cnc(C2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)s1 1633214284 ZUUDSSBWIUTZKR-UHFFFAOYSA-N 441.528 4.496 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc2ccc(O)cc2c1O 1635489263 QNFCFKPWYFQJRE-UHFFFAOYSA-N 436.508 4.253 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3cccc(F)c3Br)CC2)cc1 1636702374 PFZARASXFZPVTF-UHFFFAOYSA-N 435.337 4.268 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](CC)OC[C@H]2C)sc(C)c1-c1ccccc1 1643670858 ZAKKBUJLCCVFSB-CRAIPNDOSA-N 430.570 4.338 10 10 IICE O=C(NCc1c(O)cccc1O)c1ccccc1C(=O)c1ccc(Br)cc1 1645360783 INJVAUBIJXZOAY-UHFFFAOYSA-N 426.266 4.021 10 10 IICE Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)NCc3cc(O)ccc3O)cc12 1651222279 DITRNZVJXYJDLI-UHFFFAOYSA-N 427.913 4.449 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1671363968 ZABSNHSKXGUESR-OAQYLSRUSA-N 444.938 4.026 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CSCCN1Cc1ccccc1 1681325263 VQCNAWUGBOWNIM-XMMPIXPASA-N 440.657 4.290 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(Cc2cc3ccccc3[nH]2)CC1 1682101358 OYRVKFGUNQUIEG-HXUWFJFHSA-N 433.600 4.001 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)C1CCC(C(C)(C)C)CC1 1684169625 OOEOAMZMMVBMRK-UHFFFAOYSA-N 428.621 4.135 10 10 IICE CC(C)Cc1nnc(N2CCO[C@@H](c3ccco3)C2)n1CCCSc1nccs1 1706428610 VPEAKOXKMAGOBH-QGZVFWFLSA-N 433.603 4.286 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@H]2C)n1CCCSc1nccs1 1708723697 BMXKFPFBMIPHPU-HUUCEWRRSA-N 436.651 4.070 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCCNC(=O)OC(C)(C)C 1767111778 FUEOCXPZKMLFCM-UHFFFAOYSA-N 429.565 4.193 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)/C2=C/c2ccc(C(=O)O)cc2)cc1 1865675456 JCFQCDLLWXCOSG-HYARGMPZSA-N 430.435 4.363 10 10 IICE O=C(O)[C@H](Cc1ccccc1)N1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2293030986 AFRNHDVVLHZGOZ-HNNXBMFYSA-N 448.363 4.346 10 10 IICE O=C(O)CN1C(=O)C(=Cc2ccc(-c3ccc(OC(F)(F)F)cc3)o2)SC1=S 2293644721 WMMSJPXHMCXKHO-UHFFFAOYSA-N 429.397 4.131 10 10 IICE CC1=NN2C(=N)C(=Cc3cccc(OCCOc4cc(C)ccc4C)c3)C(=O)N=C2S1 2297310382 LJXRTOXUYWJUCI-UHFFFAOYSA-N 434.521 4.400 10 10 IICE O=C1NC(=S)SC1=Cc1ccc(OS(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1 2297361872 MTYKJBVLFLQCTC-UHFFFAOYSA-N 446.358 4.250 10 10 IICE Cc1ccc(CNCC2(F)CCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2352941290 PCAUTARRRJPBOZ-UHFFFAOYSA-N 431.346 4.292 10 10 IICE Cc1ccc(Cc2cnc(NC(=O)CCN3C(=O)[C@H](C)SC3=S)s2)cc1Cl 11635992 UUIDZNJELLTSFP-NSHDSACASA-N 440.015 4.273 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3cccc(C(C)=O)c3)C2=O)c(C(=O)O)c1OC 16906184 RDAJJAVFMCNRNU-MHWRWJLKSA-N 443.502 4.010 10 10 IICE O=C(O)c1ccc(N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)cc1O 16929351 IKKXTXOXYOIZJV-AUWJEWJLSA-N 436.308 4.259 10 10 IICE C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)/C(=C/C=C/c2ccccc2)SC1=S 47152392 UZXSDVFZPWHSEK-KWOGSNDASA-N 439.518 4.379 10 10 IICE O=C1/C(=C/c2cc(Br)ccc2O)SC(=S)N1c1cccc([N+](=O)[O-])c1 59397714 UWISJTBTBXIMJQ-AUWJEWJLSA-N 437.296 4.469 10 10 IICE COc1ccc(NC(C)=O)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435668122 UVEUERQAORYVRP-UHFFFAOYSA-N 434.540 4.014 10 10 IICE CN1c2ccccc2C(=O)N2CCc3c(n(CCC(=O)N4CCCCC4)c4ccccc34)[C@@H]21 504513410 WNRJKJZXLTXFTK-AREMUKBSSA-N 442.563 4.191 10 10 IICE biogenic CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3cccc(-n4cncn4)c3)no2)C1 519727363 RRCBMBSYSDOVJH-UHFFFAOYSA-N 439.523 4.087 10 10 IICE Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742798456 NUNKBFDWXAPUJU-SFHVURJKSA-N 434.531 4.085 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)c2)c1C 766558017 YQDOHEPJOQAPAX-UHFFFAOYSA-N 436.531 4.162 10 10 IICE Cc1nn(C)c(C)c1[C@@H]1COCCN1Cc1c(O)ccc2cc(Br)ccc12 771632085 DXALHAKANPNGKD-IBGZPJMESA-N 430.346 4.232 10 10 IICE O=C(O)c1ccccc1N(CCC1=CCCCC1)S(=O)(=O)c1cccc2nonc12 776649132 BALDJYQPNVBGCL-UHFFFAOYSA-N 427.482 4.007 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N[C@@H](C)c3ccc4ncsc4c3)cc2F)CC1 776929734 YWGAOMRQRICCJE-INIZCTEOSA-N 441.576 4.138 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccccc1C(=O)OC(C)(C)C 802610766 PVPUIJLZALLFDQ-UHFFFAOYSA-N 426.513 4.115 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCOCC3)n2C[C@H]2CCOC2)c(C)n1-c1ccccc1 802762505 ALSZLZLRPQOIIJ-JOCHJYFZSA-N 449.599 4.252 10 10 IICE Cc1ccc(-c2ccc(/C=C3/SC(=S)N(CCN4CCOCC4)C3=O)s2)cc1 920471663 HAAZLIFLPIFLTI-XMHGGMMESA-N 430.620 4.257 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/c3cccc(OCc4csc(C)n4)c3)CC2)cc1 1087036644 BJRMSUHJGFXJLZ-IZZDOVSWSA-N 449.576 4.401 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C[C@H]2CCCO2)C(F)(F)F)C1 1130476014 YBPCSGVZBSXALV-IERDGZPVSA-N 437.506 4.024 10 10 IICE C[C@@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1134686726 UGHSPYZJNSPGSW-HRAATJIYSA-N 437.506 4.249 10 10 IICE CC[C@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(Br)cc1 1135732735 DXENTVZSYACDMO-NRFANRHFSA-N 431.374 4.438 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(F)c(Cl)c(N)c3Cl)cc2F)C[C@@H](C)O1 1141901566 IKANPGXOABEVGT-PHIMTYICSA-N 444.309 4.397 10 10 IICE CCC[C@H](C)C(=O)NCCNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1159022492 COZRTDVVKAOASR-AWEZNQCLSA-N 434.378 4.139 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3cccc(SC)c3)C2)cc1F 1293224912 IVVMOALBWDSOJN-QGZVFWFLSA-N 429.561 4.063 10 10 IICE CCOc1ccc(C(C)(C)C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1OCC 1294823280 GRDAHGSZBBFLDG-UHFFFAOYSA-N 444.547 4.258 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2(Cc3ccc(F)cc3)CCOCC2)cc1 1298428246 NCQULEMEGOHEGZ-UHFFFAOYSA-N 448.538 4.496 10 10 IICE CCCN(C)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)c(F)c1 1306767596 FLZMQGOFPNZIHL-UHFFFAOYSA-N 435.345 4.135 10 10 IICE CC[C@H]1c2ccc(OC)c(OC)c2CCN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1307158740 SIGBBVPPBJGWNA-VTSXBNNFSA-N 426.469 4.312 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](c3ccc(CC(C)C)cc3)N(C)C)C2)cc1 1312818318 LSCLUUDKJYHMFE-DHLKQENFSA-N 438.616 4.075 10 10 IICE Cc1sc(NC(=O)Cc2nnn(C(C)(C)C)n2)c(C(=O)OC(C)C)c1-c1ccccc1 1358009058 HTJLGOBWRUYSRH-UHFFFAOYSA-N 441.557 4.211 10 10 IICE O=C(/C=C\c1ccc(F)c2ccccc12)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436624893 SIRUKOUPEJRPGY-VURMDHGXSA-N 426.438 4.423 10 10 IICE CCNC(=O)Nc1cc(F)ccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1465678499 NGFOPKUDDGRLHO-UHFFFAOYSA-N 436.487 4.368 10 10 IICE CCN(C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@@H](Cc1ccc(F)cc1)C(C)C 1471192392 YAZMBZBPNPJLLQ-VWLOTQADSA-N 440.607 4.376 10 10 IICE C[C@H](Nc1ncnc(C(F)(F)F)c1Br)c1ccc(N2CCOCC2)cc1 1472673297 KRXJUAACHBEXOB-NSHDSACASA-N 431.256 4.268 10 10 IICE C[C@H]1CCCN(CCCCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1493794692 XJFBOKJTFIHQLS-NZQKXSOJSA-N 441.620 4.374 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)CCc2cccs2)cc1F 1503394773 XJMTVFDHZQZELE-GOSISDBHSA-N 443.592 4.166 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H](C)C(=O)NC 1514404425 XAEDLXLVXCYXME-GOSISDBHSA-N 436.604 4.361 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(CCN2CCOCC2)Cc2ccco2)c1 1528999340 UPMAJPDIOQAPHR-UHFFFAOYSA-N 441.959 4.315 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3nccn3C)C2)c(C)n1-c1ccc(Br)cn1 1556421106 IYVXHOMFCGEQKS-MRXNPFEDSA-N 442.361 4.005 10 10 IICE CCCCn1nc(C)c(-c2cc(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)n[nH]2)c1C 1557063069 CNISFHZFIQRLDL-KRWDZBQOSA-N 436.604 4.426 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC(C)(C)C(=O)NCC3CCCCC3)c2C)cc1 1566324927 SYHBQWSHTBRZLN-UHFFFAOYSA-N 425.573 4.308 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@H]1CC1(Cl)Cl 1586884499 KKFFWPRXLLHWHN-IGVUGNCQSA-N 447.384 4.117 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(-c4ccccc4)cc3)CC2)cc1 1624099038 WKUDDKIGWWCUBU-NXVVXOECSA-N 441.531 4.206 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3nc(-c4ccccc4)cs3)cc2F)C[C@@H](C)O1 1626159472 YHYXTPAZMUXANF-CALCHBBNSA-N 439.556 4.422 10 10 IICE CCOC(=O)CN(Cc1ccc(F)cc1)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1631471773 XAARMCBJSFHLSN-UHFFFAOYSA-N 438.499 4.447 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(CCC(C)C)cc3)CC2)cc1 1631586749 IPXIDYHYQNURHL-PFONDFGASA-N 435.568 4.127 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1ccc(Cn2cc(Br)cn2)s1 1632227362 CUEFUMRQCCCQQI-UHFFFAOYSA-N 426.723 4.044 10 10 IICE Cc1cc(C(=O)NCc2cc(S(C)(=O)=O)ccc2F)c(C)n1-c1cccc(Cl)c1 1633870547 VEHCYRJHNXZOIV-UHFFFAOYSA-N 434.920 4.220 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)cc1 1634761176 PCOCGFCDSNGXIV-AZUAARDMSA-N 432.362 4.091 10 10 IICE CCC[C@H](C(=O)OCC)n1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1641094703 PDWGQJQTWKQHQU-OAQYLSRUSA-N 436.512 4.260 10 10 IICE NC(=O)N[C@@H](CC(=O)NCc1cccc(Cl)c1O)c1cccc(Oc2ccccc2)c1 1648606361 PHFGMXZLPUYBGK-FQEVSTJZSA-N 439.899 4.254 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)NCc1c(O)cccc1F)NC(=O)OC(C)(C)C 1681720168 AUDBIJHAXHENTN-LJQANCHMSA-N 431.508 4.159 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN([C@H](C)c2ccc(F)cc2F)CC1 1686826601 LITZSCJRHDCQDL-RTBURBONSA-N 444.570 4.359 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1694324396 OFOBAZJGAQBPPT-HKUYNNGSSA-N 440.636 4.102 10 10 IICE CCCCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1695223066 ORTDPXMUMAYIIX-JOCHJYFZSA-N 427.593 4.183 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1)C(C)C 1697148388 KMDJIRJFYGDICK-QHCPKHFHSA-N 437.588 4.250 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCOC 1708339077 FNMDNPHNGHKYSF-IQGLISFBSA-N 439.604 4.232 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)CCO1 1709547872 MLBLQKUAFSDVOP-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N(C)CCc2nccs2)cc1 1746090318 UNUOTAKLPRHQCD-UHFFFAOYSA-N 435.601 4.303 10 10 IICE CC(C)[C@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)NC(=O)OC(C)(C)C 1750597462 WFXWJSLRDRNDSU-SFHVURJKSA-N 445.608 4.467 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@@H](O)CC3(CCCC3)C2)cc1 1764931919 ZCHFUBBPMQCMOJ-QFIPXVFZSA-N 425.621 4.427 10 10 IICE COc1ccc(N2CCN(Cc3cc(=O)c(OCC(C)C)cn3CCC(C)C)CC2)cc1 1870435642 PADNTPWSENYBIE-UHFFFAOYSA-N 441.616 4.260 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)CC12CC2 1965989011 SWWXBUPXGOGDSL-CQSZACIVSA-N 429.330 4.316 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(C)(C)C)c(N)c2I)c(O)c1 2079038242 XKOHDJIXVCBNAE-OAHLLOKOSA-N 425.314 4.381 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C(C)C)c(CN)c1I 2079971861 MTGRNMZUMZEWHJ-OAHLLOKOSA-N 427.330 4.392 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C2(C)CC2)c(C=O)c1I 2080048926 ZNJOVJLTKHERHT-CQSZACIVSA-N 440.281 4.065 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc(Cl)c1O 2297578543 QSYCRTOVGOHYHZ-UHFFFAOYSA-N 441.654 4.027 10 10 IICE O=C1N=C(N2CCC(Cc3ccccc3)CC2)SC1=Cc1ccc(N2CCOCC2)o1 2314646811 PEONMFWHQBXNMQ-UHFFFAOYSA-N 437.565 4.041 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(c2ccc3c(c2)OCO3)C1=O)C(=O)O 2314933083 SKJWHVSYBBHSKW-CQSZACIVSA-N 443.502 4.063 10 10 IICE CC[C@@H](Nc1c(I)cnn1C)c1cc(Br)ccc1O 2353671050 XGGYTEPRUCDZAQ-LLVKDONJSA-N 436.091 4.056 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(O)c1Br 2380759044 LCPKHIGHZSQHTC-DZGCQCFKSA-N 441.366 4.067 10 10 IICE O=C(O)CCCCCNC(=O)CCCCCN1C(=O)/C(=C/c2ccccc2)SC1=S 15044766 URILOQPCDSDMBL-VLGSPTGOSA-N 448.610 4.209 10 10 IICE O=C1/C(=C\c2cc(Br)ccc2O)C(O)=NC(=S)N1c1cccc(Cl)c1 34235141 ACGPFQQFFICSCD-QPEQYQDCSA-N 437.702 4.480 10 10 IICE COc1cccc([C@@H]2CC(c3ccc(Br)cc3)=NC3(CCN(C)CC3)N2)c1O 65298211 UEBPYVDQTFDJDQ-IBGZPJMESA-N 444.373 4.109 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccoc3CN3c4ccccc4C[C@@H]3C)CC2)cc1 111150532 SUFWVGOHTQYEQE-IBGZPJMESA-N 431.536 4.202 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)c(CN3CCOCC3)s2)c(C)c1 170548750 ZTDVUUTWTNGLJM-UHFFFAOYSA-N 443.594 4.060 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1 733731085 HBYICJZYRHYHNU-UHFFFAOYSA-N 444.490 4.179 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H]1C[C@@H]1c1cccc(F)c1 742769306 CQOMHTRAVBIUMG-UYAOXDASSA-N 437.437 4.036 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2ccncn2)c(C)n1-c1ccc(Br)cc1 754940379 JITIBJPHCHBJQE-YVMONPNESA-N 440.297 4.086 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3csc(-c4ccccn4)n3)cc2F)C[C@H](C)O1 757964056 JMIGRJZMABRLNO-GJZGRUSLSA-N 441.532 4.280 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)c2ccc(Br)nc2)C1 766761361 OOZGWVHZCXPGHS-UHFFFAOYSA-N 441.373 4.228 10 10 IICE C[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc2ncsc2c1 776817410 VNSHKPFBWAIXQT-AWEZNQCLSA-N 441.512 4.361 10 10 IICE CCOC(=O)Nc1scnc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 808698680 JXGOSJKYXZLYIX-UHFFFAOYSA-N 445.472 4.298 10 10 IICE CCCOc1c(Cl)cc(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1OC 1129991143 LKDYFYPASMMZTQ-MRXNPFEDSA-N 432.948 4.402 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4cccc(C)c4)c3C(F)(F)F)C2)cc1 1131029757 GBCSRKAOAMQAGL-MRXNPFEDSA-N 444.457 4.217 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(O)c(Br)c1 1137446090 FXMOVLWHZHQICU-UHFFFAOYSA-N 427.298 4.305 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 1138333038 XPNRZVSDHXIOAU-VQTJNVASSA-N 439.556 4.472 10 10 IICE Cc1cc(CC(=O)N(C)[C@H](CNC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1138531029 OWCGJABUJBJPQN-JOCHJYFZSA-N 425.573 4.398 10 10 IICE CC1CCC(N2C[C@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)CC1 1142528212 MTAMAUFMQOMOCR-KWLQHXCVSA-N 425.617 4.499 10 10 IICE CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1142782645 MRTXMZVZPZYUNO-OALUTQOASA-N 439.600 4.072 10 10 IICE CC(C)Cn1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1-c1ccccc1 1148706537 YSCUUPHNJWBEQP-UHFFFAOYSA-N 432.568 4.097 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCc4ccc(Cl)cc43)CC2)c(OC)c1 1233937767 WFJPSUQZRDKWNO-HXUWFJFHSA-N 429.948 4.266 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(-c4ccc(Br)cc4)no3)ccc21 1292206858 KICJBHGUYCHFNT-UHFFFAOYSA-N 426.314 4.417 10 10 IICE CN(Cc1ccc(F)cc1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1348123545 PJSYENNSNJSEKX-PDGQHHTCSA-N 432.517 4.215 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(F)c(I)c2)cc1 1350865045 SXNORABYVNDPTR-UHFFFAOYSA-N 426.273 4.207 10 10 IICE COc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC(C)C)c1 1435331276 CUHQQPANGZEHIH-MRXNPFEDSA-N 434.483 4.483 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cnn(C(C)(C)C)c2-c2ccccc2)N(C)C)cc1 1439959388 DVBXJXOMRWBFRU-QHCPKHFHSA-N 433.600 4.404 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)nc1 1441711490 CWHDHNXJPGVJAP-HXUWFJFHSA-N 444.535 4.101 10 10 IICE CC[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)/C=C\c1cncc(C(=O)NC)c1 1458252714 LZZQJKNJYVTPHI-REBWPMHBSA-N 432.568 4.203 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Br)cn1 1465508222 IZDMPTLHKQBGHQ-OAHLLOKOSA-N 448.361 4.055 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC2(c3cccc(F)c3F)CCCC2)N(C)C)cc1 1469786026 LAKXFAOJJZUHMG-JOCHJYFZSA-N 444.570 4.445 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)c3cc(Cl)cc4c3OCC4)C2)cc1 1470592198 AIHNQRWIYUCUIN-HZPDHXFCSA-N 429.948 4.170 10 10 IICE CCc1nc(CN(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)cs1 1498385430 BUYBZTJOBYQEQU-UHFFFAOYSA-N 435.601 4.351 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3C[C@H](OC)C(C)C)CC2)cc1F 1504296799 RSAOCSGMPUXOGH-QFIPXVFZSA-N 445.583 4.081 10 10 IICE Cc1cc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1F 1523934931 PLZDIVXVQZLHFQ-WOJGMQOQSA-N 432.517 4.181 10 10 IICE C[C@H](NC(=O)c1ccccc1CNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1526966954 BSQFYMLOWRDPCK-SFHVURJKSA-N 439.556 4.039 10 10 IICE Cc1cccn2cc(COc3ccc(C(=O)NCc4ccc(N(C)C)c(F)c4)cc3)nc12 1527013387 BHMJHQSZTNIEJA-UHFFFAOYSA-N 432.499 4.357 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)c1 1537199405 GWBYPLIRPJMCDD-UHFFFAOYSA-N 427.844 4.451 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)cc1 1538138821 ZJUDXCWVMBXTQT-QFIPXVFZSA-N 427.976 4.242 10 10 IICE Cc1cc(-c2nnc(N3CCC(C)CC3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1542184091 PNFNYVPBXFMFSO-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CN(CCCCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)C(=O)OC(C)(C)C 1542490621 SWCOJXIYBJMNGV-QFIPXVFZSA-N 447.620 4.297 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCCC1 1544658020 OHBREIRBSJWPKN-SFHVURJKSA-N 434.536 4.167 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1C[C@@H]1CCCO[C@H]1C(C)(C)C 1554175991 DJLUOXCFTNCKPR-CEWLAPEOSA-N 428.577 4.313 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)CC1 1554691764 NURBUXZMDAMYSN-SANMLTNESA-N 448.615 4.082 10 10 IICE Cc1cc(C(=O)N2CC[S@](=O)C(C)(C)CC2)c(C)n1-c1ccccc1Br 1556621592 RPZFLMOPKZFHPH-SANMLTNESA-N 437.403 4.230 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cc1 1557355486 GTKFQXNPONUJJZ-QFIPXVFZSA-N 447.620 4.454 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@@H]2CCCC[C@H]12 1557394435 IGTIOHAYCKOHMD-DNVJHFABSA-N 436.552 4.409 10 10 IICE CN(CCc1ccc(Cl)cc1)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1559707562 XDFWHXJSOFKFHU-UHFFFAOYSA-N 432.907 4.228 10 10 IICE Cc1ccc(C(=O)NC[C@](C)(O)c2ccc(F)cc2F)cc1-n1c(C)cc(C=O)c1C 1586883035 TXTPNOBCNFJXJX-DEOSSOPVSA-N 426.463 4.131 10 10 IICE CC[C@@H](C)[C@@H](C(=O)NCc1cc(C)n(-c2ccccc2)c1C)N1C(=O)c2ccccc2C1=O 1587885924 GQNFDEUFCOOZNZ-OSPHWJPCSA-N 443.547 4.421 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCCC3)cc2)nn1-c1ccc(Br)cc1 1595435589 GVWRRFDMMDIXTJ-UHFFFAOYSA-N 439.357 4.473 10 10 IICE COc1ccc(N2CCN(C(=O)CCCCc3nc4ccccc4s3)CC2)c(OC)c1 1595989196 AQQPWYHWJIUQSX-UHFFFAOYSA-N 439.581 4.375 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](C)Sc3nc4ccccc4s3)C2)cc1 1598364174 OACQHMALBASBLO-HZPDHXFCSA-N 427.595 4.428 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1 1613075592 XUVIHMIHUWUQDO-PXDATVDWSA-N 437.588 4.129 10 10 IICE CC[C@@H](C)N(C)CCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1613407365 PZZJWJHPYOOKPE-OAQYLSRUSA-N 447.631 4.307 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H](Cc1ccccc1)N1Cc2ccccc2C1=O 1622319757 YNDCUOXKCYEAEL-XMMPIXPASA-N 428.532 4.398 10 10 IICE Cc1nc2cc(F)ccc2cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634628 DIDVICHJOUNGTK-LJQANCHMSA-N 427.907 4.436 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)NCc3c(O)ccc4c3CCCC4)CCCC[C@H]12 1622664456 VBOTYXAVZRJBMV-SQJMNOBHSA-N 428.573 4.457 10 10 IICE C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623546462 LKBWRCSZFVZGEP-KRWDZBQOSA-N 429.561 4.145 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)c1 1624377458 QEBDAXVGTJAWFV-SFHVURJKSA-N 427.508 4.321 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc(Cl)c1Br 1625146067 VSQSUPKRBGMPHZ-UHFFFAOYSA-N 436.781 4.093 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1630100631 QAILRDPNVBWYTJ-FQEVSTJZSA-N 434.559 4.174 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@@H]2CCCC2=O)c(C)n1-c1ccc(Br)cn1 1633205790 JRPPFXYCSWAWCD-WMZOPIPTSA-N 430.346 4.225 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCO[C@@]2(CCN(C(=O)OC(C)(C)C)C2)C1 1638002767 QPOCCUHIRRAXPS-QHCPKHFHSA-N 445.585 4.008 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCC12CC(CN1C(=O)OC(C)(C)C)C2 1638243706 MCZBUIIBKFLFHG-VLNJMECTSA-N 429.605 4.288 10 10 IICE COC(=O)[C@@H]1C[C@@H]2C[C@H](NC(=O)c3cc(C)n(-c4ccccc4Br)c3C)[C@@H]2C1 1639700303 NOIYZZYZAWGTDM-LFEHRJTNSA-N 445.357 4.174 10 10 IICE CSc1ccccc1[C@H](C)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1642889980 GKHOKEZMZZIFIE-HNNXBMFYSA-N 430.529 4.473 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnn2c1N[C@@H](C1CC1)C[C@H]2C(F)F 1642997577 HHYSQAACIDFCCH-XMCHAPAWSA-N 431.531 4.019 10 10 IICE Cc1ccc(C(=O)Nc2cccc([C@@]3(C)COC(=O)N3)c2)cc1-n1c(C)cc(C=O)c1C 1644585936 UUKIBSGNYOGFJU-RUZDIDTESA-N 431.492 4.422 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1C 1673745493 VCOQFLNPKKQQDA-GBESFXJTSA-N 432.609 4.031 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3cn(C(F)F)c4ccccc34)CC2)cc1 1675066210 MCFDZMAOVFHGEE-UHFFFAOYSA-N 428.483 4.467 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1C[C@H]1C 1694301946 BMZXZGFJDONDCW-UYAOXDASSA-N 438.620 4.089 10 10 IICE CS[C@H](Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1698354774 NZRJYQVAKXXLRR-HXUWFJFHSA-N 425.602 4.384 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1708314238 IJUWHQFPSYCYFO-HSZRJFAPSA-N 425.602 4.067 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc2c(c1)CCCN2C 1712515680 CUUZBXJKGZFPPH-VAMGGRTRSA-N 441.620 4.058 10 10 IICE CSc1cc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)ccn1 1712766539 YJMSSMQURKMLHE-LJQANCHMSA-N 425.558 4.027 10 10 IICE CC(C)CN(c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1741549371 XAEVUMMPWSNSHB-HSZRJFAPSA-N 441.620 4.275 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@](C)(OC)CC2)n1Cc1ccc(N2CCOCC2)cc1 1763677681 VYBNRFOHBQMCFN-CJFMBICVSA-N 441.620 4.072 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1766614548 OAEZHYKUFKXKIG-SIKLNZKXSA-N 441.620 4.418 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Cc3cccnc3)c3ccc(Cl)cc3)CC2)cc1 1858086341 GTVFNMWXARCPTH-XMMPIXPASA-N 435.955 4.419 10 10 IICE CC(C)CN1C(=O)/C(=C\c2ccc(OCC(=O)NC3CCCCC3)cc2)SC1=S 1871287235 LLRURTMXRHJEKC-XDHOZWIPSA-N 432.611 4.372 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2ccc(Br)cc2O)CC12CC2 2115364489 GUKUIDCSEXDGCB-CQSZACIVSA-N 425.367 4.424 10 10 IICE COCCNCc1ccc(N(C)[C@@H]2CC[C@@H]2OCc2ccccc2)cc1Br 2156444831 KJLPZILIZROKMM-YADHBBJMSA-N 433.390 4.369 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381126209 OZLIMUURGKRCDK-VBKZILBWSA-N 441.366 4.163 10 10 IICE CCCCc1ccc(N2C(=O)S[C@@H](CC(=O)Nc3ccc([N+](=O)[O-])cc3O)C2=O)cc1 16926406 UBKADRRRXIPNFN-SFHVURJKSA-N 443.481 4.240 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc(Cl)cc3)C(=O)N=C2O)c(C)n1C[C@H]1CCCO1 59109243 AMHOPJQJJDVHJJ-NPBUNYCVSA-N 427.888 4.444 10 10 IICE Oc1ccccc1CN(C[C@H](O)COc1c(Cl)cccc1Cl)C[C@@H]1CCCO1 98072159 LEDOHLRWNCMPRN-IRXDYDNUSA-N 426.340 4.120 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(OCc4c(C)noc4C)cc3)CC2)cc1 108428518 BHICNSGDQIBXEI-UHFFFAOYSA-N 435.524 4.232 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3CC(=O)N(c4ccc(Cl)cc4)C3)cccc21 170557070 WEMJZDBSLQBUSA-AWEZNQCLSA-N 444.874 4.107 10 10 IICE CCOc1cc(/C=C2/SC(N)=NC2=O)ccc1OCC(=O)Nc1cccc2ccccc12 210902665 YAHNXSAFMNYURY-FYJGNVAPSA-N 447.516 4.185 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)cc1Br 705883926 UDGKUCKUXPJMKO-WQJYWUQFSA-N 426.402 4.255 10 10 IICE O=C(NC1CCN(C(=O)c2ccccc2)CC1)N(Cc1ccco1)Cc1ccccc1O 726087093 PWWDHKTZWGDNJK-UHFFFAOYSA-N 433.508 4.002 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2cccc(Cl)c2)cs1 727248565 HUFRLUHQJRXIAN-UHFFFAOYSA-N 426.903 4.261 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)/C=C\c3ccc(F)cc3)cc2)cc1 747593885 IBXDVMONARMFRW-PFONDFGASA-N 446.525 4.348 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)c(F)c1 748012422 JANFZEDSTOBJBY-LLVKDONJSA-N 438.477 4.024 10 10 IICE COc1cc(OC)cc(N2CC[C@H](CN[C@@H](C)c3cc(Br)ccc3O)C2)c1 756649406 GTXYULLVHFUISI-LSDHHAIUSA-N 435.362 4.349 10 10 IICE C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 775940082 FUITZYQPBPKAIE-FZMZJTMJSA-N 448.488 4.058 10 10 IICE CCc1cc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c2c(C(C)C)noc2n1 801097253 IIRQAFGBNSWVTM-UHFFFAOYSA-N 426.492 4.019 10 10 IICE COc1cc(N2CCN(C(=O)[C@H](CCc3ccccc3)C(C)C)CC2)cc(OC)c1OC 816100945 ZUTRBHPMRHZUKQ-JOCHJYFZSA-N 440.584 4.266 10 10 IICE COc1ccc([S@@](C)(=O)=NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1134005365 LVLNQCJKBRDRCI-WJOKGBTCSA-N 439.581 4.100 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](N3CCCC3)CC2)c(C)n1-c1ccc(Br)cn1 1136844913 YLXCUDQIRFCVIS-LJQANCHMSA-N 445.405 4.342 10 10 IICE COc1ccc(C(=O)C[C@H](C)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1137081315 CZWUYJATMSHKOZ-WMZOPIPTSA-N 446.494 4.291 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCO[C@H]2c2ccc(O)nc2)c(C)n1-c1ccc(Cl)cc1 1171079421 JDPAMOSBDLSXPV-OFNKIYASSA-N 425.916 4.037 10 10 IICE CCOc1ccc(N(CC(=O)Nc2sc3c(c2C(=O)OC)CCC3)CC2CC2)cc1 1175372664 XNHQDCPDFDKIDJ-UHFFFAOYSA-N 428.554 4.277 10 10 IICE Cc1cc(CN(C)CCCOc2cccc(S(C)(=O)=O)c2)ccc1N1CCCCC1 1190635821 RHQLCBPOBTWSQJ-UHFFFAOYSA-N 430.614 4.290 10 10 IICE COC1CCN(c2ccc(CN3CCC(Oc4ccc([N+](=O)[O-])cc4)CC3)cc2)CC1 1191232888 JZRJBYLDJSPICW-UHFFFAOYSA-N 425.529 4.253 10 10 IICE C[C@@H](NC(=O)N1CCN(c2c(F)c(F)c(F)c(F)c2F)CC1)c1ccc(N(C)C)cc1 1226647150 PTAXWVXZKYRJBC-GFCCVEGCSA-N 442.432 4.041 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)Cc1cc2c(cc1OC(F)F)OCO2 1251981622 OAVSGADOXUVZDJ-HNNXBMFYSA-N 449.498 4.164 10 10 IICE Cc1ccc(-c2nnc(N(C)CCC(F)(F)F)n2Cc2ccc(N(C)C)c(F)c2)o1 1289545791 CDTGCEOCKYRWQZ-UHFFFAOYSA-N 425.430 4.489 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccc3nc(O)n(CC(F)(F)F)c3c2)C2CC2)cc1 1290739712 HQOQVKCNVAYQNX-UHFFFAOYSA-N 432.446 4.175 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc([N+](=O)[O-])c1Cl 1292593170 CFUNDDCDYFOKAM-UHFFFAOYSA-N 425.819 4.248 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(S(C)(=O)=O)c(Cl)c1 1292929877 GDRGZCJOYSRKJU-UHFFFAOYSA-N 430.913 4.216 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3C[C@@H]3CCCCC(F)(F)C3)CC2)cc1F 1300248141 VLBHNHFHYUEBAA-QGZVFWFLSA-N 437.510 4.276 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCC1(C)C 1305726989 XABHRHOQUYYXEG-GOSISDBHSA-N 427.593 4.365 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C=C\c1ccc(I)o1 1351672085 CHNNYYSRINTLCQ-LUAWRHEFSA-N 436.293 4.156 10 10 IICE COC(=O)CC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1447232145 HXKRDXLYYNRPTP-DEOSSOPVSA-N 446.547 4.130 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CC[C@]3(CO[C@@H](C)[C@H]3C)O2)c(C)n1-c1ccc(Cl)cc1 1462838651 HMINLPVUKQKIAT-CXJARPSQSA-N 430.976 4.379 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Br)ccc2C2CC2)N(C)C)cc1 1463279404 IAFAXHGPKKLPCN-OAQYLSRUSA-N 430.390 4.425 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2CCC(C)CC2)c(C)n1-c1ccc(Br)cn1 1464555788 XDURLVFPMGVLMX-MRXNPFEDSA-N 433.394 4.102 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)Nc2csc(S(N)(=O)=O)c2)cc1 1471293745 DIKOUQXKUOSXTD-UHFFFAOYSA-N 429.527 4.129 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2c(C)nn(C)c2C)n1Cc1ccc2c(c1)CCCN2C 1512801841 OIOUBFCOYOPJHY-KRWDZBQOSA-N 435.620 4.209 10 10 IICE CCN(c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1515434883 OPRPWJRWPAMFLH-UHFFFAOYSA-N 425.602 4.050 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H](C)C3)nnc2[C@@]2(OC(C)C)CCOC2)cc1 1515527996 FHCXUZORQBBIRH-CJFMBICVSA-N 441.620 4.059 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@@H]2CCOC[C@H]2OC)sc(C)c1-c1ccc(F)cc1 1531749815 NVLAHPQGFZBKBM-DOTOQJQBSA-N 435.517 4.419 10 10 IICE COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1532125137 ZQLRXZIXSHTJTL-QHCPKHFHSA-N 436.939 4.417 10 10 IICE Cc1cc(CNC(=O)[C@@]2(CNC(=O)OC(C)(C)C)CCCOC2)c(C)n1-c1ccccc1 1535142449 BCZFLMOWKPNEHH-RUZDIDTESA-N 441.572 4.032 10 10 IICE COC(=O)CCCc1csc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n1 1545421810 NVCPFAXMMPWPCO-UHFFFAOYSA-N 439.537 4.040 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1C[C@@H](Oc2ccccc2)C1(C)C 1565127649 ZBXJGZUJRJIIDQ-BJKOFHAPSA-N 437.584 4.035 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCNC(=O)[C@H]3c3ccccc3C)c2C)c1 1565193254 SZHQZCTWKVSSHA-XMMPIXPASA-N 430.552 4.094 10 10 IICE CC(C)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1[N+](=O)[O-] 1566357018 VGKWHISWXAUCCJ-GOSISDBHSA-N 431.920 4.472 10 10 IICE Cc1cc(C(=O)NCCc2ccc3c(c2)CCO3)c(C)n1-c1ccc(Br)cn1 1567559117 GYMDGHXLNHZUQL-UHFFFAOYSA-N 440.341 4.159 10 10 IICE CC1CCN(c2ccc(CNC(=O)Cc3ccc(I)cc3)cc2)CC1 1585540008 ARIOUMZUOOGXPS-UHFFFAOYSA-N 448.348 4.386 10 10 IICE Cc1cc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)n(C)n1 1612470746 VPIXPOXIMMOTGW-UHFFFAOYSA-N 435.620 4.194 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCC[C@@H]2CSC)cc1 1615380945 NLRSWWDMIYTOAY-PZJWPPBQSA-N 429.634 4.008 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(NC(=O)c2ccsc2)CC1 1625575950 HWQNJBGTBHEKGA-UHFFFAOYSA-N 435.549 4.003 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(NC(=O)CCN(C)C)cc1 1625815189 VRRGIPWAURJLRR-UHFFFAOYSA-N 432.524 4.049 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(C)c(Br)c1C 1631534409 YSMSYEGXSMYDET-UHFFFAOYSA-N 440.721 4.240 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](F)CN(Cc1ccccc1)Cc1ccccc1 1633818422 HVRWJUHHAJVDLB-AUSIDOKSSA-N 436.527 4.186 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cc1c(Br)cnn1C 1637244273 ZMCGYCQXUISJAM-OAHLLOKOSA-N 428.330 4.221 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(O)cc1 1638142472 QNUQDKCNPOZWFW-QFIPXVFZSA-N 426.900 4.026 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H](c3ccc(F)c(F)c3)C2)N(C)C)cc1 1638918246 SOPXOXKOTTVHHT-CVDCTZTESA-N 430.543 4.223 10 10 IICE CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1642155088 DDSPDKWUGZIATH-UHFFFAOYSA-N 443.975 4.216 10 10 IICE Cc1ccc(NCCNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)nc1 1652428682 JGAXZTQPVVNQEC-UHFFFAOYSA-N 427.346 4.402 10 10 IICE COC1CCN(c2ccc(CN3Cc4ccc(NC(=O)C(F)(F)F)cc4C3)cc2)CC1 1654214926 DKJNCZBKAYUHCF-UHFFFAOYSA-N 433.474 4.318 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@](O)(c2ccc(Cl)cc2)C1 1673745310 SWECTVJQGVDPMQ-HOYKHHGWSA-N 429.992 4.339 10 10 IICE Cc1cc(CNC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1684479256 UXOJKVAIUDQCAA-LJQANCHMSA-N 426.561 4.150 10 10 IICE CC1(C)CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1692861727 SUOWQIULKZNCCN-UHFFFAOYSA-N 439.648 4.459 10 10 IICE CC(C)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1706292894 NUKAHHHUIXYEMI-UHFFFAOYSA-N 425.621 4.285 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@H](C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1707274211 SRZVWMIMFHNQBN-KDURUIRLSA-N 437.588 4.127 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CC[C@@H](CN2CCCCC2)C1 1707305130 QTRWFMQWTROHPS-QFIPXVFZSA-N 438.664 4.212 10 10 IICE Cc1cccc(CCCn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)n1 1742339464 MXFPRHAKBTYVHT-UHFFFAOYSA-N 448.615 4.211 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@]2(C)CCCS2)cs1 1742565024 DXPWCRIHOSNNRQ-NRFANRHFSA-N 429.615 4.262 10 10 IICE Cc1occc1CN(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)c(F)c1 1761625062 YMYQWXRTXDPJNS-UHFFFAOYSA-N 434.519 4.055 10 10 IICE C[C@H]1CN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C[C@H](C)S1 1763102947 VAWUMJYPCGWZPJ-GJZGRUSLSA-N 434.660 4.253 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)[C@@H]2CCSC2)cc1 1764938198 GRLQZKHMWMCGTD-RTWAWAEBSA-N 429.634 4.356 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1C 1768309981 NJHPHKMRCGMIGZ-DDZAJARCSA-N 439.629 4.356 10 10 IICE Cn1cc(Nc2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)cn1 1769022153 YCFMRHJLOPLFDD-UHFFFAOYSA-N 429.550 4.124 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4cccc5ccccc45)n(C)n3)CC2)cc1 1862369869 KTFIVDWNGQVQEU-UHFFFAOYSA-N 426.520 4.211 10 10 IICE C[C@H]1C[C@H](C)CN(c2nc(=Nc3cc(Cl)ccc3O)nc(N3C[C@@H](C)C[C@@H](C)C3)[nH]2)C1 1871732290 AYPBGQYPPFTKCN-LUKYLMHMSA-N 445.011 4.361 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4ccc5c[nH]nc5c4)cc3)CC2)cc1 1872884260 NSDJSLMAEGQGPZ-UHFFFAOYSA-N 441.535 4.146 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@H](NCc1ccc(Cl)cc1O)CO2 2160182995 RGRDQWAWSMULFZ-FQEVSTJZSA-N 430.932 4.096 10 10 IICE COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)C1=Cc1ccc(C(=O)OC)cc1 2297315356 NYRSTSRXPPDAQU-UHFFFAOYSA-N 425.868 4.312 10 10 IICE CCSC1=NSC2=NC(=O)C(=Cc3cc(C)n(-c4ccc(OC)cc4)c3C)C(=N)N12 2297333780 QSFUEAGTOPHCNP-UHFFFAOYSA-N 439.566 4.433 10 10 IICE CCCOC(=O)c1cccc(N2C(=O)C(=Cc3ccc4c(c3)OCO4)SC2=S)c1 2321718034 MBOYSBKBUWSHFU-UHFFFAOYSA-N 427.503 4.388 10 10 IICE Cc1ccc(CN(C)C(=O)C2(C)CC(NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380786375 JSJGQWDDENSJRP-UHFFFAOYSA-N 441.366 4.115 10 10 IICE O=C1N=C(O)/C(=C\c2ccc(N3CCOCC3)cc2)C(=O)N1c1ccc2ccccc2c1 1153698 MCFCLWUNIHXTOW-PXLXIMEGSA-N 427.460 4.183 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3ccccc3C)C2=O)cc1OC 33322409 BCMMVXPBTUDXDQ-CPNJWEJPSA-N 442.562 4.242 10 10 IICE O=C1/C(=C\c2ccccc2)SC(=S)N1CCCCCC(=O)N1CCCC[C@@H]1CCO 33544396 DNOHGBBVRNMVBK-WENBPLFZSA-N 446.638 4.212 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccccc3O)SC2=S)cc1 83303834 NBTJHUJIRNJENQ-QGOAFFKASA-N 428.535 4.021 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)CCc2ncc(-c3ccccc3F)o2)cc1 97012563 POCKOMQFHQIJPK-UHFFFAOYSA-N 433.487 4.363 10 10 IICE COCCNCc1ccc(N2CC[C@@H](COCc3ccccc3)C2)c(Br)c1 384158535 FMCWLDSLCZQHIM-HXUWFJFHSA-N 433.390 4.228 10 10 IICE Cc1c(NC(=O)N2CCOc3cc(N(C)C)ccc32)cc(Br)cc1[N+](=O)[O-] 435325870 BENRWMPCQAEHAL-UHFFFAOYSA-N 435.278 4.163 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC[C@H]3CCN(C(=O)OC(C)(C)C)C3)ccc21 730249295 BSTXDUYVCRXFBX-IBGZPJMESA-N 443.588 4.281 10 10 IICE Cc1cc(C(=O)[C@@H](C)OC(=O)/C=C\c2ccncn2)c(C)n1-c1ccc(OC(F)F)cc1 754921558 GUJUYYDMLNUOHF-VCELZJIISA-N 441.434 4.313 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCc1cc2ccccc2nc1O 767710319 AHEFYZKWJSCZDT-UHFFFAOYSA-N 429.314 4.390 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 768237139 KUGHVQPUAOGSCU-JTHBVZDNSA-N 429.605 4.135 10 10 IICE CC(C)OCc1ccc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768879799 XYWPNGNJWZVYQC-UHFFFAOYSA-N 436.600 4.465 10 10 IICE CC(C)N1CC[C@@H](NC(=O)NCCCSc2nccs2)[C@@H]1c1ccc(F)c(F)c1 779364763 RGYKUSCVFGUBFO-MSOLQXFVSA-N 440.585 4.427 10 10 IICE CCOc1ccc(O)c(CN[C@@H](CO)c2ccc(Br)cc2C(F)(F)F)c1 793369472 IEUYRZFVAQZHRX-INIZCTEOSA-N 434.252 4.395 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc4c(c3)nc(C(F)F)n4C)c2)CC1 798987463 VPIZJRSERXRBLF-UHFFFAOYSA-N 427.499 4.294 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC)C[C@]2(CCOC2)O1 801947556 YUIAUPAQYHDAQC-BWKNWUBXSA-N 435.572 4.147 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cc(F)ccc1OC[C@H]1CCCO1 806262153 XQRNBNKPXFSLDW-OAHLLOKOSA-N 439.281 4.173 10 10 IICE CC(=O)Nc1ncc(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)s1 808526164 LMGKLOYNOMYCBB-UHFFFAOYSA-N 430.536 4.179 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2c2nnc(CC(F)(F)F)o2)c(C)n1-c1ccccn1 811558720 QCGGBNCTDVQINZ-INIZCTEOSA-N 433.434 4.344 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3c(C(F)F)nc4cnccn34)cc2Cl)C1 1128490636 XJSUYGMHXOCUFP-CYBMUJFWSA-N 433.890 4.487 10 10 IICE CCc1c(Br)cc(C(=O)NCc2ccc(O)cc2O)cc1Br 1142533602 MSNMSGRFWAZFEI-UHFFFAOYSA-N 429.108 4.115 10 10 IICE CCc1ccc(O)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1147508024 UBVANQIYDBWECX-HXUWFJFHSA-N 427.545 4.016 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCc3nn(C)cc32)c(C)n1-c1ccc(Br)cc1 1155745988 KGVFLXOOZOLYFB-IBGZPJMESA-N 427.346 4.398 10 10 IICE CC(C)(CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C(F)(F)F 1270087213 LAOBODZJXBVPDU-UKTHLTGXSA-N 434.480 4.122 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN(C(C)C)C(C)C)n1 1304457111 YJGXWSJWQMJKJH-UHFFFAOYSA-N 436.604 4.499 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)ncn4C)cc2Cl)C1 1312588923 AOSQTWGJPMYXND-INIZCTEOSA-N 425.964 4.462 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccon2)cc1 1313680097 SBMDWQIBSMEABL-UHFFFAOYSA-N 436.585 4.449 10 10 IICE COc1cc(Br)ccc1[C@H](C)NCc1ccc(N2CCN(C)CC2)c(F)c1 1343413148 APBKFXWMUNOZKR-HNNXBMFYSA-N 436.369 4.199 10 10 IICE CC(C)CCN(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1359919147 YBIKZRCMQDUHTM-OAQYLSRUSA-N 443.661 4.256 10 10 IICE COc1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1OC(F)F 1360068967 RUDXXYJSMJTEDP-UHFFFAOYSA-N 446.416 4.496 10 10 IICE CC[C@@H]1CCCC[C@H]1OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1444501314 HRXXBBQKBCGJBK-STZQEDGTSA-N 447.620 4.420 10 10 IICE CSc1cc(O)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1449033791 WZKUHYNYFCOZHH-YVLHZVERSA-N 448.566 4.483 10 10 IICE COc1ccc(-c2nc(C)sc2CC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1461491470 CSLZOOPBAFGLGW-SFHVURJKSA-N 437.565 4.073 10 10 IICE CC[C@@H]1CN(C(=O)OCc2ccccc2)[C@H](CC)CN1C(=O)/C=C/c1ccc(O)c(O)c1 1465267163 GQJQZJQBPZYXQQ-NGSBPTJYSA-N 438.524 4.149 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](OCCN3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1465871596 YKLOHPLNVZVLHS-HSZRJFAPSA-N 429.992 4.003 10 10 IICE CCOC(=O)C1(CC(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)CCOCC1 1466398257 FKTULZHOIPHZDL-LJQANCHMSA-N 425.525 4.232 10 10 IICE Cc1cc(C(=O)N2CCN(C)C3(CCCCC3)C2)c(C)n1-c1ccc(Br)cn1 1468226004 VALOHVNRNSXFDI-UHFFFAOYSA-N 445.405 4.342 10 10 IICE O=C(NCCCOc1ncc(C(F)(F)F)cc1Cl)NCc1cccc(Cl)c1O 1469686865 XGNUBTMGONXVDG-UHFFFAOYSA-N 438.233 4.381 10 10 IICE CCCOc1cncc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1532678888 JTPILWYWTNMYQW-VCHYOVAHSA-N 445.541 4.240 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1NCC(F)(F)F 1542113193 QUDCKNCCVSYMOE-UHFFFAOYSA-N 445.844 4.220 10 10 IICE CCc1ccc(OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 1544269809 WJWPFOJERNSIBC-QFIPXVFZSA-N 441.572 4.076 10 10 IICE CCC[C@H](Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1546910789 ACOJQYBIIRDLRH-HSZRJFAPSA-N 441.620 4.476 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(CNC(=O)OC(C)(C)C)n(C)c1C 1557063067 CIXJWQIZEUXJTP-KRWDZBQOSA-N 442.604 4.094 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1 1565099758 BVCPJEPDZAZLOT-DNQXCXABSA-N 434.584 4.169 10 10 IICE CO[C@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(Br)s1 1566685784 DXNFPKRTWHRSRR-KDOFPFPSSA-N 440.359 4.112 10 10 IICE COc1cccc(O)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1566846053 LETSXKBFRCQPKQ-UHFFFAOYSA-N 431.536 4.018 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)c1 1584715507 XVCUGLXFJMMGJF-UHFFFAOYSA-N 425.529 4.036 10 10 IICE CCOc1ccc(CN2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1587628889 DYRHOVFHGYKVMB-UHFFFAOYSA-N 431.580 4.380 10 10 IICE Cc1cc(-c2nnc(N3CCOCC3)n2CCCOC(F)(F)F)c(C)n1-c1ccccc1 1611936287 VOSAFPZXENFXLW-UHFFFAOYSA-N 449.477 4.116 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CS[C@H]3CCOc4ccccc43)cc2F)C[C@@H](C)O1 1613616998 DKRDVZCOPUUVLE-QZMQVMSPSA-N 444.572 4.313 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(c3ccc(Br)cc3)CC2)cc1 1617498277 GRYQZZGUZDHUSV-UHFFFAOYSA-N 430.390 4.011 10 10 IICE Cc1ccc(-c2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)cc2)nn1 1627204974 JDVRIXAYDQEARV-XMMPIXPASA-N 430.552 4.339 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C\c2cc(Br)c(O)c(OC)c2)cc1 1630469790 KZCSCBPRLMCIED-FLIBITNWSA-N 433.346 4.339 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C=C(/C)c3ccc(C(F)(F)F)cc3)CC2)cc1 1631442994 PJXDLHQYDIMITQ-ZCXUNETKSA-N 447.501 4.056 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(OC)cc1 1636364262 KMDHIFHEONUWLZ-OAQYLSRUSA-N 426.900 4.400 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)CCCNC(=O)OC(C)(C)C)ccc21 1637524903 HQOGZFWKHRCASS-INIZCTEOSA-N 431.577 4.328 10 10 IICE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)NCc1ccc(N2CCCCC2)cc1 1638694287 UDSWHFMHMRMOPK-QGZVFWFLSA-N 436.581 4.264 10 10 IICE O=C(CCCOc1ccc(I)cc1)NCc1cc(Cl)ccc1O 1639965430 JAXNVOQMJMRZRP-UHFFFAOYSA-N 445.684 4.126 10 10 IICE Cc1ccc(C(=O)Nc2cnn(Cc3ccc(Br)cc3Cl)c2)c(O)c1O 1642280204 BRYJQHVBORAMTA-UHFFFAOYSA-N 436.693 4.319 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](CCNC(=O)OC(C)(C)C)C3)ccc21 1648143246 ULOVXCJRJKMNFX-LJQANCHMSA-N 443.588 4.281 10 10 IICE CCc1ccc(N2CCN(c3ccc(/C=C\C(=O)OC)cc3[N+](=O)[O-])CC2)cc1Cl 1651843008 IWODCVKLLWZAHT-UITAMQMPSA-N 429.904 4.323 10 10 IICE COC(=O)c1cnc(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)s1 1652042726 CXBABECYFVSVTE-UHFFFAOYSA-N 448.342 4.030 10 10 IICE CCOc1cc(CN(C)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)ccc1OC(F)F 1682645978 LWHDUWQPMSQLNB-QGZVFWFLSA-N 449.498 4.116 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)CCn3cc(Br)cn3)c2C)c1 1684600200 QODZRUWGZNPDMW-UHFFFAOYSA-N 444.377 4.203 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccccc3SC(F)(F)F)CC2)cc1F 1684640755 ZXJHIDAXZSOMNZ-UHFFFAOYSA-N 443.466 4.478 10 10 IICE CCN(Cc1cccc(-c2ccncc2)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1687441385 LFPBRKDXUKFWLX-UHFFFAOYSA-N 443.595 4.232 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710056101 ALWGTDYHQKSHKR-HXUWFJFHSA-N 442.627 4.357 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)C2CCC3(CC2)OCCO3)nnc1C(C)(C)C 1742141678 LISDSZSWYAPRHT-UHFFFAOYSA-N 441.620 4.120 10 10 IICE CC1CCN(c2ccc(Cn3c([C@H]4CCOC4)nnc3N(C)CCC(F)F)cc2)CC1 1743125062 DWJVVJQAYMIVPC-IBGZPJMESA-N 433.547 4.158 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1 1745777993 OFLWVWDWBKJQFE-KDURUIRLSA-N 448.615 4.361 10 10 IICE CN(CC1CCCCC1)c1nnc(CN2CCCC2=O)n1CCCSc1nccs1 1747839973 PPMFVZFUXBWIBK-UHFFFAOYSA-N 448.662 4.056 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1conc1COC 1763499184 LYZUSLKZNMGFGD-GOSISDBHSA-N 438.576 4.211 10 10 IICE COc1ccc(CC(=O)N(c2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)cc1OC 1859892108 ZMDIBSYIVKXJKX-UHFFFAOYSA-N 443.499 4.463 10 10 IICE Cc1ccc([C@@H](C)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c(O)c1 2084722861 TVSUZTCQYAVNNU-IFMALSPDSA-N 439.600 4.473 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(Cc3ccccc3)CC(F)(F)C2)c1O 2236056730 XGMMEVFZMGGFNG-OAHLLOKOSA-N 441.316 4.163 10 10 IICE CC[C@H](C)Oc1ccc(C=C2C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1Cl 2294196281 JPEMFESXJMJHJY-LBPRGKRZSA-N 432.904 4.488 10 10 IICE Cc1ccc(N2CCN(C3=NC(=O)C(=Cc4c[nH]nc4-c4ccccc4)S3)CC2)cc1 2296928308 BQIRLOXWDIBZAZ-UHFFFAOYSA-N 429.549 4.178 10 10 IICE COc1ccc(OC)c(C=C2SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)c1 2321738520 KPZRYRJKDKQZIN-UHFFFAOYSA-N 447.534 4.135 10 10 IICE COc1ccc(N(C)CN2C(=O)/C(=C/c3ccc(OC)c(OC)c3)SC2=S)cc1 3074901 YUYDCXKFKONCQW-UNOMPAQXSA-N 430.551 4.008 10 10 IICE Cc1cc(C)c2[nH]c(=O)c(/C=C3\C(=N)N4C(c5ccccc5)=CSC4=NC3=O)cc2c1 102470781 VEXYHNJQLSHCFS-SPXSAIPKSA-N 426.501 4.449 10 10 IICE Cc1cc(/C=C2/NC(=S)N(c3ccccc3F)C2=O)c(C)n1-c1cccc([N+](=O)[O-])c1 206126222 GYEQTAPSPOEAIC-YBFXNURJSA-N 436.468 4.404 10 10 IICE COc1ccc2c(c1)[C@@H](NC(=O)Cn1c3c(c4ccccc41)CN(C(C)C)CC3)CCO2 435988834 IRJIUTZYVOAGSO-QFIPXVFZSA-N 433.552 4.056 10 10 IICE CC(=O)NCc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)s1 743153876 SMQOMDCDQPCECI-UHFFFAOYSA-N 438.549 4.448 10 10 IICE O=C(CN1CCOC[C@H]1C[C@H](O)c1ccco1)Nc1ccc(N=Nc2ccccc2)cc1 763664054 KLIOMGRDKCDDPO-YADHBBJMSA-N 434.496 4.458 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](C)Cn3ncc4ccccc4c3=O)c2C)c1 765251173 ZOZKXCMHKYYMQJ-SFHVURJKSA-N 428.536 4.239 10 10 IICE CCCN(Cc1ccccc1O)C(=O)C(F)(F)C1CCN(C(=O)OC(C)(C)C)CC1 774045860 ZPKIAFQXOXLPNG-UHFFFAOYSA-N 426.504 4.413 10 10 IICE CC(=O)c1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1Cl 783562929 ISVSTFCDXLKBKK-UHFFFAOYSA-N 448.818 4.479 10 10 IICE COc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)c(OC)c1 800573060 CBHGJXWUOVKTMD-GJZGRUSLSA-N 431.508 4.087 10 10 IICE O=C(Cc1cscc1Br)NC1CCN(c2ccc(OC(F)F)cc2)CC1 814407766 LEDMIWDNVXVQJK-UHFFFAOYSA-N 445.329 4.440 10 10 IICE Oc1ccc(Br)cc1CNC[C@H]1CN(Cc2ccccc2)CC12CCOCC2 815149373 KTFLHWLGFQYRLL-FQEVSTJZSA-N 445.401 4.173 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c(C)n1-c1ccccn1 856660195 PEUIKXWVWIWYIS-HSZRJFAPSA-N 447.583 4.018 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccccc3N3CCOCC3)cc2Cl)C1 1128384076 IYBRQPYGHTYQGH-SFHVURJKSA-N 427.976 4.343 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccsc1 1132426941 UBSXZVASWCNNET-XYKNNLTJSA-N 432.567 4.151 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(F)cc([N+](=O)[O-])c1Br 1135800626 JTGGFMLTRSTWDG-UHFFFAOYSA-N 436.281 4.369 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1nc(Br)c2ccccn12 1135964796 OHWRMNWOZXLKSQ-UHFFFAOYSA-N 427.346 4.359 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(OCc4cccs4)c3)CC2)cc1F 1137423245 ZEWMVWSGQSBCMJ-UHFFFAOYSA-N 426.513 4.437 10 10 IICE CC(C)C(=O)Nc1cc2ccccc2cc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1141901102 BWXDORBDSFRXNW-UHFFFAOYSA-N 449.526 4.340 10 10 IICE CC1(C)C[C@@H](C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc2O1 1150349044 VLZLNZXQQXQOLA-AZUAARDMSA-N 428.960 4.471 10 10 IICE Cc1ccc(C(=O)Nc2nc(Br)ccc2O)cc1-n1c(C)cc(C=O)c1C 1154597818 MVYNCEPKLWITGK-UHFFFAOYSA-N 428.286 4.330 10 10 IICE CC1(C)[C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C[C@H]1OCc1ccccc1 1235188714 XUPDIHHQJCQXLQ-QPTUXGOLSA-N 438.568 4.467 10 10 IICE Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1246508574 LBUIPEGGNSVVPS-NRFANRHFSA-N 434.506 4.240 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@]3(C)Cc3ccccc3F)C2)cc1 1252115911 NTLDIAZLYQKMND-CLOONOSVSA-N 425.548 4.467 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCS[C@H](C)[C@H]1C 1289424542 XTCICKBOWRXDRW-OPYAIIAOSA-N 429.634 4.273 10 10 IICE Cc1cc(C(=O)NCC(C)(C)N2CCCCC2)c(C)n1-c1ccc(Br)cn1 1289999115 WOZZJNJKFXWMRR-UHFFFAOYSA-N 433.394 4.246 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc(NCCn3ccnc3)cc2)cc1 1290756464 FZMGRWAKTIJLES-UHFFFAOYSA-N 443.551 4.497 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc3ccn(C)c3c2)NC(=O)OC(C)(C)C)cc1 1293793231 MHVAFXGMVNYWKV-NRFANRHFSA-N 436.556 4.240 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)/C(=C/c3ccc(O)c(OC)c3)c3ccccc3)C2)cc1 1300633914 NMYKVGYRPBRETR-KCOUNZPASA-N 444.531 4.345 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1302699915 DTOUQSNWCBGEKH-XLIONFOSSA-N 433.597 4.105 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccsc1 1304238226 MSPJLLMPLTVGDD-UHFFFAOYSA-N 432.597 4.385 10 10 IICE CCOC(=O)CN(CC(=O)N[C@H](c1ccccc1)C1CCCCC1)Cc1ccccc1O 1307862259 BLYXXHXCUARVOP-AREMUKBSSA-N 438.568 4.195 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3c(cccc3C(F)(F)F)C2)N(C)C)cc1 1313394135 JMZHFVCRYZGLLQ-NRFANRHFSA-N 434.506 4.142 10 10 IICE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1352744434 NYCMJQWRJCRYMM-INIZCTEOSA-N 436.581 4.214 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3sc4c(c3C(=O)OC)CCC4)ccc21 1355335640 QELMXCBOEWQNAQ-UHFFFAOYSA-N 426.538 4.494 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c(C)nc(-c4ccco4)nc3SC)C2)cc1 1436970541 JPEQUBKOHXQDIY-INIZCTEOSA-N 438.553 4.032 10 10 IICE Cc1cc(C)c2c(c1)N(CC(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)CCC2 1459723541 SWJPHGFINZEOSC-WOJBJXKFSA-N 439.575 4.125 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(-c2ccccn2)nc2ccccc12 1469231263 XJBUUYIMLAXYTL-UHFFFAOYSA-N 441.487 4.208 10 10 IICE Cc1cc(CC(=O)NC[C@H](NCc2ccccc2)C(F)(F)F)c(C)n1-c1ccccc1 1472567616 GLWMCLGFSUKSQF-QFIPXVFZSA-N 429.486 4.474 10 10 IICE COc1ccc(Cl)c(N2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1478841145 PZSGZBFBKZGCAV-GOSISDBHSA-N 445.007 4.186 10 10 IICE COc1cccc(CC2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CC2)c1 1479535291 UDKMMYAQNKMOHF-VWLOTQADSA-N 438.616 4.028 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)C[C@H]2CCCCO2)cc1F 1503393797 LOQAERGZFDIMDT-HXUWFJFHSA-N 429.584 4.270 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@](C)(O)[C@@H](C)CC 1513018133 LMITYLAKWNBWDO-XFAGBWLFSA-N 447.599 4.063 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H](OC)C(C)(C)C)CC2)cc1F 1518310360 WCOGDQURSCORHK-HXUWFJFHSA-N 447.599 4.111 10 10 IICE COC(=O)c1ccn(CC(=O)Nc2nc(-c3cc(C)n(-c4ccc(C)cc4)c3C)cs2)n1 1523937118 OMCYXFZEBGIGJC-UHFFFAOYSA-N 449.536 4.148 10 10 IICE COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)CO2 1524245226 KLAUHZVFVJNQIG-VQIMIIECSA-N 428.960 4.452 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(C(=O)Nc4ccccc4)cc3)C2)cc1 1529705941 CZDWJSCCJJXCNQ-IBGZPJMESA-N 429.520 4.204 10 10 IICE C[C@H](NC(=O)c1cnn(Cc2ccccc2)c1Br)c1ccc(N(C)C)cc1 1537680244 RMNBIRAOBIFUHD-HNNXBMFYSA-N 427.346 4.251 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)[C@H]1c1ccc(OC)cc1 1538976886 TXBLFNMIXOMPGX-VVMVZBAXSA-N 437.584 4.328 10 10 IICE CC1CCN(c2ccc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cn2)CC1 1545632865 XSNMZANAXXDJJK-NRFANRHFSA-N 442.991 4.071 10 10 IICE Cc1c(F)ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1N 1546150131 FNPLIHKPTXSHGA-UHFFFAOYSA-N 432.543 4.333 10 10 IICE CCN(CC)c1nnc([C@@H]2COc3ccccc3O2)n1CCCSc1nccs1 1547463041 VGCJBONNRGHKQV-KRWDZBQOSA-N 431.587 4.276 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(CO)(Cc3ccccc3)CC2)cc1 1568248971 IBHBISWZVIXIBV-UHFFFAOYSA-N 444.575 4.293 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccnn2Cc2ccc(F)cc2)cc1 1584858764 MVIIOLCALVEHNZ-UHFFFAOYSA-N 430.483 4.472 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(CC(F)F)CC2)n1Cc1ccc(N(CC)CC)cc1 1613331045 WUZNEDJABUBACD-GOSISDBHSA-N 434.579 4.073 10 10 IICE CCn1cc(CN(C)c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)cn1 1615695095 VNBIQFDMMIWCIO-QGZVFWFLSA-N 447.634 4.011 10 10 IICE CCc1cc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)ccc1Br 1623928007 ANZHOJHHLNTBTB-UHFFFAOYSA-N 440.721 4.186 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CC2(NC(=O)OC(C)(C)C)CCC2)cc1 1627205541 RUUJIHWYOMVMCQ-OAQYLSRUSA-N 445.604 4.098 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(Cl)c(Br)cc1F 1638529712 TYDUSTBAGJMODF-UHFFFAOYSA-N 444.684 4.153 10 10 IICE CCc1nc(C)c([C@@H](C)N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)s1 1641837481 CGFYUIDKHZFDCT-OAHLLOKOSA-N 447.560 4.421 10 10 IICE COC(=O)[C@@H](NCCCNC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)C(C)C 1648792735 ZLGILIZNNRCESG-QHCPKHFHSA-N 427.589 4.125 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@H](CC3CCCC3)c3ccccc3)CC2)cc1 1653967385 GOZAVBRAQHOTKD-XNMGPUDCSA-N 437.628 4.089 10 10 IICE O=C(CCN1CCCc2cc(OC(F)(F)F)ccc21)Nc1cc([N+](=O)[O-])ccc1F 1657612378 BPAAVQILYAHZQO-UHFFFAOYSA-N 427.354 4.414 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCOC3CCSCC3)cc2Cl)C1 1672137679 UWUCXYOLLGXXCM-MRXNPFEDSA-N 426.026 4.288 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1679155637 SRTYBFYCLFKQQC-KRWDZBQOSA-N 444.938 4.026 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H]2c3ccccc3C(=O)N2Cc2ccccc2)c1 1683996167 JQLFSKZXEYYVIC-SBUREZEXSA-N 445.519 4.158 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](CC(C)(C)C(N)=O)C3)cc2Cl)C1 1686268767 HEGFXPNSQULYAT-IEBWSBKVSA-N 449.039 4.400 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](CC)C1 1696424844 TUXNCEUWRHHKGR-UGKGYDQZSA-N 437.588 4.393 10 10 IICE COC[C@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1697858771 RUWDZVUNBOWUKZ-IBGZPJMESA-N 443.592 4.047 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1C[C@H]1CCCCC(F)(F)C1 1711095792 YKWGCQIERYMQMI-INIZCTEOSA-N 430.503 4.236 10 10 IICE CCc1nnc(N2CCC(C)(COC)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1727542054 IQNBPRGMSKRUIH-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCO[C@H](C(F)(F)F)C2)cc1 1728380481 BXDISVAUWQXEPY-IBGZPJMESA-N 439.526 4.139 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1728382090 XMSVSVURYDJFSQ-QFIPXVFZSA-N 436.604 4.039 10 10 IICE CN(OC1CCCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1729562722 REIYIKVHOLIMBS-UHFFFAOYSA-N 441.620 4.143 10 10 IICE Cn1ccc(Nc2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)n1 1729583267 JWEQYFCQKBHLFZ-UHFFFAOYSA-N 429.550 4.124 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1731034604 NDDZITLFQALNMN-QZTJIDSGSA-N 425.602 4.329 10 10 IICE COCCC(C)(C)Cn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1749594030 GCONNRKUBGLTFR-UHFFFAOYSA-N 447.599 4.014 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)CC2CCCCC2)cc1F 1766912315 UDWCVVPIKATROU-FQEVSTJZSA-N 429.584 4.442 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1ccncc1 1771032382 SNNCOMAAXCQJOL-UHFFFAOYSA-N 444.583 4.463 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1Cl 1858074399 ISUOEYKGJPIWEN-JOCHJYFZSA-N 436.021 4.220 10 10 IICE CNc1cc(C(=O)Nc2ccccc2N2CCOCC2)c(Nc2ccccc2)c(F)c1N 1858181487 UHZGPWQRHOMYDU-UHFFFAOYSA-N 435.503 4.282 10 10 IICE O=C(COc1cccc(Br)c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866134404 UDPHESRXNAXJSD-UHFFFAOYSA-N 436.261 4.242 10 10 IICE O=C(N[C@@H]1CC[C@H]1NCc1cc(Cl)cc(Br)c1O)OCc1ccccc1 1977132692 VMQZLKDBVLSBAX-IAGOWNOFSA-N 439.737 4.355 10 10 IICE CN1CCc2cc([C@@H](CN)N(CCCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2074285221 SICDYGVLVWSWOL-XMMPIXPASA-N 438.616 4.096 10 10 IICE CCOC(=O)c1c(C(F)(F)F)nn([C@@H](C)c2ccc(OC)cc2O)c1Br 2079858512 RABKUMZAWNYKDU-QMMMGPOBSA-N 437.212 4.165 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCCCC(=O)O)C2=O)cc1Br 2293188535 LQRCBKVSQCOGDD-UHFFFAOYSA-N 444.372 4.304 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4ccco4)SC3=NC2=O)c(C)n1-c1ccccc1F 2297469398 NMJWOQXCLFCTRZ-UHFFFAOYSA-N 433.468 4.494 10 10 IICE CCc1ccc(Oc2nc3ccccn3c(=O)c2/C=C2/SC(=S)N(CC)C2=O)cc1 39835625 DGMZSSBENTUKJA-GHRIWEEISA-N 437.546 4.270 10 10 IICE Cc1csc([C@H](C)NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 727669173 HUBMQYBSPTZHJF-CJAAZZPWSA-N 437.637 4.372 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@@H]([C@H]2CCCN2C(=O)OC(C)(C)C)C1 734687105 IEIHYGDUVKYWHY-IFMALSPDSA-N 444.620 4.382 10 10 IICE O=C(NCCc1c[nH]c2ccc(F)cc12)NC1CCN(c2ccc(OC(F)F)cc2)CC1 735184347 BHJNGULMDBVSSS-UHFFFAOYSA-N 446.473 4.419 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)s1 810028792 RLCIIQKFVDQPMX-IBGZPJMESA-N 431.602 4.220 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1cccc(F)c1 1128623340 YGURQYKFZZEYAP-GMCOFOQGSA-N 444.528 4.228 10 10 IICE COC(=O)c1cc(Cl)cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1O 1157282333 YRLJICPDVYBCIF-UHFFFAOYSA-N 440.883 4.233 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2C[C@H](OCc3ccccc3)C2(C)C)cc1 1226856093 BHRHTUKDLZECQO-PKTZIBPZSA-N 425.573 4.157 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)C(=O)NCc3ccccc3)cc2Cl)C1 1235835267 VNJGDUYHEHIZAK-ZWKOTPCHSA-N 442.991 4.080 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1 1291849694 KPFRXBRZNNXHDP-UHFFFAOYSA-N 443.491 4.065 10 10 IICE CCCO[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(F)cc1C 1293929387 WFBWDHNJVMMJCS-DEOSSOPVSA-N 428.548 4.127 10 10 IICE C[C@@H](NC(=O)NCc1ccc(Cl)cc1I)c1ccccc1O 1312601697 YUEBPQUJTPFRQI-SNVBAGLBSA-N 430.673 4.211 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCc4c(ccnc4O)C3)nnc2C(C)(C)C)cc1 1313680462 ZSWSHWUBQXVBHU-UHFFFAOYSA-N 434.588 4.133 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](C)Cn2ncc3ccccc3c2=O)c1 1320384513 DKLSQVBHCFMCOT-OAHLLOKOSA-N 434.927 4.276 10 10 IICE CN(C)c1ccc(CN(C(=O)Cc2ccc(I)cc2)C2CC2)cc1 1353229809 UWLCZYWBGDQHCI-UHFFFAOYSA-N 434.321 4.091 10 10 IICE CC(C)CCN(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1359911764 XDNUOKNKHJDQAU-XMMPIXPASA-N 447.599 4.054 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ncsc3Nc3ccccc3)cc2F)CC1 1443591619 LEMTXGMXKFURNJ-UHFFFAOYSA-N 439.560 4.098 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](OC)C(C)C)C1 1517818457 XASWDFTUTQINIU-GGAORHGYSA-N 437.588 4.249 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COCC[C@@H]1c1ccccc1 1524070144 SEPORMMORVTWKD-VLCRHTCISA-N 430.495 4.193 10 10 IICE C[C@H](Oc1ccc(F)cc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015068 CYFLBEQAQMSEQV-KRWDZBQOSA-N 445.966 4.095 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3c(Br)cnn3C)cc2Cl)C1 1530425134 OJGNTPVMPNXNNQ-LBPRGKRZSA-N 425.758 4.002 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3ccc(-c4ccccc4F)o3)CC2)c(OC)c1 1530968495 PJDFELYOLMISCV-UHFFFAOYSA-N 438.499 4.384 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1532104279 ALOBGNMDAMFTLK-HOCLYGCPSA-N 435.337 4.171 10 10 IICE COc1cccc(/C(C)=C/C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1534122977 CBZKJHABOQNHAO-FOWTUZBSSA-N 434.458 4.270 10 10 IICE COC(=O)Nc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(Cl)c1 1534308615 FFXUDJYSFYZNCI-ZIAGYGMSSA-N 449.910 4.201 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCc1cscc1Cl)c2[N+](=O)[O-] 1535105151 SNEYJQHYFKOEFL-UHFFFAOYSA-N 426.837 4.015 10 10 IICE CCOc1ccccc1N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1535562007 WULGKMYGRMQEPZ-RGEXLXHISA-N 444.553 4.479 10 10 IICE CC(=O)c1ccc(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(F)c1 1537173984 MTNZHMHTJSRXQO-VCHYOVAHSA-N 447.484 4.364 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)c1ccc(C(F)(F)F)cc1 1556882014 FUIDGKHGZHKDIA-OAQYLSRUSA-N 430.426 4.389 10 10 IICE Cc1cc(C(=O)NCCOCCN(C)C(=O)OC(C)(C)C)c(C)n1-c1cccc(Cl)c1 1557548510 BCQIPAPMYUBNHA-UHFFFAOYSA-N 449.979 4.361 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@]3(C)c3ccc(C(F)(F)F)cc3)nc12 1560074533 WYHNENOWCBYSBQ-OAQYLSRUSA-N 448.445 4.142 10 10 IICE CC(=O)c1ccc(O)c(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1 1567049505 LSWLRUBGUROHTJ-GZTJUZNOSA-N 446.575 4.276 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(C(F)(F)F)ccc1Cl 1586800740 VOXYMGUFGGUMHD-UHFFFAOYSA-N 426.866 4.498 10 10 IICE Cc1cc(C(=O)N2CCC(c3ncccn3)CC2)c(C)n1-c1ccc(Br)cn1 1596856276 QSLPLCCUXDFGBS-UHFFFAOYSA-N 440.345 4.061 10 10 IICE Cc1cc(C(=O)Cn2cc(Cl)cc(Br)c2=O)c(C)n1-c1ccc(F)cn1 1614549045 ZZIBEUSPINEFAD-UHFFFAOYSA-N 438.684 4.089 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC(C)(COC)CC2)cc1 1615379051 BOSRAEJBVCSRLG-UHFFFAOYSA-N 448.615 4.488 10 10 IICE C[C@@]1(CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1(F)F 1618062402 NOVLCKNZCNGUNE-OJNOIJSXSA-N 430.567 4.281 10 10 IICE COCCN(CC(C)C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)cc1C 1619896349 DMKQZRNSMOBOLW-JOCHJYFZSA-N 429.609 4.051 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccncc1 1625794844 ULPVLDIJDNTGED-RRPNLBNLSA-N 442.607 4.412 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C 1629969641 YZJFGJGXHSTLGZ-CJNGLKHVSA-N 441.366 4.149 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)c2ccccc2)c(C)n1-c1cccc(Br)c1 1639453258 IHXLKKJVQCITLG-JOCHJYFZSA-N 427.342 4.494 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@@H](C)c3cccc4ccccc34)CC2)cc1F 1644919516 QHXKJLCGCMWQSJ-OALUTQOASA-N 435.543 4.375 10 10 IICE Fc1cc(CNc2ncc(Br)cc2C(F)(F)F)ccc1N1CCOCC1 1655001059 VSKULWPEWQHENY-UHFFFAOYSA-N 434.231 4.451 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O 1673046638 RLMCXHVYDKNXCG-UTKZUKDTSA-N 427.520 4.205 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](Oc4ccccc4Cl)C3)C2)cc1 1683337005 ROHCHQZCEVNPRE-YLJYHZDGSA-N 429.948 4.038 10 10 IICE CC1(C)CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c2cccc(Cl)c21 1687632971 WGAXTWDWIHCBCP-UHFFFAOYSA-N 440.975 4.049 10 10 IICE CC(C)CCn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1692367344 HNXHMHMTKAKHTB-KDURUIRLSA-N 443.592 4.437 10 10 IICE CC[C@H]1CCCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)cc2C)C1 1709269749 OVKGEQPAIKQZQV-NRFANRHFSA-N 435.620 4.189 10 10 IICE C[C@H]1N(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCOC1(C)C 1726759635 BAYRWQDJVFKTTN-CVEARBPZSA-N 437.635 4.162 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1726843001 JIYSARJTAXNEHM-UQBPGWFLSA-N 443.636 4.098 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cccn(CC)c1=O 1726878817 TWJRPLJSVKNOOK-HXUWFJFHSA-N 448.615 4.258 10 10 IICE CC(=O)Nc1ccc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)cc1 1860087425 WKVLJNASNJWWEV-LZYBPNLTSA-N 428.564 4.377 10 10 IICE CN(C)Cc1cc([C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)ccc1O 1951626896 ZOCJMBYVHXGQDI-XMMPIXPASA-N 446.503 4.118 10 10 IICE CC(C)(C)OC(=O)N1CC(CCCCNCc2cc(Br)cc(F)c2O)C1 1965930133 SOAAOXQFPQKQSK-UHFFFAOYSA-N 431.346 4.421 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cccc(Br)c2O)[C@@H]2CCCC[C@@H]21 2122806084 WWTZAYWLLNPKIZ-XIRDDKMYSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cc(Br)ccc2O)C[C@H]2CCC[C@@H]21 2335107029 HCVSQYFITFEMMP-COXVUDFISA-N 425.367 4.422 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352675433 GPVRGWGQPLIABY-JONQDZQNSA-N 425.367 4.245 10 10 IICE O=C(NCCCCCNCc1cc(OC(F)(F)F)ccc1O)OCc1ccccc1 2361154950 MORKLZUBPXUFNR-UHFFFAOYSA-N 426.435 4.477 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1/C=C1/SC(=S)N(CC(C)C)C1=O 33490814 AEHZAVKUOHXIDE-SFQUDFHCSA-N 444.626 4.462 10 10 IICE Cc1cc(OC[C@@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)ccc1Cl 40317326 UNVRPWKBZLSYAO-GMAHTHKFSA-N 432.992 4.135 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)OCC(=O)N3)c(C)n1-c1ccc(Br)cc1 195589012 RDOOALATGGWZRC-UHFFFAOYSA-N 440.297 4.440 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CNCc1ccc(Br)cc1O)C2 720656826 GIFPDRZLYMJGGD-IRXDYDNUSA-N 425.367 4.422 10 10 IICE CN(c1ccc(CNC(=O)CS(=O)(=O)c2ccc(Cl)cc2)cc1)C1CCCCC1 742417477 YYTMAMYIVPRGCX-UHFFFAOYSA-N 434.989 4.199 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCC[C@@]3(CC=CCC3)C1)c2[N+](=O)[O-] 744364845 FOHBBWWAZZDYRC-VWLOTQADSA-N 430.460 4.333 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC)C[C@@]2(CCOC2)O1 801947559 YUIAUPAQYHDAQC-SQJMNOBHSA-N 435.572 4.147 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC1(C(F)(F)F)CC1 804606644 XDMDMTSJLGHEBX-FMIVXFBMSA-N 434.530 4.188 10 10 IICE COCCSc1ccc([C@@H](C)NC(=O)NCc2cc(Br)ccc2O)cc1 805069898 SAGKTZQYKYVBDJ-CYBMUJFWSA-N 439.375 4.454 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccccc1I 806095119 TXTKAVQJKBIGRW-UHFFFAOYSA-N 447.070 4.081 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccn(Cc2ccccc2)c1 1125196957 WLBGKYBIZKMNCK-UHFFFAOYSA-N 443.469 4.322 10 10 IICE CC(=O)Nc1ccc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)nc1 1138174910 DCIRJZRDCNBHCR-UHFFFAOYSA-N 427.302 4.462 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@@H]2CCCC[C@@H]12 1146320246 PKMUOBRDZSZAPI-RBZQAINGSA-N 436.552 4.029 10 10 IICE Cc1nc(-c2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)s2)cs1 1147950851 AAPNLUQRNWWVJU-UHFFFAOYSA-N 431.558 4.210 10 10 IICE CC(C)(C)OC(=O)NCc1cccnc1NCc1cc(Br)cc(F)c1O 1202444667 KFOUKQCSKYONHS-UHFFFAOYSA-N 426.286 4.326 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@@H]2c2ccc(Br)cc2)N(C)C)cc1 1251501393 QMGJRJLZTNZPAW-NHCUHLMSSA-N 445.405 4.274 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC[C@H](C(=O)NCc4ccccc4)C3)c2C)c1 1254075134 XDEIOGMBABFQMF-QHCPKHFHSA-N 444.579 4.250 10 10 IICE COC(=O)c1ncc(C(F)(F)F)cc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1288219301 KSBXHZQKPCZENW-UHFFFAOYSA-N 431.414 4.476 10 10 IICE Cc1ncccc1/C=C/C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1289102841 SSHSQMDTJJOLIT-PYUISTEWSA-N 425.504 4.273 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(-n2ccnc2C)nc1 1291446070 ZHFBLOMHYZMEOK-QGZVFWFLSA-N 431.544 4.071 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](COC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291538146 MFUINCUEKYUMRQ-FPOVZHCZSA-N 443.661 4.256 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(N)=O)C1 1294121122 JVFPBEPYIYFAGH-HXUWFJFHSA-N 434.588 4.245 10 10 IICE COCCNc1nc(CC(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)cs1 1295590619 MHAURSGMCARIBG-KRWDZBQOSA-N 425.554 4.240 10 10 IICE COc1ccc(C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)cc1S(C)(=O)=O 1295595037 ORNOKLWUOGWFLS-KRWDZBQOSA-N 439.533 4.208 10 10 IICE CC(=O)c1cc(Br)ccc1OCC(=O)NCc1c(O)ccc2ccccc12 1304090739 PVZZXICPTOEVGP-UHFFFAOYSA-N 428.282 4.206 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)CCO1 1306442262 ZTVQUUVNSWBXOJ-LJQANCHMSA-N 443.642 4.431 10 10 IICE O=[N+]([O-])c1cc2c(nc1NCc1ccc(N3CCOCC3)cc1C(F)(F)F)CCCC2 1306938485 QDQXOWWRQZRBAE-UHFFFAOYSA-N 436.434 4.336 10 10 IICE CO[C@@H](Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O)C(C)C 1315191804 IEZROHAXGJYVAH-SFHVURJKSA-N 448.365 4.049 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1ccc([N+](=O)[O-])cc1Br 1352615406 NWMVMYLKZGHJJV-UHFFFAOYSA-N 432.318 4.159 10 10 IICE Cc1ccc([N+](=O)[O-])cc1OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1354533916 UFGPIKJZYACATA-LICLKQGHSA-N 446.481 4.239 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Oc2c(OC)cc(C(C)=O)cc2OC)CCCC1 1437040227 OIBZUFAFEIWHHE-UHFFFAOYSA-N 437.492 4.354 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)cc1 1444974345 JHARWZXBIBYOID-CCLHPLFOSA-N 443.591 4.476 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1 1445652060 HVXHWUKUNUGGCF-KRWDZBQOSA-N 445.357 4.255 10 10 IICE CC(C)(C)OC(=O)CC1(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 1445883068 MOAZTDOQXQTDRA-GOSISDBHSA-N 436.980 4.028 10 10 IICE COc1ccc(CNC(=O)[C@@H]2CCCCC23CCN(C(=O)OC(C)(C)C)CC3)c(O)c1 1448385213 UJJNYIPIUSZGBJ-IBGZPJMESA-N 432.561 4.225 10 10 IICE CCN(CC(=O)N(C)[C@H](C)c1ccccc1OC)Cc1cc(Br)ccc1O 1459576662 PTIIROCYZWIEDD-OAHLLOKOSA-N 435.362 4.205 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCCC[C@H]2CS(C)(=O)=O)cc1 1460224263 YEEVJARFFYWENL-IBGZPJMESA-N 428.558 4.207 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Cl)cc(F)c2Br)cc1 1461336078 HCSSHIQPTXLLME-UHFFFAOYSA-N 429.717 4.459 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCSc3ccc(Cl)cc3)cc2F)CC1 1528694033 WDYRZKUTQAARSZ-UHFFFAOYSA-N 435.996 4.420 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(F)(F)c2ccc(Br)cc2)N(C)C)cc1 1539236144 PZODZIIKCSTHBF-GOSISDBHSA-N 440.332 4.026 10 10 IICE C[C@@H](c1cccs1)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541795934 LGSYEGVIWSJKFH-DOTOQJQBSA-N 429.565 4.294 10 10 IICE O=C(N[C@H](C(=O)Nc1ccc(Br)cc1F)c1ccccc1)c1cc(O)cs1 1544900413 UAKLMSNDPWDDAF-KRWDZBQOSA-N 449.301 4.465 10 10 IICE O=C(NCc1ccccc1O)C(F)(F)c1ccc(OC(F)(F)F)c(Br)c1 1545682005 MWNJVPKZZWXUHR-UHFFFAOYSA-N 440.162 4.462 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@H](CC(C)(C)C)c3ccc(F)cc3)CC2)cc1F 1559642506 RZOOXYQIPMPYEE-JOCHJYFZSA-N 445.554 4.389 10 10 IICE COc1ccc(CCNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1O 1564649706 KPDPJLZMBIHXIJ-INIZCTEOSA-N 431.964 4.332 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CN(Cc4ccccc4)CC[C@@H]3CO)c2C)c1 1566358119 VHLMOWGQIFIPJJ-BVAGGSTKSA-N 431.580 4.015 10 10 IICE Cc1ccc(C(=O)N2CCCN(C(=O)OCC(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1584274923 VHTXMSRZYXYWBD-UHFFFAOYSA-N 439.556 4.156 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1(c2ccc(C(F)(F)F)cc2)CCC1 1585536108 QPNRPOJOGRBIBL-UHFFFAOYSA-N 432.486 4.405 10 10 IICE Cc1ncsc1/C=C\C(=O)N(CCc1ccccn1)c1ccc(Br)cn1 1585706833 FOWCDYKSFGLKEF-VURMDHGXSA-N 429.343 4.293 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1 1597417496 GGANWPZMRJQZRQ-LJQANCHMSA-N 439.556 4.284 10 10 IICE Cc1csc([C@@H]2CN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)cc3C)CCO2)n1 1612359741 NJMVDQBIJJDAOK-FQEVSTJZSA-N 440.617 4.167 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1614651669 KCRHCRHWUAZWOF-OAQYLSRUSA-N 440.680 4.458 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1F 1616924285 IEZARHCTCBDOMN-ZHRRBRCNSA-N 449.929 4.300 10 10 IICE COc1ccc(CCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 1618253506 OKMKXTYOANNKBE-QFIPXVFZSA-N 441.572 4.076 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1 1618593714 OYUMNKZBVIOBQX-XMMPIXPASA-N 445.519 4.146 10 10 IICE COC[C@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1619701138 DIGCAYPNZQRVLB-FQEVSTJZSA-N 439.629 4.216 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCOc2cccc(Br)c2)c1 1626487500 PWNVYNLCGPOMPX-UHFFFAOYSA-N 441.325 4.478 10 10 IICE Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)c1cc2cc(O)c(O)cc2s1 1627838222 YMTAECXBCINLJU-UHFFFAOYSA-N 428.535 4.062 10 10 IICE Cc1cc(C(=O)Nc2cccc(CCCO)c2)c(C)n1-c1ccc(Br)cn1 1632660654 MKYKKVRMEAYJAL-UHFFFAOYSA-N 428.330 4.429 10 10 IICE CCN(CC)C(=O)CCC1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)CC1 1632764924 GCTLTLDWASNYIJ-UHFFFAOYSA-N 437.584 4.407 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)cc1C 1633759746 NRPWRICNLIPDBB-QHCPKHFHSA-N 445.519 4.147 10 10 IICE O=C(COc1ccc2oc3c(c2c1)CCCC3)NCc1cccc(Br)c1O 1635839925 OAQWKBDHPMZCLR-UHFFFAOYSA-N 430.298 4.475 10 10 IICE O=C(C[C@@H](c1ccccc1)c1ncc[nH]1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941627 UUADHMNNDBEVMR-SFTDATJTSA-N 438.959 4.072 10 10 IICE Cc1ccc([C@@H]2CSCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1635992658 XTSBMUAOTUDZPC-NRFANRHFSA-N 447.551 4.110 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4C)c3C(F)F)CC2)cc1 1636702391 PWNMCZYZYBPORL-UHFFFAOYSA-N 440.494 4.479 10 10 IICE Cc1cc(C(=O)N2CCC(CCNC(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccn1 1644285978 JWOZPSFKBYOXLT-UHFFFAOYSA-N 426.561 4.256 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](CO)C2CCCCC2)sc(C)c1-c1ccccc1 1654125777 XQWIGDLKOJZWNT-IBGZPJMESA-N 444.597 4.370 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3c(S(C)(=O)=O)nc4ccccc43)c2C)c1 1656148151 WFDBDDQIDSHKIW-UHFFFAOYSA-N 435.549 4.347 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1O 1659474650 BRPDEPOILBBIDK-OAHLLOKOSA-N 446.897 4.261 10 10 IICE C[C@H](CCc1ccc(I)cc1)NC(=O)N1Cc2cccc(O)c2C1 1680785566 NDJQSAXJXZAGPL-CYBMUJFWSA-N 436.293 4.043 10 10 IICE FC(F)(F)CO[C@H]1CCCN(c2nnc(C3CC3)n2CCCSc2nccs2)C1 1698469218 RBCALBSWOYJSQW-AWEZNQCLSA-N 447.552 4.342 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC3(SC)CCC3)CC2)cc1 1711865410 UGAXCMZNTCCQFZ-UHFFFAOYSA-N 443.661 4.488 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743782354 GRAJESYJRVFZLP-DENIHFKCSA-N 443.661 4.254 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](CC)NC(=O)OC(C)(C)C 1744114586 LUIWIFVPRZEQQH-FUHWJXTLSA-N 431.581 4.437 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1765535031 JUSGOAVEOJQWOO-VCOUNFBDSA-N 429.609 4.050 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3nc(-c4ccccc4Cl)oc3C)CC2)cc1 1858082472 GWAGNSCJVQZDOH-UHFFFAOYSA-N 425.916 4.203 10 10 IICE COc1cc(C(=O)N(c2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)ccc1[N+](=O)[O-] 1859889724 XTZDILSSPPZCNP-UHFFFAOYSA-N 444.443 4.434 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)[C@H](N)c1ccc2c(c1)CCN2C 1999536022 DYEJLPLEZLFGKA-JJEOQYAHSA-N 425.573 4.177 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C(F)(F)F)c(CO)c2Br)c(O)c1 2079873412 ORUWKNVEFQTKLZ-CQSZACIVSA-N 435.240 4.260 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NCc2cc(Br)cc(F)c2O)CC12CCC2 2099383505 PVADSOZPOQYTPA-AWEZNQCLSA-N 429.330 4.316 10 10 IICE CC(C)(C)OC(=O)N1CCC(C)(C)[C@@H]1CNCc1cc(Br)cc(F)c1O 2139855400 GFPKYRYKODEXDA-HNNXBMFYSA-N 431.346 4.419 10 10 IICE CC[C@H](NC[C@H]1COCCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2158553303 IEVBYRXILFMCBO-PBHICJAKSA-N 443.382 4.079 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1ccccc1C(=O)O 2296652090 ZLDLRMXBPMWDMZ-UHFFFAOYSA-N 426.519 4.005 10 10 IICE COc1cccc(-n2c(C)cc(C=C3SC(=O)N(CC(=O)OC(C)C)C3=O)c2C)c1 2297459892 PTUVDLLXSZUXDH-UHFFFAOYSA-N 428.510 4.091 10 10 IICE CC[C@@H](C)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323827357 YDAVXLYUGDVGAD-AMIZOPFISA-N 432.336 4.289 10 10 IICE CC[C@@H](C)N1C(=O)/C(=C2\C(=O)N(CC)c3ccc(Br)cc32)SC1=S 2509085 LWLCPRBMYDXTQZ-MAEIDHKBSA-N 425.373 4.186 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c(C)n1-c1cccc(F)c1 16455658 WHCMPPXNTYNDQY-DEOSSOPVSA-N 437.446 4.022 10 10 IICE CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C\Nc1ccc(Br)cn1 17293263 BNDGMTIUPZKOJR-ZROIWOOFSA-N 436.107 4.325 10 10 IICE C[C@@H]1CCc2c(cc(-c3ccccc3)n2-c2ccc(C(=O)NCCN3CCOCC3)cc2)C1 20489484 DTRZWAFCYNDTOF-OAQYLSRUSA-N 443.591 4.331 10 10 IICE CCOc1ccc(/C=C/C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 71933444 UATJYPTURFIHBN-BJMVGYQFSA-N 434.458 4.270 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(OC(F)(F)F)cc2)cc1 110148221 GUIHISRHMJSWIM-NRFANRHFSA-N 436.474 4.402 10 10 IICE CC(C)(C)OC(=O)NC1CCC(OCCNCc2cccc(Br)c2O)CC1 312275289 KGBYISROKAIYIM-UHFFFAOYSA-N 443.382 4.097 10 10 IICE COC(=O)c1c(F)ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1C 583234588 PZWBQHUOELKIFX-UHFFFAOYSA-N 437.515 4.281 10 10 IICE CCCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)C1CCN(c2cc(C)nc(C)n2)CC1 733981871 NGUNBJPYLKYDCD-UHFFFAOYSA-N 446.599 4.417 10 10 IICE CN1CC[C@@H](NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H]1c1ccccc1 758968972 ZOMGWGJPWRMRFS-FGZHOGPDSA-N 444.526 4.001 10 10 IICE O=C(NCCCSc1nccs1)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 759600875 AVKIPMPCAZCRCE-OAHLLOKOSA-N 431.505 4.427 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Oc2ccc(N3CCCC3=O)cc2)C1 766372858 GFHKIOPMMXQURF-UHFFFAOYSA-N 431.536 4.140 10 10 IICE COc1ccc(Cn2nc(C)c(/C=C3\SC(=S)N(c4cccnc4)C3=O)c2C)cc1 767341004 MOWJPDYOPAIOLQ-JAIQZWGSSA-N 436.562 4.358 10 10 IICE CC(C)CN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCc2cccnc21 776116731 BWPBRAFDNAMVCT-QHCPKHFHSA-N 440.563 4.303 10 10 IICE O=S(=O)(Nc1ccc(O)c(-c2nc3ccccc3s2)c1)c1cnn(CC2CC2)c1 777602024 XQYMKBRAXKCYLT-UHFFFAOYSA-N 426.523 4.076 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)cs2)cc1)c1ccncc1 783595017 LMJMAYUKEAKJFI-UHFFFAOYSA-N 442.547 4.320 10 10 IICE CC(=O)N1CCN(c2ccc(CNc3nnc(-c4ccccc4Cl)s3)cc2)CC1 786070650 CXBUGCWGOLZCFR-UHFFFAOYSA-N 427.961 4.139 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)Nc2cc3c(cc2O)n(C)c(=O)n3C)cc1 794211553 VITZHEVOSIMSCC-UHFFFAOYSA-N 444.495 4.316 10 10 IICE CCN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ncccc1C 798549982 QQWFZHYNNVXDLP-DTQAZKPQSA-N 431.608 4.486 10 10 IICE CC[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(C(F)(F)F)cc1O 810224340 VJLAQYYAPBZFFM-IRFCIJBXSA-N 447.501 4.051 10 10 IICE COC[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(F)c(F)c1 1127667713 YAQXFLGOUWOYCS-JOCHJYFZSA-N 441.522 4.190 10 10 IICE Cc1cc(C(=O)NCc2ccnc(OC(C)C)c2)c(C)n1-c1ccc(Br)cn1 1151867874 RASDMIKHRDDKKE-UHFFFAOYSA-N 443.345 4.364 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N(CCC4=CCCCC4)C3=O)c2C)c1 1165267347 REYJEQFTHRKMDK-UHFFFAOYSA-N 447.535 4.267 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H]3CCN(c4ccccc4Cl)C3)C2)cc1 1230300645 HRDMBQVYQJKXEI-RBUKOAKNSA-N 442.991 4.001 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C(C)(C)c3ccc4ccccc4c3)CC2)cc1 1264273659 MNDUPSXJMFHZKG-UHFFFAOYSA-N 445.607 4.455 10 10 IICE CC(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1Cl 1264992647 HAAUPFLTFSYYMC-UHFFFAOYSA-N 437.874 4.299 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cccc(Br)n1 1291444953 DECWZAVCQURMIS-AWEZNQCLSA-N 430.350 4.339 10 10 IICE COc1ccc(C(=O)C[C@@H](C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 1292381532 FFHHAGTUXDXDDA-NTKDMRAZSA-N 438.568 4.178 10 10 IICE O=C(C[C@@H]1CCc2sccc2C1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1292594891 ZOUCMWQWJLVIKY-AWEZNQCLSA-N 434.508 4.270 10 10 IICE O=C([C@@H]1CCOc2ccc(Br)cc21)N(Cc1ccccc1O)C[C@H]1CCCO1 1295406135 PIEBZKWKOWGIOR-QZTJIDSGSA-N 446.341 4.229 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](CO)c2ccccc2C(F)(F)F)CCCC1 1303995067 KWOFVTZVIJXQSN-FQEVSTJZSA-N 446.469 4.397 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1Cc1cscc1C(F)(F)F 1314751248 QOJBHDSRYGMFTH-UHFFFAOYSA-N 448.474 4.149 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2)cc1 1350088276 SVNSSITUWGFVON-UHFFFAOYSA-N 448.498 4.197 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)o1 1361257716 HEOGGUDUGFXGGP-UHFFFAOYSA-N 434.519 4.055 10 10 IICE O=C(NCC1(C(=O)NCc2ccc(N3CCCC3)cc2)CCCC1)OCc1ccccc1 1441191184 YXDCKANQLZLXSU-UHFFFAOYSA-N 435.568 4.390 10 10 IICE CCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1ccc(Cl)cc1 1445842680 JVGYLFAFJYLZER-UHFFFAOYSA-N 442.922 4.198 10 10 IICE Cc1ccccc1C[C@@H](CO)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1447763019 LKVFMSKJCAJMQV-IBGZPJMESA-N 441.369 4.498 10 10 IICE COc1cccc(N(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C(=O)OC(C)(C)C)c1 1447966650 HVNLJXIRJVBUFE-KRWDZBQOSA-N 427.545 4.380 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)c(C)n1-c1cccc(Cl)c1 1465067531 YKGAIPQDQUOEQB-UHFFFAOYSA-N 439.918 4.485 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)[C@@H](C)C3)cc2Cl)C1 1478528043 LHAIJASFUILUOO-OALUTQOASA-N 442.007 4.392 10 10 IICE C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786003 FCEDIIOFOAHTNL-BTYIYWSLSA-N 433.474 4.233 10 10 IICE Cc1nc(CCn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CC(C)C)n[nH]1 1492686697 IUYRGOSOFGJYSP-UHFFFAOYSA-N 432.576 4.114 10 10 IICE CC(C)Cc1nnc(N2CCS[C@H](C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1509234179 PDPSXIJVULNWRQ-RBUKOAKNSA-N 445.702 4.408 10 10 IICE C[C@@H]1CCC[C@@](Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1512122468 XMRZELIGNKSAOE-FQRUVTKNSA-N 448.615 4.116 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@]3(C)CCCS3)CC2)cc1F 1518309048 OFYDQAYKITZTDX-HSZRJFAPSA-N 447.624 4.336 10 10 IICE COc1ccc(N2CCC(NC(=O)c3coc(/C=C\C(=O)OC(C)(C)C)c3)CC2)cc1 1520520419 UHQXAOSUCGSTGS-KTKRTIGZSA-N 426.513 4.042 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1 1525762531 RMHBVWCFDGPEDC-INIZCTEOSA-N 437.565 4.203 10 10 IICE Cc1cccc(-c2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)n2C)c1 1527864704 VSBWFGUAUMCLTD-UHFFFAOYSA-N 425.479 4.045 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cc(F)ccc1F 1528803167 HGQZTDSHKJNWRS-YVLHZVERSA-N 436.480 4.358 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(Cc3ccccc3)CC2)NC(=O)OC(C)(C)C)cc1 1544267573 GFCHRAQIDDRPNM-JOCHJYFZSA-N 437.584 4.458 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCOC[C@@H]1OC 1545332786 OEHPDLROAIAVFQ-WPYKKVEZSA-N 441.620 4.080 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@@H](C)C1 1555540536 OJRVEXWMIFROEW-JPYJTQIMSA-N 425.621 4.295 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@](C)(O)c2ccccc2Cl)C1 1556108699 YQDNWNAKBGYVHO-RUZDIDTESA-N 439.987 4.085 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2c2cccn2C)c(C)n1-c1cccc(Br)c1 1556147058 MRNYJANDSDJODL-NRFANRHFSA-N 442.357 4.409 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1 1557275996 RTHYXSKARFOLLF-UHFFFAOYSA-N 437.418 4.215 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCN(CC)C[C@@H]2CC)sc(C)c1-c1ccccc1 1559835443 KRALLIUHDVSXQL-IBGZPJMESA-N 443.613 4.255 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](c3nncn3C(C)C)C2)cc1 1565665849 ZZZIPKSIQWXMDR-OAQYLSRUSA-N 433.556 4.028 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCCCC[C@@H]1NC(=O)OC(C)(C)C 1568737664 IAISXSKUCDUYOY-IRXDYDNUSA-N 425.566 4.358 10 10 IICE CCc1c(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cnn1CC 1618369001 PRHZDYHNDOBRAS-UHFFFAOYSA-N 439.317 4.190 10 10 IICE Cc1cc(C(=O)NC[C@@]2(O)CCN(Cc3ccccc3)C2)c(C)n1-c1cccc(Cl)c1 1618659085 VEEICIJOEIZNGK-VWLOTQADSA-N 437.971 4.114 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc2c(c1)CCC2 1624433246 UXYJSFWCYYABNX-CQSZACIVSA-N 442.562 4.234 10 10 IICE CCOC(=O)N[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)CC(C)C 1625458928 REOZJLYJIXCFMU-OAQYLSRUSA-N 427.545 4.106 10 10 IICE CC(C)C[C@H](CNC(=O)OC(C)(C)C)CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1625883381 XTUZZJIAZFPMFP-PMACEKPBSA-N 447.620 4.278 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCCNC(=O)NC2CCCCC2)cc1 1631513325 SMTLSIMPDIWFKH-UHFFFAOYSA-N 442.526 4.056 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(S(C)(=O)=O)ncc1Cl 1631531570 VTGRISNAHHGIOG-OAHLLOKOSA-N 444.940 4.248 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)[C@@H]1CCC[C@H](OC)C1 1631887779 GQITUHPCFNNHBN-UNWVZKJWSA-N 426.557 4.188 10 10 IICE COc1ccc(N2CCN(C(=O)c3ncsc3Nc3ccccc3C)CC2)cc1F 1635889416 CBONUXWDMSBMBX-UHFFFAOYSA-N 426.517 4.305 10 10 IICE O=C(c1cccc(O)c1O)N1CCN(c2cccc(OCc3ccccc3Cl)c2)CC1 1638689188 BHLXAYFLBCMOLE-UHFFFAOYSA-N 438.911 4.293 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N(Cc1ccccc1)C[C@H](O)c1cccc(OC(F)F)c1 1638990176 FKXDIGDYLDQDNQ-QFIPXVFZSA-N 443.446 4.004 10 10 IICE CC(C)(C)OC(=O)N1CCOc2ccccc2[C@H]1C(=O)NCc1cc(Cl)ccc1O 1640924924 WRALAFBNRCBGTI-IBGZPJMESA-N 432.904 4.033 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(C(F)(F)F)cc1N1CCCC1 1642155626 YZWXCCIUXGXFDT-UHFFFAOYSA-N 447.501 4.197 10 10 IICE COC1(OC)CC2(CN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)[C@@H]2C(C)C)C1 1643979333 GLYOJQQEBURIQQ-XMMPIXPASA-N 438.568 4.085 10 10 IICE COC(=O)[C@H](Cc1cncs1)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1644894345 OSCKTHVXHUQYSS-NRFANRHFSA-N 425.554 4.188 10 10 IICE COc1ccc(N(C)CCN(C)[C@H](C)C(=O)N(c2nccs2)C2CCCCC2)cc1 1646718890 JTNOMLAVZHDDKJ-GOSISDBHSA-N 430.618 4.274 10 10 IICE COC(=O)CC[C@H](SC1=NC(=O)/C(=C/c2csc3ccccc23)S1)C(=O)OC 1652013953 NXOBHBNFCHUHNX-BUYRESAOSA-N 435.548 4.100 10 10 IICE COc1ccc(NC(=O)NC(=O)CN(CCc2ccccc2)c2ccc(OC)cc2)cc1 1657675795 GMESAEXMXWESSE-UHFFFAOYSA-N 433.508 4.101 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H]3[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]43)c2C)c1 1682948272 XTRQIVUURNYJOS-ZBYYUNFXSA-N 438.572 4.067 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccccc3)cc2Cl)C1 1686268903 IEFXYTJALBHBRW-WIYYLYMNSA-N 429.992 4.227 10 10 IICE CCN(CCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C)C(C)C 1695769728 YDANKRFUYFVHSP-UHFFFAOYSA-N 442.652 4.031 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2nccs2)n1Cc1ccc(N2CCSCC2)cc1 1708403379 PAPYMUNRBBNUKC-QGZVFWFLSA-N 442.658 4.486 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@]3(CCO[C@H]3C)C2)n1Cc1ccc(N(CC)CC)cc1 1708562710 QSOQMSQCWZZDNJ-RLSLOFABSA-N 441.620 4.070 10 10 IICE CCc1nnc(N2CCC[C@@H](OCC(F)(F)F)C2)n1CCCSc1nccs1 1727587930 WCNNGMXFCMJPSZ-CYBMUJFWSA-N 435.541 4.027 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C2CC(C(C)(C)C)C2)CCOC1 1746657504 DVNULXTWLSOJIJ-MORLXBONSA-N 428.577 4.269 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCOC(C)(C)C2)cc1 1766615492 YOEZSBJKWKGABI-OAQYLSRUSA-N 427.593 4.029 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCN(C)C1CCCC1 1768681429 JDCUUKHGYDUDQN-UHFFFAOYSA-N 440.979 4.210 10 10 IICE COCCO[C@@H](C)c1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1771171894 HSAQIFPEFJWZLD-MSOLQXFVSA-N 447.599 4.128 10 10 IICE CCC1=NN(Cc2ccccc2F)C(=O)/C1=C/c1cc(Br)c(O)c(OC)c1 1865666289 IISNDONFVGTSKQ-RIYZIHGNSA-N 433.277 4.494 10 10 IICE COc1cccc(N2CCN(Cc3ccc(C(=O)Nc4cccc(N(C)C)c4)cc3)CC2)c1 1872882453 KVYWONKZNACDOC-UHFFFAOYSA-N 444.579 4.336 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2c(O)cccc2Br)C1 1952578443 PHXUTDKMIZYVIC-GDBMZVCRSA-N 434.286 4.329 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C(C)C)c(C(=O)O)c2I)cc1C 2079957476 PJMVITUKVKAGGF-LLVKDONJSA-N 428.270 4.241 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1ccccc1C(=O)O 2297578869 CDKRJMMPLWRNCW-UHFFFAOYSA-N 444.534 4.378 10 10 IICE Cc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)cc1 2314836671 IJOZVZUTRBGXRC-ZDUSSCGKSA-N 427.507 4.132 10 10 IICE COc1cc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 2314837255 QDIAGCMGBWVRDA-NSHDSACASA-N 448.953 4.283 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N([C@H](CC(C)C)C(=O)O)C1=O)C(C)=O 2314928472 WLWXDLWPFVEKKL-CVEARBPZSA-N 435.567 4.134 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCO3)SC(=S)N1C1CCN(Cc2ccccc2)CC1 2323879636 OEFLJPGAOQKTTA-UHFFFAOYSA-N 438.574 4.281 10 10 IICE Cc1ccc(CNCc2cccc(I)c2)c(O)c1Br 2352674953 AWAMWGGVSCYURK-UHFFFAOYSA-N 432.099 4.358 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C\c2cccc(OCCC(=O)O)c2)SC1=S 16908117 GJWXRYXJQBSACZ-QGOAFFKASA-N 429.519 4.345 10 10 IICE N=C1/C(=C/c2ccc(OCc3ccccc3)c(Br)c2)C(=O)N=C2SC=NN12 33774475 HYRZFFUPWPPPJE-ZSCJGDHMSA-N 441.310 4.277 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)c(C)n1-c1cccc(C(=O)O)c1 33927808 AMOUMSPROQNJSP-NDENLUEZSA-N 447.422 4.438 10 10 IICE Cc1c(CC(=O)OC(C)C)cc(-c2ccc(S(C)(=O)=O)cc2)n1-c1cccc(F)c1 45336877 VKAHIULTISIANE-UHFFFAOYSA-N 429.513 4.489 10 10 IICE CCN(CC)c1ccc(CN(C[C@H](O)COc2ccccc2OC)c2ccccn2)cc1 54120837 MYHAKPSWOJMINW-QHCPKHFHSA-N 435.568 4.383 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccccc3C(C)=O)[C@H]2c2ccc(O)c(O)c2)c1 526612841 XGHGEBYLJZPJAG-QHCPKHFHSA-N 431.444 4.366 10 10 IICE CC(=O)N[C@@H](CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)c1c(F)cccc1F 727366218 DFPLAFURRXTBSQ-QHCPKHFHSA-N 439.506 4.299 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H](C)NC(=O)c2ccccc2)cc1 733155442 OTQMOQHVVFCQGF-LJQANCHMSA-N 431.536 4.113 10 10 IICE COc1cccc(C[C@@H](C)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743606687 KJJMHBSENRUKEH-AEFFLSMTSA-N 433.499 4.196 10 10 IICE CN(C)C(=O)Sc1ccc(COC(=O)c2csc(Cc3ccc(N)cc3)n2)cc1 751929989 FLWWJZVMFXQVKK-UHFFFAOYSA-N 427.551 4.447 10 10 IICE C[C@@H](NC[C@@H](O)Cc1ccccc1)c1cc(Br)cc(Br)c1O 756547479 DJIABJGSHLVNCG-RISCZKNCSA-N 429.152 4.171 10 10 IICE CC(C)c1ncc(CN(C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 799569829 BGVQRIGGIGCXCE-UHFFFAOYSA-N 433.503 4.012 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)/C=C\c2ccc(Cl)cc2)cc1F 1125465343 VIRYVWUHGYANMF-HVMDOBLNSA-N 443.950 4.256 10 10 IICE COc1ccc2cc(/C=C\C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)ccc2c1 1129549026 AWDOJHRKSRLRSW-CLTKARDFSA-N 438.474 4.293 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)CC2)c(OC)c1 1131805158 XMPAPNKOKWJYOU-UHFFFAOYSA-N 428.838 4.338 10 10 IICE Cc1cc(C(=O)N2CC[C@H](CN3CCCCC3)C2)c(C)n1-c1ccc(Br)cn1 1136827349 WBLZGAFGXACYEO-GOSISDBHSA-N 445.405 4.200 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCc3cccnc32)c(C)n1-c1ccc(Br)cn1 1143620049 KJLKJUJLGFCRKG-MRXNPFEDSA-N 425.330 4.106 10 10 IICE Brc1cc(CN[C@H](c2ccccc2)c2nc[nH]n2)ccc1N1CCCCC1 1205320822 SEHVZBSNXFDSEL-HXUWFJFHSA-N 426.362 4.437 10 10 IICE Cc1ccsc1[C@@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1295488374 DRSAFUKXLXEQAL-MRXNPFEDSA-N 434.359 4.085 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@H]1Oc1ccccc1 1296810648 BAUSHCKKMIQYSL-QLBJFCOMSA-N 436.552 4.259 10 10 IICE CC(C)CC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@@]2(OC(C)C)CCOC2)CC1 1302829600 OQXKJMRMITXAHJ-RUZDIDTESA-N 442.604 4.487 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1ccc(F)cn1 1305503588 DUSBTSUNMITCBO-SFHVURJKSA-N 438.551 4.099 10 10 IICE Cc1cc(N(C)C)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1356338833 DRHCNOXHSBBPLR-UYRXBGFRSA-N 443.569 4.430 10 10 IICE CC(C)c1ncc(CN(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)cn1 1359673791 OTRYGXRQXLTTIC-UHFFFAOYSA-N 448.550 4.076 10 10 IICE CCCCCn1cc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)n1 1435778959 XHYIEFJJGCSELO-UHFFFAOYSA-N 435.616 4.419 10 10 IICE Cc1nc(-c2cccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)c2)cs1 1436623988 JTMVHDRRGJQTOX-UHFFFAOYSA-N 429.492 4.163 10 10 IICE COc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OCC2CC2)c1 1445889714 ZJMDRHHWVMZBRG-LJQANCHMSA-N 444.959 4.237 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C1CCN(Cc2nccn2C)CC1 1446806102 QGXDAXOQCJLCBU-FQEVSTJZSA-N 432.568 4.128 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC(c2ncco2)CC1 1452138831 RRYXMIHVWTULNB-SSZFMOIBSA-N 447.607 4.124 10 10 IICE O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1c(O)ccc2c1CCCC2 1465954582 RCCWFRMDHMGHFV-UHFFFAOYSA-N 437.418 4.316 10 10 IICE CCOC(=O)Cc1cc(Cl)c(=O)n(CC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)c1 1473031680 LNROIHXIRIXCPJ-UHFFFAOYSA-N 440.927 4.206 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)c(C)n1-c1ccccc1 1479064616 VERQSYHGTHPXQD-VWLOTQADSA-N 444.579 4.474 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@H]1C 1502259101 IIJYZGPSPHSWFN-RTWAWAEBSA-N 438.664 4.352 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1505211203 QUXGEJAEZXYMES-IBGZPJMESA-N 440.592 4.315 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(O[C@@H]4CCOC4)c3)cc2Cl)C1 1524256036 QCTKSWPXOUSTGX-VQIMIIECSA-N 429.948 4.069 10 10 IICE Cc1cnc([C@@H](C)CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1538119372 RGQFPBVIGUWHQQ-RGZVIEDOSA-N 449.598 4.102 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl 1539187542 CWNBIUQDNFWBDH-UHFFFAOYSA-N 437.853 4.278 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC(C(=O)OC(C)(C)C)CC2)CCCC1 1543897643 IABDUYLXQPWEEN-UHFFFAOYSA-N 426.557 4.109 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CN(C(=O)OC(C)(C)C)Cc3ccccc32)c1 1545684261 QBSZJZHCDXHKNV-QRWLVFNGSA-N 426.513 4.113 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4c3[C@@H](C)CC4(C)C)CC2)cc1 1558473141 RFEAXCMKJYLIKS-HYSAVQALSA-N 447.579 4.324 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC/C=C\c2ccc(Br)cc2)N(C)C)cc1 1564815095 UUEGAGIEAZHQOQ-QEVIJRNUSA-N 445.405 4.130 10 10 IICE COc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c(C(=O)NC2CC2)c1 1565673861 WAMDUCNMVATFKM-UHFFFAOYSA-N 431.492 4.060 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)OCc2ccccc2Cl)CCCC1 1585760930 KEJXKLNIGVJNTO-UHFFFAOYSA-N 440.927 4.042 10 10 IICE O=C(CCc1cccc(OC(F)F)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595583932 KGHSTRGNRVJBSU-GOSISDBHSA-N 438.902 4.360 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C/c3cccc(OC4CCCC4)c3)cc2)CC1 1626095340 TUEYSXJLAPFJEJ-JLHYYAGUSA-N 447.579 4.039 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4cccc(C(F)(F)F)c4nc3O)C2)cc1 1627158827 GUTGVJMKFUXEMI-AWEZNQCLSA-N 445.441 4.224 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(S(=O)(=O)c3ccccc3)CCCCC2)cc1F 1633263836 OQVYPWIEFSGJQN-UHFFFAOYSA-N 446.588 4.465 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)N(Cc3ccccc3)[C@@H]2c2ccccc2)c1 1633282950 QJNFVZQKHBEBQI-ZEQKJWHPSA-N 428.532 4.497 10 10 IICE CCS[C@H](C)c1noc(CN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n1 1636209564 UMZXOLQDGSPVIP-QGZVFWFLSA-N 440.569 4.305 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2OCCC3=O)c(C)n1-c1ccc(Br)cn1 1637033433 UGPBQPQWGVSICC-UHFFFAOYSA-N 440.297 4.469 10 10 IICE O=C(CCSc1ccccc1Cl)NCc1cc(F)c(N2CCOCC2)c(F)c1 1637549894 QIMYFNGKSQOKOY-UHFFFAOYSA-N 426.916 4.253 10 10 IICE Cc1cc(S(N)(=O)=O)c(C)cc1NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1637727551 MELVUWMSXSJFHR-UHFFFAOYSA-N 431.945 4.264 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H](c2ccccc2)[C@@H](O)c2ccccc2)N(C)C)cc1 1638916938 BCDJRHJZYNODRR-NXCFDTQHSA-N 446.595 4.129 10 10 IICE Cc1cc(C(=O)N2CC[C@@]3(CCCCN3C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1639035004 YWZGKRAZFKTKBG-VWLOTQADSA-N 438.572 4.495 10 10 IICE COc1ccc(C(=O)NCc2c(O)ccc3ccccc23)cc1I 1639384755 UGVCSPRFODKECA-UHFFFAOYSA-N 433.245 4.089 10 10 IICE CN(Cc1cc(Br)cs1)C(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 1641554702 QWKSIKHOUPVGQZ-UHFFFAOYSA-N 436.419 4.200 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCc4cc(Cl)ccc43)cc2F)C[C@@H](C)O1 1642843209 UHJHPJVZAOEVBD-IAGOWNOFSA-N 445.966 4.162 10 10 IICE Cc1cc(C)c(O)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1648549359 YEZANBAHWJKRKR-GZTJUZNOSA-N 430.526 4.378 10 10 IICE CCN(c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1695560264 BXLRVRYDYBWLLG-UHFFFAOYSA-N 436.629 4.100 10 10 IICE COCC[C@@H]1CCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1697957033 QRTQIESNHCIFGF-KRWDZBQOSA-N 444.630 4.150 10 10 IICE Cc1ccc(-c2nnc(N(C)C[C@@H]3CCCOC3)n2CCCSc2nccs2)o1 1707348016 KFOIVQSQWZFHJC-INIZCTEOSA-N 433.603 4.348 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CCC[C@@H]3OC)CC2)cc1 1711865239 OBEJACVOAADVJA-REWPJTCUSA-N 441.620 4.017 10 10 IICE COCC1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC1 1712273301 LKNLDVIFFAZXSM-UHFFFAOYSA-N 439.629 4.216 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@@](=O)CC 1728028070 YPWLXTZMOXOCSE-PMERELPUSA-N 427.618 4.358 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1CCSCC(F)(F)F 1729420306 MGQRQSLSACGQLG-MRXNPFEDSA-N 430.496 4.157 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1745007106 VUJRVZLDMUIXLR-UGKGYDQZSA-N 434.588 4.238 10 10 IICE CCCCN(CC)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1745441455 IZHIOXOUOAYWMA-UHFFFAOYSA-N 441.551 4.497 10 10 IICE CO[C@@]1(C)CCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1748472897 JZOOPQUASKEYGX-UZLBHIALSA-N 437.635 4.164 10 10 IICE COc1cc(C)c(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)[C@@H](C)C(=O)N3)cs1 1859574425 LLARYPJGFJKKFY-CYBMUJFWSA-N 443.550 4.292 10 10 IICE CC1=NN(Cc2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679330 HPSZYMKJDUIISC-VGOFMYFVSA-N 448.262 4.475 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C3CCC3)c(N)c2I)c(O)c1 2080043460 VCUVIVPJKXZOTF-KRWDZBQOSA-N 441.313 4.297 10 10 IICE CC[C@H](NC[C@H]1CO[C@@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2159115558 XCGDBCWRNCSNRZ-LXZKKBNFSA-N 443.382 4.125 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(N(C)C)cc2)SC1=S 2314768908 MLZGIBLYLZVHDM-LJQANCHMSA-N 426.563 4.258 10 10 IICE CCCC[C@H](NC(=O)C=Cc1ccc(C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 2328562694 CZMJHMDKPJWUNK-VWLOTQADSA-N 449.595 4.041 10 10 IICE CC[C@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(C)c(Br)c1O 2352637282 JMLYTSNQUCCSRS-ZDUSSCGKSA-N 429.355 4.020 10 10 IICE Cc1ccc(CNC(=O)[C@](C)(NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2381137746 QCMNSGUGHXJNSA-FQEVSTJZSA-N 443.382 4.409 10 10 IICE CCCN1C(=O)COc2ccc(-c3csc(NS(=O)(=O)c4ccc(C)s4)n3)cc21 11857753 UXWBSKILCBSUTO-UHFFFAOYSA-N 449.579 4.116 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4cccc(F)c4)n4c3CCCCC4)CC2)cc1 15679104 GBRBVHPTUMRTJE-UHFFFAOYSA-N 448.542 4.387 10 10 IICE O=C(NN1C(=O)/C(=C/c2ccc(F)c(Br)c2)SC1=S)c1ccccc1 22353178 CRCBRHDROGDGIK-ZROIWOOFSA-N 437.315 4.134 10 10 IICE Cc1ccccc1OCC1=NN2C(=N)/C(=C\c3ccc(Br)o3)C(=O)N=C2S1 33448089 QRVMJMLZYMDAKB-CJHGCLHJSA-N 445.298 4.049 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(CC(C)C)C1=O 33490810 LXJBDXMMUIMRJL-FOWTUZBSSA-N 430.599 4.154 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1COc2c1ccc(Cl)c2Cl 743683208 LPMPZTPKZVOQMJ-GOSISDBHSA-N 436.339 4.105 10 10 IICE O=C(CN(CC(=O)N1CCCC1)C[C@H]1CCCO1)Nc1ccc(N=Nc2ccccc2)cc1 744423228 GFDNABJDXDLHLE-HSZRJFAPSA-N 449.555 4.144 10 10 IICE O=C(c1ccccc1SCc1cscn1)N1CCS(=O)(=O)C2(CCCCC2)C1 753713985 PEZDMWVWXZILKV-UHFFFAOYSA-N 436.624 4.009 10 10 IICE C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cn(-c2ccccc2)nn1 761787802 TYLGEWIWTSKLKK-IBGZPJMESA-N 444.539 4.399 10 10 IICE COc1cc(Br)ccc1CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 779662135 ZUFYYFHOYLEASW-SFHVURJKSA-N 449.345 4.054 10 10 IICE CCN1CC[C@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)[C@@H]1c1cc(F)c(F)c(F)c1 782749268 HFSXZJZBQDYNTG-REWPJTCUSA-N 442.485 4.472 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)c(C)n1-c1ccccc1 797414008 KWCZZXOYZTYDNN-RNHFSVANSA-N 425.573 4.005 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)NCc3cc(Br)ccc3O)C2)c1 804736709 YDSFWHPJQAWVLP-OAHLLOKOSA-N 446.345 4.023 10 10 IICE Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1C 1083885847 SODUMINUODOQPL-XDHOZWIPSA-N 431.404 4.138 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)NCCCSc1nccs1)Cc1ccccc1 1136661898 TYMRDVNHCOKDJK-KRWDZBQOSA-N 435.615 4.268 10 10 IICE C[C@H](C(=O)NCc1ccc2cccnc2c1O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 1142728196 ODXWFLRFHCVWCQ-OXJNMPFZSA-N 435.524 4.459 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@@H](c2ccc(C)cc2)c2cccs2)ccc1N(C)C 1166714728 XQGYLPHFYQBVTB-QHCPKHFHSA-N 438.549 4.194 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3C(=O)NC(C)(C)C)cc2Cl)C1 1227208687 PPMIDTPVKILPFD-UZLBHIALSA-N 435.012 4.165 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nn(-c2ccc(F)cc2C)cc1O 1294684077 DVYYWLZROFUWMQ-UHFFFAOYSA-N 448.292 4.156 10 10 IICE Cc1cc(C(=O)NCC2(C(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccc(F)cc1 1299846102 LOKUWTFOAPBHIA-UHFFFAOYSA-N 430.520 4.102 10 10 IICE Cc1cc(C(=O)NC[C@H](CC(=O)O[C@@H]2CCOC2)CC(C)C)c(C)n1-c1ccc(F)cc1 1300012846 CVOGEFLQWSTKCN-SIKLNZKXSA-N 444.547 4.348 10 10 IICE CCCCN1C(=O)CC(=O)N=C1SCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1307406248 PSBAWSFHMRLGAD-UHFFFAOYSA-N 429.517 4.064 10 10 IICE CSc1ccc([C@@H](CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)N(C)C)cc1 1312757498 ZLVZPEMKPHBXNC-RBBKRZOGSA-N 443.613 4.108 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@@H]3CCCN3C[C@H]2C)cc1 1313678043 BBRZGJRXTUIVFG-OFNKIYASSA-N 438.664 4.434 10 10 IICE COc1ccc(N2CCCN(C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 1356397811 SXFPBTDALQGLRQ-OAQYLSRUSA-N 447.620 4.309 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(OC)c1 1357835522 GDXIDNFXTUSCOE-CALCHBBNSA-N 430.520 4.167 10 10 IICE CC(C)OCCCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1360394149 KWRHUZVHYZCLOT-JOCHJYFZSA-N 427.593 4.181 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@@H](C2CCCC2)C1 1436907633 CSCAOKJUXZJIHS-HNMKQIAWSA-N 432.586 4.456 10 10 IICE CCOC(=O)N1CCC([C@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 1448168547 SQKXOOPMRXDJCQ-KRWDZBQOSA-N 427.545 4.090 10 10 IICE CN(CCc1ccccc1C(=O)N1CCN(C)c2cc(F)ccc21)C(=O)OC(C)(C)C 1457135762 DTIPHOMGYAWPHO-UHFFFAOYSA-N 427.520 4.332 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1460978587 ACBNXYSJOWLGCU-RDJZCZTQSA-N 448.394 4.468 10 10 IICE CC(C)(C)c1ccc([C@H](O)CCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1468817127 ZLVZDWINXHIBSD-JOCHJYFZSA-N 446.538 4.229 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CCOCC1 1470063350 BUZXDYDCKSMJTF-HXUWFJFHSA-N 435.362 4.028 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C[C@H](C)O1 1512479379 PYFLJXOJNDPXNY-HOTGVXAUSA-N 447.605 4.261 10 10 IICE Cc1cc(CC(=O)N2CCN(Cc3ccccc3)C(=O)C2(C)C)c(C)n1-c1ccccc1 1523679576 VSDDJHFHVSRABL-UHFFFAOYSA-N 429.564 4.286 10 10 IICE COC(=O)c1cc(Br)cc(C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1 1526323503 BBSHZWALGGUNAE-UHFFFAOYSA-N 433.346 4.353 10 10 IICE C[C@H](NC(=O)CC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1535557637 CJXINIFYDYMJBP-VQTJNVASSA-N 445.604 4.128 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)Nc1cnc(Cl)cc1Cl)c2[N+](=O)[O-] 1544852250 MLFKOGXHICWFBG-UHFFFAOYSA-N 442.214 4.324 10 10 IICE CCOc1ccc(C(=O)CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1545632141 CYOJYOSUPWCANL-FQEVSTJZSA-N 444.959 4.188 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@H]1C 1548264121 LGEQWNRPCUOWRI-HXUWFJFHSA-N 437.588 4.393 10 10 IICE CSC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1 1555824122 INTMWIYANNNQOJ-UHFFFAOYSA-N 425.602 4.331 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2(c3ccc(OC)c(OC)c3)CCCC2)cc1 1557357748 ZMJCFKCJUQWLNM-UHFFFAOYSA-N 426.557 4.119 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC[C@H](C(F)(F)F)C1 1557968918 OGIHMXDXJSWSFX-OJNRTJSBSA-N 446.491 4.218 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC[C@@]2(C1)CC2(F)F 1583444427 GIZXIQRPSMVIPH-BLSFAOBESA-N 442.578 4.377 10 10 IICE Cc1cc(C(=O)Cn2ncc([N+](=O)[O-])n2)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1 1614844352 GFCONUNZCYKLCF-UHFFFAOYSA-N 427.770 4.149 10 10 IICE Cc1cc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)c(C)n1-c1ccc(Br)cc1 1624440899 LQXPXBWMRLCIBU-JOCHJYFZSA-N 430.390 4.415 10 10 IICE CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NCc1ccc2cccnc2c1O 1627069806 SOSQJOSLGNYGLH-XMMPIXPASA-N 441.531 4.093 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1COC(=O)c1ccccc1NC(=O)c1cc(O)cs1 1627312847 BSQJRWUQFSAFTK-CQSZACIVSA-N 446.525 4.262 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 1630047311 UPPLDFUZZACMMN-UHFFFAOYSA-N 439.556 4.378 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cccc(Cl)c3Cl)CC2)cc1F 1631377413 MQMJNMGUTXTCSS-CYBMUJFWSA-N 427.303 4.257 10 10 IICE COc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1C 1634163234 WDZYQMAIVHCPBO-FQEVSTJZSA-N 427.545 4.065 10 10 IICE COc1ccc(N2CCN(C(=O)NCCCCc3ccc(Cl)s3)CC2)cc1F 1635187442 PMUTZMGNGHXWKH-UHFFFAOYSA-N 425.957 4.404 10 10 IICE Cc1ccc(C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1635456801 VVADUVLLMDCDMD-AOYPEHQESA-N 446.547 4.180 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1637779635 LDJVJRIGQXASAF-SFHVURJKSA-N 432.609 4.320 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 1638348519 SXALCNCCAUKFHW-FUHWJXTLSA-N 440.540 4.464 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1638573036 GTLZWYQHESQYAE-LUTRRODMSA-N 449.938 4.305 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCCOc4cc(Cl)ccc43)CC2)cc1 1670973267 SJFINCSDKOQQEO-OAQYLSRUSA-N 429.948 4.484 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)C2CC2)cc1 1682859320 RFGPIIUWAMRDJB-DNQXCXABSA-N 434.584 4.168 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1684322970 YWZYXHJEZJZIJG-MHZLTWQESA-N 449.570 4.412 10 10 IICE CO[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1697655380 JTSOTVBEXZANHL-JOCHJYFZSA-N 425.621 4.475 10 10 IICE C=CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H](C)C(=O)NC 1705812305 WHGISIWMEKFXMZ-GOSISDBHSA-N 434.588 4.137 10 10 IICE C[C@@H]1C[C@H](Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CCO1 1707990889 LZUBQNSEVXDDOX-RMEPHLEKSA-N 442.604 4.354 10 10 IICE CCCC(=O)N[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)C1 1709410591 WQYPICSXRNFIQT-NRFANRHFSA-N 440.636 4.181 10 10 IICE CCN(Cc1cccs1)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)cc1 1728444400 PJJVIGHVWXJTAN-UHFFFAOYSA-N 439.629 4.450 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)[C@H](C)c2ccco2)cc1 1746089889 IWFUZIBJFIKBHO-GOSISDBHSA-N 433.560 4.364 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)C[C@@H]2CCCOC2)cc1F 1747571710 JGIXNCNROHQDRI-IBGZPJMESA-N 443.592 4.047 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cnccn3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1761674936 LWWDSKFMNFNEJY-UHFFFAOYSA-N 441.461 4.341 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@](C)(OC)C2)cc1 1764942083 MXQBKZFTKDJGIB-QPPBQGQZSA-N 427.593 4.029 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)C(C)C 1769683909 JWRXLDUQBBMJHE-VWLOTQADSA-N 439.604 4.232 10 10 IICE CN1CCN(c2ccc(NC(=O)[C@@H]3CCc4c(c5cc(Cl)ccc5n4C)C3)cc2)CC1 1858153673 QGQDRLKLZJFJLC-QGZVFWFLSA-N 436.987 4.327 10 10 IICE Cc1sc(NS(=O)(=O)c2cccs2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2C 1859572750 FUORYLQEEYYNPK-UHFFFAOYSA-N 433.580 4.235 10 10 IICE COc1cc(/C=C2\C(=O)N(CC(C)C)N=C2c2ccccc2)cc(Br)c1O 1865666482 NFCYBQXFMATNSV-SXGWCWSVSA-N 429.314 4.449 10 10 IICE COc1ccc(C2=NN(c3ccccc3)C(=O)/C2=C/c2cc(OC)c(O)c(OC)c2)cc1 1865679681 ACCSKLRIOZZWQQ-DEDYPNTBSA-N 430.460 4.253 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)CC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1 2060611956 AGCNIFYEHQDUKX-UHFFFAOYSA-N 444.580 4.095 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2(NCc3cccc(Br)c3O)CC2)C1 2097027949 RNRONMMZSKLIPK-OAHLLOKOSA-N 425.367 4.424 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)C[C@@H]2CCCO2)c(Br)c1 2152214439 FCUXXGFFYWEQMH-FQEVSTJZSA-N 433.390 4.371 10 10 IICE O=C(CN1C(=O)C(=Cc2cccs2)SC1=S)Nc1nc2ccc(F)cc2s1 2314563182 RVCNXBJEOCXVPF-UHFFFAOYSA-N 435.552 4.337 10 10 IICE Cc1ccc(CN(C)C(=O)c2cc(NC(=O)OC(C)(C)C)on2)c(O)c1Br 2381135874 XJASOLGFURYQNZ-UHFFFAOYSA-N 440.294 4.070 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC3(CC3)N2C(=O)OC(C)(C)C)c(O)c1Br 2381137094 LFKRFLJKSIFETR-AWEZNQCLSA-N 439.350 4.011 10 10 IICE CCCCN1C(=O)/C(=C\c2c(Oc3ccccc3)nc3ccccn3c2=O)SC1=S 34713711 YXLUVIZZDTXNOO-SAPNQHFASA-N 437.546 4.488 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c1C 59271051 RCMBUTSLWOXDEW-RUZDIDTESA-N 433.483 4.192 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@H]2c2ccc(O)c(O)c2)cc1 526282511 UIBCRFVMKSITGG-QFIPXVFZSA-N 429.432 4.040 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC(C)(C)c2cc(C(F)(F)F)on2)C1 647028311 XOZXSIKAEMJNQK-UHFFFAOYSA-N 448.489 4.466 10 10 IICE Cc1sc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)nc1-c1ccc(F)cc1 727245935 KPIULJUDSXEANK-UHFFFAOYSA-N 440.905 4.483 10 10 IICE COc1cccc(F)c1[C@@H](C)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743661422 XTGFLWIVRYHQLG-CABCVRRESA-N 437.462 4.465 10 10 IICE C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1ccc(-n2ccnn2)cc1 756756487 QHHKEZJCJHFFPS-IBGZPJMESA-N 444.539 4.399 10 10 IICE COc1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)ccc1O 798099472 AMPPPUUZMWRBRA-LFIBNONCSA-N 434.564 4.082 10 10 IICE Cc1cc(Br)cc(CNCc2cc(Cl)ccc2N2CCOCC2)c1O 798955542 RDDJFMJZNFMYIJ-UHFFFAOYSA-N 425.754 4.243 10 10 IICE Cn1nc(-c2ccc(F)cc2F)cc1NC(=O)NCc1cc(Br)ccc1O 806493770 DGMKZBLRMSDQSU-UHFFFAOYSA-N 437.244 4.155 10 10 IICE CSc1cccc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)CC2=O)c1 1124873375 WLBYHHJBSWLQIM-IBGZPJMESA-N 425.598 4.265 10 10 IICE CC(C)(C)Cc1ncc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1127266804 BPSSRFXWDGPNSM-UHFFFAOYSA-N 426.630 4.194 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(c3ccc(Cl)cc3)CCCCC2)c1 1136541297 VCLBGWORBCQPEQ-UHFFFAOYSA-N 436.961 4.049 10 10 IICE Cc1cc(C(=O)NCC2(CC(N)=O)CCCCC2)c(C)n1-c1cccc(Br)c1 1148831225 YRSIQQRNPRKBRQ-UHFFFAOYSA-N 446.389 4.412 10 10 IICE Cc1cc(C(=O)N2CCOc3ccc(Br)cc3C2)c(C)n1-c1ccccn1 1155545481 NFSRJHGRRHTFSC-UHFFFAOYSA-N 426.314 4.286 10 10 IICE Cc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1-c1ccc(F)cc1 1160170575 OBJWYPJCQNQRFK-UHFFFAOYSA-N 448.947 4.480 10 10 IICE COC(=O)c1occc1CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1167189324 VUXVZJGYFSQJHF-UHFFFAOYSA-N 431.286 4.166 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 1234555002 HBYWFSFGUHAFMX-PNLZDCPESA-N 426.536 4.004 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(CC(F)(F)F)C3)cc2Cl)C1 1270439127 JRLMPSHQVMNGJK-DOTOQJQBSA-N 431.930 4.467 10 10 IICE CC(=O)N[C@H](CC(=O)NCc1cc(C)n(-c2ccccc2)c1C)c1c(F)cccc1F 1287660836 LZSVHAGLARKWSB-JOCHJYFZSA-N 425.479 4.256 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCOCc2ccccc2)NC(=O)OC(C)(C)C)cc1 1293792169 FPKWVXWIEWZONK-JOCHJYFZSA-N 441.572 4.042 10 10 IICE CS(=O)(=O)N1CCC(SC2=NC(=O)/C(=C/c3csc4ccccc34)S2)CC1 1307351311 UBXSFHLNDATADJ-YBEGLDIGSA-N 438.621 4.029 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H]3CC[C@H](c4cccc(Cl)c4)C3)cc2)CC1 1312848710 ULCLBLIYTGZYOI-UNMCSNQZSA-N 426.992 4.227 10 10 IICE C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)N(Cc1ccco1)Cc1ccccc1O 1313137151 KOAAKBOUQNYOAA-NZQKXSOJSA-N 433.552 4.465 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCSC3)CC2)cc1 1315516103 YROXEHJFEGXMQM-SFHVURJKSA-N 429.634 4.054 10 10 IICE Cc1cc(Br)cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1357835974 LRVAMIQVFUXDBC-GASCZTMLSA-N 435.337 4.440 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CC[C@H](CN3CCCCC3)C2)nnc1C(C)(C)C 1361098648 YVLLQFIKIURION-OAQYLSRUSA-N 438.664 4.311 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2C(=O)c2ccc(F)c(F)c2)cc1 1437377625 FJMXMJVQLMOTQD-UHFFFAOYSA-N 438.474 4.413 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(C)(C)n1ccc(NC(=O)OC(C)(C)C)n1 1451666110 HJVVQIYAEOFGAQ-QGZVFWFLSA-N 443.592 4.087 10 10 IICE O=C(Cc1ccc(Br)cc1F)Nc1c(-c2ccccn2)nc2ccccn12 1457413959 YNNLINRAYPVIRN-UHFFFAOYSA-N 425.261 4.479 10 10 IICE Cc1cc(N2C[C@H](C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2=O)ccc1Br 1459185474 NSAKWXYWBNVCCT-DOTOQJQBSA-N 444.373 4.054 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccc(F)n4)CC3)cc2Cl)C1 1478527586 FQIZHSZOISNTKG-QGZVFWFLSA-N 445.970 4.142 10 10 IICE CC(C)Cc1nnc(N2CCOC(C)(C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1509224651 ATIXHAIEOPNDTQ-UHFFFAOYSA-N 425.621 4.376 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCc2ccccc2S(=O)(=O)NC(C)(C)C)cc1 1518838645 PYYPGXVMPZDLIR-UHFFFAOYSA-N 439.581 4.101 10 10 IICE CC(C)C(=O)Nc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)ccn1 1519552087 SLXOBUIKPCHILD-MRXNPFEDSA-N 428.964 4.496 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1CCCCC1(F)F 1526958706 HBFYGWVKTBNLRV-LUYJPIOASA-N 442.528 4.359 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC[S@@](=O)CC(F)(F)F)cc1 1528439097 CSMZBEBBXAOLNY-GDLZYMKVSA-N 426.464 4.209 10 10 IICE CC[C@@H](Oc1ccccc1C(C)C)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1534278033 LEQNHGVZPVGEFM-JOCHJYFZSA-N 426.557 4.333 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@@H]2CSc3ccccc3O2)cc1 1544523406 BIKRASULFITZDO-LEWJYISDSA-N 426.582 4.204 10 10 IICE CCC[C@@H](Cn1c(C2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1546911628 HWXCOOQTGAVCTR-FQEVSTJZSA-N 445.583 4.225 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c1 1556447286 HVAXITAGKSJBSQ-QZTJIDSGSA-N 432.524 4.168 10 10 IICE C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1558723623 SOKOUFJDRXRONB-CLOONOSVSA-N 446.595 4.330 10 10 IICE COc1ccc(N(C)CC(=O)N=c2cc[nH]n2Cc2ccc(C(C)C)cc2)cc1Cl 1559624507 MGDZOXQMRPBQDS-UHFFFAOYSA-N 426.948 4.214 10 10 IICE COc1ccc([C@H](C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1560128396 JQHUHDLPTNZSOV-INIZCTEOSA-N 428.488 4.068 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@](C)(O)c3ccc(F)cc3F)c2C)c1 1565193357 WHWBQYQHUSXEOH-DEOSSOPVSA-N 427.495 4.388 10 10 IICE COC(=O)[C@@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1567365482 VCVVZYVHKBIFSM-NZQKXSOJSA-N 431.536 4.271 10 10 IICE COc1cc(N)c(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cc1Br 1570018052 UNTSMVJCQLTQHB-UHFFFAOYSA-N 438.285 4.002 10 10 IICE Cc1ccccc1CCN(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1583733947 IGCCSXVDTDRRQC-HMMYKYKNSA-N 442.581 4.427 10 10 IICE CCN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccc(F)c(C)c1 1583935826 YOVARGXFLNLKAH-UHFFFAOYSA-N 432.407 4.484 10 10 IICE Cc1ccc(Nc2scnc2C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 1586800037 LSRJVCMNFDIUNN-UHFFFAOYSA-N 436.581 4.334 10 10 IICE Cc1cc(CC(=O)NC[C@H]2CCN2C(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1597353111 NEUSTPVZQPWNJH-HXUWFJFHSA-N 431.964 4.416 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1613370131 CWMUNNOTHMMWAA-SFHVURJKSA-N 436.604 4.313 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1)OC 1613613043 FSOORUCGQSBPSE-KNQAVFIVSA-N 437.588 4.393 10 10 IICE CCc1nc(CCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cs1 1613873573 UEANPBSOPNKQPY-IBGZPJMESA-N 427.574 4.123 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2csc(Cc3ccc(Cl)cc3)n2)N(C)C)cc1 1618636431 ZYFYNIRBJFVVEX-OAQYLSRUSA-N 443.016 4.486 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4cccn4C)n3CCC=C(C)C)CC2)cc1F 1619302117 IUNHQSMJHVQZRD-UHFFFAOYSA-N 438.551 4.114 10 10 IICE CCOC(=O)C1([C@H](C)NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCOCC1 1620629809 CMLMRBJMUYLTNW-SFHVURJKSA-N 438.528 4.379 10 10 IICE CCc1c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cnn1C(CC)CC 1625090575 UOAYLSJADUCRIY-IAGOWNOFSA-N 430.568 4.489 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1629144379 DURJRSHIEGZYBL-XSSIKURBSA-N 426.513 4.056 10 10 IICE Cc1cc(C(=O)NC[C@]2(N(C)C)CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1630863404 NGPDNJCLVNMAAM-NYHFZMIOSA-N 447.421 4.492 10 10 IICE CCS(=O)(=O)c1ccc(O)c(NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1636862440 QRZGYXJVQRHTJB-UHFFFAOYSA-N 432.929 4.499 10 10 IICE COCCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1640450769 JTXDBSFPNVFMFK-HXUWFJFHSA-N 426.479 4.229 10 10 IICE Cc1cc(C(=O)N2CCO[C@H]([C@@H]3COC(C)(C)O3)C2)c(C)n1-c1cccc(C(C)C)c1 1644118367 RYCUCUAWSFNCJD-GOTSBHOMSA-N 426.557 4.210 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccccc1 1652609247 DFEMIOIJJAREOM-XMMPIXPASA-N 435.911 4.397 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)c(C)n1-c1ccccc1 1681187669 DUJOGWWRAXYCPP-SGNDLWITSA-N 449.599 4.330 10 10 IICE Cc1ccc(C2(CNC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CCC2)cc1C 1681962625 CTFDFJNYLOFDNY-UHFFFAOYSA-N 443.538 4.339 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H]3CC[C@@H](c4ccc(Cl)cc4)C3)cc2)CC1 1683345096 XTUPHXAREKWDLQ-IFMALSPDSA-N 426.992 4.227 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1684537914 NXEDMPIXUJJBAI-QHCPKHFHSA-N 448.611 4.208 10 10 IICE CC(C)Cc1nnc(N(C)C[C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1692089406 ZHJISUKUWKCIPU-JOCHJYFZSA-N 443.661 4.083 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCSC[C@H]2C)cc1 1695624277 KFXKZXJGYFQSGC-LJQANCHMSA-N 436.629 4.100 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1 1705653415 GWVSCMYIPSUCEF-QFIPXVFZSA-N 449.624 4.334 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)(C)O)CC1 1712218473 XMNMUSMYWQUMMU-UHFFFAOYSA-N 449.599 4.297 10 10 IICE CSCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccn(C)n1 1712816753 VJUCGJYTPFCAOR-UHFFFAOYSA-N 449.628 4.324 10 10 IICE CCOCc1nnc(N2CC[C@@]3(CCSC3)C2)n1Cc1ccc(N(CC)CC)cc1 1729033708 VHFVJZMVEADPQS-HSZRJFAPSA-N 429.634 4.043 10 10 IICE CC(C)c1nnc(N2CC[C@@H](CN3CCCCC3)C2)n1CCCSc1nccs1 1741351581 TZHIJTOGHAFOOW-SFHVURJKSA-N 434.679 4.353 10 10 IICE Cc1ncc(CN(C)c2nnc(-c3cccnc3)n2CCCSc2nccs2)s1 1762328090 CKWUNYCXJGWMEY-UHFFFAOYSA-N 443.627 4.380 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(COC)CC2)n1Cc1ccc(N2CCSCC2)cc1 1763620348 CAXJDSFJCPVZLG-LJQANCHMSA-N 443.661 4.256 10 10 IICE COC(=O)c1ccc(O)c(-c2csc(NS(=O)(=O)c3ccc(C(C)C)cc3)n2)c1 1858073585 DQOQXCTVUJNIQI-UHFFFAOYSA-N 432.523 4.227 10 10 IICE CCOc1ccc(NC(=O)CCNCc2cc(Cl)cc(Br)c2O)cc1 1860715730 VRFACPSCVGURKJ-UHFFFAOYSA-N 427.726 4.325 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)/C2=C/c2ccc(OC)c(O)c2)cc1 1865664549 RZTZQCKAPDUGSN-FYJGNVAPSA-N 432.451 4.379 10 10 IICE CC[C@@H](NC(=O)[C@H](C)C1CCCC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1867020657 DUVHNZWIIHUSIW-FOIQADDNSA-N 432.520 4.122 10 10 IICE COc1ccc(Br)c(CN[C@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236053893 BMLGOOCFYGQYKL-KGLIPLIRSA-N 443.382 4.289 10 10 IICE CC1=NN(c2cccc(Cl)c2)C(=O)C1=CNc1ccc2c3c(cccc13)C(=O)N(C)C2=O 2297506008 SSYQWVJEIXHGBH-UHFFFAOYSA-N 444.878 4.438 10 10 IICE O=C(COc1ccc(Cl)cc1C=C1SC(=S)NC1=O)Nc1ccc(Cl)cc1 2314485624 AAJOBICDOIQZIC-UHFFFAOYSA-N 439.345 4.500 10 10 IICE COc1cc(C=C2SC(=S)N(C(C)(C)C(=O)O)C2=O)ccc1OCc1ccccc1 2323870535 GTUHDHSKOSJPEZ-UHFFFAOYSA-N 443.546 4.339 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2380738258 WIZTXMCTLBOWKU-CQSZACIVSA-N 441.366 4.115 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(Br)cc3)N=C2C)cc(OC)c1OC 13119090 DJJORHKATGMRML-SXGWCWSVSA-N 431.286 4.281 10 10 IICE Cc1c(C(=O)C(=O)OC(C)C)cc(-c2ccc(S(C)(=O)=O)cc2)n1-c1cccc(F)c1 138055849 GWQYQOQXVFNANI-UHFFFAOYSA-N 443.496 4.130 10 10 IICE CN(C)c1cccc(NC(=O)c2cc(Br)ccc2I)c1 217453337 QXVVAFXKMPCFPN-UHFFFAOYSA-N 445.098 4.372 10 10 IICE CCCN[C@H]1C(=O)Nc2cc(N(CCOC)Cc3ccccc3)c(Br)cc21 384361172 MWTNDRDTOICZBV-HXUWFJFHSA-N 432.362 4.095 10 10 IICE CC(=O)Nc1ccc(C)c(N2C(=O)C(O)=C(c3cccs3)[C@@H]2c2ccc(O)c(O)c2)c1 526510206 JOXPXBWUSOCRIV-NRFANRHFSA-N 436.489 4.483 10 10 IICE COc1c(C)cc(CN(C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1C 725863790 ILGHSMSBNKYOCJ-KDURUIRLSA-N 443.563 4.406 10 10 IICE CCc1ccccc1NC(=O)C[C@@H](C)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 773147824 VPJCLCSWMRDQFH-OAQYLSRUSA-N 434.628 4.288 10 10 IICE C[C@@H](NC(=O)N1CC[C@@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 801763818 NQZCJPTXGAAPDZ-KOSHJBKYSA-N 430.593 4.246 10 10 IICE CC(C)(C)OC(=O)N[C@](C)(C(=O)NCc1cc(Br)ccc1O)c1ccccc1 804736197 MYRQJFYVIUMHHV-NRFANRHFSA-N 449.345 4.211 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC=C(c4ccnn4C)CC3)cc2Cl)C1 805450536 JWWKCRWRYQWNLN-QGZVFWFLSA-N 427.980 4.309 10 10 IICE Cc1cccc(-c2nnnn2[C@@H]2C[C@H]2C)c1NC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 806466848 DFGWPGSJKNUQQP-VGOFRKELSA-N 445.571 4.492 10 10 IICE CCc1noc(C[C@@]2(O)CCCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)C2)n1 856673903 LYIGHOXJTBCXQY-DEOSSOPVSA-N 448.527 4.056 10 10 IICE COc1ccc2c(c1)c1c(n2Cc2nc(CCNC(=O)OC(C)(C)C)no2)CCCC1 904769840 VGSNHGOLXJKDCH-UHFFFAOYSA-N 426.517 4.027 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@]2(C)CC2(Br)Br)C2CC2)cc1 1124835061 BJDHFLRYIGOADC-MRXNPFEDSA-N 430.184 4.140 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3c(C(=O)OC)ccc(OC)c3F)ccc21 1134431384 CIRBUCVGUXAOPB-UHFFFAOYSA-N 428.460 4.091 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2ccc(N3CCCC3=O)cc2)cc1 1136425001 SSQCDZBRTWXHAK-LJQANCHMSA-N 443.547 4.453 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC[C@@H]1[C@H](C)Nc2ccnn2[C@H]1C 1137350544 PNRNADQWAWHAQO-GRDNDAEWSA-N 435.366 4.171 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)C(=O)N1c2ccccc2C[C@@H]1C 1140906101 KBTDSZFXOHDJGO-ROUUACIJSA-N 429.520 4.003 10 10 IICE CCCN1CCC(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1143392460 UCNWWRKDDASDHS-UHFFFAOYSA-N 433.394 4.103 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)c3cc4ccccc4s3)CC2)c1O 1169772787 XBXXQFLXZAXJGF-UHFFFAOYSA-N 428.941 4.421 10 10 IICE C[C@H](NC(=O)c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1)c1ccccc1O 1171729473 DTIIEQHDCQZUFF-INIZCTEOSA-N 445.544 4.125 10 10 IICE COc1ccc(Cl)cc1[C@@H](O)CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1253807635 HIWUQSYPODWDNV-QFIPXVFZSA-N 441.959 4.331 10 10 IICE CC[C@H](C)c1nnc(N(C)OC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291460143 PKYBWWQTBBBZPC-KRWDZBQOSA-N 431.556 4.126 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1292179586 WBKRTQBKLOATCM-MRXNPFEDSA-N 434.367 4.461 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCOC[C@@H]3CC(=O)c3cccs3)c2C)cc1 1294366877 ZEXLZYXYGQZMAP-IBGZPJMESA-N 438.549 4.278 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CC[C@@H](Cc3cnn(C)c3)C2)cc1 1295411763 WCZVRTPUTPKMJH-NRFANRHFSA-N 435.620 4.099 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1F 1298056527 QYPATNKCCRPQOJ-RTWAWAEBSA-N 445.583 4.024 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3O)C2)cc1 1299770455 RTLMUFOQLHQPOA-INIZCTEOSA-N 441.528 4.004 10 10 IICE C[C@@H]1[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1302197391 IPENGSBOIQQXJH-NMFUWQPSSA-N 432.542 4.219 10 10 IICE Cc1nnsc1Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1304115130 AHHOBINMJBISDH-UHFFFAOYSA-N 439.633 4.312 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)OC 1313772419 RAZKMUKTESGAPQ-UGKGYDQZSA-N 437.588 4.393 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC1CC1 1314557995 IZKVVHXVHLDJQU-WJOKGBTCSA-N 439.629 4.358 10 10 IICE COCC[C@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1315995410 GPKKXHZUOGTGOO-LJQANCHMSA-N 439.629 4.216 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(O[C@@H]4CC4(F)F)cc3)cc2F)C[C@@H](C)O1 1350933542 OUYDISXEVUXHNI-VTJXTGGHSA-N 434.458 4.156 10 10 IICE CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1351461464 ZFSADWLCUGRCOK-UHFFFAOYSA-N 446.551 4.082 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Oc3ccc(F)c(F)c3)c3ccccc3)CC2)cc1 1356445300 INEAQJFYKSCRLJ-XMMPIXPASA-N 438.474 4.442 10 10 IICE CCOC(=O)[C@@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 1361046807 MNDWJESNFAHBAJ-KAKMCVKYSA-N 443.547 4.469 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C)ccc21 1438179304 SVFPHVJIFUIYTH-XLIONFOSSA-N 429.561 4.032 10 10 IICE CCN(CCCNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)C(=O)OC(C)(C)C 1443434315 VTVDIORWCYSLAQ-UHFFFAOYSA-N 429.561 4.480 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCN(CC(C)C)C2)c(C)n1-c1ccc(Br)cn1 1446510677 CBMJTEFKLCMKKM-SFHVURJKSA-N 447.421 4.349 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2nccc2-c2ccc(F)cc2)cc1 1447563999 OSIDMXKRBUKIBZ-INIZCTEOSA-N 431.467 4.451 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cccc(Nc2nccc(C(F)(F)F)n2)c1 1464363532 QXPOCNCCVFCQSI-UHFFFAOYSA-N 443.429 4.328 10 10 IICE Cc1cc(C(=O)N2CCC(c3nc(N(C)C)n[nH]3)CC2)c(C)n1-c1cccc(C(C)C)c1 1467976381 OKPHSZRKUXSTEA-UHFFFAOYSA-N 434.588 4.421 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1 1469838445 IYJRMBJYQBQRDV-RTBURBONSA-N 431.577 4.494 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)CC3CCCC3)CC2)c(C)n1-c1ccccc1 1471036525 XNYJUDIGNFAFGE-UHFFFAOYSA-N 436.600 4.418 10 10 IICE CC[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1499652728 PVVHNLCOCAJBJK-RXVVDRJESA-N 443.661 4.181 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCCOCC(C)C)CC2)cc1 1504291915 CQJUYUXIMSNOKW-UHFFFAOYSA-N 441.620 4.334 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)cc3)cc2Cl)C1 1524252679 AZRAHZQZTBUFPZ-GOSISDBHSA-N 427.976 4.343 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3-c3nc(C(C)(C)C)no3)C2)cc1 1526246104 BTFLZYVTYRCXTB-KRWDZBQOSA-N 434.540 4.299 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CCCC2 1528728794 PZVOXEAOMOCEGM-CQSZACIVSA-N 444.553 4.162 10 10 IICE Cc1cc(CCNC(=O)c2cnc(OCc3ccccc3)cn2)c(C)n1-c1ccccc1 1534242735 VOXLJLFKLSONBZ-UHFFFAOYSA-N 426.520 4.436 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(I)ccc1F 1544094578 WYRILMOOURMHMW-UHFFFAOYSA-N 426.273 4.159 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 1557355268 DGXOOHBJEXSGGM-IBGZPJMESA-N 447.620 4.263 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCN1CCN(Cc2ccccc2)CC1 1559047911 JKNDLPYFHNGCGG-UHFFFAOYSA-N 444.535 4.056 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)N(C)C)cc1 1586054884 PYPBAPYPTDGANY-DEOSSOPVSA-N 430.552 4.038 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)cc1 1616428569 IWQLZNYVYCXCOY-NRFANRHFSA-N 437.490 4.122 10 10 IICE COc1ccc(N2CCN(Cc3ccc(OCc4ccccc4F)nc3)CC2)c(OC)c1 1620515356 IUBYCKNDEXKVPC-UHFFFAOYSA-N 437.515 4.139 10 10 IICE C[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)Sc1ccccc1 1629076686 BBOAWSOQYUQNOV-CQSZACIVSA-N 448.591 4.165 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1640257649 YGAJUPBSSSNGQQ-XGCMIMOYSA-N 447.959 4.242 10 10 IICE Cc1cc(C(=O)Cn2cc(Br)c([N+](=O)[O-])n2)c(C)n1-c1ccc2c(c1)CCC2 1643655885 CBPRESPWYIOGAZ-UHFFFAOYSA-N 443.301 4.333 10 10 IICE CCOC(=O)CS[C@H](CNC(=O)c1sccc1-n1c(C)ccc1C)C(F)(F)F 1650766326 YZORJKSUDDCCNY-CQSZACIVSA-N 434.505 4.113 10 10 IICE CCOC(=O)[C@@H]1CCCc2sc(=O)n(CC(=O)c3cc(C)n(-c4ccccc4)c3C)c21 1656738350 DXZFAKPQJWOMHY-GOSISDBHSA-N 438.549 4.183 10 10 IICE CC(C)(NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(C(F)(F)F)c1 1684142007 PPOZAFDVOZVWOF-UHFFFAOYSA-N 435.490 4.401 10 10 IICE COc1ccccc1[C@@H]1CN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CCO1 1687219879 ZQEYRGHZGWSKRS-VWLOTQADSA-N 433.552 4.428 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)cc1C 1696556840 ZTPFZEIMCXQRAH-SFHVURJKSA-N 439.633 4.126 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)CC1 1711596136 QUDBHEULWQYDTI-RUZDIDTESA-N 436.604 4.102 10 10 IICE CN(c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1)[C@H]1CCSC1 1729361656 VQVRDMKLCDSWGB-FQEVSTJZSA-N 445.702 4.410 10 10 IICE CCc1ccc(-c2nnc(N(C)[C@@H]3CCOC3)n2CCCSc2nccs2)cc1 1744319163 CQRILTWRDKYXBT-GOSISDBHSA-N 429.615 4.372 10 10 IICE COCC(C)(C)Cn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1749282443 CCJPBSPYYQHIQN-UHFFFAOYSA-N 447.599 4.014 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1763850871 KAAUNEGRHGGLPK-LJQANCHMSA-N 436.629 4.424 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCC(=O)N3)nnc2N2CCC(CC)(CC)C2)cc1 1766611398 DQTXZCVNJVBGIA-OAQYLSRUSA-N 438.620 4.140 10 10 IICE COC(=O)c1ccc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)cc1 1860086143 MNGOPFHCYZMJKK-OVCLIPMQSA-N 429.548 4.205 10 10 IICE CCN1C(=O)C(Nc2cccc([N+](=O)[O-])c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422595 FMOIRADDMKPCBI-UHFFFAOYSA-N 430.464 4.214 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC(NCc3c(O)cccc3Br)CC2)C1 1923342993 FFMQCDSEMQKOLE-UHFFFAOYSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNCc1cc(Cl)cc(Br)c1O)C(F)(F)F 1965977184 WRXOLGMSPIGTKH-LLVKDONJSA-N 447.679 4.353 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)NCCCCN=[N+]=[N-])C1 2010405647 KFKZUKHVPSARGF-JOCHJYFZSA-N 431.537 4.037 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@H](NCc1cc(Cl)ccc1O)CO2 2160180154 GMPKMHBQHCUQNT-FQEVSTJZSA-N 430.932 4.096 10 10 IICE O=C(CCN1C(=O)C(=CC=Cc2ccccc2)SC1=S)Nc1ccccc1C(=O)O 2297350532 WJQXZAFRSDOXCD-UHFFFAOYSA-N 438.530 4.171 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4ccco4)SC3=NC2=O)c(C)n1-c1ccc(F)cc1 2297469750 QRZYTDNPNAAMJK-UHFFFAOYSA-N 433.468 4.494 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCC(=O)OC)C2=O)ccc1OCCC(C)C 2314767999 JSSMOGGZNHEBDH-UHFFFAOYSA-N 437.583 4.275 10 10 IICE COc1ccc(C2=NN(C)C(=O)C2=Cc2ccc(OC(=O)c3ccccc3)c(OC)c2)cc1 2332134159 QPZFDVCJZFMDHF-UHFFFAOYSA-N 442.471 4.183 10 10 IICE Cc1ccc(CN[C@H]2CC[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c(O)c1Br 2352949159 ZQVDFPNWNKMHKJ-HRCADAONSA-N 425.367 4.483 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14460016 ZDWGRAJKBSZWAF-IUTNIJSXSA-N 428.554 4.304 10 10 IICE CCOC(=O)CCC(=O)Nc1sc2c(c1C(=O)OCC)CC[C@@H](c1ccccc1)C2 22672104 ONJBQSAYYJAURP-MRXNPFEDSA-N 429.538 4.479 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(c4nnc5ccccn45)CC3)c2C)cc1 27138479 ONUQGXYBJPAAPU-UHFFFAOYSA-N 429.524 4.165 10 10 IICE Cc1ccc(-n2cccc2/C=C2\C(=N)N3N=C(COc4ccccc4)SC3=NC2=O)cc1 32964228 CWFXMHLRBLISNW-ONWPUYBOSA-N 441.516 4.484 10 10 IICE O=S(=O)(Nc1nc(-c2ccccc2)cs1)c1cnc(Cl)c(Br)c1 35551130 GAGCXAXFRUVZIA-UHFFFAOYSA-N 430.736 4.422 10 10 IICE O=C1N=C(Nc2cc(C(=O)O)cc(C(=O)O)c2)S/C1=C/c1ccc(Cl)cc1Cl 101455388 JVWFDKVMGWGKRQ-MKMNVTDBSA-N 437.260 4.472 10 10 IICE CN(C)c1cccc(NS(=O)(=O)c2ccc(Br)cc2Br)c1 161408119 WLTRUIVTNBSTTD-UHFFFAOYSA-N 434.153 4.078 10 10 IICE CCCCCOc1cc(O)c2c(c1N)C(=O)c1c(N)c(OCCCCC)cc(O)c1C2=O 206679836 ZTPZCORCIQIKMU-UHFFFAOYSA-N 442.512 4.176 10 10 IICE COc1cccc(N2CCC[C@H](NC(=O)c3cc(C)n(-c4ccc(C#N)cc4)c3C)C2)c1 303669473 JIFDTADFTFPWIE-NRFANRHFSA-N 428.536 4.373 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cn2c(-c3cscn3)nc3ccccc32)cc1F 731346734 SKMIQOVZTOFTEH-UHFFFAOYSA-N 437.544 4.462 10 10 IICE COc1cccc(F)c1[C@@H](C)NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743661430 XTGFLWIVRYHQLG-HUUCEWRRSA-N 437.462 4.465 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)c1 743672257 HFNKKZPXYJVYML-KXBFYZLASA-N 429.517 4.027 10 10 IICE Cc1cc(C(=O)Nc2cc(I)ccc2O)c(C)n1-c1ccccn1 748309563 NOWBQUSINJKTOA-UHFFFAOYSA-N 433.249 4.052 10 10 IICE C[C@@H]1CN(c2ccc(CN[C@H](C)c3cc(Br)c(F)cc3O)cn2)C[C@@H](C)O1 756419560 VMQQSZZYLJQKFU-MGPQQGTHSA-N 438.341 4.153 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 764535915 HOVMQBGXFQWCSJ-UGKGYDQZSA-N 444.620 4.464 10 10 IICE CN1CCC[C@H](CNC(=O)NCc2cccc(Br)c2O)[C@H]1c1cccs1 765510826 CSCAHYLHMVMUNM-DYVFJYSZSA-N 438.391 4.099 10 10 IICE COc1cccc(CN2CCC(N(CC(F)(F)F)C(=O)c3ccccc3F)CC2)c1O 769466620 NSMDKCIQCGJNNJ-UHFFFAOYSA-N 440.437 4.209 10 10 IICE COc1c([N+](=O)[O-])cc(N2Cc3ccccc3C3(CC3)C2)c([N+](=O)[O-])c1Br 775546794 VPUPSAUYRFHNQK-UHFFFAOYSA-N 434.246 4.326 10 10 IICE C[C@H](NC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(N2CCOCC2)cc1 776014904 SDDDFVYKIWDZCU-ORAYPTAESA-N 443.416 4.465 10 10 IICE Cc1cc(Br)c(O)c(CN(C)[C@@H](CO)c2cccc(Br)c2)c1 781906753 BQCDFZFPRYCJJP-INIZCTEOSA-N 429.152 4.391 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](c3cc(F)ccc3F)C(F)F)CC2)cc1 788753298 FQBRIKSXNGZVQT-IBGZPJMESA-N 425.426 4.202 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]([C@@H](O)C(F)(F)F)C3)cc2Cl)C1 799994545 CUTPJOMXJVPAHM-SIXWZSSISA-N 447.929 4.421 10 10 IICE COc1cc(C)c(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)c1C 806768673 LHYQWUNSCITYAL-UHFFFAOYSA-N 436.600 4.474 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3C[C@H](C[C@H]4COCC(=O)N4)c4ccccc43)c2C)c1 807705051 AXDYEJDANHVLOR-SFTDATJTSA-N 443.547 4.052 10 10 IICE Cc1noc2nc(-c3ccccc3)cc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c12 813530594 OSKZQPJCFWKFQC-UHFFFAOYSA-N 442.519 4.307 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](N3CCC3)[C@H](F)C2)c(C)n1-c1ccccc1Br 819532147 UHVLMRGKBIYHQU-UYAOXDASSA-N 434.353 4.115 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H]1Cc1c(F)cccc1Cl 918225014 ZQZUSRHKWRRZPZ-QGZVFWFLSA-N 449.929 4.372 10 10 IICE CC[C@H](CSC)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1127579544 QNZFHRHOUWLXMR-DFSFMLJYSA-N 426.604 4.017 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H](C)Cc3ccc(OC(F)(F)F)cc3)C2)cc1 1129992966 CSXGJTNGJDRPHL-SJLPKXTDSA-N 436.474 4.415 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)[C@@H](C)C2)c1 1136789747 CGEWLKMMKKVYHT-ROUUACIJSA-N 439.556 4.377 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccnc(-c2ccccc2)c1N 1137349525 XBHXVYUFXBTSMV-UHFFFAOYSA-N 426.314 4.461 10 10 IICE C[C@H](NC(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 1142503845 GMRQHIXSNOPYSL-PXNSSMCTSA-N 433.593 4.030 10 10 IICE CCS(=O)(=O)c1ccccc1CC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1142528414 WXRFWLWXEQZVMW-UHFFFAOYSA-N 428.598 4.108 10 10 IICE CC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1160644795 BOKNIDWRMSRWDH-TZIWHRDSSA-N 433.474 4.309 10 10 IICE CC[C@H](CN(C)CC(=O)NCc1ccc(N(C)C)cc1)Oc1ccc(Cl)c(Cl)c1 1193485103 NNMQKORJKHHBOI-GOSISDBHSA-N 438.399 4.465 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCOc4c3ccc(Cl)c4Cl)C2)cc1 1248489892 IICQKEIUQGHMEV-SCLBCKFNSA-N 436.339 4.404 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](N3CCCC3)C2)n1CCCSc1nccs1 1287446290 JQFRXCGBQFELEV-GOSISDBHSA-N 434.679 4.180 10 10 IICE CC[C@H](C)[C@@H](Cn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C)OC 1291424896 DIUQQJBPPZLMCR-LAUBAEHRSA-N 447.599 4.111 10 10 IICE COc1ccc(N2CCCN(C(=O)C3(C(=O)OC(C)(C)C)C(C)(C)C3(C)C)CC2)cc1 1291855778 DIEZEAPLANAEGZ-UHFFFAOYSA-N 430.589 4.128 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cncn1 1306815589 MAQVACXKEGNNRU-UHFFFAOYSA-N 432.576 4.271 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccn(-c2cc(F)cc(F)c2)n1 1456079534 ZBHXIODMELBXHT-UHFFFAOYSA-N 448.420 4.151 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@](N)(c1cccc(F)c1)C(F)(F)F 1457672734 NXKQWJBUOYCUSI-KRWDZBQOSA-N 449.242 4.059 10 10 IICE O=C(c1c(F)ccc(O)c1O)N1CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 1457717572 ZRCHOSWLIPAHAF-JOCHJYFZSA-N 440.902 4.438 10 10 IICE CCCCNC(=O)C1(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CCCCC1 1464676226 IDTYZWDAZVQMEE-UHFFFAOYSA-N 425.573 4.452 10 10 IICE C[C@@H](NC(=O)NCC1(c2ccccc2)CC(O)(C(F)(F)F)C1)c1ccc(N(C)C)cc1 1469854664 SYFINOATNFKMMQ-NYYVNYEXSA-N 435.490 4.138 10 10 IICE COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1470594470 TZDWBZQXBCROTQ-VGSWGCGISA-N 431.964 4.204 10 10 IICE COC1CCN(c2ccc(CN[C@H](CO)c3ccc(Br)c(F)c3)cc2)CC1 1473508179 XWSTVEZXOYEFHS-OAQYLSRUSA-N 437.353 4.027 10 10 IICE C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473771011 RBKVYKQKIUUXKR-GJZGRUSLSA-N 443.459 4.048 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1499936711 AQBDCYBNFPTAJH-UQBPGWFLSA-N 437.588 4.129 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CCc1nc2c(s1)CCCC2 1509138301 NUELJWUYAGQWDQ-UHFFFAOYSA-N 425.602 4.397 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cccc(C(F)(F)F)n2)C1 1526349314 CPGBRZMHYSXUIL-UHFFFAOYSA-N 430.474 4.138 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1527735496 ULVQCILEUXZAST-KNQAVFIVSA-N 427.976 4.242 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(OC(F)F)cc(OC(F)F)c3)C2)cc1 1529403523 AKEKVNSGBRABSL-CYBMUJFWSA-N 442.409 4.154 10 10 IICE CSCC[C@@H](C)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1538625514 GABAFCRJFOJRND-OPCAMPFDSA-N 426.604 4.017 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N1CCC[C@@H]1C 1542226963 OEXXHYRAGFJNJK-HNNXBMFYSA-N 443.393 4.447 10 10 IICE O=C(Nc1ccc(F)cc1)Nc1cccc2c1CCN(C(=O)c1c(F)ccc(O)c1O)C2 1558928199 YJFLSXPVXGPPJC-UHFFFAOYSA-N 439.418 4.219 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 1564946458 PXGNXEXABICUEY-AJTFRIOCSA-N 434.628 4.300 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)/C(F)=C\c3ccc(C(F)(F)F)cc3)cc2)CC1 1567591550 IPFKRZCDBMPBDD-KGENOOAVSA-N 449.448 4.001 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CCc3nnc(-c4cccc(C)c4)n3C2)cc1 1587459533 AIVDONXJUHXNPG-JOCHJYFZSA-N 431.584 4.321 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(F)c3Br)CC2)cc1F 1595482609 OLGSSTDRZXHZEA-UHFFFAOYSA-N 445.691 4.352 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1c(OC)cccc1C(=O)OC 1613364608 QXBININQFNJUSY-UHFFFAOYSA-N 440.521 4.429 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)cc1C 1617513535 DQBILUATFLKANN-NRFANRHFSA-N 445.519 4.147 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@@]2(C)Cc2ccc(OC(F)(F)F)cc2)cc1 1620158019 XZYWPWWLFMKRDE-QHCPKHFHSA-N 449.517 4.365 10 10 IICE O=C(N(Cc1ccccc1O)C[C@@H]1CCCO1)C(F)(F)c1ccccc1Br 1632398189 DBENBGWMVUTDQX-HNNXBMFYSA-N 440.284 4.454 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(C(F)(F)F)ccc2N)c1 1633084014 SFXYWMSVBLHFAK-UHFFFAOYSA-N 442.441 4.032 10 10 IICE Cc1cc(C(=O)NCc2nc3c(s2)COCC3)c(C)n1-c1cccc(Br)c1 1638997181 PYBXQORUISIWCV-UHFFFAOYSA-N 446.370 4.316 10 10 IICE Cc1cc(C(=O)N[C@H](C2CCOCC2)C2CC2)c(C)n1-c1ccc(Br)cn1 1639717646 VJEMDNNRGWDKSS-FQEVSTJZSA-N 432.362 4.187 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC3(CCN(Cc4ccccc4)CC3)C2)c([N+](=O)[O-])c1 1642730847 ALASUGXNGDWVSK-NTMALXAHSA-N 435.524 4.274 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C(F)=C\c3ccc(F)c(C(F)(F)F)c3)cc2)CC1 1651024360 QHMBTFQMCMIHKY-DEDYPNTBSA-N 439.428 4.223 10 10 IICE COc1ccc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(OC(F)F)cc4)c3C)oc2c1 1656535305 VPFQVJBAZIKUAG-UHFFFAOYSA-N 442.418 4.495 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC3(c4ccc(C(F)(F)F)cc4)CC3)C2)cc1 1686132746 ZURCVQDIFJZHEX-GOSISDBHSA-N 433.474 4.324 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2C[C@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1692981241 FRRRRABREMWZRV-GHTZIAJQSA-N 448.615 4.217 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3Cc3nc(C(C)(C)C)cs3)CC2)cc1 1711865371 SRIHSBOOBLAFMS-UHFFFAOYSA-N 440.617 4.114 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC(N3CCCCC3)CC2)nnc1C(C)(C)C 1724234863 KJVKWYDJFNRFAN-UHFFFAOYSA-N 438.664 4.453 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C(C)C 1728027958 VIJMPLNERPYWBL-UHFFFAOYSA-N 436.604 4.361 10 10 IICE COC[C@H]1CCCCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1730548787 ZCKOLSCLQHZVSV-IBGZPJMESA-N 429.584 4.442 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1)OC 1745267135 SAFMFHGKOOKTMW-DENIHFKCSA-N 437.588 4.393 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1752722409 WSIPRVYLMHXRQL-SJORKVTESA-N 444.630 4.483 10 10 IICE CCc1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N(C)Cc2ccccc2O)s1 1764512896 PKJCWAUSFWYVHX-UHFFFAOYSA-N 436.585 4.154 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N([C@H](C(=O)O)c4ccccc4)C3=O)n12 1858591236 FQVIZWQXRJIUGL-WHGQRRHOSA-N 449.966 4.385 10 10 IICE Cc1cc(Cl)ccc1NC(=O)COc1cccnc1NC(=O)Oc1ccc(N)cc1 1858680610 DGSNTYFIEBKJHA-UHFFFAOYSA-N 426.860 4.254 10 10 IICE COC(=O)c1c(NC(=O)c2cnccn2)sc(C)c1-c1ccc(Br)cc1 1866102274 JYTXGIVKFXNDRR-UHFFFAOYSA-N 432.299 4.315 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccccc1NC(=O)N1CCCC1 1874179190 SLNUFSVIEHEVQK-UHFFFAOYSA-N 439.471 4.342 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC12CCC(NCc1cc(Br)ccc1O)CC2 2090478433 JYLISBXGHURCDL-RYZJOYRSSA-N 425.367 4.470 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cc(Br)ccc3O)C[C@@]2(C)C1 2116288603 RZYDYKIOKRTMIS-NBQZKYEYSA-N 425.367 4.280 10 10 IICE CCCOc1c(Br)cc(C=C2C(=O)N(CC)N=C2C(F)(F)F)cc1OC 2332114460 GCDMOZRPMNNVEF-UHFFFAOYSA-N 435.240 4.410 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3CC[C@@H]([C@@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2381141525 AHCNGDHBGVHAQJ-PNBKFKSVSA-N 443.357 4.431 10 10 IICE CS(=O)(=O)Oc1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)cc1 3003256 CGUKIXDSQCVFBQ-OQLLNIDSSA-N 425.940 4.084 10 10 IICE COc1ccc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccc(OC)cc3)C2=O)cc1 15039736 PARIIYNLHJFNFK-RGEXLXHISA-N 442.562 4.324 10 10 IICE CC1CCN(C(=O)CN2C(=O)/C(=C/c3ccc(-c4ccccc4)o3)SC2=S)CC1 39793807 ALLTZFJXPIHADO-UYRXBGFRSA-N 426.563 4.406 10 10 IICE Cc1ccc(N2C(=O)C[C@H](N3C(=O)/C(=C/C=C\c4ccccc4)SC3=S)C2=O)cc1 102882758 DNRROVRYDPUHRR-TWIOELIHSA-N 434.542 4.085 10 10 IICE O=C1NCCOc2ccccc2CCCCCC12CCN(Cc1cccc(F)c1O)CC2 643589591 XSVIQADVHJHKCL-UHFFFAOYSA-N 440.559 4.425 10 10 IICE Cc1cc(-c2csc(N3CCN(c4ncccn4)CC3)n2)c(C)n1-c1ccc(F)cc1 728592669 PRMTVBSRNMYQLJ-UHFFFAOYSA-N 434.544 4.473 10 10 IICE Cc1cc(C(=O)COC(=O)c2c(F)ccc([N+](=O)[O-])c2F)c(C)n1-c1ccc(F)cc1 752568562 QCBLOUAXNJAVLO-UHFFFAOYSA-N 432.354 4.459 10 10 IICE Cc1cc(N2CCC[C@H](N[C@@H](C)c3cc(Br)cc(Cl)c3O)C2)n(C)n1 774469029 QOFGXFPZWORFMI-JSGCOSHPSA-N 427.774 4.170 10 10 IICE COCc1ccccc1CS(=O)(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 805089053 AHUPQZCFMVRXOS-KRWDZBQOSA-N 437.005 4.342 10 10 IICE CN1CC[C@H](NC(=O)NCc2cc(Br)ccc2O)[C@H]1c1ccc(Cl)cc1 805239745 PDCMDAUECQRUQG-FUHWJXTLSA-N 438.753 4.053 10 10 IICE CC(C)(C)c1cc(O)c(O)c(CN2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)CC2)c1 813122960 HPGHLRPBXRBPRY-UHFFFAOYSA-N 426.601 4.256 10 10 IICE O=C1N=C(SCC(=O)N2CCOC[C@H]2C2CC2)S/C1=C/c1csc2ccccc12 814772889 HTLVYLVTSRWXQP-ZJTXRKTBSA-N 444.603 4.242 10 10 IICE Cc1cc(CC(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)c(C)n1-c1ccccc1 1141469725 AJFDPEIUUMYBMB-UHFFFAOYSA-N 431.945 4.300 10 10 IICE CSCc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccc1F 1141815605 QHHOHFDOHLZHGN-UHFFFAOYSA-N 442.478 4.474 10 10 IICE Cc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc(O)c2ccccc12 1150353772 GSYILRHABJEZLP-QGZVFWFLSA-N 425.916 4.002 10 10 IICE COc1cnc([C@H]2CCCN2C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)nc1O 1158517380 VRPWULCNAWDCCA-GOSISDBHSA-N 426.904 4.229 10 10 IICE CCN(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)c1cc2ccccc2o1 1190528848 NBRSWAAEHZGUIW-NFBKMPQASA-N 437.584 4.007 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 1230200882 NLGFZIVUIAJBNE-PMACEKPBSA-N 446.636 4.328 10 10 IICE COc1ccc(N2CCN(C(=O)NCC(C)(C)c3ccc(C)cc3C)CC2)c(OC)c1 1251464128 FIXJKZMIUAKPED-UHFFFAOYSA-N 425.573 4.130 10 10 IICE CCN(CC)CCNC(=O)c1ccc(NC(=O)c2sccc2-n2c(C)ccc2C)cc1 1290622081 MTDFJXDXDNDYIQ-UHFFFAOYSA-N 438.597 4.480 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)c1 1291938981 ZWUJYWRAWXHFSZ-UHFFFAOYSA-N 425.488 4.369 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCN(CC)[C@H](C)C2)cc1 1295415169 OPBQNPWHYVVAQD-OAQYLSRUSA-N 447.631 4.073 10 10 IICE Cc1cc(CNC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(C)n1-c1ccccc1 1313102833 SAHMIVHRTPOMTR-NQIIRXRSSA-N 426.561 4.291 10 10 IICE CCN(c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1)C1CCCC1 1313573070 BVQIYEAPCAVHRR-UHFFFAOYSA-N 425.621 4.427 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)sc2c1CCCC2 1349148380 WFFIYIBMDQCUHK-OAHLLOKOSA-N 426.538 4.022 10 10 IICE O=C(C[C@@H]1CCC[C@H](C(F)(F)F)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1360045350 CAISPXVGBLTRKW-DLBZAZTESA-N 436.421 4.263 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 1444993090 YNDBHYQQCUNBBO-LBPRGKRZSA-N 443.809 4.388 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C3CC3)c2C)cc1 1447126513 HDILOLDYAOOAQD-OAQYLSRUSA-N 427.545 4.136 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C 1463782450 COIXKKSVGOOZMG-OAQYLSRUSA-N 447.645 4.378 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1OCCC(C)C 1470446314 NFUUOKRATZFNFI-UHFFFAOYSA-N 426.557 4.011 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CCCN1CCCCCC1=O 1517148495 OJOBNECBWZCUSL-UHFFFAOYSA-N 439.604 4.146 10 10 IICE Cc1cc(CC(=O)N[C@H](Cc2ccccc2)C(=O)N(C)C)c(C)n1-c1ccc(Cl)cc1 1520926265 CXHGMRUJOYXEGK-HSZRJFAPSA-N 437.971 4.106 10 10 IICE CC[C@@](C)(NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C(F)(F)F 1530428148 KQJUNLCZNMLJLY-OJNOIJSXSA-N 434.480 4.264 10 10 IICE CCOC(=O)c1c(NC(=O)c2ccc(C(=O)NC)nc2)sc(C)c1-c1ccc(C)cc1 1531341593 BPMYXYJLMWZWSV-UHFFFAOYSA-N 437.521 4.216 10 10 IICE CC[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)[C@H](CC)CO1 1531531943 GZGXILYCWWIEDI-DSWHRGLISA-N 438.640 4.146 10 10 IICE Cc1c(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)noc1C(C)(C)C 1532477702 NXSRFWKJANDKLY-UHFFFAOYSA-N 433.420 4.216 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCOc2ccc(Br)cc21 1536550097 OGVMHBLJPPNOTK-KXBFYZLASA-N 431.374 4.437 10 10 IICE CN(c1ccc(CNC(=O)c2nccn3c(Br)cnc23)cc1)C1CCCCC1 1542410737 PFWPXBYEGUENJK-UHFFFAOYSA-N 442.361 4.191 10 10 IICE COc1cc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)ccc1C 1544498775 CDMAWPSNBYCBJM-UHFFFAOYSA-N 449.526 4.148 10 10 IICE Cc1cc(C(=O)NN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c(C)n1-c1cccc(C(C)C)c1 1556113994 NVEUUDDCDMOCET-SANMLTNESA-N 444.535 4.330 10 10 IICE C[C@@H]1c2ccc(C(=O)NCCCSc3nccs3)n2CCN1C(=O)OC(C)(C)C 1565620008 HMPHFUWZLQBPCB-CQSZACIVSA-N 436.603 4.169 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CC23CN(C(=O)OC(C)(C)C)C3)cc1)C1CCCCC1 1583698854 BERDMEOHZIKEKJ-OAQYLSRUSA-N 427.589 4.329 10 10 IICE CCS(=O)(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1584853294 OQYSCKOHGHNLHW-UHFFFAOYSA-N 425.554 4.441 10 10 IICE CCO[C@H]1COCC[C@H]1CC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 1585492789 MUVWFQCGFYTCJL-RDPSFJRHSA-N 426.557 4.126 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c1 1585665092 LORJVIMXPMVQSF-HNNXBMFYSA-N 431.920 4.173 10 10 IICE OC1CCN(c2ccc(CNc3cc(C(F)(F)F)nc(-c4cccnc4)n3)cc2)CC1 1612646380 VMHDUALYJJTSII-UHFFFAOYSA-N 429.446 4.131 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)c(C)n1-c1cccc(Cl)c1 1622292824 KHASHDVLJPAYBM-IBGZPJMESA-N 426.900 4.455 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)cc1 1622497362 FGRXDNYGGBOFEC-HXUWFJFHSA-N 432.442 4.283 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(c4nc(F)c(F)cc4F)CC3)c2C)c1 1625105742 JAWFACHLRUCZPG-UHFFFAOYSA-N 442.485 4.486 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C/C(=O)NCc2ccc(N3CCSCC3)cc2)C1 1625970298 YEIFFJJZHYPSNL-ZBWUASRJSA-N 445.629 4.059 10 10 IICE COc1ccccc1CCNC(=O)CNC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1626571599 IIFYLQKMQZFYTN-UHFFFAOYSA-N 447.579 4.315 10 10 IICE CCO/C=C\[C@@](O)(CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)C(F)(F)F 1628621707 AFTDWKUEACEUJS-OLHLWXQYSA-N 430.854 4.321 10 10 IICE COc1cc(OC)cc(N2CC[C@H](NC(=O)c3sccc3-n3c(C)ccc3C)C2)c1 1629263771 FTEIHLDGQXVACX-KRWDZBQOSA-N 425.554 4.182 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCC1CN(C(=O)OC(C)(C)C)C1 1629972760 XQDNTFIOIHQHOY-UHFFFAOYSA-N 441.366 4.150 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](C[C@H]2CCCO2)C(F)(F)F)cc1 1631608346 ULWSSILQHSYYDW-HSALFYBXSA-N 428.495 4.008 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(F)c(Cl)c2)NC(=O)OC(C)(C)C)cc1 1634161647 AXPPKKHZHAROBQ-FQEVSTJZSA-N 449.954 4.470 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cccc(COc4cccc(C=O)c4)c3)c2)CC1 1634578680 SSKKISZMBKCVKU-UHFFFAOYSA-N 443.547 4.472 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1640259896 INHZYQPHLUGSMH-MRXNPFEDSA-N 431.529 4.423 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H](NC(=O)c3cc4cc(O)c(O)cc4s3)C(C)(C)[C@@H]21 1642991214 LHNJYZCVAYIFOT-UPRAQXHNSA-N 446.569 4.466 10 10 IICE COc1cccc(CNC(=O)N[C@@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)c1O 1682837341 XFPGMJHZZDCOHW-IBGZPJMESA-N 443.544 4.246 10 10 IICE Cc1nnc(N2CCN(c3ccccc3Cl)CC2)n1CCCSc1nccs1 1693506945 BBIMHXBNAVCIKT-UHFFFAOYSA-N 435.022 4.205 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1CC1(C2CC2)CCC1 1694327728 BBQJALUXAUDALY-UHFFFAOYSA-N 425.577 4.119 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(C)C)C1 1695499913 WYAXMXWOPIWOSZ-OAQYLSRUSA-N 448.615 4.313 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C1 1696373347 PNMJTBMNBWNJPB-QGZVFWFLSA-N 429.615 4.447 10 10 IICE CO[C@@H]1CCC[C@@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1749157394 BZUZXBAHNVKBOL-IEBWSBKVSA-N 427.936 4.151 10 10 IICE COC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C[C@H](C)O1 1749544570 UYAFDQWOFJMGJL-UGKGYDQZSA-N 437.588 4.249 10 10 IICE CCC[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CCO1 1765652643 YMBWJELBYWUDHZ-QFIPXVFZSA-N 439.629 4.358 10 10 IICE CCCN1CCC(N(C)c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1766100572 ZDQMTACHJDYOJU-UHFFFAOYSA-N 438.664 4.317 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)cn2C)n1Cc1ccco1 1768682508 XMGXOOFKDAGTOY-UHFFFAOYSA-N 442.317 4.029 10 10 IICE CC1(C)CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1772846462 SLZCVVWCUAEFOY-UHFFFAOYSA-N 429.584 4.226 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(Cc3ccc(C(=O)O)cc3)C2=O)ccc1OC 1858590870 MMUXCAHMVKWACG-WOJGMQOQSA-N 429.519 4.194 10 10 IICE O=C(CNCc1ccc(Cl)cc1Cl)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1860717685 JZOWDQBKFDLBAC-UHFFFAOYSA-N 439.298 4.497 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](NCc1c(O)cccc1Br)C2 1878874450 IVIAUTWDKGZDHT-UTNFCUCBSA-N 429.330 4.123 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCNCc1ccc(Br)cc1O)C(F)(F)F 1913269043 DZQPIYVREBCOJV-CYBMUJFWSA-N 427.261 4.090 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NCc1cccc(Br)c1O 2144144700 LKDXLQQDKRJCFM-QZTJIDSGSA-N 433.346 4.435 10 10 IICE COc1ccccc1-n1c(C)cc(C=C2C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)c1C 2297470270 CCNKOJUNOBGSJR-UHFFFAOYSA-N 447.442 4.284 10 10 IICE CCc1ccccc1-n1c(C)cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c1C 2313558229 WAUHVZGCWYYGKY-UHFFFAOYSA-N 431.467 4.462 10 10 IICE COc1cc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])s3)SC2=S)cc(OC)c1OC 2321738487 GDILAVFVYCCVKC-UHFFFAOYSA-N 438.508 4.088 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(CCNCc3cc(Br)ccc3O)CC[C@H]1C2 2338281839 BLJOCJCJGBBTDF-OXJNMPFZSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(CCNCc3ccc(Br)cc3O)CC[C@H]1C2 2338298651 QHIWROFCZROXJH-OXJNMPFZSA-N 425.367 4.424 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3C[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(O)c1Br 2352943762 YEMKSQCQRHJOEU-QXSJWSMHSA-N 425.367 4.245 10 10 IICE Cc1cccc(N2C(=O)/C(=C3\C(=O)Nc4ccc(Br)cc43)SC2=S)c1 2317901 WYXJHSXAGGNPIL-CCEZHUSRSA-N 431.336 4.486 10 10 IICE CC(=O)N(C1CC1)[C@@H]1CCOC2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)C1 169770215 ZPFHKXRPINGOHP-RUZDIDTESA-N 449.595 4.259 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1cccc(Br)c1 735828619 BSSYINOTMLXHQU-UHFFFAOYSA-N 445.401 4.252 10 10 IICE Cc1cccc(C(C)C)c1NC(=O)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743975758 UZNPPZRKNBVIOH-KRWDZBQOSA-N 445.510 4.444 10 10 IICE COc1ccc(C)cc1[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748009769 WSDWIYSJKTVAQZ-CQSZACIVSA-N 446.550 4.063 10 10 IICE C[C@@H](NC(=O)c1ccccc1)C(=O)OCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 763958675 BWZXRLQNZKBITO-QGZVFWFLSA-N 430.464 4.402 10 10 IICE O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)Nc1ccc(OCc2cccnc2)cc1 797745162 WVDXIZCBFIWZIN-UHFFFAOYSA-N 441.871 4.138 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3nnn(C4CC4)c3C(F)(F)F)cc2Cl)C1 800049257 NSRITCAIWXNVGU-GFCCVEGCSA-N 441.885 4.452 10 10 IICE O=C(CSc1ccc(Cl)cc1[N+](=O)[O-])NCc1cc(Br)ccc1O 804740652 KAPOUVSMBNWFKA-UHFFFAOYSA-N 431.695 4.125 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1CCc1ccccc1 917641870 BYQOCDSNSJTLJT-JLHYYAGUSA-N 441.315 4.328 10 10 IICE CC(C)COc1ccc(/C=C2/C(=O)NC(=O)N(c3cccc(Br)c3)C2=O)cc1 1084056336 OMOCQZSSKAWKOU-ZDLGFXPLSA-N 443.297 4.150 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)c1 1125989154 WFHYTHDCZIVYNL-HXUWFJFHSA-N 425.891 4.422 10 10 IICE Cc1cc(CC(=O)Nc2cc(Br)cn(C)c2=O)c(C)n1-c1ccc(Cl)cc1 1126755207 VEXIYZKWCUQAEY-UHFFFAOYSA-N 448.748 4.390 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(Cl)cc2Br)N(C)C)cc1 1134681949 ODGNOHOHAHPHFQ-LJQANCHMSA-N 438.797 4.130 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(F)cc2Br)cc1 1136480289 HUXTWGRGSFVODJ-HXUWFJFHSA-N 449.364 4.405 10 10 IICE CC(C)n1ncc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1-c1ccccc1 1275224403 HKPJRSXXCLVBIM-UHFFFAOYSA-N 440.494 4.176 10 10 IICE CN(C[C@@H]1CC=CCC1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1314796217 WGCYKQBNWBJMFU-MRXNPFEDSA-N 429.619 4.110 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3N2C(=O)OC(C)(C)C)cc1F 1357200105 IMNRXCSXKDVDFZ-DSKINZAPSA-N 433.568 4.466 10 10 IICE CCOC(=O)N[C@H](Cc1ccccc1)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1438177319 LFLFITYUARMUGF-XMMPIXPASA-N 433.552 4.110 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 1446795886 BWHYWGYIKYRRRL-QIJUGHKUSA-N 434.536 4.047 10 10 IICE CC(C)(C)OC(=O)Nc1ccn(C(C)(C)C(=O)NCc2ccc(N3CCCCC3)cc2)n1 1452054195 UKKOIWHJLUFGDV-UHFFFAOYSA-N 441.576 4.272 10 10 IICE Brc1cc(CN2CCC[C@@H](N3CCOCC3)CC2)ccc1N1CCCCC1 1474601086 GPKHIFGZNUKWIQ-HXUWFJFHSA-N 436.438 4.126 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4ccc(C(F)(F)F)cc4C3)C2)cc1 1478860734 RJNPWGHBOBEJHL-INIZCTEOSA-N 433.474 4.308 10 10 IICE Cc1ccccc1Cc1nnc(N2CCCO[C@H](C)C2)n1CCCSc1nccs1 1492586031 VOZHXEYCFHWVPT-GOSISDBHSA-N 443.642 4.431 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)CCC(F)(F)F 1510675716 UNLZOMNSOIWVLN-UHFFFAOYSA-N 432.494 4.075 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2[C@H]3CCCC[C@@H]3CCN2C(=O)OC(C)(C)C)cc1F 1527013374 AYCVFBZWNHRALP-LQWHRVPQSA-N 433.568 4.324 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(COc3ccc(F)cc3)o2)N(C)C)cc1 1537478056 TZFQTIQCORPRDI-QFIPXVFZSA-N 425.504 4.096 10 10 IICE Cc1cc(CC(=O)N[C@H](Cn2ccccc2=O)c2ccccc2)c(C)n1-c1ccccc1 1538239146 YGQJKRDZKNYPQY-RUZDIDTESA-N 425.532 4.356 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1Cc1cccc(C(F)(F)F)n1 1554175712 UGORIPFOPZKKHY-SFHVURJKSA-N 447.461 4.324 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](C)C[C@H](C)NC(=O)OC(C)(C)C)CCCC1 1557180284 BRLVUFHILGJQJF-IRXDYDNUSA-N 443.588 4.337 10 10 IICE CCOC(=O)c1c(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)sc(C)c1C 1559492274 KRPUFUMYNWYLKF-UHFFFAOYSA-N 429.586 4.211 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)Nc1ccc(Br)cn1 1559609369 DOCNDDIKVYJIIS-UHFFFAOYSA-N 430.224 4.134 10 10 IICE COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)N[C@@H](C)c1ccccc1O 1560075211 WRFXWFPWBNGZPY-KBPBESRZSA-N 426.435 4.114 10 10 IICE C[C@H](NC(=O)N1CCN(Cc2ccc(Br)cc2)CC1)c1ccc(N(C)C)cc1 1564597414 MOHUOUYGVFULQX-KRWDZBQOSA-N 445.405 4.104 10 10 IICE Cc1cc(C(=O)N2CCO[C@@](C)(C(F)(F)F)C2)c(C)n1-c1ccc(Br)cn1 1587657625 KAMGHIUDYQIXJJ-QGZVFWFLSA-N 446.267 4.045 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1595595874 MHUVRWVPJBKDPA-INIZCTEOSA-N 433.335 4.247 10 10 IICE CC(=O)c1cc(F)cc(CN2CCN(Cc3csc(-c4ccc(F)cc4)n3)CC2)c1O 1615990689 HPYFKXOYMNCPQE-UHFFFAOYSA-N 443.519 4.314 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2csc(Cc3ccc(Cl)cc3)n2)N(C)C)cc1 1618636417 ZYFYNIRBJFVVEX-NRFANRHFSA-N 443.016 4.486 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2cccc(C(F)(F)F)n2)cc1 1624854527 MTQZJKCDWPGJMC-UHFFFAOYSA-N 429.442 4.222 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)CC(C)C 1628251651 ZPYMQQSFYTZGGD-INIZCTEOSA-N 435.362 4.422 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(I)cc3)cc2)CC1 1628605057 NYNCHOLKSJRKNV-UHFFFAOYSA-N 434.321 4.458 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 1630302369 ZIOUQRNSXKMZHN-UHFFFAOYSA-N 427.844 4.202 10 10 IICE Cc1cccc(C2(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)CCC2)c1 1630899386 DZUYBFLDZWMVON-UHFFFAOYSA-N 442.562 4.372 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCOC[C@H]2C(=O)OC(C)(C)C)cc1 1632839320 JKPJOUOVMVIQGA-NRFANRHFSA-N 438.528 4.351 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCc3ccc4ccccc4c3O)cc2F)CC1 1632993866 JCXYFGQYMJYSNW-UHFFFAOYSA-N 435.543 4.075 10 10 IICE CCN(C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H](C)Cc1ccc(OC)cc1 1636353622 FJZXPTZPLADYMB-CTNGQTDRSA-N 425.573 4.193 10 10 IICE CC1(C)C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CCN(C(=O)OC(C)(C)C)C1 1637518356 CFBVYFPHUNWMTM-INIZCTEOSA-N 425.957 4.271 10 10 IICE Cc1cc(CC(=O)N2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c(C)n1-c1ccccc1 1638136760 FMTJTBTWCHHLCQ-AREMUKBSSA-N 437.584 4.496 10 10 IICE C[C@H](NC(=O)c1cccc(OCCN(C)C(=O)OC(C)(C)C)c1)c1ccc(N(C)C)cc1 1638957499 PQJQICGGWUMRQC-SFHVURJKSA-N 441.572 4.489 10 10 IICE O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1639551418 OHOYNZZYARMMKA-GFCCVEGCSA-N 443.248 4.435 10 10 IICE COC(=O)c1cnc(CCNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)s1 1639829328 GCKLQIYLNLZICD-UHFFFAOYSA-N 425.554 4.433 10 10 IICE Cc1cc(C(=O)Cn2nnn(-c3ccccc3)c2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 1640784557 YKPCTXIRDGHNLQ-UHFFFAOYSA-N 442.306 4.026 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3)C2)cc1 1680824969 RQSNRJGPOWDTGB-CVEARBPZSA-N 449.382 4.159 10 10 IICE CC(C)(C)OC(=O)NCCC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccccc1 1681653388 IFPXTJMOKUMTIA-HXUWFJFHSA-N 425.529 4.464 10 10 IICE C[C@H]1C[C@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCN1C(=O)OC(C)(C)C 1686310164 XIWCIRAFOIFTAP-AZUAARDMSA-N 430.593 4.216 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)N(C)C)cc1 1687806951 LSIRSPWMXPSJET-SIKLNZKXSA-N 435.572 4.086 10 10 IICE CC(C)OCCCn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1692616328 LZHZLXMCOFBNFL-UHFFFAOYSA-N 441.620 4.224 10 10 IICE Cc1csc(CCCCn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)n1 1693328154 YXZLPBVGXDONNZ-LJQANCHMSA-N 427.574 4.259 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C[C@@H](C)S1 1708241952 SWWFEUVFZKEQCB-RBSFLKMASA-N 425.649 4.099 10 10 IICE CCCN(CC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1709709757 NNCCSTOVWBEGQT-NRFANRHFSA-N 429.634 4.358 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CC(C)(OC)C2)cc1 1710028077 PHVZYCICHCTNOE-UHFFFAOYSA-N 425.602 4.050 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@](C)(OC)CC2)n1Cc1ccc(N2CCOCC2)cc1 1763677683 VYBNRFOHBQMCFN-NBGIEHNGSA-N 441.620 4.072 10 10 IICE CCOC[C@H]1CCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1766489217 GMGRGVMGTSSXHE-IRXDYDNUSA-N 437.635 4.021 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(c4ccc(C(=O)O)cc4)C3=O)n12 1860085911 STGGLGQJUXUADU-WUXMJOGZSA-N 435.939 4.462 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)/C2=C/c2ccc(O)c(OC)c2)cc1 1865675376 DUHGGAQGTAAPTM-DEDYPNTBSA-N 432.451 4.379 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCNCc1c(O)cccc1Br)C(F)(F)F 1913255348 GRQHODWRFCHWIO-ZDUSSCGKSA-N 427.261 4.090 10 10 IICE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2010160071 YDRYHTCTSUAGRI-PXNSSMCTSA-N 428.529 4.022 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3c(O)cccc3Br)C[C@@]2(C)C1 2116279452 XGLAPVBLPPHLJB-MNVSYLFESA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)c1O 2227749711 VPDAMPIRLPGPCB-CYBMUJFWSA-N 429.355 4.043 10 10 IICE Cc1ccc(OCCOCCOc2ccc(C=C3SC(=S)N(C)C3=O)cc2)cc1 2293662234 UGIYQFMKGXZVGE-UHFFFAOYSA-N 429.563 4.300 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3Cc3ccccc3Cl)C2=O)cc1 2296398141 WFVXGSYSPJIMCU-UHFFFAOYSA-N 433.895 4.419 10 10 IICE Cc1ccc(CN[C@H]2CCC3(CC3)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352684251 PKONDGZOBWLNNG-HNNXBMFYSA-N 425.367 4.485 10 10 IICE COc1ccc(Br)c(CNC[C@H]2C[C@@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c1O 2358678270 SBCNLKOBROFBCV-DVOMOZLQSA-N 441.366 4.041 10 10 IICE Cc1ccc(CNC(=O)[C@]2(NC(=O)OC(C)(C)C)CCC[C@@H]2C)c(O)c1Br 2381141881 FYAYIETURILUFQ-RBZFPXEDSA-N 441.366 4.163 10 10 IICE CSc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@@H]32)cc1 14551913 MCXYKLOUFZBCQH-SXWKCWPCSA-N 442.606 4.256 10 10 IICE CCCCCOc1ccc(/C=C2\SC(=S)N(CCCC(=O)OC)C2=O)cc1OC 40888447 JUIIRYHLZUIIBA-JXAWBTAJSA-N 437.583 4.419 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526328407 OKAXZIILUYGMFO-QFIPXVFZSA-N 437.423 4.311 10 10 IICE C[C@@H](NCc1cc(Br)cc(F)c1O)C1CCN(C(=O)OC(C)(C)C)CC1 715745168 ODFYLGOPLXWMPW-GFCCVEGCSA-N 431.346 4.419 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N[C@@H](C)c3ccc(F)cc3)ccc21 728639966 USDXHPHTWYUVPS-INIZCTEOSA-N 426.488 4.078 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 743808121 LXLSBHQUKYWGML-DLBZAZTESA-N 432.314 4.078 10 10 IICE CN(Cc1cn(C)nc1C(F)(F)F)C(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 750264079 YOVJGJFNWHHBFD-UHFFFAOYSA-N 444.417 4.451 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccn(-c2c(F)cccc2F)n1 754547781 JXLZLMFZJVYCBN-UHFFFAOYSA-N 429.382 4.178 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(CNC(=O)C(C)(C)C)ccc3Cl)ccc21 786016901 LOYNCYCMPOJLBY-UHFFFAOYSA-N 427.976 4.315 10 10 IICE CC(C)C(=O)c1ccc([C@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 801687779 JZPWRVFORMMEIG-NRFANRHFSA-N 447.623 4.477 10 10 IICE CCOC(=O)c1c(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)noc1C 809953615 PKXZHISCFKZVAJ-KRWDZBQOSA-N 427.526 4.495 10 10 IICE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1125326194 VSQCTAVESYLZPE-KSVUCXBSSA-N 446.378 4.415 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CC[C@@H]2[C@@H](C1)C2(F)F 1131084700 APQSKENCMKXGPR-ZTFDUECGSA-N 442.578 4.280 10 10 IICE Cc1c(O)nc2ccccc2c1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1141815641 RUJRMQDHDPDXEK-UHFFFAOYSA-N 445.441 4.034 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCCCC[C@@H]3NC(=O)OC(C)(C)C)C2)cc1 1146949797 HWMIFRLXFCVCBZ-BWAGFHJFSA-N 445.604 4.254 10 10 IICE Cc1cc(I)cc(C(=O)NCc2ccc3cccnc3c2O)c1C 1162612897 RVJMFFSQMGGGEW-UHFFFAOYSA-N 432.261 4.092 10 10 IICE CC(C)[C@H]1CN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c2ccccc21 1194000878 ZFWOPFYCUZRRRA-XQBPLPMBSA-N 439.575 4.315 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3)Cc3ccc(F)cc3)cc2)CC1 1254715995 CSKNHZLQBNIAMU-UHFFFAOYSA-N 446.570 4.490 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)sc2c1CCCC2 1264066894 DZFSQRFNSPJWCY-LBPRGKRZSA-N 448.491 4.073 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2c1 1294860487 UIRSYGICZYQOHN-MRXNPFEDSA-N 443.906 4.141 10 10 IICE CCOCc1nnc(N2CCC[C@@H](OC(C)(C)C)C2)n1CCCSc1nccs1 1297227980 XGMQRGPISUZVKK-MRXNPFEDSA-N 439.651 4.237 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCCC[C@H]2NC(=O)OC(C)(C)C)cc1 1300279140 DMDJQDVNKGKENX-LEWJYISDSA-N 433.593 4.063 10 10 IICE COc1ccc(N(C)C[C@H](NS(=O)(=O)c2ccc(C)cc2)c2ccccc2)cc1F 1307556376 YNBFRXNHDTVIND-QFIPXVFZSA-N 428.529 4.299 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(F)cc4)no3)cc2F)C[C@@H](C)O1 1350931747 CHIYINKTZSEVFC-GASCZTMLSA-N 427.451 4.163 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354755496 UDPBIJZNSFAMNL-QGZVFWFLSA-N 444.457 4.320 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)cnc3N(C)C)cc2)CC1 1443669637 YBNKFNJVIILGBJ-UHFFFAOYSA-N 431.378 4.076 10 10 IICE CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@H](CC)CN1C(=O)OCc1ccccc1 1444317965 HBBUIHBKTYJFEC-RTBURBONSA-N 426.513 4.058 10 10 IICE COc1cc(N2CCN(C(=O)c3[nH]c4c(Cl)cccc4c3C)CC2)cc(OC)c1OC 1447442934 IAPLGYCBZQUKSK-UHFFFAOYSA-N 443.931 4.118 10 10 IICE Cc1cc(C(=O)N2CCC([C@H]3CCCO3)CC2)c(C)n1-c1ccc(Br)cn1 1447881766 XPRTULVOBLSJRF-LJQANCHMSA-N 432.362 4.283 10 10 IICE CCCOc1ccc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1OCC 1466398441 NCARDUMFIFNRPC-UHFFFAOYSA-N 435.904 4.049 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CCC1 1503692983 IGNMIKCSADOUDB-UHFFFAOYSA-N 434.588 4.114 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc2c1OCCO2 1530426901 WRHRDBZOIYHAEY-OAHLLOKOSA-N 430.932 4.286 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 1536549295 CXJHLGUJDBZEJD-YWBKXGLFSA-N 445.966 4.120 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3csc(Cc4ccc(Cl)cc4)n3)cc2)CC1 1536925498 WYOWEDJHLJXIBT-UHFFFAOYSA-N 441.000 4.069 10 10 IICE CC(C)CN(c1nnc(CC2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1541545741 NICWPDMPCXOMIT-UHFFFAOYSA-N 439.648 4.358 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCCC1 1544658019 OHBREIRBSJWPKN-GOSISDBHSA-N 434.536 4.167 10 10 IICE COCCN(C)CCCC1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)CC1 1545901722 VZPBCNZUOYIGFG-UHFFFAOYSA-N 439.600 4.117 10 10 IICE Cc1ccc(CNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c(-n2cc(Cl)cn2)n1 1564578913 ZTUXKENPSZGGDD-UHFFFAOYSA-N 438.963 4.171 10 10 IICE Cc1ccc(Cl)cc1CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1585834514 FTZPABTXIAALPV-UHFFFAOYSA-N 434.835 4.262 10 10 IICE CSCC1(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC1 1587035778 WLESQPPRZVAVKC-VBKFSLOCSA-N 438.615 4.067 10 10 IICE CCC[C@@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CCN1CCOC 1596604998 LEEFVMCODCKRHH-HSZRJFAPSA-N 432.008 4.249 10 10 IICE Cc1cc(CC(=O)Nc2cccc(F)c2S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1597110002 RVDXADLAGLFALD-UHFFFAOYSA-N 434.920 4.471 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(C(=O)N3CCN(C)CC3)cc2)c1 1597586703 OCWBMITZSLCPAA-UHFFFAOYSA-N 430.552 4.042 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCCOc3cccc(Cl)c3Cl)cc2)CC1 1598276197 BFYJRMLTZWSCMR-UHFFFAOYSA-N 436.383 4.221 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(OCc4c(C)noc4C)cc3)C2)cc1 1598364135 NAVCWGSJFSDAGQ-OAQYLSRUSA-N 449.551 4.064 10 10 IICE CCCCC[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)(C)C 1617322947 NVTKLSVRRJXAET-KSAKKHMLSA-N 429.605 4.011 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](C)N2CCc3ccccc3C2)cc1 1626305968 VOOPNXNIAKAWGC-FQEVSTJZSA-N 429.564 4.012 10 10 IICE O=C(Nc1cccc(N2CCCCCC2)c1)c1ccc(NCCN2CCOCC2)c(F)c1 1629496650 RRWRMAXKMFQHBM-UHFFFAOYSA-N 440.563 4.203 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)[C@H]2CCCCO2)NC(=O)OC(C)(C)C)cc1 1629678516 BNYKIMYILXZAQL-VQTJNVASSA-N 433.593 4.030 10 10 IICE CC(=O)CCc1ccc2oc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)c(C)c2c1 1630282648 GMUIFYXNEHXZGX-UHFFFAOYSA-N 434.536 4.154 10 10 IICE O=C(CCc1cccc(F)c1Br)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631219061 LXTHSUIDGURHDL-KRWDZBQOSA-N 436.321 4.434 10 10 IICE COCC[S@](=O)Cc1cccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1633750979 IWHJWNDJQOFBFX-HKBQPEDESA-N 438.549 4.054 10 10 IICE C[C@@H](OCc1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634162950 PTYLCTYAKCCSTL-XMSQKQJNSA-N 441.572 4.040 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3cnccn3)C2)c(C)n1-c1ccc(Br)cc1 1635791444 GKOXMVHILCGFNP-INIZCTEOSA-N 425.330 4.276 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3cc(O)ccc3O)[C@@H]2c2cccs2)cc1 1637122606 JNYPYYYKBVQJED-WMZHIEFXSA-N 436.533 4.268 10 10 IICE Cc1cc(C(=O)N[C@@H](C(C)C)C2(CO)CC=CC2)c(C)n1-c1ccc(Br)cn1 1639382031 XBWFPJJHOVDBPP-FQEVSTJZSA-N 446.389 4.335 10 10 IICE Cc1cc(C(=O)NCc2c(F)ccc3nc[nH]c23)c(C)n1-c1ccc(Br)cn1 1642045740 HZEQTRRQBCPPOZ-UHFFFAOYSA-N 442.292 4.197 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F 1642998104 WZTKHUMDFNCSCS-QGZVFWFLSA-N 446.588 4.277 10 10 IICE CCn1c2ccccc2c2cc(NC(=O)CN(C)c3ccc(OCC(=O)OC)cc3)ccc21 1645254601 NBNLJLUBMUMDJI-UHFFFAOYSA-N 445.519 4.441 10 10 IICE Cc1cc([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3ccc(OC(F)(F)F)cc3)c2C)c1=O 1656385419 QEWQDBHAVGMDNG-UHFFFAOYSA-N 449.385 4.254 10 10 IICE Cc1cc(CNC(=O)N2CCC(NC(=O)c3ccccc3)CC2)c(C)n1-c1ccccc1 1684478869 LKHSFRDZASULKI-UHFFFAOYSA-N 430.552 4.198 10 10 IICE C#C[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@@H](O)C1 1705478513 CRDHPJQKYXOTJN-QTGUNEKASA-N 431.584 4.362 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1CC 1705895791 SEQHYAZJYHYKFP-JPYJTQIMSA-N 446.599 4.280 10 10 IICE CC[C@](C)(O)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1708330781 YRUXQDPGJNNNFR-VWLOTQADSA-N 425.621 4.408 10 10 IICE COc1cccc(-c2nnc(N(C)C[C@@H]3CCOC3)n2CCCSc2nccs2)c1 1711903611 XRAWQQHKHBABOY-INIZCTEOSA-N 445.614 4.065 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1727660692 DPDYOPSEKKOVIG-HTAPYJJXSA-N 434.588 4.114 10 10 IICE CC[C@@]1(C)CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1744255349 MSOYHVVSASMMNJ-DEOSSOPVSA-N 443.661 4.083 10 10 IICE CC1=CCN(c2nnc(Cc3csc(C)n3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1751719303 UXMPCBZOWQMGCB-UHFFFAOYSA-N 426.565 4.044 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccncc1Cl 1766233503 AWYVURUJIWQTLV-UHFFFAOYSA-N 440.979 4.148 10 10 IICE COCCN(Cc1ccc(C)o1)c1nnc(C)n1Cc1ccc(N2CCC(C)CC2)cc1 1771100862 DZYWIOCYIBKDDX-UHFFFAOYSA-N 437.588 4.426 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(c3ccc(O)cc3)C2=O)cc1 1860074969 BUKXYCVAZSCIEJ-CPNJWEJPSA-N 442.562 4.045 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H](CNCc2cc(Br)cc(F)c2O)C1(C)C 1885866465 PNRZEOPFSGZVOE-DOMZBBRYSA-N 431.346 4.323 10 10 IICE CCc1nn([C@@H](c2ccc(C)cc2O)C2CCC2)c(I)c1C(=O)O 2079124795 JPMQYKXTSGRPOI-MRXNPFEDSA-N 440.281 4.152 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1C=O 2079951891 ZUTMBLOVAOJILV-QGZVFWFLSA-N 426.298 4.430 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C(C)(C)C)c(CO)c2I)cc1C 2080006054 OQCNUPHUDPRYSM-LBPRGKRZSA-N 428.314 4.209 10 10 IICE COC(=O)c1c(C2(C)CC2)nn([C@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080039896 XVAKDALTUNCTJF-INIZCTEOSA-N 435.318 4.197 10 10 IICE CC1=NN2C(=N)C(=Cc3cc(C)n(-c4ccc(Br)cc4)c3C)C(=O)N=C2S1 2293449697 DJTNNQGMSCUNEE-UHFFFAOYSA-N 442.342 4.496 10 10 IICE CCOc1cc(C)c(C=C2C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1C(C)C 2293467591 GDUUANADNAVPBH-UHFFFAOYSA-N 426.513 4.488 10 10 IICE COc1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1OCc1ccc(Cl)cc1 2296648965 PTZRHJKDNQVHKV-UHFFFAOYSA-N 449.937 4.213 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)ccc1OCCC(C)C 2313549224 QHSCGIKVOCWHIJ-UHFFFAOYSA-N 442.899 4.440 10 10 IICE CN1C(=O)C(=C2SC(=S)N(C3CCCCC3)C2=O)c2cc(Br)ccc21 2314717420 REXDOHBBFMARDF-UHFFFAOYSA-N 437.384 4.330 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3ccccc3OC)SC2=S)N(C)C)cc1 2323879914 QFSPLZGHVWCWBB-GOSISDBHSA-N 428.579 4.208 10 10 IICE CCOC(=O)c1c(NC(=O)C=CC(=O)O)sc(C)c1-c1ccc(Br)cc1 2326433130 JHUZWDNNEQBVKT-UHFFFAOYSA-N 438.299 4.242 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)[C@@](C)(NCc2cc(Br)cc(F)c2O)C1 2336508025 JBJZGILRVXDPAV-INIZCTEOSA-N 439.272 4.028 10 10 IICE CC[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352634970 AAIHKFQVQOYVBN-LJQANCHMSA-N 429.355 4.020 10 10 IICE COc1ccc(-n2cccc2/C=C2\C(=N)N3N=C(c4ccccc4F)SC3=NC2=O)cc1 20210753 XYQKWSYDAVBXGK-RBRHTRMMSA-N 445.479 4.292 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)c(C)n1-c1ccccc1 62694213 CYDICFKAOJUUEU-UHFFFAOYSA-N 435.955 4.388 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\[C@@H]3C(=O)N(c4ccccc4)N=C3C)SC2=S)cc1 102616620 NMGBCVZMTCOMBW-DYGKOUCMSA-N 437.546 4.373 10 10 IICE Cn1nc2c(c1C(=O)N(c1ccccc1)c1ccc(N)cc1)CN(C(=O)OC(C)(C)C)CC2 170262443 VMXIWQDXNIPPPD-UHFFFAOYSA-N 447.539 4.274 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccc(NC(C)=O)cc3)sc2C)cc1C 170550908 NGTABLHJKGBDRF-UHFFFAOYSA-N 431.539 4.195 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 226693998 FRVPGFYRPRNZIK-STXHMFSFSA-N 433.917 4.325 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1 734471309 MKOKRJJKRNEFLI-NXVVXOECSA-N 449.576 4.404 10 10 IICE O=C(Nc1ccc(N2CCCC2)nc1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743096041 GXNIEKQAOFTLPU-KRWDZBQOSA-N 431.487 4.074 10 10 IICE Cn1ccnc1C[C@@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)c1ccccc1 745913415 YRTDMRWOUFJAEU-JOCHJYFZSA-N 430.508 4.415 10 10 IICE Cc1cc(C)n(Cc2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)cc2)n1 750874974 PONOHWVIZUMAHW-AREMUKBSSA-N 446.595 4.436 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cnn(-c2ccncc2)c1C(F)F 786763888 AICHWFLBVFUXOY-UHFFFAOYSA-N 425.483 4.467 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1c(Cl)ccc2c1CCO2 797667015 QGJUXPNYRVLKIS-UHFFFAOYSA-N 440.975 4.129 10 10 IICE Cc1c(NC(=O)NCCCSc2nccs2)cc(Br)cc1[N+](=O)[O-] 797684923 OYYJAPBRTBXQRG-UHFFFAOYSA-N 431.337 4.426 10 10 IICE Cc1cc(Br)c(O)c(CNCc2cc(Cl)ccc2N2CCOCC2)c1 798498840 JUZLIWRUECQUEE-UHFFFAOYSA-N 425.754 4.243 10 10 IICE Cc1ccccc1[C@@H](O)C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 804989074 LKFKYRGRALSQET-NLFFAJNJSA-N 437.584 4.048 10 10 IICE CCCc1nc(C)c(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1129575183 SJXBYWKCNMZFPD-BOPFTXTBSA-N 448.541 4.409 10 10 IICE CCOc1ccc(-c2nc(C(=O)N(C)CCN(C)c3ccc(OC)cc3)cs2)cc1 1130745092 PQVFIQMVVHDPRD-UHFFFAOYSA-N 425.554 4.426 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccc3c(c2)OCO3)c(C)n1-c1ccc(Br)cn1 1135769858 OIFLTJCQKWAGER-UHFFFAOYSA-N 442.313 4.253 10 10 IICE O=C(CCCOCCc1ccccc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137437805 DFANFIVZYJCQBE-QFIPXVFZSA-N 430.976 4.166 10 10 IICE CC[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@H](O)c1ccccc1F 1150196651 JOGSWPBUCJFACH-BKMJKUGQSA-N 437.559 4.175 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(F)cc1 1150378804 VWRCXGXTBZXURW-HXUWFJFHSA-N 442.531 4.335 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)c2)CC1 1153546251 IIAXUHSTOBCILM-UHFFFAOYSA-N 436.434 4.396 10 10 IICE CC[C@@H]1CN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC[C@@H]1NC(=O)OC(C)(C)C 1230194818 GBLUVIZBZWNXEG-KNKQGSTJSA-N 446.636 4.327 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccc(F)cc1 1293846246 PNERUVONCFIQAB-DFBJGRDBSA-N 435.543 4.253 10 10 IICE Cc1cc(C(=O)N2CCN(CCc3cnccn3)CC2)c(C)n1-c1ccc(C(C)C)cc1 1302860077 ZVTJCQPAPPPVCI-UHFFFAOYSA-N 431.584 4.008 10 10 IICE Cc1cnn(CCn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)c1 1304603778 UBFYLKIGRIPQJW-UHFFFAOYSA-N 435.620 4.308 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(C)CCOCC1 1305383419 OZAOGYSMRMSFCU-FQEVSTJZSA-N 441.620 4.081 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1361046119 WIIPIZSCLHWFHU-UHFFFAOYSA-N 436.604 4.360 10 10 IICE Cc1cc(CCNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1-c1ccccc1 1438179742 PWEVCRVOIPWCMU-UHFFFAOYSA-N 429.480 4.161 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C\C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)o1 1466290465 XTRUBZBOBUYKLK-NJBZPOFQSA-N 427.497 4.162 10 10 IICE COC(=O)[C@@H]1CC[C@@H](c2ccccc2)N1C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1467605344 DMJONLFFDVQMAC-DQEYMECFSA-N 444.531 4.354 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl 1469159724 MGFFTLTUCPRFSB-UHFFFAOYSA-N 427.844 4.202 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1 1478840532 DHPLCUYXHGDLSC-AUSIDOKSSA-N 425.573 4.374 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@]3(C)Cc3ccc(Cl)s3)cc2)CC1 1479185783 UBVBXJWIJWHHQO-HSZRJFAPSA-N 447.048 4.460 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)CC(F)(F)F)cc1F 1503390208 CVRMFNPHRPSCAJ-UHFFFAOYSA-N 442.848 4.245 10 10 IICE CCO[C@@H]1CCCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1516422454 ORHQQZGVOVFIDL-XMMPIXPASA-N 448.615 4.164 10 10 IICE CC[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC(=O)N(C4CC4)C3)c2C(=O)OC(C)(C)C)C1 1523612864 CPRNRXJFQHOXMV-KGLIPLIRSA-N 432.586 4.168 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(C(=O)NC4CC4)cc3)cc2Cl)C1 1524703601 MOWPNVJATYJJJH-INIZCTEOSA-N 425.960 4.399 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 1534503078 RJDAIPWIDBZRHH-MRXNPFEDSA-N 425.554 4.423 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@H]1C[C@H]2CC[C@H]1C2 1536315700 YUZKMUPPCUVKFJ-NWNSKGDQSA-N 432.586 4.360 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1cccc(C)n1 1545333398 ZRGDBSQNGPMUED-FQEVSTJZSA-N 448.615 4.211 10 10 IICE C[C@H](c1cccc(O)c1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1545505024 QUWZBKXAJLRWRO-ONDHQXCVSA-N 444.553 4.342 10 10 IICE CON(C)c1nnc(-c2ccc(Br)cc2)n1CCCSc1nccs1 1555761537 UAPNRPCNFGAXQX-UHFFFAOYSA-N 440.392 4.344 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2cccc(Cl)c2O)cc1 1558757021 LUVDHEOTYYSTSF-UHFFFAOYSA-N 430.913 4.085 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nn1-c1ccc(Cl)cc1 1596359929 ZAAKAAINDBTYPM-UHFFFAOYSA-N 426.973 4.317 10 10 IICE COCCCN(Cc1cc2c(C)cc(=O)oc2c(C)c1O)C[C@H]1CCCN2CCCC[C@@H]12 1614472674 BHCZOCAGPZUNOC-OFNKIYASSA-N 442.600 4.218 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1615382267 RPPMSVOAKYMPJE-HXUWFJFHSA-N 448.615 4.162 10 10 IICE COc1ccc(CNC(=O)c2csc(-c3cc(Br)ccc3OC)n2)c(O)c1 1617762421 HAGXLUFQXSLZLU-UHFFFAOYSA-N 449.326 4.225 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCCCC1 1620073910 FYXQMHIUKLVKCK-UHFFFAOYSA-N 437.588 4.396 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(Br)cnc3C3CC3)CC2)cc1 1623429489 DQAFIPNFXBJGCA-UHFFFAOYSA-N 430.346 4.083 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(c2cccc(Br)c2)CC1 1623817600 LMBYEGUYOGPAEB-UHFFFAOYSA-N 433.327 4.037 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCCN(C)C(=O)c1ccncc1 1623925605 SLVZYHLIZBKXFR-HXUWFJFHSA-N 431.536 4.429 10 10 IICE CCCO[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(F)cc1C 1629967936 KEAUCSMQKCFBII-QHCPKHFHSA-N 432.511 4.018 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](Cc3ccccc3)[C@@H](O)C(F)(F)F)ccc21 1633190236 YQMDFWSXWJUUEF-IFMALSPDSA-N 448.485 4.169 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)c(C(F)(F)F)cc1F 1638347140 DLIIXDYXNKBYKP-MRVPVSSYSA-N 436.199 4.379 10 10 IICE COc1ccc(N2CCN(Cc3cc(Cl)cc(Cl)c3[N+](=O)[O-])CC2)c(OC)c1 1644225252 CZJZMZZSEGJGPW-UHFFFAOYSA-N 426.300 4.241 10 10 IICE COc1ccc2c(c1)CCCCN2CCNC(=O)NC(C)(C)COCc1ccccc1 1644968641 FLXOYOHUNWLDGM-UHFFFAOYSA-N 425.573 4.133 10 10 IICE COc1ccc([C@H](CNC(=O)CSc2ncc(Cl)s2)N2CCCCC2)cc1 1652126489 GCQNGSRCSVEDCT-INIZCTEOSA-N 426.007 4.241 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@](C)(OC)C2)sc(C)c1-c1ccccc1 1653497117 GBHIHDLPKSXCQO-QHCPKHFHSA-N 430.570 4.340 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](C)c3cc(Cl)cc4c3OCC4)CC2)cc1 1676325954 OGILTYAITUVKCX-INIZCTEOSA-N 429.948 4.266 10 10 IICE COCCC(C)(C)Cn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1697919300 XKTDVXJTQSXDIJ-UHFFFAOYSA-N 445.583 4.083 10 10 IICE CC(C)[C@@H]1OCCC[C@@H]1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1706361953 MBGFZHFQDFRNEC-QPPBQGQZSA-N 435.572 4.057 10 10 IICE CCN(CC(C)C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709980725 RWZMDAPHGTUYSH-UHFFFAOYSA-N 448.615 4.079 10 10 IICE CCCN1CCC[C@H]1Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1728155799 NQFOJBKGAOGLIL-QFIPXVFZSA-N 440.636 4.001 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(CC)C2CCCCC2)cc1 1764931877 XYWDRNZBTQWUDF-UHFFFAOYSA-N 440.636 4.470 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCCC[C@@H](COC)C2)cc1 1764934729 FUBNCTGNQMJNHJ-JOCHJYFZSA-N 448.615 4.488 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1765428996 RNWWKQWDFHGNOG-DEOSSOPVSA-N 439.629 4.457 10 10 IICE CCC[C@H](C)CN(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1765496178 XOWJVTFQGQQUSH-SIKLNZKXSA-N 425.621 4.475 10 10 IICE CN(c1nnc(-c2cc(Br)c[nH]2)n1CCCSc1nccs1)C1CC1 1768535096 ITXOBHBHWJLZEG-UHFFFAOYSA-N 439.408 4.273 10 10 IICE COc1ccc(OC)c(Cc2nc3ccc(C(=O)Nc4cccc(N(C)C)c4)cc3[nH]2)c1 1872807589 VKUXWVXMZDKBIK-UHFFFAOYSA-N 430.508 4.489 10 10 IICE CN(C)c1ccc([C@H](N)C2(NC(=O)OC(C)(C)C)CCN(Cc3ccccc3)CC2)cc1 2044751963 HDACZQZPVYKAEJ-QHCPKHFHSA-N 438.616 4.312 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(C)C)c(CN)c2I)c(O)c1 2078984782 ZKTWNWLCXCAKRN-KRWDZBQOSA-N 425.314 4.083 10 10 IICE Cc1nn(Cc2cccc(Br)c2O)c(I)c1C(C)C 2079595684 MICNVOWKHJOHIV-UHFFFAOYSA-N 435.103 4.436 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1CNCc1cc(Br)cc(F)c1O 2102799402 VPNLDNPVYCPXJW-LBPRGKRZSA-N 439.272 4.028 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2=O)cc1C 2294130988 RIJNKDOQMXZDEB-UHFFFAOYSA-N 431.404 4.138 10 10 IICE CCOC(=O)c1cc(-c2ccc(C=C3C(=O)NN(c4ccccc4)C3=O)o2)ccc1Cl 2294623650 NLGNIMHYCSWSIB-UHFFFAOYSA-N 436.851 4.238 10 10 IICE COc1cccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C(=O)NC2=S)c1 2296275665 IZQPJYVURAGPDS-UHFFFAOYSA-N 445.544 4.242 10 10 IICE Cc1ccc(COc2ccccc2C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1 2313558509 CKLQLTXVBLXWMV-UHFFFAOYSA-N 430.435 4.380 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380784030 QSJCSSAULOIMAV-CABCVRRESA-N 441.366 4.115 10 10 IICE Cn1c(SCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nc2ccccc21 8808334 PVTFQPFITLKTJB-UHFFFAOYSA-N 427.485 4.080 10 10 IICE COc1ccccc1C(=O)Nc1cccc(N2CCC(N[C@H]3CCOC(C)(C)C3)CC2)c1 14996607 SYPIFEJOCFXHAH-NRFANRHFSA-N 437.584 4.464 10 10 IICE CCCCCCN1C(=O)/C(=C/c2c(NCCC)nc3ccccn3c2=O)SC1=S 33474139 LRVBIEOTDURATN-PEZBUJJGSA-N 430.599 4.298 10 10 IICE Cc1cc(C)cc(Oc2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(C)C2=O)c1 213196318 KGJYWXOASWUTRV-BOPFTXTBSA-N 437.546 4.243 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1 304087409 WPYOZXGHSNSZSG-RTBURBONSA-N 434.458 4.218 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(C(=O)Nc3cccc(F)c3)CC2)c1O 738118541 CVVGDXPYWOMEJV-UHFFFAOYSA-N 436.483 4.322 10 10 IICE C/C(=C\C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1C(F)(F)F 741915283 SKUNIORCWDXZSV-QCUIPMNBSA-N 445.485 4.127 10 10 IICE CCOc1ccc(O)c(CN[C@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)c1 742382492 ANLWHOGHLDWMQC-HSZRJFAPSA-N 429.513 4.213 10 10 IICE CCN(CCc1cccs1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769036222 UGHLLPYIJOSPLQ-UHFFFAOYSA-N 426.630 4.054 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917030273 GHARQSNOUBPSNR-BRWVUGGUSA-N 433.955 4.060 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@]3(C)Cc4ccccc4C(=O)O3)cc2Cl)C1 1128490447 SXQTUQACALFFKD-GYCJOSAFSA-N 426.944 4.364 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc(-c4cccc(C)c4)n3)CC2)c(OC)c1 1131804502 LSCUSUPBRZSANF-UHFFFAOYSA-N 437.565 4.027 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)OC(C)C)c(C)n1-c1ccccc1Br 1136920654 YKAMIAQUMLUPIZ-IBGZPJMESA-N 433.346 4.413 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(Cl)cc3Cl)CC2)cc1F 1150239053 BQNBJHCMGUJNTJ-ZDUSSCGKSA-N 427.303 4.257 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 1162539532 FFXSOUPNMVDTEA-ZDUSSCGKSA-N 426.296 4.058 10 10 IICE CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1169565238 BBHLSMNBUPGZDB-PBNUPURSSA-N 448.563 4.362 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Br)cn1 1171788436 WFFZJBAJRRZIJL-FZNQNYSPSA-N 448.361 4.102 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2F)c1 1266558492 OHTDLTWVGOJYAZ-NRFANRHFSA-N 425.891 4.200 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1 1291361689 RCRXLDQPZNIVPQ-CEYNDMKZSA-N 437.588 4.127 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)ccc1N 1294685722 SMIFOOQBCUSMJV-UHFFFAOYSA-N 428.124 4.162 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)S[C@H](C)C1 1301818657 RELPJXPBOFHOCB-HDICACEKSA-N 425.602 4.329 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1cccs1 1302575607 LZNKNGFDJCGRHQ-UHFFFAOYSA-N 425.602 4.179 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1(N2CCOCC2)CCCCC1 1305384982 XCZMXYGJSMXWRB-HXUWFJFHSA-N 441.620 4.169 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1306537430 SLLRGQCEWZNJMU-SANMLTNESA-N 448.615 4.436 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNc1ccccn1 1316301737 JPDZPNJLZMNZHK-UHFFFAOYSA-N 431.544 4.247 10 10 IICE COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c([N+](=O)[O-])cc1F 1350088222 QNQITZLPTBTGGG-UHFFFAOYSA-N 427.432 4.244 10 10 IICE COc1cc(Br)c(OC)c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1351671942 BMYJEHYCNZIWEZ-UHFFFAOYSA-N 433.346 4.339 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nc(C)cs1 1353069893 XPLPLUXWVQTUTO-VGVSSDJJSA-N 449.598 4.449 10 10 IICE CCOc1ccccc1CN1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)[C@H](C)C1 1448235964 MHULGBHSVOPKBX-HXUWFJFHSA-N 432.568 4.234 10 10 IICE O=S(=O)(c1ccccc1N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(F)(F)F 1458169223 NMYKBEKVFFGVHK-OAHLLOKOSA-N 448.894 4.416 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1459303801 GKDVOQWWBIMJAK-RUZDIDTESA-N 448.563 4.162 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC[C@@H](CNC(=O)OC(C)(C)C)[C@H]2C(F)(F)F)c1O 1460305828 XRKSTNAVYGOLCE-UGSOOPFHSA-N 448.457 4.402 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Br)c(F)cc1C 1466398531 PYSSSIQHKGMKFQ-UHFFFAOYSA-N 444.684 4.071 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@@H]1CCC[C@@H](OC)C1 1469740237 HMDUGBJNFAGKMV-OZOXKJRCSA-N 432.948 4.224 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1[C@@H]1C[C@H]1CF 1503488564 FZEPVMYUKFSUIQ-OKZBNKHCSA-N 445.539 4.223 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1515529967 APZMVASBAKSBDF-RDGATRHJSA-N 441.620 4.420 10 10 IICE CCCOc1cc(OC)ccc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1524058510 NGFMRNYRKXGYOY-INIZCTEOSA-N 434.483 4.484 10 10 IICE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1525761706 GCSURYGLQSHLBD-DMJCMNNJSA-N 435.612 4.108 10 10 IICE CC(C)(Cc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1527481607 OKJWSXTUTIABKN-UHFFFAOYSA-N 449.364 4.310 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCC1CC(F)(F)C1 1527705732 XBYFMZHQXDELSV-ZROIWOOFSA-N 430.567 4.281 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3nc4ccccc4cc3Br)C2)cc1 1529709329 XJSPWJDONMWYCX-OAHLLOKOSA-N 440.341 4.262 10 10 IICE COCCOCc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1531543193 CJYSZYKCJAYUKS-UHFFFAOYSA-N 435.568 4.210 10 10 IICE Cc1ccc(C)c([C@@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 1535455395 KXFZAJZBELAPRF-OAHLLOKOSA-N 428.444 4.478 10 10 IICE CSC1CCC(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1 1538072110 GHVAKYHWGACVQS-UHFFFAOYSA-N 438.505 4.022 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c1 1542747977 FTBJRCBYSSTMGE-UHFFFAOYSA-N 444.579 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCS[C@@H](C)C2)cc1 1547448566 OCRJMDKCMVGYDI-IBGZPJMESA-N 436.629 4.100 10 10 IICE CN(CC(C)(C)C)c1nnc(-c2noc3c2COCC3)n1CCCSc1nccs1 1554134522 UNEPAOWXNIDKNE-UHFFFAOYSA-N 448.618 4.127 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1CC[C@H](Cc2ccccc2)C1 1564591864 WSOAEIYSOLXBKH-UYAOXDASSA-N 429.511 4.012 10 10 IICE Cc1c(Br)cccc1CCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1565329760 AWZDVIGMTQQMMK-LJQANCHMSA-N 447.373 4.396 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Nc3nc(C)cc(C)n3)ccc2O)cc1F 1565688180 MJPBYTPTBFOBDA-UHFFFAOYSA-N 437.519 4.458 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@](C)(CO)c2ccc(Br)cc2)cc1 1570769941 OOSNEWBMWWMFHK-QFIPXVFZSA-N 427.342 4.494 10 10 IICE CC(C)Oc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Br 1583335152 URFFLHUHFIDSMG-UHFFFAOYSA-N 433.346 4.003 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3Cc4ccccc4CN3C(=O)OC(C)(C)C)ccc21 1583623262 IRSGPJKUPOUEDM-HSZRJFAPSA-N 435.568 4.047 10 10 IICE Cc1cnc(Cl)cc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1586620296 VVZWHJCWGSOCCY-GOSISDBHSA-N 432.952 4.105 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(-c4ccccc4)c3N)cc2F)C[C@@H](C)O1 1596695247 OEJLLZWJTGEWMQ-CALCHBBNSA-N 434.515 4.014 10 10 IICE Cc1cc(C(=O)N(C)[C@@H]2CCCc3c2cnn3C)c(C)n1-c1ccc(Br)cn1 1596748759 VQQIYFKPXBXGHT-GOSISDBHSA-N 442.361 4.135 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2C[C@@]2(C)CN(C)C2=O)c(C)n1-c1ccccc1 1611934122 WHOZRDZRWPQECN-AREMUKBSSA-N 448.615 4.313 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCOCC4)cc3)n2CCC(C)C)n1 1612185664 MPUHJOOAHBQMSK-UHFFFAOYSA-N 434.588 4.168 10 10 IICE CCON(Cc1ccccc1)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1618582285 BMYSQAQALLBQOE-KRWDZBQOSA-N 428.488 4.243 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nccc(C(F)F)n1 1620117818 LFCWNVOYOGYPLG-UHFFFAOYSA-N 439.470 4.126 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(C(C)(C)O)CC2)sc(C)c1-c1ccccc1 1620505026 LUPNHFHZRIMUDK-UHFFFAOYSA-N 444.597 4.322 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1csc([C@@H](C)NC(=O)OC(C)(C)C)n1 1626722853 LGQDNDGINXCYQA-HZPDHXFCSA-N 446.617 4.464 10 10 IICE O=Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2)s1 1634423999 QBWMRIFTXFXKOQ-UHFFFAOYSA-N 438.524 4.258 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ncccc4F)CC3)cc2Cl)C1 1634720227 REOFDAYHPRXVKK-KRWDZBQOSA-N 445.970 4.142 10 10 IICE Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1642155469 UCLRVSNPOUDPQG-UHFFFAOYSA-N 443.519 4.288 10 10 IICE Brc1cc(CNCCCc2nnc3n2CCCCC3)ccc1N1CCCCC1 1656614395 KVPUWVRLNUFQOP-UHFFFAOYSA-N 446.437 4.480 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4cccc(F)c4)CC3)C2)cc1 1673823600 WABJGRYSWVKEND-OAQYLSRUSA-N 425.548 4.325 10 10 IICE Cc1cc([C@@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C2CC2)ccc1F 1680743011 FGMZHEKIUNBCPZ-NRFANRHFSA-N 433.474 4.199 10 10 IICE O=C(NCCc1sccc1Br)N(Cc1ccccc1O)C[C@H]1CCCO1 1684867883 SEGMTGQXHNIKRU-OAHLLOKOSA-N 439.375 4.150 10 10 IICE O=C(NCc1cc(C(F)(F)F)cc(Cl)n1)NCc1cccc(Br)c1O 1684994617 QJIVCSZWUNZMPO-UHFFFAOYSA-N 438.631 4.221 10 10 IICE CC1CCN(C(=O)OC[C@@H]2CCCCN2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 1686173176 DDBLZOGZGBKEPX-KNQAVFIVSA-N 430.593 4.246 10 10 IICE C[C@@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1687155702 UFCZFWUAGQSSAV-VWLOTQADSA-N 443.538 4.233 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC(c3cccc(C(F)(F)F)c3)C2)N(C)C)cc1 1687806956 LVISSCUOCZGFJS-NRFANRHFSA-N 434.506 4.183 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCCCC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1692981215 FLIPGWRXALQOOA-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1CCCOC1CCCCC1 1729420150 IGGRAZFXRVTOGP-HXUWFJFHSA-N 428.577 4.254 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC[C@@H](OC(C)(C)C)C1 1742141776 OGQYWXPYDDCQPL-FGZHOGPDSA-N 441.620 4.336 10 10 IICE CCc1nnc(N2CCc3cc(OC)c(OC)cc3C2)n1CCCSc1nccs1 1744646198 NXEBSDFEKBYVRK-UHFFFAOYSA-N 445.614 4.059 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCc3cccc(C)n3)CC2)cc1 1768703427 NBXSNJJKNUXRCH-UHFFFAOYSA-N 448.615 4.247 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CC4)n3C[C@H](OC)C(C)(C)C)CC2)cc1 1770257501 BPDWETXTDMWFMK-QFIPXVFZSA-N 441.620 4.017 10 10 IICE COCCN(C)c1nnc(-c2cccc3cccnc23)n1CCCSc1nccs1 1771069325 NMVGGHCHYIBPNW-UHFFFAOYSA-N 440.598 4.215 10 10 IICE O=C1/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)SC(=S)N1Cc1ccc2c(c1)OCO2 1858588871 GWWCRIRLEPXSEU-FRKPEAEDSA-N 434.882 4.378 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCc2ccccc2F)sc(C)c1-c1ccccc1 1860759691 DYEXPTCKALIPGI-UHFFFAOYSA-N 440.496 4.294 10 10 IICE CCCN1C(=O)C(NCCc2cccs2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873168851 MIKUOWMPGIJPQS-UHFFFAOYSA-N 433.577 4.478 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@@H](NCc2cc(Br)ccc2O)C1 2096261268 HXOUYJUKMWOWCI-KRWDZBQOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3c(O)cccc3Br)C[C@]2(C)C1 2116279451 XGLAPVBLPPHLJB-LRDNONRASA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)CN1C(=O)SC(=Cc2ccc(-c3cccc(C(=O)O)c3)o2)C1=O 2294134386 REZMHTGZGSOWNA-UHFFFAOYSA-N 429.450 4.023 10 10 IICE N=C1C(=Cc2ccc(SCc3ccco3)o2)C(=O)N=C2SC(C(F)(F)F)=NN12 2297348154 NCFAYPYDISOJDT-UHFFFAOYSA-N 426.401 4.346 10 10 IICE COc1cc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)ccc1O 14459048 XYSAVTXIARQLBC-IUKKYPGJSA-N 426.538 4.012 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472447 NTABJDONIMPISH-LGVFNWMJSA-N 434.540 4.493 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccc(C)cc3)C2=O)cc1OC 15045863 CMVOUXQDMCHHNX-YQNUULROSA-N 442.562 4.241 10 10 IICE Cc1ccc(OCCOc2ccc([N+](=O)[O-])cc2/C=C2/SC(=S)N(C)C2=O)cc1 27531646 PFCZEBYMOXDDCT-LDADJPATSA-N 430.507 4.192 10 10 IICE CCCCCCN1C(=O)/C(=C\c2c(NCC)nc3c(C)cccn3c2=O)SC1=S 33474131 DTOKQILLUATXAD-DTQAZKPQSA-N 430.599 4.216 10 10 IICE COC(=O)CCCCCN1C(=O)/C(=C\c2ccc(O)c(Br)c2)SC1=S 40846605 ZSUWIQYSRUMNPL-GXDHUFHOSA-N 444.372 4.089 10 10 IICE CCCCCOc1ccc(/C=C2\SC(=S)N(CCC(=O)OCC)C2=O)cc1OC 40888449 GMZFAMXCKHINCS-JXAWBTAJSA-N 437.583 4.419 10 10 IICE Cc1cc(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)c(C)n1-c1ccc(F)cc1 110458331 YCBVGHWIXNSWRC-RTBURBONSA-N 427.564 4.195 10 10 IICE Cc1cc(C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)c(C)n1-c1ccc(Cl)cc1 747190200 LZUIZRVFNHTTPH-UHFFFAOYSA-N 439.947 4.255 10 10 IICE O=C(NCc1ccccc1)C1CCN(Cc2ccc(OCc3ccccc3)cc2O)CC1 753535172 BVOFKSZARGUBMD-UHFFFAOYSA-N 430.548 4.500 10 10 IICE C[C@H](N[C@H](C)Cn1ncc2ccccc2c1=O)c1cc(Br)cc(Cl)c1O 756777227 HABZIIATRDVSPH-NEPJUHHUSA-N 436.737 4.257 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]c3cccc(F)c23)NC(=O)OC(C)(C)C)cc1 761776632 RZNDPUFKARHXIS-HXUWFJFHSA-N 440.519 4.369 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](C)Cn3ncc4ccccc4c3=O)c2C)c1 765251171 ZOZKXCMHKYYMQJ-GOSISDBHSA-N 428.536 4.239 10 10 IICE O=C1CCc2cc(-c3csc(NS(=O)(=O)c4ccc5ncsc5c4)n3)ccc2N1 775144251 QASOCCVPYFKBQG-UHFFFAOYSA-N 442.547 4.105 10 10 IICE C[C@@H](NC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccc(N2CCOCC2)cc1 788757124 UDJWEOWEMCEEOH-BFUOFWGJSA-N 425.426 4.168 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCOc1cccc(C(F)(F)F)n1 1138027235 QBLCQPZFSAEBIL-UHFFFAOYSA-N 431.414 4.129 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1c1nc(C(=O)NCc2ccc(N3CCCC3)cc2)co1 1141537843 DDBSLXHAZZRLBE-FQEVSTJZSA-N 440.544 4.277 10 10 IICE Cc1c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(O)nc2ccccc12 1143190347 BZIFOVWQAXRELX-UHFFFAOYSA-N 427.451 4.249 10 10 IICE CCn1ncc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1-c1ccccc1 1150347536 JSMKBCIRYFNEOJ-FQEVSTJZSA-N 438.959 4.323 10 10 IICE O=C(CCn1ccc2cc(Cl)ccc21)NCc1cc(F)c(N2CCOCC2)c(F)c1 1161175019 MCJRAMDRQKUGCD-UHFFFAOYSA-N 433.886 4.116 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc4c(cnn4C(C)(C)C)c3=O)c2C)cc1 1165782225 QQSZDETVJHKUCK-UHFFFAOYSA-N 447.539 4.037 10 10 IICE Cc1cc(C(=O)N2Cc3cncnc3[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1175594222 NVTNNIRKBLVNAL-CYBMUJFWSA-N 425.330 4.406 10 10 IICE Cc1cc(CNC(=O)NC[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1234336791 KTBJNBOOBBPASV-KESTWPANSA-N 426.561 4.197 10 10 IICE CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1253807790 IFMWZFVNPRFLCF-XXBNENTESA-N 438.616 4.363 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 1264689483 VXLWFAGIKKHINF-HUUCEWRRSA-N 449.910 4.250 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCS[C@H](C(C)C)C1 1289422981 FQZYDILAVFIPBC-QFIPXVFZSA-N 436.629 4.341 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCC34CCC4)ccc21 1292206607 HMBGLBJPOAOJOJ-HXUWFJFHSA-N 427.589 4.113 10 10 IICE COc1cccc(N2CC[C@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)c1 1292716401 UVOSAHUQUNGGCS-QFIPXVFZSA-N 431.536 4.232 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)c1 1294446484 FLUQJQOUVILXPA-DEOSSOPVSA-N 429.564 4.366 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)CCC(F)(F)F)cc1F 1298056136 KQVSIHRLBCWUBL-KRWDZBQOSA-N 429.462 4.162 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC(CCCO)CC2)cc1F 1298061834 OSUNVIOUPPCXRJ-UHFFFAOYSA-N 431.600 4.109 10 10 IICE CC[C@](O)(CCC(F)(F)F)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1304201511 FKLPUXQFWFFSPL-QFIPXVFZSA-N 439.522 4.008 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CCCSC3)CC2)cc1F 1315511820 FOEZZOWVFZKDNT-GOSISDBHSA-N 447.624 4.094 10 10 IICE COCC[C@@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1315995408 GPKKXHZUOGTGOO-IBGZPJMESA-N 439.629 4.216 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cnnn2-c2cccc(Cl)c2Cl)C2CC2)cc1 1352744473 PVRWRTMZNQUCSI-UHFFFAOYSA-N 430.339 4.445 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3cc4cc(Cl)ccc4[nH]3)cc2F)C[C@@H](C)O1 1357836675 ZVNCCRMNVUXWNQ-HUUCEWRRSA-N 429.923 4.433 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4ccccc4c(Cl)n3)cc2F)CC1 1359920400 TUJYHJWQAGLACK-UHFFFAOYSA-N 426.923 4.099 10 10 IICE Cc1cc(C)cc(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1360543670 LXSLANTUYTWIRL-ZHZULCJRSA-N 442.581 4.393 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4cc(Br)ccc4[nH]3)C2)cc1 1452029238 NRAGQFMZTBSXBK-CQSZACIVSA-N 428.330 4.195 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1462847608 WZAAGKSEKSQATM-DYESRHJHSA-N 425.573 4.256 10 10 IICE CCCN(C)C(=O)[C@@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1464679582 QWOPKOIRHWDDIQ-FQEVSTJZSA-N 434.005 4.060 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)CC1 1504023520 NJUBAUPLUIUSRX-OAQYLSRUSA-N 446.646 4.318 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC(F)(F)CO1 1512804233 JFJNCPDADHUZEA-FXAWDEMLSA-N 433.547 4.452 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3Cc3c(C)coc3C)CC2)cc1F 1518308107 HVYHQPZAXLTCND-UHFFFAOYSA-N 441.551 4.308 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(-n4cccc4)ccc3Cl)cc2F)CC1 1528701744 PLDZOJYZBSEGRK-UHFFFAOYSA-N 440.950 4.342 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](C)SCc1nc(O)c2ccccc2n1 1529277965 LGRQVXYVLLYQTA-SJORKVTESA-N 438.597 4.079 10 10 IICE O=C(CCc1cccc(C(F)(F)F)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1533992236 MBQRNNQCRPUHHQ-UHFFFAOYSA-N 445.529 4.486 10 10 IICE COc1ccccc1Cn1cnc2cc(C(=O)N(C)Cc3ccc(N(C)C)cc3)ccc21 1540440333 CYUXPJMCZHVPKM-UHFFFAOYSA-N 428.536 4.431 10 10 IICE CN(CCc1ccccc1C(=O)N(C)Cc1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 1540440685 QBCIUVMFRMUBMR-UHFFFAOYSA-N 425.573 4.434 10 10 IICE CC(C)c1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1540712281 QYOQWXTWQGJCQR-UHFFFAOYSA-N 430.551 4.308 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](CN(C)CC)C2)sc(C)c1-c1ccccc1 1559581648 NGNXUXKGMCNPKH-GOSISDBHSA-N 443.613 4.112 10 10 IICE C[C@@H](c1ccccc1)[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1566185377 GGWDJBGTHILKMJ-HUUCEWRRSA-N 430.551 4.177 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCc3nn(C)cc32)c(C)n1-c1cccc(Br)c1 1568147169 LYZLECHFUGXXHV-LJQANCHMSA-N 427.346 4.398 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc2[nH]c(-c3cccs3)nc12 1570515020 XXWFSNBANIXNMT-UHFFFAOYSA-N 435.505 4.203 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(OCc4ccccc4)ccc3O)C2)cc1 1570563524 SBSJDQSCTHZHRX-FQEVSTJZSA-N 432.520 4.236 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C)ccc21 1584634145 GCRXLPSRMFQMMD-OXQOHEQNSA-N 443.588 4.137 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ncccc3C2)c(C)n1-c1ccccc1Br 1588121198 JMKGXTOPULHVES-UHFFFAOYSA-N 439.357 4.344 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)c(F)c1 1611263907 WBRPJZZKYYWIDX-QGZVFWFLSA-N 434.519 4.308 10 10 IICE COC(=O)/C=C/c1ccc(N(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)c([N+](=O)[O-])c1 1611817971 KCNNAHRXNAYQIT-WUXMJOGZSA-N 438.459 4.379 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC[C@H](C3CCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1613355461 NOCJUTGNNOUBEK-YLJYHZDGSA-N 429.584 4.298 10 10 IICE CCC[C@@H](C)CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1614363553 FCAXIEVKFPLHJX-OFNKIYASSA-N 441.620 4.277 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2cc(C)on2)cc1 1615381041 PFOPGACJFVNKFI-UHFFFAOYSA-N 445.571 4.091 10 10 IICE COC[C@H](F)Cn1c(-c2ccc(C)o2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1619614597 MFKZIZIBCRZARF-LJQANCHMSA-N 427.524 4.068 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c1 1624789329 NPUBIDNNPDJTJV-UHFFFAOYSA-N 444.579 4.235 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1nc2ccc(Br)cn2c1F 1628873733 KKNQTEXHQGDIAZ-UHFFFAOYSA-N 445.336 4.498 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(O)c(F)cc1F 1629319324 RUZKCVNLEDMFJO-APSNUPSMSA-N 438.452 4.040 10 10 IICE Cc1cc(C(=O)Nc2c(C(N)=O)n[nH]c2C(C)C)c(C)n1-c1cccc(Br)c1 1629829451 OVFOKLIQWOPMMV-UHFFFAOYSA-N 444.333 4.054 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC3(CCC3)S(=O)(=O)CC2)cc1 1630041649 LNOLRUMVMISLES-UHFFFAOYSA-N 440.569 4.351 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)[C@@H]1CCC[C@@H](OC)C1 1631887778 GQITUHPCFNNHBN-KJXAQDMKSA-N 426.557 4.188 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@]2(C)CN(C(=O)OC(C)(C)C)CCO2)c1C 1634097824 ZHFRNYUSZHYRME-RUZDIDTESA-N 441.572 4.158 10 10 IICE CC(C)[C@@H](CCNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)NC(=O)OC(C)(C)C 1637142520 HSWUWGFERRNHNJ-OAQYLSRUSA-N 432.609 4.366 10 10 IICE CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)NCc2cccc(Br)c2O)CC1=O 1640083615 DVUNNTOBAUMQEA-ZBFHGGJFSA-N 445.357 4.338 10 10 IICE CC(C)(C)OC(=O)NCCc1ccccc1C(=O)NCc1cccc(Br)c1O 1640084451 WQHRKTBOBSGUQU-UHFFFAOYSA-N 449.345 4.152 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(Cl)cc3Cl)CC2)c(OC)c1 1655378402 AKEJSJUBGLUHJG-AWEZNQCLSA-N 438.355 4.160 10 10 IICE COC(=O)CN(CC(=O)Nc1ccc(-c2ccccc2)cc1)Cc1cc(Cl)ccc1O 1657602614 HQPWSMWGTOJOJT-UHFFFAOYSA-N 438.911 4.326 10 10 IICE CC(C)CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)(C)C 1657953496 XIJFYLRCVIBQQI-YDHSSHFGSA-N 435.628 4.496 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](c3ccc(C)cc3)c3ccccn3)C2)cc1 1686356408 YGSIZBVHUJAYFB-CJFMBICVSA-N 430.552 4.314 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Nc3ccccc3Cl)CC2)N(C)C)cc1 1687806312 DDUHCROCLFJLCS-HSZRJFAPSA-N 444.023 4.295 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2cc(C)on2)n1Cc1ccc(N2CCSCC2)cc1 1694001521 YAYUCWVJKGPHJA-QGZVFWFLSA-N 440.617 4.326 10 10 IICE COC(=O)C1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)CC1 1697044795 SWDGEAVUDVVLMT-UHFFFAOYSA-N 435.572 4.398 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC(F)F)C1 1698273507 SUBMQTPTPRUXTQ-LJQANCHMSA-N 445.514 4.207 10 10 IICE CN(CC(C)(C)C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1711060251 XZXMWCGZONVMTB-OAQYLSRUSA-N 445.583 4.026 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1CCc1csc(C(C)(C)C)n1 1729419571 VDICAXNSWUDQKN-UHFFFAOYSA-N 449.584 4.074 10 10 IICE COCCN(CC(C)C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1730749028 RWXHRLRPTTVOSJ-UHFFFAOYSA-N 445.677 4.286 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C)N2CCC(C)CC2)n1 1751604315 RNPGIBANWQFTAB-HXUWFJFHSA-N 434.588 4.111 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)C1 1761144576 OVRYBUDUPOEKME-INIZCTEOSA-N 432.619 4.163 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCCC1(F)F 1762870581 ZBGPKTFKGZZZNZ-IBGZPJMESA-N 433.547 4.139 10 10 IICE COCCN(c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@H](C)C1 1771090782 KCCWFKUXQOCGJI-PXNSSMCTSA-N 429.584 4.440 10 10 IICE CCOC(=O)N1CCN(C(=O)/C=C/c2cc(C)n(-c3ccc(C(F)(F)F)cc3)c2C)CC1 1858131049 UGUMTZZVELWMBM-BJMVGYQFSA-N 449.473 4.427 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3ccccc3F)N=C2C(F)(F)F)cc(OC)c1OC 1865668309 QMOYPBRWELDRAE-ZSOIEALJSA-N 438.377 4.196 10 10 IICE CCC1=NN(Cc2ccccc2F)C(=O)/C1=C/c1cc(Br)cc(OC)c1O 1865672202 PJFQSWZCWIAHFD-OQLLNIDSSA-N 433.277 4.494 10 10 IICE CCN1CCc2cc([C@@H](O)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044715747 WSHQOYYXQQPABO-DEOSSOPVSA-N 439.600 4.129 10 10 IICE Cc1cc(NS(=O)(=O)c2cc(Br)sc2Br)c(C)cc1O 2145853378 PDQJFERMBVWIDH-UHFFFAOYSA-N 441.166 4.396 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@H](NCc1cc(Br)cc(F)c1O)C2 2241053529 CLTRIGBHPLJMLF-WPUCRFQZSA-N 443.357 4.465 10 10 IICE O=C1C(=Cc2c[nH]c3ccccc23)SC(=S)N1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2296883323 SUWYURXZBMCSLG-UHFFFAOYSA-N 441.450 4.213 10 10 IICE COc1ccc(-n2c(C)cc(C=C3C(=N)N4C(SC)=NSC4=NC3=O)c2C)cc1 2297333835 ZNXFNFMCYBUQMF-UHFFFAOYSA-N 425.539 4.042 10 10 IICE CC[C@@H](C)[C@H](C(=O)O)N1C(=O)C(=Cc2c(Cl)nc3scc(C)n23)SC1=S 2323827177 DUGHPUQGNHMQQQ-RDDDGLTNSA-N 429.976 4.058 10 10 IICE COc1ccc(/N=N/c2nc(-n3nnc4ccccc43)nn2-c2ccc(OC)cc2)cc1 15778360 XQDWAWPQJONVPB-SHHOIMCASA-N 426.440 4.434 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)n2)cc1 727242180 VFKLKSKRXUPVAN-UHFFFAOYSA-N 438.914 4.044 10 10 IICE CCOC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)o1 748091938 SHCWMWGHXJGYGU-UHFFFAOYSA-N 446.428 4.106 10 10 IICE Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 784076096 YRTLTPWHGNQPPQ-UHFFFAOYSA-N 428.920 4.341 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-n2cc(C)cn2)cc1 791246638 PKIZVPKWYVBQJY-UHFFFAOYSA-N 434.540 4.183 10 10 IICE O=C(NCCCSc1nccs1)N[C@@H]1CCOc2c(Br)cccc21 800710898 BKBWNXOWFJXWPW-CYBMUJFWSA-N 428.377 4.211 10 10 IICE Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c(C)c1 1084536054 AGGHWXXBSZERQE-PDGQHHTCSA-N 431.404 4.138 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)cc1 1124586328 YTGSKCDTMDKMOX-RTBURBONSA-N 441.538 4.082 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccsc3Br)cc2F)C[C@@H](C)O1 1125188721 UXRHPLDBCORGGX-VXGBXAGGSA-N 427.339 4.193 10 10 IICE CC[C@H](C)c1nc(C)c(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 1125256477 IIEXGOIPNSAFHH-YESZJQIVSA-N 442.579 4.219 10 10 IICE CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 1126581432 FEDWZWCHTYRVPD-MRXNPFEDSA-N 446.498 4.066 10 10 IICE O=C(/C=C/c1csc(C(F)(F)F)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129660429 RCJWQBBWJHTQHY-OWOJBTEDSA-N 432.414 4.211 10 10 IICE Cc1nc(-c2cccs2)c(CC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)s1 1129661587 PLDUYDXDULTGPY-UHFFFAOYSA-N 449.548 4.154 10 10 IICE COC(=O)c1ccc(Cl)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 1142712708 FEOPUPPZPZYMRF-LJQANCHMSA-N 430.932 4.014 10 10 IICE Cc1ccc2[nH]c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cc2c1Br 1158717069 LUNJHCWTRCDOCH-FQEVSTJZSA-N 443.389 4.338 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1Cc1ccc(N2CCOCC2)cc1 1167739309 BTLRPOREBMTPEC-XZOQPEGZSA-N 429.605 4.277 10 10 IICE COCCN(Cc1c(Br)cccc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 1191610187 HQYQYFCTWGHVRN-UHFFFAOYSA-N 425.279 4.028 10 10 IICE C[C@@]1(NCc2cc(Br)cc(F)c2O)CCN(C(=O)OCc2ccccc2)C1 1202227074 KFERJAVCFCRYOV-HXUWFJFHSA-N 437.309 4.185 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCC[C@@H](N(C)C)C(F)(F)F)cc2Cl)C1 1227209816 WRODJFQCWUNMFR-RDTXWAMCSA-N 434.934 4.258 10 10 IICE Cc1cc(CCNC(=O)N(C)CCCNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1233974475 OHWBTSJKUZFCSD-UHFFFAOYSA-N 428.577 4.193 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H]2CN(C)C[C@H]2c2ccccc2)c(C)n1-c1ccccc1 1233974503 OWVOBJYTXVZCTC-RSXGOPAZSA-N 430.596 4.281 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4cc(F)ccc4F)CC3)C2)cc1 1252116453 RWOIEOQYKPGXMP-IBGZPJMESA-N 443.538 4.464 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1 1264442297 CYGFZNBRTZHXNQ-FQEVSTJZSA-N 427.976 4.192 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)cc2Cl)C1 1270438588 ABHARFNRGZUDRV-INIZCTEOSA-N 447.000 4.442 10 10 IICE CS[C@@H](C)Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1302551973 BJMPUWOONZEJBY-AZUAARDMSA-N 429.634 4.160 10 10 IICE COc1ccccc1CN(C)c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1315638727 LSAAASYQRBTANV-GOSISDBHSA-N 445.614 4.414 10 10 IICE CC[C@H](C)Oc1ccccc1/C=C/C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1360094103 QRAJBGFGTPHDGC-RPAADVPWSA-N 439.575 4.475 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@H]1C[C@@H](OCC)C12CCCC2 1471191244 OBMSPZBHXJJSIQ-BJKOFHAPSA-N 442.648 4.098 10 10 IICE Cc1cc(C(=O)NCc2cc(C3CC3)n(C)n2)c(C)n1-c1ccc(Br)cc1 1472070859 MGPQFHUUZKJPBL-UHFFFAOYSA-N 427.346 4.398 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)CSc3ncc(CO)n3C)c2C)ccc1Br 1472996578 GIJICAILKGWIQW-UHFFFAOYSA-N 448.386 4.366 10 10 IICE Cc1noc(C)c1[C@@H](C)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1511923004 NSPOXYJETLRUCU-MGPUTAFESA-N 425.533 4.270 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1512810574 WOIRGMQWGFYHRF-FQEVSTJZSA-N 448.615 4.080 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(I)c(F)cc2F)cc1 1516599495 NJUZMZYZHSJUMJ-UHFFFAOYSA-N 444.263 4.346 10 10 IICE COc1ccc(N2CCN(C(=O)CCCOc3ccc(C)cc3Cl)CC2)c(OC)c1 1530967780 GGBBEVWPCRIXBZ-UHFFFAOYSA-N 432.948 4.173 10 10 IICE Cc1ccc([C@H](CN2CCOCC2)NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1532383011 WDJNGKBVWWSYKJ-SANMLTNESA-N 431.580 4.135 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1542567871 FRSUJAFDHPLUDL-QHCPKHFHSA-N 447.560 4.369 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543040380 WMOJYXJSHSYWTK-NRFANRHFSA-N 435.620 4.045 10 10 IICE Cc1nnc(N2CCN(Cc3cccc(Cl)c3)CC2)n1CCCSc1nccs1 1543325308 LMPYFHGBJLZXEY-UHFFFAOYSA-N 449.049 4.201 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C4SCCS4)cc3)CC2)c(OC)c1 1543632889 RNCWPFRZIFWXEP-UHFFFAOYSA-N 430.595 4.145 10 10 IICE CCc1nc(CN(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1546379101 KRUVLAVOWJHYQF-UHFFFAOYSA-N 428.581 4.454 10 10 IICE CCOC(=O)[C@@H](C)C1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1558239276 KMLBWRGSJGIRLR-AWEZNQCLSA-N 433.346 4.128 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc4c3[C@@H](C)CC4(C)C)CC2)cc1 1558473138 RFEAXCMKJYLIKS-HSNDNRACSA-N 447.579 4.324 10 10 IICE COc1cccc([C@H](C)N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1565679841 CMZKTWPUEHOQPJ-FQEVSTJZSA-N 445.563 4.434 10 10 IICE Cc1cc(C(=O)NCc2ccc([C@H](C)O)cc2)c(C)n1-c1ccc(Br)cn1 1566184256 ZFQQDCMHHDKOQL-HNNXBMFYSA-N 428.330 4.235 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2CC(=O)c2cccs2)c(C)n1-c1ccc(F)cc1 1566211005 UFIYLOWCMKNFRC-IBGZPJMESA-N 426.513 4.409 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2 1588227673 ADMBLCLIQHFMDU-QGZVFWFLSA-N 432.929 4.044 10 10 IICE CO[C@](C)(C1CC1)[C@@H](C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1597434267 SSJTVBGKIXGZPN-CCTYPNJASA-N 438.640 4.049 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C 1611046202 WACLPCWWYHOYIV-FQEVSTJZSA-N 439.552 4.351 10 10 IICE Cc1ccc(-c2nnc(N3CCC(NC(C)C)CC3)n2CCCSc2nccs2)o1 1612033278 RXUCYUJMRSOQLF-UHFFFAOYSA-N 446.646 4.452 10 10 IICE Cc1cncc(/C=C/C(=O)N2C[C@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)c1 1626448348 QYJMUZYOLADFJM-MOTZXUDYSA-N 425.504 4.273 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cc(Br)ccc1OCc1ccccc1 1626837872 ICWFVTACKNEDFL-UHFFFAOYSA-N 428.282 4.369 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)cc1)C1CCCCC1 1627001866 SZZKIXQSVWMBKV-NRFANRHFSA-N 431.646 4.409 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSCc3ccc(Br)cc3)CC2)cc1 1630992104 GTZSJFAGTOJZNO-UHFFFAOYSA-N 449.414 4.430 10 10 IICE Cc1cc(C(=O)Nc2cc(C(F)(F)F)[nH]n2)c(C)n1-c1ccc(Br)cn1 1631174164 GFHPEQDKQRVKTH-UHFFFAOYSA-N 428.212 4.246 10 10 IICE CC(C)(C)c1ccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)o1 1635774981 YKFLXWWJNBWVRR-UHFFFAOYSA-N 434.539 4.075 10 10 IICE CCc1[nH]nc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1Br 1641341260 GJOLHXZNZAXRKG-UHFFFAOYSA-N 431.334 4.215 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](c4ccn(C)n4)C3)cc2Cl)C1 1680561974 GVWFWBWLMMIVJW-IEBWSBKVSA-N 429.996 4.399 10 10 IICE Cc1cc(CNC(=O)NCC2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]23)c(C)n1-c1ccccc1 1684483072 FHIDPUCCIWUPRA-VXKWHMMOSA-N 438.572 4.006 10 10 IICE CC[C@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC[C@H]1c1ccccc1 1685328394 VHEHUGXBZQCSGY-SQJMNOBHSA-N 448.611 4.114 10 10 IICE Cc1ccsc1CCn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1692915358 DWJAOFDRUVALQN-UHFFFAOYSA-N 439.629 4.487 10 10 IICE CCCCn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1695231085 AFKHNNAYTVUGLP-HDICACEKSA-N 429.565 4.191 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1707973665 VTLXIIKMYIDNIG-TXTKFYIRSA-N 441.620 4.230 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](COC)C1 1727847405 IAKITSZILRBWSB-MOVYNIQHSA-N 435.572 4.170 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728920009 BIXKBCDPKFSEHN-YADHBBJMSA-N 436.604 4.336 10 10 IICE Cc1nnc(N2CCC(C(=O)c3cccs3)CC2)n1CCCSc1nccs1 1742778376 SCODTEGTTANQAK-UHFFFAOYSA-N 433.628 4.386 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC=CO1 1743723448 FKQDCXPTGQJGEF-DENIHFKCSA-N 425.577 4.210 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CC[C@H]1CCCCO1 1767111644 ACCJLBNSFGJJIS-GOSISDBHSA-N 427.936 4.295 10 10 IICE O=C(Nc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccn1)c1ccccc1 1860502801 BJVQXONFUPUFGT-UHFFFAOYSA-N 447.450 4.362 10 10 IICE O=C(CNCc1cccc(Cl)c1Cl)Nc1cccc2c1C(=O)c1ccccc1C2=O 1860718791 GOFXAMVUCUSFND-UHFFFAOYSA-N 439.298 4.497 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](CNCc2cc(Br)cc(F)c2O)(C2CC2)C1 1965956716 RVHLWFGUEUIXAX-FQEVSTJZSA-N 443.357 4.421 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@H]1CNCc1cc(Cl)cc(Br)c1O 2078327245 AZCQZGXAJJILER-NJZAAPMLSA-N 431.758 4.153 10 10 IICE O=C1N=C(N2CCN(Cc3ccccc3)CC2)SC1=Cc1ccc(Br)cc1 2294407185 XJDJAWDHHBPHEM-UHFFFAOYSA-N 442.382 4.237 10 10 IICE CCC1=NN2C(=N)C(=Cc3cccn3-c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)N=C2S1 2297500256 VQNQQJJJGYENLI-UHFFFAOYSA-N 428.861 4.068 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccccc1OCc1ccc(F)cc1 2313558675 HHFIZRNYUBBSIE-UHFFFAOYSA-N 434.398 4.210 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[C@@H]2NCc1cc(Cl)cc(Br)c1O 2318636794 IUZCTXIIMQIOOS-WHOFXGATSA-N 431.758 4.296 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCCO3)SC(=S)N1c1ccc(Cl)c([N+](=O)[O-])c1 2321646938 MOSWURRJUMCXFJ-UHFFFAOYSA-N 434.882 4.425 10 10 IICE CC1=NN(c2ccccn2)C(=O)C1=Cc1cc(Br)cc(Br)c1O 2332131618 MJHTWZBNMIOZLU-UHFFFAOYSA-N 437.091 4.118 10 10 IICE O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccc(-c2cccc(C(=O)O)c2)o1 8872535 IHYWLSDTYNUGHP-GDNBJRDFSA-N 443.242 4.413 10 10 IICE O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)cc1 14550786 ZZUZOJCBIFQLHI-IPJJNNNSSA-N 425.510 4.206 10 10 IICE CC(=O)c1cccc(N2C(=O)/C(=C\c3cccc(OCCC(=O)O)c3)SC2=S)c1 16908153 YFTIGDOYKPPJLN-WOJGMQOQSA-N 427.503 4.149 10 10 IICE Cc1ccc(C(=O)O)c(NC(=O)CN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)c1 16922472 QDFVOGKJWJBKSX-WCTLISOUSA-N 438.530 4.089 10 10 IICE CC1CCC(Nc2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(C(C)C)C2=O)CC1 33489171 SZLFAEVOVXSQPH-ATVHPVEESA-N 442.610 4.295 10 10 IICE CN(C)c1ccc([C@H]2CC(c3ccc(Br)cc3)=NN2C2=NC(=O)CS2)cc1 72413108 QICDKMJJJSTZCW-GOSISDBHSA-N 443.370 4.296 10 10 IICE COc1ccc([C@@H](CC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)NC(C)=O)cc1 109295351 VKARUDICWIEPQJ-RUZDIDTESA-N 437.584 4.348 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(c1)nc(Cc1cccs1)n2C 557562025 BNALDXRIQXYQOC-UHFFFAOYSA-N 432.549 4.331 10 10 IICE COc1ccc(CN(C)C)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 569999857 IHBPZWHRXRQLOL-UHFFFAOYSA-N 434.584 4.117 10 10 IICE O=C(N1CCc2c(NCc3cc(Br)cc(F)c3O)cccc21)C(F)(F)F 721176956 YYGCNTJZBQZKKM-UHFFFAOYSA-N 433.199 4.357 10 10 IICE CN1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 754857853 IMIXJEMMURQCDS-FGZHOGPDSA-N 428.939 4.100 10 10 IICE Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 766595701 KEGDICXWNWQUPJ-IXDOHACOSA-N 445.583 4.260 10 10 IICE Cc1ccccc1C(=O)NC1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 768327496 RZCPYDSKPNSOAV-UHFFFAOYSA-N 436.556 4.288 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(C(=O)N4CCCC4)CC3)cc2Cl)C1 800719838 ODFZDUUXZZSOLX-GOSISDBHSA-N 447.023 4.120 10 10 IICE COc1c([N+](=O)[O-])cc(N(C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1Br 919802357 MVWLOZIIWXXNAJ-UHFFFAOYSA-N 428.214 4.092 10 10 IICE CCOc1cc2c(cc1/C=C/C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O[C@H](C)C2 920881781 RHIJKHDYVAMSTH-KWKDUPADSA-N 436.552 4.136 10 10 IICE CON(C[C@H]1CCC[C@H](C)C1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1141631575 GWFHANJBDZDGOS-GJZGRUSLSA-N 438.571 4.084 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCCN1Cc1ccccc1 1148444220 PSFRLMLGBFLLDD-OFNKIYASSA-N 443.538 4.428 10 10 IICE Cc1cc(C(=O)NCc2ncc3c(n2)CCC3)c(C)n1-c1ccccc1Br 1161433283 LYWSRFYAYQXOLL-UHFFFAOYSA-N 425.330 4.065 10 10 IICE Cc1cc(C(=O)NCC(C)(C)C2=CCOCC2)c(C)n1-c1ccc(Br)cn1 1181052973 LCZYZKNIZUWZKG-UHFFFAOYSA-N 432.362 4.354 10 10 IICE CC1(C)OC(=O)c2c(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cccc21 1265564766 UPRVHLFHNCUIRS-CQSZACIVSA-N 430.451 4.092 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(S(=O)(=O)C4CC4)cc3)cc2Cl)C1 1270438591 ABHARFNRGZUDRV-MRXNPFEDSA-N 447.000 4.442 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@]34C[C@H]3CN(C(=O)OC(C)(C)C)C4)cc2Cl)C1 1270440622 RTFVHPHEOJGKMN-SDWUMEBZSA-N 448.007 4.450 10 10 IICE CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)c1cc2cc(O)c(O)cc2s1 1290133888 SUEBXIGCTHJKSW-UHFFFAOYSA-N 425.293 4.330 10 10 IICE CN1CCCc2cc(Cn3c([C@H]4CCCCO4)nnc3N(C)CCOC(C)(C)C)ccc21 1298890177 ZYLZMCLTWXASMH-JOCHJYFZSA-N 441.620 4.202 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCNC(=O)OC(C)(C)C 1302576051 UNEWZTWDCVSYSC-UHFFFAOYSA-N 442.608 4.163 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)[C@@H](C)c1cccc(N2CCOC2=O)c1 1312886029 TXWKDMGOKPDIDV-MOPGFXCFSA-N 438.572 4.351 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@H](CCc3ccccc3)C(F)F)C2)cc1 1312901397 GGCVWJUHXNQKBK-DENIHFKCSA-N 431.527 4.429 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)cc1C 1316438272 GYVVHWBFNZJACE-NHCUHLMSSA-N 429.634 4.274 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(OC2CCCC2)nc1 1354784426 LKSQOMVYMYSJSM-UHFFFAOYSA-N 449.473 4.188 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3ccccc3Cc3ccccc3)CC2)cc1 1356445648 KLDVAHCILHOYNW-OAQYLSRUSA-N 430.548 4.402 10 10 IICE C[C@H](NC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)c1ccc(N2CCOCC2)cc1 1442412875 PMMOTFQEFSHXNU-NSHDSACASA-N 442.274 4.368 10 10 IICE O=Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)s1 1444666361 SPMLRSYKEKJGGF-UHFFFAOYSA-N 434.561 4.366 10 10 IICE COc1cc2c(c(OC)c1)N(CC(=O)Nc1nc(-c3ccc(F)cc3)cs1)CCC2 1460248974 JSQFMQTZIYRFKK-UHFFFAOYSA-N 427.501 4.358 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(c3cccc(OC(F)(F)F)c3)CCC2)N(C)C)cc1 1463279460 IFATWQIMTFEMPR-OAQYLSRUSA-N 449.517 4.492 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(c4ccc(Cl)cc4)C3=O)c2C)cc1 1465296715 WINBDDLNSVRDEY-JOCHJYFZSA-N 437.927 4.291 10 10 IICE CCc1nsc(N2CCN(C(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)CC2)n1 1465528376 QFEYOTPMWOBOAI-UHFFFAOYSA-N 429.977 4.124 10 10 IICE COc1cc(Br)c(OC)c(C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 1468668183 VSJSBQCZHNXWRD-UHFFFAOYSA-N 435.101 4.409 10 10 IICE CCOC(=O)CN(CC(=O)Nc1ccc(Oc2cccc(C)c2)cc1)Cc1ccccc1O 1473572197 DGBDNEIJJFMNAC-UHFFFAOYSA-N 448.519 4.497 10 10 IICE CCCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1514719911 VJHLQAOPMWPROX-UHFFFAOYSA-N 434.588 4.067 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1C)OC 1518718210 DPKLQFCCURHNCJ-JUXOCIIHSA-N 437.588 4.249 10 10 IICE O=C(CCc1ccc(Cl)c(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524851000 BTYAVMBVEHRNEL-UHFFFAOYSA-N 429.294 4.357 10 10 IICE CCOc1cc(N2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)ccc1[N+](=O)[O-] 1524936008 HGCLVNVMZQGLPL-UHFFFAOYSA-N 448.523 4.363 10 10 IICE CC/C(=C\C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1cccc(Cl)c1 1524982063 IIIXQQHLRBPTGW-FMQUCBEESA-N 442.003 4.471 10 10 IICE CCN(CC)[C@H](C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1cccc(C(F)(F)F)c1 1526034862 BCWACMJJXOWBCB-QFIPXVFZSA-N 449.517 4.446 10 10 IICE Cc1ncc(/C=C\C(=O)N2C[C@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)s1 1538218510 NOJNIQHZFIGRLT-LYASGUKUSA-N 431.533 4.334 10 10 IICE COc1ccc([C@H]2[C@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC(=O)N2C)cc1 1544246083 HJEHZQBWCANWIC-RSXGOPAZSA-N 449.595 4.300 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@H](OC(C)(C)C)C2)cc1F 1552838119 UJTPBKMHRAKSBZ-GHTZIAJQSA-N 445.583 4.167 10 10 IICE COC1CCN(c2ccc(CN3CCC(C(=O)Nc4ccc(F)cc4)CC3)cc2)CC1 1559598863 WWYYMQBRURGTHE-UHFFFAOYSA-N 425.548 4.292 10 10 IICE COC1CCN(c2ccc(CN[C@@](C)(CO)c3ccc(Br)cc3)cc2)CC1 1559828957 HQEKOTIDHREAQB-QFIPXVFZSA-N 433.390 4.062 10 10 IICE CC[C@@H](c1ccccc1OC)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559879502 KYTLGODJPYACSJ-QFIPXVFZSA-N 442.515 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 1595709982 RTRWBXBUBDATSK-GOSISDBHSA-N 435.568 4.017 10 10 IICE CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCc2c(O)ccc3ccccc23)c1 1597737445 XCJGQJOHDNQCIB-UHFFFAOYSA-N 446.956 4.158 10 10 IICE O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NCc1cccc(Cl)c1O 1606860769 SHFHLJFGNQYQAQ-UHFFFAOYSA-N 440.912 4.295 10 10 IICE COC(=O)C1=C(CSc2ncc(C(C)(C)C)s2)N(C)C(=O)N[C@@H]1c1ccccc1 1613617234 HNCNNJYNANWXKA-QGZVFWFLSA-N 431.583 4.356 10 10 IICE COc1ccc(N2CCCN([C@H](C)C(=O)Nc3ccc(Br)c(C)c3)CC2)cc1 1615219910 UTAOJZBWBCTRHR-QGZVFWFLSA-N 446.389 4.305 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(o2)CCCC3)NC(=O)OC(C)(C)C)cc1 1618252172 AVNOSMNJMYBTCD-IBGZPJMESA-N 427.545 4.220 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)C2CC2)cc1 1624261934 FFHLFBCWGOWIPH-HSZRJFAPSA-N 427.539 4.401 10 10 IICE CN(c1ccc(CNC(=O)c2cc(I)c[nH]2)cc1)C1CCCCC1 1625905200 LXZBLFHSLAWSKB-UHFFFAOYSA-N 437.325 4.318 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@H](C(=O)N(C)c4ccccc4)C3)c2C)cc1 1635406197 PSLVTVLXEFMFEA-FQEVSTJZSA-N 431.536 4.228 10 10 IICE CCOC(=O)C(CC)(CC)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1637772460 DWTBSPHPBIXDQU-UHFFFAOYSA-N 436.350 4.103 10 10 IICE O=C(CCC(=O)c1ccc2ccccc2c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1638688370 NVQMIYSKEALACI-UHFFFAOYSA-N 438.474 4.234 10 10 IICE COc1ccc([C@@H](NC(C)C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 1648435833 WHVPCLLNSYJRHS-LOSJGSFVSA-N 439.600 4.008 10 10 IICE CCCCOc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(O)c1 1650720461 VHLNZTBVVGUTLY-IAGOWNOFSA-N 430.520 4.254 10 10 IICE CCCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1c(C)oc(C)c1C 1655663517 BGNMCUIPIURWNS-UHFFFAOYSA-N 445.579 4.099 10 10 IICE COC1CCN(c2ccc(CN[C@@](C)(CO)Cc3ccc(Br)cc3)cc2)CC1 1660390104 XLCJOIYJCUKOKR-HSZRJFAPSA-N 447.417 4.148 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCCc2ccc(OC(C)(C)C)cc2)N(C)C)cc1 1670818309 XISVBKKFOPDTQT-QHCPKHFHSA-N 426.605 4.075 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 1675219916 BTTZTLSVUAIAEQ-WBVHZDCISA-N 443.700 4.277 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 1682097846 XANSEWMLISOKAR-NTUVXCKYSA-N 427.564 4.429 10 10 IICE Cc1cccnc1[C@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)C(C)(C)C 1683195715 LPGMMKMDOCBNAG-NRFANRHFSA-N 432.515 4.091 10 10 IICE CC[C@@](C)(O)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1708330780 YRUXQDPGJNNNFR-RUZDIDTESA-N 425.621 4.408 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(O)(C(F)(F)F)CC2)n1CCCSc1nccs1 1708468657 IMOAGGJKISEYRG-CYBMUJFWSA-N 449.568 4.324 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H]2c2nncn2C)n1Cc1ccc(N(CC)CC)cc1 1708504983 RISGNNNMPCAHEK-GHTZIAJQSA-N 436.608 4.156 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1712725473 AEGQZYQFXOVILQ-GOSISDBHSA-N 425.602 4.331 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C[C@@H](C)O1 1745001418 JHMDYKIQIZSUII-WOIUINJBSA-N 437.588 4.391 10 10 IICE C[C@@H]1C[C@H]1n1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1752054201 XPNIQPYALJPLMY-BPQIPLTHSA-N 427.549 4.273 10 10 IICE COCCN(c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@@H](C)C1 1771090784 KCCWFKUXQOCGJI-YLJYHZDGSA-N 429.584 4.440 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C2CCC2)c(I)c1CO 2079952481 JBYGVRXEAATEFF-SFHVURJKSA-N 440.325 4.254 10 10 IICE CCCOc1cc(N(CC)CC)ccc1C=C1C(=O)NN(c2cccc(Cl)c2)C1=O 2295157471 AWQSTPNSCBBQMY-UHFFFAOYSA-N 427.932 4.436 10 10 IICE O=C1C(=Cc2cc(Br)ccc2O)SC(=S)N1c1cccc([N+](=O)[O-])c1 2313610199 UWISJTBTBXIMJQ-UHFFFAOYSA-N 437.296 4.469 10 10 IICE COc1ccc(C=C2SC(=S)N([C@H](C)C(=O)Nc3cccc(C)c3)C2=O)cc1OC 2314836899 LOPYDHBOTABOJA-CQSZACIVSA-N 442.562 4.241 10 10 IICE CC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)SC1=S 2323813819 GCRWUUDAJBPTQK-INIZCTEOSA-N 443.546 4.339 10 10 IICE Cc1ccc(CNC[C@@H]2CC(F)(F)CN2C(=O)OC(C)(C)C)c(O)c1Br 2352694137 RLONHUDMPBOMFJ-ZDUSSCGKSA-N 435.309 4.197 10 10 IICE CCN1C(=O)/C(=C/c2ccc(N(CC)CC)o2)C(=O)N(c2ccc(Cl)cc2)C1=S 33333131 QVTDDTQJDFABOJ-LGMDPLHJSA-N 431.945 4.343 10 10 IICE CCN1C(=O)/C(=C/c2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCO3)SC1=S 39850190 IWRURXNVFSFKJK-ODLFYWEKSA-N 435.530 4.489 10 10 IICE COC(=O)CCCN1C(=O)/C(=C\c2ccc(OCCC(C)C)c(OC)c2)SC1=S 40938549 ISAJDWZMBCXAMH-QGOAFFKASA-N 437.583 4.275 10 10 IICE Cc1ccc(C(=O)N2CCN(CC(=O)c3cc(C)n(-c4ccccc4)c3C)CC2)cc1C 62694127 NSSPKWPWSGUESM-UHFFFAOYSA-N 429.564 4.352 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1CC(F)(F)F)N1CCO[C@H]2CCCC[C@@H]21 109624521 VMVGOWWTEZJVPQ-WMZOPIPTSA-N 439.503 4.375 10 10 IICE Nc1ccc(CCC(=O)Nc2ccc(Br)c(I)c2)cc1 383566258 YGZPNAXOJIZONU-UHFFFAOYSA-N 445.098 4.207 10 10 IICE COc1ccc(N2CCC(NC(=O)Nc3ccc(OCc4cccnc4)cc3)CC2)cc1 728692659 QVKPAMPBTJXFCV-UHFFFAOYSA-N 432.524 4.460 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3CCC(c4nnc5n4CCC5)CC3)c2C)cc1 728915824 YYLNLMFGARZWQF-UHFFFAOYSA-N 447.583 4.093 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3c(C)cc(C)cc3C)n2)cc1 731059025 NPUZKZQLRIAYCD-UHFFFAOYSA-N 443.594 4.215 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@H]3CCc4ccccc4C3)C2=O)cc2c1OCCO2 743284983 RLKHCBZGNQRYCI-RONKMWSCSA-N 439.558 4.225 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](C)c3ccc(-n4ccnc4C)cc3)CC2)cc1 754926016 MGJWAQRAEZEQDD-LJQANCHMSA-N 433.556 4.172 10 10 IICE Cc1ccnc(C2CCN(CC(=O)c3cc(C)n(-c4ccc5c(c4)OCCO5)c3C)CC2)n1 755219644 BHTCAVMTJYLKAI-UHFFFAOYSA-N 446.551 4.026 10 10 IICE C[C@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(N2CCOCC2)cc1 777811683 VPASZSRTUJIJDF-UGKGYDQZSA-N 436.600 4.207 10 10 IICE Cc1ccc(C2CCN(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)CC2)cn1 782999199 KZSLAOVBRZOVKK-RTBURBONSA-N 440.563 4.232 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(OC)c(OC)cc3Cl)n2)cc1 790477141 AWDYHVYURROGNV-UHFFFAOYSA-N 440.930 4.290 10 10 IICE COc1cc(C)c(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1OC 916669535 CMXRUSGXTWAUAO-HOTGVXAUSA-N 431.508 4.087 10 10 IICE COc1cc(C)ccc1OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1124469745 ONEPVAULOWEEQY-LDADJPATSA-N 431.510 4.340 10 10 IICE C[C@@H]1CN(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c2ccccc2NC1=O 1126351372 LYFYXWPZIICYFB-MRXNPFEDSA-N 435.524 4.215 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc3ccccc3cc2Br)cc1 1130548021 SMSIMGBCQYRTEF-UHFFFAOYSA-N 428.330 4.214 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCOc2ncccc2C(F)(F)F)c1 1137637532 PUOTVMWHEVCMRY-UHFFFAOYSA-N 431.414 4.129 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NC(C)(C)C)c(C)n1-c1ccc(Br)cc1 1178489908 IQFKHQOQQADXAC-LJQANCHMSA-N 446.389 4.376 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NC[C@@H]3CCCC[C@H]3c3ccccc3)cc2)CC1 1251102679 XPTPTQIBYKZAKU-ZCYQVOJMSA-N 448.611 4.162 10 10 IICE Cc1ccc(C)c([C@H]2CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1251103235 CEHAKGGRQWJTTP-XMMPIXPASA-N 434.584 4.052 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)CCCC1 1264810317 QCOZHRVTUMNMRR-INIZCTEOSA-N 435.524 4.141 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)N(C)C)cc1 1289599440 BOEQZJUWHIWVIF-HSZRJFAPSA-N 448.523 4.486 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCc3sccc3C2)cc1 1290969678 SKXSSGBBFYAQIS-HXUWFJFHSA-N 433.537 4.440 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1302677265 SEXWEEZDPBQHFP-HNNXBMFYSA-N 437.500 4.193 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)o1 1304343898 TVDUYVOIKNSCSF-UHFFFAOYSA-N 430.556 4.224 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1306442463 OJKGKKHFNHCLRH-GBXCKJPGSA-N 448.615 4.162 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)sc(C)c1-c1ccccc1 1307996542 JYBPRDZIGLUMBT-BQLSAVKESA-N 430.570 4.240 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(CC(=O)N4CCCC4)CC3)c2C)c1 1313130604 AQOSDPJIZWPCKD-UHFFFAOYSA-N 436.600 4.337 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)CCC(F)(F)F)cc1 1313678609 DSPYZTBABKQMFK-GOSISDBHSA-N 439.526 4.455 10 10 IICE COC(=O)CCCOc1ccc(CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1353670412 FPCSWNYSXFAYBN-UHFFFAOYSA-N 434.536 4.285 10 10 IICE COc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(OCCC(C)C)c1 1434912337 VTAHULJZNMMLAY-LJQANCHMSA-N 426.557 4.448 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2cccc(F)c21 1435499743 GMEWVDPYOLLZJV-ATVHPVEESA-N 430.501 4.145 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc4ccc(OC)cc4c3C)CC2)c(OC)c1 1438186548 LCDAXGPLJMQUMI-UHFFFAOYSA-N 426.538 4.198 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3cccc(OCCN4CCOCC4)c3)c2C)c1 1442325557 FXMKEWNTMMEMGN-UHFFFAOYSA-N 447.579 4.044 10 10 IICE Cc1cc(C(=O)N[C@]2(c3ccccc3)C[C@H](O)C2)c(C)n1-c1ccc(Br)cn1 1455507669 XPQBZGDIQYRHKC-CXGRPWHSSA-N 440.341 4.032 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)c(C)n1-c1ccccc1 1461966518 JHMLKNZTCQLRMP-UKILVPOCSA-N 433.527 4.112 10 10 IICE COC(=O)c1ccc(CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1OC 1466084875 QLUFYNIVOAMEJG-UHFFFAOYSA-N 426.900 4.473 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C1=NO[C@]2(CCCN(C(=O)OC(C)(C)C)C2)C1 1467497587 MAXMRNMHHGGUSD-XMMPIXPASA-N 445.560 4.067 10 10 IICE O=C(N[C@H]1CCCc2c(F)cccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1468553608 HMRKFRRLVHCCPB-SFHVURJKSA-N 446.525 4.201 10 10 IICE CCC[C@@H]1CN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1500232221 JHPTVXDKSKBUKR-SIKLNZKXSA-N 443.661 4.398 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](CC(C)C)C1 1503807924 GUFMVGYKRQGYJL-OAQYLSRUSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)CSc2nccn2-c2cccc(OC)c2)cc1 1540459514 KREFTLXEGXQQQH-UHFFFAOYSA-N 438.597 4.478 10 10 IICE Cc1nc(C2(NC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)CCCC2)no1 1545049925 NOQNCYXVWKPSQI-UHFFFAOYSA-N 444.333 4.142 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)CC1 1558641471 WGQFODLTUJWEDT-XSBJJCPUSA-N 444.572 4.387 10 10 IICE CCOC(=O)c1c(C)oc2ncn(CC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)c(=O)c12 1559346121 YKIZCDBZFQQLLY-UHFFFAOYSA-N 447.491 4.073 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(CC3CCC3)c3ccccc3)cc2F)C[C@@H](C)O1 1559619787 ZOYGHQJFUBOVAY-WOJBJXKFSA-N 439.575 4.362 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CC[C@H](c2cccc(Cl)c2)C1 1564908791 XGEQFFILFNPBRO-FPOVZHCZSA-N 427.976 4.437 10 10 IICE CCc1ccc(F)cc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1565881901 KHUXRCRMNSVIOD-NRFANRHFSA-N 429.536 4.450 10 10 IICE Cc1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1-n1c(C)cc(C=O)c1C 1566131701 NJYLUTGDYMDZGI-UHFFFAOYSA-N 445.563 4.424 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCCN(C(C)(C)C)CC1 1611963456 QVZSRPVDQKLPOB-UHFFFAOYSA-N 447.631 4.073 10 10 IICE CC[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1614143766 LBECCMCHTKDBPZ-HXUWFJFHSA-N 439.648 4.459 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)c2)n1 1626723040 QQPIRJZZMUHGMX-SFHVURJKSA-N 433.556 4.278 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](CN1CCCC1)c1ccccc1 1629055400 IWNCBAIMUPOIOR-OFNKIYASSA-N 443.538 4.253 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c(C)n1-c1cccc(Br)c1 1634690514 ZPHOLRTZUPCQRB-JIGPKXGUSA-N 447.373 4.265 10 10 IICE C[C@H]1C[C@@H](CCNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC(C)(C)C1 1634872278 ZPYXFKYGZVQOSZ-AZUAARDMSA-N 428.621 4.040 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccc(Br)c2O)cc1 1635840525 USDMVEZWLOQXIV-UHFFFAOYSA-N 441.325 4.234 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCC1(Cc2cccc(Cl)c2)CC1 1636019425 RWCPHPKTZDXVHS-UHFFFAOYSA-N 442.003 4.371 10 10 IICE Cc1cccc(C)c1[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638483669 AHOYXDIICGKMKF-QHCPKHFHSA-N 434.584 4.052 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(CCc2ccccc2)ccc1O 1642155413 RMHKDHFPRJEXAB-UHFFFAOYSA-N 430.548 4.069 10 10 IICE C[C@@H](Sc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1656544184 LFTPGIFPKBMUTO-CYBMUJFWSA-N 432.457 4.490 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)C2)cc1 1682188664 XXKYGJAYFIGPHK-AZUAARDMSA-N 438.528 4.019 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCN(Cc1ccccc1)c1ccccn1 1683424327 AILBFYUGPODFLC-JOCHJYFZSA-N 445.611 4.393 10 10 IICE O=C(NCc1cc(Cl)ccc1O)NC[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1 1683845732 LCCUHEKXNWIKHS-OAQYLSRUSA-N 435.911 4.242 10 10 IICE CO[C@@](C)(CNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)COCc1ccccc1 1687011495 YQAZOKFKMGKZSJ-SANMLTNESA-N 439.600 4.440 10 10 IICE CC(C)c1nnc(N(C)Cc2cscn2)n1Cc1ccc(N2CCSCC2)cc1 1691672616 JENJSAIONKWDDW-UHFFFAOYSA-N 428.631 4.096 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@H](C)[C@H]3CCCC[C@H]32)n1CCCSc1nccs1 1692511977 SSZXXILNVYRYFC-GVDBMIGSSA-N 448.662 4.070 10 10 IICE C[C@@H]1SCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)[C@@H]1C 1693877648 SHWXNSZQUQQAIG-CABCVRRESA-N 432.644 4.309 10 10 IICE C=CCO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)COC)C1 1705916861 OUXGRKNRDKVVGO-XXBNENTESA-N 449.599 4.416 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC[C@H](OCC(F)(F)F)C1 1707304222 OWHDRZZMZQOIIK-IBGZPJMESA-N 439.526 4.372 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)CCC(F)(F)F)cc1 1710025629 HLMPRHCDQHUXDJ-UHFFFAOYSA-N 433.482 4.018 10 10 IICE c1ccc(CCc2nnc(N3CCSCC3)n2CCCSc2nccs2)cc1 1722478741 WIUCGSDYPDUJKQ-UHFFFAOYSA-N 431.656 4.255 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1 1729229657 CWEFWIWMAGXCMX-PVQQOCSKSA-N 439.629 4.213 10 10 IICE CO[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC1(C)C 1730395033 SWPGVDRLIMROKK-HXUWFJFHSA-N 443.661 4.038 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Br)s2)n1CC1(C)COC1 1747750392 RBPMISZDCKXVSP-UHFFFAOYSA-N 449.374 4.148 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1764295224 ZYXQSJJJHMQPPQ-LJQANCHMSA-N 437.588 4.129 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccc(C)o4)n3C[C@@H](C)SC)CC2)cc1F 1768704385 CBRRSVLVALHJPE-MRXNPFEDSA-N 445.564 4.072 10 10 IICE COc1cc(C=C2SC(N3C[C@@H](C)O[C@H](C)C3)=NC2=O)ccc1OCc1ccccc1 2053496911 PERNXZAKWQXXKK-IAGOWNOFSA-N 438.549 4.354 10 10 IICE CC[C@H](NC[C@@]12C[C@@H]1CN(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2092532393 SLQYMFKAPQZWLO-JOTOCRJQSA-N 425.367 4.452 10 10 IICE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCc1cc(Br)cc(F)c1O 2107376162 CTCAWJLJENADGW-MLGOLLRUSA-N 431.346 4.419 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@](NCc3cccc(Br)c3O)(C2)C1 2138713013 BFBIFZRXCDMHCJ-VBKZILBWSA-N 425.367 4.424 10 10 IICE CCN[C@H]1C(=O)Nc2cc(N(CCCOC)Cc3ccccc3)c(Br)cc21 2152205502 JRKOSILJFWSOQC-HXUWFJFHSA-N 432.362 4.095 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)ccc1OCc1ccccc1 2294741831 GMSQHSMYDPMWBB-UHFFFAOYSA-N 442.471 4.249 10 10 IICE Cn1cc(C=C2SC(=S)N(NC(=O)c3cccc(Cl)c3)C2=O)c2ccccc21 2297468891 DFPQXESXYUVJLH-UHFFFAOYSA-N 427.938 4.378 10 10 IICE COc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(SC)SC4=NC3=O)c2C)cc1 2297470603 SIXYGUMXIVNVHF-UHFFFAOYSA-N 425.539 4.042 10 10 IICE [N-]=[N+]=NCCCC[S@@](=O)c1cc(I)ccc1Br 2300795666 ZMGGPWXTKIFXQM-QGZVFWFLSA-N 428.093 4.252 10 10 IICE CCOc1cc(/C=C2/SC(Nc3cccc(C)c3)=NC2=O)ccc1OCCC(=O)O 16920018 OENGXIMOLLFDGD-CPNJWEJPSA-N 426.494 4.330 10 10 IICE CCCCc1ccc(N2C(=O)S[C@H](CC(=O)Nc3ccc([N+](=O)[O-])cc3O)C2=O)cc1 16926410 UBKADRRRXIPNFN-GOSISDBHSA-N 443.481 4.240 10 10 IICE Cc1noc(C)c1CSCC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 22613107 HVJGBVLEIGPTAO-UHFFFAOYSA-N 430.501 4.497 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)c3cccc(F)c3)CC2)c(C)n1-c1ccc(F)cc1 62694538 CWMWESRQRMRKHT-UHFFFAOYSA-N 437.490 4.013 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2cn(Cc3ccccc3)c3ccccc23)SC1=S 206837788 XMTVJLGPSRESIY-DEDYPNTBSA-N 436.558 4.454 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(Cn4ccccc4=O)cc3)ccc21 483325589 UCQPVVDVMKTWKK-UHFFFAOYSA-N 443.547 4.045 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccccc3F)[C@H]2c2ccc(O)c(O)c2)c1 526204903 YVFFGKXYPKXHBG-QFIPXVFZSA-N 437.423 4.311 10 10 IICE CC(C)N(C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(C)C 731988652 GFTUCZWFCVSCKO-DHDCSXOGSA-N 441.416 4.296 10 10 IICE COc1ccc(-c2nc3c(s2)[C@@H](NC(=O)NCc2cccc(OC)c2O)CCC3)cc1 745811951 IJQDSAGXWVLUMK-SFHVURJKSA-N 439.537 4.410 10 10 IICE CC(=O)N1CC[C@H](NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c2ccccc21 757618497 ULSUYMBIYUWEDI-DEOSSOPVSA-N 430.552 4.434 10 10 IICE Cc1cc(N2CCC[C@@H](N[C@H](C)c3cc(Br)cc(Cl)c3O)C2)n(C)n1 774469033 QOFGXFPZWORFMI-TZMCWYRMSA-N 427.774 4.170 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCc2cccnc21 776118272 OPCFSQAMPHDYKG-JOCHJYFZSA-N 426.536 4.057 10 10 IICE COc1ccc(O)c(CNC(=O)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1 777741657 TYELLYNFSDBKQE-PZJWPPBQSA-N 435.927 4.217 10 10 IICE CCN1CC[C@H](NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1c1cc(F)c(F)c(F)c1 782391247 JYBHWYWWQCAPDL-NZQKXSOJSA-N 437.481 4.005 10 10 IICE C[C@H]1CN(Cc2cc(Br)cc(Br)c2O)C[C@]2(CCO[C@H](C)C2)O1 797604478 GTPQTSYOTJSPLB-BWACUDIHSA-N 449.183 4.076 10 10 IICE CS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1 873993115 DOUDYEUITIEHEJ-UHFFFAOYSA-N 444.559 4.168 10 10 IICE COc1ccc(N2CCN(C(=O)CCCOc3cccc4ccccc34)CC2)c(OC)c1 1131803921 DHZJPPDYKYKSGG-UHFFFAOYSA-N 434.536 4.365 10 10 IICE Cc1cc(CNC(=O)[C@H](C(C)C)S(=O)(=O)C2CCCCC2)c(C)n1-c1ccccc1 1132048262 OLHHLUCXEGVFIW-QHCPKHFHSA-N 430.614 4.482 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2 1136428175 OASSLNBPCYNKCF-JOCHJYFZSA-N 429.973 4.384 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@H](CCNC(=O)OC(C)(C)C)C3)c2C)cc1 1157845377 VPFJBZOFJMHFJL-IBGZPJMESA-N 441.572 4.480 10 10 IICE CC1CCN(c2ccc(Cn3c(N4C[C@H](C)O[C@H](C)C4)nnc3C(C)(C)C)cc2)CC1 1305065198 GQUYUMVFHVQGSY-BGYRXZFFSA-N 425.621 4.474 10 10 IICE CCc1ccc(-c2ccc(C(=O)NCCCN3CCN(c4ccc(OC)cc4)CC3)o2)cc1 1350975803 FYACYFXKTCLNGC-UHFFFAOYSA-N 447.579 4.460 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(-c4cccc(F)c4)s3)cc2)C1 1355065542 PLFHKDNCRSAOOU-SFHVURJKSA-N 437.540 4.186 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C/C=C/c2ccccc2)CC1 1443761832 IKNRIKOFJHAZKC-DHZHZOJOSA-N 427.548 4.378 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H]1CCC[C@H](C(F)(F)F)O1 1448683721 HXAZZTRQEGLYAZ-FXAWDEMLSA-N 444.494 4.265 10 10 IICE COc1ccc(CCC(=O)NCc2cccc(Br)c2O)c(Br)c1 1448961297 NSSUBVLBFAXQJP-UHFFFAOYSA-N 443.135 4.175 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccsc3-n3c(C)ccc3C)cc2F)CC1 1464949506 XMTTXQANQVGJNH-UHFFFAOYSA-N 440.588 4.367 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 1466398644 JMXAFVCBEUAHDL-QGZVFWFLSA-N 443.463 4.285 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)OCCN3C)c(C)n1-c1ccc(Br)cn1 1467377098 MEPHMSAYPNFFOX-UHFFFAOYSA-N 441.329 4.333 10 10 IICE CCOC(=O)[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C1CCCCCC1 1469647543 SEDMYASTGSSMGD-RUZDIDTESA-N 438.568 4.467 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](C)[C@H]1CNC(=O)OC(C)(C)C 1470556403 UFFXMBIDWYMNNS-ZWCUEREDSA-N 446.636 4.327 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3c(F)cccc3F)CC2)N(C)C)cc1 1471547896 PDLYJAZFRJOOIN-DEOSSOPVSA-N 444.570 4.298 10 10 IICE CC(C)Cc1nnc(N2CCS[C@H](C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1509234181 PDPSXIJVULNWRQ-RTBURBONSA-N 445.702 4.408 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)[C@H]1CCSC1 1510671796 GUWNVGJSPTYBQB-IBGZPJMESA-N 443.020 4.358 10 10 IICE CC/C=C/Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@]1(OCC)CCOC1 1514217012 FWQXCNSZMFTUTR-NPJCXYKHSA-N 439.604 4.133 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(F)c3cccnc23)c1 1537586916 CEXPILVEANYVEM-UHFFFAOYSA-N 428.467 4.118 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(C(=O)OC(C)(C)C)CCCCCC1 1539302560 SMXIXYNCBIZQGL-UHFFFAOYSA-N 430.589 4.164 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 1539468792 QKDWBPHUTYGSMN-UHFFFAOYSA-N 443.547 4.468 10 10 IICE Cc1cc(C(=O)NCCc2nc3ccccc3[nH]2)c(C)n1-c1ccc(Br)cn1 1540455411 DJYFBRSSNQNUDZ-UHFFFAOYSA-N 438.329 4.100 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)C[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543541973 BTWVALCSWWWIJP-BGYRXZFFSA-N 425.621 4.141 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(Cc3ccccc3)CC2)NC(=O)OC(C)(C)C)cc1 1544267577 GFCHRAQIDDRPNM-QFIPXVFZSA-N 437.584 4.458 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3Cl)CC2)cc1 1544314893 IISATSHLKFGSKF-SFTDATJTSA-N 448.394 4.044 10 10 IICE C[C@H]1[C@H](C)CCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1544412785 VZSUWJCWPGACAW-UXHICEINSA-N 439.648 4.358 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)cnc1F 1545508901 RNYBBCLDFZISMC-UHFFFAOYSA-N 432.087 4.114 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2nccs2)cc1 1547447567 CMCBHBYAWFCZCE-UHFFFAOYSA-N 447.612 4.251 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](OC)C1 1554592519 OCBUSOWZOKDVHX-BOCKYXSRSA-N 437.588 4.249 10 10 IICE COC[C@@H](F)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1555275325 BJOLNPYSPKSNJH-FQEVSTJZSA-N 443.592 4.152 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1(C)C 1570018213 ZSHQOZMQSYTNIZ-RDJZCZTQSA-N 435.528 4.274 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C2)cc1 1585664806 GNALMSYXRBIWGN-OAHLLOKOSA-N 445.350 4.444 10 10 IICE Cc1ccc(Oc2ccccc2CC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1598276178 AWAOLAGYRXBYSZ-UHFFFAOYSA-N 429.564 4.398 10 10 IICE O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc2cc(O)c(O)cc2s1 1618498023 VTDNEEZBTWSTCY-UHFFFAOYSA-N 446.956 4.239 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](F)C1 1619611695 MSVCVZGJPWJWHV-YWMUFLPLSA-N 429.515 4.131 10 10 IICE CCCCC[C@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1627934046 SMYXQXOJHCWEJI-VCLNNIJQSA-N 449.595 4.338 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1nc(Br)sc1Cl 1630351703 ZDMVLDOPKGIVNE-UHFFFAOYSA-N 432.796 4.042 10 10 IICE COC(=O)CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc2cc(O)c(O)cc2s1 1634578056 LDDGHLTZZZGSCP-UHFFFAOYSA-N 439.411 4.147 10 10 IICE COC(=O)Cn1nc(C)c(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c1C 1637760755 JCSPXIRBCLKQEN-UHFFFAOYSA-N 436.556 4.134 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)C2CCN(CCC(F)(F)F)CC2)c1 1639023666 MSJOMMJBNJGMGU-UHFFFAOYSA-N 435.490 4.395 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)c1 1641014723 CHPPZHMOQJFULA-UHFFFAOYSA-N 438.503 4.084 10 10 IICE COC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCN(c2ccc(OC)c(F)c2)CC1 1653749687 UQNZFBLKKHRZEW-LJQANCHMSA-N 427.303 4.177 10 10 IICE CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675579857 BPEBJXKHTFLERJ-UHFFFAOYSA-N 434.506 4.189 10 10 IICE C[C@H](c1nc2ccccc2s1)N(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684607442 PXBGSODQYGOISO-UZLBHIALSA-N 425.602 4.368 10 10 IICE CCOC[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1696378283 MMLRYTHXYVGHEL-HXUWFJFHSA-N 443.661 4.040 10 10 IICE CCOCc1nnc(N2CCS[C@H](C(C)C)C2)n1CCCSc1nccs1 1710753987 CWRSJTSQLQPQJI-HNNXBMFYSA-N 427.665 4.031 10 10 IICE CCc1nnc(N2CCO[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1727617551 FKMXAJJFUYQYCG-JOCHJYFZSA-N 425.621 4.376 10 10 IICE COCCO[C@H](C)c1nnc(N(C)C2CCCCC2)n1Cc1ccc2c(c1)CCCN2C 1730815908 NIVRQCMXXVFYEY-LJQANCHMSA-N 441.620 4.202 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)[C@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)c(F)c1 1761048797 QVEPSZHBHTUYML-GDBMZVCRSA-N 427.490 4.365 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccoc1 1764678547 MXSBBORXPSYBFQ-UHFFFAOYSA-N 446.555 4.060 10 10 IICE COc1ccccc1N1CCN(C(=O)[C@@H]2CCc3c(c4cc(Cl)ccc4n3C)C2)CC1 1858153480 IOOUPDMWERDRKP-QGZVFWFLSA-N 437.971 4.294 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1nccn1C 1866014597 GDDAZZQJOLLFIY-VBKZILBWSA-N 447.366 4.466 10 10 IICE CCOC(=O)c1ccc(CNC(=O)c2ccc3[nH]c(-c4ccc(N(C)C)cc4)nc3c2)cc1 1872743124 WSFKKUNMZSLRBJ-UHFFFAOYSA-N 442.519 4.403 10 10 IICE CC(=O)NC(=Cc1ccccc1)C(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C 2041454271 LBPXZPPRJQYEPF-UHFFFAOYSA-N 448.494 4.445 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)C1NCc1cc(Br)cc(F)c1O 2103912743 WRMXMUQLARPANN-VXGBXAGGSA-N 431.346 4.275 10 10 IICE CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc(Cl)c1OCC 2296968808 VTJJNKUGWMTSCH-UHFFFAOYSA-N 428.872 4.112 10 10 IICE CCOc1cc(C=C2C(=O)N(c3cccc(C(=O)O)c3)N=C2C)cc(Br)c1O 2297109856 JEDRPHWYZUKTTP-UHFFFAOYSA-N 445.269 4.058 10 10 IICE CC1=NN(c2ccc(C)cc2C)C(=O)C1=CNNc1ccc(I)cc1 2297512226 OYBLDXFWWSDEIG-UHFFFAOYSA-N 446.292 4.131 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2cccc(O[C@@H](C)C(=O)O)c2)SC1=S 2314931588 PDMRQJQRYXGRJQ-ZDUSSCGKSA-N 429.519 4.343 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]3CCC[C@H]23)c(O)c1Br 2352679348 IZKRGAUKCKENQN-BZUAXINKSA-N 425.367 4.341 10 10 IICE Cc1ccsc1[C@@H]1Nc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2[C@H]2C=CC[C@H]21 14456146 TVZJABPZMJNSFD-DZKDUJFISA-N 430.595 4.340 10 10 IICE COc1ccc(/C=C2\SC(N3CCN(c4ccc(C)c(Cl)c4)CC3)=NC2=O)cc1 33341094 RZSAILVNZYEOAA-MOSHPQCFSA-N 427.957 4.450 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)Nc3ccccc3F)c3ccco3)CC2)cc1 38637897 DHJKJQZSOZRTQW-QFIPXVFZSA-N 438.503 4.112 10 10 IICE CCOc1ccccc1NC(=O)COc1ccc(Cl)cc1/C=C1\SC(=S)NC1=O 39794061 XPFCNGONLDFVBX-YVLHZVERSA-N 448.953 4.245 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1ccccc1C 40867742 LXUFSNCISQCTNZ-UNOMPAQXSA-N 443.546 4.259 10 10 IICE CN(C)c1ccc(CN2C[C@@H](O)C[C@@H]2c2nc(-c3ccc(OC(F)(F)F)cc3)no2)cc1 209373828 SPEZHHAOXASHMC-PKOBYXMFSA-N 448.445 4.009 10 10 IICE Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC(CNC(=O)OC(C)(C)C)CNC(=O)OC(C)(C)C 389237353 WRGNDMBIFXSAOK-NVXWUHKLSA-N 449.592 4.257 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(Br)s2)cc1 733952921 XZMVRKOOCFKSHL-QGZVFWFLSA-N 437.403 4.327 10 10 IICE Cc1cnn(-c2ccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)c1 742807010 WKKIGTUSRUXIED-GOSISDBHSA-N 426.467 4.181 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)cs2)cc1Cl 749738148 QXEIJTWTUVJHSR-UHFFFAOYSA-N 438.914 4.060 10 10 IICE Fc1ccc([C@@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C2CC2)cc1 774389563 KZQJTWJSWYXTPQ-DEOSSOPVSA-N 435.522 4.322 10 10 IICE Cc1csc(C2(N[C@H](C)C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CCC2)n1 778129502 YLZMNOMJPNGYDT-OAHLLOKOSA-N 445.544 4.223 10 10 IICE C/C(=C/C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc([N+](=O)[O-])cc1 783965687 JLITXVFCXYOVOB-PFONDFGASA-N 431.439 4.385 10 10 IICE Cc1ccc(NCc2ccc(OCc3ccccc3)cc2O)cc1C(=O)N1CCOCC1 787302760 FEJSEEFNMCYANR-UHFFFAOYSA-N 432.520 4.364 10 10 IICE Cc1n[nH]cc1-c1nnc(NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)s1 800567181 XCEFIXGLFRZTFJ-GFCCVEGCSA-N 445.980 4.448 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCc2cc(Br)ccc21 919918081 XXXLIEHDEGTXQV-OAQYLSRUSA-N 444.373 4.115 10 10 IICE COc1ccc(F)cc1CN1CCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1135652578 GYWILQZULLRKKO-UHFFFAOYSA-N 435.543 4.129 10 10 IICE COc1cc(OC)cc(N2CC[C@H](CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)c1 1137523027 NETZCXARRBTEGM-OAQYLSRUSA-N 447.579 4.297 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c(C)n1-c1ccc(F)cc1 1137894500 UZHYZELSKHSZMW-MRXNPFEDSA-N 427.426 4.047 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN([C@@H](C)c3ccsc3)CC2)cc1 1138536541 XVFKNUZFZKVFSD-IBGZPJMESA-N 435.593 4.416 10 10 IICE Cc1cc(C(=O)N2CCc3cc(Cl)nnc3C2)c(C)n1-c1ccc(Br)cc1 1143220984 QKYYZCATBCZUBO-UHFFFAOYSA-N 445.748 4.499 10 10 IICE C[C@H](NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]([C@@H]2CCCO2)C1)c1ccc(N(C)C)cc1 1154667991 BBJRLHMNPOCSGJ-GWWHBBDRSA-N 445.604 4.125 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccc(Cl)s3)C2=O)c(C)n1-c1ccccc1 1188736340 LOTRCOIIYLPWNU-QFIPXVFZSA-N 441.940 4.459 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC(n3cc(Cl)cn3)CC2)cc1 1295409755 HYWWENGEKSTUNL-UHFFFAOYSA-N 427.984 4.172 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1295414830 LNDRVGLNQYJSCN-SQJMNOBHSA-N 441.620 4.072 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)[C@H](O)c3cc(Cl)cc(Cl)c3)C2)cc1 1300632691 BRVOUWRVBRCYER-FXAWDEMLSA-N 437.367 4.457 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3ccc(OCC(F)(F)F)cc3)C2)cc1 1312994919 POXHUWHCMRULGQ-KRWDZBQOSA-N 437.462 4.057 10 10 IICE Cc1ccc(Br)cc1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1357836177 PHJAHFGXZFHOQY-HZPDHXFCSA-N 449.364 4.369 10 10 IICE CC(C)[C@@H]1CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CCS1 1444994824 WHQXJVGLWGIKMY-YTBHAWNYSA-N 438.615 4.017 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H](O)COc3ccc(F)c(F)c3)c2C)c1 1445663092 XOUTVIJQNFAXMI-IBGZPJMESA-N 428.479 4.159 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)on2)c1 1445854352 SPAAEWPSAIHEHV-UHFFFAOYSA-N 445.878 4.114 10 10 IICE Cc1cccc(-n2c(C)cc(CNc3ccc(S(=O)(=O)N(C)C)cc3[N+](=O)[O-])c2C)c1 1458531717 RYPMJFXSRHWYMX-UHFFFAOYSA-N 442.541 4.173 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@]3(C=Cc4ccccc4O3)C2)N(C)C)cc1 1471546805 FUZSVNRPIFNAOH-JYFHCDHNSA-N 434.584 4.005 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc(C(=O)OC)c1 1472906400 JLCKTCPPHZAJAG-UHFFFAOYSA-N 439.439 4.068 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N([C@@H](C)c4ccccc4)C3=O)c2C)cc1 1472976568 XUQUASRMYAHCAB-SFHVURJKSA-N 443.503 4.137 10 10 IICE CCCN1CCC(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CC1 1514879797 MQYXJDHKCXSYKZ-UHFFFAOYSA-N 439.629 4.394 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@@H](C)C2 1525452646 DENUVMRZYMAFIU-HZPDHXFCSA-N 440.565 4.430 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)N(C)C)cc1 1537483860 RHOAMBHIAPULKL-NRFANRHFSA-N 426.948 4.023 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1 1537803658 VQGWGNCKCCKYRV-NRFANRHFSA-N 429.536 4.125 10 10 IICE CC[C@@](O)(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Cl)c1 1545043463 ZWRKPJKCFQUPPB-VGSWGCGISA-N 438.902 4.324 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC(C)(C)CCC(=O)OC(C)(C)C)cc1 1545130612 XBDWZRSTUXCELK-UHFFFAOYSA-N 426.557 4.466 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 1557084982 WXJUTKDCGANGHQ-UHFFFAOYSA-N 441.281 4.043 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(-n3cnc4ccccc43)cc2)N(C)C)cc1 1558723464 OTCJSERQGYESOV-VWLOTQADSA-N 427.552 4.124 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1coc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1 1597781255 OSXSSYABXJAKFL-FQEVSTJZSA-N 442.560 4.475 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1603393809 UCYVDAVUOVBBTE-LEWJYISDSA-N 439.648 4.358 10 10 IICE COc1ccc(N2CCC(Nc3ncnc(C(F)(F)F)c3Br)CC2)cc1 1611917286 HFIPMARSBQWMDT-UHFFFAOYSA-N 431.256 4.347 10 10 IICE O=C(NCCCSc1nccs1)c1cnn(-c2cccc(F)c2)c1C(F)(F)F 1616240689 FURKZEMJOLABQP-UHFFFAOYSA-N 430.452 4.399 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Cl)cc(Cl)c1O 1622634894 LYUANUXDOLZIPY-CQSZACIVSA-N 429.731 4.452 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1C 1623202232 AAGGHCLKRRHWGA-NOZRDPDXSA-N 431.580 4.015 10 10 IICE Cc1cc(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)OC(C)C)c(C)n1-c1ccc(F)cc1 1625008744 XBWXRYQTZRLARH-QHCPKHFHSA-N 438.499 4.232 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2ccc(-c3nn[nH]n3)cc2)cc1 1627161435 HMQDCJVXVJBHMM-UHFFFAOYSA-N 426.484 4.278 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@H]2c2cnn(C)c2)c(C)n1-c1ccc(Br)cn1 1634264652 NKUOAOXPSMNKOF-LJQANCHMSA-N 442.361 4.208 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)CC(=O)c1ccccc1F 1635489049 HKLCJUNZRPTJQX-QGZVFWFLSA-N 442.531 4.423 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)COc1ccc2cc(Br)ccc2c1 1636058510 FORZLHOQNRUGGV-UHFFFAOYSA-N 435.314 4.489 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@H]1CN(c2ccccc2)C(=O)O1 1644585256 YUZFTDAOLVHKHU-OAQYLSRUSA-N 437.540 4.489 10 10 IICE COc1ccc2c(c1)CN(CC(=O)NCc1ccc(N(C)C)cc1)[C@H](c1ccccc1)C2 1653765177 WSBUBOFXHALLAC-SANMLTNESA-N 429.564 4.177 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@H](c4ccccc4Cl)C3)CC2)c(OC)c1 1672995984 FFZYBXXOZRBIIB-QAQDUYKDSA-N 429.948 4.135 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H]1CCc1ccccc1 1681849558 DLLQKIYDWZZSSK-FQEVSTJZSA-N 429.511 4.108 10 10 IICE COCCN(CCC(=O)OC(C)(C)C)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1683149138 LCKCOCOIDZGIGD-UHFFFAOYSA-N 443.588 4.026 10 10 IICE COCCN(Cc1ccc(F)cc1Cl)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1683337014 SXLCICDFHZKUAQ-QGZVFWFLSA-N 449.954 4.172 10 10 IICE CC(C)CON(CC1CCCCC1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725464 MLSDRSYWAMYKCX-UHFFFAOYSA-N 439.547 4.481 10 10 IICE CC(C)[C@@H](Cn1c(CC2CC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1691596277 FONHXWOPERHQDC-LJQANCHMSA-N 443.592 4.122 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CCN(C2CCC2)C1 1693757695 UFSZSZFQYBBVBG-SFHVURJKSA-N 442.627 4.140 10 10 IICE C=CCN(CCOC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C)COC1 1705881611 VFZUGQQUOGOTSR-UHFFFAOYSA-N 435.572 4.028 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1708746831 YWRCWOKFYSRGNI-GOSISDBHSA-N 440.636 4.246 10 10 IICE CCOCc1nnc(N2CCO[C@](C)(CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1747221982 XHGODKIVAOLEHP-RUZDIDTESA-N 441.620 4.105 10 10 IICE COCC1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC1 1749513453 KEAZLHDNCZUQEE-UHFFFAOYSA-N 429.615 4.447 10 10 IICE O=C(O)CC(=Cc1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 2053511500 WOSFOHYGCRWXMT-UHFFFAOYSA-N 425.466 4.056 10 10 IICE CCOC(=O)c1ccc2c(c1)nc(C(Cl)=Cc1ccc(N(C)CCOC)nc1)n2CC 2054622910 SNHMVDIJQSFTTH-UHFFFAOYSA-N 442.947 4.447 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@@]21CNCc1c(O)cccc1Br 2089369521 ONTTUXGFTIUDRN-JLTOFOAXSA-N 425.367 4.424 10 10 IICE CCOC(=O)CCN1C(=O)C(=Cc2cc(Br)ccc2OCC)SC1=S 2314741017 SLZYWKUWJGZWOQ-UHFFFAOYSA-N 444.372 4.002 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(O)c3)C2=O)ccc1O[C@H](C)C(=O)O 2314934654 JJQRNYVMIHTKPX-GFCCVEGCSA-N 445.518 4.049 10 10 IICE Cc1ccc(CN(C)[C@]2(C(=O)O)CC[C@@H]2OCc2ccccc2)c(O)c1Br 2381129524 LHWIYRLATLGCPB-LAUBAEHRSA-N 434.330 4.098 10 10 IICE O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccnc1)N2 14547162 HEPZVZBTBUTURQ-FBLLAGFSSA-N 431.561 4.429 10 10 IICE CCOC(=O)c1ccc(NC(=O)CCN2C(=O)/C(=C/c3cccs3)SC2=S)cc1 15037981 JDTYOMYMWPPZNV-VBKFSLOCSA-N 446.575 4.155 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc(Nc4cccc(Cl)c4)n3)CC2)cc1 23236549 YDCYYYTZXPAGST-UHFFFAOYSA-N 442.972 4.440 10 10 IICE O=C1/C(=C/c2ccc3c(c2)OCO3)SC(=S)N1CNc1cccc(Br)c1 59372245 PRZAIWUHFSNCRV-APSNUPSMSA-N 449.351 4.449 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(C)c3)[C@@H]2c2ccc(O)c(O)c2)c1OC 526324649 ZSFDXCWAJAFDJN-JOCHJYFZSA-N 433.460 4.481 10 10 IICE O=C1N[C@@H](c2cc(Br)cc(Br)c2O)[C@@H](Cc2ccccc2)O1 575282146 CKEPTYXZVLABHN-KGLIPLIRSA-N 427.092 4.309 10 10 IICE Cc1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)c(C)n1-c1ccccn1 742127477 XYCHMRYSYHYQTM-OAQYLSRUSA-N 434.540 4.485 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccccc1-n1cccn1 745784206 OZHBIVSTPUVPCK-UHFFFAOYSA-N 429.318 4.072 10 10 IICE Cc1cc(C(=O)NCc2cccc(CS(C)(=O)=O)c2)c(C)n1-c1ccc(Cl)cc1 749244174 GWOZOBFCEZVFEI-UHFFFAOYSA-N 430.957 4.222 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1COc2ccccc21 754880639 MSBAFMVCYDCOFJ-TWOQFEAHSA-N 431.483 4.121 10 10 IICE C[C@@H](N[C@H](C)c1cc(Br)c(F)cc1O)c1cccc(NS(C)(=O)=O)c1 756494455 MCTJVXPEBGEFJP-GHMZBOCLSA-N 431.327 4.077 10 10 IICE Cc1nn(C)c(C)c1[C@@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)C(F)(F)F 757894395 RXPKNJLVWHWSNG-LJQANCHMSA-N 436.434 4.351 10 10 IICE COc1ccc(O)c(CNC(=O)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1 777741656 TYELLYNFSDBKQE-FPOVZHCZSA-N 435.927 4.217 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cnccc3C(F)(F)F)n2)cc1OC 785544047 OYEDFRMZTYRECU-UHFFFAOYSA-N 445.444 4.042 10 10 IICE Cc1nc([C@H]2CCCOC2)sc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 794238821 NJEACDLODXEQQK-DAYGRLMNSA-N 447.576 4.028 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)c(C)s1 799186574 AQJSYWHYKSRHHS-UHFFFAOYSA-N 431.514 4.252 10 10 IICE COc1ccccc1CN(CCO)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 800718717 CVOOKISJTWOLIW-SFHVURJKSA-N 445.991 4.289 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCc1cc(Br)ccc1O)c1ccccc1 804732776 AZSFAWLGQJUATO-QGZVFWFLSA-N 449.345 4.079 10 10 IICE C[C@@H](Oc1ccccc1F)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCO1 812298011 GBPSEBXIVBUGOS-SJLPKXTDSA-N 426.492 4.078 10 10 IICE Cc1nc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c(C)s1 1134542253 NVBZYMIMGXABRP-UHFFFAOYSA-N 428.315 4.484 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Sc1ccccc1Cl 1137816881 UGFUZQZUAFTTEO-LBPRGKRZSA-N 428.337 4.381 10 10 IICE Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)nn1-c1ccc(Br)cc1 1150378346 PXTIITYJBWFTKC-UHFFFAOYSA-N 440.341 4.458 10 10 IICE CCOc1ccnc(N2CCCN(C(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2)n1 1150430552 BATBFRDVKJGGGK-UHFFFAOYSA-N 447.583 4.252 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](c1cccc(Br)c1)N1CCCC1 1157102871 QKSSUZKDRWRAJA-IBGZPJMESA-N 438.362 4.094 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 1157102873 QMWOWVWVXNDDNX-UHFFFAOYSA-N 435.318 4.065 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCC[C@H]2Cc2cnn(C)c2)cc1 1253222428 WWKJWTJTRZBFQG-URXFXBBRSA-N 435.572 4.202 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(-c2cc(F)cc(F)c2)n1 1265566331 JAYUIYVJUNBDOT-MRXNPFEDSA-N 448.420 4.151 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(F)(F)F)C2)c(C)n1-c1ccccc1Br 1293750406 NCZZSUUATGKPMQ-INIZCTEOSA-N 431.252 4.260 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3C[C@H]2O)c(C)n1-c1cccc(Br)c1 1294752088 JRNPKXHNUWDBMK-RTWAWAEBSA-N 425.326 4.245 10 10 IICE C[C@@H]1C[C@@H]1Cn1c(-c2cc(Br)cn2C)nnc1N(C)Cc1ccccc1O 1304951201 OYMSOXTYLDKEEO-UKRRQHHQSA-N 430.350 4.044 10 10 IICE CC[C@@](C)(O)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1305308431 XLXXEMNCDMVOSZ-XMMPIXPASA-N 439.629 4.328 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H](C[C@@H]2CCCO2)C(F)(F)F)cc1 1352929394 PQHIONUTXRRYPN-HOTGVXAUSA-N 426.401 4.391 10 10 IICE Cc1nn(Cc2ccc(C(=O)N(C)Cc3ccc(N4CCCC4)cc3)cc2)c(C)c1[N+](=O)[O-] 1356255726 KEKHENDXVUYRNI-UHFFFAOYSA-N 447.539 4.329 10 10 IICE Cc1nc(C(=O)NCc2ccc3c(c2)CCCN3C)nn1-c1c(Cl)cccc1Cl 1442399408 DFWCYXIMFGFQEF-UHFFFAOYSA-N 430.339 4.195 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1443529290 CNLNBKHRZDNVPG-GOSISDBHSA-N 439.556 4.296 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)NCc3ccc4cccnc4c3O)CCCC[C@H]12 1451957829 KXZZWRQGHIULQK-MHECFPHRSA-N 425.529 4.126 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1465834352 KUXHROMCSQMXMI-FGZHOGPDSA-N 442.943 4.234 10 10 IICE COc1cccc([C@@H](NC(=O)OC(C)(C)C)C(=O)NCc2c(O)ccc3c2CCCC3)c1 1465959056 XCLZOCICKQZISR-JOCHJYFZSA-N 440.540 4.162 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(CCc3ccccn3)Cc3ccc(F)cc3)C2)cc1 1470771315 CRHUMDMWWIXOAP-HSZRJFAPSA-N 448.542 4.263 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1N[C@H]1CCCN(C(=O)Cc2ccccc2)C1 1472766352 BNWKTWPLQCETQF-NRFANRHFSA-N 443.503 4.471 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3nc4cccc(OC(F)F)c4s3)cc2)CC1 1472879351 SZBMHWDAYQUULZ-UHFFFAOYSA-N 432.496 4.212 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(Cl)cc3Cl)CC2)cc1F 1473270353 VKACCDXDNKFFSF-CYBMUJFWSA-N 426.319 4.290 10 10 IICE Cc1ccc(O)c(CNC(=O)N2CCOc3ccc(NC(=O)OC(C)(C)C)cc3C2)c1 1479194471 KNFDFMXKDBMRTG-UHFFFAOYSA-N 427.501 4.152 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1499936709 AQBDCYBNFPTAJH-KBMIEXCESA-N 437.588 4.129 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1nc(C(F)(F)F)cs1 1509137385 KFPJZMRQZZSPRK-UHFFFAOYSA-N 425.480 4.342 10 10 IICE Cc1noc(C)c1[C@H](C)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1511923006 NSPOXYJETLRUCU-QRWLVFNGSA-N 425.533 4.270 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)CCO1 1513576302 LNZIPJFDXVUHKD-RUZDIDTESA-N 437.588 4.129 10 10 IICE CO[C@@H](Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1517838121 JOKVTUWQHXSENM-GOTSBHOMSA-N 441.620 4.427 10 10 IICE CCc1nc(C)c(COC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)o1 1527910632 HXKPNFICQBNTQY-GDNBJRDFSA-N 436.580 4.332 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)CSCc3ccccc3)cc2F)CC1 1530376721 MSOBFLWXCSYASX-IBGZPJMESA-N 429.605 4.153 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)NC(=O)OC(C)(C)C 1541429051 TWZNDKPTFDEHFQ-UHFFFAOYSA-N 431.581 4.122 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC[C@H](C)N(C)C(=O)OC(C)(C)C)cc1 1543266039 XNPDGNDWZRFRMD-KRWDZBQOSA-N 441.572 4.211 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CC[C@@H](Nc2ccccn2)CC1 1545632263 GWVIULAEQWYFNE-JRGCBEDISA-N 442.991 4.192 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 1558387829 KHBVEAMPKMOVMK-HXUWFJFHSA-N 445.332 4.329 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCOc2ccccc2F)NC(=O)OC(C)(C)C)cc1 1565881377 BOVVTNUNWPHXEM-HXUWFJFHSA-N 445.535 4.043 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(-c2cccc(Cl)c2F)no1 1586800576 SSZUDBNRIOQFOG-UHFFFAOYSA-N 443.906 4.273 10 10 IICE Cc1cc(C(=O)NC[C@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccc(F)cc1 1587541282 BKOXELDDKPSUCJ-HNNXBMFYSA-N 428.529 4.170 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c(C)n1-c1ccccc1 1595949670 CEZJHDKAZNHUPI-FQEVSTJZSA-N 435.955 4.459 10 10 IICE COC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1596199896 UXAOFJFURJFWQM-OAQYLSRUSA-N 428.891 4.401 10 10 IICE CO[C@](C)(C1CC1)[C@@H](C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1597434269 SSJTVBGKIXGZPN-KIUKGOGISA-N 438.640 4.049 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CCO1 1614439271 VVMOJFGIKYWPIJ-KNQAVFIVSA-N 437.588 4.393 10 10 IICE CN1C(=O)c2ccc(-c3ccc(F)cc3F)cc2O[C@H]2CN(Cc3ccccc3O)C[C@@H]21 1615262373 FQMQTMUPTNHBPF-URXFXBBRSA-N 436.458 4.055 10 10 IICE CN(Cc1ccsc1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1617997320 UTHWCDAOKFNBOK-UHFFFAOYSA-N 425.602 4.158 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1C 1618502180 YOHANQZTKPTHGO-MJGOQNOKSA-N 448.615 4.360 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCO[C@@H]3CCC[C@@H]32)sc(C)c1-c1ccccc1 1620432914 SWQXLBYJSRSQTK-ZWKOTPCHSA-N 428.554 4.092 10 10 IICE Cc1cc(C(=O)N[C@H](CO)Cc2ccccc2)c(C)n1-c1cccc(Br)c1 1625432464 LRSNSSJXYGEXAL-IBGZPJMESA-N 427.342 4.190 10 10 IICE CC(C)(C)OC(=O)NCc1cccc2c1N(C(=O)c1ccc(N=NC(N)=O)cc1)CCC2 1629524829 ZTWKGKKBSSUJQF-UHFFFAOYSA-N 437.500 4.467 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1635416384 ICTPKXWPPHDTMI-FQEVSTJZSA-N 431.305 4.459 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3cccc4cnccc34)C[C@H]2C)c([N+](=O)[O-])c1 1639858996 ZNKMRFJWJJUEAW-UGAXZCSASA-N 432.480 4.044 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)c([N+](=O)[O-])c1 1640762255 HKMGGXIDMFNRKY-UHFFFAOYSA-N 426.400 4.190 10 10 IICE C[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)c2ccccc2)ccc1Cl)c1ccccc1O 1642824383 SGVBTJMZFYVPRA-OAHLLOKOSA-N 444.940 4.362 10 10 IICE CCOC(=O)c1ccc(NCCNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)nc1 1653696784 RDLRUARNSURCFU-UHFFFAOYSA-N 440.931 4.161 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC(C)(C)O)C2CC2)sc(C)c1-c1ccccc1 1654245449 KTOQBIPUIPDDSM-UHFFFAOYSA-N 430.570 4.074 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@@H]1CSCCN1Cc1ccccc1 1681538842 CMBQDHIPGQTCRM-QGZVFWFLSA-N 440.396 4.116 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H](O)c3ccc(-c4ccccc4)cc3)C2)cc1 1683504150 LWYWXZQFKQMXLX-FQRUVTKNSA-N 445.563 4.221 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCSC[C@H]3c3ccc(Cl)cc3)C2)cc1 1683945823 WVBUMFDDTWZLBQ-RXVVDRJESA-N 431.989 4.427 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCC[C@H]3COC(=O)N(C)C)c2C)c1 1684478774 IFOBYJNJOJGSTA-QFIPXVFZSA-N 426.561 4.165 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCSC(F)(F)F 1691662918 RMCKPDPLAXADOK-UHFFFAOYSA-N 443.539 4.128 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC(CN(C)C(C)C)CC1 1707305189 SEYIDTUQGYQKLU-UHFFFAOYSA-N 449.647 4.253 10 10 IICE Cc1nnc(N(Cc2ccccc2[N+](=O)[O-])C2CC2)n1CCCSc1nccs1 1707867483 ZPZFQRRXOWZTFZ-UHFFFAOYSA-N 430.559 4.303 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726968153 RQMJHYUDVOLCIA-PMACEKPBSA-N 425.621 4.285 10 10 IICE COCC1(C)CCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1730500856 KXXJJSKAKJQAEH-QFIPXVFZSA-N 441.620 4.195 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](C)C1 1741112339 CQHLLZQUOFUVPR-MOPGFXCFSA-N 448.615 4.361 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@H]1CCCCO1 1743563795 MSRVFRZGOVHDHR-NFBKMPQASA-N 441.620 4.224 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H](OC)[C@H](C)CC 1763748647 RZADWVFNWIFVEZ-KGVIQGDOSA-N 447.599 4.327 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC([C@](C)(O)C(F)(F)F)CC2)cc1 1766609240 XKDLLKNXQFAVFI-NRFANRHFSA-N 439.526 4.011 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1 1858586670 FWVWHQSZCHJLBJ-XSFVSMFZSA-N 440.590 4.335 10 10 IICE O=C(O)C[C@@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)Cc1ccc(O)c(O)c1 1951414036 NRCRBKFRUACVHG-KRWDZBQOSA-N 447.487 4.270 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C3CC3)c(C(=O)O)c2I)c(O)c1 2078992607 QNTMWDHRTRFWSB-MRXNPFEDSA-N 440.281 4.323 10 10 IICE COC(=O)c1c(C)nn([C@H](c2ccc(C)cc2O)C(C)(C)C)c1I 2079106722 MKSFOTQGTGHRSE-OAHLLOKOSA-N 442.297 4.232 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@H](NCc3c(O)cccc3Br)[C@H]2C1 2092936938 OQRNBOIVJVUPIL-JLJPHGGASA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cccc(Br)c3O)C[C@@]2(C)C1 2116284827 IBZBAVUHEYYARK-MDOVXXIYSA-N 425.367 4.280 10 10 IICE CN(C)c1ccc([C@@H](N)c2ccc(Br)cc2I)cc1 2142282440 DHONHWITTRDMEO-OAHLLOKOSA-N 431.115 4.168 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1O 2236033476 RTOONQNXEHDOKL-KBPBESRZSA-N 443.382 4.336 10 10 IICE COc1ccc(Br)c(CNC[C@@]2(C)CCCCN2C(=O)OC(C)(C)C)c1O 2236056352 VGDCIZRPZREYGK-HXUWFJFHSA-N 443.382 4.433 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccc(OC)c(OC)c3C(=O)O)SC2=S)cc1 2297316479 MHRHRVAKGTXMMV-UHFFFAOYSA-N 445.518 4.207 10 10 IICE Cc1ccc(N2CCN(C3=NC(=O)/C(=C/c4c[nH]nc4-c4ccccc4)S3)CC2)cc1 1899806 BQIRLOXWDIBZAZ-QNGOZBTKSA-N 429.549 4.178 10 10 IICE CCN(CC)c1ccc(CN(C[C@@H](O)COc2ccc(OC)cc2)c2ccccn2)cc1 54120836 QMQQLYZZBDMASN-HSZRJFAPSA-N 435.568 4.383 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC[C@@H](Cc3noc(-c4cnccn4)n3)C2)cc1 169774055 VORGYIXFSJOYAK-IBGZPJMESA-N 442.523 4.029 10 10 IICE COc1cc([C@H](C)NCc2ccc(N3CCOCC3)cc2)ccc1OCc1ccncc1 237394795 RPRPFEFGOISRLK-FQEVSTJZSA-N 433.552 4.357 10 10 IICE COC(=O)Cc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526625457 MQIZCNHVSOLJMO-DEOSSOPVSA-N 445.471 4.179 10 10 IICE CN(C)c1ccc(CN(C2CC2)S(=O)(=O)/C=C\c2ccccc2Br)cc1 727447876 AWQLHJLERGMDTB-YPKPFQOOSA-N 435.387 4.480 10 10 IICE CCOc1ccc(CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2cc(F)ccc2F)c(O)c1 742385267 VOGRTVRMALBZAZ-QHCPKHFHSA-N 447.503 4.352 10 10 IICE COc1cc(C(=O)N(C)C)ccc1NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 752712001 VRXXDMOPTOMSCZ-UHFFFAOYSA-N 434.540 4.169 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 772558069 NFHHLOJBPZCMFS-UZLBHIALSA-N 433.346 4.464 10 10 IICE C[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(N2CCCCC2=O)cc1 811974043 MHIFZEWZRRGNDK-AWEZNQCLSA-N 446.345 4.232 10 10 IICE C[C@H](NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)c1ccc(N2CCOCC2)cc1 812015492 QXGJXDFMUJPORU-LAUBAEHRSA-N 439.560 4.172 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccc2Br)n1C[C@@H]1CCCO1 812265385 STTDMAYKGAYOQU-INIZCTEOSA-N 443.345 4.229 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(-c4ccc(C(F)(F)F)cc4)c3)C2)cc1 1130185297 DKKLHZPLJUDDBK-INIZCTEOSA-N 444.457 4.156 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCNc3ccc(C(F)(F)F)cn3)c2C)cc1 1142500348 YFJVLOCDJJBAEI-UHFFFAOYSA-N 432.446 4.358 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cnc(OCC3CC3)c(Cl)c2)cc1 1142713640 XSEPQZALPGCDNS-NRFANRHFSA-N 443.975 4.411 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(O)cnc2c(F)cccc12 1148444329 RQVGKZSTDLOHDQ-ZDUSSCGKSA-N 431.414 4.080 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)CC(=O)c1ccc(Cl)cc1 1152400864 GEEZNRFWVHRILE-CYBMUJFWSA-N 438.307 4.110 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)NCC1(c2ccccc2)CC1 1190935687 TVASYCAORRUGAN-UHFFFAOYSA-N 449.595 4.312 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@H](c3ccccc3)c3ccc(F)cc3)nc12 1192003866 DBUJNUCSOIXVJV-HSZRJFAPSA-N 448.498 4.362 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC2(C(C)(C)c3ccc(F)cc3)CC2)N(C)C)cc1 1251501402 QOWPHNCDXGXKRN-QFIPXVFZSA-N 426.580 4.304 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)N(C)C)cc1 1252261760 SOVSQXNWQZRMQS-SKPFHBQLSA-N 448.615 4.257 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CCc1ccc(OCC(F)(F)F)nc1 1287182814 ZETMRXYLPFYETD-UHFFFAOYSA-N 449.477 4.322 10 10 IICE CCc1ccc(CN2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)s1 1293695393 JBRVDHRDKLCFKB-UHFFFAOYSA-N 449.620 4.417 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1299752643 WDNLCGGJBFAXKP-HXUWFJFHSA-N 433.603 4.491 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CC[C@@H](C3CCOCC3)C2)nnc1C(C)(C)C 1304240326 KAUATCULCTXBAT-OAQYLSRUSA-N 425.621 4.251 10 10 IICE CCc1ccccc1-n1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)nn1 1353013350 MHLKDHGKEKXNMF-UHFFFAOYSA-N 429.524 4.331 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)C3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1361048865 LNDUJYKKAUIKLU-INIZCTEOSA-N 429.515 4.481 10 10 IICE COc1cccc(N2CCC(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)c1 1442759279 UYALNESLUGUQEC-UHFFFAOYSA-N 445.563 4.243 10 10 IICE CCOCCC1(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCC1 1444515890 WMXGNFRFRAPMAW-FQEVSTJZSA-N 433.593 4.032 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)O[C@H]([C@@H]2CCCOC2)C(F)(F)F)CCCC1 1459759448 PZDLNXJKGGFAAP-SPLOXXLWSA-N 425.447 4.429 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)N1CCN(Cc2ccc(C(C)C)cc2)CC1 1459781074 ZFHDDQOVBAHRGG-UHFFFAOYSA-N 435.612 4.306 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(=O)Nc3ccccc3)cc2)N(C)C)cc1 1463279489 IMRQAXZXWQHTTE-XMMPIXPASA-N 430.552 4.038 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@H]2c2ncon2)c(C)n1-c1ccc(Br)cn1 1466330795 QISHAISUWFXQQA-KRWDZBQOSA-N 444.333 4.392 10 10 IICE C[C@H](NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1O)c1ccc(N(C)C)cc1 1467261001 XYDGPPCJZIKBFT-AWEZNQCLSA-N 439.462 4.480 10 10 IICE Cc1cc(CCNC(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1470969046 OWHZHCHVWCLBKH-UWJYYQICSA-N 440.588 4.334 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@H]3c3ccccc3Cl)cc2)CC1 1479343765 LHOPVODRGMPJDN-QFIPXVFZSA-N 440.975 4.088 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@@H](F)C3)n2CCCCCO)c(C)n1-c1ccccc1 1510617439 FJNLGZVVDYUOGC-VGSWGCGISA-N 425.552 4.309 10 10 IICE CC[C@H]1CCCN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)C1 1514064430 ILHPHYRQFAVKFO-SFHVURJKSA-N 445.662 4.405 10 10 IICE COC(=O)c1cc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(C)cc4)c3C)cs2)n(C)n1 1523937800 YIWIIRUQUXOUFZ-UHFFFAOYSA-N 449.536 4.298 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CCCCC2 1525460871 WFEDAUMAVDDXCC-OAHLLOKOSA-N 426.538 4.185 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1c(Cl)ccc(I)c1F 1529082592 AUNUJUMXVSIWIQ-UHFFFAOYSA-N 446.691 4.388 10 10 IICE COC(=O)C[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(C)cc1 1540467437 UCFKLEIDLGBISI-DEOSSOPVSA-N 432.520 4.178 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@]12CCC(=O)N1c1ccccc1S2 1545508573 GRSAWCHTLMQLFY-HXUWFJFHSA-N 447.354 4.132 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3/SC(N4C[C@H](C)O[C@@H](C)C4)=NC3=O)o2)cc1 1554199424 VFYXBXWQEYPVBT-IVTDNZOPSA-N 440.521 4.203 10 10 IICE CCOC(=O)[C@@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1584884559 PHKXXKHGWQXZAY-LJQANCHMSA-N 430.854 4.290 10 10 IICE COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)c2ccc(N=NC(N)=O)cc2)c1 1587959147 AJKUHCHTNGGABT-UHFFFAOYSA-N 432.436 4.467 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OC(F)F)cc1F 1595582052 BHCIJCKXBFIVNJ-CQSZACIVSA-N 428.838 4.181 10 10 IICE C[C@H]1CN(c2ccnc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c2)C[C@H](C)O1 1597950540 MBDKOKMTAOZMQK-PMACEKPBSA-N 436.600 4.394 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@@H]3CC[C@]32CNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1612988710 UACIUWCLKFWKLZ-XHLGOQEJSA-N 445.516 4.055 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](OC)C(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1613206817 JPKQNTVPUJRACY-GHTZIAJQSA-N 443.661 4.254 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)OC3(CCOCC3)C2)cc1 1615374707 CGUPIIMMKASFAH-FQEVSTJZSA-N 441.620 4.070 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CCCc2cccnc21 1627171626 UGVXPVDFZZFQNQ-VAFHRPCXSA-N 443.619 4.318 10 10 IICE C[C@H](NC(=O)N1C[C@@H](CCNC(=O)C(F)(F)F)c2ccccc21)c1ccc(N(C)C)cc1 1634434367 BJDSLGDIBUZSHO-DOTOQJQBSA-N 448.489 4.196 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCCCN1Cc1ccccc1 1635940750 ILNJASHYBJIORR-PKTZIBPZSA-N 442.003 4.181 10 10 IICE COC(=O)c1ccc2nc(CNC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)[nH]c2c1 1641919932 OZUWJGBNTHPJIK-UHFFFAOYSA-N 430.508 4.304 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)cc(C(=O)OC)c1 1643330461 IZELLLNYZVFHKC-UHFFFAOYSA-N 439.439 4.068 10 10 IICE Cc1cccnc1[C@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 1644901142 NZCUYYPSHZYEGN-UZUQRXQVSA-N 441.531 4.479 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c(O)cc(Cl)cc3Cl)cc2F)C[C@H](C)O1 1648474120 ABVGTHULDGZWDR-RYUDHWBXSA-N 427.303 4.382 10 10 IICE COC[C@H](SCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccccc1 1652237254 IDBKOQVVJVBLGT-BSRJHKFKSA-N 446.588 4.176 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1ccc2c(c1)OCCCO2 1676136942 ANIIEMRXIIMKAN-UHFFFAOYSA-N 449.345 4.090 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)c2C)c1 1680639427 WPJBKNDFRJVWJK-KRWDZBQOSA-N 428.577 4.363 10 10 IICE Cc1cc(CCNC(=O)N2CCCN(c3ncccc3F)CC2)c(C)n1-c1ccccc1 1687216766 IZAIKWPZHXUXMO-UHFFFAOYSA-N 435.547 4.093 10 10 IICE CCCN1CCC(N(C)c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)c(F)c2)CC1 1709773978 ORCFOAHFIZQBFZ-GOSISDBHSA-N 430.616 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCS[C@@H](C)[C@@H]2C)cc1 1710028177 RPAPMTNYLUXFEF-BBTUJRGHSA-N 429.634 4.354 10 10 IICE CN(C[C@H]1CCCOC1)c1nnc(Cc2ccsc2)n1CCCSc1nccs1 1768800176 VASXLZPZMUXAJN-QGZVFWFLSA-N 449.671 4.432 10 10 IICE COc1cccc(OCC(=O)N(c2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)c1 1859891679 LFULRXMZCXRRJS-UHFFFAOYSA-N 429.472 4.291 10 10 IICE COC(=O)c1c(NC(=O)C(=O)N[C@H]2CCCC[C@@H]2C)sc(C)c1-c1ccc(C)cc1 1860760992 LQWSMSJCOTYESC-YOEHRIQHSA-N 428.554 4.452 10 10 IICE CCOC(=O)Oc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1865865024 OBOQVGUIDSUSFF-QHCPKHFHSA-N 439.556 4.245 10 10 IICE COc1ccc(CNc2ccc(Br)cc2I)c(O)c1 2231664599 GWZASMBRCHDVPM-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC[C@H](C)NCc1ccc(N(CC(=O)N(C)C)Cc2ccccc2)c(Br)c1 2240054831 ZBMAJWXZNWOAMO-KRWDZBQOSA-N 432.406 4.432 10 10 IICE CCCCN1CCc2cc(C=C3C(=O)NC(=S)N(c4ccc(C)c(C)c4)C3=O)ccc21 2296940796 QFDZYJOYENYHJO-UHFFFAOYSA-N 433.577 4.297 10 10 IICE CCOc1ccc(-c2ccc(C=C3C(=N)N4N=C(CC)SC4=NC3=O)o2)c([N+](=O)[O-])c1 2297348168 OLXYSUYSSFDMFU-UHFFFAOYSA-N 439.453 4.283 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(CC(C)C)C1=O 2314414482 AEHZAVKUOHXIDE-UHFFFAOYSA-N 444.626 4.462 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)C2=Cc2ccc(OC)c(O)c2)cc1 2332100203 VURGZZSXBLFZOI-UHFFFAOYSA-N 432.451 4.379 10 10 IICE CCCC1=NN(Cc2ccc(F)cc2)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141105 GZPQOXAOGHBATN-UHFFFAOYSA-N 425.416 4.087 10 10 IICE Cc1ccc(CNC(=O)C[C@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380738014 UDFNRLZGKAMSMH-HNNXBMFYSA-N 443.382 4.409 10 10 IICE Cc1ccc(CNC(=O)c2ccoc2CNC(=O)OC(C)(C)C)c(O)c1Br 2381145234 CFWNBUQDFLMQEC-UHFFFAOYSA-N 439.306 4.011 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC(Cc3cccnc3)CC2)C1 444262768 CZACTWGNZDUVKP-UHFFFAOYSA-N 430.596 4.284 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccccc3NC(=O)c3ccccc3)CC2)cc1 726560616 IYMATVWUCBAYML-UHFFFAOYSA-N 429.520 4.346 10 10 IICE COC[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccc1 727097733 JLYKDOIHTWMXIH-CLEQQJOVSA-N 446.619 4.233 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1ccc3c(c1)CCCN3C)O[C@@H](C)C2 730828690 WZMWCYSNDUAXQI-BUKVSMQUSA-N 435.568 4.146 10 10 IICE CC(C)N(CCc1nccs1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754660307 GIYXWCXAUKDOLE-INIZCTEOSA-N 438.544 4.376 10 10 IICE C[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cc2c(s1)CCC2 765282132 STEZTCKZRAZUNR-QGZVFWFLSA-N 437.588 4.343 10 10 IICE COc1cccc(N2CC[C@H](CN[C@@H](C)c3ccc(N4CCOCC4)cc3Cl)C2)c1 765638787 QJPIKTRMXYMBPQ-RBUKOAKNSA-N 429.992 4.362 10 10 IICE Cc1nc(-c2ccc(CNC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2)cs1 789918285 VECHXXBPDFPDHJ-UHFFFAOYSA-N 436.581 4.297 10 10 IICE O=C(CO[C@@H]1CCCc2ccccc21)NC1CCN(c2ccc(OC(F)F)cc2)CC1 797447515 DPXKGCAZVNOULQ-JOCHJYFZSA-N 430.495 4.467 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccnn2CC(F)(F)F)cc1 857449560 FADVPEYCLUVGRA-UHFFFAOYSA-N 432.446 4.367 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c1 919809141 IKNNHRRXUVTRGO-UHFFFAOYSA-N 439.518 4.293 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C\c3ccsc3C(F)(F)F)cc2F)CC1 1125976344 WPCHISARGMKIHZ-XQRVVYSFSA-N 441.494 4.378 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)CC2CCCC2)c(C)n1-c1ccc(Br)cn1 1139357070 SCOMOFSLOQEFHT-KRWDZBQOSA-N 434.378 4.170 10 10 IICE CCS[C@H](C)c1noc(CN(C)C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1150760062 GPHJONNPRZEJQY-MRXNPFEDSA-N 426.542 4.376 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cccc(-c3nnnn3C(C)C)c2)c1 1168216349 VROFTPNMSHYONO-UHFFFAOYSA-N 428.496 4.393 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1183705817 BAPDFNZHSVCESO-AUSIDOKSSA-N 439.600 4.244 10 10 IICE COC(=O)COc1ccc(N(C)Cc2cc(Cl)ccc2I)cc1 1193308363 FFPSCNMIDIINPZ-UHFFFAOYSA-N 445.684 4.133 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCNC(=O)[C@H]3c3cccs3)cc2Cl)C1 1227207231 FACSRQKZKPQBPX-MGPUTAFESA-N 447.004 4.021 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)cc1 1228489460 ZWDAOWQRJNZGOT-FSSWDIPSSA-N 427.593 4.068 10 10 IICE C[C@H]1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)CN1C(=O)OC(C)(C)C 1234107045 OMZAYGNCMLPAOM-FZMZJTMJSA-N 432.348 4.286 10 10 IICE CN(C)c1ccc(CNC(=O)c2cnnn2-c2cc(C(F)(F)F)ccc2Cl)cc1F 1264827763 OBOYFRMOZWVHGK-UHFFFAOYSA-N 441.816 4.075 10 10 IICE Cc1cccc([C@@H]2C(=O)NCCN2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1280388037 YCZRNCIOGOQCNN-XMMPIXPASA-N 435.955 4.298 10 10 IICE C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)c1ccccc1O 1302538093 GXXWQIIKVYHRMM-KSSFIOAISA-N 447.329 4.133 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F 1304089861 OWILFCHJSBDNGS-IBGZPJMESA-N 440.446 4.068 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305487551 HSHCFCKKFIAPQY-CRAIPNDOSA-N 441.555 4.120 10 10 IICE COC(=O)/C=C/c1ccc(N(C)C[C@@H]2CCN(Cc3ccc(C)s3)C2)c([N+](=O)[O-])c1 1307156049 DRUZUVJMEMSZHN-YOCVDRLZSA-N 429.542 4.109 10 10 IICE C[C@@]1(c2ccccc2)CCCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1312834260 UVFVJOXQWBRNPW-XMMPIXPASA-N 429.511 4.065 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC2CCN(C(=O)CC(F)(F)F)CC2)c1 1321436901 DQNPAWLMGWZQET-UHFFFAOYSA-N 441.881 4.421 10 10 IICE COc1cc(N2CCN(C(=O)CCCc3ccc(C4CC4)cc3)CC2)cc(OC)c1OC 1435839850 DAJRUKUOMSJDPD-UHFFFAOYSA-N 438.568 4.261 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c1 1455928700 OIFGEYLELKIGMX-IIBYNOLFSA-N 439.556 4.139 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)cc1 1459613366 KKTVEVZTZPMKRS-LJQANCHMSA-N 436.383 4.219 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1 1464987071 CWNWMGCOJZTPLQ-LJQANCHMSA-N 439.556 4.236 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1CC=C(c2ccc(F)cc2)CC1 1469554343 YFBQQVMRQWDQAR-HXUWFJFHSA-N 445.485 4.376 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]34OCCC[C@H]3C4(F)F)cc2Cl)C1 1469961931 ZDTQUABNRZHJBB-DJKXOVBDSA-N 427.923 4.190 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCO[C@@H]1C 1500735329 WQGINVVKYVNNSF-CJFMBICVSA-N 437.588 4.129 10 10 IICE CCOCc1nnc(N(C)[C@H]2C[C@H](OCC)C23CCC3)n1Cc1ccc(N(C)C)cc1C 1503005788 BQGBKBPHLQAFRS-VXKWHMMOSA-N 441.620 4.021 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnn(-c2cccc(Br)c2)c1 1525761435 BQEVACSMBWWUEC-MRXNPFEDSA-N 441.373 4.370 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCCC(F)(F)C1 1525799009 HNURRTHYCFHGHL-MKRLJBPISA-N 428.501 4.111 10 10 IICE C/C(=C/C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccccc1C(F)(F)F 1535156961 QYQNDEMZBKKKIF-PEZBUJJGSA-N 445.485 4.127 10 10 IICE COC(=O)Nc1cc(C(=O)N(C)CCN(C)c2ccc(OC)cc2)cc(C(F)(F)F)c1 1538161661 YTDZIKZHENHWHF-UHFFFAOYSA-N 439.434 4.101 10 10 IICE Cc1nnc(N(C)Cc2ccc(Br)s2)n1Cc1ccc(N(C)C)c(F)c1 1543143966 SASPPQCFHLKNDH-UHFFFAOYSA-N 438.370 4.300 10 10 IICE Cc1cc(C(=O)N2CCC(OCC3CC3)CC2)c(C)n1-c1ccc(Br)cn1 1544758993 DWNCKRPHRXYLEM-UHFFFAOYSA-N 432.362 4.283 10 10 IICE CN(OC1CCCC1)c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1554323416 CJPTYYMNJKSLJO-UHFFFAOYSA-N 430.603 4.213 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@@H](C)C1 1555540539 OJRVEXWMIFROEW-WZONZLPQSA-N 425.621 4.295 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](C[C@H]3COCCO3)C(F)(F)F)cc2Cl)C1 1556369222 JAEIKASHOFFLFV-HYVNUMGLSA-N 448.913 4.177 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCC1 1564667897 KNUHRPIVAOUYEO-GCJKJVERSA-N 446.636 4.375 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCO[C@@H](c2ccncc2)C1 1564774402 LMYIOTFYYJKMJQ-PKOBYXMFSA-N 434.334 4.002 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c(Cl)cccc1OCC1CC1 1566026392 SHDGTUJSAVQWEP-UHFFFAOYSA-N 432.923 4.159 10 10 IICE Cc1c(C(=O)NCc2ccc3cccnc3c2O)c(=O)oc2ccc(Br)cc12 1570533530 GMLNGXVLWJYYKE-UHFFFAOYSA-N 439.265 4.048 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@]3(C)CC(c4cccc(Cl)c4F)=NO3)CC2)cc1 1596733233 OIIAYTWDPVQACC-QHCPKHFHSA-N 445.922 4.110 10 10 IICE O=C(Nc1cccc(N2CCCCC2)c1)c1ccccc1NS(=O)(=O)C(F)(F)F 1626755779 GIGHOUVGSOUULC-UHFFFAOYSA-N 427.448 4.191 10 10 IICE Cc1ccc(C(=O)Nc2cccc(CN3CCOCC3)c2)cc1-n1c(C)cc(C=O)c1C 1626974310 GDRANRYGMJMUNJ-UHFFFAOYSA-N 431.536 4.300 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1634398105 COOFJLBREUEDOB-SIKLNZKXSA-N 440.588 4.193 10 10 IICE Cc1ccc(C(=O)NC[C@H](CO)Cc2ccc(F)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1635611880 JBMRLBRPPWSOPV-LJQANCHMSA-N 440.490 4.074 10 10 IICE CC[C@H](NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)c1ncc(-c2ccccc2)[nH]1 1636353544 DFRQQRBXEIJNQH-GCJKJVERSA-N 433.556 4.362 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1nc(O)c2c(C)c(C)sc2n1 1638243549 HNKWXVUNPJRQTC-CQSZACIVSA-N 426.586 4.068 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3cccc4cnccc34)C[C@H]2C)c([N+](=O)[O-])c1 1639858995 ZNKMRFJWJJUEAW-NBEHIINDSA-N 432.480 4.044 10 10 IICE Cc1cc(C(=O)Cn2cc(N=S(C)(C)=O)cn2)c(C)n1-c1ccc(Br)cc1 1641305599 YVUNXXAIZSUKBU-UHFFFAOYSA-N 449.374 4.295 10 10 IICE COC(=O)c1cc(OCC(=O)NCCC(c2ccccc2)c2ccccc2)ccc1N(C)C 1644178578 FQVWEAHLXALMJR-UHFFFAOYSA-N 446.547 4.256 10 10 IICE Cc1cnn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1C(=O)NCc1cc(Cl)ccc1O 1644590669 JYMIIEFSZJLNAL-KRWDZBQOSA-N 448.951 4.053 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C2)c1O 1648351329 IRIXJEOFSQTCGL-CVEARBPZSA-N 434.430 4.011 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@@H](c3cccs3)n3cccc3)cc2F)CC1 1648544766 BQWDIQFLQKVGEQ-QFIPXVFZSA-N 440.588 4.127 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cc(OC)c(Br)cn2)CCCC1 1648694380 QPSHAHBBWAUWPX-UHFFFAOYSA-N 444.329 4.334 10 10 IICE COCCN(Cc1csc(-c2ccc(C(=O)OC)cc2)n1)c1ccc(OC)c(OC)c1 1652711277 LAJJZBGBZLUFKN-UHFFFAOYSA-N 442.537 4.267 10 10 IICE COC(=O)COc1ccc(N(C)Cc2cc(C)c(I)cc2C)cc1 1654116662 GVRNSNHUPPTULL-UHFFFAOYSA-N 439.293 4.096 10 10 IICE COc1ccc([C@@H](C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1654949282 CXCUUNILPBAMCE-MRXNPFEDSA-N 428.488 4.068 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(C)(c3ccc(Br)cc3)CC2)cc1 1658389615 VBKUMWUSSJMRSB-UHFFFAOYSA-N 444.417 4.185 10 10 IICE C[C@@H](NC(=O)NC1(C2CCN(C(=O)OC(C)(C)C)CC2)CC1)c1ccc(N(C)C)cc1 1681551902 JFFHDWDTPQEXKS-QGZVFWFLSA-N 430.593 4.293 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCN3CC(F)F)cc2Cl)C1 1682024375 RIWKYWTYJGVJDH-DOTOQJQBSA-N 428.955 4.105 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC(C)(C)c3cccc(C(F)(F)F)c3)cc2)CC1 1684874774 VFBJHXXAHPETCO-UHFFFAOYSA-N 434.506 4.192 10 10 IICE CC(C)Cc1nnc(N(C)C[C@@H](C)c2nccs2)n1Cc1ccc(N(C)C)c(F)c1 1692073074 MLDONKUNQVHNHM-MRXNPFEDSA-N 430.597 4.426 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](C[C@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1692175141 GLLTUQQXNOMDND-TZIWHRDSSA-N 443.611 4.373 10 10 IICE CCN(c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1695564075 YPTYKVPXYKYUJX-UHFFFAOYSA-N 436.629 4.100 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1CCSCC1 1707305652 GWWRRVANZLNKPH-NHCUHLMSSA-N 443.661 4.173 10 10 IICE Cc1ccccc1CN(C)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1707673058 LSNUCWODLFEDTC-UHFFFAOYSA-N 437.598 4.319 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1Cc1nc(C(C)(C)C)cs1 1729420359 OHNNBZZKFIJHSC-UHFFFAOYSA-N 448.596 4.408 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1741585649 VUGAERMAGRKDFS-UGKGYDQZSA-N 445.583 4.024 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1749301229 YCTWZBJBKAMDDK-QGZVFWFLSA-N 425.602 4.188 10 10 IICE C[C@H]1CC(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C[C@H](C)O1 1762752359 CDFVYOQQDRGWBS-IRXDYDNUSA-N 426.586 4.476 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 1858594390 XBVMIXWHHXLJKN-VGVSSDJJSA-N 448.909 4.145 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CCCN(C(=O)CC)C2)sc(C)c1-c1ccccc1 1860645722 FLIVVSVOGHFAIS-KRWDZBQOSA-N 428.554 4.487 10 10 IICE COCCN1C(=O)C(NCCC2=CCCCC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873167722 UXVRFIOLYOIMJI-UHFFFAOYSA-N 447.579 4.301 10 10 IICE CCOC(=O)N1CCN([C@@H](c2cc(C)ccn2)c2cc(Cl)c3cccnc3c2O)CC1 2059179317 WQEMSPVTIIIBEJ-OAQYLSRUSA-N 440.931 4.161 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCCCOc1cccc(OC)c1 2297347231 MNWDKVNAQYCRJC-UHFFFAOYSA-N 445.562 4.431 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccccc2O)SC1=S)NCc1ccccc1 2314838012 ZVUBNMBVBWSFOU-UHFFFAOYSA-N 440.590 4.470 10 10 IICE CCOC(=O)COc1c(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)cccc1OC 2834626 BGDPWUWDWGZHQW-LICLKQGHSA-N 447.509 4.182 10 10 IICE CCOc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCC2)cc1OCC 5098010 FJEIEWPHQBKEMH-QFIPXVFZSA-N 425.573 4.117 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccccn2)SC1=S)C(c1ccccc1)c1ccccc1 9445611 JPLFTWVNNAGOJC-XDJHFCHBSA-N 431.542 4.146 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccncc4)nc4ccc(F)cc34)CC2)cc1 35218793 MMXXTRSTFAHJLM-UHFFFAOYSA-N 442.494 4.407 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4ccc(C(C)C)cc4)c3C)CC2)on1 107759100 JHWSKGCYWPAIOZ-UHFFFAOYSA-N 434.540 4.112 10 10 IICE C/C(Nc1ccc(Cn2cnnc2)cc1)=C1\C(=O)N(c2ccccc2)N=C1c1ccccc1 205954585 PETRHZXMFGWGAU-LYBHJNIJSA-N 434.503 4.463 10 10 IICE O=C(O)Cc1ccc(N2C(=O)/C(=C/C=C\c3ccccc3[N+](=O)[O-])SC2=S)cc1 210170720 LDNBFRAXPKPXKD-CWCJHYOQSA-N 426.475 4.184 10 10 IICE COc1cc(/C=C2/SC(=S)N(Nc3nc4ccccc4s3)C2=O)cc(OC)c1O 210510937 AJMHIDRHKKJJKL-OQLLNIDSSA-N 445.547 4.247 10 10 IICE CC(C)(C)OC(=O)NCC(CNC(=O)OC(C)(C)C)NCc1c(O)ccc2ccccc12 389354985 PVGFIWRKTUKIDT-UHFFFAOYSA-N 445.560 4.053 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(NC(=O)c4ccccc4C)CC3)ccc21 482847826 MFPQDBOKKHAVJE-UHFFFAOYSA-N 447.579 4.248 10 10 IICE COC(=O)/C=C\c1ccc(NC2CCN(c3ccc(OC(F)F)cc3)CC2)c([N+](=O)[O-])c1 726595184 YOTWHVVQGPZAIN-OQFOIZHKSA-N 447.438 4.463 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)c(C)n1-c1ccccc1 733038789 QGOLPHFSDJTWSP-OAQYLSRUSA-N 438.616 4.221 10 10 IICE CCOc1ccc(-c2nc(NS(=O)(=O)c3ccc(C(=O)OC)cc3)sc2C)cc1 748673888 MWYWNLYWKCXSNR-UHFFFAOYSA-N 432.523 4.105 10 10 IICE Cc1ncsc1/C=C\C(=O)NCc1ccc(N(C)C(=O)/C=C\c2scnc2C)cc1 765478644 ILWUXSZERYOASH-WGEIWTTOSA-N 438.578 4.222 10 10 IICE C[C@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)c(F)cc1O 797103055 MAYNSWBVFFCBCG-JTQLQIEISA-N 444.732 4.231 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C4CC4)C3)n2C[C@H]2CCOC2)c(C)n1-c1ccccc1 802756568 RRPXMKRTZMSNPZ-YKSBVNFPSA-N 447.583 4.004 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c1C 804204227 SBPZNOHBBPFSPB-SFHVURJKSA-N 435.490 4.323 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1CCO[C@@H]1c1cnn(Cc2ccccc2)c1 807840787 JXHKKZWJHSWRSL-GHTZIAJQSA-N 446.334 4.338 10 10 IICE CCOc1ccc(N2C(=O)/C(=C/c3cc(OC)c4c(c3)OCCO4)SC2=S)cc1 814274045 XDUBRFXMOXUEMU-PDGQHHTCSA-N 429.519 4.271 10 10 IICE CC(=O)c1c(C)nc(C)nc1SCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 914869314 AJDIACMRIDQSBL-UHFFFAOYSA-N 437.521 4.407 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1nc2c(s1)CCC2 1124592410 VVXYOBYWDPNKNP-XNTDXEJSSA-N 433.555 4.001 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3cccc(OC(F)(F)F)c3)cc2F)C[C@@H](C)O1 1125188841 VNTIJDINTIONPL-HUUCEWRRSA-N 440.437 4.197 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCCC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1136160264 ZOJSESCZOCUXAK-UHFFFAOYSA-N 429.520 4.272 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(C(=O)NC3CCCCC3)CC2)cc1 1136513012 NOTOENOLOSWOFW-UHFFFAOYSA-N 449.595 4.137 10 10 IICE CCN(CCCNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)C(=O)OC(C)(C)C 1136651139 XOUOQQSTFLVLAX-UHFFFAOYSA-N 427.545 4.284 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)c2C)cc1 1154306123 BPULAPVUUPNRIR-QGZVFWFLSA-N 427.545 4.184 10 10 IICE Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1185555853 XWHMWINVLJIYGO-SNVBAGLBSA-N 435.353 4.029 10 10 IICE COc1ccc(C[C@@H]2CCCN(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)C2)cc1 1252117948 ZMIIDBQLJRWVKM-FCHUYYIVSA-N 437.584 4.194 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCCc3cc(Cl)sc3Cl)cc2)CC1 1288334679 NEGUQQPDJAFPSI-UHFFFAOYSA-N 426.413 4.446 10 10 IICE CCOCc1nnc(N2CCS[C@H](CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1297344332 MENONCROXIITGX-JOCHJYFZSA-N 443.661 4.431 10 10 IICE CC(C)(C)OC(=O)NCC1([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2)CCC1 1304180614 RUXUYRVABNFMMD-BQYDLMEBSA-N 430.545 4.187 10 10 IICE Cc1cc(CNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccc1 1313132810 LBXISRFXULABKI-GOSISDBHSA-N 426.561 4.245 10 10 IICE COc1cc(OC)cc(-c2nnc(N3CC[C@@H](C)C3)n2CCCSc2nccs2)c1 1315343267 OYBKIUFJDQSARG-OAHLLOKOSA-N 445.614 4.447 10 10 IICE CCOC(=O)[C@@H](CCCC(C)C)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1439195588 WYQJVNCLWYHDKG-OAQYLSRUSA-N 428.573 4.403 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(C)c(Br)ccc4[nH]3)CC2)cc1F 1445849043 WPDWGMWIIUMKPJ-UHFFFAOYSA-N 446.320 4.349 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(CCc2ccc(Cl)cc2)C[C@@H](O)C(F)(F)F)cc1 1450631637 ZPLUFHZLUBBBJU-MRXNPFEDSA-N 442.825 4.111 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc(-c2cnco2)c1 1464270728 KYVGAJLEYBQGIN-UHFFFAOYSA-N 431.414 4.127 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(NC(=O)OCC(F)(F)F)ccc2O)cc1 1464304124 XUPHZNNIMFCZDK-UHFFFAOYSA-N 439.434 4.279 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C\COc2ccccc2)NC(=O)OC(C)(C)C)cc1 1465324837 JKBPMQKZLOMLMY-REBWPMHBSA-N 439.556 4.070 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@H]3c3cccc(Cl)c3)CC2)cc1 1473431065 YGLVITQYUMDISJ-ZCYQVOJMSA-N 444.019 4.059 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@H]2CC[C@H](C)C2)c(C)n1-c1ccccc1 1510604266 UCOWPQXDWLUBJB-UEXGIBASSA-N 448.615 4.489 10 10 IICE CCc1nc(CN(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1513742242 KJVUWVZKBZZSCU-UHFFFAOYSA-N 430.597 4.484 10 10 IICE Cc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nnn1Cc1ccc(F)cc1 1530890027 RCUGMHKFSNGAHY-UHFFFAOYSA-N 431.515 4.154 10 10 IICE CC(C)C[C@@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Cl)cc1 1531600623 UAXXBHKUIPTXAG-JOCHJYFZSA-N 449.016 4.021 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1cccc(I)c1 1533144688 YXRYBAOSQOOYTJ-UHFFFAOYSA-N 436.337 4.337 10 10 IICE CCCCNC(=O)c1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1541061422 SNDQHSOKZWWCBT-UHFFFAOYSA-N 431.536 4.367 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1CCCc1ccnc(C(C)(C)C)n1 1554175183 KBJRUBGXTMXLOA-UHFFFAOYSA-N 434.588 4.293 10 10 IICE COC(=O)[C@@H](Cc1ccccc1O)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1557590778 FMAIJBKNGKTXCW-HSZRJFAPSA-N 434.536 4.437 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1scnc1C1CC1 1584148665 AQEDMUYPDCAQDW-ZROIWOOFSA-N 433.555 4.390 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@]2(C(=O)OC(C)(C)C)CCOC2)cc1 1585619238 JTULGUJVLXFXGB-DEOSSOPVSA-N 438.528 4.399 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)c2cccc(N3CCOC3=O)c2)c1 1586396712 CYOBRGPGPWDHHN-QGZVFWFLSA-N 431.492 4.354 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccc2c(c1)CCOC2 1587504309 BTGWPPGFIQAMFC-PDGQHHTCSA-N 444.603 4.441 10 10 IICE CC[C@H](C)c1nnc(N2CCSC3(CCOCC3)C2)n1Cc1ccc(N(C)C)cc1C 1613361584 PVEVCHYYXVOPRL-SFHVURJKSA-N 443.661 4.317 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](NC(=O)OC(C)(C)C)C1CCCCCC1 1623579532 CNXCQCIRUFIPTO-LJQANCHMSA-N 425.566 4.358 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Br)CC2)c(OC)c1 1623759615 JDFBPLPDXCBQOB-UHFFFAOYSA-N 439.737 4.082 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3CC[C@@H]3c3ccc(Cl)cc3F)CC2)c(OC)c1 1623764108 IZRQOPJTCSCICZ-MJGOQNOKSA-N 432.923 4.339 10 10 IICE COc1cccc(-c2noc(SCC(=O)N(C)Cc3ccc(N4CCCC4)cc3)n2)c1 1624626544 STBLNIXBRQNYSY-UHFFFAOYSA-N 438.553 4.096 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)c2nc(-c3ccc(Cl)cc3)no2)cc1 1638659743 MTDLPABQQRVXJU-HNNXBMFYSA-N 443.935 4.237 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(OCCN(C)C)cc3OC)c2C)cc1 1639164267 WXSMPXFGDVPEDL-UHFFFAOYSA-N 437.540 4.304 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCCCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)C1 1644796022 OKZYICUKUIRICR-QFIPXVFZSA-N 429.521 4.102 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C 1683254391 PTBDHEBALNKWKD-SFHLNBCPSA-N 446.636 4.184 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCC[C@H]3CC3(O)CCCCC3)C2)cc1 1683340115 PMGCDNVLGZENLU-UNMCSNQZSA-N 429.605 4.171 10 10 IICE COc1cccc2c1OCCC[C@H]2NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1683779255 VQHQORAJROYOKE-UYAOXDASSA-N 426.513 4.005 10 10 IICE C[C@H](CNC(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccc(S(C)(=O)=O)cc1 1684791654 IWSPLBCXXCNDLS-GOSISDBHSA-N 444.597 4.444 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC1CCN(CC(F)(F)F)CC1 1691669199 UFHIIYSYMAMGOZ-UHFFFAOYSA-N 425.499 4.018 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@]1(C)CCCS1 1696684536 ADZJRMSCOCBQRV-DEOSSOPVSA-N 443.661 4.334 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CC[C@@H](C)C(C)(C)C1 1707305382 YHEZPEFXQJBFCS-TZIWHRDSSA-N 425.621 4.467 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCS[C@H](C)C2)cc1 1710026747 OEHJICUITRUWML-UYAOXDASSA-N 429.634 4.008 10 10 IICE COCC1=CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC1 1730527124 OITBEOXUHHBYCW-UHFFFAOYSA-N 427.599 4.367 10 10 IICE CC(C)c1nnc(N(C)CC2CC(F)(F)C2)n1Cc1ccc(N2CCSCC2)cc1 1741336449 MEYDNUYNZKEKCB-UHFFFAOYSA-N 435.588 4.485 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1741382629 BJFOKTPAFUSAIP-INIZCTEOSA-N 431.635 4.190 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1741442697 GZIGSEPMYNOBTN-OALUTQOASA-N 429.584 4.125 10 10 IICE Cc1cc(-c2nnc(Nc3cnn(C)c3)n2C[C@](C)(O)C(C)C)c(C)n1-c1ccccc1 1761677441 PKLWQVXNSWENBO-DEOSSOPVSA-N 433.560 4.237 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(C)(C)c1cccs1 1763100539 XASQBFMNVXVLGF-UHFFFAOYSA-N 443.592 4.354 10 10 IICE CCc1nnc(N(CC)Cc2cccs2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764746325 KLQGUAGMABGANB-UHFFFAOYSA-N 439.629 4.186 10 10 IICE CCCCN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)cc1C 1765725848 QRTGVWOANPSYLS-UHFFFAOYSA-N 431.588 4.176 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1 1766737431 SWBOGEYPJPMLRZ-FZEVHQGJSA-N 439.629 4.358 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCC3)C(=O)N(CCCCN(C)C)C2=O)cc1 1873165699 QDBCLGDFCXNWJN-UHFFFAOYSA-N 448.611 4.048 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc(-c4cccc(Cl)c4)n3)CC2)cc1 1873831713 DTBSWXMYKVUQJN-UHFFFAOYSA-N 427.957 4.363 10 10 IICE O=C1NC(=O)N(c2ccc(O)cc2)C(=O)C1=Cc1ccccc1OCc1ccccc1Cl 2297341209 JXEMWYVBDYRLFO-UHFFFAOYSA-N 448.862 4.291 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S)Nc1ccc(F)cc1 2297349441 LFIBVJVUFJRAJB-UHFFFAOYSA-N 444.509 4.175 10 10 IICE CCCN1C(=O)C(=Cc2c(NC3CCC(C)CC3)nc3ccccn3c2=O)SC1=S 2314414628 GTDHXAXEQKPBEF-UHFFFAOYSA-N 442.610 4.296 10 10 IICE O=C(NN1C(=O)C(=Cc2cccc(OCc3ccccc3)c2)SC1=S)c1ccncc1 2314720269 JYNHJKZWTINCFT-UHFFFAOYSA-N 447.541 4.207 10 10 IICE CSc1ccc(C=C2SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)cc1 2321582863 FMEVATOFAUEUED-UHFFFAOYSA-N 431.516 4.211 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CC[C@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381136229 CDBNHENNGOXPKI-WFASDCNBSA-N 441.366 4.115 10 10 IICE CC[C@H](C)N(Cc1ccc(N(CC)CC)cc1OS(=O)(=O)CC)C(=O)c1ccco1 37402155 SSUCCYCCVAPKHB-KRWDZBQOSA-N 436.574 4.295 10 10 IICE COc1ccc(/C=C2\C(=O)N(c3ccc(Br)cc3)C(=S)N=C2O)c(OC)c1 59198486 XYMCNGUKBNDICH-DHDCSXOGSA-N 447.310 4.138 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)/C=C\c2c(Cl)nc3sccn23)cc1 211913552 FXFYNGRDTIIPNM-FPLPWBNLSA-N 426.933 4.012 10 10 IICE COc1ccc(N2CCN(C(=O)COc3c(Cl)cc(Cl)cc3Cl)CC2)cc1 302758384 NRXCJEXRDDLAHF-UHFFFAOYSA-N 429.731 4.383 10 10 IICE COc1ccc(N2C(=O)/C(=C/c3cccc(OCC(F)(F)F)c3)SC2=S)cn1 726986798 YDKYWZUWLLBUJM-ZSOIEALJSA-N 426.441 4.437 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCO[C@H](c2cccs2)C1 761654400 BIDPZANIULZQIV-SFHVURJKSA-N 437.512 4.101 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@H](c4nncn4C4CC4)C3)c2C)cc1 774696375 DPMYUWJSWZWDHY-FQEVSTJZSA-N 447.583 4.482 10 10 IICE Cc1cc(F)c(Br)cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 790639619 QQJMEYICQQPLCX-UHFFFAOYSA-N 428.308 4.216 10 10 IICE Cc1cc(C(=O)N[C@@H](c2cnn(C)c2)C2(CO)CCC2)c(C)n1-c1cccc(Cl)c1 820175069 RVJUSTYGBGCGLY-NRFANRHFSA-N 426.948 4.115 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c1C 918575942 MBMVLYPXCOQOQR-PMACEKPBSA-N 432.568 4.341 10 10 IICE COC[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(F)cc1 1122007714 HGKFYJHPZGURJE-XLIONFOSSA-N 437.462 4.083 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2([C@@H]3CCCCO3)CCC2)NC(=O)OC(C)(C)C)cc1 1136903830 MUDJFBONDKFKNT-RTWAWAEBSA-N 445.604 4.174 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cc2ccc(Br)cc2c(=O)o1 1141738193 ZCFHFQKJHSUYNZ-UHFFFAOYSA-N 443.080 4.498 10 10 IICE CCOC(=O)C(C)(C)n1cc(NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cn1 1149742441 ZPLXDTVFBGRMGG-UHFFFAOYSA-N 428.920 4.495 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCCn2cc(C(F)(F)F)nc21 1149901502 ZIXCBOGAEOEYKD-ZDUSSCGKSA-N 446.267 4.296 10 10 IICE COC(=O)c1cnc([C@@H]2CCCN(C(=O)c3sccc3-n3c(C)ccc3C)C2)s1 1168026047 MDQSGLKOWCKGNU-OAHLLOKOSA-N 429.567 4.419 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@H]1CCCOC1 1178046934 FGSLALPQSCTQIQ-OXJNMPFZSA-N 435.362 4.028 10 10 IICE COc1cc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)ncn1 1182481384 GOOFGWZUPZVJAM-KRWDZBQOSA-N 430.430 4.411 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3nc(-c4ccccc4F)cs3)C2)cc1 1248165955 HZBAIGDJPWZYBL-INIZCTEOSA-N 440.544 4.284 10 10 IICE COc1cccc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1264440162 TVIBGSHDTMFUNG-BXUJETTOSA-N 444.553 4.303 10 10 IICE Cc1cc(C(=O)NCCCc2ccc(O)cc2)c(C)n1-c1ccc(Br)cn1 1293906746 FAEBSVQPQKVYID-UHFFFAOYSA-N 428.330 4.320 10 10 IICE COCCCC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1 1312651649 WNMRMNVVQZUHMG-XMMPIXPASA-N 425.573 4.005 10 10 IICE Cc1cncc(C(=O)O[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1Cl 1337101641 WVYWTUXALTWRKT-CYBMUJFWSA-N 448.862 4.003 10 10 IICE CN(C)c1ccc(CNC(=O)[C@]2(c3ccccc3)CCN(C(=O)OC(C)(C)C)C2)cc1F 1358004225 PDUVMAGWGRVKMQ-RUZDIDTESA-N 441.547 4.087 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)N1CCN(c2ccc(OC)cc2)CC1 1435576045 AZGPGODBYIYDLA-UHFFFAOYSA-N 430.504 4.111 10 10 IICE Nc1c(Br)cccc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444985594 JPRYMUHRGJZUDM-GFCCVEGCSA-N 440.288 4.032 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1 1447173034 NUTLNDZVIYOPQR-JOCHJYFZSA-N 428.891 4.091 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1458223147 ZBORFCWRNLEOEP-OAHLLOKOSA-N 434.487 4.459 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)CSc3nnnn3C3CC3)c2C)ccc1Br 1458879072 LHDKXWDXHSJBPG-UHFFFAOYSA-N 446.374 4.461 10 10 IICE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N(CC)Cc1cc(Br)ccc1O 1465848847 DLYAQJIFTAGFOX-GUYCJALGSA-N 443.382 4.443 10 10 IICE COc1ccccc1Cc1nnc(N2CC=CCC2)n1CCCSc1nccs1 1504405773 DQMNAXKKTOTISY-UHFFFAOYSA-N 427.599 4.283 10 10 IICE C[C@H]1CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C[C@H](C)S1 1512434246 YDWJPJCGTFFWHN-GJZGRUSLSA-N 432.644 4.309 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCOC[C@@H]3c3cc(F)cc(F)c3)ccc21 1528920629 KEAZXBAZUUIAFD-HSZRJFAPSA-N 428.479 4.396 10 10 IICE Cc1cc(C(=O)CSc2nnnn2CC(C)C)c(C)n1-c1ccc(Br)cc1 1559349383 WDBDYJIIQDHVQF-UHFFFAOYSA-N 448.390 4.474 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2c(F)cccc2F)cc1F 1583752760 PGPFGPGYBSFBQO-IBGZPJMESA-N 437.462 4.052 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@](C(=O)NCCCSc2nccs2)(c2ccccc2)C1 1585228821 YGMFTSOCAQPZSU-VVOJOOEHSA-N 447.626 4.367 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCCc2ccc(Br)s2)cc1 1585443775 GEYSTZQIJAEAQQ-UHFFFAOYSA-N 425.392 4.437 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCCC3)cc2)nn1-c1ccccc1Br 1595435873 NNTKUOQUKAQTTF-UHFFFAOYSA-N 439.357 4.473 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1cccc2c1CCN(C(=O)OC(C)(C)C)C2 1623581914 YJKWRXJWRUDBDW-UHFFFAOYSA-N 445.556 4.030 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccnc(N2CCC[C@@H](C)C2)c1 1629969461 VCWJQDLQPFJFRT-OAHLLOKOSA-N 432.362 4.448 10 10 IICE Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NCc3cc(Cl)ccc3O)c2)c1 1632222992 BOXWDRGJJDEIOA-UHFFFAOYSA-N 430.913 4.085 10 10 IICE COc1cccc(Cn2cccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)c2=O)n1 1637536657 FUAZNYOFHCXZFI-UHFFFAOYSA-N 442.519 4.268 10 10 IICE Cc1cc(C(=O)N[C@H](C(C)C)C2(CO)CC=CC2)c(C)n1-c1ccc(Br)cn1 1639382032 XBWFPJJHOVDBPP-HXUWFJFHSA-N 446.389 4.335 10 10 IICE COC1CCN(c2ccc(CN(C)C[C@@H](O)c3ccccc3Br)cc2)CC1 1643431860 YBKKFYWIXMZECT-JOCHJYFZSA-N 433.390 4.230 10 10 IICE CC(=O)N(c1ccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1)[C@@H]1C[C@@H]1C 1670258216 HQDRXIKZLAIPAM-PDIWNELESA-N 437.540 4.367 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H]1CCCC[C@H]1c1ccccc1 1676126819 XUYKQHRYPLNZET-LOSJGSFVSA-N 448.611 4.256 10 10 IICE CC[C@@]1(C(=O)OC(C)(C)C)CCCN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 1682188068 FMKDOEVXOVTDJY-UQBPGWFLSA-N 445.604 4.065 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC4(C3)CN(C(=O)OC(C)(C)C)C4)c2C)c1 1683307727 MFVOREHZMPCPJP-UHFFFAOYSA-N 438.572 4.165 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCC[C@@H]3CC3(O)CCCCC3)C2)cc1 1683340112 PMGCDNVLGZENLU-IFMALSPDSA-N 429.605 4.171 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 1684280560 MSGPKKCZIWUOKL-LJQANCHMSA-N 447.501 4.366 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3c(F)cccc3F)C3CCCC3)cc2)CC1 1684873048 DQKBUFAVNIZLPP-UHFFFAOYSA-N 442.554 4.371 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCOC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694010806 VPBXRPNEBSOQSG-GOSISDBHSA-N 447.599 4.067 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C[C@H](C)O1 1694919939 KJVGMCVLIQZTTL-SIKLNZKXSA-N 437.588 4.393 10 10 IICE C=CCO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)COC)C1 1705916855 OUXGRKNRDKVVGO-AUSIDOKSSA-N 449.599 4.416 10 10 IICE Cc1nc(C)n([C@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)n1 1725882341 UXDYPNWIPPSZBC-KRWDZBQOSA-N 446.650 4.090 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1726902895 AWIYDXAYEJPJCA-FHWLQOOXSA-N 429.584 4.440 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCCOC4)n3CCC=C(C)C)CC2)cc1 1730180900 VUETZLCZMNDELH-NRFANRHFSA-N 439.604 4.254 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)C3)n2CCCNC(=O)C(C)C)c(C)n1-c1ccccc1 1761676605 OJPWZQQBFAMKGZ-LJQANCHMSA-N 448.615 4.361 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCSC1 1764229087 QEXQFIIFZWXHBX-QHCPKHFHSA-N 425.602 4.067 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1766613605 HYOOBGMAZGYGAP-DEOSSOPVSA-N 448.615 4.164 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)cc1[N+](=O)[O-] 1860084363 MFSFDRPZXPFOLJ-VIZOYTHASA-N 446.535 4.335 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4ccc5nc[nH]c5c4)cc3)CC2)cc1 1872883949 DXDHKNUOYZAYGD-UHFFFAOYSA-N 441.535 4.146 10 10 IICE O=C(Nc1nccs1)[C@H](c1cc(F)ccc1O)n1cc2cccc(Br)c2n1 1887582252 FYUQVOCKEMAGQO-INIZCTEOSA-N 447.289 4.328 10 10 IICE [N-]=[N+]=NCCCC[S@](=O)c1cc(I)ccc1Br 2300795665 ZMGGPWXTKIFXQM-KRWDZBQOSA-N 428.093 4.252 10 10 IICE CCOc1ccc(NC(=O)COc2ccc(Cl)cc2C=C2SC(=S)NC2=O)cc1 2314485645 AOOQOEYHTNNZFJ-UHFFFAOYSA-N 448.953 4.245 10 10 IICE COc1cccc(S(=O)(=O)c2nnn(-c3ccc(N)cc3)c2-c2ccc(Cl)cc2)c1 11730818 LRNKUXSMMVDUAU-UHFFFAOYSA-N 440.912 4.011 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)cc1 47152177 HQXRYXWUUWRLBH-ATVHPVEESA-N 427.507 4.133 10 10 IICE Cc1ccccc1Oc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(C(C)C)C1=O 213174966 YQGRFAFESHEBAG-ATVHPVEESA-N 437.546 4.405 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(N(C)C)c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526503986 MGPOJNKXCTULRU-HSZRJFAPSA-N 432.476 4.230 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)N(CCSc2ccc(F)cc2)c2ccccc2)c1 742007719 QNENLLBICWBVDY-GHXNOFRVSA-N 435.524 4.419 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 753207910 RGSBLMPPPUHXDE-NVQXNPDNSA-N 445.563 4.468 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc([C@@H]2CCCOC2)c1 768532757 GTEBXRZIDDHZSE-RUZDIDTESA-N 433.596 4.043 10 10 IICE Cc1ccc(COC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c(C)n1 771985093 MQDZTSASTXVGOZ-GZTJUZNOSA-N 432.592 4.485 10 10 IICE CCc1cc(NC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)ccc1C 778287579 PZSGFQANGPNIHF-UHFFFAOYSA-N 448.546 4.135 10 10 IICE O=C1COc2cc(C(=O)Nc3cccc(N4CCCCCC4)c3)c(Br)cc2N1 782709864 YSHPXWBNRSKCLO-UHFFFAOYSA-N 444.329 4.413 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(CN2CCCC2)c1 791249341 FESRNAOEDLSDLK-UHFFFAOYSA-N 437.584 4.285 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCc2sc(Cl)cc21 813590253 JSUJYZVPDFMVQF-QGZVFWFLSA-N 437.968 4.379 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1n[nH]c2ccc(Br)cc12 820002291 OFQNGGOSTAVYOV-UHFFFAOYSA-N 433.269 4.287 10 10 IICE CCOC(=O)[C@@H](C[C@@H]1CCCO1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1133413104 RVTWIUCOSVZBJW-SIKLNZKXSA-N 438.528 4.399 10 10 IICE Cc1cc(C(=O)NC[C@@]2(N(C)C)CCSC2)c(C)n1-c1ccccc1Br 1137150934 BGKCVOHOPNZFTA-FQEVSTJZSA-N 436.419 4.024 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1142370531 CSMPMQBQWOWSNF-YDIMBITNSA-N 444.019 4.390 10 10 IICE COc1ncc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cn1 1160646831 VTHPTXGKEUFTLO-SFHVURJKSA-N 430.430 4.411 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3ccc(Cl)c(Cl)c3Cl)nc12 1192781035 PNDKJCVBGOPRFG-SECBINFHSA-N 443.718 4.423 10 10 IICE CO[C@@H]1CCC[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1 1289511108 ZDKCBWPUYXFZQC-DZGCQCFKSA-N 429.318 4.303 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(Sc3nncn3C)cc2)cc1 1290618741 FEJRKGFXMIBMOP-UHFFFAOYSA-N 445.548 4.368 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccccc2)c1 1301046445 AFMVXKKTIIQATP-UHFFFAOYSA-N 430.913 4.085 10 10 IICE FC(F)[C@@H]1CCCN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)C1 1302950399 SVUXPFHVKPLMQN-CABCVRRESA-N 443.589 4.293 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1305554756 RJUQDKAXYALCDH-VQIMIIECSA-N 439.526 4.454 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@H](C)N(c3ccc(F)cc3)C2=O)c(C)n1-c1ccc(F)cc1 1307275060 ZYEMXBIFIXAENY-INIZCTEOSA-N 437.446 4.412 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C\c3ccc(F)c4ccccc34)cc2)C1 1351135853 VSMVRZIYMSWYEE-QNOJTCODSA-N 431.511 4.010 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc([N+](=O)[O-])ccc1F 1351312675 RVNPHSNPUOVUMJ-SXGWCWSVSA-N 449.460 4.103 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C 1360848479 WBSVEGWASQTSTI-IBGZPJMESA-N 431.577 4.342 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CCCN(CC(F)(F)F)C1=O 1446807488 UWJPGLIBFLOSSS-VQIMIIECSA-N 434.458 4.283 10 10 IICE CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)NCc1cc(Cl)cc(Cl)c1O 1450721779 NYENBDOLCPLHEV-UHFFFAOYSA-N 432.647 4.149 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CC1 1468657930 VUVQMODQKGXZJN-UHFFFAOYSA-N 439.491 4.074 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](CO)c3ccccc3C(F)(F)F)ccc21 1472031253 MRFNDTUEUYFZOR-FQEVSTJZSA-N 434.458 4.387 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cnc4sc([N+](=O)[O-])cc4c3=O)c2C)c1 1473029694 SBRUIKRXQJYCCL-UHFFFAOYSA-N 436.493 4.273 10 10 IICE CCN(Cc1cccc(-c2ccncc2)c1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1479030533 KOSOKGLNLLKMNG-UHFFFAOYSA-N 444.579 4.441 10 10 IICE CCc1cnc(CCn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)s1 1498135577 OBJKFZUXWXIBBI-UHFFFAOYSA-N 434.569 4.252 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCc1nccs1 1503487920 PGTSLFTWRXITPQ-UHFFFAOYSA-N 426.933 4.035 10 10 IICE CCN(CC)CCOc1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cc1 1516250779 OTPSLBURYXWFFH-UHFFFAOYSA-N 429.524 4.369 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H]2C2CCC2)n1Cc1ccc(N(C)C)c(F)c1 1519297122 IQSACFNYOOBYQB-UWJYYQICSA-N 445.583 4.024 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4ccccc4F)c3C(F)(F)F)C2)cc1 1528318905 ZSBUKQHMOKSBBP-CQSZACIVSA-N 448.420 4.048 10 10 IICE COc1cc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)ccc1OCc1cscn1 1528923608 CIQNWBQOKYICCD-QGZVFWFLSA-N 439.581 4.466 10 10 IICE C[C@H](NC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1)c1ccc(N(C)C)cc1 1537679049 DOZMFABVJKGWFI-HTAPYJJXSA-N 439.625 4.443 10 10 IICE COc1cc(OC)cc(N2CC[C@H](NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)c1 1545173747 DXXIZLBNZXCBDA-IBGZPJMESA-N 437.515 4.259 10 10 IICE Cc1nc2c(F)cccc2cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632492 NGIAZQXOPSEYTN-GOSISDBHSA-N 427.907 4.436 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1COCCO1 1547132032 HEGRLRGMDYBLDC-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CC[C@H]1C 1554592522 OCBUSOWZOKDVHX-LYHRCORUSA-N 437.588 4.249 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(-c2ccc(OC)cc2)cc1F 1557114985 RCXPRIICBKBSBU-UHFFFAOYSA-N 437.467 4.412 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H]2CCCO2)c(C)n1-c1cccc(Br)c1 1558606723 DHFRAUFUIRAAMP-PMACEKPBSA-N 447.373 4.267 10 10 IICE CC(C)(NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(F)c(F)c1 1559695674 FIMGAXUCRBLADN-UHFFFAOYSA-N 434.442 4.204 10 10 IICE CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1564594225 WPYYRRNESWRXMM-HVETUWLQSA-N 432.996 4.084 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C)c(Br)o1 1568378699 KLEIUVLFQLPALT-UHFFFAOYSA-N 437.334 4.353 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)CC2)cc1 1596732710 GJUUAUSOLUDIKZ-UHFFFAOYSA-N 439.556 4.419 10 10 IICE C[C@H]1CCCCN1CCCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1612770704 HAIJRWTVFHEOGG-NRFANRHFSA-N 448.615 4.261 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2CCCSc2nccs2)C[C@H]1C 1615768117 IXLJBLWJEHZTOJ-IAGOWNOFSA-N 436.695 4.425 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1617070489 WNMJOOGAILYZNM-HXUWFJFHSA-N 437.588 4.394 10 10 IICE CN(CC1CCOCC1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1618140809 YXBAUKUEUIDXIY-KRWDZBQOSA-N 437.635 4.021 10 10 IICE CN(CCc1cnccn1)c1nnc(C2CCCC2)n1CCCSc1nccs1 1618189092 XVCLJDYBOPNSSY-UHFFFAOYSA-N 429.619 4.044 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cccc2c1CCN(C(=O)OC(C)(C)C)C2 1624479767 NJWHVNVVIWGRPA-UHFFFAOYSA-N 437.584 4.247 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(Br)cc2F)cc1 1626106629 QAVWLGGIBYNOFP-FQEVSTJZSA-N 449.364 4.405 10 10 IICE Cc1cc(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c(C)n1-c1ccc(Cl)cc1 1628961587 YIMWXXDDEHRBHT-QHCPKHFHSA-N 437.971 4.244 10 10 IICE CCOC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1629013397 NWWQYGBRZPOWGU-LJQANCHMSA-N 447.535 4.336 10 10 IICE COc1cc2c(cc1CNC(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)O[C@H](C)C2 1630920518 OAQQRNFEVVAKNA-QGZVFWFLSA-N 432.520 4.477 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(F)c(Br)c1 1631425992 VCISIEOBXSKNKM-OAHLLOKOSA-N 441.728 4.342 10 10 IICE CCN(CC)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1636063277 FASNXBBSZJYBNB-RUZDIDTESA-N 445.563 4.116 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCCS(=O)(=O)C[C@@H]3c3ccccc3)c2C)c1 1636235663 WZLMKXRDOMNOTE-XMMPIXPASA-N 436.577 4.405 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C 1638570226 WSSDLHPFCBGEAY-SFTDATJTSA-N 439.556 4.328 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cc(O)c(Cl)cn1 1639373350 CBWVKAPTJUPSIK-NTUHNPAUSA-N 439.971 4.122 10 10 IICE COC(=O)/C=C\c1ccc(N(Cc2ccc(Cl)cc2)Cc2cnn(C)c2)c([N+](=O)[O-])c1 1642648827 LTUAHORIYVGADK-POHAHGRESA-N 440.887 4.375 10 10 IICE COC(=O)[C@@](C)(Cc1ccc(F)cc1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1644514108 ZMKNYDUBJQKHMQ-RUZDIDTESA-N 438.499 4.146 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](C(=O)NCc2cccc(Cl)c2O)(c2ccccc2)C1 1648609203 UARIMPWGYCUQBC-HSZRJFAPSA-N 430.932 4.241 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(Cc2nc([C@@H]3C[C@@H]3C)no2)CC1 1673743165 AYSLYNQJCJOKJU-NPPFBWRTSA-N 439.604 4.163 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](COC(=N)O)Cc3ccccc3)c2C)c1 1683304319 WNDLUKSREFSOER-JOCHJYFZSA-N 434.540 4.322 10 10 IICE CCOC[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1696378282 MMLRYTHXYVGHEL-FQEVSTJZSA-N 443.661 4.040 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)Cc1cccs1 1724235495 ORNMXCJWARNLNK-UHFFFAOYSA-N 432.597 4.385 10 10 IICE C[C@H]1CCC[C@@H]1Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1726540209 USXAABNEWWJBDC-PZJWPPBQSA-N 425.621 4.485 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1749972021 PPMUNUWKDBOIOT-UYAOXDASSA-N 447.599 4.128 10 10 IICE CC(C)Cc1nnc(N2CCO[C@@](C)(C(C)(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1750758264 RWZGIVJKXJKVIC-XMMPIXPASA-N 431.600 4.371 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866014599 GDDAZZQJOLLFIY-XOBRGWDASA-N 447.366 4.466 10 10 IICE COc1ccc(-n2nc(C(=O)Nc3ccc(Oc4ccc(N)cc4)cc3)c(=O)cc2C)cc1 1866284914 KVTDNAIVXYJGSL-UHFFFAOYSA-N 442.475 4.176 10 10 IICE CN(Cc1nccn1Cc1ccccc1)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 1915031554 CJTUOQODIYQIPH-UHFFFAOYSA-N 447.583 4.443 10 10 IICE CCOC(=O)N1CCN([C@H](c2cccc(C)n2)c2cc(Cl)c3cccnc3c2O)CC1 2059179277 HKSLDXZEOXQWGZ-NRFANRHFSA-N 440.931 4.161 10 10 IICE COC(=O)c1c(C)nn([C@@H](c2cc(C)c(C)cc2O)C(C)C)c1I 2079927220 NLSBEQDAKVMHEP-MRXNPFEDSA-N 442.297 4.151 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NCc2ccc(Br)cc2O)C12CCC2 2118413758 QQJQVPZNRCZAKD-YOEHRIQHSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NCc2cccc(Br)c2O)C12CCC2 2118417123 CAZJWIYDROOFKH-GOEBONIOSA-N 425.367 4.328 10 10 IICE CN(C)C1=NC(=O)/C(=C2/C(=O)N3c4c2cccc4[C@@](C)(c2ccccc2)CC3(C)C)S1 2185889191 IYHAOEREACNPBD-GYKXOELXSA-N 431.561 4.424 10 10 IICE CN(C)c1ccc(C=C2C(=O)NN(c3ccc(Br)c4ccccc34)C2=O)cc1 2294623646 MKYSFDVPZLYKMZ-UHFFFAOYSA-N 436.309 4.130 10 10 IICE CC(=O)c1cccc(NC(=O)C(=Cc2ccc(N(C)C)cc2)NC(=O)c2ccccc2)c1 2297315521 JCGIHPZJFBCESR-UHFFFAOYSA-N 427.504 4.365 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=CNCCc2ccccc2)cc1 2297347899 GLLDRGKFRYTSNX-UHFFFAOYSA-N 442.475 4.071 10 10 IICE Cc1ccc(CN(C)C(=O)C(C)(C)[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2380761502 GVSIRLQMVLIPTK-ZDUSSCGKSA-N 443.382 4.361 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)ccc1O 14459049 XYSAVTXIARQLBC-BSRJHKFKSA-N 426.538 4.012 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccc(O)cc3)SC2=S)cc1 15047365 CFUFYCWUFDHDMC-FDIDITGRSA-N 428.535 4.019 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 15047413 JNEWKRPCIVFFKZ-FDIDITGRSA-N 430.526 4.453 10 10 IICE COCCNc1nnc(SCC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)s1 23581600 BDWJWEXQERRZCR-UHFFFAOYSA-N 434.562 4.426 10 10 IICE COc1cc(OC)c(/C=C2\C(=O)N(c3cccc(C)c3)C(=O)N=C2O)cc1Br 33322195 CPFFRPBKWYWOSY-ZSOIEALJSA-N 445.269 4.281 10 10 IICE CCOc1ccc(O)c(/C=C2\C(=O)N(c3cc(OCC)ccc3OCC)C(=O)N=C2O)c1 59104929 ZGLUWSUNVWXVQV-ATVHPVEESA-N 440.452 4.095 10 10 IICE O=C(COc1ccc(/C=C2/SC(=S)NC2=O)cc1)Nc1ccccc1C(F)(F)F 210893717 WXBOFLIIOJJAHZ-OQLLNIDSSA-N 438.452 4.212 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc3c(c2)CCCC(=O)N3)C1 435871142 RCYNAIBPLPAONY-UHFFFAOYSA-N 430.552 4.321 10 10 IICE Cc1ccc(OCCCN(c2cccc3c2C(=O)c2ccccc2C3=O)S(C)(=O)=O)cc1 586185665 BQVBUEJULHVYGG-UHFFFAOYSA-N 449.528 4.006 10 10 IICE O=C(O)/C=C/c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c(Br)c1 705929624 GUFTVCVQXIEFBT-YUVOTWOWSA-N 427.342 4.115 10 10 IICE CC(C)COC1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903973 LBCRVUOPTMXPQO-QGZVFWFLSA-N 425.520 4.103 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1 767772449 IKBZBHGUACWLJG-UHFFFAOYSA-N 447.531 4.084 10 10 IICE Cc1cccc(C2(O)CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)c1C 768249128 OQTCYUCBIDJLJJ-UHFFFAOYSA-N 439.625 4.050 10 10 IICE Cc1sc(NS(=O)(=O)c2csc([N+](=O)[O-])c2)nc1-c1c(F)cc(F)cc1F 768857823 KCTSDFQXOYLQSZ-UHFFFAOYSA-N 435.430 4.306 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)c(C)n1-c1ccc(F)cc1 771410995 WHUZUYOJYOJRQH-HSZRJFAPSA-N 437.559 4.488 10 10 IICE Cc1nc([C@H]2CCCN2C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cs1 773238318 UDGRPXBIGYAHQT-VTJXTGGHSA-N 432.565 4.251 10 10 IICE Cc1nc2c(s1)[C@H](NC(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)CCC2 780821139 OTKPBQVYXDTFRS-CKFHNAJUSA-N 432.565 4.081 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cc(C)cc(Br)c2O)C1 781912553 QOWNMJOZNPLGDD-CYBMUJFWSA-N 437.300 4.086 10 10 IICE CC(=O)[C@H](C)CCCCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 783222121 NWBOWMUIXCBODE-WBVHZDCISA-N 449.503 4.118 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NCc1cc(Cl)cc(Cl)c1O 805365609 UYTRVPMXONTUCT-NHYWBVRUSA-N 432.348 4.144 10 10 IICE CCOC(=O)c1c(NC(=O)CO[C@H](C)c2nccn2C)sc(C)c1-c1ccc(F)cc1 808054832 BCINCNUCASHAPY-CYBMUJFWSA-N 445.516 4.489 10 10 IICE Cc1cc(C(=O)COC(=O)c2cccc(N3CCOC3=O)c2)c(C)n1-c1ccc(F)cc1 919199346 XCXHWRFQNOBDRE-UHFFFAOYSA-N 436.439 4.230 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)cc1 1125234393 AXQUEJRKFAGMER-QFIPXVFZSA-N 425.573 4.490 10 10 IICE CC(=O)c1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1OC(C)C 1127181572 JRDVWIDOQQCFJV-UHFFFAOYSA-N 449.595 4.138 10 10 IICE Cc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1128383910 GMFKNUOPZKHSDJ-GOSISDBHSA-N 449.016 4.365 10 10 IICE COc1cc([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1S(C)(=O)=O 1181301538 QPPNOHZALXRSGG-OAHLLOKOSA-N 444.528 4.136 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3ccc(Br)c(Cl)c3)CC2)cc1 1264733192 QOAAXBBUTZOTAI-UHFFFAOYSA-N 437.765 4.393 10 10 IICE C[C@H](CSc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266259188 SUZLXEITIWJQGM-LJQANCHMSA-N 441.616 4.402 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cccc2ocnc12 1269441428 HRMNOGLCRJQMSI-MHWRWJLKSA-N 427.482 4.197 10 10 IICE Cc1cc(CC(=O)NCCCCn2cc(Br)cn2)c(C)n1-c1ccccc1 1271501364 UKXNGBPTGHTBIY-UHFFFAOYSA-N 429.362 4.192 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1cccnc1OCC(F)(F)F 1287365904 YVPJOKWZVDLTLL-UHFFFAOYSA-N 449.477 4.203 10 10 IICE C[S@](=O)(=NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1 1289018872 JOALZNWTVBSKCO-ZTCWRLSJSA-N 448.566 4.101 10 10 IICE CNC(=O)c1ccc(CN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C2CC2)cc1 1292486777 GFRHPYCHZKFRDW-UHFFFAOYSA-N 443.547 4.379 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2cccnc2)n1CCOC(C)(C)C 1298313610 CENPDAWZLOGGCL-UHFFFAOYSA-N 434.588 4.392 10 10 IICE CC(C)Cc1nnc(N2CCN(CCC(C)(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1302965329 QXCMBLLPKKSCCY-UHFFFAOYSA-N 444.643 4.288 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H]2CCCO2)c(C)n1-c1ccccc1Br 1304200018 FQCNEQNNFNPLBU-QZTJIDSGSA-N 447.373 4.267 10 10 IICE Cc1nnc(N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)n1CCCSc1nccs1 1304786173 BNVMVLFOBWLNEJ-POXGOYDTSA-N 435.644 4.160 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CC[C@@H](C)[C@@H](O)C2)cc1 1313678749 HRXVYPDURHRPAK-GCJKJVERSA-N 439.629 4.032 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cncc(-c4cccc(C)c4)c3)CC2)cc1 1353706665 JEGOCZADNKNUOX-UHFFFAOYSA-N 444.579 4.008 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)cn2C)nnc1N(C)C1CC1 1361095560 MYILVEFOUCWASD-UHFFFAOYSA-N 443.393 4.067 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Br)cc3c2OCCO3)cc1 1440671262 CTFXACSBVUNOPI-UHFFFAOYSA-N 433.346 4.339 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@@H](O)C(F)(F)F 1447085155 WMYCVCDQYKUMHL-JKSUJKDBSA-N 433.268 4.288 10 10 IICE Cc1cc(CC(=O)N2CCC(N3CCOC[C@@H]3C)CC2)c(C)n1-c1ccc(Cl)cc1 1450520977 DUSXWCSCXHTKTN-SFHVURJKSA-N 429.992 4.002 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC(C)(C)O[C@](C)(C(F)(F)F)C2)CCCC1 1460428972 AVDHHCYEZLBFQX-QFIPXVFZSA-N 438.490 4.487 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)cc2)CC1 1462809906 SVYABARCZGEYIH-SFTDATJTSA-N 446.378 4.115 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@@H]1CSCCS1 1503488325 SQBVLUFTMBPLND-MRXNPFEDSA-N 448.017 4.184 10 10 IICE CCC(O)(CC)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1513521421 LTXYECYILOBZDE-QFIPXVFZSA-N 441.620 4.307 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CCc3nncn3CC2)sc(C)c1-c1ccc(C)cc1 1524869761 NSXRGWGTPIDFOW-KRWDZBQOSA-N 438.553 4.391 10 10 IICE CC(C)(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1F 1527864175 LEAJQXAPXMCYJO-UHFFFAOYSA-N 426.866 4.188 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cnn4cc(Br)cnc34)c2C)c1 1531612809 XJTONRVSRLCSRP-UHFFFAOYSA-N 438.329 4.138 10 10 IICE CC(C)(C)[C@@H]1CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CCO1 1541167279 CIUUCMSDXPPNDH-KRWDZBQOSA-N 444.630 4.230 10 10 IICE Cc1ccc(-c2nnc(N3C[C@H](C)S[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1542316277 CBYPYXUEMLDZAA-IYBDPMFKSA-N 429.565 4.430 10 10 IICE CCC(=O)N[C@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(CC)CC)cc2)C1 1545164936 NEZACBLZVGTBIV-CTNGQTDRSA-N 440.636 4.181 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3OCc3c(C)noc3C)C2)cc1 1557133799 YCSNHZNLLUECDP-LJQANCHMSA-N 435.524 4.135 10 10 IICE C/C(=C\C(=O)N1C[C@H]2CCCCN2c2cc(Br)c(F)cc21)c1cnccn1 1583070300 HUBLYVFJZMHUCH-MAUPQMMJSA-N 431.309 4.187 10 10 IICE COc1ncc(Br)cc1CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1584788453 QFMQCUKNRCTLRO-UHFFFAOYSA-N 432.293 4.329 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(OCCC(C)C)c(OC)c3)C2)cc1 1585665397 RMPAANWYQCCBJJ-IBGZPJMESA-N 426.557 4.385 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1c(O)cccc1F)c1ccc([N+](=O)[O-])cc1Cl 1596912273 NKVBIYSVLVZUKJ-UHFFFAOYSA-N 443.818 4.275 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C(=O)OC(C)(C)C)CC[C@@H]3C)ccc21 1598054525 ZLLSSZSTCZBZAA-OXJNMPFZSA-N 428.573 4.487 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@@H]1c1cnn(C)c1 1611963447 QQVAYOUTLHOPKR-JOCHJYFZSA-N 435.620 4.364 10 10 IICE CC[C@@H](Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1613636903 OBWQDDJKDOKBNJ-VXKWHMMOSA-N 427.593 4.181 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3CCC3CCCCC3)CC2)cc1 1616347327 PSVZFLYQWCLGSW-NOZRDPDXSA-N 429.649 4.003 10 10 IICE C[C@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1620752769 BDUQAYIEOSVWJT-CRAIPNDOSA-N 434.458 4.421 10 10 IICE CCCc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)[nH]c(C)c1C(C)=O 1622634753 HVMAQULKSGIPLR-GOSISDBHSA-N 431.964 4.232 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)c(OC)c1 1623764105 IZRQOPJTCSCICZ-HKUYNNGSSA-N 432.923 4.339 10 10 IICE Cc1cc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2F)c(C)n1-c1cccc(Cl)c1 1623837520 ZMKAPTOTHNOMJU-NRFANRHFSA-N 425.891 4.200 10 10 IICE Cc1cc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2F)c(C)n1-c1ccc(Cl)cc1 1632605024 ZZXKURWXIFPWKY-OAQYLSRUSA-N 425.891 4.200 10 10 IICE Cc1cc(C(=O)NC[C@H](C)Oc2ccccc2)c(C)n1-c1ccc(Br)cn1 1633775988 QGXQIPTVZZQRFV-HNNXBMFYSA-N 428.330 4.449 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3CCN([C@@H]4CCSC4)CC3)cc2Cl)C1 1634023207 WWPITSXIQQNQBT-YLJYHZDGSA-N 436.065 4.410 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(O)cc(Br)c1 1634753613 PNTJOWVIRXZGMN-CQSZACIVSA-N 441.272 4.155 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCN(C(=O)C(F)(F)F)C2)c(C)n1-c1ccc(Cl)cc1 1643911404 YRZMDQXZGBCMIA-OAHLLOKOSA-N 441.881 4.278 10 10 IICE COC(=O)c1sc2c(c1Br)CN(Cc1cc(Cl)cc(C(C)=O)c1O)C2 1643988151 RWDDCHZUUVUGQA-UHFFFAOYSA-N 444.734 4.375 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ncc(-c3ccccc3)[nH]2)cc1 1645115559 BANRRZDXICEVTM-UHFFFAOYSA-N 426.520 4.198 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H]1c1ccc(F)c(F)c1 1673472297 GHUWBZOYTAFYKD-FQEVSTJZSA-N 437.437 4.126 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)N(C)C)cc1 1684890313 WCXMOXOHANAUFU-VJBWXMMDSA-N 445.007 4.228 10 10 IICE C#C[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1nnc(C)s1 1705479455 LVZAWCMUSGHNTD-INIZCTEOSA-N 445.596 4.213 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1709220956 WODIANOKQBYXHO-PXNSSMCTSA-N 434.588 4.114 10 10 IICE Cc1cccc(-c2nnc(N3C[C@@H](C)S[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1724487035 MVYGLGZKEAOLGU-IAGOWNOFSA-N 440.592 4.232 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC(C(C)C)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1762429764 LTRXPVLAKBNZTA-UHFFFAOYSA-N 449.647 4.435 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@H]2CCCO2)n1CCCC(C)(C)C 1768651868 ZAYFRCDMUOJILX-JOCHJYFZSA-N 441.620 4.429 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C(F)F)c(CN)c2I)cc1C 2079853573 GAKIYOBFKCBRCG-HNNXBMFYSA-N 447.267 4.206 10 10 IICE CCc1cccc(CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c1O 2084739945 XKCMFNRTRMZDNA-HSZRJFAPSA-N 439.600 4.166 10 10 IICE C[C@H](NCc1cc(Br)ccc1O)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116250707 IXVNJISBPXSNJM-SJCJKPOMSA-N 425.323 4.492 10 10 IICE COc1ccc(Br)c(CN[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)c1O 2236053921 BTDNCBBXNWLWFL-JIPZTSHUSA-N 433.390 4.410 10 10 IICE Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCCOc3ccccc3)C2=O)c1 2293199824 LFURPYXEGPXQPH-UHFFFAOYSA-N 442.471 4.119 10 10 IICE CCOc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(SC)SC4=NC3=O)c2C)cc1 2297469174 NBQNJUKYYYQTGI-UHFFFAOYSA-N 439.566 4.433 10 10 IICE Cc1ccc(-c2ccc(C=C3C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)cc1[N+](=O)[O-] 2313560399 RVAGNIPPGWWFPC-UHFFFAOYSA-N 431.404 4.172 10 10 IICE O=C1NN(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(-c2ccccc2F)o1 1186370 CAGMLCFVBGMYSY-LFIBNONCSA-N 427.229 4.310 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3ccccc3Cl)nc3ccccn3c2=O)SC1=S 39835654 JUUKUWOEXRZNBA-RVDMUPIBSA-N 443.937 4.361 10 10 IICE Cc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)c1 47152176 MCLBRFYKKNJOJE-ATVHPVEESA-N 427.507 4.133 10 10 IICE CCN(CCOC)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)C(F)F)cc1 254499490 AISGLEIJQNVNRL-UHFFFAOYSA-N 442.444 4.479 10 10 IICE Cc1ccc2oc(SCC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)nc2c1 303645917 SSJYEBQLBRUCRW-HZPDHXFCSA-N 443.544 4.297 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)C1 435542120 AUWNSHFBPLWQRY-UHFFFAOYSA-N 445.567 4.330 10 10 IICE C[C@H](NC(=O)N1CCC(CN2CCc3ccccc32)CC1)c1ccc(N2CCOCC2)cc1 732242798 IYBFJZNPMAISHR-NRFANRHFSA-N 448.611 4.069 10 10 IICE C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754245446 GXBXLVRJOMMNNL-CCEZHUSRSA-N 431.439 4.385 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCC(=O)c1ccc(F)c(F)c1 755828957 LJCKSJFUVHNXDV-UHFFFAOYSA-N 426.257 4.445 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCCCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 758179072 OJQQVZLYGWEKSV-VXKWHMMOSA-N 445.604 4.003 10 10 IICE Cc1cc(C(=O)COC(=O)c2cc(F)cnc2Cl)c(C)n1-c1ccc2c(c1)OCO2 767757753 QQILQTNDFWSFNH-UHFFFAOYSA-N 430.819 4.050 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](c3c(F)cccc3F)C(F)(F)F)CC2)cc1 776016133 DLHZHXFTGWPGAE-SFHVURJKSA-N 429.389 4.109 10 10 IICE CC(C)(C)c1noc(-c2ccccc2C(=O)NCc2cc(Br)ccc2O)n1 804739584 KLADIVNIIBPLCX-UHFFFAOYSA-N 430.302 4.432 10 10 IICE Cc1cc(C(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)c(C)n1-c1cccc(C(C)C)c1 856607897 SMEQKQWAQBZYNC-BJKOFHAPSA-N 444.579 4.208 10 10 IICE CCOc1c(Cl)cccc1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1125187854 JTMHNXVKOYILIT-HZPDHXFCSA-N 434.939 4.350 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)c(C)n1-c1ccc(Cl)cc1 1129370308 MIEBVVNAJDTPSL-LJQANCHMSA-N 439.918 4.351 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3C(=O)c3ccc(C)cc3)C2)cc1 1142799099 YWTCRWJPMKAQCV-FQEVSTJZSA-N 428.532 4.491 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)N(C)C)cc1 1158717380 NVPJZEWXOHVHFY-FQEVSTJZSA-N 446.473 4.058 10 10 IICE CCOCCNC(=O)CSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 1188225961 NUFXWIOFZUMRSD-UHFFFAOYSA-N 429.973 4.497 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3csc(C4CCCCC4)c3)cc2)C1 1264737776 HIJNPZBXTPEXEB-LJQANCHMSA-N 425.598 4.428 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc4ccc(C(F)(F)F)cc4nc3O)CC2)cc1 1291855825 DTWQBOGLEKTAHK-UHFFFAOYSA-N 445.441 4.320 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1-n1c(C)cc(C=O)c1C 1295868321 ZBGFBGUAPRGDSU-KRWDZBQOSA-N 438.549 4.110 10 10 IICE Cc1ccc(C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)cc1-n1c(C)cc(C=O)c1C 1298023468 BDPJZAYHNLOVCD-YFNKSVMNSA-N 448.567 4.339 10 10 IICE Cc1ccc(C(=O)N[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1305572103 WNQGUMPKGKZLNW-BGYRXZFFSA-N 425.529 4.001 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CSCc3cccc(Cl)c3)cc2F)CC1 1435077484 WPLCARBZAXZFBN-UHFFFAOYSA-N 435.996 4.171 10 10 IICE CC(C)c1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)nc1 1444515867 WDRQTHCHMONCFW-NRFANRHFSA-N 426.561 4.267 10 10 IICE CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1458023937 YYNVLMNEXQXFQK-QGDZQMKYSA-N 441.660 4.312 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4F)C3=O)c2C)cc1C 1472984701 PQUQDVHBKACXMC-SANMLTNESA-N 447.510 4.500 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2cnc(C)s2)cc1 1515531685 KBGHCIAQXOMVGQ-LJQANCHMSA-N 440.617 4.078 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cccc(S(=O)(=O)C(F)F)c2)cc1 1533209136 ARUOESHXBIYRPU-UHFFFAOYSA-N 448.491 4.185 10 10 IICE C[C@]1(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CC1(Cl)Cl 1534129649 IXIJVIOEKWGXSK-INIZCTEOSA-N 425.278 4.132 10 10 IICE O=C(C[C@@H]1C[C@H]1Cc1ccccc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1534129741 LXDQCLYGCZJEMX-UXHICEINSA-N 432.486 4.427 10 10 IICE COc1ncc(/C=C\C(=O)N2CCCc3c(NC(=O)CC4CCCCC4)cccc32)cn1 1537253838 SRUJMDPFCAVSHV-SEYXRHQNSA-N 434.540 4.387 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)C1 1537815371 RQITYNVEYHXRBN-NFQMXDRXSA-N 432.612 4.215 10 10 IICE COc1cncc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1C 1538920716 WHEPJDLDIGRYEE-UHFFFAOYSA-N 438.285 4.123 10 10 IICE COc1cccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1OC(C)C 1539582073 ONYQDEUFTYOQQG-INIZCTEOSA-N 434.483 4.483 10 10 IICE CN(c1ccc(CNC(=O)[C@H](C[C@H]2COCCO2)C(F)(F)F)cc1)C1CCCCC1 1542412359 XRRFEMKNJFTPAQ-PMACEKPBSA-N 428.495 4.056 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@@]2(F)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1544267348 DSQIYLAHBNYHNA-TYBLODHISA-N 441.547 4.320 10 10 IICE COC(=O)c1cc2c(cc1NC(=O)c1cc(C)n(-c3ccc(F)cc3)c1C)OCCCO2 1557945606 CGZBMNHLLYCHJZ-UHFFFAOYSA-N 438.455 4.433 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)cc2)CC(C)C)cc1 1559919147 AMNNDDXNNXIDMV-BGYRXZFFSA-N 425.573 4.410 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](c3ccccc3C)C(C)(C)C)CC2)cc1 1566233168 VPBBHVDCIHYYDN-BOMYWPOKSA-N 449.595 4.112 10 10 IICE Cc1cc(CC(=O)N[C@H](CO)c2ccccc2OC(F)(F)F)c(C)n1-c1ccccc1 1568599472 GEWMJPDLHWKOBZ-HXUWFJFHSA-N 432.442 4.385 10 10 IICE C[C@H](C1CC1)n1nccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1584821614 WBSZMXRDXYIEKH-KAECEXQPSA-N 444.557 4.223 10 10 IICE COc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 1613111054 ASHBQVPNXZKALS-AREMUKBSSA-N 445.519 4.061 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(CCC(F)(F)F)cc1 1623928108 FPNSNRBGMLFXQN-UHFFFAOYSA-N 429.822 4.356 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(-n3c(C)ccc3C)ccc1Cl)C[C@@H]2O 1624208441 KGGIHIWYVRJXHY-FQEVSTJZSA-N 440.927 4.454 10 10 IICE CCn1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C(C)C)n1 1628491788 XOMCGCAZGJXSCZ-HXUWFJFHSA-N 443.592 4.088 10 10 IICE CCCCN1C(=O)c2ccc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)cc2C1=O 1633111736 YHJVKPOQCUIPMG-UHFFFAOYSA-N 433.552 4.249 10 10 IICE COC(=O)c1cc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c(O)c(OC)c1 1640001183 YJQRCNMEUTXAFN-UHFFFAOYSA-N 442.899 4.430 10 10 IICE Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)CC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 1643509886 USBXBIWHGSTFAH-UHFFFAOYSA-N 430.457 4.106 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H]2CCc3ncc(Br)n3C2)c1 1647911787 LLXVQWTXEUMSDI-INIZCTEOSA-N 427.346 4.106 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3ncc(Br)n3C2)c(C)n1-c1ccc(Cl)cc1 1648684553 AMNNWHWPHXPILO-HNNXBMFYSA-N 447.764 4.451 10 10 IICE O=C(NCCc1cn(Cc2ccc(Cl)cc2)cn1)c1cc2cc(O)c(O)cc2s1 1648893779 IDVSLVSMZZVLIC-UHFFFAOYSA-N 427.913 4.183 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@]4(C[C@@H](C)C[C@@H](C)C4)C3=O)c2C)cc1F 1651884651 AHELPOSPCOOQGB-BBSRFHRESA-N 439.531 4.471 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2Cc1nnnn1-c1ccc(OC(F)F)cc1 1653957386 XVFYLTAXBXQJMA-MRXNPFEDSA-N 429.471 4.107 10 10 IICE Brc1cc(CNCc2cccnc2-n2cccn2)ccc1N1CCCCC1 1655577015 HAADCNMSOSHTBM-UHFFFAOYSA-N 426.362 4.310 10 10 IICE Cc1nc(C(F)(F)F)nn1CC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 1656557015 MMPKOURDDNUOOX-UHFFFAOYSA-N 428.361 4.497 10 10 IICE C[C@@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)C(=O)N1c2ccccc2C[C@H]1C 1672776727 JHPUVMRBNPGXPA-QZTJIDSGSA-N 433.508 4.063 10 10 IICE CCOc1cccc(CN(CCO)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 1684322709 SQJGGXLXBIHUMD-UHFFFAOYSA-N 435.568 4.239 10 10 IICE CCC1(N2CCOCC2)CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1687286246 ANFWSTYWGPNQTA-UHFFFAOYSA-N 438.616 4.189 10 10 IICE CNC(=O)c1ccc(CN(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)C2CC2)cc1 1687286399 GUWKIXACMAGMCU-UHFFFAOYSA-N 430.552 4.328 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCO[C@H](C(C)(C)C)C1 1693005205 FLOCIXHGTBXFFJ-QFIPXVFZSA-N 434.588 4.014 10 10 IICE CC[C@H](C)[C@H](Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C)OC 1693974217 MOMJNQPNJTYVDA-UGKGYDQZSA-N 443.636 4.362 10 10 IICE COc1cccc(-c2nnc(N(C)Cc3ccon3)n2CCCSc2nccs2)c1 1697508298 OPSZWJFULJDVKA-UHFFFAOYSA-N 442.570 4.217 10 10 IICE CCNC(=O)C(C)(C)Cn1c([C@H](C)CC)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1728641094 JDTSWIREYYFEFZ-LJQANCHMSA-N 440.636 4.191 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1730849884 AQXDHKAEEYZVDY-RTWAWAEBSA-N 443.636 4.297 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(C(C)C)CC1 1760994148 QIYSAQJPUUJDOE-UHFFFAOYSA-N 425.621 4.386 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@H](C1CCCCC1)N(C)C 1768680960 BACMHDNATPGYBQ-HSZRJFAPSA-N 448.615 4.116 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1OCC 1860085476 NBTBGIFTVSADRC-VCHYOVAHSA-N 445.518 4.294 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CCCN(C(C)=O)C2)sc(C)c1-c1ccc(C)c(C)c1 1860645549 CGKHSULVYRFCOV-SFHVURJKSA-N 428.554 4.324 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccc(O)c(OC)c2)cc1 1865675363 DJTXTKVFXWFVIG-KGENOOAVSA-N 430.460 4.253 10 10 IICE CCN(CCN(C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2)C(=O)OC(C)(C)C 2044767097 QNHPVMNGWJPYMQ-UHFFFAOYSA-N 448.608 4.255 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(CCNCc2cccc(Br)c2O)C1 2140326526 BJAYPIBNJRQKOA-QRWLVFNGSA-N 425.367 4.282 10 10 IICE CSc1ncc(CNc2ncc(I)cc2Br)s1 2248650869 HYNDNVCIYWQZKY-UHFFFAOYSA-N 442.145 4.239 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1ccc2c(c1)OCO2 2294280061 WDMBQTGRBRQNEH-UHFFFAOYSA-N 442.265 4.055 10 10 IICE CC(C)CCN(C)c1ccc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 2313548334 SMFGJOIZNXXDTO-UHFFFAOYSA-N 425.916 4.489 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccc(OC)cc3)C2=O)cc1)C(=O)O 2314929089 GXVSWMHTTXDFSB-QGZVFWFLSA-N 429.519 4.343 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3C[C@H]2C[C@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352949591 GPVRGWGQPLIABY-XUWVNRHRSA-N 425.367 4.245 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380758994 ZCBPHZYOCWMOGX-UKRRQHHQSA-N 441.366 4.163 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 226885662 XQUBCKFRSLPEOD-IMWIBFENSA-N 434.540 4.493 10 10 IICE COc1cc(Cl)cc(CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OCc2ccccc2)C3)c1O 701087010 QKXFJNRRSSLJII-LSTHTHJFSA-N 430.932 4.334 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(Br)s3)cc2F)C[C@@H](C)O1 733922254 TWDWMCGBPURCNY-BETUJISGSA-N 441.366 4.122 10 10 IICE O=C(O)c1cccc(N2C(=O)/C(=C\c3cnc(-c4ccncc4)s3)SC2=S)c1 753135348 OQYLVGKOXWRSLS-OQLLNIDSSA-N 425.516 4.309 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3ccc(Cl)s3)cc2F)C[C@@H](C)O1 754595619 FPHJAUKKNDDKNP-QLFBSQMISA-N 439.984 4.121 10 10 IICE O=C(Cc1csc(-c2ccccc2)n1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768533002 KPCDGDXPSYLABM-UHFFFAOYSA-N 446.620 4.201 10 10 IICE Cc1cc(C(=O)Cn2ccnc2[C@@H](O)c2ccc(F)cc2)c(C)n1-c1ccc2c(c1)OCO2 786756435 ICWBIDFLWDYOGA-DEOSSOPVSA-N 447.466 4.123 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)c1 795694615 PSANSYWTPRUWOQ-SVBPBHIXSA-N 448.607 4.413 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cc3ccc4c[nH]nc4c3)no2)C1 809478912 DBCGPYOQHSKXNV-UHFFFAOYSA-N 426.524 4.306 10 10 IICE CCN(C)Cc1cc(O[C@H]2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)ccn1 856624162 URXWXADVMSYXQQ-SANMLTNESA-N 446.595 4.163 10 10 IICE Cc1onc(-c2cccc(F)c2)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1125187427 FVUFGJXFGPJIPT-GASCZTMLSA-N 441.478 4.472 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1C 1135444843 XHODEBSKDFIDTA-UHFFFAOYSA-N 445.972 4.145 10 10 IICE CCCOc1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1136200959 PZUFNVVJQLBHKG-UHFFFAOYSA-N 432.523 4.296 10 10 IICE COC(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)o1 1139741197 ZZUYIHJCBIUQBF-UHFFFAOYSA-N 431.286 4.166 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 1151723894 ARAPEPQWOFBUCE-LJQANCHMSA-N 430.552 4.257 10 10 IICE O=C(NCc1c(O)cccc1O)[C@H](Oc1ccccc1Br)c1ccccc1 1156880777 AQYTVCYQQIOWSU-HXUWFJFHSA-N 428.282 4.297 10 10 IICE Cc1ccc(CN(CC(=O)NC(=O)Nc2ccccc2)c2ccc3c(c2)OCCO3)s1 1167760213 RSQSNZFCCGUUOW-UHFFFAOYSA-N 437.521 4.183 10 10 IICE Cc1ccc(C(=O)N2CCn3c(cnc3C(F)(F)F)C2)cc1-n1c(C)cc(C=O)c1C 1179663706 FYJHTHZWFVXDTO-UHFFFAOYSA-N 430.430 4.086 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)c3cc(Cl)cc(Cl)c3)C2)cc1 1230858883 PWOLXHBKRVHLFC-FXAWDEMLSA-N 438.355 4.004 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3ccc(Br)s3)C2)cc1 1252117090 VXVGVDDTXQTKGD-CQSZACIVSA-N 438.391 4.187 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(N)=O)c1 1271692825 TUFCMOYPPCDHLR-FQEVSTJZSA-N 430.335 4.227 10 10 IICE Cc1cc(-c2nnc(N3CCCC[C@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1289359095 JGCOYYWBGYEKAN-IBGZPJMESA-N 448.615 4.457 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CCS[C@H](C(C)C)C1 1289423457 LNHQFUWFEUZBIJ-UNMCSNQZSA-N 443.661 4.173 10 10 IICE CC1CCN(CCCCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CC1 1291180981 SWSSCUADJWBGJF-QHCPKHFHSA-N 441.620 4.374 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC(Cn3nc(C)cc3C)CC2)cc1 1295410660 MGRWKWHCMFCQAN-UHFFFAOYSA-N 435.620 4.211 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1303768253 AGKPBWRYZRMDGN-IIBYNOLFSA-N 439.556 4.200 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1305031134 BFADROZDEQTUMA-HXUWFJFHSA-N 425.621 4.285 10 10 IICE CCOCc1nnc(N2Cc3ccccc3O[C@H](C)C2)n1CCCSc1nccs1 1314324283 KLRDKOAWECTOIP-MRXNPFEDSA-N 445.614 4.241 10 10 IICE COc1cc(F)cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1356119991 XNWOBIJMVWHROY-CAOOACKPSA-N 434.489 4.203 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccccc3C(C)(C)C)cc2F)C[C@H](C)O1 1357836321 TUIRDRZHKYOEQF-ROUUACIJSA-N 428.548 4.432 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1360273600 NRMOBSSXHJNOCB-MGSLXVHVSA-N 439.987 4.425 10 10 IICE CCN(CC)c1nc2sc(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)cc2s1 1436973047 UGKBFUDNMOZYEJ-HNNXBMFYSA-N 444.626 4.469 10 10 IICE CC(C)(C)N1C(=O)C[C@H](C(=O)NCc2c(O)cccc2F)[C@H]1c1ccc(Cl)c(F)c1 1456031026 WCGQLJUTNONNLX-RNODOKPDSA-N 436.886 4.328 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](Cc3cccnc3)C3CCCC3)cc2F)CC1 1456124493 CMSQJBFYWBAGFH-QHCPKHFHSA-N 438.591 4.028 10 10 IICE CSc1ccc([C@H](C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1460021571 DCMUHKRBZADEHH-HNNXBMFYSA-N 430.529 4.473 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1 1463803001 AJOJICHRCCGOET-UHFFFAOYSA-N 441.988 4.146 10 10 IICE COC(=O)c1cc(CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1OC 1463936834 ZBGOTTPSHXJAIA-UHFFFAOYSA-N 426.900 4.473 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc2cc(O)c(O)cc2s1 1464694985 LVUUTEJGVAORNO-UHFFFAOYSA-N 434.464 4.313 10 10 IICE C[C@H](NC(=O)N1CCC[C@](O)(c2ccc(Br)cc2)C1)c1ccc(N(C)C)cc1 1478471000 LRSVWISHOFYBQP-KSFYIVLOSA-N 446.389 4.269 10 10 IICE CC(C)c1ccc(C[C@H]2CCN(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)C2)cc1 1479185969 XXCQDZMCOITLRU-XMMPIXPASA-N 434.628 4.336 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(F)(F)C1 1494771624 FFGRERORYMXWAA-QFIPXVFZSA-N 429.515 4.359 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)[C@H]1CC 1500312392 LZTSBWSFKPLIPV-JOCHJYFZSA-N 434.588 4.258 10 10 IICE CC1=CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1511376931 LEDPHQSFEJOLMD-UHFFFAOYSA-N 437.632 4.280 10 10 IICE C[C@H]1COCC[C@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1512544093 UHFKQZGNVDJCAT-GWOFKNCZSA-N 442.604 4.211 10 10 IICE Cc1cc(CC(=O)NCC(=O)Nc2ccc(Br)cc2)c(C)n1-c1ccccc1 1516676942 APOVLQBBMRZNHA-UHFFFAOYSA-N 440.341 4.154 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1[N+](=O)[O-] 1520120523 OOPQZLFDFNJOEM-BOPFTXTBSA-N 445.497 4.272 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](NC(=O)c1ccc(Cl)s1)C(C)C 1529278289 PIMFVIDXYZJXFK-MGPUTAFESA-N 436.021 4.278 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(-c4cccc(Cl)c4)nc3O)C2)cc1 1529706770 HAUJWOMMKKNEAB-MRXNPFEDSA-N 437.927 4.373 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccc(C(F)(F)F)cc3)c2C)cc1 1538159631 ADLJMJYOYBEPPD-UHFFFAOYSA-N 446.473 4.417 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)Cc2cccc(I)c2)cc1 1539307923 MCWOHRQKUCDPKL-UHFFFAOYSA-N 436.337 4.339 10 10 IICE Cc1nc(C2CC2)ccc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1544267649 GOPQHRNYTOSQBO-JOCHJYFZSA-N 438.572 4.329 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@H]2CSc3ccccc3O2)cc1 1544523409 BIKRASULFITZDO-SFTDATJTSA-N 426.582 4.204 10 10 IICE C[C@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1)c1ccccc1O 1557968470 ZTWBXUMFYUYWDV-ZDUSSCGKSA-N 448.903 4.477 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnc(C3OCCO3)s2)cc1 1565656180 RQKUVZVXXAAUIO-UHFFFAOYSA-N 439.537 4.110 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCO[C@H]1C(C)C 1614012332 QUCNYNDCLFUFHG-YKSBVNFPSA-N 441.620 4.017 10 10 IICE CC[C@@H]1CCC[C@@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@]1(OC(C)C)CCOC1 1614134701 BDXRHQBCGWSQKG-FHAGJXEFSA-N 442.604 4.487 10 10 IICE Cc1cc(C(=O)CSc2nc(O)c3cnn(C)c3n2)c(C)n1-c1ccc(F)c(Cl)c1 1614708046 GLYXYGQEDHJFII-UHFFFAOYSA-N 445.907 4.244 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1615430978 FXQXJYAQYZNXMT-QFIPXVFZSA-N 438.664 4.075 10 10 IICE COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N1CCN(c2ccc(OC)c(F)c2)CC1 1616275301 MAMZFCWHTTXJHR-LJQANCHMSA-N 427.303 4.177 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Br)cc(OC(C)C)c3)C2)cc1 1617262806 NPXGHLUPJSZASG-QGZVFWFLSA-N 433.346 4.254 10 10 IICE COc1cccc([C@H]2CN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CCO2)c1 1622248178 RQIGZHPVKKYALV-RUZDIDTESA-N 432.520 4.437 10 10 IICE CC(C)(C)C(=O)Nc1ccccc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1623161341 GZIKQDQJBLGWCU-UHFFFAOYSA-N 448.611 4.133 10 10 IICE Cc1ccc(C(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)cc1-n1c(C)cc(C=O)c1C 1624459571 NLVTWEPKSYUKCQ-SFHVURJKSA-N 449.595 4.326 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2cc3n(n2)CCCC3)c(C)n1-c1ccc(Br)cn1 1628005177 BCQSBNRJYXHFHA-AWEZNQCLSA-N 442.361 4.275 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1 1630288678 YWGXXZXULAQTCR-UHFFFAOYSA-N 425.529 4.036 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C)[C@H]3c3cccc(Cl)c3)cc2)CC1 1633110908 LJWJXIRLRPKYPA-VWNXMTODSA-N 439.987 4.412 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccc(Cl)c(F)c4)C3)cc2)CC1 1633111399 RWOMAKKEBHDDAH-SFHVURJKSA-N 443.950 4.385 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)[C@@]12CCCO2 1633710346 JOVWCYHWNFRUEC-VWPQPMDRSA-N 447.373 4.313 10 10 IICE CCCCCCOc1ccc(C(=O)NCc2ccc(N3CCN(C(C)=O)CC3)cc2)cc1 1634073706 CQCKXGYKNZQASU-UHFFFAOYSA-N 437.584 4.244 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1nc2cc(Br)cnc2[nH]1 1637354047 FRINILUVQYHARQ-UHFFFAOYSA-N 438.285 4.193 10 10 IICE Cc1cc(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)c(C)n1-c1ccc2c(c1)OCCO2 1640877152 UJQGNQLXDLNYKL-UHFFFAOYSA-N 426.400 4.174 10 10 IICE Cc1cc(CC(=O)N[C@H](Cc2ccccc2)c2nc(O)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1648697071 XZOJJJHUELCTAR-OAQYLSRUSA-N 449.942 4.214 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)[C@H]1CCN(c2ccccc2Cl)C1=O 1673743532 FRQXPVYTDQWXRY-VGSWGCGISA-N 442.991 4.092 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](C)[C@H](CCNC(=O)OC(C)(C)C)C1 1683426498 YHDQHOLMWRHMLR-SVFBPWRDSA-N 446.636 4.184 10 10 IICE CC(C)N1CCC[C@@H](Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1706568568 DCARIBHBQYYPEK-HXUWFJFHSA-N 439.629 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC(COC)CC2)cc1 1710025752 LTVQUCNKZOFMKX-UHFFFAOYSA-N 436.604 4.041 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1(C)C)OC 1730463471 MYAVPJHMMBTNCH-NRFANRHFSA-N 437.588 4.393 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@@H](C)[C@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1742333354 CBBIPSZAAMQOTQ-MOPGFXCFSA-N 436.629 4.401 10 10 IICE C[C@H]1C[C@H](C)CN(C(C)(C)Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1762701634 DGUGELJVWQLTAF-PMACEKPBSA-N 448.615 4.439 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NC1CCCCC1 1766389828 YXXFCWLIJQUQLP-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(CC)CC)cc2)C1 1766461322 AJJPLOLEBLMXGM-OAQYLSRUSA-N 436.604 4.421 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](C)C1 1771022435 NKPBCJYHPZGRMJ-PMACEKPBSA-N 437.588 4.393 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc(O)c1O 1951866840 HQXBWQWHAJGBJR-VWLOTQADSA-N 433.460 4.326 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C(F)F)c(CO)c1I 2079844898 ONUWTJDYTGMPIA-LBPRGKRZSA-N 436.240 4.239 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C2(C)CC2)c(CO)c1I 2080004298 YNMIPDOEOVUGIG-OAHLLOKOSA-N 440.325 4.353 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C(F)(F)F)c(N)c2I)cc1C 2080038965 UPFSTAGQKDKHTQ-MRVPVSSYSA-N 425.192 4.020 10 10 IICE O=C(N[C@H]1CC12CC(NCc1cc(Br)cc(F)c1O)C2)OCc1ccccc1 2086047289 MEJGVABQMNGERK-JGCRXCKMSA-N 449.320 4.231 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@@H]2NCc2c(O)cccc2Br)CC1 2132776720 BVRNXLDHFHRVSG-KRWDZBQOSA-N 425.367 4.424 10 10 IICE CC[C@@]1(NCc2c(Br)ccc(OC)c2O)CCN(C(=O)OC(C)(C)C)C1 2227749903 HMYVGIVMFMDONP-LJQANCHMSA-N 429.355 4.043 10 10 IICE O=C1NC(=S)SC1=Cc1cccc(OCCOc2ccc(Br)cc2)c1 2293579785 LEHXKHNWJYWLQI-UHFFFAOYSA-N 436.352 4.396 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc([N+](=O)[O-])c1O 2297577028 MDAVEUHNNXDADN-UHFFFAOYSA-N 447.450 4.013 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(CCCC)C1=O 2314414797 MQDJSJVRPLNCSJ-UHFFFAOYSA-N 430.599 4.298 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 14544777 LIVRQJJFONDDEK-PDOGEWKWSA-N 435.549 4.015 10 10 IICE C/C(NCCSCc1nc[nH]c1C)=C1\C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 20288211 KIHIZGBIOGSSQE-OQKWZONESA-N 449.555 4.405 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(CC)cc3)C2)sc2c1CCCC2 21449839 LAZMISYKOYTSEY-MRXNPFEDSA-N 440.565 4.358 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526400326 HQVZVFZBGBMOHZ-HSZRJFAPSA-N 433.460 4.481 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)/C=C\c2cnc3ccccc3n2)c2ccccc2C1 728004411 MEESKWJSEMJGNG-SEYXRHQNSA-N 430.508 4.427 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 743623998 MXWDIEGOPXCGGV-JOCHJYFZSA-N 436.556 4.128 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3CCCN(c4ncccc4C(F)(F)F)C3)ccc21 746813539 VLQCNTBIHSWFPB-SFHVURJKSA-N 432.490 4.016 10 10 IICE FC(F)(F)Cn1c(-c2ccccc2)cnc1SCCc1nnnn1-c1ccccc1 748033840 SNTOFTPUCFHLIK-UHFFFAOYSA-N 430.459 4.423 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc4[nH]c(=O)ccc4c3)n2)c1C 751127382 MNBIWHTWFWTXMS-UHFFFAOYSA-N 442.566 4.281 10 10 IICE Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 754542351 JZXLHPPFQAXKLK-UHFFFAOYSA-N 448.478 4.482 10 10 IICE Cc1nc(SCC(=O)NCc2cc(Br)ccc2O)[nH]c1Cc1ccccc1 804736328 RROJRLMKXDIAFR-UHFFFAOYSA-N 446.370 4.186 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 812307104 BPEMRZVSERASBD-NRFANRHFSA-N 432.528 4.156 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc[nH]c2C2CCC2)NC(=O)OC(C)(C)C)cc1 813465997 XFOJOEBXCKAEHB-FQEVSTJZSA-N 426.561 4.344 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1Cc1c(F)cccc1Cl 919790788 PQHPDZPQKWSTSJ-LJQANCHMSA-N 431.939 4.232 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4cc(C)ccn4)cc3)cc2F)CC1 1125975977 GLZBROMOWCONPM-UHFFFAOYSA-N 448.542 4.393 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)cc1 1129785923 KFGGSEIIUUPLKR-UHFFFAOYSA-N 425.554 4.423 10 10 IICE CCN(Cc1occc1C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1129805946 YNODTZJGEVYIQG-PDGQHHTCSA-N 432.542 4.367 10 10 IICE Cc1cc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c(C)n1-c1ccccc1 1132264647 ZAKDJDQAHRZAOC-SMIHKQSGSA-N 447.579 4.076 10 10 IICE Cc1nnc(-c2cccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)c2)n1C 1151437001 HKDZKZDHNUYESA-UHFFFAOYSA-N 427.508 4.192 10 10 IICE CN(C)c1ccc(CN(C[C@H](O)COc2cc(F)cc(Br)c2)C2CC2)cc1 1190446757 OFLBIVHVPOVRBA-FQEVSTJZSA-N 437.353 4.059 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1nc(C(F)(F)F)n2c1CCCC2 1230200637 LNCGFAKQAYUUDG-HNNXBMFYSA-N 437.510 4.043 10 10 IICE COc1cc(/C=C/C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc(Br)c1O 1299479051 SPNGLCTXDNTJAT-RZIFZGNASA-N 447.373 4.298 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)N[C@H](C)c3ccccc3O)cc2)cc1 1302530351 MHCNYPDTJIVURK-MRXNPFEDSA-N 440.521 4.083 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)C2)cc1C 1312571330 NIATXQAQVGXPQE-QFIPXVFZSA-N 438.572 4.183 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C 1312805417 IKLNBBJEOOLDQX-NLFFAJNJSA-N 440.632 4.381 10 10 IICE COc1ccc(OC2CCN(c3nnc(C)n3CCCSc3nccs3)CC2)cc1 1315526480 IPTNILQGCIXJNZ-UHFFFAOYSA-N 445.614 4.282 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc([N+](=O)[O-])ccc1F 1351312674 RVNPHSNPUOVUMJ-CXUHLZMHSA-N 449.460 4.103 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1 1353910427 JDMJZABGZQTRAP-OAQYLSRUSA-N 444.000 4.114 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c(Cl)c1 1358140412 MEUKTITVYBYLGU-UHFFFAOYSA-N 431.920 4.270 10 10 IICE CC[C@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1360528928 SLBHCGZYYDLZGT-GXYBQNOFSA-N 443.569 4.422 10 10 IICE Cc1cc(N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)nc(C(C)C)n1 1440688116 OXIJJDGYOYIRPD-UHFFFAOYSA-N 431.584 4.207 10 10 IICE Cc1cc(C(=O)NCCN2CCN(c3ccccc3)CC2)c(C)n1-c1cccc(Cl)c1 1441099975 ITQWWGCWYIVGJB-UHFFFAOYSA-N 436.987 4.300 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)c1 1442211130 PERLQOMWICPOQH-UHFFFAOYSA-N 444.535 4.333 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(F)c1I 1460981837 ISQOJVAIJDHAKG-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1461333195 AXASPVYWKDKQGB-UHFFFAOYSA-N 448.611 4.011 10 10 IICE Cc1cc(CC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)c(C)n1-c1ccccc1 1463077861 NNNPDTINVVFJDU-NRFANRHFSA-N 425.573 4.398 10 10 IICE Cc1ccc(NC(=O)c2sccc2-n2c(C)ccc2C)cc1S(=O)(=O)NC1CC1 1465272365 YWGZEHXOOTXWRL-UHFFFAOYSA-N 429.567 4.157 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 1465993562 TUYZLESBTBNZOF-LLVKDONJSA-N 431.382 4.180 10 10 IICE Cc1cc(C)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1CO 1466952136 QOKGWUYFWKWVPE-VXLYETTFSA-N 444.553 4.165 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CC=C(c2ccc(Cl)cc2)CC1 1470448864 BITLPKUZROOQPD-UHFFFAOYSA-N 447.913 4.454 10 10 IICE C[C@@H](NC(=O)N1C[C@@H]2CCC[C@]2(CNC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1478470787 JGOPNHKGHDAZSQ-VUMVONDWSA-N 430.593 4.150 10 10 IICE Cc1cccc(-c2nnc(N(C)[C@@H]3CCSC3)n2CCCSc2nccs2)n1 1492497414 WENFHRGCCCHJTL-OAHLLOKOSA-N 432.644 4.229 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(O)CCOCC1 1501854216 XSHVRWNGPQTECX-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CCC[C@H](C)N(C)c1nnc(CC2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1514307947 LNBMUEXPIXVANE-IBGZPJMESA-N 425.621 4.112 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2ccc(F)cc2)no1 1524057729 AIVYLABAPFKDMY-MRXNPFEDSA-N 431.414 4.481 10 10 IICE CCCOc1ccc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OCCC 1526035241 DNEWLGQYMCVCKW-UHFFFAOYSA-N 426.557 4.164 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cc(F)ccc1F 1528803164 HGQZTDSHKJNWRS-LICLKQGHSA-N 436.480 4.358 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@@H]1C[C@H]2C=C[C@H]1C2 1530531273 HPKNBQFIIFZGLU-IPJSKRPOSA-N 430.570 4.136 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(=O)c2ccc(Cl)cc2o1 1533328165 HHIWBSRAQMJSCE-CQSZACIVSA-N 448.853 4.447 10 10 IICE CCOC(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nc1C 1538421130 LFNXCDOVAXBCBK-OAHLLOKOSA-N 429.948 4.386 10 10 IICE Cn1nc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cc1C(F)F 1539360535 ADCGWAZPZCXQPJ-UHFFFAOYSA-N 447.243 4.082 10 10 IICE COCCN(CCNC(=O)c1cc(C)n(-c2ccccc2C)c1C)C(=O)OC(C)(C)C 1556075696 ITMKFVOODVBLID-UHFFFAOYSA-N 429.561 4.016 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3Cc4cc(F)ccc4NC3=O)cc2Cl)C1 1556369236 JILCPMPVLCKFCO-RDTXWAMCSA-N 429.923 4.143 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)NCc3cc(Cl)cc(Cl)c3O)cc2)c1C 1556883802 CVEMCKPGUNRRTK-UHFFFAOYSA-N 448.306 4.300 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(C(F)(F)F)c(I)c1 1558456209 VLLMWBYBXJQDTO-QHHAFSJGSA-N 449.166 4.373 10 10 IICE CCN(C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)[C@H]1CCN(c2ccccc2)C1=O 1585418060 MYWXYUQATVJZMP-DEOSSOPVSA-N 429.520 4.174 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C(=O)OC)[C@@H]4CCCC[C@H]43)ccc21 1585636322 JJZZFOATPMAZIU-JAXLGGSGSA-N 426.557 4.098 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1 1587460321 VFNWHMWMHPLMMC-XLIONFOSSA-N 433.593 4.252 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@]1(C)CCCS1 1603303635 SIKGRWJMRXAAIL-XMMPIXPASA-N 443.661 4.235 10 10 IICE COc1ccc2nc([C@H](C)NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)[nH]c2c1 1617178382 LCXAFDGJXWSTAA-INIZCTEOSA-N 430.508 4.211 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1626155589 YQSPLDBQAFHTCZ-GASCZTMLSA-N 445.560 4.088 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2ccc(C(F)(F)F)cc2nc1O 1628854947 TXCDNQYDDZUXAK-UHFFFAOYSA-N 445.441 4.068 10 10 IICE CC[C@@H](C)Oc1cc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccn1 1631551228 HZZBXKWUSOLVCY-LJQANCHMSA-N 434.584 4.297 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3C2=O)c(C)n1-c1ccccc1Br 1631827246 ROGLKCPBVLUNGU-SFHVURJKSA-N 439.309 4.230 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](O)c1ccc(Cl)c(Cl)c1 1632040274 PFHCABVWDDUYDI-GOSISDBHSA-N 445.293 4.413 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3c4c[nH]nc4CN3C(=O)OC(C)(C)C)c2C)c1 1635327146 PFCMORZVFDNYKB-JOCHJYFZSA-N 449.555 4.234 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCC(=O)N[C@@H](C)c1ccccc1 1635676275 ANADMYVNFDGYFR-HNNXBMFYSA-N 433.346 4.161 10 10 IICE Cc1cc(C(=O)NCCc2ccc(CO)cc2)c(C)n1-c1ccc(Br)cc1 1637239623 DNAUMFQUNTUHNR-UHFFFAOYSA-N 427.342 4.321 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCO[C@]2(CCN(C(=O)OC(C)(C)C)C2)C1 1638002766 QPOCCUHIRRAXPS-HSZRJFAPSA-N 445.585 4.008 10 10 IICE C[C@H]1C[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1cc2cc(O)c(O)cc2s1 1639532748 ULFCAOFSEGIUPM-IPYPFGDCSA-N 434.558 4.324 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2sc(SC(F)(F)F)nc2C)cc1 1639814286 RDGPYDHKHKNQRF-UHFFFAOYSA-N 433.521 4.209 10 10 IICE CC(=O)c1nn(C)cc1OCC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1641485759 UVQRJNNJOXDXAK-UHFFFAOYSA-N 430.302 4.054 10 10 IICE COc1ccc(-n2cc(O)c(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)n2)cc1 1642454408 GIUJWLFQTGLYBT-UHFFFAOYSA-N 430.508 4.232 10 10 IICE O=C(N[C@H](C1CCCC1)C1CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1643521185 ANDVKFYOKWGWNO-HXUWFJFHSA-N 434.583 4.343 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@H](C)N(c3ccc(F)cc3)C2=O)c(C)n1-c1cccc(F)c1 1652518528 YNVIVDVMXLNQRI-INIZCTEOSA-N 437.446 4.412 10 10 IICE C[C@H](Sc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652833006 FLLFXXTWXRBRPD-ZDUSSCGKSA-N 432.457 4.490 10 10 IICE COC(=O)COc1ccc(N(C)Cc2c(C)nn(Cc3ccc(Cl)cc3)c2C)cc1 1653259567 XGCOOJFZGAQUEZ-UHFFFAOYSA-N 427.932 4.390 10 10 IICE COc1ccc(N(C)CC(=O)Nc2cccc(I)c2)cc1Cl 1653679769 AYCDKRCZIGFSRH-UHFFFAOYSA-N 430.673 4.028 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCO)Cc3ccccc3)cc2Cl)C1 1682024326 QANGJVTZFPTJCP-NQIIRXRSSA-N 429.992 4.369 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H]3CC[C@@H](c4ccc(Cl)cc4)C3)cc2)CC1 1683345097 XTUPHXAREKWDLQ-IRLDBZIGSA-N 426.992 4.227 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CC(C)(C)OC(C)(C)C1 1693006194 RIYVJRYUFYUVPB-UHFFFAOYSA-N 448.615 4.080 10 10 IICE Cc1cccc(OCc2nnc(N(C)[C@@H]3CCOC3)n2CCCSc2nccs2)c1 1693217579 ZEKLDGZNHUXDLC-QGZVFWFLSA-N 445.614 4.030 10 10 IICE Cc1cc(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)cs1 1724223307 GKHQMJWKSURQQU-UHFFFAOYSA-N 425.583 4.394 10 10 IICE CC[C@H](C)c1nnc(N(CCOC)Cc2ccco2)n1Cc1ccc2c(c1)CCCN2C 1726900694 DQFJZMHXWXHZSS-IBGZPJMESA-N 437.588 4.468 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H]2CSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1726984535 RETWBBZROAQTJE-IEBWSBKVSA-N 447.624 4.147 10 10 IICE CC(C)SCCn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1741769068 BIZWVLXSPZODQI-UHFFFAOYSA-N 429.634 4.160 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@@H](OC)C2)cc1 1746091662 DOCJKQPLRQWOTH-YADHBBJMSA-N 427.593 4.029 10 10 IICE CC(C)CCN(c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1)C1CC1 1750791705 ZHESFLBNEMQTLA-IBGZPJMESA-N 429.584 4.440 10 10 IICE Cc1ccc(-c2nnc(N3C[C@H](C)OC(C)(C)C3)n2CCCSc2nccs2)o1 1761746049 FRTIWYUYQLULDQ-HNNXBMFYSA-N 433.603 4.489 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCCC[C@@H](COC)C2)cc1 1764942108 NJAAKEZKKMOJAI-FYYLOGMGSA-N 441.620 4.277 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)CC2CC(F)(F)C2)cc1 1766613086 BFQHYHIBMNUCTG-LJQANCHMSA-N 433.547 4.158 10 10 IICE COc1ccc(-c2nnc(N(C)Cc3ccon3)n2CCCSc2nccs2)cc1 1768454758 SSKSOXZXFCQAOM-UHFFFAOYSA-N 442.570 4.217 10 10 IICE CCN[C@H]1C(=O)Nc2cc(N(CCN(C)Cc3ccccc3)Cc3ccccc3)ccc21 2034743290 JGPMENZUOFFVPD-AREMUKBSSA-N 428.580 4.428 10 10 IICE O=C1C(=Cc2cc3ccccc3nc2N2CCOCC2)SC(=S)N1Cc1ccco1 2040458826 JSMNYRRCLBXUNS-UHFFFAOYSA-N 437.546 4.066 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2cc(Br)cc(F)c2O)C12CC2 2108028997 GPVDYUWUNKUUSN-CYBMUJFWSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)NC1(c2csc(=NCc3cc(Br)ccc3O)[nH]2)CC1 2224315137 PJTPFMRVSVJHBZ-UHFFFAOYSA-N 440.363 4.159 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3)C2=O)ccc1OCCC(=O)O 2314934853 LDSZSZKGRHDWCY-UHFFFAOYSA-N 429.519 4.345 10 10 IICE O=C(O)c1ccc(C=C2C(=O)N(c3ccc(Br)cc3)N=C2C(F)(F)F)cc1 2332139596 XLGNWXDMWMZIRB-UHFFFAOYSA-N 439.187 4.496 10 10 IICE CCC1=NN(Cc2ccc(Cl)cc2)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141476 XOGCSNMSEBHCBM-UHFFFAOYSA-N 427.844 4.211 10 10 IICE C[C@@H](CCCCC(=O)Nc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1ccc(O)c(O)c1 2012433 ZRBLJEGNAJFUPE-VBKZILBWSA-N 440.462 4.327 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCCC1 20681685 JKOMCCPTKZDSGT-IECBHUPTSA-N 440.565 4.489 10 10 IICE C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)/C(=C\c2ccccc2)SC1=S 33558482 RTIAZHYTOJDMRG-OOWUWCJESA-N 435.574 4.117 10 10 IICE CN1C(=O)/C(=C\c2ccc(OCc3ccccc3F)c(Br)c2)C(O)=NC1=S 96476562 DXOGNJOHHXYBDB-JYRVWZFOSA-N 449.301 4.264 10 10 IICE COC(=O)c1ccc(-c2ccc(/C=C3/C(=O)N(c4cccc(C(=O)O)c4)N=C3C)o2)cc1 100700750 JBXCRTIWFYRWJZ-DEDYPNTBSA-N 430.416 4.238 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@@H](COc3ccccc3)C2)C1 436035873 FORPPXHIKXJQRC-OAQYLSRUSA-N 431.580 4.335 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CCn3cnc4ccccc43)no2)C1 573839443 CGZVOZVHIKHOEE-UHFFFAOYSA-N 440.551 4.432 10 10 IICE CC(C)(CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CCCCO1 758743385 YTJBRJKQLQOAPD-IBGZPJMESA-N 425.520 4.151 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3CCCc4cn(C5CCCC5)nc43)CC2)cc1 764764646 ZXMOQRMIMWORSX-QHCPKHFHSA-N 437.588 4.306 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2CCC(N3CCCCC3)CC2)C1 766803413 GVUSVMAJLHGIMU-UHFFFAOYSA-N 436.644 4.321 10 10 IICE C[C@H](Nc1cccc(CN2C[C@@H](C)O[C@H](C)C2)c1)c1ccc(N2CCOCC2)c(F)c1 777226448 FOZVRYKMPIDOOI-AQNXPRMDSA-N 427.564 4.445 10 10 IICE CCc1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)s1 800636888 QAESDYAXUODFGG-ZDUSSCGKSA-N 434.993 4.159 10 10 IICE COc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)OCC(=O)C(C)=O)cc1OC 808498627 XBJBFNXIXNPZHB-SFQUDFHCSA-N 445.471 4.054 10 10 IICE O=C(NCc1ccccc1CN1CCCCC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 916221589 QNOVAKYHSSNCNB-DEOSSOPVSA-N 437.584 4.269 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c2c(C)nn(C)c2n1 1128488054 MKAYCLABOJNEEQ-AWEZNQCLSA-N 425.964 4.405 10 10 IICE C[C@H](NC(=O)c1cc(Cl)cc(Br)c1N)c1ccc(N2CCOCC2)cc1 1136443020 MZGMOODKPWLSGN-LBPRGKRZSA-N 438.753 4.012 10 10 IICE C[C@H](Sc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1148701466 ZFCAOPLZQVZSHZ-HNNXBMFYSA-N 449.414 4.207 10 10 IICE COc1ccc(CNC(=O)NCc2c(-c3ccc(F)cc3)nc3ccc(C)cn23)c(O)c1 1251291901 NNXUWKSTNRBSTI-UHFFFAOYSA-N 434.471 4.162 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cn(-c4ccc(Cl)c(Cl)c4)cn3)C2)cc1 1276831808 FHJJRSUNMLRTNK-OAHLLOKOSA-N 445.350 4.444 10 10 IICE COc1ccc(N(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1278359077 RSYQGAQOXYVTPP-QGOAFFKASA-N 430.526 4.089 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(Nc4nccs4)cc3F)CC2)cc1 1291855624 ATYDGJWBTSRGKC-UHFFFAOYSA-N 426.517 4.387 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1csc(Cc2ccc(Cl)cc2)n1 1301350710 WMHDWMJVMCCZJQ-UHFFFAOYSA-N 441.984 4.278 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)C[C@H]1C 1306459985 DBRDYNJGPSEMCN-WUTDNEBXSA-N 446.599 4.376 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1O 1307734406 MTIXLZWDECVNLN-SFHVURJKSA-N 430.932 4.387 10 10 IICE COCC1(C)CCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)CC1 1315832397 IFPHGKSXLXBRPS-UHFFFAOYSA-N 434.588 4.016 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CC[C@H](C)C2 1349305237 VCMQORUTIANCHC-VUROTCPHSA-N 446.613 4.415 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C[C@H]3OCc4cc(Cl)ccc43)cc2F)C[C@@H](C)O1 1350931721 BVFNOCAPIWFPHW-ZCCHDVMBSA-N 432.923 4.371 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(=O)OC(C)(C)C)cc3)cc2F)C[C@H](C)O1 1350933505 OCZPFKGDBBGOSO-IRXDYDNUSA-N 442.531 4.325 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@]2(c3ccccc3)CCN(C(=O)OC(C)(C)C)C2)cc1F 1358004227 PDUVMAGWGRVKMQ-VWLOTQADSA-N 441.547 4.087 10 10 IICE COc1cc(N2CCN(C(=O)C(C)(C)c3cccc4ccccc34)CC2)cc(OC)c1OC 1435844429 ZNJVNFGUIMCRGF-UHFFFAOYSA-N 448.563 4.492 10 10 IICE CCn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(-c2ccccc2)n1 1441783740 NKWTVGWIHYXOCS-HDICACEKSA-N 436.531 4.253 10 10 IICE Cc1ccc(C(=O)N2CCC([C@H]3N(C(=O)OC(C)(C)C)CC34CCC4)CC2)c(O)c1O 1455152982 HQHVLWRIKREXFI-HXUWFJFHSA-N 430.545 4.048 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1459836897 CERPKJHKXYHBDA-YVHKJVDXSA-N 447.982 4.450 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c1 1464717627 BPMSILKZJHYWPN-QFIPXVFZSA-N 448.498 4.082 10 10 IICE Cc1cc(C(=O)Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)n1-c1cccc(C(F)(F)F)c1 1473036299 GSKBPLOCNORCGR-UHFFFAOYSA-N 437.334 4.009 10 10 IICE CC(C)CN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1509382112 ZAXXJPRBWVFSOQ-JOCHJYFZSA-N 445.583 4.024 10 10 IICE CCc1nc(C(=O)NCc2ccc(N(C)C)c(F)c2)nn1-c1c(Cl)cccc1Cl 1527013383 BEUFRPQIAKGYDU-UHFFFAOYSA-N 436.318 4.272 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@]2(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C2)cc1 1527393151 KRXAJASRZCWZPR-NRFANRHFSA-N 443.510 4.339 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(N4CCCCC4)cc3)cc2F)C[C@@H](C)O1 1542113495 ZTBNTLNLDNJJJV-KDURUIRLSA-N 425.548 4.360 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cn4c(Br)cnc4s3)cc2)CC1 1543143345 ZQSKPINIRDHHKN-UHFFFAOYSA-N 433.375 4.325 10 10 IICE COC(=O)Cc1c(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)[nH]c2ccccc12 1543541274 SAJCNSUXDGSPDD-UHFFFAOYSA-N 445.519 4.385 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C[C@H](C(F)(F)F)O1 1544622742 AGGGAWOUJYQOKB-QWHCGFSZSA-N 449.568 4.371 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3nccn3)nc2)c(C)n1-c1ccccc1Br 1544653174 VSJOSOPNIDTDPO-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc2c(c1)CCCN2C 1552586865 INJSLTNPMVXETA-RXVVDRJESA-N 443.661 4.181 10 10 IICE CCCc1ccc(C(=O)CCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1556945917 ARBDYORMVGUUPZ-UHFFFAOYSA-N 430.495 4.033 10 10 IICE COCc1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)sc2cccc(F)c12 1557640710 TVRDNCZACICAJL-UHFFFAOYSA-N 428.529 4.078 10 10 IICE Cc1cc(CNC(=O)N2CC(OCCCOc3ccccc3)C2)c(C)n1-c1ccccc1 1565193874 NNMGBFGZNKJQHO-UHFFFAOYSA-N 433.552 4.474 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1 1566374293 BXHLSCNWGQAKQC-SRMJIJMDSA-N 448.922 4.369 10 10 IICE CCOc1ccccc1CN(CCCn1ccnc1)C(=O)c1ccc(N=NC(N)=O)cc1 1585530425 SRCWXVBYUDJWPE-UHFFFAOYSA-N 434.500 4.177 10 10 IICE COCCO[C@]12CCC[C@@]1(NC(=O)Cc1cc(C)n(-c3ccc(Cl)cc3)c1C)CCO2 1586094709 LRRKHYRRRJMLMC-DNQXCXABSA-N 446.975 4.109 10 10 IICE CN(Cc1ccc(Cl)nc1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1587312479 MZSZRYXYRKMNFL-YBEGLDIGSA-N 449.960 4.124 10 10 IICE C/C=C/[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1587552170 MKNHRRQYTSEDAS-UTJVBXODSA-N 427.589 4.304 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2C1 1611011136 FJIVJQGISYKNIZ-HNNXBMFYSA-N 445.510 4.302 10 10 IICE CC[C@H]1CCCN1c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1614168991 RCKICJBFLRMLTA-SFHVURJKSA-N 428.581 4.266 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2CC(=O)N1CCCN(Cc2ccc(C)cc2)CC1 1618691205 DPRFPMMFSIIFAD-RUZDIDTESA-N 449.639 4.373 10 10 IICE Cc1nc2cc(F)ccc2cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634627 DIDVICHJOUNGTK-IBGZPJMESA-N 427.907 4.436 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)n1ccc(NC(=O)OC(C)(C)C)n1 1626885513 AOGWXYJYVPPUHL-UHFFFAOYSA-N 429.565 4.080 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc(Br)cc(Br)c2O)cc1F 1631438299 PWYVPFQXGIGXBI-UHFFFAOYSA-N 446.114 4.052 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cn3c(SC(F)F)nc4ccccc43)CC2)cc1 1632153699 FPYABUZHGJUKEW-UHFFFAOYSA-N 446.523 4.099 10 10 IICE O=C(NCc1c(O)cccc1F)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 1633584618 HLNWDUPWXDMSEO-UHFFFAOYSA-N 426.319 4.302 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2c(-c3ccc(F)cc3)nc3ccc(F)cn23)cc1 1635702739 DEKONDNFZJKXSI-UHFFFAOYSA-N 434.406 4.372 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2c2ncccn2)c(C)n1-c1ccc(Br)cn1 1641835617 IYVAZXHXURNACH-QGZVFWFLSA-N 426.318 4.019 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ncccc3C2)c(C)n1-c1ccc(Br)cc1 1643316745 NNNSMIXTXYKBOF-UHFFFAOYSA-N 439.357 4.344 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1 1643600533 PHSHBFDQXZBUGU-OAQYLSRUSA-N 430.426 4.389 10 10 IICE COC(=O)C[C@@H]1CC[C@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1646574321 XQZMJGLBVHXBHJ-WBVHZDCISA-N 433.346 4.318 10 10 IICE CCc1cc(N2CCC(Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)CC2)ncn1 1650831608 DPCVBWDJFNQMDG-UHFFFAOYSA-N 431.496 4.259 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)NCc1cccc(COCc2ccco2)c1 1653810942 TYANBSCXUGDILW-UHFFFAOYSA-N 434.536 4.464 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(CO)CCc4ccccc43)cc2Cl)C1 1680561286 BBRNLHBMUQIBSB-IQGLISFBSA-N 442.003 4.252 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1681080280 STZBHGCRAGGZTB-LJQANCHMSA-N 448.350 4.183 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCCSC[C@H]3c3ccccc3OC)C2)cc1 1683945383 RUNLQQATAPNKJY-GCJKJVERSA-N 441.597 4.172 10 10 IICE Cc1nc(Cc2nnc(N(C)OC3CCCC3)n2Cc2ccc(N(C)C)cc2C)cs1 1693346714 SBRPHMQMJZESKN-UHFFFAOYSA-N 440.617 4.367 10 10 IICE CC[C@H](C)c1nnc(N2CCCC[C@@H](SC)C2)n1Cc1ccc(N2CCOCC2)cc1 1726983078 WXXXBWSCWXJKFM-SIKLNZKXSA-N 443.661 4.398 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC(=O)N1 1743819087 QSKJYZKZIBDBTP-YLJYHZDGSA-N 434.588 4.114 10 10 IICE CC(C)[C@@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)NC(=O)OC(C)(C)C 1750597461 WFXWJSLRDRNDSU-GOSISDBHSA-N 445.608 4.467 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCCN(C)C(=O)OC(C)(C)C 1763506751 LGOADOIVDIQZPD-QGZVFWFLSA-N 431.581 4.391 10 10 IICE COc1ccc(OCCN2C(=O)/C(=C\c3c[nH]c4ccc(OC)cc34)SC2=S)cc1 1858586558 BHWHOGZSNJYQJD-RGVLZGJSSA-N 440.546 4.465 10 10 IICE CCOc1cc(N2CCOCC2)c(OCC)cc1NN=NCCc1ccc(OC)cc1 1860491381 NQMMEGCRLRCGAZ-UHFFFAOYSA-N 428.533 4.351 10 10 IICE CC(C)CCC(=O)N1CCC(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1860606080 KIFRKOOVPXUPHC-UHFFFAOYSA-N 432.520 4.075 10 10 IICE CCCCOc1cn(CC(C)C)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870659463 FOSYCXLBWXVYSW-UHFFFAOYSA-N 427.589 4.014 10 10 IICE [N-]=[N+]=NC[C@@H]1CCN(C(=O)c2cc(Cl)cc(Cl)c2I)C1 1912186133 AAMFIYWXTVBFJF-ZETCQYMHSA-N 425.057 4.370 10 10 IICE CC1(C)C[C@@H](NCc2cc(Br)cc(F)c2O)CN(C(=O)OC(C)(C)C)C1 1923178813 UJCOHJDMOCHIEE-CQSZACIVSA-N 431.346 4.419 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2c(O)cccc2Br)C1 1952578446 PHXUTDKMIZYVIC-ZBFHGGJFSA-N 434.286 4.329 10 10 IICE Cc1ccc([C@H](C2CCC2)n2nc(C3CC3)c(CN)c2I)c(O)c1 2078999424 PIJWUMUCAYMVAH-SFHVURJKSA-N 437.325 4.227 10 10 IICE OCc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)cc1Br 2130156831 IGSYEUFWNPHLAM-GOSISDBHSA-N 429.280 4.195 10 10 IICE COc1ccc(Br)c(CNC[C@]23CC[C@@H]2CN(Cc2ccccc2)C3)c1O 2236054008 CWRQIKYJDXYYAZ-VGSWGCGISA-N 431.374 4.165 10 10 IICE CC1=NN2C(=N)C(=Cc3ccc(OCCOc4ccccc4Cl)cc3)C(=O)N=C2S1 2293381578 UTYDIDVCPOOVQT-UHFFFAOYSA-N 440.912 4.437 10 10 IICE COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)C1=Cc1ccc(OC)c(OC)c1OC 2293891582 AKMNOLURYMQWPH-OAHLLOKOSA-N 437.492 4.146 10 10 IICE CC(C)CCN1C(=O)C(=Cc2cc3ccccc3nc2N2CCOCC2)SC1=S 2314647886 KZBBFWMXFTWVEG-UHFFFAOYSA-N 427.595 4.319 10 10 IICE CCCC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323823674 FCFQSJGWAMJZAP-GFCCVEGCSA-N 432.336 4.433 10 10 IICE COCCNc1cc(N(CCO)Cc2ccccc2)c2noc3c2c1C(=O)c1ccccc1-3 9642178 WQVJPSMOLVFEFA-UHFFFAOYSA-N 443.503 4.096 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCCC(=O)O 16911917 LDHBHPNGFWCAAS-LICLKQGHSA-N 433.482 4.094 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C\c3c[nH]c4ccccc34)SC2=S)cc1 210697363 IZLYESNUPVHYLP-XDHOZWIPSA-N 437.546 4.407 10 10 IICE O=C(COc1cccc(/C=C2/SC(=S)NC2=O)c1)Nc1cccc(C(F)(F)F)c1 210894000 SYWUUCXCIDXZGO-OVCLIPMQSA-N 438.452 4.212 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)c3ccccc3)ccc21 727309228 FWZVIRPPCZYVFR-CAOCKLPOSA-N 431.580 4.159 10 10 IICE CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 745649771 XQNDRYVLGRACIK-HSZRJFAPSA-N 431.527 4.210 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C(F)F 769146306 DDSBHWQXHGXQBF-LBPRGKRZSA-N 446.420 4.187 10 10 IICE Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 772449872 XTUJAPRHJDGGGE-QHCPKHFHSA-N 439.604 4.089 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc([C@H]2CCCOC2)cc1 779948921 WHDBAGRQEPKZDV-VWLOTQADSA-N 433.596 4.043 10 10 IICE CN(C)CCOc1ccc(CNC(=O)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 918413480 BCYRVLOASHUGNH-UHFFFAOYSA-N 445.523 4.297 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 918564411 DLERBEFUXUJLJJ-JOCHJYFZSA-N 439.575 4.110 10 10 IICE Cc1cc(C(=O)COC(=O)CCc2nc(C(C)(C)C)no2)c(C)n1-c1ccc(F)cc1 919124517 ASRYXTHUMUWAFR-UHFFFAOYSA-N 427.476 4.272 10 10 IICE CS[C@@H]1CC[C@@H](N(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1126591627 VDBIWCYXGLPNOD-QZAYQTGJSA-N 438.615 4.160 10 10 IICE Cc1ccc(Br)c2[nH]c(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc12 1135733141 VSGPUPKHDIYFOI-UHFFFAOYSA-N 442.357 4.348 10 10 IICE CC(C)Oc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)ccc1[N+](=O)[O-] 1136480608 RRGQGSJANYWQPE-OAQYLSRUSA-N 441.528 4.269 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)c(F)cc3C)CC2)cc1F 1150239400 GPXQBUZGWXRKAN-UHFFFAOYSA-N 425.273 4.007 10 10 IICE Cc1cc(C(=O)NC2([C@@H]3CCCCO3)CCC2)c(C)n1-c1ccc(Br)cn1 1152879170 KPHSBNVLQNNNME-SFHVURJKSA-N 432.362 4.473 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(O)(C(C)C)CC2)sc(C)c1-c1ccccc1 1198676511 SJATXPOZITVMFM-UHFFFAOYSA-N 444.597 4.322 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cn3ccccc3n2)nnc1N(C)CC(C)(C)C 1289423721 NTOPYYJSCQHMDD-UHFFFAOYSA-N 445.615 4.422 10 10 IICE CCC(CC)N1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CC1=O 1293124588 BCQWOBFXKGUJJF-HXUWFJFHSA-N 437.584 4.332 10 10 IICE CC(C)Cc1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1302932149 WRRAERZMCJXQKU-OAQYLSRUSA-N 439.648 4.360 10 10 IICE Cc1cccc(-c2nnc(N(C)CCOC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)n1 1304462591 XKCDTQWYRRLKDC-UHFFFAOYSA-N 448.615 4.331 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1coc(C(N)=O)c1 1306450026 HXCCNWWUKLMLAG-KRWDZBQOSA-N 431.414 4.304 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)c(C)n1-c1cccc(F)c1 1307299265 UZLZUUKQTMXJHZ-XMMPIXPASA-N 437.446 4.022 10 10 IICE COc1ccc(N2CCN(c3nnc([C@@H]4CCOC4)n3CCCC(C)(C)C)CC2)cc1F 1315513675 ZFRCXZJLAXULOR-GOSISDBHSA-N 445.583 4.083 10 10 IICE COc1ccc(Cl)cc1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1351912824 GUPRCUAANMLYOG-UHFFFAOYSA-N 425.960 4.386 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)c2)CC1 1448055274 PCAWPYQKVAEFLP-UHFFFAOYSA-N 441.290 4.435 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CS[C@@H](C)C(=O)NCC(=O)OC(C)C)c2C)cc1C 1459126052 KXHXTHUBRLAOFM-IBGZPJMESA-N 444.597 4.083 10 10 IICE COCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)sc2cccc(F)c12 1461077384 OMMAMSGRJOOVRD-HNNXBMFYSA-N 428.529 4.452 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3cccc(OC4CCCC4)c3)CC2)c(OC)c1 1461984469 SIRQYPOYSCVJMY-UHFFFAOYSA-N 438.568 4.307 10 10 IICE C[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)N1CCC(Cc2ccccc2)CC1 1464259383 IFZPTFMJNJCDGO-OAQYLSRUSA-N 437.653 4.199 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 1466398642 JMXAFVCBEUAHDL-KRWDZBQOSA-N 443.463 4.285 10 10 IICE Cc1cc(C(=O)NCc2noc(C(F)(F)F)n2)c(C)n1-c1ccc(Br)cc1 1467593746 DGGLSVLFXROBPM-UHFFFAOYSA-N 443.223 4.188 10 10 IICE Cc1ccc(C[C@H](CO)CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1Br 1469854480 RPXSPNRBTJWDMM-AEFFLSMTSA-N 448.405 4.035 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)CCN(C)C(=O)OC(C)(C)C)c2C)c1 1471033816 IFGRDXSIKVHANE-UHFFFAOYSA-N 428.577 4.411 10 10 IICE Cc1nnc(N(C)Cc2cnc(C(C)C)nc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1492782643 TZPZDYQAGKFPHL-UHFFFAOYSA-N 433.604 4.421 10 10 IICE CC1CCN(c2ccc(Cn3c(-c4cccnc4)nnc3N(C)CCCCCO)cc2)CC1 1512275782 LXMADABRBWJMSU-UHFFFAOYSA-N 448.615 4.224 10 10 IICE CCOC(=O)c1c(NC(=O)COCc2cc(C)on2)sc(C)c1-c1ccc(F)cc1 1525141886 UVTZICPMVSVXJF-UHFFFAOYSA-N 432.473 4.491 10 10 IICE Cc1ccc(-c2nc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)cs2)o1 1526002571 FOMATWXWXOUKBD-GJZGRUSLSA-N 429.517 4.394 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@]1(C)CC1(Br)Br 1529276870 BIKGZPRFQDEATA-MLGOLLRUSA-N 432.200 4.004 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3sc(NC(=O)OC(C)(C)C)nc3C)C2)cc1 1529708069 OVVGLYMFCWYXIH-HNNXBMFYSA-N 446.573 4.063 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1540440318 CTYVJZZFVADVDV-DYESRHJHSA-N 434.367 4.237 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(Cn2cc(Br)cn2)cc1 1540812032 QZYGPCDWIVYHDM-UHFFFAOYSA-N 439.357 4.224 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2C[C@H](C)S[C@H](C)C2)cc1 1547447085 OAWCFLXQUVVOIW-NSHGMRRFSA-N 429.634 4.007 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@H]1N(C)CCCC1(C)C 1554175188 KCZGQRBVEQUJBW-OAQYLSRUSA-N 439.629 4.393 10 10 IICE C[C@H](NC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1)c1ccccc1O 1557968057 QWTHHMAYUGVYGX-LBPRGKRZSA-N 429.270 4.491 10 10 IICE Cc1cc(C(=O)N2CC(=O)Nc3ccccc3C2)c(C)n1-c1ccc(Br)cc1 1570755947 JVKFCFALWSCEQV-UHFFFAOYSA-N 438.325 4.451 10 10 IICE Cn1nc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c2ccccc21 1586351505 BKNCPSXLTRNURW-FOWTUZBSSA-N 442.591 4.255 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)n1 1598290815 DXXIKLCWRFPTIY-QFIPXVFZSA-N 436.531 4.207 10 10 IICE CC[C@H](C)c1nnc(N2CCOC[C@@H](C3CCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1613355458 NOCJUTGNNOUBEK-PXNSSMCTSA-N 429.584 4.298 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3sc(Cc4ccc(F)cc4)nc3C)C2)cc1 1617263184 SGKBVKJQSIGWKP-GOSISDBHSA-N 425.529 4.199 10 10 IICE Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)n2)n1 1626722553 ALMIXPHDMDXLPF-HNNXBMFYSA-N 425.964 4.273 10 10 IICE Cc1sc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc1-c1ccco1 1631425677 LYLFHSGRJOZZHP-QGZVFWFLSA-N 445.972 4.394 10 10 IICE Cc1cc(C(=O)N[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccn1 1634510613 VNFXFFPCDLAWKY-RUZDIDTESA-N 432.524 4.020 10 10 IICE Cc1cc(C(=O)Nc2ccc3nc(O)n(C)c3c2)c(C)n1-c1ccc(Br)cn1 1634784576 GUTNPRASSRZEGB-UHFFFAOYSA-N 440.301 4.096 10 10 IICE O=C(NC1(Cc2ccccc2)CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1635335552 KBJNSSGIMOEQPW-UHFFFAOYSA-N 442.562 4.150 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F 1639254531 TWXCCWJBFAFSBT-AWEZNQCLSA-N 431.480 4.341 10 10 IICE Cc1cc(C(=O)Nc2cc(-c3nccn3C)[nH]n2)c(C)n1-c1ccc(Br)cc1 1643746789 XXOKLPSWYCHXIK-UHFFFAOYSA-N 439.317 4.233 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCc3c2n[nH]c3C)sc(C)c1-c1ccccc1 1656426835 UNCRDLNYWCRYPK-UHFFFAOYSA-N 438.553 4.323 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@@H](C)Oc3ccc(C(C)C)cc3)CC2)cc1F 1672567658 WUWWDFGWRQGSQY-GOSISDBHSA-N 429.536 4.257 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(c2cccc3cnccc23)C[C@@H]1C 1673743377 CYFOOAPAAJBPBR-RTWAWAEBSA-N 445.611 4.461 10 10 IICE C[C@]1(Cc2ccc(F)cc2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683195700 LBMFJGRQLXEUEZ-XMMPIXPASA-N 447.501 4.247 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CCO)c3ccc(Cl)c(Cl)c3)C2)cc1 1683782119 ITJMVBWCXSFOGA-QRWLVFNGSA-N 438.355 4.004 10 10 IICE CC1(C)C[C@@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1684174275 CQCFEVNOFDJAQF-QHCPKHFHSA-N 434.584 4.071 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@](C)(OC)C1CC1 1694001034 XEOVZZBUYZSOSS-DFBJGRDBSA-N 441.620 4.080 10 10 IICE C=CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncnn1C(C)(C)C 1705835809 VAGUGKHZXIRSKC-UHFFFAOYSA-N 444.587 4.370 10 10 IICE CCOCc1nnc(N2CCC[C@H](OC(C)(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1710713141 HEXFRKRRNDLBQR-NRFANRHFSA-N 429.609 4.021 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCC2(C)C)CCOC1 1746657516 DYDWMTGOFZLJHI-CYFREDJKSA-N 428.577 4.099 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@H](C)C1 1749800225 YUVJBTVHFFBDSO-OFAXGOBFSA-N 441.620 4.194 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N(C)Cc1cc(Cl)ccn1 1761697300 BGBFASWRXVNIOH-UHFFFAOYSA-N 449.990 4.391 10 10 IICE CC1=CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1762179505 SAXDXMYDMKCDET-UHFFFAOYSA-N 437.632 4.280 10 10 IICE CN(Cc1ccccc1O)c1nnc(CNC(=O)c2cccs2)n1CC1CCCCC1 1768684018 ONTFDHYHADJGLX-UHFFFAOYSA-N 439.585 4.192 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1770889022 JBSNZXLPUXYRLM-NRFANRHFSA-N 448.615 4.324 10 10 IICE CC[C@H](C)c1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1772851090 CGJBKBRNZIWKJS-SFHVURJKSA-N 447.574 4.284 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c1O 2236048569 FCVBNEDONOQGJK-CZUORRHYSA-N 443.382 4.336 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(C(=O)OC(C)(C)C)C3(CCC3)C2)c1O 2236054782 MJJWBYMCRZLTFJ-CYBMUJFWSA-N 441.366 4.185 10 10 IICE Nc1ccc(CCC(=O)Nc2ccc(Br)cc2I)cc1 2240337941 WZUWLIQIDCDJDT-UHFFFAOYSA-N 445.098 4.207 10 10 IICE CNCc1ccc(N(C)Cc2ccc(I)cc2)c(Br)c1 2280271873 AIIOTVINRPSRGO-UHFFFAOYSA-N 445.142 4.410 10 10 IICE COc1ccc(C=C2SC(=O)N(CCC(=O)Nc3ccc(C(=O)O)cc3)C2=S)cc1 2297450073 LHRHGXUZCIVCHT-UHFFFAOYSA-N 442.518 4.259 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3[N+](=O)[O-])C2=O)cc(OC)c1OC 2313608999 CNLQOVXTEGYDDT-UHFFFAOYSA-N 432.479 4.026 10 10 IICE COc1ccc(CN2C(=O)C(=Cc3cc(OC)c(OC)c(OC)c3)SC2=S)cc1 2323745240 ODQNJZSXQFWYAS-UHFFFAOYSA-N 431.535 4.122 10 10 IICE CC[C@@H](C)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323827359 YDAVXLYUGDVGAD-OQPBUACISA-N 432.336 4.289 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2cccc([N+](=O)[O-])c2)cc1 2332134625 QOOBJXBZLNLSSI-UHFFFAOYSA-N 429.432 4.447 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1cccc(Br)c1O)[C@H]2F 2333285165 UBSWLOMBQYRMCI-DMRZNYOFSA-N 429.330 4.123 10 10 IICE CN(C)c1ccc(C2(c3ccc(N(C)C)cc3)O[S@@](=O)c3cc(N(C)C)ccc32)cc1 15772721 PIZBWYWSPMVORZ-HKBQPEDESA-N 435.593 4.229 10 10 IICE CCOc1cc(/C=C2/SC(Nc3cc(C)ccc3C)=NC2=O)ccc1OCC(=O)O 16916127 XSQWHCPYRAGLEU-YBFXNURJSA-N 426.494 4.248 10 10 IICE CCCN(C(=O)c1ccc2c(c1NCCO)C(=O)c1ccccc1C2=O)c1ccccc1F 20108089 SMAPDFWCPRDCBW-UHFFFAOYSA-N 446.478 4.062 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1Cl)N2)N1CCOCC1 20700322 VPUUIAYDDUFWLK-DRSNIGMVSA-N 430.957 4.187 10 10 IICE COc1ccc(N2CCN(Cc3cccc(C(=O)N(C)Cc4ccccc4)c3)CC2)cc1 34684245 XKGOEMIJLLLQHI-UHFFFAOYSA-N 429.564 4.290 10 10 IICE COc1ccc(OCCCOc2ccc(/C=C3\C(=N)N4C=CSC4=NC3=O)cc2)cc1 34888064 APIAWDURXYXEER-OSPAEEFESA-N 435.505 4.320 10 10 IICE CCCc1nc(N2CCCN(Cc3ccccc3O)CC2)c2cnn(-c3ccccc3)c2n1 35925679 BXLYZCGRZZGRRU-UHFFFAOYSA-N 442.567 4.186 10 10 IICE Cc1cc(C(=O)N2CCCN(Cc3ccccc3)CC2)c(C)n1-c1ccc2c(c1)OCCO2 106073761 FNIHJJYGYCTVLB-UHFFFAOYSA-N 445.563 4.213 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1 170245016 UOESVCORHLDWNO-HXUWFJFHSA-N 430.548 4.210 10 10 IICE COc1ccc2nc(NC(=O)CN3C(=O)/C(=C\c4cccs4)SC3=S)sc2c1 208741573 XVMPWKPQBFQCGU-RIYZIHGNSA-N 447.588 4.206 10 10 IICE COc1ccccc1/C=C1/SC(=S)N(CCCC(=O)Nc2ccc(O)cc2)C1=O 210718879 QFQKRNOOYXNCEF-QGOAFFKASA-N 428.535 4.021 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(OCC(F)(F)F)n1 739564766 RXVPTPYLZWRYHK-UHFFFAOYSA-N 445.388 4.023 10 10 IICE CN1CCC[C@@H](CNC(=O)NCc2ccc(N3CCSCC3)cc2)[C@H]1c1cccs1 743555506 ZYMMLJADUYEPBE-UGKGYDQZSA-N 444.670 4.184 10 10 IICE Cc1nccn1-c1ccc([C@@H](C)NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 754911133 KVISWRGPXLKUCN-GOSISDBHSA-N 435.597 4.294 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2cc3ccccc3nc2O)cc1 767351942 BXNYKTRFXNUMED-QHCPKHFHSA-N 433.552 4.147 10 10 IICE CO[C@H](C)c1nc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cs1 785019514 RXEBBXAUMQADPL-MRXNPFEDSA-N 427.570 4.315 10 10 IICE Cc1ccc(-n2cccn2)cc1NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 789404633 HLXCGKCCZVIGRN-QZTJIDSGSA-N 437.519 4.255 10 10 IICE Cc1ccc([C@@H](NCc2cc(C)cc(Br)c2O)[C@H](C)S(C)(=O)=O)cc1 798088165 IJVSRBDXBAPIPB-KSSFIOAISA-N 426.376 4.036 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(OC(F)F)c(OC)c2)CCCC1 1124542170 FZTZDFONAGGDKA-UHFFFAOYSA-N 444.478 4.455 10 10 IICE CCSc1cc(Cl)ccc1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 1124584926 IEEYYNDSLQBCHW-UHFFFAOYSA-N 448.032 4.403 10 10 IICE Cc1cc(OCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1Br 1137727344 GYFMBZURDIQPRM-GOSISDBHSA-N 434.330 4.050 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4)c3C(F)F)CC2)cc1 1151502780 BCPFIJGEDCHYGX-UHFFFAOYSA-N 426.467 4.171 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3C[C@@H](OC(C)(C)C)[C@@H]3n3cccn3)c2C)cc1 1158289801 YOSVBQKOLAJLPG-DNVJHFABSA-N 436.556 4.226 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1scc(Br)c1Br 1162612437 JFPXWUVKZNFNGL-UHFFFAOYSA-N 442.132 4.457 10 10 IICE C[C@@H](NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)c1ccccc1O 1171717201 NEXGMYLNTCGZMM-OAHLLOKOSA-N 436.961 4.101 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1 1229653574 QCMNMOWOJBMTOM-QHCPKHFHSA-N 438.616 4.075 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1255015891 HDADWIYNXLDSHB-ZJOUEHCJSA-N 430.593 4.072 10 10 IICE COc1cccc(CNC(=O)NCc2c(Cl)cc(Br)cc2Cl)c1O 1255804944 NMODTSWKKPKZAS-UHFFFAOYSA-N 434.117 4.470 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccnc4cc(Cl)ccc34)cc2F)CC1 1265012289 VRUKFOOYWWNTFF-UHFFFAOYSA-N 426.923 4.099 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)cc2Cl)C1 1270438827 CNTUUBJRKDEUBR-INIZCTEOSA-N 435.996 4.450 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C)C3)n2CCOC(C)(C)C)c(C)n1-c1ccccc1 1304197257 RZTQQRRRSZHKKF-LJQANCHMSA-N 437.588 4.393 10 10 IICE C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307695740 PAXSMBQMPAFLSB-IAGOWNOFSA-N 441.531 4.206 10 10 IICE CC[C@H](CSc1ccccc1)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1312340908 FTJIJYCHZIECGK-QGZVFWFLSA-N 435.540 4.172 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H]3CC[C@@H](c4cccc(Cl)c4)C3)cc2)CC1 1312848708 ULCLBLIYTGZYOI-IRLDBZIGSA-N 426.992 4.227 10 10 IICE CCN(CC)C(=O)C1(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCCCC1 1351289423 ZBOIEZJVBONOOT-UHFFFAOYSA-N 439.600 4.216 10 10 IICE CCCc1ccc([C@@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2cccs2)cc1 1440863533 CPFGUTYAWRTZHI-OAQYLSRUSA-N 444.578 4.297 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1CSCCN1C(=O)OC(C)(C)C 1441913968 LZMRXDOQZJMORX-HXUWFJFHSA-N 435.634 4.232 10 10 IICE Cc1cc(C(=O)Oc2ccc3c(c2)NC(=O)CC3)c(C)n1-c1ccc(Br)cn1 1447791202 CXSIOSRMEHGUHP-UHFFFAOYSA-N 440.297 4.356 10 10 IICE Cc1ccc(C(=O)NC[C@@H]2CCCN(CC(F)(F)F)C2)cc1-n1c(C)cc(C=O)c1C 1450321516 ZJGQCSOBDXATBU-SFHVURJKSA-N 435.490 4.219 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 1457037692 NAOSKBVFDWNESI-MRXNPFEDSA-N 427.715 4.273 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@]2(c3ccccc3)C[C@@H](NC(=O)OC(C)(C)C)C2)c1 1465993653 VEJUQVXEWWEXAB-YLNNLZOCSA-N 440.540 4.203 10 10 IICE COC(=O)[C@]1(c2ccccc2)CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1468448083 QISQZJXSRSQJFL-AREMUKBSSA-N 432.520 4.060 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC3CCN(c4ccncc4)CC3)cc2Cl)C1 1478529184 XDOIXBRRARQKAS-GOSISDBHSA-N 442.007 4.440 10 10 IICE CN(Cc1ccc(Br)s1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1479535948 ZEYBKXUIPNLLQV-KRWDZBQOSA-N 439.423 4.021 10 10 IICE CCC[C@H](Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O)OC 1514332440 QOJIUEGIYWDXBY-MRXNPFEDSA-N 448.365 4.193 10 10 IICE COc1ccc([C@@H]2C[C@H]2CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 1527481805 RJSLIPKKLAZLOH-ODHOGUPTSA-N 426.532 4.258 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)cc1 1543640391 DAPAPXFWYFKMCJ-IBGZPJMESA-N 443.547 4.453 10 10 IICE CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1544721620 UKXRHTITNKGQHC-AMDXRBSFSA-N 427.633 4.209 10 10 IICE C[C@H]1SCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)[C@@H]1C 1545157157 RJCSMMAAIZWUSD-HUUCEWRRSA-N 432.644 4.309 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1545606535 RXUYIFUSUNJTHP-UHFFFAOYSA-N 448.494 4.250 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CC[C@H](F)C3)CC2)cc1F 1554960122 AQPAZSIRVWARGK-MSOLQXFVSA-N 447.574 4.479 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2ccccc2)C2(CO)CCOCC2)c1 1557223349 CGVRYDIBBUVIFQ-VWLOTQADSA-N 446.547 4.167 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCc3cccc4c3OCCO4)cc2Cl)C1 1564649791 NENUOKNVEBLXBB-KRWDZBQOSA-N 443.975 4.389 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCCOc3ccc(Cl)cc3Cl)cc2)CC1 1598277723 XBQKYONSTZIXBF-UHFFFAOYSA-N 436.383 4.221 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(C3CC3)[C@@H](C)c3ccc(Cl)cc3)CC2)cc1 1615906773 GRCYCGDVYFMSPP-YADARESESA-N 444.019 4.057 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](O)COc2ccc(C(F)(F)F)cc2)cc1 1622497361 FGRXDNYGGBOFEC-FQEVSTJZSA-N 432.442 4.283 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC[C@@H]2CC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1628496494 ZFPQXVFVPATZKG-UXHICEINSA-N 433.593 4.030 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc2cccnc2c1O)c1c(F)cccc1F 1630532118 HVIIKXFLKBYNPF-IBGZPJMESA-N 443.450 4.101 10 10 IICE Cc1ccc(C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1631283847 SKHPNYYPBLVUGJ-UHFFFAOYSA-N 446.551 4.358 10 10 IICE CCOc1cc(NC2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)ncn1 1633576234 XMWQXOMPQVUQKI-UHFFFAOYSA-N 433.556 4.308 10 10 IICE Cc1ccc2cc(Cl)cc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c2n1 1634424167 USUMBBLTQBLBFP-UHFFFAOYSA-N 427.907 4.227 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](C2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)C1 1638251615 PTUQFMPDPNOZGQ-HNNXBMFYSA-N 446.569 4.422 10 10 IICE COC(=O)C[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1cccc(C)c1 1644180955 UHNVHRHTNYPCHY-XMMPIXPASA-N 432.520 4.178 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1cc2cnccc2o1 1650731998 PLKRGZRUKAEDLI-YVLHZVERSA-N 443.575 4.187 10 10 IICE Cc1cc(C(=O)N2CC[C@](CO)(C(F)(F)F)C2)c(C)n1-c1cccc(Br)c1 1651583603 GHZKTWVNRZYCLP-SFHVURJKSA-N 445.279 4.244 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1 1682071633 NZFZCGOLFUHDOJ-UXHICEINSA-N 432.609 4.368 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)N(C)C(=O)OC(C)(C)C 1693999872 VVGOMWFJKRXKMK-SJORKVTESA-N 431.581 4.389 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)OC)CC1 1694976448 BZWVPHPZOPZEEO-UXBLZVDNSA-N 448.571 4.207 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)N1CCC[C@H](C)C1 1712655365 KQICPYAGRJXATC-ICSRJNTNSA-N 436.604 4.471 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCC2(C)C)CCOC1 1723665662 DMDFSSQIZQEBRG-NLFFAJNJSA-N 442.604 4.487 10 10 IICE C[C@@H]1CCCN1c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCCSc1nccs1 1726580148 QQJAMTWSHSXCIT-CQSZACIVSA-N 430.559 4.481 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCOC3)n2CCOC(C)C)c(C)n1-c1ccccc1 1751409879 ONBKMWIKKKFQEZ-NRFANRHFSA-N 437.588 4.250 10 10 IICE COc1cc(/C=C2/SC(=S)N(Cc3ccc(Cl)cc3)C2=O)cc([N+](=O)[O-])c1O 1858591112 YGAWAWIZNWBLGQ-OVCLIPMQSA-N 436.898 4.364 10 10 IICE O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1c(F)cccc1Cl 1865678174 YBHQHNWXEKXKRM-POHAHGRESA-N 443.740 4.437 10 10 IICE CC(C)[C@H](C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1)N1C(=O)c2ccccc2C1=O 1865902176 UCTKYEVHOSVUHN-HSZRJFAPSA-N 427.504 4.119 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)c4cc(Cl)cc(Cl)c4oc3=O)CC2)cc1 1866411002 JNCPSNPZGVCWQC-UHFFFAOYSA-N 447.318 4.379 10 10 IICE CC(C)(C(=O)O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)nc(O)c1 1952461733 ARHXPJKQMGONHN-QFIPXVFZSA-N 448.475 4.183 10 10 IICE O=C1C(=Cc2ccc(-c3ccccc3F)o2)SC(=S)N1CCCN1CCOCC1 2040480294 MKQRKPVVNYLVOL-UHFFFAOYSA-N 432.542 4.009 10 10 IICE CCc1nn(Cc2c(O)cccc2Br)c(I)c1CC 2079673827 ARCZBAPDNGPDEB-UHFFFAOYSA-N 435.103 4.129 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)cc(F)c2O)CC2(CC2)C1 2098587713 LREVIBNHJFZLLQ-CQSZACIVSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](CNCc1cc(Br)ccc1O)C2 2103452542 UVPSPDUBKIBKIQ-FFGGFLGDSA-N 425.367 4.422 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)C(=Cc3ccc4c(c3)OCCO4)SC2=S)c1 2321683276 FJGCCDIYNJBCMU-UHFFFAOYSA-N 447.921 4.304 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CC(=O)N(C)Cc1ccc(C)c(Br)c1O 2381136031 ZLQCEQBWBDBPJQ-CQSZACIVSA-N 443.382 4.457 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)C2=O)cc1 8644076 IOQMMDSFLHWGEF-VWLOTQADSA-N 433.483 4.192 10 10 IICE CC(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)N(C)C(=O)CO4)cs2)cc1 11857564 HZMQPDDRFNSNKO-UHFFFAOYSA-N 443.550 4.090 10 10 IICE CSc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@@H]32)cc1 14551914 MCXYKLOUFZBCQH-JTAQYXEDSA-N 442.606 4.256 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(CCCC(=O)OCC)C2=O)cc1OCC 206867429 WZRYTIARCAFWGN-NBVRZTHBSA-N 437.583 4.419 10 10 IICE Cc1ccc(Cn2nccc2NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)o1 435919277 WFCJJXTWVDNNKW-UHFFFAOYSA-N 431.540 4.193 10 10 IICE O=S(=O)(Nc1nc(-c2sccc2Br)cs1)c1ccc2c(c1)CCO2 727248123 FLBSIRCAGOQQKS-UHFFFAOYSA-N 443.369 4.370 10 10 IICE CC(=O)c1csc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c1 730355391 ROSMMFABGMLIBX-UHFFFAOYSA-N 425.462 4.127 10 10 IICE CCN(C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H](C)c1cccnc1 734526288 PAAATCCUWDDDLG-MRXNPFEDSA-N 436.478 4.230 10 10 IICE Cc1cc(C)nc(-n2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)c(C(C)C)n2)n1 744357892 BOWNKNXCKGNLFX-UHFFFAOYSA-N 432.572 4.273 10 10 IICE O=C(c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1F)N1CCCC1 763389061 IGIJEZDNJNUSHQ-UHFFFAOYSA-N 449.504 4.125 10 10 IICE CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)Cc1ccc(N2CCOCC2)cc1 768180856 PZFWEGJQHAYDKQ-UHFFFAOYSA-N 435.490 4.391 10 10 IICE CC1(C)Oc2ccc(NC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)cc2O1 768878484 PKBMWWZKYHTEQX-UHFFFAOYSA-N 436.556 4.048 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC[C@@H](C(F)(F)F)[C@H]2C)c([N+](=O)[O-])c1Br 795191578 GVKZBJHJRYADCS-RNFRBKRXSA-N 428.161 4.051 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](C)c3nnc4n3CCCCC4)cc2Cl)C1 799860524 CEZSLLTUIGIKDH-IRXDYDNUSA-N 445.011 4.455 10 10 IICE COCc1nc(C(=O)NCc2cc(Br)ccc2O)c(-c2ccccc2)s1 804734279 HHODJJOVDZBSHM-UHFFFAOYSA-N 433.327 4.355 10 10 IICE Cc1cc(CCNC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c(C)n1-c1ccccc1 1131781773 NZSJOLHQJNIWFX-PMACEKPBSA-N 432.568 4.075 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cscc1Cl 1133603019 NBCCAYBKUOZRHP-CHHVJCJISA-N 440.974 4.448 10 10 IICE Cc1ccc(C(=O)NCc2ccccc2Cn2cccn2)cc1-n1c(C)cc(C=O)c1C 1135869969 HLUHYPPOWBLDJC-UHFFFAOYSA-N 426.520 4.390 10 10 IICE COc1cc(C2(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)CC2)ccc1C 1137438445 LCQFAQJUEIEGAD-FQEVSTJZSA-N 428.960 4.175 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 1138290319 ZDHWGKJSSXNTGL-HXUWFJFHSA-N 439.556 4.426 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC[C@H](C(=O)OCc2ccccc2)c2ccccc2)cc1 1138319598 XXUZAMZUAYRNJQ-NRFANRHFSA-N 430.464 4.106 10 10 IICE CC(C)(C)OC(=O)NCC[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2ccc(O)c(O)c2)C1 1156511724 LLNHVIYNJCOFJD-LECLMCCNSA-N 438.524 4.231 10 10 IICE CCOC(=O)[C@@]1(CNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CCCOC1 1287367251 GXLBHBYITXSOEJ-XMMPIXPASA-N 438.528 4.258 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(OC[C@H]4CCOC4)CC3)c2C)c1 1313133814 WOEOZIDQZZTWQO-NRFANRHFSA-N 425.573 4.130 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3csc(-c4ccccc4)n3)cc2F)C[C@H](C)O1 1350934083 XVCXEGALCUAUDL-HOTGVXAUSA-N 425.529 4.493 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1351559123 YHJZILVZRBDIIZ-RMENWYJGSA-N 426.538 4.395 10 10 IICE COC(=O)c1cc(CNC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)ccc1OC 1352592978 QWFUOOAELAXYHI-UHFFFAOYSA-N 426.900 4.473 10 10 IICE CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1354578324 WEQAOYUXVYHIAH-HXUWFJFHSA-N 436.508 4.484 10 10 IICE CN(CCc1ccccc1C(=O)N1CCN(C)c2ccc(F)cc21)C(=O)OC(C)(C)C 1361036788 QFIKUNVDILSRHX-UHFFFAOYSA-N 427.520 4.332 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)C(=O)c1ccc(Br)s1 1435414830 HRDVYSFNIMLSTP-UHFFFAOYSA-N 427.283 4.042 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)Oc3ccccc3Cc3ccccc3)C2)cc1 1437573432 BSYDATJRSIGJJH-NFBKMPQASA-N 430.548 4.448 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)[C@@H]([C@H]2CCCO2)C1 1439569221 MZNNQXGOOYDLEW-ZPMCFJSWSA-N 444.959 4.320 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1F 1443774539 UYKHCBZEECLSQB-GCJKJVERSA-N 431.939 4.161 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2c(Cl)n[nH]c2C2CC2)NC(=O)OC(C)(C)C)cc1 1444516065 XZRHFXJUAGWNSS-MRXNPFEDSA-N 447.967 4.002 10 10 IICE COC(=O)C[C@H](Cc1ccccc1)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1456847009 MHQUFBPMISDVAP-QHCPKHFHSA-N 432.520 4.119 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)c2ccc(S(=O)(=O)N(C)C)cc2)c1 1459621992 UZGICAICNDZRAD-UHFFFAOYSA-N 445.972 4.274 10 10 IICE CCN1CCN(C(=O)c2ccc(NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)cc2)CC1 1464599201 LBKIKGHKTQWQDD-UHFFFAOYSA-N 444.579 4.433 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(N3N=C(Cc4ccccc4)CC3=O)cc2)cc1F 1472496947 WVOINWKTGOTVPL-UHFFFAOYSA-N 444.510 4.157 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC2CC2)cc1 1473791904 KHYSNRHLGNLJKI-WOJBJXKFSA-N 439.575 4.281 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1CC 1514639318 OVNXALPCMCYWPJ-UHFFFAOYSA-N 432.576 4.249 10 10 IICE Cc1ccc(CO[C@@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 1527246719 XGSMRUMCDCRLEW-KRWDZBQOSA-N 436.474 4.072 10 10 IICE CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1=O 1527594364 AOJXWVMHYILWDP-UXHICEINSA-N 437.584 4.156 10 10 IICE CCc1ccc(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1530186779 KODIQQGASWTRIS-HKWRFOASSA-N 442.581 4.338 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1 1538160047 IPLHAGIGCALRJA-UHFFFAOYSA-N 448.523 4.424 10 10 IICE CC(C)CCN1CCC(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)CC1 1541523668 SGURGFNKCUMYNL-HSZRJFAPSA-N 441.620 4.230 10 10 IICE COCc1cccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1542566098 NHZUCPBGRHMSBW-UHFFFAOYSA-N 428.330 4.328 10 10 IICE Cc1cc(C=O)c(O)c(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 1546150454 OKHGRYYJGMLLTM-UHFFFAOYSA-N 443.547 4.130 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1ccccc1CS(=O)(=O)c1ccccc1 1558553807 BAJKZMKDEOWUHC-UHFFFAOYSA-N 431.513 4.449 10 10 IICE COC(=O)CC1(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CCCC1 1558675431 DGMOBKNBIBYWTP-UHFFFAOYSA-N 448.361 4.105 10 10 IICE Cc1ccccc1[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 1585943687 YXSXXDMOFSIGOP-OAQYLSRUSA-N 442.562 4.444 10 10 IICE CN(C)c1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1F 1595928715 HFZFNAHGOVINMV-WQRHYEAKSA-N 447.532 4.261 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN1CC=CCC1 1617125902 KDQQQSJCJIJWSR-UHFFFAOYSA-N 448.615 4.087 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)OCc2ccccc2)[C@H](C)O)c(C)n1-c1ccc(C(C)C)cc1 1624810826 XCJAVCJHSAFHMB-CPJSRVTESA-N 448.563 4.440 10 10 IICE Cc1cc(C(=O)NCC(=O)NC2CCCCC2)c(C)n1-c1ccc(Br)cc1 1626961703 OSONQKVFRPXWDT-UHFFFAOYSA-N 432.362 4.035 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H](C(C)(C)O)C2)sc(C)c1-c1ccccc1 1644427692 DUSWUMLPLUIPQZ-GOSISDBHSA-N 444.597 4.322 10 10 IICE NC(=O)COc1cccc2c1CCCN2CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1654514500 LMLCMQAXOXWYFS-UHFFFAOYSA-N 443.507 4.357 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCO[C@H](c3ccncc3)C2)cc1 1682628278 PGFPZYMEZFBUEI-URXFXBBRSA-N 434.540 4.373 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC3(C)CCC4(CC3)OCCO4)cc2Cl)C1 1686269159 LLNWHUALQFDZRL-KRWDZBQOSA-N 435.996 4.451 10 10 IICE CC(C)[C@H](Cn1c(CC2CC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1691596276 FONHXWOPERHQDC-IBGZPJMESA-N 443.592 4.122 10 10 IICE CC(C)N(CCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)C(C)C 1692482160 MBTZZTLLELFEHR-NRFANRHFSA-N 429.609 4.023 10 10 IICE C[C@@H]1SCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)[C@H]1C 1693877650 SHWXNSZQUQQAIG-GJZGRUSLSA-N 432.644 4.309 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1CC 1705895790 SEQHYAZJYHYKFP-FDDCHVKYSA-N 446.599 4.280 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(CC)C[C@@H]2CCCO2)cc1 1710026202 ALFWUMQFWVAVKM-XZOQPEGZSA-N 441.620 4.420 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1712794545 ZNHRUGDCPMBNAS-LJQANCHMSA-N 445.677 4.236 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1727028731 QCKTWSSCEKFFEP-CHWSQXEVSA-N 435.541 4.198 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCSC3(CCOCC3)C2)cc1 1746085588 DJHHVYBRSBUVTG-UHFFFAOYSA-N 443.661 4.398 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@]1(C)CCCO1 1747753508 HVWYADBYMDSUEJ-FPGHNAPASA-N 428.577 4.108 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC(CN(C)C(C)C)CC1 1751432232 BIDTVIVVRHYREZ-UHFFFAOYSA-N 440.680 4.456 10 10 IICE CC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOCCN(C)C)CC1 1762168460 ACIXUWIVQDJULY-UHFFFAOYSA-N 448.615 4.087 10 10 IICE CCS[C@H]1CC[C@@H](N(C)c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)C1 1768361485 NPBMWJADVSEJHY-RTWAWAEBSA-N 431.675 4.298 10 10 IICE COc1ccc(-c2nnc(N3CCCO[C@@H](C)C3)n2CCCSc2nccs2)cc1 1770074413 MGLWSDKOFYIZAC-INIZCTEOSA-N 445.614 4.208 10 10 IICE COC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1770902169 VNUSNDWXZFKAKF-CTNGQTDRSA-N 437.588 4.250 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2ccc(Br)cc2O)C12CCC2 2120832083 MQHQLZORPGVERO-HNNXBMFYSA-N 425.367 4.424 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccc(C(C)C)cc3)C2=O)c(C)n1-c1ccncc1 2294216936 RBXVTBRREZJBBJ-UHFFFAOYSA-N 444.560 4.444 10 10 IICE CN1C(=O)C(=C2SC(=S)N(c3ccccc3)C2=O)c2cc(Br)ccc21 2314717337 DXFYNWQVBNOABH-UHFFFAOYSA-N 431.336 4.202 10 10 IICE O=C(O)[C@H](Cc1ccc(O)cc1)N1C(=O)C(=Cc2cccc3ccccc23)SC1=S 2318684179 SNCOKPNDGYYCHC-IBGZPJMESA-N 435.526 4.443 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1cc(Br)ccc1O)[C@H]2F 2333275661 GPUMEUHDJGZBDH-WBTNSWJXSA-N 429.330 4.123 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccc(F)cc1 15039591 SEEMDVCDXBRJNH-ATVHPVEESA-N 445.497 4.354 10 10 IICE O=C(CN1C(=O)/C(=C\c2cccc(Cl)c2)SC1=S)Nc1ccc2nccnc2c1 102733281 AEZKQMGOCHMWCI-RQZCQDPDSA-N 440.937 4.123 10 10 IICE CC(=O)Nc1cccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526395957 FKVAUQRVEYWASV-HSZRJFAPSA-N 430.460 4.422 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C[C@H]2CCCC[C@@H]21 727134562 ZYJSRSINQFTJAR-HJNYFJLDSA-N 427.589 4.471 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769056726 DIDGSNDUZTTYEY-UHFFFAOYSA-N 436.600 4.046 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 780414115 BNSFBGINYYDXFG-UHFFFAOYSA-N 435.430 4.048 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cccc(-c4noc(CC(C)(C)C)n4)c3)C2)cc1 1130826600 DTRNBIHTERYRKW-LJQANCHMSA-N 434.540 4.343 10 10 IICE COC(=O)c1scc(C)c1NC(=O)[C@H](C)N(Cc1ccc(N(C)C)c(C)c1)C(C)C 1175838741 QXFUWOCCKLZXQB-KRWDZBQOSA-N 431.602 4.455 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCC[C@H](N(C)C)C(F)(F)F)cc2Cl)C1 1227209812 WRODJFQCWUNMFR-KDOFPFPSSA-N 434.934 4.258 10 10 IICE CCc1oc2ccccc2c1CN(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251750603 GJWMWUXNGPXCPN-UHFFFAOYSA-N 443.494 4.452 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)Nc3sc4c(c3C(=O)OC)CCC4)CC2=O)cc1 1264229539 IVJAUPKAVCIOBN-INIZCTEOSA-N 440.565 4.358 10 10 IICE O=C(C/C=C/c1ccc(Br)cc1)NCc1ccc(N2CCOCC2)c(F)c1 1264687791 KAIOCULACDDZNF-OWOJBTEDSA-N 433.321 4.145 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1c(NC(=O)OC(C)(C)C)cnn1C 1290331737 PCENQRXVEAKDDM-UHFFFAOYSA-N 427.549 4.030 10 10 IICE O=C(N[C@@H]1CCCCC12CCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1298649270 NZSBFVRBZCHDKG-GOSISDBHSA-N 434.583 4.487 10 10 IICE O=C(NCC[C@@H]1CCc2ccccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1298684105 CYZFAXTZSSFXAG-INIZCTEOSA-N 442.562 4.104 10 10 IICE FC(F)(F)COc1ccc(CN(Cc2cccs2)c2ccc3c(c2)OCCO3)nn1 1307528947 KTSUMZRXRKTSIQ-UHFFFAOYSA-N 437.443 4.457 10 10 IICE COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1307628192 CSZXFRZWWNUSDR-CVEARBPZSA-N 428.488 4.148 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@H](C(F)(F)F)[C@H]1C 1307734523 PISDBCBECIXGJO-PBFPGSCMSA-N 430.426 4.062 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CC4)n3CCSCC(C)C)CC2)cc1 1315512043 HHDLUUKPNGTZAZ-UHFFFAOYSA-N 429.634 4.270 10 10 IICE CC(C)CCN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359911261 MJIQUZDYVIOVSX-UHFFFAOYSA-N 427.637 4.315 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)Cc1ccccc1Cl 1441783518 LNJFODLMYKNZJU-HDICACEKSA-N 447.982 4.231 10 10 IICE O=C(c1cc2cccc(C(F)(F)F)c2nc1O)N(Cc1ccccc1O)C[C@H]1CCCO1 1446566543 LOHSUGMTCQPBHN-MRXNPFEDSA-N 446.425 4.486 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 1446795901 BWHYWGYIKYRRRL-STZQEDGTSA-N 434.536 4.047 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(Br)cc(N2CCCC2)c1 1451959234 WMNAHTDQTMFZNV-UHFFFAOYSA-N 426.314 4.233 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2 1454110170 XADYSKWYMZYDDX-PMACEKPBSA-N 437.540 4.131 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3cccc(Cl)c3)cc2Cl)C1 1467502618 PBSWGLYBAHAEHH-OAHLLOKOSA-N 434.367 4.276 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(CNC(=O)OC(C)(C)C)c1 1469103439 HKHFUQLOHVJLHJ-SFHVURJKSA-N 425.573 4.447 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2c(C)c(Br)ccc2[nH]1 1469231711 WJCNJGBIRFZIKD-UHFFFAOYSA-N 445.313 4.150 10 10 IICE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(C)n(-c3ccc(OC)cc3)c1C)CCS2 1472273700 MKEKVYJLVFNVGM-RKDDFOCISA-N 442.581 4.050 10 10 IICE Cc1cccc(C)c1[C@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786775 WDOTUFVAYQBYRA-OAQYLSRUSA-N 429.511 4.465 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1499720538 CDXLKDXGPKFPTI-SFHVURJKSA-N 440.592 4.234 10 10 IICE CCCCCn1c(Cc2cccnc2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1500341417 ZFSVUAGJSJAXHG-UHFFFAOYSA-N 434.588 4.179 10 10 IICE COCC[C@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1504787696 ZZRNYNIEIPYSIF-OAQYLSRUSA-N 425.621 4.296 10 10 IICE CC(C)Oc1cc(Br)ccc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1537478158 WNPIVGSWFQBJOQ-HXUWFJFHSA-N 448.405 4.335 10 10 IICE CC1CCC(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)CC1 1537497433 HRHUFUGKALBLCI-IPCDKGFNSA-N 439.522 4.071 10 10 IICE CCO[C@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NCc2ccc(N(CC)CC)cc2)C1(C)C 1542089499 QETINRLZZMUMLH-NBGIEHNGSA-N 447.620 4.248 10 10 IICE CC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)[C@@H]1CN(Cc2ccccc2)CCO1 1543744724 PVLNGIOVPAAYSM-SXOMAYOGSA-N 445.607 4.432 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CC2)cc1 1544892411 RNIUMJYOZPSFGS-UHFFFAOYSA-N 433.552 4.464 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3cccc(C(=O)OC(C)C)c3)n2)c(C)n1-c1ccccc1 1559346992 ILXWKPNGZDWEQP-UHFFFAOYSA-N 443.507 4.196 10 10 IICE O=C(c1ccc(I)cc1O)N(Cc1ccco1)Cc1ccccc1O 1566302930 PZJVTZPHFJKRJE-UHFFFAOYSA-N 449.244 4.138 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(I)cc1F 1585263274 AGHOADIHZKQJCA-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE CCO[C@@H]1COCC[C@@H]1CC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 1585492788 MUVWFQCGFYTCJL-HYBUGGRVSA-N 426.557 4.126 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](C2CCC2)CC1 1588094831 CNKQSOAOADXGAI-MRXNPFEDSA-N 434.583 4.297 10 10 IICE CCOCc1nnc(N2CC[C@@H](CC(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1616783030 VYKDMNNMXHDIAM-NRFANRHFSA-N 443.661 4.289 10 10 IICE Cc1cc(C(=O)N[C@H](CCC(C)(C)C)C(N)=O)c(C)n1-c1ccccc1Br 1618095468 IRVJHZCJVXPYKP-QGZVFWFLSA-N 434.378 4.267 10 10 IICE Cc1cccc(-n2ccnc2SCC(=O)NCc2cccc(Br)c2O)c1C 1626822117 JEIRPRXBUYOTFF-UHFFFAOYSA-N 446.370 4.366 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC[C@H]2CC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1628496496 ZFPQXVFVPATZKG-VQTJNVASSA-N 433.593 4.030 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccnc(O[C@H]3CCOC3)c2)cc1 1628565299 LCWSZGDRCKMHNG-DEOSSOPVSA-N 447.535 4.171 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1ccc(C(F)(F)F)cc1 1630280333 KACJNPRPAUOTLZ-QAPCUYQASA-N 444.400 4.125 10 10 IICE Cc1cc(C(=O)N2CCCc3c(cnn3C)C2)c(C)n1-c1cccc(Br)c1 1637965415 BEGIGNPNYVIHLR-UHFFFAOYSA-N 427.346 4.179 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)C[C@H]1CCC(=O)NC1 1638241816 XHSOBWCISQIYLM-BEFAXECRSA-N 433.474 4.214 10 10 IICE COC(=O)CCn1nc(C)c(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1C 1642673192 IVPPIFLAWACUSI-UHFFFAOYSA-N 442.947 4.305 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2C[C@@H](C)O)sc(C)c1-c1ccccc1 1645480025 LAOBPBUJLPOTPP-VQIMIIECSA-N 444.597 4.464 10 10 IICE COCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H](C)c1ccccc1 1653248742 XFSQQWWVSCFSMM-GOSISDBHSA-N 442.515 4.110 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCOC3CCSCC3)cc2Cl)C1 1672137678 UWUCXYOLLGXXCM-INIZCTEOSA-N 426.026 4.288 10 10 IICE C[C@H](NC(=O)N[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1)c1ccc(N(C)C)cc1 1680281242 WQMDOJLDCLLWQH-OJAHFUOMSA-N 430.593 4.148 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCc4ccccc4NC3=O)cc2Cl)C1 1680561317 BVDPTLHDWQIEIP-IIBYNOLFSA-N 440.975 4.329 10 10 IICE COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)CCC2 1683252949 AYDNOVJECIKZPQ-XMSQKQJNSA-N 437.584 4.198 10 10 IICE Cc1cc(CN(C)c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)no1 1692992725 UKKFWTCGTWEBGA-UHFFFAOYSA-N 440.617 4.011 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc([C@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1694800034 KUNIAVVVGKTSJV-ZWCUEREDSA-N 429.609 4.050 10 10 IICE CCCCCN(c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(C)C)c(F)c1)C(C)C 1709566598 CJQKUUPAWAFRLK-UHFFFAOYSA-N 444.599 4.173 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCCCCC2)n1Cc1ccc2c(c1)CCCN2C 1712550574 COQQXHBMZJSJGM-FQEVSTJZSA-N 441.620 4.203 10 10 IICE C[C@@H]1CN(c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(F)(F)F 1712841597 FSAFVICQUVZGAX-CZUORRHYSA-N 425.474 4.119 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2c(C)nn(C)c2C)n1CCCSc1nccs1 1726874194 CEFNSLRWXGQHQR-AWEZNQCLSA-N 433.651 4.417 10 10 IICE C[C@@H]1CCCN(CCCCn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1752173580 JGXGFOSCJFSFLC-OAQYLSRUSA-N 448.615 4.118 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1764935364 QLDZEWZRWYBOAE-QFIPXVFZSA-N 448.615 4.406 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1C[C@@H]1CCCO[C@H]1C(C)(C)C 1768681476 KDGVRWTZNCMJBP-TUNNFDKTSA-N 442.604 4.355 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1771437150 UUKZCCHXKBQZIN-JKSUJKDBSA-N 439.676 4.490 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)N(C)C)cc1 1858594444 ZSZVLFXZBVFGPE-LPGQDOADSA-N 443.550 4.108 10 10 IICE CCOc1ccc2cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c(=O)oc2c1 1859707068 HIEQXUONOUTSLQ-UHFFFAOYSA-N 439.423 4.219 10 10 IICE CCC[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1Cc2ccccc2C1=O 1874180001 VJQPMXMEBPSGLM-QFIPXVFZSA-N 438.483 4.225 10 10 IICE Cc1ccc(O)c([C@@H](C)NC[C@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c1 2084723464 YPVVYFNTRFYGTN-IRLDBZIGSA-N 439.600 4.473 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@](C)(F)[C@](C)(Br)C3)ccc(N)c2C1 2205660028 AMLIGALKLTZPRH-UXHICEINSA-N 442.373 4.264 10 10 IICE CC(C)(C)OC(=O)N1CCC(NCc2cc(Br)ccc2O)(C(F)F)CC1 2227503133 QIOYKCPVNZNSKA-UHFFFAOYSA-N 435.309 4.279 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)CC2)c1O 2236051015 NDQOMUBVUKVLFY-KGLIPLIRSA-N 443.382 4.479 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)[C@H](Cc1ccccc1Br)NC(=O)OC(C)(C)C 2237422207 SJGYQKVNJKVPMP-HNNXBMFYSA-N 440.342 4.044 10 10 IICE CSc1ccc(C=C2SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 2323809179 HIHLACLDTLMZCW-INIZCTEOSA-N 431.560 4.011 10 10 IICE COC(=O)c1ccc(-c2ccc(/C=C3\C(=N)N4N=C(CC(C)C)SC4=NC3=O)o2)cc1 18169181 NQPFGDJTAAWMQV-GESHDMKESA-N 436.493 4.398 10 10 IICE CC(=O)N(c1nc(/C=C2\SC(N3CCCCC3)=NC2=O)cs1)c1ccccc1F 26456140 VMDOUKODEPHJNV-BOPFTXTBSA-N 430.530 4.423 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)CCc3ccccc3)CC2)c(C)n1-c1ccccc1 62694168 CPIDFLNGYUXTQL-UHFFFAOYSA-N 429.564 4.054 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccccc2O)SC1=S)NCc1ccccc1 210758994 ZVUBNMBVBWSFOU-HMMYKYKNSA-N 440.590 4.470 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(F)cc3F)[C@@H]2c2ccc(O)c(O)c2)c1 526549637 DRIBPWUDHVBPJN-OAQYLSRUSA-N 425.387 4.442 10 10 IICE Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)n1 731120908 HSTONSUURSVDMB-QFIPXVFZSA-N 449.599 4.187 10 10 IICE CC(C)(C)OC(=O)N1CCc2cccc(/C=C3\SC(=S)N(Cc4ccon4)C3=O)c21 764411474 KPNFURXHVPCXGT-WJDWOHSUSA-N 443.550 4.374 10 10 IICE COc1cc(O)c(CN2CCC[C@H]2c2ccccc2I)cc1OC 768448685 VJIDKZCWKDZAMK-INIZCTEOSA-N 439.293 4.351 10 10 IICE CC(=O)c1c(C)cccc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 782801754 DETLCWYFCXOCBC-UHFFFAOYSA-N 428.400 4.134 10 10 IICE COc1cnccc1[C@@H](C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 783867518 JGMYRQDJQYNTSK-GPLLRDDGSA-N 447.607 4.011 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)c(C)n1-c1ccc(Cl)cc1 919710421 OUEVJKUXNNWFPL-GOSISDBHSA-N 428.945 4.447 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(C)nc(-c4ccc(Cl)cc4)n3)C2)cc1 1130185327 DXNSQGVSXVMOIH-QGZVFWFLSA-N 436.943 4.370 10 10 IICE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(C)n(-c3cccc(C)c3)c1C)CCS2 1158654828 YBONCXBATRBFLT-IQJRZOLZSA-N 426.582 4.350 10 10 IICE COc1cccc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 1167487584 BIAWADDLKPGVLT-UHFFFAOYSA-N 428.330 4.233 10 10 IICE CC[C@@H](c1cccc(OC)c1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1170028108 YBYAKCADPBCLCH-QHCPKHFHSA-N 442.515 4.492 10 10 IICE CC(C)[C@@H](CCNC(=O)N(C)Cc1ccc(N2CCCC2)cc1)NC(=O)OC(C)(C)C 1231362165 NDXKTNXZRRAABX-OAQYLSRUSA-N 432.609 4.368 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1COc2cccc(Br)c2C1 1235735184 KEVSDAXHWHAMBE-INIZCTEOSA-N 432.362 4.050 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1251951664 SKPZSSVJTWWFMY-FZMZJTMJSA-N 432.348 4.192 10 10 IICE CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H]1CCN(c3ccc(OC)cc3)C1)CCC2 1252114480 CLOANBYASMHARK-OXQOHEQNSA-N 428.602 4.259 10 10 IICE Cc1ncccc1/C=C\C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1289102840 SSHSQMDTJJOLIT-JEZWAEDTSA-N 425.504 4.273 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c1C 1296404780 YPUYNSICIHVHRF-XMMPIXPASA-N 431.580 4.423 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H](C)c1nccs1 1297056233 OPAWVLAHNMBIDZ-SFHVURJKSA-N 440.617 4.311 10 10 IICE COc1ccc(NS(C)(=O)=O)cc1NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1298268685 WXXBFWFMDTYFRB-UHFFFAOYSA-N 427.526 4.035 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3C[C@H]3CCCCC(F)(F)C3)CC2)cc1F 1300248140 VLBHNHFHYUEBAA-KRWDZBQOSA-N 437.510 4.276 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccc(Br)cc3)CC2)c(C)n1-c1ccccn1 1300404316 FHSCCVZKFHPDQI-UHFFFAOYSA-N 439.357 4.214 10 10 IICE COc1ccc(C(=O)N[C@@H](C(=O)NCc2c(O)ccc3ccccc23)c2ccccc2)cc1 1304090030 VSJUCLGIALNQLQ-RUZDIDTESA-N 440.499 4.342 10 10 IICE CC[C@H](C)c1nnc(N2CCCC3(CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305501326 USQWMSYXKKWWAQ-SFHVURJKSA-N 429.584 4.442 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@@H](C(F)(F)F)C2)cc1F 1314660463 JOZREIVFPAYUKP-QGZVFWFLSA-N 448.468 4.372 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(Cc3nccn3C(F)F)CC2)c1 1318057635 XOSMZSNEYYQFFQ-UHFFFAOYSA-N 447.917 4.297 10 10 IICE CO[C@@H](C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1)[C@H]1CCOC1 1353908919 VNWWHYJMKSZXGS-MGPUTAFESA-N 429.517 4.347 10 10 IICE CC(C)(C)OC(=O)CC1(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 1435333171 QJCXQFLYFCEAOL-MRXNPFEDSA-N 438.515 4.275 10 10 IICE Cc1cc(-c2csc(NC(=O)COCc3nccn3C)n2)c(C)n1-c1ccc(F)cc1 1457524905 BVFUCCMRSLHPJS-UHFFFAOYSA-N 439.516 4.246 10 10 IICE C[C@H](SCC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473053320 PWZMGZBUEHVGHY-HNNXBMFYSA-N 429.497 4.405 10 10 IICE Cc1cc([C@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c(C)o1 1478527929 JAIZZHVEAUYJCG-NPMXOYFQSA-N 433.980 4.493 10 10 IICE CCN(c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1501590751 QIAACGDCKOFNRC-UHFFFAOYSA-N 436.629 4.485 10 10 IICE CCc1nnc(N2CCN(c3ccc(C)c(C)c3)CC2)n1CCCSc1nccs1 1513915402 PVQSFANCDNTEFV-UHFFFAOYSA-N 442.658 4.423 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CCCCC2 1515519682 LLJOEJRJMSZABK-AWEZNQCLSA-N 444.528 4.324 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)cc1 1516916802 CLYALTBXDZXFGE-IBGZPJMESA-N 443.661 4.398 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC(Cl)=C(Cl)C2)cc1F 1517000243 SVXGROFQYUYLFS-UHFFFAOYSA-N 447.345 4.493 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CSc3ccccc3Br)C2)cc1 1526246089 BMXXSMNHCWQODX-OAHLLOKOSA-N 435.387 4.193 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1 1528924101 IYUBGQVBRNQYJW-VWRAKTAISA-N 427.633 4.364 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(-c4ccccc4C(F)(F)F)on3)cc2)CC1 1536532057 KAUFCYQVDUMLKR-UHFFFAOYSA-N 444.457 4.042 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2ccsc2C1 1538958794 ASOGYNZXRKEMFW-LFIBNONCSA-N 432.567 4.063 10 10 IICE O=C(N[C@@H]1CCc2c(Cl)cccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1543722368 ZUBWNKMPTVQDRI-QGZVFWFLSA-N 448.953 4.325 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)C1CCOCC1 1546312712 HMZYSPQUZXKFPC-HSZRJFAPSA-N 426.557 4.306 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1(C)C 1547250616 ZQAAIKYTKHLBTI-UHFFFAOYSA-N 434.588 4.258 10 10 IICE COC(=O)c1occc1CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1557537033 FLYOGBJJSJMYIF-UHFFFAOYSA-N 431.286 4.166 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1564454300 KFQRSCPPIPECSQ-SFHVURJKSA-N 436.339 4.426 10 10 IICE Cc1cc(C(=O)Nc2c[nH]nc2-c2ccccn2)c(C)n1-c1ccc(Br)cn1 1566350545 DWZMJFMDTLHLKD-UHFFFAOYSA-N 437.301 4.289 10 10 IICE CCOC(=O)C[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)cc1 1583672196 YULGPNRUPLGFRT-QHCPKHFHSA-N 436.483 4.470 10 10 IICE Cc1cc(C(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c(C)n1-c1ccc(Br)cn1 1588081698 HYNVQUBTOJCNRF-ROUUACIJSA-N 432.362 4.017 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)COc2cccc(Br)c2)cc1 1598292640 SRCSLFLOPYNXOU-OAQYLSRUSA-N 447.373 4.102 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c(C)o1 1611175280 KWKUCSXKXBWZCM-UHFFFAOYSA-N 447.535 4.151 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(OC)CCCC1 1613165047 JNJPZQOQCHAIJW-HXUWFJFHSA-N 441.620 4.224 10 10 IICE CCOCCN(C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1CCc2ccccc21 1636353826 KOWUVCRITWSFKK-CPJSRVTESA-N 437.584 4.257 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2[nH]c3ccccc3c2Br)N(C)C)cc1 1637004838 SOGDIFRDXLZVAF-GOSISDBHSA-N 429.362 4.029 10 10 IICE Cc1ccc(C(=O)NCCCNC(=O)/C=C/c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1639277681 OLTTWONXBOWONN-ACCUITESSA-N 443.547 4.165 10 10 IICE Cc1cc2nc(Cl)cc(NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)n2n1 1639876931 PPCYDKMVHKUYOQ-QGZVFWFLSA-N 444.967 4.435 10 10 IICE Cc1cc(C(=O)Nc2nc3c(s2)CCCC3=O)c(C)n1-c1ccc(Br)cn1 1648246467 JCBRLNKZZMHNJY-UHFFFAOYSA-N 445.342 4.479 10 10 IICE COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC1CCN(c2ccc(OC(F)F)cc2)CC1 1650714570 UTPQYTGZGYYLKZ-UHFFFAOYSA-N 435.427 4.372 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)c3ccc(OC(F)(F)F)cc3)C2)cc1 1672385581 BRIUMTGPKHJRKC-JKSUJKDBSA-N 437.462 4.481 10 10 IICE Cc1cc(CNC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1684479255 UXOJKVAIUDQCAA-IBGZPJMESA-N 426.561 4.150 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCCCNC(=O)OC(C)(C)C)cc1 1686073891 ILCXXTCNLQPHBZ-UHFFFAOYSA-N 444.576 4.362 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCO[C@H](COc4ccccc4)C3)c2C)c1 1687284685 HUPLUVJTYIXEJE-VWLOTQADSA-N 433.552 4.392 10 10 IICE CC(C)c1ccc(C(C)(C)NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1687632305 ORQUVLHYJYFOOQ-UHFFFAOYSA-N 436.600 4.246 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(C(N)=O)CCCC1 1693994292 BZIBXBGRWFNWCU-IBGZPJMESA-N 438.620 4.074 10 10 IICE COc1ccccc1OCc1nnc(N2CC[C@@H](C)C2)n1CCCSc1nccs1 1697613137 PRKPUDCJTCODQQ-MRXNPFEDSA-N 445.614 4.351 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccccn3)CC2)n1Cc1ccc(N(CC)CC)cc1 1708528115 GQESHDZEPHVEGS-OAQYLSRUSA-N 447.631 4.408 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)Cc2cnn(CC)c2)cc1 1710026120 XWHRXDBSXHKMRO-UHFFFAOYSA-N 444.587 4.087 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)C(=O)NC 1710102371 UAZAJZMHQLVXKT-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CC(C)N1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC1 1723550005 WGSWLTHZUORVTI-UHFFFAOYSA-N 428.631 4.114 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763825696 GJJXKKVQLYMIQL-GCJKJVERSA-N 445.583 4.169 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N(C)CCc2cnccn2)cc1 1766611989 YMACQQQNQQHWIX-UHFFFAOYSA-N 433.604 4.299 10 10 IICE Cc1ccc(-c2nc(=Nc3cccc4c3C(=O)c3ccccc3C4=O)c(C(=O)O)c[nH]2)cc1 1859833023 XTQTUNMSSYJYIR-UHFFFAOYSA-N 435.439 4.091 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ccc3c[nH]nc3c2)sc(C)c1-c1ccc(C)cc1 1860750819 UTAPOZFPCOXFHV-UHFFFAOYSA-N 448.504 4.272 10 10 IICE COc1cc(/C=C/C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccc1OC(C)=O 1861862997 HQUGXWQOJLEDOH-ACCUITESSA-N 441.439 4.048 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)/C2=C/c2ccc(OC)c(O)c2)cc1 1865664713 VURGZZSXBLFZOI-DEDYPNTBSA-N 432.451 4.379 10 10 IICE COCCCN1C(=O)C(Nc2ccccc2F)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420550 PJHWZSMNVMLSSK-UHFFFAOYSA-N 447.510 4.462 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](NCc1cc(Br)ccc1O)C2 1878848354 GPUMEUHDJGZBDH-JKQORVJESA-N 429.330 4.123 10 10 IICE CCc1nn(Cc2cc(Br)ccc2O)c(I)c1C1CC1 2079636156 MDCVECVMRYRBRS-UHFFFAOYSA-N 447.114 4.444 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C(F)F)c(C(=O)O)c2I)cc1C 2080047519 GBZHORQOLSXKKT-QMMMGPOBSA-N 436.196 4.055 10 10 IICE CC[C@@]1(CNCc2c(Br)ccc(OC)c2O)CCCN1C(=O)OC(C)(C)C 2236054595 KFGDQCCHPXVOEY-FQEVSTJZSA-N 443.382 4.433 10 10 IICE Cc1cccc(OCCCOc2ccc(C=C3C(=O)NN(c4ccccc4)C3=O)cc2)c1 2293276355 QWAXIBAWCORMOX-UHFFFAOYSA-N 428.488 4.304 10 10 IICE CCOc1ccc(-n2cccc2C=C2C(=N)N3C(SCC)=NSC3=NC2=O)cc1 2297346855 OVFVMLMZODNOBW-UHFFFAOYSA-N 425.539 4.206 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C)cc3)C2=O)ccc1OCCC(=O)O 2314930954 BKYXNSVRYYSQIY-UHFFFAOYSA-N 429.519 4.263 10 10 IICE COc1ccc(OCCN2C(=O)C(=Cc3c[nH]c4ccc(OC)cc34)SC2=S)cc1 2323719254 BHWHOGZSNJYQJD-UHFFFAOYSA-N 440.546 4.465 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cccc(Br)c2O)C[C@@H]2CCC[C@@H]21 2335118237 BPLXWEGFQABZPZ-QRTARXTBSA-N 425.367 4.422 10 10 IICE Cc1ccc(CNC(=O)[C@@H](C(C)C)[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2380721829 MRSJUOAHODHUPR-ZFWWWQNUSA-N 443.382 4.265 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](CNC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2381135863 XFMWAEZOQKUOOK-HNNXBMFYSA-N 443.382 4.218 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@H](c2ccncc2)c2ccc3cccnc3c2O)c1 54620943 IOQYMUINRZGNGX-OAQYLSRUSA-N 443.459 4.110 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccc(O)cc3)C2=O)ccc1OCCC(=O)O 210463870 HIDFYSQNWFWCOE-PDGQHHTCSA-N 445.518 4.050 10 10 IICE Cc1ccc(CNC(=O)c2ccc3c(c2)CN(Cc2ccc(N(C)C)cc2)CCO3)cc1 257195577 WJTAQRDDPPOQQT-UHFFFAOYSA-N 429.564 4.386 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3ccccc3F)ccc2=O)c(C)n1-c1ccc2c(c1)OCO2 727268992 FJWKEPSYNIYKRI-UHFFFAOYSA-N 445.450 4.069 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1 732469814 RKCFORIEPSQMOM-IBGZPJMESA-N 430.543 4.227 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc(Cl)s3)cs2)cc1 733731470 MLQOSBALGXDSHK-UHFFFAOYSA-N 428.944 4.041 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ccc(N2CCCC2)cc1)Cc1ccccc1 743309894 FPDSXRBBOPRPSN-QFIPXVFZSA-N 437.584 4.429 10 10 IICE C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1 751935725 CIYWKLGYNZOQAF-KRWDZBQOSA-N 449.576 4.300 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 764541579 UNRDTMDUJCRICK-YLJYHZDGSA-N 443.544 4.343 10 10 IICE Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 766244730 SLOGMCFLTLVGHC-UHFFFAOYSA-N 437.544 4.065 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2noc(-c3ccsc3)n2)C1 769662360 ABXQJVJADGAWLM-UHFFFAOYSA-N 436.537 4.263 10 10 IICE COc1cc([C@@H](C)NCC(=O)NCc2ccc(N(C)C)cc2)ccc1OC1CCCC1 775007552 DTVQWCUKEOTHOE-GOSISDBHSA-N 425.573 4.050 10 10 IICE CC(C)(C(=O)NCCc1ccc(O)c(O)c1)[C@@H](O)c1ccc(OCc2ccccc2)cc1 778914449 OIMUNUMOLULBDC-DEOSSOPVSA-N 435.520 4.095 10 10 IICE COc1cc(Cl)ccc1-c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCO1 812255600 JEIJUUXOMMEXGA-KRWDZBQOSA-N 428.920 4.128 10 10 IICE Cc1ccccc1CO[C@@H](C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125197064 ZAJZUQBRZFUQIA-KRWDZBQOSA-N 436.474 4.072 10 10 IICE Cc1cc(CNC(=O)c2cncc3nc(C(F)(F)F)n(C)c23)c(C)n1-c1ccccc1 1132267179 DFCAPGREEJRXDS-UHFFFAOYSA-N 427.430 4.325 10 10 IICE C[C@H](NC(=O)[C@H]1CCCN1Cc1ccc(Cl)cc1)c1ccc(N2CCOCC2)cc1 1136442952 KKXVLRFUSZIISH-FDDCHVKYSA-N 427.976 4.018 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](c2cccc(F)c2)c2nccn2C)cc1 1141271564 XYHSFUWRXIBPGM-RUZDIDTESA-N 444.510 4.228 10 10 IICE Cn1ncc(NC(=O)OC(C)(C)C)c1CCC(=O)NCc1cc(Cl)cc(Cl)c1O 1141737796 IQEXKMIMUWCBQP-UHFFFAOYSA-N 443.331 4.029 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H](C)NC(=O)c3ccccc3)cc2Cl)C1 1155726748 MCWRUHSFNQJGRG-QZTJIDSGSA-N 427.976 4.401 10 10 IICE CCC1(CC)CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 1169301723 XRWPCEHVUVDOAN-PMACEKPBSA-N 433.612 4.348 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1 1230809661 SHCMNRSRGBGQJW-RXVVDRJESA-N 433.911 4.043 10 10 IICE Cc1cc(C(=O)COC(=O)[C@@H]2CC(=O)N(C)c3ccccc32)c(C)n1-c1ccc(F)cc1 1251836889 MAJGGOSKUNAESE-OAQYLSRUSA-N 434.467 4.109 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CCc4cc(Br)ccc43)CC2)cc1F 1254805232 FNXVGRIFDZAGRR-LJQANCHMSA-N 448.336 4.116 10 10 IICE COc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1C(F)(F)F 1264688845 BEFRZEDHCRRPMQ-KBPBESRZSA-N 440.437 4.397 10 10 IICE COc1cc(N2CCN(C(=O)c3cc(Cl)cc4ccccc34)CC2)cc(OC)c1OC 1267905949 QVOOCALTZIJKCE-UHFFFAOYSA-N 440.927 4.481 10 10 IICE CCc1nnc(N(CCOC)Cc2ccco2)n1Cc1ccc(N2CCC(C)CC2)cc1 1292891433 KJUVQWLSGGDIQZ-UHFFFAOYSA-N 437.588 4.371 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CCCC1 1295283353 IIWDBRXSTNZNNX-HSZRJFAPSA-N 434.580 4.447 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cc2cc(Br)cc(Br)c2o1 1299569179 BKYPSHSEGXNJQO-UHFFFAOYSA-N 441.075 4.299 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1[C@@H]1CCC[C@@H](C(F)(F)F)C1 1314750902 MTYQFLKEXALDKQ-HZPDHXFCSA-N 432.450 4.371 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCN(C(=O)OC(C)(C)C)C2CC2)cc1 1442601475 MCLAIIZSOAKHCQ-JOCHJYFZSA-N 445.604 4.050 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1461076836 KZAIEKYIQOGLFS-LJQANCHMSA-N 444.531 4.405 10 10 IICE CCO/C=C\[C@@](O)(CNC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468483584 RBEWMADPKBJXBC-GDCKJWNLSA-N 444.881 4.250 10 10 IICE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(C)n(-c3ccccc3C)c1C)CCS2 1472274185 WQMYCPIIYHBGLV-IQJRZOLZSA-N 426.582 4.350 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1513129188 ZQONUFSHISCGRT-GOSISDBHSA-N 446.603 4.402 10 10 IICE COc1ncc(/C=C/C(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)cn1 1530686290 KEVORWGJBXZTKH-JWAJRPJHSA-N 429.476 4.016 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(OCC(F)(F)F)c1 1533991491 AWYXEODMXKXOMT-UHFFFAOYSA-N 447.501 4.090 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(C(=O)N(C)c4ccccc4)cc3)C2)cc1 1537108786 DXQJQAWPNKFRQF-HXUWFJFHSA-N 443.547 4.228 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(-c4ccccc4C)c3C(F)F)C2)cc1 1537109252 LNMXDOUXIJRNCH-KRWDZBQOSA-N 440.494 4.383 10 10 IICE Cc1cc(C(=O)N2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)c(C)n1-c1ccc(Cl)cc1 1546245867 JGXWXOSDXSZURO-RTBURBONSA-N 443.035 4.378 10 10 IICE CC(C)CCOC1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1559513587 VPOPHEJJGJXMGA-SFHVURJKSA-N 448.563 4.316 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@H](CC2CC2)c2cc(F)cc(Br)c2)cc1 1559771452 WUAUESZRAZYLHP-OAQYLSRUSA-N 448.380 4.401 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H](Cc3ccccc3)c3ccccn3)C2)cc1 1564962603 MQLXFARWWGEMCZ-PKTZIBPZSA-N 444.579 4.242 10 10 IICE COCCCN(Cc1c(O)ccc2c(C)c(C)c(=O)oc12)C[C@H]1CCCN2CCCC[C@@H]12 1565538730 IIQYOXGMHYEWRT-OFNKIYASSA-N 442.600 4.218 10 10 IICE CC[C@@](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)(C(=O)OC)c1ccccc1 1568899049 ZETLXMSTVWCDLL-SANMLTNESA-N 432.520 4.044 10 10 IICE Cc1cc(CCNC(=O)CC2CC(NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1586622127 IODBURUCPAAOHS-UHFFFAOYSA-N 425.573 4.446 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3ccc(S(=O)(=O)C(C)C)cc3)c2C)c1 1596483190 UTLRPEGWMISSIW-UHFFFAOYSA-N 438.593 4.444 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCOC2(CCCC2)C1 1611963068 GFWYDYBRNAFLIP-UHFFFAOYSA-N 425.621 4.439 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N(C)Cc2c(C)nn(C)c2C)cc1 1615380000 SVJNHCBKPFBRJP-UHFFFAOYSA-N 435.620 4.427 10 10 IICE CCOC(=O)N[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)C1 1616012129 HBNOLULTRAWWOW-HXUWFJFHSA-N 442.608 4.011 10 10 IICE CN(C(=O)OC(C)(C)C)[C@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)Cc1ccccc1 1625101992 HQNDBKQFUYHRDW-IBGZPJMESA-N 439.516 4.057 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])c4nsnc4c3)cc2Cl)C1 1626168850 HQCYYSGNSLYHRG-GFCCVEGCSA-N 445.932 4.419 10 10 IICE O=C(NCc1ccncc1)Nc1cccc(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1627999507 KQDPVOVSMMCJKG-UHFFFAOYSA-N 434.477 4.282 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c1 1629809797 FAAQMKCZMQYGML-KSFYIVLOSA-N 439.556 4.282 10 10 IICE O=C1CC(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)(c2cccc(Cl)c2)C1 1630261901 GCHWSXIARCQHMW-IBGZPJMESA-N 447.362 4.081 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(C(F)(F)F)c(O)c1 1634753397 KQDOEOUIPXGGIB-CYBMUJFWSA-N 430.373 4.411 10 10 IICE CCN1CCN(c2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc2F)CC1 1643276069 OCMZYMWATLIGIN-UHFFFAOYSA-N 448.542 4.440 10 10 IICE C[C@H](SCCC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1643871842 BSSPIFGWZLEIRB-AWEZNQCLSA-N 439.533 4.254 10 10 IICE COC(=O)[C@@H](C[C@H]1CCCOC1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1648733923 CHCVEOPQKDLIMY-AUSIDOKSSA-N 426.557 4.306 10 10 IICE COC(=O)[C@@H](Cc1cc2ccccc2o1)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1651633593 ATRZLUHXTWIWPC-HSZRJFAPSA-N 444.487 4.167 10 10 IICE Cc1cc(C(=O)COc2cccc(F)c2C(N)=O)c(C)n1-c1cccc(Br)c1 1651914597 FNUKYEZCZNTIBM-UHFFFAOYSA-N 445.288 4.356 10 10 IICE O=C(CN1CCCC[C@H]1c1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)c(F)c1 1653606892 SDMWAAHADFUXPA-QFIPXVFZSA-N 445.966 4.159 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1c(F)cccc1F 1658743896 ZMQMKFCZDDKUKY-AWEZNQCLSA-N 434.442 4.199 10 10 IICE CC(=O)NCc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1682023889 MDMSQMMUEUXPTD-QGZVFWFLSA-N 442.991 4.212 10 10 IICE CCCCN(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1695195129 KMOOEFMBRIWGFD-UHFFFAOYSA-N 436.629 4.102 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1695437440 XCKSWQSFXHVMRU-UHFFFAOYSA-N 432.572 4.035 10 10 IICE CCO[C@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1710619105 XUUUKPDXYUXQSU-QFIPXVFZSA-N 443.661 4.083 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1 1730549690 ZKTSVNFJKRBODV-HXUWFJFHSA-N 434.588 4.016 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCCS(C)(=O)=O 1745457293 NRJDSECJTQEAHZ-UHFFFAOYSA-N 443.617 4.024 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)CC1CC(F)(F)C1 1761697525 JBLGYULSVUTRSI-UHFFFAOYSA-N 426.515 4.244 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1765534529 FHANXHGHGXFPFS-GHTZIAJQSA-N 429.634 4.356 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCC[C@@H]1CC 1767936405 MBKPCODPJGYFDW-RBUKOAKNSA-N 445.583 4.115 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N([C@H](C)c3ccccc3)C2)sc2c1CCCC2 1859478981 RTLOHYYMOMQCJZ-NVXWUHKLSA-N 440.565 4.352 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@H](CO)C(C)C)cc1Br 1915284317 KBUFNANSMMBFBS-JOCHJYFZSA-N 435.406 4.209 10 10 IICE C[C@@H](NC(=O)C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 2017516787 MLSVRBFCYPBXOB-IEBWSBKVSA-N 428.529 4.070 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3cc(Cl)cc(Br)c3O)C[C@H]21 2037301451 ZSMVQOXCPBSBDN-BPLDGKMQSA-N 431.758 4.296 10 10 IICE CN[C@@H](c1ccc2c(c1)CCCN2C)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044757137 VCWBABHUCHFXJW-VWNXMTODSA-N 439.600 4.440 10 10 IICE Cc1nn(Cc2cccc(Br)c2O)c(I)c1C1CC1 2079629710 FEKUKDGMBFLLTO-UHFFFAOYSA-N 433.087 4.190 10 10 IICE COc1ccc([C@H](n2nc(C(F)F)c(C(=O)O)c2Br)C2(C)CC2)c(O)c1 2079861661 KYTVRRLTBJVWLA-ZDUSSCGKSA-N 431.233 4.385 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@H](NCc1ccc(Br)cc1O)C2 2232283479 VYKHRTFLUYPQQU-SJWGOKEGSA-N 425.367 4.326 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3cccs3)SC2=S)cc1 2314836908 LQBDVQWVNUUXLE-GFCCVEGCSA-N 446.575 4.153 10 10 IICE O=C(CN1C(=O)c2ccccc2C1=O)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 3070892 QDBGIMNRQDPMPP-RUZDIDTESA-N 436.467 4.047 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471784 NUAVGBMVFGHSST-LQWHRVPQSA-N 427.526 4.498 10 10 IICE COc1cc(OC)c(/C=C2\C(=O)N(c3ccccc3)C(=S)N=C2O)cc1Br 33409378 VYRIKTVEEXIJEY-JYRVWZFOSA-N 447.310 4.138 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C\c3cccc(O)c3)SC2=S)cc1 210700410 DTTFKLPFNDAEAU-QGOAFFKASA-N 428.535 4.021 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cn3cc(Cl)ccc3n2)C1 443911660 YPYURXGLCWJSBE-UHFFFAOYSA-N 435.959 4.025 10 10 IICE CCCNC(=O)[C@H](C(C)C)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 606672191 XUGHMYKZIYLHOF-LTBFUDJGSA-N 441.416 4.201 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@H](NCc1ccc(Br)cc1O)C2 701086326 FIJSTXRTDDELGD-DBVUQKKJSA-N 445.357 4.434 10 10 IICE Cc1ccc([C@@H](C)CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 738460399 PJPSHCRLOYGDHU-KRWDZBQOSA-N 435.490 4.453 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741216804 MSCIIJSHKCTEQC-RTWAWAEBSA-N 448.485 4.214 10 10 IICE CCCN(CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)Cc1ccccc1O 744392416 MSLAHDFWWDJUOL-UHFFFAOYSA-N 426.498 4.275 10 10 IICE COc1ccc(O)c([C@@H](C)Nc2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)cn2)c1 756845754 RPZRGIUEMSMLBD-MRXNPFEDSA-N 428.533 4.026 10 10 IICE Cc1cc(C(=O)CN2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)c(C)n1-c1ccccc1 771467119 LSHCVXZURFFMJJ-DEOSSOPVSA-N 433.596 4.391 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H]1c1ccccc1I 779519414 DBVMGCBOBRKJOJ-DZZUKKPASA-N 435.261 4.079 10 10 IICE O=C(CCCOC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccc1 789058316 JRYLMCLQITXYBF-UHFFFAOYSA-N 443.411 4.190 10 10 IICE C[C@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(N2CCOCC2)c(F)c1 794822276 BDWVUJDVAGRWLH-MNNVXMFVSA-N 429.502 4.118 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(F)(F)F 800997565 RWRXQSPNWFFOSX-XFXZXTDPSA-N 436.546 4.434 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)NCc1cc(Br)ccc1O)O[C@@H](C)C2 804734488 NKBIJNZDMFPQSR-ULFGMLNVSA-N 446.341 4.297 10 10 IICE CN1CCC[C@H](CNC(=O)NCc2cc(Br)ccc2O)[C@H]1c1cccs1 806856021 CODZVUABTJDBFM-ACJLOTCBSA-N 438.391 4.099 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 1124549642 NXZHFYIJTOACOK-FYYLOGMGSA-N 425.960 4.118 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1141985038 CSHCQOGPDPQXGP-UHFFFAOYSA-N 431.536 4.268 10 10 IICE Cc1cc(CC(=O)N[C@H](C2CCOCC2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1163530946 HQHIRLWWUSZYSS-XMMPIXPASA-N 445.003 4.364 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 1175648304 ODUGPRSCNGDYMX-IOOHMRRSSA-N 442.556 4.139 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](c3ccccn3)c3ccccc3OC)C2)cc1 1225526593 QAHYXGKXMVZRLF-KBMIEXCESA-N 446.551 4.014 10 10 IICE COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1233603428 DKVPKCBAOPKBIL-CYFREDJKSA-N 437.584 4.339 10 10 IICE COc1ccc(C(=O)c2ccccc2NS(=O)(=O)c2cc(Cl)ccc2OC)cc1 1258937934 ZOSCWCPTLVAFNO-UHFFFAOYSA-N 431.897 4.389 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@@]3(C)c3cccc(Br)c3)C2)cc1 1278861336 IHDWUXZUUFJZPT-XJABCFGWSA-N 429.358 4.130 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(Cn3cc(N)c(C(F)(F)F)n3)cc2)cc1 1291709151 AQDPDRFIUGLTET-UHFFFAOYSA-N 445.489 4.309 10 10 IICE CCN(CC(C)C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1295291040 YHGYZXSCELZVHT-OAQYLSRUSA-N 429.634 4.213 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCCc3cc(OC)c(O)c(OC)c3)c2C)cc1 1301464796 NHCZIKXNCPGMII-UHFFFAOYSA-N 438.524 4.188 10 10 IICE CCC[C@H](C)CN(C)c1nnc(CC2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1306561935 FVWOTAMTUGBVBI-SFHVURJKSA-N 429.584 4.127 10 10 IICE COc1cc(N(C)CC2CCN(C(=O)OCc3ccccc3)CC2)cc(OC)c1OC 1307471580 CTSBTNCOPGROIU-UHFFFAOYSA-N 428.529 4.197 10 10 IICE CCOC(=O)c1c(NC(=O)c2cn(-c3cccnc3)nn2)sc(C)c1-c1ccc(C)cc1 1352235311 GUYOMYIBWAHMRY-UHFFFAOYSA-N 447.520 4.437 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C\[C@]3(C)CC[C@@H](C)C3(C)C)CC2)cc1 1353706659 JCAOKNBRYSWLBF-YHTJWYOBSA-N 427.633 4.342 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3nc(-c4ccccc4)cs3)cc2F)C[C@@H](C)O1 1354657334 KPAUSDDDPYOWFZ-IYBDPMFKSA-N 425.529 4.493 10 10 IICE C[C@@H](NC(=O)C(C)(C)Oc1ccc(Br)cc1)c1ccc(N2CCOCC2)cc1 1357928768 QHCXLBQDLDYFQB-MRXNPFEDSA-N 447.373 4.321 10 10 IICE CC(C)N(CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)OC(C)(C)C 1435335344 YTTKXKKWWVZUHD-MRXNPFEDSA-N 441.519 4.019 10 10 IICE Cc1cc(CCNC(=O)[C@@]2(C)CCCN2C(=O)c2ccccc2)c(C)n1-c1ccccc1 1438179461 NWYQYNFMPVQGAK-HHHXNRCGSA-N 429.564 4.448 10 10 IICE CC1CCN(c2ccc(CNC(=O)Cc3cccc(I)c3)cc2)CC1 1464960489 HSWCGANRQVUZOK-UHFFFAOYSA-N 448.348 4.386 10 10 IICE CN(Cc1nccs1)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1503516426 RJVJCNHLYDWQDP-UHFFFAOYSA-N 431.616 4.015 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCO4)n3CC(C)(C)C(C)C)CC2)cc1F 1504295305 GZZVMMPMPKJPPJ-OAQYLSRUSA-N 445.583 4.286 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1(c2ccc(F)cc2)CC1 1534131906 GJEJCZCHRCXVKG-QGOAFFKASA-N 444.528 4.362 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CN2CC[C@@H](c3ccccc3)NC2=O)cc1 1540800053 DFEKIFBOAUWTJU-DEOSSOPVSA-N 446.551 4.031 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N(C)C[C@@H](C)c1nccs1 1542227066 RPEAUFVITNIQBA-GOSISDBHSA-N 449.628 4.403 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Oc3cccc(Cl)c3)C(C)C)CC2)c(OC)c1 1543633321 YUHJSOISXMTZBZ-JOCHJYFZSA-N 432.948 4.109 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1544884560 KNOVVFAMZKWERE-UHFFFAOYSA-N 434.462 4.421 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@H](C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1545578330 ZEBDZDCBBMNGHM-XMSQKQJNSA-N 425.621 4.474 10 10 IICE COC(=O)c1ccccc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1546150501 PLHRIOAWCKYETJ-UHFFFAOYSA-N 443.547 4.090 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc([C@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1546590179 DBTBIIGXPSDPQD-XQBPLPMBSA-N 441.620 4.058 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC(C)(C)SC)CC2)cc1F 1554959196 LFNICTFFNVACIL-UHFFFAOYSA-N 435.613 4.192 10 10 IICE CSCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)O 1555924530 RDWVTTOWABJZBZ-UHFFFAOYSA-N 427.618 4.313 10 10 IICE COC(=O)c1ccc(CCNC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c(OC)c1 1556755685 QIEMTSJFEMQDCU-UHFFFAOYSA-N 434.536 4.479 10 10 IICE O=C(NCc1ccc2sccc2c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1556892077 OYANTCVEXMEIQI-UHFFFAOYSA-N 444.559 4.399 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)c([N+](=O)[O-])c1 1559053589 XGAPWHMXEUUEPP-VURMDHGXSA-N 435.402 4.126 10 10 IICE C[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1=O 1586081385 DIXMAVCGVKABBS-SJORKVTESA-N 441.959 4.007 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cc(C(F)(F)F)[nH]n1 1597034304 VGJNKFFMBNRLJG-YFHOEESVSA-N 446.501 4.110 10 10 IICE Cc1cc(C(=O)NN2CCc3ccccc3C2=O)c(C)n1-c1ccc(Br)cc1 1597284143 PPBBKLWQOBCRHC-UHFFFAOYSA-N 438.325 4.200 10 10 IICE Cc1cc(CCNC(=O)[C@](N)(c2cccc(F)c2)C(F)(F)F)c(C)n1-c1ccccc1 1611616098 IDNVJFYNXQSDOG-JOCHJYFZSA-N 433.449 4.308 10 10 IICE CCC[C@@](C)(NCC(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OCC)C(=O)OC 1615578111 OMPNVYIURRASGO-HSZRJFAPSA-N 446.569 4.160 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1=CC[C@H](NC(=O)OC(C)(C)C)C1 1622327885 DIWKQSHTKJCUES-INIZCTEOSA-N 439.350 4.117 10 10 IICE O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1623543479 OBPMYCASIOIHOL-ARFHVFGLSA-N 434.583 4.343 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1 1627026829 ZEANXOROHRPZQS-GOSISDBHSA-N 447.597 4.007 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](CCCc2ccccc2)c2ccccc2)c1 1629281305 BNXXBPGTJBFYKB-JOCHJYFZSA-N 438.549 4.258 10 10 IICE C[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(C)c2ccccc12 1630261863 DOIDJNKTUOMWTN-APWZRJJASA-N 425.960 4.422 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(-c2cccs2)on1 1634384443 BWTXWPDLPDTVAY-UHFFFAOYSA-N 427.526 4.405 10 10 IICE CCO[C@H]1C[C@@](O)(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1634606698 GAHNRGHHFLQOBK-SIKLNZKXSA-N 449.389 4.153 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cnn(CC(=O)NC2CCCC2)c1 1637244117 UDLFUXGHBIRMTM-IBGZPJMESA-N 446.551 4.051 10 10 IICE CN(Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638478408 APTQSMQIBSHIJC-UHFFFAOYSA-N 449.382 4.037 10 10 IICE COC(=O)CN(Cc1cn2cc(Cl)cc(Cl)c2n1)Cc1cc(Cl)ccc1O 1652735423 YBPLEGBNSKZLKA-UHFFFAOYSA-N 428.703 4.175 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3cc(F)ccc3F)cc2Cl)C1 1672138001 ZYYKKOCTJSFSRP-XOBRGWDASA-N 437.918 4.387 10 10 IICE Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1683195821 PGNDOTIQTDDASO-PKOBYXMFSA-N 429.511 4.197 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cc(Cl)cc(Cl)c3F)C2)cc1 1683340504 UYMJMAGELZVWAI-ZDUSSCGKSA-N 426.319 4.467 10 10 IICE Cc1cc(CNC(=O)NCCOc2cccc(C(F)(F)F)n2)c(C)n1-c1ccccc1 1685960846 QIBXGYZIYXBXKE-UHFFFAOYSA-N 432.446 4.386 10 10 IICE Cc1cc(-c2nnc(N(CC(C)C)C(C)C)n2Cc2cnnn2C)c(C)n1-c1ccccc1 1707271212 LPYJAKRKJVJRSC-UHFFFAOYSA-N 446.603 4.400 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@@H]2C)n1Cc1ccc(N(CC)CC)cc1 1708724423 JMYOPTSIOBCSFW-MOPGFXCFSA-N 440.636 4.326 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1727904705 ZCXJVJIPGDNPKI-UQBPGWFLSA-N 437.588 4.129 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCS[C@H](C)C2)cc1 1728383143 SEIXUNKJTIDZPI-WIYYLYMNSA-N 429.634 4.356 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H]2C)n1Cc1ccc(N(CC)CC)cc1 1744071493 CKFZEKVGQQJNNP-GOSISDBHSA-N 426.609 4.080 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2Cc2nncn2C)c(C)n1-c1ccccc1 1751409862 NTDCBCZZKBADJH-UHFFFAOYSA-N 432.576 4.012 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1766613611 HYTIWIBWFQWSCE-HYBUGGRVSA-N 448.615 4.020 10 10 IICE COC(=O)[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C1 1769384680 QXRFJLSULVZVIS-HXUWFJFHSA-N 435.572 4.398 10 10 IICE Cc1cc(=O)c(OCCOc2ccc(Cl)cc2)cn1CCCOc1ccc(N)cc1 1857916025 ANBZHVWDOGBWCH-UHFFFAOYSA-N 428.916 4.319 10 10 IICE COc1cc(/C=C2/SC(=S)N(C3CCN(Cc4ccccc4)CC3)C2=O)ccc1O 1858594371 WQCNRALLGBGFAI-KGENOOAVSA-N 440.590 4.267 10 10 IICE COc1ccc2[nH]cc(/C=C3/SC(=S)N(c4cc([N+](=O)[O-])ccc4OC)C3=O)c2c1 1860084220 QMBREPCUJOJCDW-CNHKJKLMSA-N 441.490 4.499 10 10 IICE O=C(Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1)c1ccccc1 1860549414 DWRSMSSURNVJAH-UHFFFAOYSA-N 447.450 4.362 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCCc4cccs4)cc3)CC2)cc1 1872883927 DFUXJGRGWHJMNJ-UHFFFAOYSA-N 435.593 4.051 10 10 IICE CC[C@H](NCC1CN(C(=O)OCc2ccccc2)C1)c1cc(Br)ccc1O 1914339322 JSOJSXROGZMWRI-IBGZPJMESA-N 433.346 4.464 10 10 IICE Cc1ccc([C@H](n2nc(C3CC3)c(CN)c2I)C2(C)CC2)c(O)c1 2078998409 GDWBANYHVLRFGI-KRWDZBQOSA-N 437.325 4.227 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC12CCC(NCc1cc(Br)ccc1O)CC2 2090478432 JYLISBXGHURCDL-CMVHYPBASA-N 425.367 4.470 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@H]2NCc2cccc(Br)c2O)CC1 2132804936 PUDZWNHHQFHPDT-MRXNPFEDSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CNC[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c1O 2236050157 BGIAROGKQJKGDG-MLGOLLRUSA-N 443.382 4.192 10 10 IICE O=C1N=C(N2CCN(c3ccc(Cl)cc3)CC2)SC1=Cc1cccc([N+](=O)[O-])c1 2296758959 GPCPEIBKHRNSQX-UHFFFAOYSA-N 428.901 4.041 10 10 IICE CCOc1ccc(C=C2SC(=S)NC2=O)cc1OC(=O)c1ccc([N+](=O)[O-])c(C)c1 2297200037 UEFWKPHBFXCLGQ-UHFFFAOYSA-N 444.490 4.010 10 10 IICE COc1ccc2nc(NC(=O)CN3C(=O)C(=Cc4ccccc4)SC3=S)sc2c1 2314563194 VUTUJDHKYGJBRG-UHFFFAOYSA-N 441.559 4.145 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(O)c1Br 2352673481 XFFXORAWGBFMTH-MUJYYYPQSA-N 425.367 4.483 10 10 IICE CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1OCc1ccc(C)cc1 33332247 SPPGGXMEVZXJRK-JCMHNJIXSA-N 428.488 4.434 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3OC)[C@H]2c2ccc(O)c(O)c2)cc1OC 526405452 DBVMFSRIZWGPHO-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2CNCc1cccc(Br)c1O 703956080 SURXBHDVVGMZFD-OAHLLOKOSA-N 425.367 4.282 10 10 IICE CN(C)c1ccc(CN(C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C2CC2)cc1 730137302 CGMAZTHHTZWJQX-LJQANCHMSA-N 430.593 4.074 10 10 IICE Cc1c(CS(C)(=O)=O)cccc1NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 735174269 LSUFYNGUNCTERM-UHFFFAOYSA-N 439.581 4.311 10 10 IICE O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 743358981 PLKDNLUQZNURKP-BJKOFHAPSA-N 437.584 4.138 10 10 IICE CCOC(=O)c1sc([C@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)nc1C 757271723 LWPZISTUTFIRET-INIZCTEOSA-N 432.590 4.375 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccccc1C(=O)OC(C)(C)C 775363617 SEJDMFGEYMQIRP-UHFFFAOYSA-N 425.529 4.142 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cccc(OCc2cccnc2)c1 806214198 DZCQXPKORQKDPI-UHFFFAOYSA-N 428.286 4.450 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1cc2ccccc2n(C)c1=O 821069255 GELDMFWHPIKRGL-UHFFFAOYSA-N 433.533 4.485 10 10 IICE CCc1cccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1130634209 SZQXFEFNMHAKKO-UYRXBGFRSA-N 428.554 4.296 10 10 IICE CCN1CCN(c2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc2)CC1 1135777564 PHSQTGWJXGVXRH-UHFFFAOYSA-N 430.552 4.301 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccn1 1141867813 GTINDSCHYUFDGQ-CQUHBBLWSA-N 429.542 4.080 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-c2ccc(Cl)cc2)c[nH]1 1141926421 BCMBSPPYEZLLBL-UHFFFAOYSA-N 431.870 4.380 10 10 IICE C[C@H](C(=O)NCc1ccccc1F)N1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1190932983 AKZNFPWPEYEBCL-QGZVFWFLSA-N 441.547 4.308 10 10 IICE CC(C)C[C@H](CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)NC(=O)OC(C)(C)C 1264822422 QFYFQGNOFNEDPD-UYAOXDASSA-N 433.593 4.030 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2(C(=O)OC(C)(C)C)CCCC2)C1 1265363678 MCCWGISTUCZFBX-UHFFFAOYSA-N 439.600 4.179 10 10 IICE COc1ccc(/C=C(/C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1F 1266258412 ACLMXDOBNYELHQ-CYVLTUHYSA-N 437.559 4.086 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)COc3ccccc3Cc3ccccc3)C2)cc1 1276831987 KDJXMQOCBSWTFY-QFIPXVFZSA-N 430.548 4.308 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 1295703247 XBHUKFJSZIFKAF-KRWDZBQOSA-N 431.920 4.483 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)N[C@@H](C)c2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1 1312364910 JRPAZZGNZBBDNG-WMHILYHISA-N 433.911 4.296 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 1313123866 JCPLEPKSGKAEHF-XIKOKIGWSA-N 426.344 4.371 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC(Cc3ccc(C(F)(F)F)cc3)C2)N(C)C)cc1 1313411581 HPBGBJDUHWLHJC-QFIPXVFZSA-N 448.533 4.258 10 10 IICE CCO[C@@H](CCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1314061148 VAJIRFLFHFROKI-GMAHTHKFSA-N 442.604 4.500 10 10 IICE CC[C@@]1(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)CCNC1=O 1349819217 FPKUZOKEYOZEKV-JOCHJYFZSA-N 426.517 4.212 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(C(=O)OC(C)(C)C)c3)cc2F)C[C@@H](C)O1 1350934101 YFCFHZHHWZQHDP-IAGOWNOFSA-N 442.531 4.325 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccsc2)N(C)C)c(C)n1-c1ccc(Br)cn1 1441010398 YAJZNZCODJUAJU-GOSISDBHSA-N 447.402 4.346 10 10 IICE O=C(C[C@@H](c1ccccc1)c1ncc[nH]1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444983480 FETGHSSPEYFUAV-RXVVDRJESA-N 440.494 4.318 10 10 IICE CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1470968878 LKDWMHMHPBKMQP-WMZHIEFXSA-N 438.616 4.363 10 10 IICE COC(=O)c1cccc2c1OCCN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)C2 1472166380 POVGCJCLYAUIFQ-UHFFFAOYSA-N 446.503 4.036 10 10 IICE CCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccccc1Cl 1529403996 MINVLNFWUKFMPE-KRWDZBQOSA-N 438.959 4.353 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CCOC1 1541715748 RNTULIVNNGYMJX-XMMPIXPASA-N 447.599 4.054 10 10 IICE Cc1ccc(C(=O)NCCc2nc3c(F)cccc3n2C)cc1-n1c(C)cc(C=O)c1C 1542890673 AWTWTCCSJLGYSF-UHFFFAOYSA-N 432.499 4.213 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N=[S@](C)(=O)c2ccc(N(C)C)cc2)CCCC1 1544121043 JAHRGENSEULHER-WJOKGBTCSA-N 439.581 4.278 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)COCc1cccc(Cl)c1 1556426524 QJQFMFNJPGOOES-UHFFFAOYSA-N 432.948 4.245 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3c(O)cccc3Br)CCC[C@@H]12 1561001423 TWPQKFAOLPDJCL-YLJYHZDGSA-N 425.367 4.424 10 10 IICE C[C@H]1CC[C@H](c2nc(CC(=O)NCc3ccc(N4CCC(O)CC4)cc3)cs2)CC1 1585539691 PRZGUYRYLBYVFP-UAPYVXQJSA-N 427.614 4.257 10 10 IICE C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1586054830 OTRDSFGVOZHPHA-UQBPGWFLSA-N 446.595 4.330 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@H]1CCCS1 1617938150 XOEHRVLVULIKKW-OAHLLOKOSA-N 448.390 4.273 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1618539798 UJBVNYSGQPGRBU-UHFFFAOYSA-N 445.563 4.045 10 10 IICE Cc1ccc(-n2ncc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2C)cc1 1622635183 SEBIBXWDKPMJSU-HXUWFJFHSA-N 438.959 4.243 10 10 IICE COc1ccc(C[C@](C)(O)CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1OC 1628948785 ZCWPHWFHLUTGOM-SANMLTNESA-N 436.552 4.143 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2ccc(Br)cc2c1 1631070108 SDFGMGKJRIVPIZ-UHFFFAOYSA-N 425.326 4.369 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1 1633995985 WQOUONIVKJHKDH-VXKWHMMOSA-N 437.540 4.131 10 10 IICE Cc1cc(CCNC(=O)NCc2c(F)cccc2-n2cccn2)c(C)n1-c1ccccc1 1635329425 DKCZAVVQQJIHHH-UHFFFAOYSA-N 431.515 4.461 10 10 IICE CN(C(=O)c1c[nH]nc1[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(Br)cc1 1635497234 WVLJIEAYHXQAKZ-ZDUSSCGKSA-N 449.349 4.173 10 10 IICE COC1CCN(c2ccc(CN3C[C@@H](C)[C@H](CCNC(=O)OC(C)(C)C)C3)cc2)CC1 1648314949 AJEBEIRCDSBMLF-TZIWHRDSSA-N 431.621 4.285 10 10 IICE CC(C)(C)OC(=O)NC[C@@]12CCCC[C@@H]1CN(Cc1ccc(N3CCOCC3)cc1)C2 1648669256 VFAQEUBYYZWWPT-PXDATVDWSA-N 429.605 4.040 10 10 IICE CCN(c1ccccc1)S(=O)(=O)c1ccc(NCc2cc(C)ccc2O)c([N+](=O)[O-])c1 1651258645 IXQUNSDANGKCDS-UHFFFAOYSA-N 441.509 4.436 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cnn(C)c3I)c2C)c1 1652514282 GELHGYYBCDIQAB-UHFFFAOYSA-N 448.308 4.301 10 10 IICE COCCN(CC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(OC)c(OC)c1 1653590538 XEIAVVZDPBISAO-CQSZACIVSA-N 441.355 4.341 10 10 IICE CCC[C@H]1CN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CCN1CCOC 1684599600 FDBRSBITQHNJQL-DEOSSOPVSA-N 426.605 4.045 10 10 IICE Cc1cccc(OC[C@H](O)CN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C(C)C)c1 1686826444 IHLJBWBYEUEGPU-ZJSXRUAMSA-N 441.616 4.160 10 10 IICE Cc1ccc(O)c(CNC(=O)NCC[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1 1687328667 MKKPGDIHCOQECN-HXUWFJFHSA-N 427.545 4.026 10 10 IICE Cc1ccc(-c2nnc(N3CCOC(C)(C)[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1742205143 LYVPUPNVUWBUEH-MRXNPFEDSA-N 427.524 4.104 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1743446319 SLLFDRYPZYJYQH-UUOWRZLLSA-N 439.629 4.455 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763825695 GJJXKKVQLYMIQL-AVRDEDQJSA-N 445.583 4.169 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CCOC)CC1 1765326566 YEBVPAOZKNHCIE-UXBLZVDNSA-N 448.615 4.087 10 10 IICE CCN1C(=O)Cc2cc(-c3csc(NS(=O)(=O)c4ccc(C)cc4C)n3)ccc21 1859572676 YWCRFURMJROTJZ-UHFFFAOYSA-N 427.551 4.137 10 10 IICE COC(=O)c1c(-c2cc(C)ccc2C)csc1NC(=O)CCN1C(=O)CSC1=S 1865767971 JRQHMYYWSJFZEE-UHFFFAOYSA-N 448.591 4.007 10 10 IICE CCOCCCn1cc(OCCO)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1870787497 HZIZVSVUAAWHHC-UHFFFAOYSA-N 437.540 4.002 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(F)cc1C(F)(F)F 1891633035 VKQXSRFPXJQNGE-YOEHRIQHSA-N 428.451 4.312 10 10 IICE Cc1ccc([C@@H](C)n2nc(C3CCC3)c(C(=O)O)c2I)c(O)c1 2079003329 ACZVJVKTMRZITM-SNVBAGLBSA-N 426.254 4.077 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1nnc(S)n1-c1ccccc1 33884160 MAPDIPUVFZFIHF-UHFFFAOYSA-N 431.477 4.307 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccccc1 733974873 NRYNLONQQRTPFD-OTWHNJEPSA-N 429.611 4.215 10 10 IICE C[C@@H](NC[C@H](CO)c1ccccc1)c1cc(Br)cc(Br)c1O 756636912 XSQJNGXOIWNPEF-DGCLKSJQSA-N 429.152 4.344 10 10 IICE COCC[C@H]1CCCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 768386341 ZNTVFGGVTLMLJB-MSOLQXFVSA-N 425.520 4.105 10 10 IICE CCOc1ccc([C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1[N+](=O)[O-] 773145504 ILGIHPHYOWVYNH-LJQANCHMSA-N 438.572 4.376 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccoc4)n3Cc3cccs3)CC2)cc1F 802696432 ANIHPCALROECMX-UHFFFAOYSA-N 439.516 4.122 10 10 IICE COc1ccccc1C/C(C)=C/C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438538 NDVYRSWNSILNSK-RYEVTAHJSA-N 428.960 4.324 10 10 IICE Cc1cc(CNC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1151154444 VPTHYKLJZKCXHX-UHFFFAOYSA-N 441.572 4.126 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1Cl 1175371948 OLCRDYCEMHRWPT-UHFFFAOYSA-N 433.955 4.095 10 10 IICE O=C(CN(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2)NC(=O)Nc1ccccc1 1191580682 AHLOXDQMBWRRHE-JXMROGBWSA-N 443.503 4.326 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(C(=O)c4ccco4)c3)cc2F)C[C@@H](C)O1 1264688950 FAWUWUMBOPRFOF-IAGOWNOFSA-N 436.483 4.193 10 10 IICE Cc1ccc(N2CCC[C@@H](NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2=O)cc1 1294079314 ZHZDTHPYMYOQTI-HSZRJFAPSA-N 429.520 4.140 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cc(F)ccc3CS(C)(=O)=O)c2C)c1 1294313457 FJBQLVSQNRYASY-UHFFFAOYSA-N 442.556 4.325 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2cccc3c2OC(F)(F)O3)c1 1301016393 DSDJHIJJNITLQK-UHFFFAOYSA-N 426.419 4.201 10 10 IICE O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1313152121 RSGVTVISHRQKGZ-WEYGHZABSA-N 448.922 4.406 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](c2ccco2)N2CCCCC2)cc1 1440545722 JXVZRBLHQMFOGG-XMMPIXPASA-N 433.552 4.386 10 10 IICE Cc1ccc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)n1 1464604322 LSLCVLJGTPVCOA-GOSISDBHSA-N 432.362 4.040 10 10 IICE CO[C@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1469074287 TWBSZYDZSDWYCJ-CTNGQTDRSA-N 440.341 4.294 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1 1478482541 LGJULASBIHWZHR-MRXNPFEDSA-N 433.474 4.368 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC(c3cnn(C)c3)CC2)cc1 1501840617 LAZXMYVUXGSADO-UHFFFAOYSA-N 449.647 4.489 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC[C@H](CO)O1 1514425783 PWDWRZFKOUOQLC-FCHUYYIVSA-N 437.588 4.129 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(Cl)c(I)c2)cc1F 1528619302 JWTTWIHYUWPDSB-UHFFFAOYSA-N 432.664 4.080 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cc2ccccc2nn1 1529902015 KYJFFRBLFRSRID-FOWTUZBSSA-N 440.575 4.311 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)sc2c1CCCCC2 1533784649 UUCBAGOHJQEVHW-CYBMUJFWSA-N 446.956 4.449 10 10 IICE CC[C@@H](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)N1CCc2ccccc2C1 1540832446 NZYKINADDLAJNB-DEOSSOPVSA-N 429.564 4.473 10 10 IICE COc1ccccc1N1CC[C@H](CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)C1 1542712215 AVSLXSGZNDJUPY-JOCHJYFZSA-N 445.563 4.100 10 10 IICE Cc1cc(F)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(F)c1 1565881826 JCMGBDLZDPODGI-IBGZPJMESA-N 433.499 4.335 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1 1566255190 IRAPBMQTIVPMBD-UGKGYDQZSA-N 441.572 4.157 10 10 IICE CC1CCN(c2cccc(NC(=O)c3ccc(I)cc3N)c2)CC1 1586589274 XJLVEOGNYQYAID-UHFFFAOYSA-N 435.309 4.362 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@H]2CSC)cc1 1615382706 DJMOIXCKIFNAFU-LEWJYISDSA-N 429.634 4.356 10 10 IICE COc1ccc(CNC(=O)CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1 1625693894 IOQJZQITTTWERF-UHFFFAOYSA-N 433.552 4.272 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)cc1 1626107503 YAGCJHMDWYQOIF-NHCUHLMSSA-N 437.367 4.301 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](CC1CC1)NC(=O)OC(C)(C)C 1629971728 GDAIEUIKIXEONK-INIZCTEOSA-N 441.366 4.197 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1occc1CN1C(=O)Cc2ccccc21 1630180299 NSRAGJCQUOWEOY-SFHVURJKSA-N 431.536 4.104 10 10 IICE COc1cc(CN2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)cc(OC)c1 1630841084 OUKIWDJYOXJFSY-UHFFFAOYSA-N 447.579 4.378 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSc3ccccc3Br)CC2)cc1 1630992695 SATQHWUIAJLVIN-UHFFFAOYSA-N 435.387 4.289 10 10 IICE Cc1ccnc(Nc2cccc(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)c2)n1 1633402314 AQZWBRLBKFZEMG-UHFFFAOYSA-N 430.556 4.311 10 10 IICE O=C(c1cc2c(cc1Br)OCO2)N(Cc1ccco1)Cc1ccccc1O 1635647270 DVRHSEYWPSUNIG-UHFFFAOYSA-N 430.254 4.319 10 10 IICE COC(=O)c1ccc2c(c1)CCCCN2C(=O)/C=C/[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1636044041 LSURKXYZNWVSFE-LVMGUKCRSA-N 442.556 4.346 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccccc2OCCN(C)C(=O)OC(C)(C)C)c1 1636061481 OIYDDUJUCGIKDM-INIZCTEOSA-N 444.528 4.138 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 1638570224 WSSDLHPFCBGEAY-NHCUHLMSSA-N 439.556 4.328 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(C(C)(C)C)CCN(Cc2ccc(N3CCOCC3)cc2)C1 1648128660 OYQMAIGUOZMWDC-RUZDIDTESA-N 431.621 4.286 10 10 IICE COC1CCN(c2ccc(CN3CC[C@]4(CCN(C(=O)OC(C)(C)C)C4)C3)cc2)CC1 1654070681 VDMXDWIWRXABGV-VWLOTQADSA-N 429.605 4.135 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCN(CC4CC4)C3)cc2Cl)C1 1672137465 SIOCSNTWZRCAHS-NQIIRXRSSA-N 433.040 4.498 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCc4cc(Br)ccc43)C2)cc1 1683504605 YGQWXSFFVHZVEY-QVKFZJNVSA-N 444.373 4.271 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2ccc(NC(=O)OC(C)(C)C)cc2)cc1 1684777371 SRKKTONCIJBZAD-UHFFFAOYSA-N 442.560 4.320 10 10 IICE CCN(CC)CC[C@H](NC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1)c1ccccc1 1685766509 AIJUTNKNOUSUFE-QHCPKHFHSA-N 442.579 4.139 10 10 IICE CCN1CCCC[C@H]1Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695846318 AZMYJCXJVXCEFZ-QFIPXVFZSA-N 440.636 4.001 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCCC[C@@H](SC)C2)cc1 1710026566 LBGLXKQAGOSMHW-RBBKRZOGSA-N 443.661 4.398 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743493157 GLRRGLNJTDMEKB-DFBJGRDBSA-N 436.604 4.307 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)C[C@H](C)C1 1745877861 LIFLDWJPZQKBFU-OALUTQOASA-N 448.615 4.313 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3ccc(NC(=O)CC(C)(C)C)cc3)CC2)cc1 1874753105 AZDCANYYMLJBCX-UHFFFAOYSA-N 437.584 4.465 10 10 IICE CC(C)CNCc1ccc(N(C)C[C@@H](O)COCc2ccccc2)cc1Br 1916345140 SMIYLJDLZKASAP-OAQYLSRUSA-N 435.406 4.209 10 10 IICE CCC(=O)Oc1ccc(C=C2C(=O)N(c3ccc(Cl)c(C(=O)O)c3)N=C2C)cc1OC 2297326783 DUDXCIOGDHKNNR-UHFFFAOYSA-N 442.855 4.168 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3ccccc3OCCC(=O)O)SC2=S)cc1 2314933378 VNZARQRGTNSTHO-UHFFFAOYSA-N 427.503 4.149 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)ccc1O[C@@H](C)C(=O)O 2314934137 YGVHYIUTGJHBMJ-NSHDSACASA-N 433.482 4.092 10 10 IICE O=C1C(=Cc2cc(Cl)cc(Br)c2O)SC(=S)N1CCCCCO 2323792124 QFBLXJJBPKVYAE-UHFFFAOYSA-N 436.780 4.172 10 10 IICE COc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2=O)cc1 59270947 QHXSYJSCJWIOAY-AREMUKBSSA-N 445.519 4.061 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(OC)c1O)N2 226709125 UVOPBZDOGNPAGL-JLHGSKIFSA-N 428.554 4.258 10 10 IICE Cc1ccc2oc(SCC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)nc2c1 303645918 SSJYEBQLBRUCRW-IYBDPMFKSA-N 443.544 4.297 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(I)c(Cl)c1 318264790 KXUYSMLOHIOYGZ-UHFFFAOYSA-N 428.701 4.283 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc4c5c(cccc35)C(=O)N4)n2)cc1 727241884 KVUKNBXILHUBFF-UHFFFAOYSA-N 437.502 4.338 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1 733732300 ZVCFKNBJVMXZMZ-UHFFFAOYSA-N 438.530 4.480 10 10 IICE CCN(CC)CC1CCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903003 ATUSUKUBCWSMHY-LJQANCHMSA-N 438.563 4.020 10 10 IICE CN1CC[C@H](NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@H]1c1ccccc1 758968970 ZOMGWGJPWRMRFS-FCHUYYIVSA-N 444.526 4.001 10 10 IICE COc1ccc(Br)c(C(=O)NCCCNCc2cc(Cl)cc(C)c2O)c1 776169807 QDCHIRRLBFJCEP-UHFFFAOYSA-N 441.753 4.035 10 10 IICE C[C@H](NC(=O)N(C)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 776240917 YFJBYUQJCNDLRE-XVSDAANHSA-N 430.593 4.386 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(C)n(-c4cccc(Cl)c4)n3)CC2)cc1 777742432 GMWXIKJATYDSGU-UHFFFAOYSA-N 425.920 4.197 10 10 IICE CC(C)N1CC[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1c1ccc(F)c(F)c1 778826320 ISWMTRWBWMZVLR-GOTSBHOMSA-N 430.543 4.396 10 10 IICE COc1cc(Br)ccc1/C=C1\SC(=S)N(CCc2cccnc2)C1=O 781550230 PACNELSFBICCJU-SXGWCWSVSA-N 435.368 4.297 10 10 IICE O=C(COC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1)c1ccc(O)c(O)c1 782725048 HRAAMPIYDJWUBA-UHFFFAOYSA-N 446.381 4.219 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(Cl)ccc3F)n2)cc1OC 789727608 QFROYTRMAPKDOO-UHFFFAOYSA-N 428.894 4.421 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC1CC(F)(c2cccc(Cl)c2)C1 796631912 ASDMGLYDADYELT-UHFFFAOYSA-N 431.939 4.345 10 10 IICE CCN(CC)c1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)N[C@@H](C)C(N)=O)cc1 914718451 ONFMPGWCMWEXGA-DOMQTXCISA-N 442.563 4.171 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2ccc(F)cc2)on1 1126583423 SUPKTLCKALRTNA-INIZCTEOSA-N 431.414 4.481 10 10 IICE Cc1onc(-c2cccnc2)c1C(=O)N1C[C@@H](NC(=O)OC(C)(C)C)Cc2ccccc21 1129851832 CFJOAUHCGTWXTA-SFHVURJKSA-N 434.496 4.141 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3c[nH]c4cc(Br)ccc34)C2)cc1 1129990639 FAQYLIYNAAZSCH-HNNXBMFYSA-N 442.357 4.124 10 10 IICE Cn1cc(CN(C(=O)/C=C\c2cnc3ccccc3n2)c2ccc(Br)cc2)cn1 1133065882 PDTAVCMWNXMKIK-FLIBITNWSA-N 448.324 4.372 10 10 IICE CSCC[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1nnc2ccccn12 1135786068 ORAAVTWERRGYBD-OAQYLSRUSA-N 447.564 4.174 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC(=O)Nc1cccc2ccccc12 1136537702 SLSMQOUPCJTGLZ-UHFFFAOYSA-N 425.488 4.428 10 10 IICE COc1ccc(CNC(=O)c2ccsc2NC(=O)c2ccc(Cl)cc2O)c(O)c1 1139032884 SGVDFHYQDSKINN-UHFFFAOYSA-N 432.885 4.004 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccccc3NCC(F)(F)F)cc2F)C[C@@H](C)O1 1141901263 DJWJFWCZDUUSJW-GASCZTMLSA-N 439.453 4.344 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc(Br)cc(Br)c2)c1 1150543953 VSFSVEYDQWYVFZ-VIFPVBQESA-N 429.108 4.417 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1 1160283976 JJPPLGDQQFPBRJ-HHHXNRCGSA-N 448.538 4.042 10 10 IICE COC(=O)[C@H]1Cc2ccc(O)cc2CN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1176915881 PHHNVVZUXYXXMW-HSZRJFAPSA-N 444.491 4.346 10 10 IICE Cc1cc(C(=O)N(C)CC2(O)CCCCCC2)c(C)n1-c1ccc(Br)cn1 1296711216 IRVRAFAVKLKYMM-UHFFFAOYSA-N 434.378 4.409 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CN(c3ccc(Br)cc3)C2=O)cc1 1298860064 IKNZMJCOIYGOOB-FQEVSTJZSA-N 438.325 4.002 10 10 IICE CC(C)NC(=O)c1nnc(N(C)CC2CCCCC2)n1CCCSc1nccs1 1303337011 JDFKBGNXMQKRGJ-UHFFFAOYSA-N 436.651 4.072 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2C[C@@]2(C)CN(C)C2=O)c(C)n1-c1ccccc1 1304191815 GOYYXJKZRVBREI-AREMUKBSSA-N 448.615 4.313 10 10 IICE COc1ccc(Cl)cc1N1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1=O 1350044392 JSKKVFBTRLJGSE-SFHVURJKSA-N 443.975 4.205 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@@H](Cc2ccccc2Cl)C(N)=O)c1 1444207501 LILABPBZGRERGY-QGZVFWFLSA-N 444.362 4.475 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](OC(=O)N(C)C)C2)c(C)n1-c1cccc(Br)c1 1449846894 BZOYPSLYRUYNIP-SFHVURJKSA-N 448.361 4.159 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)c2nc(C(F)(F)F)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1456380097 FVUCCDSLOSBSIL-NSHDSACASA-N 425.842 4.304 10 10 IICE CC(=O)N[C@H](C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)C(C)C 1457572311 FTGUUPJSWHEDTK-CTNGQTDRSA-N 435.490 4.459 10 10 IICE CCOc1ccc(N2C[C@@H](C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CC2=O)cc1 1463785003 LAZRLFWHBUXUJI-NRFANRHFSA-N 435.568 4.087 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4ccc(F)cc4Cl)CC3)CC2)c(OC)c1 1478365821 JYXYRNYADTWNTD-UHFFFAOYSA-N 447.938 4.060 10 10 IICE CCO[C@@H](CCn1c(-c2cnn(C)c2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1516105214 HYDQMXCLISYDKD-QFIPXVFZSA-N 438.576 4.006 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4c(F)cccc4F)no3)cc2F)C[C@H](C)O1 1526002545 DZRWNOQDZKJOKK-KBPBESRZSA-N 445.441 4.303 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1526246043 AMPWVIBVDINMDE-WBVHZDCISA-N 449.364 4.418 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)cc1 1527062164 BIRHUNSYGRCZKC-UHFFFAOYSA-N 435.955 4.275 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cccc(NC(=O)c4ccc(F)cc4)c3)C2)cc1 1538747317 QBJGAODPBPZMQK-NRFANRHFSA-N 433.483 4.095 10 10 IICE CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1539911726 CGCLAOHXCIVOPT-SPEDKVCISA-N 449.039 4.413 10 10 IICE Cc1cc(CC(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)c(C)n1-c1ccccc1 1540751823 LYIVJLFBSZVNPB-MHZLTWQESA-N 444.623 4.132 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541792181 OMFDRWVAIWTQTO-FUHWJXTLSA-N 427.524 4.216 10 10 IICE Cc1cccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C(F)(F)F 1544720646 HCSOFPNEQJZJGY-UHFFFAOYSA-N 431.502 4.476 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCN(C(C)=O)CC1 1546781094 VGMHOFPDLBMSNG-UXBLZVDNSA-N 446.599 4.377 10 10 IICE CCCN(CC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1547111589 UMYXYJLIWGAGQC-HSZRJFAPSA-N 441.620 4.013 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2ccc(I)c(Cl)c2)cc1 1556363989 BRCYPPNYSGBEGJ-UHFFFAOYSA-N 442.644 4.037 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Cc1ccc(OC)c(OC)c1Cl 1566306164 BHTGVBNVCAOQOW-UHFFFAOYSA-N 442.737 4.417 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3ccc(Cl)cc3Cl)CC2)cc1F 1566346829 NMZPKFCUSKLMEE-UHFFFAOYSA-N 427.303 4.259 10 10 IICE CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1568142094 MYGMBNATPMGCOV-VVRYKASASA-N 425.960 4.370 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CSc1cc(Cl)ccc1Cl 1570514882 SMUAKNAWEGPOLA-UHFFFAOYSA-N 428.337 4.383 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)ccc1[N+](=O)[O-] 1586082857 UUQAYQKPXMOVFU-HNNXBMFYSA-N 431.920 4.488 10 10 IICE Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1597799543 CWAACZUHUWUWBM-JTHBVZDNSA-N 435.612 4.277 10 10 IICE Cc1nc(Cc2nnc(N(C)CCC(F)F)n2Cc2ccc(N(C)C)cc2C)cs1 1612394591 SMBWIIBGQSNEJO-UHFFFAOYSA-N 434.560 4.148 10 10 IICE CCOC(=O)Cc1cc(Cl)c(=O)n(CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c1 1613789210 LETVERABZCVMLW-UHFFFAOYSA-N 444.890 4.037 10 10 IICE CN(C)c1ccc(Cn2c(N(C)[C@H]3CCCc4c3cnn4C)nnc2C(C)(C)C)cc1F 1617667327 OAVVVQTVWWUBCR-IBGZPJMESA-N 439.583 4.076 10 10 IICE CC(C)C[C@H](NCC(F)(F)F)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1624287381 YKBSXXKVYLSJLK-FQEVSTJZSA-N 425.495 4.441 10 10 IICE O=C(CSc1ccc(F)c(F)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1631425974 UNNJTPSGNFIHNG-HNNXBMFYSA-N 426.916 4.197 10 10 IICE Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)N[C@H](C)c2ccccc2O)C1 1632247332 ZGARSACFWWRVGZ-CVEARBPZSA-N 445.357 4.193 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c(C)n1-c1ccccc1Br 1633032138 OTDDGVHFTZMZPZ-SFHVURJKSA-N 448.405 4.039 10 10 IICE CCCc1nc(C)c(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)o1 1637115603 BINBELAXKTYTEY-UHFFFAOYSA-N 431.334 4.431 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1 1642311888 UJHBLYDCYBSAPO-XMMPIXPASA-N 442.003 4.445 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4ccc(C=O)cc4)cc3)CC2)c(OC)c1 1643035612 JRBZQEZGHQJMQO-UHFFFAOYSA-N 430.504 4.146 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H]2CCc3ncc(Br)n3C2)c1 1647911788 LLXVQWTXEUMSDI-MRXNPFEDSA-N 427.346 4.106 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 1683255042 XFFSDGMMPSLUBO-SFHVURJKSA-N 440.563 4.191 10 10 IICE Cc1nnc(N2CC[C@@H](C)N(Cc3ccccc3)CC2)n1CCCSc1nccs1 1693476229 KZBCEYRRPWIYJM-GOSISDBHSA-N 442.658 4.326 10 10 IICE Cc1nnc(N2C[C@H](c3ccc(F)cc3)O[C@H](C)C2)n1CCCSc1nccs1 1693520499 HVQYFNTZSQJWMO-RDTXWAMCSA-N 433.578 4.331 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@H](c3nccs3)C2)n1Cc1ccc(N(C)C)c(F)c1 1761926510 VVTPNACBZAZITN-BEFAXECRSA-N 444.580 4.079 10 10 IICE Cc1nnc(N2CCC(C(=O)c3ccc(F)cc3)CC2)n1CCCSc1nccs1 1762538572 DWZRMABMWWOGFJ-UHFFFAOYSA-N 445.589 4.464 10 10 IICE CNc1cc(C(=O)N2CCN(c3ccccc3OC)CC2)c(Nc2ccccc2)c(F)c1N 1858180971 AYVCRRHLNHDREC-UHFFFAOYSA-N 449.530 4.164 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCNCc1ccc(Br)cc1O)C(F)(F)F 1913269044 DZQPIYVREBCOJV-ZDUSSCGKSA-N 427.261 4.090 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](CNCc2ccc(Br)cc2O)(C2CC2)C1 1967777371 GPMLPWHDVLFTKE-HXUWFJFHSA-N 425.367 4.282 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)C2(CC2)C1 2129398746 XHHXZSZDUWGOCD-OAHLLOKOSA-N 429.330 4.173 10 10 IICE CC1=NN(c2ccc(C)cc2C)C(=O)C1=CNc1ccc2c3c(cccc13)C(=O)N(C)C2=O 2297451649 SQDAYCNFTJDVSU-UHFFFAOYSA-N 438.487 4.401 10 10 IICE CCOc1cc(C=C2SC(=S)N(C3CCCCC3)C2=O)ccc1OCCC(=O)O 2314934408 HNFJWTPASIAPOU-UHFFFAOYSA-N 435.567 4.473 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3C[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352949833 JTTYOPLJYXHIKT-KBMXLJTQSA-N 425.367 4.198 10 10 IICE CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 8760812 AZPIYCXHNBNIQN-UCQKPKSFSA-N 434.467 4.136 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478057 AQVIQLTVKYNCGI-DRSNIGMVSA-N 427.526 4.452 10 10 IICE CSc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@H]32)cc1 14551912 MCXYKLOUFZBCQH-MZKRTTBSSA-N 442.606 4.256 10 10 IICE O=C(O)Cc1ccc(N2C(=O)/C(=C/C=C/c3ccccc3[N+](=O)[O-])SC2=S)cc1 39859331 LDNBFRAXPKPXKD-CZMAMTTRSA-N 426.475 4.184 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2cccc(OCc3ccc(C)cc3)c2)SC1=S 40937977 JBCRSWOXQZWAEK-CPNJWEJPSA-N 427.547 4.338 10 10 IICE CC[C@@H](NCCN(CCOC)C(=O)OC(C)(C)C)c1cc(Br)ccc1O 382067237 RJYYBUWZCAHMSA-MRXNPFEDSA-N 431.371 4.079 10 10 IICE CC(C)c1cccc(S(=O)(=O)Nc2nc(-c3ccc(S(C)(=O)=O)cc3)cs2)c1 743046268 TUAALVCHNKUDLO-UHFFFAOYSA-N 436.580 4.138 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](C)C[C@@H]3c3ccco3)cc2F)CC1 745808029 JNEKJFPLUHHCRG-PGRDOPGGSA-N 428.552 4.243 10 10 IICE Cc1cc(CCNC(=O)N2CCC(OC[C@@H]3CCCO3)CC2)c(C)n1-c1ccccc1 751782945 ZWLNMRHXBQEWDR-DEOSSOPVSA-N 425.573 4.006 10 10 IICE COc1cc(N2CCN(C(=O)c3sc(C4CCCC4)nc3C)CC2)cc(OC)c1OC 759223255 YMACUQGLWOGFBD-UHFFFAOYSA-N 445.585 4.097 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@H](c1ccccc1)[C@@H]1CCOC1 772458965 GNINDRHMZQLQOL-XMSQKQJNSA-N 445.510 4.334 10 10 IICE CC(C)[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(F)(F)F 787703907 FMBBJIWDNNNANG-UQTJOTSZSA-N 436.546 4.433 10 10 IICE Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NCc1cc(Br)ccc1O 806244941 CJIUEELWEZHXJZ-UHFFFAOYSA-N 432.318 4.021 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1 1127837684 AFRISHXHBWTQPF-CCNLRRDASA-N 428.554 4.337 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](C(=O)NCc2ccc(N3CCCC3)cc2)(c2ccccc2)C1 1136190301 ZXHNJPVAGQXVFV-HHHXNRCGSA-N 449.595 4.482 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)NCc3ccc(N4CCSCC4)cc3)CCC[C@H]12 1141803224 HIQHRPUOQMAGKK-GBXCKJPGSA-N 445.629 4.036 10 10 IICE Cc1cc(C(=O)N2CC(O)(c3ccc(Br)cc3)C2)c(C)n1-c1ccc(F)cc1 1147642938 ZTIYAYKRXYJAAK-UHFFFAOYSA-N 443.316 4.339 10 10 IICE CC(C)NC(=O)c1ccccc1NC(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1167755426 PSMYHGNLOUJXLA-UHFFFAOYSA-N 435.446 4.115 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(Br)ccc3Cl)C2)cc1 1230858877 PPYSMYZZWZJGMI-HNNXBMFYSA-N 438.753 4.189 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ccc(N2CCSCC2)cc1)C(C)(C)C 1291626290 GKCHFZNMICAHRZ-LJQANCHMSA-N 435.634 4.186 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)CCC(F)(F)F)cc1 1313678611 DSPYZTBABKQMFK-SFHVURJKSA-N 439.526 4.455 10 10 IICE CCc1ccc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)cc1 1354389919 XOPXLDKKBLJJIG-QFIPXVFZSA-N 445.563 4.490 10 10 IICE COC(=O)C[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(F)cc1 1355977065 AWRWNSVJPYTFKQ-OAQYLSRUSA-N 438.499 4.088 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCCNC(=O)CCc3ccc(C)cc3)ccc21 1357822320 KQBUMXHYNHLPFR-UHFFFAOYSA-N 436.552 4.119 10 10 IICE CCOC(=O)[C@]1(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CCc2ccccc21 1360686593 BOHGQLXCHTZIJE-SANMLTNESA-N 434.536 4.039 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)c(F)cc3Cl)cc2F)CC1 1435073511 FSFBWYFUZHQVHO-UHFFFAOYSA-N 428.310 4.344 10 10 IICE Cc1cc(CC(=O)Nc2ccnc(OCCN(C)C)c2)c(C)n1-c1ccc(Cl)cc1 1435740829 XDEBFRJLMKGRHZ-UHFFFAOYSA-N 426.948 4.264 10 10 IICE CC(C)Oc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccn1 1435997882 HEWMFGMYVMQOPF-BOPFTXTBSA-N 445.541 4.238 10 10 IICE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1c(O)ccc2c1CCCC2 1445898899 CFSHLGKTYCSEHG-NRFANRHFSA-N 428.960 4.385 10 10 IICE Cc1ccc(C(=O)N2C[C@@H](CN(C)C)Oc3ccccc32)cc1-n1c(C)cc(C=O)c1C 1446113622 RKTPWGBNMXAFKR-JOCHJYFZSA-N 431.536 4.184 10 10 IICE Cc1cc(C(=O)N2C[C@@H](O)Cc3ccccc32)c(C)n1-c1ccc(Br)cc1 1448678012 LSMMMPFOVZXOLE-IBGZPJMESA-N 425.326 4.420 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cccc(OC4CCCC4)c3)cc2F)CC1 1456129255 LTUYUDUPDULAIF-UHFFFAOYSA-N 425.548 4.219 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(S(=O)(=O)NC(C)(C)C)o3)c2C)c1 1462080437 MKZLPJVBTXBNKV-UHFFFAOYSA-N 443.569 4.002 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCNc2ncccc2C(F)(F)F)CCCC1 1464285460 VDIIKZUFURDYJA-UHFFFAOYSA-N 446.473 4.171 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1F 1465006474 NUMLRQCDEMKNOI-HSZRJFAPSA-N 441.547 4.479 10 10 IICE CC[C@H](NC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)[C@H](c1ccc(C)cc1)n1cncn1 1470556590 XZKNAHNHVWUTQD-OPXMRZJTSA-N 448.615 4.259 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@H]1CCCS1 1503473024 HBVJAPFMHWWUEZ-NRFANRHFSA-N 443.661 4.235 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CC[C@H](F)C1 1509131295 FDCAOIWEFUWDAS-SFTDATJTSA-N 429.584 4.088 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H](C)C3)nnc2[C@@]2(OC(C)C)CCOC2)cc1 1515527999 FHCXUZORQBBIRH-NBGIEHNGSA-N 441.620 4.059 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1nccs1 1517767454 ZCHJTBONFSZGNA-KRWDZBQOSA-N 436.585 4.480 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)Cc2ccc(Br)c([N+](=O)[O-])c2)cc1 1539307795 LINKJTRNJGJSGT-UHFFFAOYSA-N 434.334 4.405 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCO[C@@H](C)C1 1555510245 FXQRIOIPBPETJO-PZJWPPBQSA-N 437.588 4.250 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1555648885 NPXVEHNRWPMQEK-LJQANCHMSA-N 429.609 4.051 10 10 IICE COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CSCc3ccco3)c2C)c1 1559326809 ZFQHSLVGORQSHL-UHFFFAOYSA-N 441.505 4.376 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@H](c2ccccc2)C1 1570154901 ZZKHKVVMUCBGLF-IBGZPJMESA-N 437.500 4.283 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCN(C)C)Cc2ccsc2)CCCC1 1584618333 DVSFKPLCOYRZFZ-UHFFFAOYSA-N 425.598 4.181 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3csc(Cc4ccc(F)cc4)n3)C2)cc1 1585665252 OTUGPQKJNACXOG-KRWDZBQOSA-N 425.529 4.138 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1598028334 JLJXIBXDHDKREF-DUXKGJEZSA-N 437.559 4.292 10 10 IICE Cc1ccc(Br)c2cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)[nH]c12 1603555379 PQNFWUZPXNKVHR-FQEVSTJZSA-N 443.389 4.338 10 10 IICE CCc1ccc(N(CC)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 1615910169 LQVPRRDSEWKKAI-OALUTQOASA-N 427.564 4.144 10 10 IICE CCOc1ccc(N2CCN(C(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)CC2)cc1 1623429811 OWMYKDJTIFEFOS-FQEVSTJZSA-N 433.593 4.063 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2 1624973009 DQUKXEQNSQNJHQ-UHFFFAOYSA-N 445.563 4.288 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc(-c3cnn(C)c3)nc3c(C)c(C)ccc23)c1 1630374222 ZCPHGZIYYRRTJT-INIZCTEOSA-N 430.508 4.457 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)N3CCN(c4ccc(OCC)cc4)CC3)CC2=O)cc1 1632153542 CCQILWPILPERBG-JOCHJYFZSA-N 449.595 4.130 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(F)nc1Br 1635645055 WUOPNHWCHHUTQA-UHFFFAOYSA-N 430.277 4.133 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)nc3Cl)cc2F)C[C@@H](C)O1 1638197324 YHVKYTWTAJAUJZ-VXGBXAGGSA-N 445.844 4.437 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]([C@H]3CCCO3)C2)sc(C)c1-c1ccccc1 1648269568 BXTKFVYAZFSNJC-RTBURBONSA-N 442.581 4.340 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCN(C(=O)OCC(C)C)CC3)c2C)c1 1675109585 WXIDLFPUSOXCTQ-UHFFFAOYSA-N 440.588 4.412 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)c3ccsc3)CC2)c(C)n1-c1ccccc1 1683307445 GUBLRINJLDJOHW-UHFFFAOYSA-N 436.581 4.213 10 10 IICE CC[C@@H]1[C@@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCN1C(=O)OC(C)(C)C 1683977088 NPMOKQAIVGXYED-LEWJYISDSA-N 430.593 4.216 10 10 IICE CCOCCN(CC)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1696428593 GGLUSGVYYKLSQI-HSZRJFAPSA-N 441.620 4.277 10 10 IICE Cc1ccc([C@@]2(O)CCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)cc1 1707339707 PWJIEACTBLFYFV-JOCHJYFZSA-N 443.642 4.447 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCO[C@](C)(CC)C2)cc1 1710027240 BXXXEAIDYYIVNU-AREMUKBSSA-N 448.615 4.164 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1741461537 HPWUWOZJXMNWKG-QFIPXVFZSA-N 425.621 4.234 10 10 IICE CCOCc1nnc(N2CCSC[C@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1767982675 PLFNXIJQORAACC-LJQANCHMSA-N 429.634 4.041 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCN(C(=O)OC(C)(C)C)C2)n1C1CC1 1768681654 LOFOQUVZDHBAEZ-KRWDZBQOSA-N 427.549 4.070 10 10 IICE CCCOc1c(Br)cc(/C=C2\C(=O)N(CC)N=C2C(F)(F)F)cc1OC 1865667601 GCDMOZRPMNNVEF-XFFZJAGNSA-N 435.240 4.410 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(Br)cc2)N2CCCCC2)cc1 1868005053 BZNBEGVQLBQQMG-JOCHJYFZSA-N 444.417 4.401 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(COc4ccc([N+](=O)[O-])cc4)cc3)CC2)cc1 1872869494 DTTXQMZEDRFYBY-UHFFFAOYSA-N 447.491 4.145 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3cn(C4CC4)c(=O)c4ccccc34)cccc21 1874179200 SSBJFNAJLUWVPD-UHFFFAOYSA-N 434.451 4.364 10 10 IICE CN(Cc1cnn(Cc2ccccc2)c1)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 1915033192 OYBCMHRNOZOHQW-UHFFFAOYSA-N 447.583 4.443 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1cccc2nonc12 2296553731 LTVDOHIUYSUMGD-UHFFFAOYSA-N 442.522 4.216 10 10 IICE Cc1ccc(CN(C)[C@H]2CC[C@H]2NC(=O)OCc2ccccc2)c(O)c1Br 2307568092 AERHTNWOLNVEEH-MSOLQXFVSA-N 433.346 4.352 10 10 IICE Cc1cccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(Cc4ccccc4)C3=O)c2C)c1C 2313631155 DCUJOEYWHVZZRG-UHFFFAOYSA-N 427.504 4.373 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)ccc1O[C@H](C)C(=O)O 2314934135 YGVHYIUTGJHBMJ-LLVKDONJSA-N 433.482 4.092 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2)c(O)c1Br 2352692803 KMJYTFFWFJCFGW-MUJYYYPQSA-N 425.367 4.198 10 10 IICE COc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@@H]32)cc1O 14457116 BYWVLKLBRPAYHT-AXHZCLLHSA-N 440.565 4.402 10 10 IICE COc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3c[nH]c4ccccc34)SC2=S)cc1 15046864 MTCWKZVYMLIXOE-JFENUBAZSA-N 437.546 4.405 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCC(=O)OC)C2=O)ccc1OCCC(C)C 40937913 JSSMOGGZNHEBDH-QGOAFFKASA-N 437.583 4.275 10 10 IICE CC/C(=C\C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccccc1 728818522 SJVDGOLKNSPUIJ-DYTRJAOYSA-N 445.542 4.052 10 10 IICE c1cncc(COc2ccccc2CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768671326 ZNHFIEKNPNTYPX-UHFFFAOYSA-N 442.607 4.482 10 10 IICE C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 773234290 AKSANXBJKCDQIP-AIANPOQGSA-N 431.474 4.312 10 10 IICE O=S(=O)(Nc1cc(Cl)c(O)cc1F)c1cc(Br)cc2cccnc12 808113902 LJWHFWCDBKVUKX-UHFFFAOYSA-N 431.670 4.296 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccccc1SCC(=O)NC(C)C 1129815048 RZKMKXHWMZTLEF-SFHVURJKSA-N 427.614 4.039 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4ccccc4n3CC(F)(F)F)C2)cc1 1130185836 SMLIHNRKRPFXMD-MRXNPFEDSA-N 431.458 4.469 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)C(=O)N1c2ccccc2C[C@H]1C 1140906100 KBTDSZFXOHDJGO-QZTJIDSGSA-N 429.520 4.003 10 10 IICE Cc1sc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)nc1C(C)C 1146971591 LKEPLSPIRSHFSE-UHFFFAOYSA-N 437.568 4.395 10 10 IICE Cc1cccc(-n2c(S)nc3cc(C(=O)N(C)Cc4ccccc4O)ccc3c2=O)c1C 1149871258 CNUCZHGWANWNOL-UHFFFAOYSA-N 445.544 4.269 10 10 IICE CCOC(=O)C[C@H]1CCN(C(=O)C2=CCCN(C(=O)OC(C)(C)C)CC2)c2ccccc21 1159164824 JCMZPVIBMNZELF-LJQANCHMSA-N 442.556 4.417 10 10 IICE COC[C@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(Cl)cc1 1228558134 USJCQGFBCPMHLO-FPOVZHCZSA-N 432.948 4.166 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@]3(C)Cc3ccccc3F)C2)cc1 1252115919 NTLDIAZLYQKMND-UQBPGWFLSA-N 425.548 4.467 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cnc2c(c1)CCCC2 1269008679 YYQOKPARVMDHSK-YBFXNURJSA-N 441.553 4.330 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H](CCNC(=O)OC(C)(C)C)C(F)F 1298320017 ZBQAYUQLODHDEK-CQSZACIVSA-N 427.517 4.434 10 10 IICE CC(C)CN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1303150770 MAZPVLFGZLGDLP-UHFFFAOYSA-N 440.567 4.168 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](OC)C(C)C 1305503225 AFGJERCDMPCSLX-SIKLNZKXSA-N 429.609 4.188 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)C(F)(F)F 1305726933 UOBUQPIFWGUBTI-UHFFFAOYSA-N 441.498 4.127 10 10 IICE C[C@H](NC(=O)N1CCC[C@@H](NC(=O)c2ccc(Cl)cc2)C1)c1ccc(N(C)C)cc1 1312534712 HAANBHVCBXTASC-OXJNMPFZSA-N 428.964 4.071 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c2ccccc2OC)cc1 1354542696 YPYMUASEFBHTGT-JOCHJYFZSA-N 441.572 4.424 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CCc4cc(Br)ccc43)CC2)cc1 1356398112 XYGSCYYDCRVRLH-NRFANRHFSA-N 429.358 4.226 10 10 IICE C[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 1357927978 LEKJCIBGABGOQZ-YROCYRMSSA-N 443.385 4.441 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C(C)=C/c1cccnc1)CCC2 1435021467 XWFBPUYIXJRFHD-SAPNQHFASA-N 432.476 4.423 10 10 IICE COc1cc(C(=O)N2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)ccc1C 1441681440 OJKCBDSJRLSKLD-UHFFFAOYSA-N 445.563 4.318 10 10 IICE CC(C)Oc1ncc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1445878304 BKRMGRVLYOXJST-KRWDZBQOSA-N 438.355 4.276 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2sccc2nc1Cl 1446818063 UVRNDYUAVBUOEJ-UHFFFAOYSA-N 425.293 4.124 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Br)cn1 1455419312 WFFZJBAJRRZIJL-KOMQPUFPSA-N 448.361 4.102 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCCN(Cc3ccccc3)CC2)cc1 1463829709 XRKBQCFTYUEKPF-UHFFFAOYSA-N 429.564 4.184 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CSc3ncnc4sc(C)c(C)c34)C2)cc1 1469281069 WGGCJOUQKPZFCU-MRXNPFEDSA-N 442.610 4.052 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cc1 1470218057 RPYXDNWHANUHGO-GAJHUEQPSA-N 438.568 4.275 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cc(C)on1 1494772696 MTEWCPSQYYEXMI-RUZDIDTESA-N 448.571 4.446 10 10 IICE CCN1C[C@@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1502250042 SXKWYGCOLKUCSD-IAGOWNOFSA-N 440.567 4.019 10 10 IICE COCc1ccc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1523384369 ZTOHSERZGOWRAX-UNOMPAQXSA-N 445.537 4.307 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1532655551 MKFDKKAGNIIHKP-VFNWGFHPSA-N 448.350 4.004 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](C)S(=O)(=O)c3ccc(F)cc3)c2C)c1 1534759236 LTWQERHXPZQEJV-SFHVURJKSA-N 428.529 4.020 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)c1 1543727493 DOGZDMSEZNNMCH-XMMPIXPASA-N 431.536 4.450 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C(F)(F)c1ccccc1NC(C)=O 1545508515 DRUGRBJEFWHSDN-UHFFFAOYSA-N 441.272 4.254 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccccc3Oc3ccccc3)CC2)c(OC)c1 1560082375 BYWUZHMVBQJYHG-UHFFFAOYSA-N 447.535 4.257 10 10 IICE CCN(C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)[C@@H]1CCN(c2ccccc2)C1=O 1585418061 MYWXYUQATVJZMP-XMMPIXPASA-N 429.520 4.174 10 10 IICE CNc1ccc(Cl)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1586619135 CSEYXXPSCATALW-FQEVSTJZSA-N 446.979 4.444 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCC[C@H](C(F)F)C1 1611963951 GVYKOZUWFGUDMO-FQEVSTJZSA-N 440.542 4.168 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cnc(OC4CCOCC4)c(Cl)c3)cc2)CC1 1616694418 GPKWYPDIURJJHJ-UHFFFAOYSA-N 443.975 4.459 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)COc2ccccc2C(F)(F)F)cc1 1626106905 RWHZTBVNQDBOBQ-IBGZPJMESA-N 436.474 4.358 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCCC[C@@H]3COC(=O)NC(C)C)c2C)cc1 1627002526 ITTMZAWAHUIQKC-HXUWFJFHSA-N 427.545 4.232 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccccn3)C2)c(C)n1-c1cccc(Br)c1 1631987504 UFRUPQLHPNQRGC-SFHVURJKSA-N 439.357 4.260 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4cc(Cl)ccc4s3)cc2)CC1 1634074859 VFOCFCGZEOKWQT-UHFFFAOYSA-N 427.957 4.153 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H](c1ccccc1)N(C)C 1634385249 VAHUQQFICIIYHC-QHCPKHFHSA-N 425.573 4.068 10 10 IICE CNC(=O)CC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1636028067 VNHFPXJHFXWJDB-GOSISDBHSA-N 446.389 4.378 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)c1ccc(Cl)cc1 1638587860 VHMVPUDXXROARZ-HSZRJFAPSA-N 427.976 4.209 10 10 IICE Cc1ccc(Br)c2cc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)[nH]c12 1641203389 CKXUASCDOFNXPJ-UHFFFAOYSA-N 442.357 4.130 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(Cl)c(Cl)c1 1644590919 VCMSJEVKYUCTJK-SCLBCKFNSA-N 427.715 4.188 10 10 IICE COc1cc2c(=O)ncn(CC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)c2cc1F 1651915008 XAKUWEYIPNAQLN-UHFFFAOYSA-N 433.483 4.451 10 10 IICE C[C@H]1C[C@@H](Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CCO1 1707990888 LZUBQNSEVXDDOX-GWOFKNCZSA-N 442.604 4.354 10 10 IICE C[C@@H](c1ccccc1)N(C)c1nnc([C@H]2CCC(=O)N2)n1CCCSc1nccs1 1723754592 KIKDIHATMGVIPC-DOTOQJQBSA-N 442.614 4.066 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cccnc1OCC(F)F 1752616442 YGUJGNIAIAZPGP-HNNXBMFYSA-N 431.487 4.221 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H](c3nccs3)C2)n1Cc1ccc(N(C)C)c(F)c1 1761926512 VVTPNACBZAZITN-HNAYVOBHSA-N 444.580 4.079 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1762728715 IKFYYTHBCLGNCD-BGYRXZFFSA-N 434.588 4.050 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCCC[C@H](COC)C2)cc1 1764934730 FUBNCTGNQMJNHJ-QFIPXVFZSA-N 448.615 4.488 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)[C@@H]2CCSC2)cc1 1764938197 GRLQZKHMWMCGTD-NHCUHLMSSA-N 429.634 4.356 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 1765237239 KQPAYSJTUBHPDQ-AEFFLSMTSA-N 427.524 4.104 10 10 IICE CCCN(CCC)C(=O)Cn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@@H]21 1860347563 XUWUULSWVAALAJ-AREMUKBSSA-N 444.579 4.437 10 10 IICE CC[C@@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccncc2)C1=O 1873168218 NAURTYCILCEVGI-QGZVFWFLSA-N 428.536 4.157 10 10 IICE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)OCc1ccccc1 2044755260 VXXBCNDUBDPENG-DQMJNTIXSA-N 439.600 4.438 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@H](NCc1c(O)cccc1Br)C2 2226144526 NXRCYGUWHJYHKF-GRDNDAEWSA-N 425.367 4.280 10 10 IICE COc1cc(OC)c(-n2c(C)cc(C=C3C(=N)N4OC(C)=CC4=NC3=O)c2C)cc1Cl 2297347849 WOIXUNMRZQOWMD-UHFFFAOYSA-N 440.887 4.215 10 10 IICE COc1cc(C=C2SC(=S)N(CNc3ccc(F)cc3)C2=O)cc(OC)c1OC 2313503211 AZEQDJICNRHKHW-UHFFFAOYSA-N 434.514 4.122 10 10 IICE Cc1ccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2352637475 KVFDDKJDDOIEID-OAHLLOKOSA-N 429.355 4.019 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380748068 ZCBPHZYOCWMOGX-UKRRQHHQSA-N 441.366 4.163 10 10 IICE CC[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380764273 BXOIAODYDQEPPL-JLTOFOAXSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@@H]2CCN2C(=O)OC(C)(C)C)c(O)c1Br 2381128854 AMNYOLJHPISIOX-OAHLLOKOSA-N 441.366 4.211 10 10 IICE C[C@@H]1Oc2ccc(-c3csc(NS(=O)(=O)c4ccc(Cl)cc4)n3)cc2N(C)C1=O 11857482 HMGGENJJZHCPQY-NSHDSACASA-N 449.941 4.008 10 10 IICE O=C(CCN1CCCCC1)NN1C(=O)/C(=C/c2ccc(-c3ccccc3)o2)SC1=S 35518172 WFQOSRRASKQIMR-CYVLTUHYSA-N 441.578 4.055 10 10 IICE CCCCCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)OCCC)C2=O)c2ccccc21 40938200 UHWGEBBOZDPZNK-HNENSFHCSA-N 446.594 4.138 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C/c3ccc(OC(=O)c4ccccc4)cc3)C(=N)N12 104372786 RKSLOIVHMFIKFG-QNISKULHSA-N 436.518 4.236 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1ccc(OCc2cccnc2)cc1 106009630 LPHSNCDHPWHZEL-MDWZMJQESA-N 443.547 4.169 10 10 IICE CC(=O)CSC1=N/C(=C/c2ccc(N(C)C)cc2)C(=O)N1c1ccc(OC(F)F)cc1 206806947 ANSKGOBEDWUTCM-XDHOZWIPSA-N 445.491 4.420 10 10 IICE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ccc(CN)c(Br)c1F)C2 705880034 GHFSWKDVXXLDDM-SZPZYZBQSA-N 432.381 4.395 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H](COCc1ccccc1)c1ccccc1 740910334 WAJBCKNZDXICMP-SANMLTNESA-N 445.563 4.281 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)NC(=O)OC(C)(C)C)cc1 742752228 FLGGGOWRZZVUMY-BDTNDASRSA-N 441.547 4.377 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCC(c2ccc(O)cc2)CC1 769045234 ZBDIYZVHMPSFNN-UHFFFAOYSA-N 448.611 4.013 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H](c3ccccc3)c3cccc([N+](=O)[O-])c3)cc2)C1 779021490 ZMZBVVLBAFRINX-DHLKQENFSA-N 444.535 4.176 10 10 IICE CC(C)(C)OC(=O)N1CCCc2cc(C(=O)Nc3cccc(N4CCOCC4)c3)ccc21 793130248 CEHCOMRDYUZDSW-UHFFFAOYSA-N 437.540 4.463 10 10 IICE Cc1ccc(CNC(=O)NCc2cc(Br)ccc2O)c(OC[C@@H]2CCCO2)c1 805198646 RYLFMWKLSPUFKO-SFHVURJKSA-N 449.345 4.020 10 10 IICE Cc1nc(COC(C)(C)C)oc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472091 GPTOCYYEYVZJFK-QGZVFWFLSA-N 435.952 4.052 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)/C=C/c2ccc(Br)o2)cc1 916566482 ZQTSLFXTSGCHHP-FMAYLGMYSA-N 433.346 4.329 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3c(C)nn(C)c3Cl)n2)c1C 917872026 DUNFMVOMFJJEIJ-UHFFFAOYSA-N 427.983 4.135 10 10 IICE CC[C@H]1N[C@](N=Nc2ccc([N+](=O)[O-])cc2)(P(=O)(OC(C)C)OC(C)C)OC1=O 1088716039 OBJIVGDTIWTEFE-NVXWUHKLSA-N 428.382 4.258 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc([N+](=O)[O-])ccc3N3CCOCC3)c2C)c1 1132264494 UDDXNCVMFKLUSY-UHFFFAOYSA-N 448.523 4.077 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1136546714 TVGNVNPDHATIBO-QGZVFWFLSA-N 438.906 4.312 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cccc(NC(=O)N2CCCC2)c1 1141987526 IMZUASDBHHRDOV-UHFFFAOYSA-N 444.535 4.464 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1[C@@H]2CCCC[C@@H]2CCN1C(=O)OC(C)(C)C 1146196513 LQUSAPJDPNFCAU-QIJUGHKUSA-N 429.605 4.493 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@]1(c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1146198592 XOGBAASZACHPIJ-AREMUKBSSA-N 437.584 4.256 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccccc1OC 1159033392 HQUIYPYWVPURHJ-PGRDOPGGSA-N 444.959 4.450 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccccc1O 1167521756 INYRWGFVLJVQBX-UHFFFAOYSA-N 428.488 4.018 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 1175648305 ODUGPRSCNGDYMX-QGHLFXPHSA-N 442.556 4.139 10 10 IICE COc1cccc2c1OCCC[C@H]2NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1176408803 XZQOWKLHNFHKAP-HSZRJFAPSA-N 432.520 4.488 10 10 IICE O=C(CCc1ccccc1C(F)(F)F)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266259283 XHDRBYMZVPSXRN-UHFFFAOYSA-N 445.529 4.486 10 10 IICE CC(C)CCN(C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCSCC2)cc1 1287581546 ZKWBOYKVBZMHTF-UHFFFAOYSA-N 438.645 4.367 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)cc1 1293284807 XZBACXMUOKEGEL-QFIPXVFZSA-N 441.572 4.115 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NN1CCCc2ccccc21 1296855637 JXMNCOFATDQKDH-NBVRZTHBSA-N 443.619 4.214 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)C2)cc1 1299771178 ZVGWJFLAFQPMKY-LLVKDONJSA-N 442.274 4.306 10 10 IICE Cc1ccc(CN(C)c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)s1 1304346674 WKZLLIIXHZAZFT-SFHVURJKSA-N 443.592 4.432 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCS(=O)(=O)CC 1306701133 STUDVVCTFTUOJE-UHFFFAOYSA-N 443.617 4.024 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C1 1359884174 MKFNNCGDXCPYNA-FQEVSTJZSA-N 436.579 4.390 10 10 IICE CC(C)CSCCn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1360083292 CFYIVESOOVWMQT-UHFFFAOYSA-N 443.661 4.408 10 10 IICE C[C@@H](NC(=O)Cc1c(Cl)cccc1Br)c1ccc(N2CCOCC2)cc1 1434913564 ZMMBUJCFIQWBTA-CQSZACIVSA-N 437.765 4.359 10 10 IICE CCCc1csc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1458498430 VRLPDCWJTIFSEH-GDNBJRDFSA-N 435.571 4.465 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1csc(CCNC(=O)OC(C)(C)C)n1 1463802993 AEQVIDIOXRYLPU-UHFFFAOYSA-N 444.601 4.083 10 10 IICE COc1ccc(N2CCC(NC(=O)C[C@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1464705396 RBILMAZAGWOEKQ-IBGZPJMESA-N 433.593 4.110 10 10 IICE Cc1cnc(NC(=O)[C@H]2CSCN2C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)s1 1464829931 PYUKMLZJGDXGLH-GOSISDBHSA-N 444.557 4.152 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(O)Cc1cc(Cl)cc(Cl)c1 1470449511 SMUYBXLWIAUIAU-UHFFFAOYSA-N 446.281 4.209 10 10 IICE Cc1cc(C(=O)Nc2ccccc2CNS(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1471342634 SMTQQBHCIOKTCH-UHFFFAOYSA-N 431.945 4.049 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)[C@H](C)C3)cc2Cl)C1 1478528044 LHAIJASFUILUOO-RBUKOAKNSA-N 442.007 4.392 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCc4c3ccc(F)c4Br)C2)cc1 1478634041 CYZFNSQBYDXXQH-BFUOFWGJSA-N 448.336 4.162 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCSC(F)(F)F)cs1 1492665848 WEVQWXLUQRTHLY-UHFFFAOYSA-N 443.520 4.229 10 10 IICE CCC(O)(CC)Cn1c(Nc2ccn(C)n2)nnc1-c1cc(C)n(-c2ccccc2)c1C 1497469709 YSLBJOHITQLNLE-UHFFFAOYSA-N 433.560 4.381 10 10 IICE CCCC(=O)N[C@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1499876256 SVWYKCGODOAMIK-NQIIRXRSSA-N 440.636 4.099 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(C2CCCC2)n1CCCSc1nccs1 1502059197 BMWZENRGZBSZGI-UHFFFAOYSA-N 431.635 4.335 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1 1520327392 NSBGLLDHZAHGSY-OAQYLSRUSA-N 425.891 4.422 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1548052905 CETALLPIBPNTDF-XZOQPEGZSA-N 441.620 4.420 10 10 IICE CCOCc1nnc(N2CCC[C@@H](OC(C)(C)C)C2)n1Cc1ccc(N(CC)CC)cc1 1548150061 AROWZAHKEOXVRL-JOCHJYFZSA-N 443.636 4.493 10 10 IICE Cc1ccc(-c2csc(NC(=O)CN(Cc3ccccc3O)C[C@H]3CCCO3)n2)cc1 1559635601 XSZQXAXHWLGYIH-HXUWFJFHSA-N 437.565 4.444 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)sc2C)cc1 1583475960 PCAWTWCUJGRVQB-UHFFFAOYSA-N 435.593 4.414 10 10 IICE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C(=O)c1ccc(N=NC(N)=O)cc1 1611123801 VPTAOAQEXHGGFD-UHFFFAOYSA-N 425.489 4.016 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(Br)cnc2O)cc1 1624286800 OPWIMACMZCTXPL-UHFFFAOYSA-N 430.302 4.051 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c1 1625117520 PTARORZUBAJYSP-QGZVFWFLSA-N 438.549 4.143 10 10 IICE CCc1cc2c(CC(=O)NCc3ccc(N4CCN(C(C)=O)CC4)cc3)csc2s1 1625198343 DYIRGOWMPRFTGU-UHFFFAOYSA-N 441.622 4.053 10 10 IICE Cc1ccc2[nH]c(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc2c1Br 1628854993 WKHMKFJEYFSITE-UHFFFAOYSA-N 442.357 4.348 10 10 IICE CCN(CC)[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1 1631425694 MODSQJGVPGKGML-FYYLOGMGSA-N 429.992 4.209 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(Cn4cc(Cl)cn4)cc3)c2)CC1 1633402927 STGIZHPLFMUKCF-UHFFFAOYSA-N 437.975 4.368 10 10 IICE COc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)c(I)c1 1634000377 HKCBCGQJSONGEC-UHFFFAOYSA-N 441.246 4.178 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCO[C@@H](C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1637018438 VAEBHYDFBCEELH-QFBILLFUSA-N 434.378 4.433 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1nc(-c2ccccc2)n2c1CCCCC2 1639588067 QYBFGFLVKVMVBS-UHFFFAOYSA-N 447.535 4.188 10 10 IICE COc1ccc(N2CCN(CCNc3nc4cccc(OC(F)F)c4s3)CC2)cc1 1642161800 YCEHCBGCARLROA-UHFFFAOYSA-N 434.512 4.140 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)Nc4ccccc4S3(=O)=O)c2C)cc1C 1652691709 OTADUZOVVGXXOA-UHFFFAOYSA-N 437.521 4.130 10 10 IICE COC(=O)Nc1ccc(CNC(=O)CN(CCc2ccccc2)c2ccc(OC)cc2)cc1 1653680071 KPZBIJKJECLHJG-UHFFFAOYSA-N 447.535 4.239 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@]3(C)Cc3ccc(F)c(Cl)c3)nc12 1659815828 VVNBNYPUGUNZCG-QFIPXVFZSA-N 446.910 4.001 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(CNC(=O)OC(C)(C)C)cc1F 1682447056 OUKKNMBRTAXTSI-UHFFFAOYSA-N 444.551 4.258 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCn3c(cc4c(Cl)cccc43)C2)N(C)C)cc1 1684607451 QAXCLCHIHIAEKF-QHCPKHFHSA-N 439.991 4.189 10 10 IICE CC[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 1694970039 VVWZXDNURJMLHT-FXAWDEMLSA-N 429.584 4.268 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC([C@@H]4CCOC4)CC3)nnc2C(C)(C)C)cc1F 1696611203 WDSXCEVCEPPZAE-LJQANCHMSA-N 429.584 4.082 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCC1(C)C 1698232983 XEUSBGLLVDBQBL-ZVDOUQERSA-N 428.577 4.170 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N(C)[C@H]3CCOC3)cc2)CC1 1708103955 IHCJIAAGNWVPPX-QFIPXVFZSA-N 425.621 4.376 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1708375366 UGEBHDGVTNCSNB-VGOFRKELSA-N 445.583 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)Cc2nccs2)cc1 1728381612 VKOBUIYBDWAGEJ-UHFFFAOYSA-N 435.601 4.271 10 10 IICE COC1CCC(CCn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)CC1 1730348803 DWYGYOWRSRBAPV-UHFFFAOYSA-N 435.572 4.201 10 10 IICE CCc1ccc(-c2nnc(N(C)[C@H]3CCOC3)n2CCCSc2nccs2)cc1 1744319164 CQRILTWRDKYXBT-SFHVURJKSA-N 429.615 4.372 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3ccccc3OC)SC2=S)N(C)C)cc1 1858594243 QFSPLZGHVWCWBB-JZQBQCRLSA-N 428.579 4.208 10 10 IICE CCCCCCNC(=O)Cn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@H]21 1860347427 OZCCLYNLCKJJMH-SANMLTNESA-N 444.579 4.485 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@H]1CNCc1ccc(Br)cc1O 1967785856 AGYHIBQUWYTFTD-INIZCTEOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Cl)cc(Br)c2O)[C@H](F)C1 2029903618 KFAMUBKMHVINAJ-ZIAGYGMSSA-N 437.737 4.245 10 10 IICE Cc1ccc([C@@H](C2CCC2)n2nc(C3CC3)c(CO)c2I)c(O)c1 2078999952 YDOJGFJJZRBOIG-GOSISDBHSA-N 438.309 4.261 10 10 IICE COc1ccc([C@@H](n2nc(C(F)(F)F)c(CN)c2Br)C(C)(C)C)c(O)c1 2079863491 TZQUITMIFXWITN-CQSZACIVSA-N 436.272 4.473 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NCc2cc(Cl)cc(Br)c2O)C[C@@H](F)C1 2219141863 QULYZCLDFMSRKE-OLZOCXBDSA-N 437.737 4.245 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C(C)C)c1O 2236054349 HMDWVFBXBNEYRS-WBVHZDCISA-N 443.382 4.287 10 10 IICE CCC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 2297328304 GODLRAGMYVGEGJ-CQSZACIVSA-N 432.479 4.309 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C2CCCC2)C1=O 2314413676 DPTROKCGMCEWTK-UHFFFAOYSA-N 442.610 4.440 10 10 IICE CCOc1cc(C=C2SC(=S)N(CC(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 2314842194 FKBMSBAUVIDBNK-UHFFFAOYSA-N 448.953 4.284 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(c3ccccc3OC)C2=O)c1)C(=O)O 2314931421 NZXCFINWDBVDFE-MRXNPFEDSA-N 429.519 4.343 10 10 IICE CCOc1cccc(C=C2SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)c1O 2321630766 MCJDPLLYGNBTLZ-UHFFFAOYSA-N 432.479 4.114 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)ccc1O 2321635429 FJAROBLWJBKWEA-UHFFFAOYSA-N 432.479 4.114 10 10 IICE COC(=O)c1cccc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)c1 2321718270 UXRPMSKIWPRUPD-UHFFFAOYSA-N 429.548 4.205 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 2332144826 QUUPOBZZHQKASQ-UHFFFAOYSA-N 445.431 4.152 10 10 IICE O=C1N/C(=C\c2ccc(N3CCCC3)cc2)C(=O)N1Cc1ccc(Br)cc1 33315590 IMZGYXWRMYOFCS-UYRXBGFRSA-N 426.314 4.142 10 10 IICE CCCCCN1C(=O)/C(=C/c2c(NCCC)nc3ccc(C)cn3c2=O)SC1=S 33468524 LRALOXDXXLXZFF-VBKFSLOCSA-N 430.599 4.216 10 10 IICE O=C(COC(=O)/C=C\c1ccccc1Cl)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 33470484 OHIDBKBIBYYZFI-XFXZXTDPSA-N 445.858 4.311 10 10 IICE O=C(COC(=O)/C=C\c1cccc(Cl)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 33504242 FNAKVAVWEOUUNS-FLIBITNWSA-N 445.858 4.311 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3cc(Br)ccc3O)CC[C@H]2C1 401125647 NPKMFGUVOKOFEQ-YSVLISHTSA-N 425.367 4.280 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(Cc2ccccc2)Cc2cc[nH]n2)C1 444086172 IUVBWTZVEHHTRQ-UHFFFAOYSA-N 441.579 4.360 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccccc3F)[C@@H]2c2ccc(O)c(O)c2)c1 526204902 YVFFGKXYPKXHBG-JOCHJYFZSA-N 437.423 4.311 10 10 IICE CCN(Cc1ccccc1NC(=O)NCc1cc(OC)ccc1O)C(=O)OC(C)(C)C 737019449 CILCCBXLHIULOX-UHFFFAOYSA-N 429.517 4.480 10 10 IICE C[C@H](CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(Br)cc1 770256788 YWHBDNWDZPYXJV-QGZVFWFLSA-N 431.374 4.438 10 10 IICE C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 776417905 QTYJZDJNQSLRQT-BZNIZROVSA-N 446.381 4.173 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(c3nc(-c4ccccn4)no3)CC2)c1 781905337 NAMTUZYIVRAWCZ-UHFFFAOYSA-N 429.318 4.288 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(F)c(Br)cc1Cl 793121005 YHCYEIRDXUZNPT-UHFFFAOYSA-N 445.691 4.147 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 810167772 NZGZYBLLFMGZGZ-KBPBESRZSA-N 435.565 4.016 10 10 IICE CC(C)n1ncc2cc(/C=C/C(=O)N3CCCc4cc(Br)ccc43)c(=O)[nH]c21 918677151 NVCPXDIRJXRPPX-VMPITWQZSA-N 441.329 4.061 10 10 IICE Cc1cc(CNC(=O)Cc2csc(NC(=O)c3ccco3)n2)c(C)n1-c1ccccc1 1132048429 UZJPXQXDRYDRNK-UHFFFAOYSA-N 434.521 4.255 10 10 IICE CCSc1ccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 1132866406 HFZSIMPQKHRHCQ-UHFFFAOYSA-N 446.484 4.412 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CC(=O)N(CCOc4ccccc4)C3)c2C)c1 1136944525 IWICFDOBSRKJCI-JOCHJYFZSA-N 445.563 4.121 10 10 IICE CCOC(=O)CCN(C[C@@H]1CCCN1CC)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1142138086 KTHGVIBAGFKVDK-QHCPKHFHSA-N 439.600 4.282 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(C(=O)c4cccc(O)c4)cc3)c2)CC1 1153546675 OBPBTPXUZCJPFC-UHFFFAOYSA-N 443.547 4.406 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1CC(Cl)(Cl)C1 1156837795 VPTMMSGJTCYAEX-GHXNOFRVSA-N 435.423 4.182 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C 1162540191 SVHLCVMHGWNYST-UHFFFAOYSA-N 434.414 4.108 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H](C)[C@H]2CCO)sc(C)c1-c1ccccc1 1171833897 KYKRRFKKBFENFF-QFBILLFUSA-N 444.597 4.322 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@](C)(CO)c2cccc(Br)c2)cc1 1180167105 UUCZGBKQDNCJAC-JOCHJYFZSA-N 427.342 4.494 10 10 IICE C[C@H](NC(=O)C1(C(=O)OC(C)(C)C)CCCCCC1)c1ccc(N2CCOCC2)cc1 1264822455 RJURXRWENYNIGA-IBGZPJMESA-N 430.589 4.383 10 10 IICE Cc1ccc2c(c1)CCN2C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1271488751 PZHPNKHBBJKQSS-UYRXBGFRSA-N 426.538 4.315 10 10 IICE C[C@H]1CC[C@H](Cn2c(CNC(=O)c3cccs3)nnc2N(C)Cc2ccccc2O)C1 1291057610 KDYXBAVCYSGYOL-IRXDYDNUSA-N 439.585 4.048 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C/C(=O)NCc2ccc(N3CCSCC3)cc2)o1 1291629861 WPOJJDGWQBRDJC-PKNBQFBNSA-N 428.554 4.118 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CC=C(C(F)(F)F)CC1 1304238575 VDAQXAWALDXCNT-GOSISDBHSA-N 449.521 4.294 10 10 IICE CCc1nnc(N2C[C@H](C)O[C@H](c3ccsc3)C2)n1Cc1ccc(N(C)C)c(F)c1 1306109606 GIIDRSFOUFCXMZ-YWZLYKJASA-N 429.565 4.122 10 10 IICE COc1ccc(N2CCN(CCCCOc3ccc(Br)cc3)CC2)c(OC)c1 1308013945 GCYBAWSBEALREP-UHFFFAOYSA-N 449.389 4.448 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccn(-c4ccc(Cl)cc4)n3)cc2F)C[C@@H](C)O1 1355131733 YNMJQZCTQZPUJG-HZPDHXFCSA-N 442.922 4.208 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(O)c(O)c2)c2c[nH]c3ccccc23)cc1 1440597950 RQIJMKIMLPAGEQ-OAQYLSRUSA-N 429.520 4.136 10 10 IICE CCc1nc2ccccc2n1CCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445887851 VRHWNTFQGGZWGW-IBGZPJMESA-N 440.975 4.129 10 10 IICE Cc1ccc(C(=O)N2C[C@H](CN(C)C)Oc3ccccc32)cc1-n1c(C)cc(C=O)c1C 1446113633 RKTPWGBNMXAFKR-QFIPXVFZSA-N 431.536 4.184 10 10 IICE Cc1cc(C(=O)Nc2nc3c(s2)CS(=O)(=O)CC3)c(C)n1-c1cccc(C(C)C)c1 1451366196 GSOZRPANJXPBJO-UHFFFAOYSA-N 443.594 4.397 10 10 IICE CCOC(=O)Cc1nnc(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)s1 1457726649 XWHKPSCIBWIUFY-UHFFFAOYSA-N 426.542 4.427 10 10 IICE Cc1cc(CNC(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)c(C)n1-c1ccccc1 1462083029 GXMYDHFSEAOBAJ-UHFFFAOYSA-N 429.480 4.177 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C(F)(F)Oc2ccc(C=O)cc2)cc1 1464073531 KZMZAEOJXPXKBV-UHFFFAOYSA-N 428.435 4.359 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3Cc4ccc(C)c(Br)c4C3)C2)cc1 1478957704 RFLLYYZYLRTNOW-MRXNPFEDSA-N 430.346 4.070 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@@H](c3noc(C(C)C)n3)C2)cc1 1501835626 ZEKUVKPCXIJKGH-HXUWFJFHSA-N 437.592 4.371 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCC2)nnc1N1C[C@@H](C(F)(F)F)O[C@H](C)C1 1510671511 DADAOOGKOZFWIS-BEFAXECRSA-N 437.510 4.124 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@@H]2CS(=O)(=O)c3ccccc32)c1 1523032730 XYOKYELRHDYDLZ-MRXNPFEDSA-N 428.941 4.048 10 10 IICE Cc1cc(CC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1523924196 CGQSPOYQFORCDZ-ROUUACIJSA-N 432.008 4.294 10 10 IICE CCOC(=O)c1c(NC(=O)C2CCN(C(=O)OC)CC2)sc(C)c1-c1ccc(F)cc1 1525141529 QUUDJVLNTGXICK-UHFFFAOYSA-N 448.516 4.456 10 10 IICE C[C@@H](Oc1ccc(F)cc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015069 CYFLBEQAQMSEQV-QGZVFWFLSA-N 445.966 4.095 10 10 IICE CN(C)c1ccc(CNC(=O)c2nn(-c3cc(Cl)ccc3F)c3c2CCC3)cc1F 1528618957 FVKDEFVXRDLPCU-UHFFFAOYSA-N 430.886 4.289 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCC(C)(C)C(=O)OC(C)(C)C)CCCC1 1529621179 CZUWHKGOWWINNV-UHFFFAOYSA-N 428.573 4.403 10 10 IICE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1537838364 AMPDXUUVSOOKIZ-FYWRMAATSA-N 446.378 4.415 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1CO[C@@H](CCC(=O)OC(C)(C)C)C1 1540464548 IFCFKVFUIBJCBP-IRLDBZIGSA-N 430.589 4.162 10 10 IICE CCN(CC(=O)Nc1ccccc1OC)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1540700892 KIKZILAUGXMHOM-UHFFFAOYSA-N 433.508 4.016 10 10 IICE Cc1cc(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)c(C)n1-c1ccccc1 1544085899 ADGZBXCBXPWYGK-UHFFFAOYSA-N 433.443 4.257 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CO[C@@H]1C[C@H](C)CC[C@@H]1C(C)C 1566848918 CTKDKGOCDIWAED-XFQXTVEOSA-N 425.953 4.025 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1567467833 SWRCXXUGSOBIHT-NVXWUHKLSA-N 426.513 4.074 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2c[nH]c3c(Cl)cccc3c2=O)cc1 1583918557 IORGIBXFYASZGQ-SFHVURJKSA-N 439.943 4.069 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCNC(=O)c3c(F)cccc3F)c2C)c1 1586213267 RWRHJCVBZJEEHG-UHFFFAOYSA-N 425.479 4.149 10 10 IICE Cc1cc(C(=O)Nc2c(Cl)ccc3nonc23)nn1-c1ccccc1Br 1586682653 BEZFOIGYPVTXMO-UHFFFAOYSA-N 432.665 4.385 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1617070486 WNMJOOGAILYZNM-FQEVSTJZSA-N 437.588 4.394 10 10 IICE CCOC(=O)C[C@@H]1CCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1617306200 ATCHYQIIZDCIRB-SFHVURJKSA-N 433.346 4.414 10 10 IICE CO[C@@H](C)c1nc(Cn2c(C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cs1 1618925916 NWGFAIZQMOJKEV-INIZCTEOSA-N 426.590 4.035 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OCC(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1627619714 XSMSAAZFDHRWJA-UHFFFAOYSA-N 431.964 4.227 10 10 IICE COc1ccc([C@H](CO)CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1629561887 MZLSCXOVSQNTJA-FQEVSTJZSA-N 426.944 4.191 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(Br)c3)CC2)cc1F 1631378124 YSKFAPDVWDMTKB-UHFFFAOYSA-N 427.701 4.213 10 10 IICE Cc1cc(C(=O)N(C)c2ccc3c(c2)OCO3)c(C)n1-c1ccc(Br)cn1 1631894245 PHXFEYQHHOSHSO-UHFFFAOYSA-N 428.286 4.257 10 10 IICE CC1(C)Cc2cccc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)c2O1 1635973832 VWPQEHZKCQRDDA-UHFFFAOYSA-N 444.534 4.220 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)CC1 1639099543 VSTKKNKHRJEESX-HNNXBMFYSA-N 436.524 4.126 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1640088559 SQZCOCNCCDHTRR-WFASDCNBSA-N 429.355 4.100 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NCc2ccccc2)cc1Cl 1642153705 WRQKUJGHEMJAFV-UHFFFAOYSA-N 437.927 4.354 10 10 IICE COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1F 1657960821 HVQCMJQZQRCUHU-HUUCEWRRSA-N 446.478 4.288 10 10 IICE CCCC1(CCC)CCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1660030774 DEMSGDXPBOBXBA-WOJBJXKFSA-N 433.612 4.490 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCN(CC)C(=O)OC(C)(C)C 1693995437 CYDWKMDNODTZHO-QGZVFWFLSA-N 431.581 4.391 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)C)n2C[C@@H]2CC2(C)C)c(C)n1-c1ccccc1 1724206159 VCYLGVWTMRJXEP-FQEVSTJZSA-N 448.615 4.360 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N(C)CCc1cccs1 1724234135 AHGILEKANPYFRT-FQEVSTJZSA-N 439.629 4.335 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1C[C@@H](C1CCCCC1)N(C)C 1729420219 JXNMBQKXRNNJNM-VXKWHMMOSA-N 441.620 4.025 10 10 IICE C[C@@H]1CCCN(CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1752182653 HMCFEAWEOSSNPP-GOSISDBHSA-N 425.602 4.004 10 10 IICE CCc1nnc(N2CCCN(C(C)(C)C)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1763068682 VNMRGWZPVFMGIZ-UHFFFAOYSA-N 438.664 4.436 10 10 IICE CCC(C)(C)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1763334772 UPLXDIJAAMUWAS-QFIPXVFZSA-N 441.620 4.429 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@@H]2CCCCO2)n1CCC(C)(F)F 1767081412 ZOFKHBAFUPQGNZ-FQEVSTJZSA-N 449.546 4.038 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccc(C)c(C)c3)sc2CCC(=O)O)cc1 1858035112 QGTDVWPWSMRIJP-UHFFFAOYSA-N 446.550 4.254 10 10 IICE CSc1ccc(/C=C2/SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 1858592057 HIHLACLDTLMZCW-KTZOAPACSA-N 431.560 4.011 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(Cl)cc2)nc1-c1ccc2c(c1)CC(=O)N2C 1859572230 SOCOEOBRUHMRKU-UHFFFAOYSA-N 433.942 4.092 10 10 IICE CCCOC(=O)c1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)c1 1860086867 MBOYSBKBUWSHFU-VCHYOVAHSA-N 427.503 4.388 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2cc(C)ccn2)sc(C)c1-c1ccc(C)c(C)c1 1860748521 DREYYFRHUIXHSN-UHFFFAOYSA-N 437.521 4.408 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)N2CCCCC2)cc1 1865982223 JCFHAAZCRIXLPR-OAQYLSRUSA-N 430.936 4.271 10 10 IICE COc1ccc(O)c([C@@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@@H]2C(=O)O)c1 1952766995 YXLUWCVAESRSFO-GJZUVCINSA-N 445.471 4.239 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)[C@@H]2C[C@H]21 2057596840 YMZBWWSVDWVNGH-AEGPPILISA-N 431.758 4.296 10 10 IICE COCCNCc1ccc(N2CCC[C@@H](OCc3ccccc3)C2)c(Br)c1 2186382897 XTDCWAQBDWYIGQ-HXUWFJFHSA-N 433.390 4.371 10 10 IICE CN1CCc2cc([C@@H](O)C3(COCc4ccccc4)CN(C(=O)OC(C)(C)C)C3)ccc21 2256697811 BSHAQRHPRIKKTP-HSZRJFAPSA-N 438.568 4.166 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2cccc(O)c2)SC1=S)Nc1nccs1 2314836746 JMWFKZJATYXKRF-UHFFFAOYSA-N 433.580 4.249 10 10 IICE CCn1c(/C=C\c2ccc(N(C)C)cc2)nc2ccc(I)cc2c1=O 33432302 BKAMOPWZDFUJRD-GHXNOFRVSA-N 445.304 4.257 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccccc1 210710994 RMTZMUAKWJSAHE-GHRIWEEISA-N 427.507 4.215 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c(C)n1-c1ccc(F)cc1 728914243 CXLCBSYRBQLWSX-GOSISDBHSA-N 439.575 4.386 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1 743337068 PBHRGOYIBSJFEB-SJLPKXTDSA-N 428.529 4.104 10 10 IICE C[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@H](c2ccccc2)O1 745903849 JDYIJQIRTDGFQC-SFGWALBWSA-N 445.510 4.428 10 10 IICE COc1cc(N2CCN(C(=O)c3ccc(-c4ccc(F)cc4)o3)CC2)cc(OC)c1OC 759221670 DPPBYHCEGJPAND-UHFFFAOYSA-N 440.471 4.074 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H](c1cccnc1)C1CC1 760012060 PHIDSDBOKZQBQP-GTVARFKMSA-N 443.619 4.392 10 10 IICE COC(=O)Nc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1F 766593030 PBHSJHPGZCICMB-UHFFFAOYSA-N 438.503 4.364 10 10 IICE O=C(/C=C/c1nc2ccccc2s1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768532514 MIOPPDVJSMBPDO-VAWYXSNFSA-N 432.593 4.158 10 10 IICE Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768903682 RNZCULNVLOXSDL-UHFFFAOYSA-N 437.544 4.065 10 10 IICE C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 792034357 YOSALVKNWKGTCN-IUODEOHRSA-N 439.400 4.024 10 10 IICE Clc1ccn2c(CNCc3ccc(N4CCN(CC5CC5)CC4)cc3)c(Cl)nc2c1 796347552 VPKNVBCBJIPGGS-UHFFFAOYSA-N 444.410 4.463 10 10 IICE COc1ccc(CNC(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)c(O)c1 797635295 IHCSMSYXLVKMHS-UHFFFAOYSA-N 429.480 4.029 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1Oc1ccncc1 800933444 ANVPAEVARKDYCP-UHFFFAOYSA-N 442.563 4.336 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OC(F)F)c(Cl)c1 1127267520 JILGSKZJPATXJR-UHFFFAOYSA-N 449.929 4.403 10 10 IICE Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127267834 NEHLVCCLHINHDL-LJQANCHMSA-N 442.003 4.264 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c(C)nn(C)c3Sc3ccccc3)C2)cc1 1130185803 RSRCXFLZNDZLEJ-SFHVURJKSA-N 436.581 4.145 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C\c3cc(Cl)cc(Cl)c3)cc2)CC1 1133847174 GWZGFAQVDURFAI-UTCJRWHESA-N 432.351 4.025 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@]2(c3cnn(C)c3)CCCO2)cc1 1134581779 NNYMSFNYDVLTIZ-DEOSSOPVSA-N 432.528 4.337 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c(C)n1-c1cccc(Br)c1 1137377086 BOMAGGNRVVXMRY-DYESRHJHSA-N 430.390 4.413 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(NC(=O)c2ccc(OC)cc2)s1 1157102027 HXMUSQPOJWOUAE-UHFFFAOYSA-N 431.510 4.130 10 10 IICE COc1ccc(N2CCN(Cc3ccc(Br)c4cccnc34)CC2)c(OC)c1 1197106419 ZLAIXDRDPONPFG-UHFFFAOYSA-N 442.357 4.337 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCOC[C@H](C3CCC3)C2)nnc1C(C)(C)C 1304239917 FHSJSQWHRSGQRN-OAQYLSRUSA-N 425.621 4.251 10 10 IICE C[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1)c1ccc(N(C)C)cc1 1306829455 FSLCGHDQVMOYHJ-NBGIEHNGSA-N 445.563 4.468 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H]1/C=C/c1ccccc1 1312833183 GJYYIMHOOMEFFV-IBDYFIJFSA-N 427.495 4.189 10 10 IICE CCN(CC)c1ccc(Cn2c(N(C)C3CCC3)nnc2[C@]2(OC(C)C)CCOC2)cc1 1313677937 BEYYXMLUMOQCSX-VWLOTQADSA-N 441.620 4.202 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)Nc2ncn(Cc3cccnc3)n2)cc1 1319929779 VBVCBXJFUDSAEB-UHFFFAOYSA-N 426.484 4.455 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C3(c4cccc(C)c4)CCCC3)CC2)cc1 1351457710 PYOJNDCHEJTNSS-UHFFFAOYSA-N 435.612 4.144 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1Cc2ccc(Br)cc2C(=O)O1 1353424501 HAESGDYAPHBBOS-FQEVSTJZSA-N 445.357 4.034 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](C[C@H]1CCCO1)C(F)(F)F 1435064467 KORVTTIJIUDRKW-SJORKVTESA-N 436.421 4.121 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)cc1 1435466227 WOBXHIDLABUQFI-UHFFFAOYSA-N 436.987 4.300 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)[C@@H]1Oc1ccccc1 1448160103 KMMPOMOFKUDSED-GPXOXTDOSA-N 432.520 4.261 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1cnc(N(C)C)cn1 1457576366 RRUDBPJOCYZRAY-SFHVURJKSA-N 443.473 4.468 10 10 IICE Oc1ccccc1CN(C[C@@H](O)COc1cc(Cl)cc(Cl)c1)C[C@H]1CCCO1 1459739268 IHJNTWHIRROLIW-RTBURBONSA-N 426.340 4.120 10 10 IICE CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1459990477 RFPZPOXXMFDPBT-KNXBSLHKSA-N 448.563 4.362 10 10 IICE Cc1cc(CCNC(=O)[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1461971540 ZLUCYGOOKBBOHL-RUZDIDTESA-N 425.573 4.400 10 10 IICE Cc1nc(-c2ccccn2)sc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1465951995 SIGFGGIDNACZKW-KRWDZBQOSA-N 442.972 4.267 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCC3(CNC(=O)OC(C)(C)C)CC3)ccc21 1469808690 WAGDYQNNLPZDDD-UHFFFAOYSA-N 443.588 4.329 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)c3cc(Cl)cc4c3OCC4)C2)cc1 1470592200 AIHNQRWIYUCUIN-JKSUJKDBSA-N 429.948 4.170 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCCc3cc(-c4ccccc4)n[nH]3)C2)cc1 1470594356 SFSQJJNSUZIXBP-HXUWFJFHSA-N 447.583 4.186 10 10 IICE COc1cc(N2CCN([C@@H](C)c3ccc(OC(F)(F)F)cc3)CC2)cc(OC)c1OC 1473363710 KOHJVJBQBYAAKL-HNNXBMFYSA-N 440.462 4.494 10 10 IICE COCCC1(NCc2c(O)cccc2Br)CCN(C(=O)OC(C)(C)C)CC1 1474678910 AYJFIYLGLFFUEG-UHFFFAOYSA-N 443.382 4.051 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 1478322056 FPZRQEPENKFBRX-OAQYLSRUSA-N 446.954 4.271 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)CC1 1504023517 NJUBAUPLUIUSRX-NRFANRHFSA-N 446.646 4.318 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)sc2c1CCCCC2 1515317888 REXXQHXWNYDAIG-MRXNPFEDSA-N 440.565 4.412 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccccn1 1518750383 YWVSJCYJPUVAQI-HXUWFJFHSA-N 448.546 4.369 10 10 IICE CC(C)C[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1526259693 KZEKFGRMUQALGG-NZQKXSOJSA-N 442.003 4.488 10 10 IICE Cc1cc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)ncc1C(N)=O 1532707380 PNHHQTQABHKQIE-UHFFFAOYSA-N 449.511 4.411 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccccc2C(=O)NCC(F)(F)F)c1 1539961710 BAPJYQAPJPZYTP-UHFFFAOYSA-N 443.425 4.451 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 1542431973 NIFVYVBDKLFYAB-FGZHOGPDSA-N 448.394 4.044 10 10 IICE COc1ccc(Cl)cc1C(F)(F)C(=O)NCc1ccc(N2CCSCC2)cc1 1544409819 SYLIWEKPOCOPFU-UHFFFAOYSA-N 426.916 4.310 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCO[C@@H](C)C1 1555510242 FXQRIOIPBPETJO-FPOVZHCZSA-N 437.588 4.250 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(CC(=O)NCCCSc3nccs3)cc21 1565620417 REVVUYOTMIXHTI-UHFFFAOYSA-N 433.599 4.282 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)COc2cc(Cl)cc(Cl)c2)c(C)n1-c1ccccn1 1587360162 ZLBQRPQWYKCTLX-SFHVURJKSA-N 448.350 4.308 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3sc(SCC(C)C)nc3C)CC2)c(OC)c1 1587490499 JKAAQFNCFRHWPX-UHFFFAOYSA-N 449.642 4.108 10 10 IICE Cc1cc(C(=O)N2CCC[C@]2(CO)CC(C)C)c(C)n1-c1ccc(Br)cn1 1626763477 XROSDRYMBFCTSO-OAQYLSRUSA-N 434.378 4.265 10 10 IICE CC1CCN(C(=O)OC[C@H]2CCCCN2C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1627096716 MGXBLOCJTWJCJZ-MRXNPFEDSA-N 432.542 4.176 10 10 IICE CCCS(=O)(=O)Nc1cccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1628312351 KPTDBWWGSKYPJA-UHFFFAOYSA-N 439.537 4.311 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CO[C@@H]1CCCc2ccccc21 1634384648 HJRDXDAHVIAKMA-XMMPIXPASA-N 438.568 4.469 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 1636264120 XUMAVIOTBSMJHX-NIYFSFCBSA-N 435.568 4.202 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccncc2OCCCN(C)C)c1 1641863987 ZQHCYTBDPJMAQS-UHFFFAOYSA-N 440.975 4.403 10 10 IICE Cc1ccc(C)c(SCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1 1656065478 SZNGOUIVFRURGF-UHFFFAOYSA-N 428.579 4.333 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CC[C@H](OCC(C)C)C1 1693006261 SOVOTAOEMUTEJU-XZOQPEGZSA-N 441.620 4.194 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCCn2c(CC3CC3)nnc2N(C)Cc2ccccc2O)C1 1693574824 PUPWNMWPDDZSML-WOJBJXKFSA-N 425.621 4.331 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCc1cnc2c(Cl)cnn2c1 1693999103 QZIUSMJJIFLFSZ-HNNXBMFYSA-N 439.951 4.072 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)CC(C)(C)C)n1Cc1ccc(N(C)C)cc1C 1694293414 CDZZWAQFZZRSKS-UHFFFAOYSA-N 428.625 4.102 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1709330457 AGFWOIVSJMFUHB-KRWDZBQOSA-N 429.565 4.432 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C1 1710614519 RHYHSMAOGKYWJL-QFIPXVFZSA-N 436.604 4.183 10 10 IICE CN(CC(C)(C)C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1711057151 NNKURODFEQLSEJ-UHFFFAOYSA-N 448.615 4.079 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC(c2cnn(C)c2)CC1 1724236154 TWKHTROLTZAOFB-UHFFFAOYSA-N 435.620 4.017 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726909354 QLPNOMXHRLRCDX-RCCFBDPRSA-N 447.624 4.146 10 10 IICE Cc1cc(-c2nnc(N3CCCCCC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1761678486 GLYRAVYLXIDPOC-UHFFFAOYSA-N 434.588 4.211 10 10 IICE CCCn1cc(OCC(=O)NCC)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1870970210 VFHGRXZHNYRDAE-UHFFFAOYSA-N 434.540 4.129 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C3(C)CC3)c(CO)c2I)c(O)c1 2079024375 CGARVEMGNQYESR-MRXNPFEDSA-N 440.325 4.291 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](C2(NCc3cc(Br)cc(F)c3O)CC2)C1 2090168176 FQORIJRUZOAUJU-ZDUSSCGKSA-N 429.330 4.173 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)c1O 2236054524 JJHVLNXFDBCUCK-QGZVFWFLSA-N 431.374 4.450 10 10 IICE O=C1C(=CC=Cc2ccc([N+](=O)[O-])o2)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 2297533950 JGPQYIZGGANBQE-UHFFFAOYSA-N 445.456 4.492 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(c2ccc(OC)cc2)C1=O)C(=O)O 2314933453 WBUNRQNKUFDRJU-INIZCTEOSA-N 429.519 4.343 10 10 IICE CCN1CCN(c2cc(NCc3ccco3)c3c4c(onc24)-c2ccccc2C3=O)CC1 9641974 CQCGCGJUDDNTNS-UHFFFAOYSA-N 428.492 4.386 10 10 IICE O=C1/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)SC(=S)N1CCN1CCOCC1 96930769 HJAABNYXXPKADG-QGOAFFKASA-N 434.970 4.133 10 10 IICE CC1=NN(CCOC(=O)Nc2ccccc2)C(=O)[C@@H]1N=Nc1ccc([N+](=O)[O-])cc1Cl 256003028 TVLFDYXFHZZILW-QGZVFWFLSA-N 444.835 4.167 10 10 IICE CCc1nc(-c2ccccc2NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n[nH]1 444333554 ZWFYCMUAORHGNV-UHFFFAOYSA-N 442.567 4.394 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC(c3nc(-c4ccccc4)no3)CC2)c([N+](=O)[O-])c1 728908569 MVVBLSJHYQBDDH-NTMALXAHSA-N 434.452 4.215 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 732409647 FEWQMILHMNDAKW-XSQUDIARSA-N 443.463 4.052 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCC(=O)c2ccc(F)c(F)c2)cc1 755262198 ODBLAJPHZQKHIW-HXUWFJFHSA-N 430.495 4.202 10 10 IICE C[C@H]1C[C@H](NC(=O)NCc2cc(Br)ccc2O)CCN1Cc1ccccc1 805177326 YEHJTHBMKZERJE-HNAYVOBHSA-N 432.362 4.007 10 10 IICE CC(=O)C(=O)CSc1nnc(COc2ccccc2F)n1[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 808010276 RDSMVRYBQAQVSC-QSPRXWTASA-N 431.533 4.244 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(C(F)(F)F)c2)n1C[C@H]1CCCO1 812306971 KOCUBDXHJMMGCR-GOSISDBHSA-N 432.446 4.485 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1 857433504 FHNBJDNTIRZADO-NRFANRHFSA-N 436.383 4.091 10 10 IICE CCOCn1nc(C)c(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1C 1139139592 XJLANXHBEPBVEH-INIZCTEOSA-N 432.996 4.243 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@]2(C)CCN(Cc3ccccc3)C2)cc1 1144569485 XQCSFIMYAUODPB-HHHXNRCGSA-N 429.564 4.230 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H](NC(C)=O)c1cccc(Br)c1 1155704903 SBJJRBZDQCTZAD-FQEVSTJZSA-N 433.346 4.161 10 10 IICE COc1cccc(CCNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1 1167487572 BDRPYCYEIOMXDR-UHFFFAOYSA-N 428.330 4.233 10 10 IICE Nc1c(F)cc(Br)cc1C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1298829977 NHYSKPKPEUJKLT-UHFFFAOYSA-N 426.249 4.132 10 10 IICE COc1cc(/C=C\C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc(Br)c1O 1299479053 SPNGLCTXDNTJAT-WUKHSURWSA-N 447.373 4.298 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H](OC)C(C)(C)C 1305526102 JJELAMAHWBAZOQ-DYESRHJHSA-N 447.599 4.327 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@@](O)(c3ccc(Br)cc3)C2)c1O 1308128803 LYJAIGMBKZWXOV-FQEVSTJZSA-N 438.749 4.494 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1ncc(Br)cc1Br 1323483284 OGXRAEATVKSJCW-UHFFFAOYSA-N 432.459 4.049 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)CC2)cc1 1352538790 XREYGOAEDIGNQK-UHFFFAOYSA-N 439.556 4.465 10 10 IICE CCOC(=O)c1cccc(N(CC)C(=O)/C=C\[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1441971462 RDQSFPHHYXNGFH-HWOXTHGCSA-N 430.545 4.420 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc(O)c1C 1455262798 OYGXEDDQJLEOKR-ZDLGFXPLSA-N 430.526 4.378 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C(CNCc3cc(Cl)cc(Br)c3O)[C@H]2C1 1474260358 UFPFZCRTHPQHTK-ZIAGYGMSSA-N 431.758 4.011 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@]4(CO[C@H](C)C4)O3)cc2Cl)C1 1478529208 XGSDAWMMONZNQX-PSHPWPFNSA-N 435.996 4.102 10 10 IICE CO[C@@H](Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1503994607 OGDCLNBWHQRFGU-GGAORHGYSA-N 441.620 4.080 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)cc1 1533211430 WYBMVAPSQLLXBP-UHFFFAOYSA-N 431.536 4.442 10 10 IICE COc1ccc(Oc2ccc(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)nc2)cc1 1537033814 QDVXUSBYWOUYFL-UHFFFAOYSA-N 433.508 4.290 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)c1 1539834646 RWBKLQNKEFEORK-HSZRJFAPSA-N 430.483 4.299 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CN(C)c3ccccc3[N+](=O)[O-])cc2Cl)C1 1539911902 FDAUAVMPXGTMPI-INIZCTEOSA-N 430.936 4.237 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]([C@H]2CCCO2)C1 1545504669 AOHLZJGYWVUVPO-SYYKKAFVSA-N 446.588 4.326 10 10 IICE CSC[C@@H]1CCCN1c1nnc(-c2ccc(C)o2)n1Cc1ccc(N(C)C)c(F)c1 1555893702 XGOZTFOTNYXKEK-KRWDZBQOSA-N 429.565 4.432 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CN3CC[C@H](c4ccccc4)NC3=O)c2C)c1 1557887773 LERBCYZUFNNTND-XMMPIXPASA-N 430.552 4.175 10 10 IICE CCOC(=O)[C@]1(COC)CCCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1559780865 OLZZNCJYASGXGL-XMMPIXPASA-N 438.528 4.332 10 10 IICE CCOC(=O)c1csc([C@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)n1 1564945950 IQOZGTIYQJIYMB-OXQOHEQNSA-N 444.601 4.172 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H](C)N2CSCCSC2)cc1 1565656063 NDDYVWURGZTPSA-GOSISDBHSA-N 445.654 4.380 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)Cc2cc(C)on2)cc1 1615379899 PMBAFFANJORPCU-UHFFFAOYSA-N 445.571 4.476 10 10 IICE CCOCc1nnc(N2CC[C@H](CC(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1616783032 VYKDMNNMXHDIAM-OAQYLSRUSA-N 443.661 4.289 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(Br)c(Cl)c2)N(C)C)cc1 1616857937 BSCCSXQAADFNOU-IBGZPJMESA-N 438.797 4.130 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(F)cc4)c3C(C)C)CC2)cc1 1623429498 FFTSTTXMPDNZET-UHFFFAOYSA-N 436.531 4.496 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N(C)C2CC2)c(C)n1-c1ccc(C(C)C)cc1 1623582350 OKYWQCQUFFGPNT-JOCHJYFZSA-N 425.598 4.353 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc2ccccc2c1O 1630368443 IZHKYOUPMOGYGW-UHFFFAOYSA-N 430.426 4.331 10 10 IICE Cc1ccc2[nH]c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2c1Br 1630550376 OSEFWMTVPPLTRW-UHFFFAOYSA-N 446.320 4.145 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1631398821 NYSDLYLJPVENRL-GOSISDBHSA-N 429.521 4.101 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](C(C)C)N1Cc2ccccc2C1=O 1635676613 HJXMLOHECQAZAU-HXUWFJFHSA-N 445.357 4.184 10 10 IICE COc1ccc(O)c([C@H](C)Nc2ncnc3cc(I)sc23)c1 1642230414 YNLFUHZJNYUZLF-QMMMGPOBSA-N 427.267 4.183 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCCN(C(=O)OC(C)(C)C)C2CC2)c1 1643514214 VSVYCISRAKKVSP-UHFFFAOYSA-N 439.556 4.426 10 10 IICE COc1ccc(N2CCN(C(=O)COc3c(C=O)cc(Cl)c4ccccc34)CC2)cc1 1643823443 RCAVLMMMSWTCGH-UHFFFAOYSA-N 438.911 4.042 10 10 IICE Cc1cccnc1[C@@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 1644901141 NZCUYYPSHZYEGN-SBUREZEXSA-N 441.531 4.479 10 10 IICE CCC[C@@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1=O 1652606964 OSKWJDVZZWMKQU-OAQYLSRUSA-N 435.446 4.406 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCN(C(C)C)CC2)cc1 1710025869 QBPWAWARNMXPEQ-UHFFFAOYSA-N 447.631 4.073 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1727664236 OSYHCSCEQGVYHA-WMZHIEFXSA-N 439.648 4.457 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1snnc1C 1743563663 LBXLOLZBRAXDMP-MRXNPFEDSA-N 425.606 4.236 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCSC(C)(C)C2)cc1 1746093564 QMLNEHFWBOEGCH-FQEVSTJZSA-N 443.661 4.398 10 10 IICE Cc1nnc(N2CCN(c3ccccc3F)C[C@H]2C)n1CCCSc1nccs1 1751929809 WBEKXUXQOJFVFD-OAHLLOKOSA-N 432.594 4.080 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCc1nccc(C(F)(F)F)n1 1752615636 MSCWOBUGEYMXNC-AWEZNQCLSA-N 434.466 4.185 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2CCC[C@H](C(=O)OC)C2)cc1 1764938172 GGIOOLRGWVZYJB-NRFANRHFSA-N 439.604 4.220 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1cccnc1 1766545920 AFRMFCMUSMYNJX-UHFFFAOYSA-N 444.583 4.463 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@@H]1C 1768007045 KFNWEUZUSFWGPM-QUCCMNQESA-N 437.588 4.391 10 10 IICE CC(C)CC(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 1860548813 CYRAAVCFLRMNLL-UHFFFAOYSA-N 427.460 4.094 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ccc(OC)cc2)sc(C)c1-c1ccc(C)cc1 1860749082 UYVHKJPGOCMICS-UHFFFAOYSA-N 438.505 4.404 10 10 IICE CCC1=NN(Cc2ccc(F)cc2)C(=O)/C1=C/c1cc(Br)cc(OC)c1O 1865672348 XZVSRXJQZGIMCP-CXUHLZMHSA-N 433.277 4.494 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CNCc2cc(Br)cc(F)c2O)CC1(C)C 1878889098 DOKXEPYXOABBJT-LBPRGKRZSA-N 431.346 4.419 10 10 IICE CN(C[C@@H](O)COCc1ccccc1)c1ccc(CNC(C)(C)C)cc1Br 1916393301 GTBVMPLDEFQLKV-LJQANCHMSA-N 435.406 4.351 10 10 IICE Nc1ccc(NC(=O)NCCCONC(=O)OCC2c3ccccc3-c3ccccc32)cc1 1977695049 PMZYHLCPDWRLHP-UHFFFAOYSA-N 446.507 4.251 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)[C@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 2044751720 DQJXJKACXVJPAW-OZXSUGGESA-N 438.616 4.183 10 10 IICE CC[C@@]1(NCc2c(Br)ccc(OC)c2O)CCCN(C(=O)OC(C)(C)C)C1 2236054362 HOKPXCSONUOMRS-HXUWFJFHSA-N 443.382 4.433 10 10 IICE O=S(=O)(c1ccc([C@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@H]32)cc1)N1CCOCC1 9968860 PZYXUOKZHZFZJV-NNMXDRDESA-N 430.957 4.187 10 10 IICE COCCN1C(=O)/C(=C\c2cc3ccccc3nc2N2CCC(C)CC2)SC1=S 208281389 XXDUAOCTNALGMO-XMHGGMMESA-N 427.595 4.319 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 226738766 NBKUNXBYLPWQOX-XQBPLPMBSA-N 427.526 4.452 10 10 IICE CCN(CC)c1ccc(CNC(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)cc1F 303347087 MUCMHGRNTULWRP-IBGZPJMESA-N 428.552 4.006 10 10 IICE Cc1cccc(NC(=O)CN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1C 435621198 JQRUAHSISUHPQA-UHFFFAOYSA-N 446.595 4.122 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc(Br)ccn2)C1 445219494 KFCNHLDDMUYWFF-UHFFFAOYSA-N 427.346 4.204 10 10 IICE COc1ccc(C(=O)N2CCC(NCc3cc(-c4ccccc4)ccc3O)CC2)c(OC)c1 725848563 YDJDAKQCNXZNOE-UHFFFAOYSA-N 446.547 4.471 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccccc3OC3CCC3)cc2F)C[C@@H](C)O1 735680831 IVHMSNPOXKHZFB-QZTJIDSGSA-N 441.547 4.370 10 10 IICE C[C@H](CCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NC(=O)OC(C)(C)C 764989453 YSPPEHCPSVKDFE-CVEARBPZSA-N 441.519 4.066 10 10 IICE Cc1cncc(/C=C\C(=O)NCc2ccc(N(C)C(=O)/C=C/c3cncc(C)c3)cc2)c1 765480229 LKRGSXYRJAVNLC-NAKBGQTNSA-N 426.520 4.099 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](C(F)(F)F)[C@@H]3C)cc2F)C[C@@H](C)O1 773234307 AKSANXBJKCDQIP-IVSAIRAKSA-N 431.474 4.312 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\c3cc(-n4ccnc4)cs3)SC2=S)cc1 783698684 MZLFRAVNXKQMPM-WOJGMQOQSA-N 427.576 4.386 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)Nc1ccc(C)c(C(=O)N2CCOCC2)c1 801765163 IYNBQBBYZJJGDC-UHFFFAOYSA-N 425.529 4.007 10 10 IICE Cc1cc(C(=O)OCC(=O)N2CCC[C@@H](C(F)(F)F)C2)c(C)n1-c1ccc(F)cc1 918834432 UMLNZFXMJGRSHZ-OAHLLOKOSA-N 426.410 4.191 10 10 IICE O=C(CSc1cccc(C(F)(F)F)c1)NCc1ccc(N2CCC(CO)CC2)cc1 919968665 NKTYNQWKFJRLEW-UHFFFAOYSA-N 438.515 4.323 10 10 IICE CC(C)(C)c1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc(Cl)n1 1127267960 NLAOQIQMCWXMRF-UHFFFAOYSA-N 441.019 4.495 10 10 IICE Cc1ccc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)cc1-n1c(C)cc(C=O)c1C 1142023891 WFXYQXXIQYTYEF-UHFFFAOYSA-N 445.563 4.342 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCn2c(S)nnc2-c2cccc(C)c2)cc1F 1144977635 KPMVHMXZUHPFON-UHFFFAOYSA-N 441.576 4.234 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](Cc3ccccc3)CN3CCOCC3)c2C)c1 1147418494 QARBOXNUMVFPTO-RUZDIDTESA-N 445.607 4.384 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nc2ccccc2o1 1264331096 GNLQGVHVMNZTFR-SFQUDFHCSA-N 441.509 4.221 10 10 IICE CC[C@H](C)[C@H](Cn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C)OC 1291424898 DIUQQJBPPZLMCR-UWJYYQICSA-N 447.599 4.111 10 10 IICE Cc1cccnc1[C@@H](N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 1307568330 JIKUTGRGIPJFFY-SBUREZEXSA-N 441.531 4.479 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1Cl 1350762282 XVGGSZLFHSHTDL-UHFFFAOYSA-N 426.866 4.363 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)sc2c1CCCCC2 1354175302 ANJRPAWYLSIWIX-CYBMUJFWSA-N 446.956 4.449 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCCOc3ccc4c(c3)CCC4)cc2F)C[C@H](C)O1 1354656776 FWJVGPYOEAENCX-OALUTQOASA-N 440.559 4.403 10 10 IICE Cc1cccc(F)c1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1361101905 GMRXLLNNNMRCCS-WQRHYEAKSA-N 432.517 4.181 10 10 IICE Cc1cc(CC(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)c(C)n1-c1ccccc1 1440778547 CTTQSRBFHVCXOX-UHFFFAOYSA-N 430.552 4.449 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc3c(c2)CCN(C(=O)OC(C)(C)C)CC3)cc1F 1442476760 VPZKUKIGWHZALO-UHFFFAOYSA-N 441.547 4.157 10 10 IICE CC[C@@H](c1ccccc1)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(C)C 1459718286 IWZCGRPDSUJJCN-DEOSSOPVSA-N 441.591 4.388 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)NCCC(C)C)c(C)n1-c1cccc(Cl)c1 1464852769 LMMHAFPOODBMFV-HXUWFJFHSA-N 434.005 4.425 10 10 IICE COc1cc(F)c([C@@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1465051123 DCWICJXFZADFCI-MRXNPFEDSA-N 438.499 4.483 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCOCc2ccc(Cl)cc2Cl)cc1 1478341420 DNOOMJUEPVGCBR-UHFFFAOYSA-N 440.371 4.296 10 10 IICE COc1cccc([C@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)C2(C)C)c1 1479030748 QGBNZEPZRVBWEY-XMMPIXPASA-N 437.584 4.134 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1500735154 RARRGIKYNGTRLF-VWLOTQADSA-N 434.588 4.067 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCOC(C)(C)C)CC2)cc1 1504292794 SNICVNDGUWPDPQ-UHFFFAOYSA-N 427.593 4.086 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(=O)NC)C1 1514200262 ZRFNZRBXKWPCCE-ISPXXFMDSA-N 446.599 4.281 10 10 IICE CCC[C@@](C)(O)Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1514260868 BZWGRZPHEOOIEV-RUZDIDTESA-N 441.620 4.212 10 10 IICE CC[C@@H](CC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(OC)cc1 1521010207 PFYHJXOSHXDHPG-FQEVSTJZSA-N 427.564 4.176 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2csc(-c3ccc(OC)c(OC)c3)n2)cc1 1527595090 HLDSABGDPASPLW-UHFFFAOYSA-N 441.553 4.044 10 10 IICE CC(C)N(Cc1ccccn1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1527616716 INNJHKDEQDXGBO-UYRXBGFRSA-N 443.569 4.249 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(Oc4ccccc4OC)cn3)C2)cc1 1529411544 HFCNOYCXJDIOKI-SFHVURJKSA-N 433.508 4.147 10 10 IICE CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1534247490 LFLFITYUARMUGF-DEOSSOPVSA-N 433.552 4.110 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cn(Cc2ccc(Cl)cc2Cl)nn1 1536550343 PTJJYAJERGMJCD-OAHLLOKOSA-N 446.382 4.369 10 10 IICE CS[C@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C(C)(C)C 1538396764 ZEBJOUGCOINYKN-UVQBRAAOSA-N 440.631 4.311 10 10 IICE CSCC[C@H](C)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1538625509 GABAFCRJFOJRND-HKJJFUAXSA-N 426.604 4.017 10 10 IICE CCN(CC)c1nc2sc(C(=O)N[C@H]3CCN(c4ccc(OC)cc4)C3)cc2s1 1538746900 MULMMNFMBUNGPW-AWEZNQCLSA-N 430.599 4.221 10 10 IICE CC(C)Oc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1Br 1540536644 MMUHJYNTOWYJCV-UHFFFAOYSA-N 447.373 4.345 10 10 IICE C[C@H]1CCCCN1CCCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1544019550 ZWISLBQDTQPFFD-RBBKRZOGSA-N 441.620 4.169 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(Br)ccc1C1CC1 1544630793 STEONGHHRMCCHW-UHFFFAOYSA-N 447.348 4.357 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(F)cn1 1555475687 ZEUQNVQUVYBFRS-UHFFFAOYSA-N 448.546 4.408 10 10 IICE CCCCN(CC(=O)Nc1ccc(I)cc1)Cc1ccccc1O 1559790397 RHCRCKRNKDGCPY-UHFFFAOYSA-N 438.309 4.238 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)cc1 1567851425 UPCQYYGWPCKEDQ-UHFFFAOYSA-N 448.538 4.184 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)cc2Cl)C1 1586081892 JYKINNBSAFBCLC-RDTXWAMCSA-N 429.923 4.458 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Br)s1 1595573537 RKDVSGBZNRMQEM-ZDUSSCGKSA-N 429.767 4.264 10 10 IICE CN(c1ccc(CNC(=O)c2cc(Br)cc(N)c2N)cc1)C1CCCCC1 1597951035 SALPBXYMXBZTMK-UHFFFAOYSA-N 431.378 4.312 10 10 IICE CCOC(=O)C[C@H]1CCN(C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)c2ccccc21 1616616651 UWSQDSZUMHPDKP-AEFFLSMTSA-N 428.529 4.074 10 10 IICE COc1ccc([C@H](OC)[C@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1624050447 GSNGPOILLIJVOV-HFJWLAOPSA-N 434.536 4.350 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)cc1 1627158921 KBSXEKYYXLEJAD-FQEVSTJZSA-N 431.536 4.172 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccccc3NC(=O)OCc3ccccc3)C2)cc1 1632612054 SHRYTCPKFNEJKP-HXUWFJFHSA-N 445.519 4.453 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@H](O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cn1 1635867983 OZIGXCFZSCUCBG-RBZFPXEDSA-N 446.320 4.243 10 10 IICE CCN(C)c1ccc(CN2CCC([C@H]3OCCC[C@H]3NC(=O)OC(C)(C)C)CC2)cc1 1658889616 MZUNTTUQAPHTGC-DHIUTWEWSA-N 431.621 4.427 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CCCOc4cc(Cl)ccc43)CC2)cc1F 1670972395 HRVPMQLDYMPVPT-IBGZPJMESA-N 433.911 4.233 10 10 IICE Cc1cccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1682025049 ZNELMNMGKSYYDW-RXVVDRJESA-N 429.992 4.288 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(Br)c3Cl)C2)cc1 1683182870 KDYJOZSIOJJOPF-AWEZNQCLSA-N 438.753 4.189 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(Cc3ccccc3)C[C@H](O)c3ccccc3)C2)cc1 1683782683 SJBMOSLKMUYUKQ-OZXSUGGESA-N 445.563 4.219 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@H]2c3ccccc3C(=O)N2Cc2ccccc2)c1 1683996162 JQLFSKZXEYYVIC-GAJHUEQPSA-N 445.519 4.158 10 10 IICE CC[C@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC[C@@H]1c1ccccc1 1685328392 VHEHUGXBZQCSGY-OFVILXPXSA-N 448.611 4.114 10 10 IICE CCN(CC)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)c(F)c1 1695630278 YHPKROUCPVCNEQ-UHFFFAOYSA-N 435.345 4.135 10 10 IICE C[C@@H]1CCCN(CCCCn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)C1 1708085071 KAPPHXKCCMIIDX-OAQYLSRUSA-N 448.615 4.118 10 10 IICE C[C@H]1C[C@H](C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1726461026 SDIBCTIBDXFTGF-OALUTQOASA-N 443.611 4.373 10 10 IICE C[C@H]1CCCN1CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1726584756 FUJHAOVAXKPUSO-CZTZKLFOSA-N 441.620 4.023 10 10 IICE CCN(CC1CCC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1746266623 DNVPADSSLRIBBO-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCC(C)C)CCOC1 1746656567 QTNSKFZLWQGWFO-RUZDIDTESA-N 441.620 4.213 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@@H]1CCO[C@H](C)C1 1747030682 ZLQQKBMCMQNJOX-NHCUHLMSSA-N 441.620 4.256 10 10 IICE CCS[C@H]1CCCCN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1747498986 JCQGBRAJYUZEAI-IRLDBZIGSA-N 443.661 4.317 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccn2)cc1 1764937980 APVBJBDITQDZEU-QHCPKHFHSA-N 434.588 4.446 10 10 IICE CC[C@H](C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858596647 YDAVXLYUGDVGAD-KQWQSBQESA-N 432.336 4.289 10 10 IICE COC(=O)c1c(NC(=O)/C=C\C(=O)NCc2ccccc2)sc(C)c1-c1ccccc1 1866263928 JNANAMOEPUNZIS-YPKPFQOOSA-N 434.517 4.321 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)[C@H]1C1CC1 1886006836 OOVGPRASMTVRJA-HZPDHXFCSA-N 429.330 4.171 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)ccc1O 1951869209 QWKXHXHBGSGAFM-VWLOTQADSA-N 433.460 4.326 10 10 IICE CN1CCc2cc([C@H](O)C[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999508875 LXLXWIFYTYJDIG-FYYLOGMGSA-N 426.557 4.213 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@@H](N)c1ccc(N2CCCC2)cc1 2044760069 HMLKLUWDGGMTNC-ZEQRLZLVSA-N 438.616 4.312 10 10 IICE CCOC(=O)c1c(C(C)(C)C)nn([C@@H](C)c2ccc(OC)cc2O)c1Br 2080056647 WTVUZHWUBGSPBL-NSHDSACASA-N 425.323 4.443 10 10 IICE COc1ccc(Br)c(CN[C@@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236053892 BMLGOOCFYGQYKL-KBPBESRZSA-N 443.382 4.289 10 10 IICE CCOC(=O)c1ccc(NC=C2SC(=S)N(CCOc3ccccc3)C2=O)cc1 2296650868 XDWYSIRWWXNRDX-UHFFFAOYSA-N 428.535 4.056 10 10 IICE CCN(CC)c1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1 2297298188 VSWXYNCWQJKYMG-UHFFFAOYSA-N 425.579 4.387 10 10 IICE CCN1C(=O)C(=Cc2cn(CCCOc3ccc(C)cc3)c3ccccc23)C(=O)NC1=S 2313624060 LCIUAAOEBRVRJW-UHFFFAOYSA-N 447.560 4.065 10 10 IICE C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S 2314837860 XPZYBIXKJMXWAV-NSHDSACASA-N 447.925 4.477 10 10 IICE CN(C)c1ccc([C@@H](CNS(=O)(=O)CCc2ccccc2)N2CCc3ccccc32)cc1 15780717 YAOCWYMZVBCYRS-AREMUKBSSA-N 449.620 4.019 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1 18150737 IXSPNNKYRIGXOF-ISLYRVAYSA-N 449.576 4.437 10 10 IICE Cc1ccc(Oc2nccnc2N2CCC(C(=O)NCc3ccc(N(C)C)cc3)CC2)cc1 33141944 LPVRVHSPDVJWDS-UHFFFAOYSA-N 445.567 4.176 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccc(Cl)c(Cl)c4)c3N)CC2)cc1 40703987 FJCYSSZMUGUAPN-UHFFFAOYSA-N 445.354 4.444 10 10 IICE CCOC(=O)c1cccc(N2C(=O)/C(=C/c3ccc(OC)c(OC)c3)SC2=S)c1 40859646 OFWBXNTZUNRKKD-WQRHYEAKSA-N 429.519 4.286 10 10 IICE CC[C@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCCO1)c1cc(Br)ccc1O 390650088 VERGSUJZWHIQFJ-WBVHZDCISA-N 443.382 4.221 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526328404 OKAXZIILUYGMFO-JOCHJYFZSA-N 437.423 4.311 10 10 IICE O=C(NCCc1c[nH]c2cc(F)ccc12)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745785948 FMLVJLJZOOJLKM-QGZVFWFLSA-N 446.473 4.419 10 10 IICE Oc1cc(OCc2ccccc2)ccc1CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 753569232 GWOLCSRQAGRRBD-QFIPXVFZSA-N 444.510 4.473 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(c2ccccn2)CC1 754352504 WYNIRQVTWYHUTF-QGZVFWFLSA-N 439.515 4.064 10 10 IICE C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C)c1ccc(N2CCOCC2)cc1Cl 762642236 KYCIFXOESDTJGZ-XGHQBKJUSA-N 438.012 4.473 10 10 IICE COC(=O)N(C)Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 766692076 MSBMUEXVVLAAKL-UHFFFAOYSA-N 448.567 4.245 10 10 IICE Cc1csc(C2(N[C@@H](C)C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CCC2)n1 778129501 YLZMNOMJPNGYDT-HNNXBMFYSA-N 445.544 4.223 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc([C@H]4CCCOC4)cc3)cc2F)C[C@@H](C)O1 779857983 STPXDFOICMBCFB-HMFYCAOWSA-N 426.532 4.263 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cnc(CC2CC2)nc1 791325603 NUFMXCFKBWQHKB-MHWRWJLKSA-N 444.607 4.111 10 10 IICE CO[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)n1 799995567 OODLGMUAUVGJST-CABCVRRESA-N 435.956 4.008 10 10 IICE Cc1cc(CCNC(=O)CCCNC(=O)OCc2ccccc2)c(C)n1-c1ccccc1 1131781589 FSBFWUMHMHXZFP-UHFFFAOYSA-N 433.552 4.459 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H](c1ccccn1)C1CC1 1133947817 ZCBTYRIHRIBMAP-LYDJUCFBSA-N 443.619 4.392 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1ccc(C(F)(F)F)cc1 1137816890 UVRBOVYIHLSCER-GFCCVEGCSA-N 445.821 4.034 10 10 IICE CC(=O)Nc1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1Cl 1142197313 FDKRRMVBNHPRLU-UHFFFAOYSA-N 426.948 4.083 10 10 IICE O=C1[C@H](N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)CCN1CC(F)(F)F 1167680548 IBIFAKKDJHLMBP-BQHGXPCASA-N 432.442 4.141 10 10 IICE C[C@@H](c1cc(F)ccc1F)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1190382532 IXQKBUCRLDQXAP-AWEZNQCLSA-N 434.442 4.372 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CC[C@H](C)N(C(=O)OC(C)(C)C)C1 1230200613 LEDAJVFHIXDDGX-BJLQDIEVSA-N 432.609 4.079 10 10 IICE CCCCN(CC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1294243179 VTLDOWOECFKGJW-JOCHJYFZSA-N 427.593 4.031 10 10 IICE O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)O1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860037 PRFOEOBPNQVKMZ-RYRKJORJSA-N 434.886 4.016 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CO)c2ccc(C(F)(F)F)cc2)c1 1295918701 OBHPFDMTXKFYSZ-OAQYLSRUSA-N 430.426 4.389 10 10 IICE COC[C@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1301276047 AQGCUKKDCISKHC-FQEVSTJZSA-N 429.584 4.127 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)CCc1cn(C)nn1 1306451435 MKNUDJUCHVXZSW-IBGZPJMESA-N 431.462 4.059 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC)c(OC)c2)sc2c1CC[C@H](C)C2 1307441889 FKAJZLCIIOYPTM-AWEZNQCLSA-N 446.569 4.142 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C 1312805407 IKLNBBJEOOLDQX-CJFMBICVSA-N 440.632 4.381 10 10 IICE COc1ccc2c(c1)[C@H](C(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)CCC2 1357836118 NNZXBOXSYQGDHL-XGHQBKJUSA-N 426.532 4.184 10 10 IICE CN(C)c1ccc(CN(C(=O)COCCc2ccc(Br)cc2)C2CC2)cc1 1358205434 IJPRGRTVIUDXPD-UHFFFAOYSA-N 431.374 4.265 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H]2c2cnn(C)c2)n1CCCSc1nccs1 1359838637 FWXKWHVNKQKLRK-QGZVFWFLSA-N 431.635 4.191 10 10 IICE COc1nc(C)c(Br)cc1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1440686067 XVLUJDSAMHFESY-UHFFFAOYSA-N 432.362 4.424 10 10 IICE Cc1ccc(C(=O)NCCNc2ncnc3sccc23)cc1-n1c(C)cc(C=O)c1C 1452492176 ADYCUDNTRLJPEK-UHFFFAOYSA-N 433.537 4.062 10 10 IICE Cc1cc(CC(=O)N[C@H](C)c2nc(C(F)(F)F)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1456380063 FVUCCDSLOSBSIL-LLVKDONJSA-N 425.842 4.304 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1457193863 JWCWHVMWKCIPIU-CQSZACIVSA-N 434.558 4.470 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCCc3ccccc3Br)C2)cc1 1461075340 FFCALGFTEVDWKZ-QGZVFWFLSA-N 431.374 4.423 10 10 IICE CC(=O)c1cc(Br)ccc1OCC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1463812537 KSQCIPMNZGMANM-UHFFFAOYSA-N 445.357 4.289 10 10 IICE COc1cccc(N(CC(=O)NCc2ccc3cccnc3c2O)C(=O)OC(C)(C)C)c1 1469247507 ASDKCUYWFVPOBQ-UHFFFAOYSA-N 437.496 4.007 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)c(OC)c1 1470858889 PBBLGUULPRTURD-UHFFFAOYSA-N 433.552 4.382 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cc(I)cn3)c2C)c1 1472993645 CVUYFQNKNGOVGX-UHFFFAOYSA-N 433.293 4.395 10 10 IICE CN(C)c1ccc(Cn2c(N3CCOC[C@H](C4CCC4)C3)nnc2C(C)(C)C)cc1F 1503394041 VMRUIWVSOVFHLG-LJQANCHMSA-N 429.584 4.082 10 10 IICE CC[C@@H]1C(=O)NCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(C)C 1513970184 IHVBDXZJTMZHDA-JOCHJYFZSA-N 434.588 4.114 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(OC(F)F)cc3F)cc2F)C[C@@H](C)O1 1516809319 AUWJDMPKFQNLSD-CHWSQXEVSA-N 426.410 4.110 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1CCCCC1(F)F 1526958705 HBFYGWVKTBNLRV-HNDQUVLASA-N 442.528 4.359 10 10 IICE C[C@H](NC(=O)C(F)(F)c1ccccc1Br)c1ccc(N2CCOCC2)cc1 1528554959 PZRKZEDKOKMSSN-AWEZNQCLSA-N 439.300 4.255 10 10 IICE Cc1nc(-c2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)s2)cs1 1535345502 AFQGODNITAKZSM-UHFFFAOYSA-N 435.521 4.225 10 10 IICE O=C(NCCCCc1ccccc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1539682727 RBYLLDFKQUSGNM-UHFFFAOYSA-N 430.551 4.007 10 10 IICE Cc1nnc(N2CCO[C@@H](c3ccc(Cl)cc3)C2)n1CCCSc1nccs1 1543344610 ZWELCGPENCFJTB-QGZVFWFLSA-N 436.006 4.457 10 10 IICE Cc1cc(CNC(=O)CSCC(=O)N(C)C2CCCCC2)c(C)n1-c1ccccc1 1544080213 KZQHKAFPABWSBD-UHFFFAOYSA-N 427.614 4.235 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCc2cc(Br)ccc21 1544410142 YDNMEUVWNKLYPS-HXUWFJFHSA-N 431.399 4.349 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](OC)CC[C@H]2C)sc(C)c1-c1ccccc1 1560063966 PQRXTGYETSFDBC-QAPCUYQASA-N 430.570 4.338 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@@H]1c1nnc([C@H]2CCCO2)o1 1564946468 PZZYJAZSVDZYFP-DUXKGJEZSA-N 441.576 4.163 10 10 IICE CCOc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1OCC 1566356431 DTKDXDQUVRDPAW-LJQANCHMSA-N 432.948 4.237 10 10 IICE Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1-n1c(C)cc(C=O)c1C 1567294472 BSIVKMOOUZFJCP-DFBJGRDBSA-N 429.564 4.465 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(CCO)Cc2cnn(Cc3ccccc3)c2)c1C 1596488771 ZSZLSAXPXDFUFR-UHFFFAOYSA-N 442.563 4.282 10 10 IICE CC(C)COc1ccc(C2(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)CCC2)cc1 1598277047 JZDLOOLTSLOIOV-UHFFFAOYSA-N 435.612 4.211 10 10 IICE CC(C)[C@@H]1OCCC[C@H]1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1603172451 WBDWWNGZAZJDIF-RDPSFJRHSA-N 435.572 4.057 10 10 IICE CCc1cccc(OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1618253982 VDKHAOZCGSKJTH-JOCHJYFZSA-N 441.572 4.076 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CSc2cccc(Br)c2)N(C)C)cc1 1618641622 BYTVYMIXDAGCMR-LJQANCHMSA-N 436.419 4.026 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc(-c3csc(N4CCOCC4)n3)cc2)cc1 1618725413 BHARQTCSYFEUDR-UHFFFAOYSA-N 436.497 4.061 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H](OC)C(C)(C)C)CC2)cc1 1619301691 VCFJTFIEPQYHQL-NRFANRHFSA-N 443.636 4.362 10 10 IICE Brc1cnc(NCc2ccc(N3CCCCC3)cc2)cc1N1CCOCC1 1620972081 KJMAKSQDJIAQIY-UHFFFAOYSA-N 431.378 4.283 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C3)c2C)c1 1621985030 OGSJEDIIRDEPID-XMSQKQJNSA-N 441.572 4.157 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CC(=O)N(c2ccc(C)c(C)c2)C1 1629968263 CRRSAHNVUHEIHJ-QGZVFWFLSA-N 445.357 4.173 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C[C@@](O)(c2nc3ccccc3s2)C(F)(F)F)c1 1630366877 YOSFNQLFPSABEG-NSPYISDASA-N 440.443 4.028 10 10 IICE C/C=C\C[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C(=O)OCC 1632607447 LZWCJNNWHQWUNF-WPGJWXSHSA-N 433.346 4.484 10 10 IICE CCOc1ccc(C(=O)N(C)C)cc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1634995238 WHABVZVAFZVBRZ-UHFFFAOYSA-N 447.535 4.188 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@@H](c3cccc(F)c3)C2(C)C)N(C)C)cc1 1638918447 VHOPJRUBFWQUOB-XZOQPEGZSA-N 426.580 4.472 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@H](CNc4ccc(Cl)cc4)C3)C2)cc1 1683787770 QDUMHRAUTDJTHV-GHTZIAJQSA-N 442.991 4.461 10 10 IICE CC(C)(C)c1nnc(N2CC=C(C(F)(F)F)CC2)n1Cc1ccc(N2CCOCC2)cc1 1691057475 VFUZVAVACMFTME-UHFFFAOYSA-N 449.521 4.159 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCC[C@@H](C(F)F)C1 1693005371 HMMQFQSOKRSPSA-HXUWFJFHSA-N 440.542 4.168 10 10 IICE C[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1693674135 JEMFVMUVNPTXRD-IBGZPJMESA-N 425.621 4.069 10 10 IICE CCCCn1cc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)c(C)n1 1709636335 IIDLHFLPLIXCFW-QFIPXVFZSA-N 438.576 4.215 10 10 IICE CSCCCN(C)c1nnc(-c2ccc(C)o2)n1Cc1ccc2c(c1)CCCN2C 1712817434 WMKQCWMZCYZAEE-UHFFFAOYSA-N 425.602 4.467 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H](Oc3ccccn3)C2)cc1 1728383739 YXUQMKZZBKMNER-QHCPKHFHSA-N 448.615 4.424 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC=CO1 1743723453 FKQDCXPTGQJGEF-UGKGYDQZSA-N 425.577 4.210 10 10 IICE CC(C)N(CCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)C(C)C 1761180141 SBVNEOXUOFXZIK-JOCHJYFZSA-N 429.609 4.371 10 10 IICE CN(CCC(F)(F)F)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1768828981 AJFJKDZGPKTPDT-UHFFFAOYSA-N 428.509 4.368 10 10 IICE COc1ccc(CN2C(=O)C(NC(C)C)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)cc1 1873166793 HGXPKFKAUCZDRX-UHFFFAOYSA-N 443.547 4.381 10 10 IICE COc1ccc(C2(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CCOCC2)cc1 1874179194 SQFAFEWUTNPVGD-UHFFFAOYSA-N 441.483 4.158 10 10 IICE COc1ncc(C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c(C)c1Br 1891133204 UOEZEPGRVFZZLS-RDJZCZTQSA-N 430.346 4.080 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)CC(NCc1cc(Br)ccc1O)C2 1913376568 WEBUZGKMLZZSCI-UHFFFAOYSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@@H]2NCc2cccc(Br)c2O)C1 1918886958 BKBFCRMPGMZYOX-JXFKEZNVSA-N 425.367 4.424 10 10 IICE Cc1ccc(O)c(CNC2(CNC(=O)OC(C)(C)C)CCN(Cc3ccccc3)CC2)c1 2067209959 HTACGAQSMATCTB-UHFFFAOYSA-N 439.600 4.350 10 10 IICE COC(=O)c1cccc(-n2c(C)cc(C=C3NC(=O)N(Cc4ccc(F)cc4)C3=O)c2C)c1 2294037388 AAKHPVAZKAHYMX-UHFFFAOYSA-N 447.466 4.113 10 10 IICE C[C@@H](C(=O)N1CCCC[C@@H]1c1cccnc1)N1C(=O)C(=Cc2ccco2)SC1=S 2296303805 JOYYRXNCKHUNDT-WMLDXEAASA-N 427.551 4.018 10 10 IICE CCOCCCN1C(=O)C(=Cc2cc(Cl)cc(Br)c2O)SC1=S 2323791513 QDQDCWHWQTUKJR-UHFFFAOYSA-N 436.780 4.436 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC(NCc3cccc(Br)c3O)C[C@H](C2)C1 2339993235 XFOHGYJZJIEIOQ-KBPBESRZSA-N 425.367 4.280 10 10 IICE CC(C)c1ccc(N2C(=O)NC(=O)/C(=C\c3cc4c5c(c3)CCCN5CCC4)C2=O)cc1 2313856 RVVTTWVPYTWKPM-PXLXIMEGSA-N 429.520 4.175 10 10 IICE CC/C(NCCc1c[nH]cn1)=C1\C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 9972291 VUXVRWYWLUCPJO-DYTRJAOYSA-N 442.548 4.267 10 10 IICE COc1ccc(N2CCn3c(nc4ccccc43)C2)cc1NC(=O)COc1ccccc1 19855487 QURUNBOBAQZTAT-UHFFFAOYSA-N 428.492 4.083 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N(CCC)C1=O 33457851 JRAGEIXBNVCPMJ-SSZFMOIBSA-N 430.599 4.216 10 10 IICE CCCCCCN1C(=O)/C(=C/c2c(NCC)nc3ccc(C)cn3c2=O)SC1=S 33474137 BRRSVZVOAHLCGW-VBKFSLOCSA-N 430.599 4.216 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCCC(=O)O 210464209 RZNIYAMNWVOPSC-WQRHYEAKSA-N 447.509 4.484 10 10 IICE O=C(/C=C\c1c(F)cccc1F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 215559732 RLXWGYFVBDMHLG-SREVYHEPSA-N 426.385 4.150 10 10 IICE COc1cc(N2CCN(C(=O)c3ccc4c(c3)Cc3ccccc3-4)CC2)cc(OC)c1OC 759219723 CYIWUHBWNYCBMF-UHFFFAOYSA-N 444.531 4.246 10 10 IICE CC(C)(c1ccc(C(=O)Nc2cccc(N3CCS(=O)(=O)CC3)c2)cc1)C(F)(F)F 764798180 AXJSPAMDSWAKNO-UHFFFAOYSA-N 440.487 4.014 10 10 IICE COC(=O)[C@H](NCc1cc(Br)cc(OC)c1O)c1ccc2ccccc2c1 779177538 FDKLUHUSNCOIBY-LJQANCHMSA-N 430.298 4.320 10 10 IICE COc1ccc(O)c(CNC(=O)C[C@@H](NC(=O)OC(C)(C)C)c2cc(C)nc(Cl)c2)c1 788516836 SSIWYWQDWFPQQP-QGZVFWFLSA-N 449.935 4.030 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(N3C(=O)N[C@@H](C)C3=O)c2C)c1C 811538125 UJYNFOLUUYPXKW-KRWDZBQOSA-N 430.508 4.408 10 10 IICE CC(C)c1noc2ncc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cc12 916456751 POHVSVRGAHSWRG-UHFFFAOYSA-N 448.445 4.132 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H](c1ccc(Cl)cc1)C1CC1 918187229 ZTSUVVHSRBQGNZ-JOCHJYFZSA-N 431.939 4.391 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc(OC)c1O 1084454217 MEFOIUOTWIYHOH-LZYBPNLTSA-N 432.479 4.032 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)sc2c1CCCCC2 1125083594 AZFGTKPYPVHJOS-CQSZACIVSA-N 444.528 4.243 10 10 IICE Cc1nc(C(C)C)oc1CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1141412272 FEBRAODASFDOBY-YBEGLDIGSA-N 449.623 4.466 10 10 IICE Cc1ccc(C(=O)Nc2nc(-c3c[nH]c4ncc(Br)cc34)cs2)c(O)c1O 1147408549 ZWTTVFZIKFZDPV-UHFFFAOYSA-N 445.298 4.421 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnc(Br)c(C)c1 1149900425 OFSWVBXHLXWMKI-UHFFFAOYSA-N 428.124 4.283 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)/C=C/c1ccc(I)o1 1155704394 JYEZLMFUPKTYLK-PKNBQFBNSA-N 425.266 4.432 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(Cl)ccc1I 1157101614 BTAHKRKCFPCGBO-UHFFFAOYSA-N 436.673 4.066 10 10 IICE CCN1C(=O)C(C)(C)COc2cc(NC(=O)c3cc4cc(O)c(O)cc4s3)ccc21 1170155385 QCARSYJZFBKTMB-UHFFFAOYSA-N 426.494 4.336 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)N(C)Cc3c(F)cccc3Cl)CC2)cc1 1192412904 LYJPBDAZGZYWED-KRWDZBQOSA-N 433.955 4.047 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2CCN3S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1296183786 UCLJXRAVIDXORX-UHFFFAOYSA-N 443.956 4.322 10 10 IICE Cc1c(C(=O)NCc2ccc3cccnc3c2O)cnn1-c1cccc(Br)c1 1299721975 YAMJAMLTCDPUFJ-UHFFFAOYSA-N 437.297 4.127 10 10 IICE O=C(CCC(=O)NC(c1ccccc1)c1ccccc1)NCc1ccc2cccnc2c1O 1299726345 RXXVQSWNHUXILE-UHFFFAOYSA-N 439.515 4.243 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)c(F)c4)c3C)C2=O)o1 1307297518 CKGIPHOZOSLSLX-DEOSSOPVSA-N 437.471 4.093 10 10 IICE CSc1ccc([C@@H](CNC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)N(C)C)cc1 1312753593 OBIOXEALIBBONF-FDDCHVKYSA-N 428.646 4.316 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccc(C)cc3)C2)sc2c1CCCC2 1353914972 XBUOXPQUYMWSFN-QGZVFWFLSA-N 440.565 4.099 10 10 IICE Cc1cccc(F)c1CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1361101904 GMRXLLNNNMRCCS-WOJGMQOQSA-N 432.517 4.181 10 10 IICE CSc1ccccc1NC(=O)CN(C)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1463941852 ZYAHLTFQHOMFJZ-UHFFFAOYSA-N 449.576 4.268 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N(CC(C)C)c3ccc(C)cc3C)CC2)cc1 1469827788 OSOXLOQWANPGHZ-OUKQBFOZSA-N 449.595 4.206 10 10 IICE CC[C@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cccc(OC)c1OC 1471136732 YKERISUVUSMXSV-QUCCMNQESA-N 428.529 4.251 10 10 IICE Cc1cc(C(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)c(C)n1-c1ccc(F)cn1 1472968834 IYSPMJPGMBVBRD-UHFFFAOYSA-N 427.785 4.345 10 10 IICE CC[C@H](C)c1nnc(N2CCC(N(CC)CC)CC2)n1Cc1ccc(N(C)C)c(F)c1 1495463670 NRRCHPRAWJHWKL-SFHVURJKSA-N 430.616 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCC(F)(F)CC2)cc1 1501844501 UYBJSBJPFJOLOZ-UHFFFAOYSA-N 440.542 4.394 10 10 IICE CCC1(CC)CCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1513600864 XPFXUGUJGHOVRU-LJQANCHMSA-N 429.584 4.442 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(C)(C)C(C)C 1516568173 WKXBSNYFLHHLMC-UHFFFAOYSA-N 429.609 4.222 10 10 IICE Cc1cccc(C(=O)N2CCC[C@@H]2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 1534543502 XXMMIPWHOAUNRR-RUZDIDTESA-N 429.564 4.366 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 1542370953 LCQWVJOJYWQART-UHFFFAOYSA-N 433.552 4.344 10 10 IICE CN(c1ccc(CNC(=O)[C@H](C[C@@H]2COCCO2)C(F)(F)F)cc1)C1CCCCC1 1542412360 XRRFEMKNJFTPAQ-UXHICEINSA-N 428.495 4.056 10 10 IICE CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1544010909 AMQQMGZRWSOPDT-AVRDEDQJSA-N 437.584 4.372 10 10 IICE CC[C@@]1(C)CCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1546062051 JWKGKPLTLKNRSN-CLOONOSVSA-N 441.620 4.059 10 10 IICE O=C(C[C@H]1CSc2ccccc2O1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595584396 MZUKCNWAGUBPOG-ROUUACIJSA-N 432.973 4.070 10 10 IICE COc1ccccc1[C@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1595776982 KIGCTXRHJDPCMD-ITRAFESCSA-N 444.553 4.303 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2cccc(O)c2)c(C)n1-c1cccc(Cl)c1 1595800551 ZACVQAOYZMAVEF-UHFFFAOYSA-N 425.916 4.003 10 10 IICE Cc1cc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c(C)n1-c1ccc(C(C)C)cc1 1597246346 IDBVUADKKHHQGW-UHFFFAOYSA-N 440.565 4.236 10 10 IICE CC[C@@]1(C)CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1613691441 KDSBHWFIRPPRPA-VWLOTQADSA-N 425.621 4.285 10 10 IICE Cc1cc2c(c(Cl)n1)C(=O)N(CC(=O)c1cc(C)n(-c3ccc(C)c(F)c3)c1C)C2=O 1613774725 DECNVFJMZKSMLC-UHFFFAOYSA-N 439.874 4.377 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccccc4OC)CCCCC3)CC2)cc1F 1622579148 QVWIWTIYWGFGOS-UHFFFAOYSA-N 426.532 4.394 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2nn(-c3ccc(Cl)c(F)c3)c3c2CCC3)c1 1622778974 CXMUFFUGBZWHFD-LBPRGKRZSA-N 429.879 4.359 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H](NC(=O)OC(C)(C)C)C3(C)C)cc2)CC1 1628608492 FEFCKFBYUCPXMM-NHCUHLMSSA-N 429.605 4.479 10 10 IICE C[C@@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1630287894 NKIFRRDSHIQEBS-GGAORHGYSA-N 443.385 4.004 10 10 IICE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1630351474 RKLPZYJDAXQSHL-DEOSSOPVSA-N 449.661 4.433 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)cc1 1636538362 PVYYHUYQOFJUOW-JOCHJYFZSA-N 436.474 4.408 10 10 IICE CCCOc1c(Cl)cc(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cc1OC 1636702364 OVVBWTGWPRDRNH-UHFFFAOYSA-N 432.948 4.499 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)s1 1640238486 RWPLPEFVYDCHPB-DLBZAZTESA-N 439.585 4.210 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 1643394867 ZHGHNPHTGPOLTP-AUSIDOKSSA-N 443.950 4.305 10 10 IICE CCc1ccc(N2CCN(c3ccc(/C=C/C(=O)OC)cc3[N+](=O)[O-])CC2)cc1Cl 1651843009 IWODCVKLLWZAHT-WEVVVXLNSA-N 429.904 4.323 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@@H]3CCO[C@H](c4ccc(F)cc4)C3)C2)cc1 1673822770 HJSPAELTHTWAMA-XANCMCCPSA-N 441.547 4.222 10 10 IICE CC(C)NC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1680561321 BYPCYEIIIPLXTF-IEBWSBKVSA-N 435.012 4.023 10 10 IICE CCc1ccccc1[C@H](CNC(=O)NCc1c(O)cccc1F)NC(=O)OC(C)(C)C 1681720167 AUDBIJHAXHENTN-IBGZPJMESA-N 431.508 4.159 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](C)c3ccc(-n4cccn4)c(F)c3)CC2)cc1 1682659909 XYADEDCQOOXXOU-SFHVURJKSA-N 437.519 4.003 10 10 IICE CCN(c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1)[C@@H](C)C1CCC1 1695524717 CLISYYKYMBITBC-SFHVURJKSA-N 429.584 4.440 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@](C)(OC)C1CC1 1708507490 LQDYZWLHRPNUSE-UQBPGWFLSA-N 441.620 4.332 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)C[C@H]2CCCCO2)cc1 1728382883 QSGKBBPBORATLH-DHIUTWEWSA-N 441.620 4.420 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1728383039 RCNQVCKRFLJUCS-DENIHFKCSA-N 441.620 4.418 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1750280997 FHINYYXWAPDCII-IRLDBZIGSA-N 443.661 4.317 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1764937313 PYODNUGITSXBDT-XMMPIXPASA-N 448.615 4.020 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC=CCO1 1768106037 ZRMSTYFEYJYJET-JOCHJYFZSA-N 435.572 4.170 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC[C@H]1C 1770652608 NGHFUVWKRMFHAM-VGOFRKELSA-N 439.629 4.214 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(Cc4ccccc4C)n4ccccc34)CC2)cc1 1858349565 HKXJBBHIHIFXEX-UHFFFAOYSA-N 440.547 4.205 10 10 IICE COc1ccccc1N1CCN(/N=N/c2ccc(I)cc2C)CC1 1860486485 GXQWBKGWAWDSEP-QZQOTICOSA-N 436.297 4.429 10 10 IICE Cc1ccc2nc(-c3ccc(NC(=O)CCN4C(=O)CSC4=S)cc3)sc2c1 1865768679 OPJXGBNVPYEXTF-UHFFFAOYSA-N 427.576 4.461 10 10 IICE Cc1ccc2c(C)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(=O)oc2c1 1866294622 OEQCDNSKBHUHJF-HSZRJFAPSA-N 447.579 4.433 10 10 IICE COc1ccc(-c2ccc(C=C3SC(=S)N([C@@H](CCSC)C(=O)O)C3=O)o2)cc1 2041068685 FYNGJVBBJCJCFI-HNNXBMFYSA-N 449.575 4.363 10 10 IICE COc1cc(C=C2SC(=S)N(CC(=O)O)C2=O)ccc1OCc1ccc(Cl)cc1 2053466969 HUDLKZVIIXLCKO-UHFFFAOYSA-N 449.937 4.213 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1Br)C(=O)NCCCCN=[N+]=[N-] 2237422325 UKYUPMVBEHTBJM-HNNXBMFYSA-N 440.342 4.092 10 10 IICE COc1ccc(Br)c(CN[C@H](C)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1O 2271310714 GASPOEBEUJEQQJ-DOMZBBRYSA-N 429.355 4.041 10 10 IICE O=C(COc1ccc(C=C2SC(=S)N(Cc3ccco3)C2=O)cc1)N1CCCCC1 2314485833 DKUAZVMPDQYZRE-UHFFFAOYSA-N 442.562 4.072 10 10 IICE COC(=O)CCCN1C(=O)C(=Cc2cccc(OCc3ccccc3)c2)SC1=S 2314759338 BUKQPDITDZNQID-UHFFFAOYSA-N 427.547 4.420 10 10 IICE O=C(NN1C(=O)C(=Cc2c(Cl)cccc2Cl)SC1=S)c1ccc(O)cc1 2314926842 UBFPWEIESCUYKJ-UHFFFAOYSA-N 425.318 4.245 10 10 IICE COc1cc(N2C(=O)C(=Cc3c(C)nc4ccccn34)SC2=S)cc(OC)c1OC 2321738596 WYNXRDLBNCQYNY-UHFFFAOYSA-N 441.534 4.074 10 10 IICE Cc1ccc(C)c(-n2c(C)cc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1 20356351 RBDUYYSMYXCPBK-DMNVVODESA-N 446.580 4.383 10 10 IICE O=C(/C=C\c1ccc2ccc(Cl)cc2n1)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405662 ILBMBLQALBJRJD-VURMDHGXSA-N 439.918 4.318 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 757764040 PGCKETHQEAHQCL-LJQANCHMSA-N 427.980 4.146 10 10 IICE COC(=O)c1ccc([C@@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)C(F)(F)F)cc1 775214425 GQBSNJVPQOJISC-LJQANCHMSA-N 431.414 4.309 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccc(NC(=O)c2cccs2)cc1 804733747 MBKMQVMEDILTHF-UHFFFAOYSA-N 431.311 4.399 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C(F)F)nc2n1CCCC2 1126581491 GEPORKMRVGYLQR-ZDUSSCGKSA-N 440.441 4.157 10 10 IICE COc1cc(N2CCN(C(=O)c3cc(-c4ccccc4)oc3C)CC2)cc(OC)c1OC 1127931886 FKRFLJQIJMGWLA-UHFFFAOYSA-N 436.508 4.243 10 10 IICE CC[C@H](C)Oc1ccccc1/C=C/C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549033 BBRCMLHDIOIPMF-IJDCCNJMSA-N 430.495 4.308 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)c(C)cc3C)CC2)c(OC)c1 1131805195 YTTLKJWETNMZSB-UHFFFAOYSA-N 433.346 4.046 10 10 IICE CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1142627736 XBSIYCZBEBYSQX-AWEZNQCLSA-N 443.544 4.085 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCCCC[C@H]3NC(=O)OC(C)(C)C)C2)cc1 1146949802 HWMIFRLXFCVCBZ-YUXAGFNASA-N 445.604 4.254 10 10 IICE C[C@@H](NC(=O)c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1)c1ccccc1O 1151886025 RNFHQSGTQMEZHQ-CQSZACIVSA-N 430.913 4.337 10 10 IICE Cc1cc(C(=O)N[C@H]2Cc3cccc(O)c3C2)c(C)n1-c1ccc(Br)cc1 1154261557 BAUCGWZZHZMDFE-KRWDZBQOSA-N 425.326 4.459 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1157102944 SMUPHHMKIPFHOX-SFHVURJKSA-N 431.529 4.376 10 10 IICE Cc1cc(C(=O)N[C@H](c2ccccc2F)[C@@H](C)O)c(C)n1-c1ccc(Br)cn1 1164548324 FQBJIMWZHYHXTM-VLIAUNLRSA-N 446.320 4.243 10 10 IICE COC(=O)c1cnc([C@H]2CCCN(C(=O)c3sccc3-n3c(C)ccc3C)C2)s1 1168026042 MDQSGLKOWCKGNU-HNNXBMFYSA-N 429.567 4.419 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2ccc(Br)cn2)cc1 1235275059 BBVPMVCRJBMDNV-UHFFFAOYSA-N 443.345 4.415 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)cc1 1290324265 OTBCIXOCYQZWJO-RTWAWAEBSA-N 446.389 4.427 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)[C@H](c2ccccc2Cl)C1 1296954994 KQCCQDDYPDGTEX-SFHVURJKSA-N 446.931 4.114 10 10 IICE CO[C@@](C)(Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)C1CC1 1299506014 SBMPIXPDBDNEKB-QFIPXVFZSA-N 427.936 4.151 10 10 IICE O=C(N[C@H]1CCCC12CCCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1300770883 VJWORXMPBQTKLI-SFHVURJKSA-N 434.583 4.487 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)c(C)n1-c1ccccc1 1313101437 WLYRHEVJKCXIIF-QFIPXVFZSA-N 429.923 4.462 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)C1(C)C 1314257657 RYXQBHVHAOVINU-SFTDATJTSA-N 443.661 4.082 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359837185 ZYWQIYVORZBUJZ-DEOSSOPVSA-N 439.648 4.358 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)[C@H]([C@H]2CCCO2)C1 1439569218 MZNNQXGOOYDLEW-VOQZNFBZSA-N 444.959 4.320 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](c3ccccc3)C2)c(C)n1-c1ccc(Br)cn1 1440968212 PKFVMGBKHTUAAB-FQEVSTJZSA-N 440.341 4.465 10 10 IICE O=C(NCCCSc1nccs1)[C@@H](Cc1ccccc1)N1Cc2ccccc2C1=O 1443492219 RZHOMGAQRPEVHX-HXUWFJFHSA-N 437.590 4.009 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)CSc1nc2ccccc2nc1N1CCCC1 1465030997 PDPHRKDQJCAEDD-UHFFFAOYSA-N 435.597 4.013 10 10 IICE C[C@@H](NC(=O)c1cc(C2CCN(C(=O)OC(C)(C)C)CC2)no1)c1ccc(N(C)C)cc1 1467259228 GXQUFPZGVQXUKW-MRXNPFEDSA-N 442.560 4.346 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@](C)(CNC(=O)OC(C)(C)C)C1 1467426401 BMHOBMYZIBTPJE-RUZDIDTESA-N 439.556 4.284 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)cc1 1470218060 RPYXDNWHANUHGO-UZUQRXQVSA-N 438.568 4.275 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@]1(C)OCCc2ccccc21 1471190938 XAIDPHCPDRBBET-OAQYLSRUSA-N 433.346 4.174 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC(=O)N(C(C)(C)C)C3)cc2Cl)C1 1478528496 OYYYRBMIYUPLSI-SJLPKXTDSA-N 435.012 4.023 10 10 IICE CC(C)[C@@H](CCNC(=O)NCc1cc(Cl)cc(Cl)c1O)NC(=O)OC(C)(C)C 1479013650 VHXRJQSBPOHPLY-OAHLLOKOSA-N 434.364 4.438 10 10 IICE Cc1ccc(N2CCN(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1479099998 RCKHHWXEXQNVNG-UHFFFAOYSA-N 430.552 4.269 10 10 IICE C[C@@H]1SCCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)[C@H]1C 1494691639 XQTGYATYFURPOP-HOTGVXAUSA-N 446.671 4.233 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCN(CC(C)C)CC2)cc1 1501840083 YTNYXYMRLIIHNL-UHFFFAOYSA-N 447.631 4.013 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3(CNC(=O)OC(C)(C)C)CC3)cc2Cl)C1 1519549486 BFWLJENHAHGEBR-MRXNPFEDSA-N 435.996 4.497 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccnc(OC3CCCC3)c2)cc1 1540782094 YGFUQUAEGIMVIC-UHFFFAOYSA-N 431.536 4.482 10 10 IICE CCOC(=O)[C@@H](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)Cc1ccccc1 1544099874 PMDVYFCQCFQHPZ-JOCHJYFZSA-N 432.520 4.058 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H]1C 1564945998 WOEXRKYIOFVHOQ-GBESFXJTSA-N 432.609 4.031 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1c(F)ccc(SCC2CC2)c1F 1585536112 QUMRSNTYFVWKEB-UHFFFAOYSA-N 432.536 4.358 10 10 IICE Cc1cc(C(=O)NC[C@@]2(N3CCOCC3)CCSC2)c(C)n1-c1ccc(C(C)C)cc1 1597460724 YAAJPIPQVBCQNA-VWLOTQADSA-N 441.641 4.155 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4SC[C@@H]3C)cc2F)C[C@@H](C)O1 1615994934 NLGUFJBZSQOJKN-OKZBNKHCSA-N 443.588 4.056 10 10 IICE CCOCc1nnc(N2CCC[C@H]2Cc2cccs2)n1Cc1ccc(N(C)C)c(F)c1 1616891083 IHJGBTVGNONQRK-SFHVURJKSA-N 443.592 4.341 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1Cc1cccs1 1617893214 KOWIYQQRVRHHLY-UHFFFAOYSA-N 439.629 4.450 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nc(O)c2ccccc12 1625991295 NMMNUQMAGZJPAE-UHFFFAOYSA-N 445.441 4.034 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](c3ccco3)C2)c(C)n1-c1ccc(Br)cn1 1629619799 CNWWDRAFUOFNLT-SFHVURJKSA-N 430.302 4.058 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C[C@@](O)(c2nc3ccccc3s2)C(F)(F)F)c1 1630366876 YOSFNQLFPSABEG-JEOXALJRSA-N 440.443 4.028 10 10 IICE CCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1630595796 NKFCBAJRILXDGL-HSZRJFAPSA-N 435.955 4.451 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)COc2ccc(C(F)(F)F)cc2)cc1 1631607757 GGKYRGMOROSRGQ-NRFANRHFSA-N 436.474 4.358 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cc(Br)cc2c1OCCO2 1637134782 RBUJHKWQXKSYHS-UHFFFAOYSA-N 433.085 4.163 10 10 IICE Cc1cc(C(=O)N2CC[C@]3(CCCCN3C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1639034997 YWZGKRAZFKTKBG-RUZDIDTESA-N 438.572 4.495 10 10 IICE Cc1cc(C)c2c(c1)CCN(C(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)C2 1640893541 BVHVGLZSHJJLQC-UHFFFAOYSA-N 442.562 4.070 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C2CCCC2)[C@H](C)CO)sc(C)c1-c1ccccc1 1642726366 KNXYWYAIUTWKGP-MRXNPFEDSA-N 444.597 4.464 10 10 IICE C[C@H](NC(=O)CCNC(=O)OCC1c2ccccc2-c2ccccc21)c1ccccc1O 1648893640 ALLSEAQYACGTNP-KRWDZBQOSA-N 430.504 4.498 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(N(C)C)cc1 1681780223 ZEVZEUXHZFSEJZ-HOIFWPIMSA-N 426.536 4.004 10 10 IICE COc1cccc(CN(C[C@@H]2CCCO2)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c1 1683420919 AXXDXQUOYUCQLY-CPJSRVTESA-N 439.600 4.391 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H](N(C)C(=O)OC(C)(C)C)C1 1683421083 DOLWEPJENVTEDZ-GHTZIAJQSA-N 432.609 4.033 10 10 IICE COC(=O)c1cnc([C@@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)s1 1683479618 NNRQXSGRDNZOLD-OAHLLOKOSA-N 426.542 4.206 10 10 IICE CN(Cc1csc(Br)c1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1685682372 ZXNJWFAOPBHCRT-KRWDZBQOSA-N 439.423 4.021 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)NCc3cc(Cl)cc(Cl)c3O)C2)cc1C 1686234571 HEEMQYCQWFLUPP-HNNXBMFYSA-N 438.311 4.008 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCO[C@@H](C(C)(C)C)C1 1693006384 XRXYPMSIICXSON-FCHUYYIVSA-N 441.620 4.194 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](N3CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694100717 ZVYQHEVIIVLLIA-UYAOXDASSA-N 428.600 4.110 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(N)=O)C1 1694984789 XIESQACAZHLGPX-JUIXODQZSA-N 432.572 4.021 10 10 IICE CC[C@]1(C)CC[C@@H](Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)O1 1708829374 MMZCWANFULJXCU-WIOPSUGQSA-N 441.620 4.222 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(COC)CC1 1726798149 ATMKOVBRMIKPCT-SANMLTNESA-N 449.599 4.297 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)C[C@@H]2CC=CCC2)cc1F 1729329565 HJIOLGZFWBTELQ-HXUWFJFHSA-N 434.563 4.310 10 10 IICE CC1CCN(c2ccc(Cn3c([C@@H]4CCOC4)nnc3N(C)CCC(F)F)cc2)CC1 1743125063 DWJVVJQAYMIVPC-LJQANCHMSA-N 433.547 4.158 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCCO[C@H](C)C2)cc1 1746093552 QITVFRNKGRMTTO-DENIHFKCSA-N 427.593 4.029 10 10 IICE CCCOc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1[N+](=O)[O-] 1860398660 JMAIDVJROGCTOM-UHFFFAOYSA-N 430.416 4.411 10 10 IICE O=C(CCNCc1cc(Cl)cc(Br)c1O)Nc1cccc2cccnc12 1860715584 NVCJWKXEMFIEDW-UHFFFAOYSA-N 434.721 4.475 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CNC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)c1 1860908460 HGUKDPJMHBZTSA-CCEZHUSRSA-N 444.491 4.243 10 10 IICE COc1ccc(C2=NN(c3ccccn3)C(=O)/C2=C/c2ccc(Cl)c([N+](=O)[O-])c2)cc1 1865677179 WNLSZQBBLJJWMU-SFQUDFHCSA-N 434.839 4.486 10 10 IICE CCCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CCN(C)CC2)C1=O 1873164554 HEMVTCONFHNGHV-UHFFFAOYSA-N 448.611 4.048 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(F)cc1Br 1891634329 QAKJPHGWSPZASW-YOEHRIQHSA-N 439.350 4.055 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2010402517 RJXKHQGNMQJKPG-OALUTQOASA-N 431.537 4.036 10 10 IICE CN(C)C(=O)CN(Cc1ccccc1)c1ccc(CNC2CCC2)cc1Br 2240023585 JBMKGIGETGBLCW-UHFFFAOYSA-N 430.390 4.186 10 10 IICE Cc1ccc(OCCn2cc(C=C3C(=O)NN(c4ccccc4)C3=O)c3ccccc32)cc1 2293656505 NITBRSIPCGWGSJ-UHFFFAOYSA-N 437.499 4.490 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@H]1C[C@@H]2NCc1cc(Br)cc(F)c1O 2329598700 SWWOXFVOKLOKOW-KUDNYVPYSA-N 429.330 4.075 10 10 IICE Cc1ccc(CNC(=O)CCCCN(C)C(=O)OC(C)(C)C)c(O)c1Br 2352645792 NFGGSKMIUVWUEA-UHFFFAOYSA-N 429.355 4.117 10 10 IICE Cc1ccc(CNC[C@H]2C[C@](F)(CNC(=O)OC(C)(C)C)C2)c(O)c1Br 2352932874 SHLNAJBJHCXVNR-XVDXERDNSA-N 431.346 4.196 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N([C@@H](C)CC)C1=O 33723686 OHFHLJNFDUJCJD-DSDLTIFZSA-N 430.599 4.296 10 10 IICE Cn1cc(/C=C2/SC(=S)N(NC(=O)c3cccc(Cl)c3)C2=O)c2ccccc21 34737704 DFPQXESXYUVJLH-LICLKQGHSA-N 427.938 4.378 10 10 IICE O=C(CNC(=O)c1cccc(F)c1)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 96994829 BQTPDOFWMJZEFR-VWLOTQADSA-N 428.463 4.320 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 226789646 IPQSQFWUYLXWDV-GJLBYMJHSA-N 427.526 4.498 10 10 IICE COc1cccc(CNc2cc(Br)ccc2I)c1O 311648613 SHYPVWRQSSOBAW-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc(Cl)ccc2-n2cncn2)C1 435658571 ZUBRVRYIRBCFCH-UHFFFAOYSA-N 448.958 4.281 10 10 IICE O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1nc(-c2sccc2Br)cs1 727248303 OIYPMXBURKBFMC-UHFFFAOYSA-N 446.329 4.343 10 10 IICE C[C@H]1CN(Cc2cccc(NC(=S)NCCCN(C)c3ccccc3)c2)C[C@H](C)O1 737449819 PSZHQDZZZKCPRJ-PMACEKPBSA-N 426.630 4.109 10 10 IICE Cc1ccc(-n2nc(C)c(CC(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2C)cc1Cl 773742556 XKRWHYPLEMSXJZ-CQSZACIVSA-N 427.932 4.152 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Nc3ccc(C(C)=O)c(Cl)c3)cc2F)CC1 783129754 XYJPUTFJRITJJP-UHFFFAOYSA-N 432.927 4.145 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC(c3ccccc3F)C2)c([N+](=O)[O-])c1Br 812484940 CADGWNDIMFEQLN-UHFFFAOYSA-N 426.198 4.017 10 10 IICE COCCn1c(C)c(C)c2cc(-c3nc(C4(NC(=O)OC(C)(C)C)CC4)no3)ccc21 904998027 RQFCMCOAEXIOJF-UHFFFAOYSA-N 426.517 4.468 10 10 IICE C[C@@H](NC(=O)c1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccc(N2CCOCC2)cc1 920881356 NGNPKDHTSGPWEP-GOSISDBHSA-N 439.556 4.039 10 10 IICE COC(=O)c1csc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1137349441 TZPAKDZWEXKHEW-UHFFFAOYSA-N 434.315 4.352 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@]1(c2ccccc2)CCC(=O)NC1 1137816627 MVKVIWBZMKXQPS-HRFSGMKKSA-N 428.532 4.330 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1F 1150239392 GLVYVOJRYDXHQJ-PGRDOPGGSA-N 447.348 4.223 10 10 IICE CCCN(CCNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)C(=O)OC(C)(C)C 1152982114 JITNGWPVRSPLBU-UHFFFAOYSA-N 443.588 4.292 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 1154026585 NPQUJMXLVJLKHN-BVBHFADKSA-N 432.561 4.103 10 10 IICE C[C@@]1(NC(=O)C(F)(F)F)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1175577206 HQLGEFYHJJMDBW-HXUWFJFHSA-N 433.434 4.183 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3C(=O)NC(C)(C)C)cc2Cl)C1 1227208684 PPMIDTPVKILPFD-JXFKEZNVSA-N 435.012 4.165 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N2CCOc3c(F)ccc(F)c32)C1 1278346246 WVFJTUSVSJDJBS-UHFFFAOYSA-N 430.451 4.297 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(c2ccc(I)cc2)CC1 1292179622 XEFMDEYRSGDGBK-UHFFFAOYSA-N 448.348 4.438 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2COc3ccc(Cl)cc3C2)cc1 1292381721 HSGAGZPDUCGMSU-UGKGYDQZSA-N 428.960 4.165 10 10 IICE COC1([C@H](C)NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCOCC1 1299523854 LDWTUGSEEXDGJN-INIZCTEOSA-N 435.362 4.171 10 10 IICE CC(C)c1nnc(N2CCN(c3cccs3)CC2)n1CCCSc1nccs1 1302683638 YLSIUPCHDILXGS-UHFFFAOYSA-N 434.660 4.429 10 10 IICE CC(C)Cc1nnc(N2CCCN(C(C)(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1302934391 XGDAWUPWZQUNDF-UHFFFAOYSA-N 430.616 4.041 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCSc2nc3ccccc3s2)N(C)C)cc1 1304768387 LEKZXFBZJJKZSG-LJQANCHMSA-N 428.627 4.264 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)N(C)C)cc1 1313419943 WGQQAPRUFHIJDD-PXDATVDWSA-N 433.600 4.426 10 10 IICE CC(C)COCCCn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1360074364 OKZSKMBVOWTLGC-UHFFFAOYSA-N 443.636 4.111 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(N(C)C)c3ccccc3n2)cc1 1442619718 SUISXGBNWJFFMW-OAQYLSRUSA-N 432.568 4.188 10 10 IICE O=C(/C=C\c1nc2ccccc2s1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880099 FNKKMPLRXDZTFQ-IBSYWUHOSA-N 427.957 4.449 10 10 IICE COc1cc(OC)cc(N2CC[C@H](CNC(=O)c3sccc3-n3c(C)ccc3C)C2)c1 1446085332 HUAKYNIGSHOERL-GOSISDBHSA-N 439.581 4.429 10 10 IICE Cc1ccc(C)c(C(=O)c2ccccc2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 1464308345 NBUMLKWNMUTPNT-UHFFFAOYSA-N 446.522 4.440 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@@]12CCN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1472010724 VPRCZSZHPBEKLC-QFIPXVFZSA-N 432.542 4.318 10 10 IICE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCCC2)cc1)C1CCN(C(=O)OC(C)(C)C)CC1 1479136153 VQCPUVWPFLNPQS-LJQANCHMSA-N 444.620 4.464 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)cc1 1516598896 HOYFANYRTBATDK-IBGZPJMESA-N 447.501 4.217 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1CCCC1CCCC1 1519411322 FPYDVBCXIGAQKR-UNMCSNQZSA-N 428.577 4.315 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(O[C@H]4CCOC4)c3)cc2Cl)C1 1524256030 QCTKSWPXOUSTGX-LPHOPBHVSA-N 429.948 4.069 10 10 IICE CC(=O)Nc1ccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(F)c1F 1525702862 YDIOUDRKLRJWHO-UHFFFAOYSA-N 441.478 4.250 10 10 IICE COCC1CCC(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 1528456057 UZGNRSVPPFQJEN-SFQUDFHCSA-N 438.640 4.051 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1541441951 GBQZPSLNYSCOHW-NRFANRHFSA-N 425.621 4.234 10 10 IICE Cn1nc(C(F)(F)F)c2cc(C(=O)N(Cc3ccco3)Cc3ccccc3O)cnc21 1545496692 WGBKLWUSRZEXOX-UHFFFAOYSA-N 430.386 4.128 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](C2CC2)N(C)Cc2ccccc2)cc1 1567881790 VBNRQRJXDRGZDS-HHHXNRCGSA-N 443.591 4.476 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)/C(F)=C/c1ccc(F)c(C(F)(F)F)c1 1596695375 RQGFVHHWYGYBQK-ZDLGFXPLSA-N 444.375 4.447 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)c2ccsc2)N(C)C)cc1 1603556537 YXBCXYVTVVJOSN-JOCHJYFZSA-N 436.581 4.099 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2CCC2CC2)c(C)n1-c1ccccc1 1611934493 KNLPFEONNQWWBG-UHFFFAOYSA-N 448.615 4.361 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2COC(=O)N2CCC(C)CC2)c(C)n1-c1ccccn1 1627096527 JXYDITLJVATSHA-NRFANRHFSA-N 438.572 4.352 10 10 IICE COc1ccc(Cl)cc1[C@@H](O)CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1627482541 IIAFITUYPULAKJ-QFIPXVFZSA-N 440.927 4.340 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1F 1635889802 FFXZXMJIWCWQIX-UHFFFAOYSA-N 435.499 4.017 10 10 IICE Cc1cc(C(=O)NC[C@@H](CCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1636138694 UNSYCFDYZWUDDS-GOSISDBHSA-N 442.357 4.148 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCSc3c(C)[nH]c4ccccc34)C2)cc1 1636353975 NIXFSVFLCRZEEM-SFHVURJKSA-N 438.597 4.403 10 10 IICE Cc1cc(C(=O)N[C@H]2CON(C(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(C(C)C)c1 1636613351 ITLQOTQQCVYHDT-LJQANCHMSA-N 427.545 4.498 10 10 IICE COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1639551449 PDYFPAZPOLTGAM-AWEZNQCLSA-N 435.427 4.372 10 10 IICE COC(=O)/C=C\c1ccc(N2Cc3cc(Br)ccc3C[C@H]2C)c([N+](=O)[O-])c1 1642548717 WRTPUJCCOONCPB-IBSXUBTNSA-N 431.286 4.495 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@H](S(=O)(=O)c3ccccc3)C2)c(C)n1-c1ccc(Cl)cc1 1643881357 NDZSTGNCGJBSEH-XGAFWQRZSA-N 442.968 4.482 10 10 IICE CCc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1O 1645936978 IAAHTTCNNSIKER-ATVHPVEESA-N 430.526 4.324 10 10 IICE COc1ccc([C@@H](CNC(=O)CSc2ncc(Cl)s2)N2CCCCC2)cc1 1652126490 GCQNGSRCSVEDCT-MRXNPFEDSA-N 426.007 4.241 10 10 IICE Cc1cc(CNC(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1 1684479042 QQVMPDUWRAKAHG-GOSISDBHSA-N 439.581 4.400 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(N)=O)C1 1694984793 XIESQACAZHLGPX-MVHVFESUSA-N 432.572 4.021 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2scnc2C)cc1 1695624958 LWDJBQRRRKNIER-IBGZPJMESA-N 440.617 4.078 10 10 IICE CN(C)C(=O)C1(Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CCCC1 1696574250 QJNWLZNCOIMWON-UHFFFAOYSA-N 439.604 4.001 10 10 IICE CN(CC1CC(F)C1)c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1696734978 APHYGAUXEIAISW-UHFFFAOYSA-N 432.594 4.087 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1)OC 1727243605 ZKJWJYPYDONZJG-OAQYLSRUSA-N 434.544 4.402 10 10 IICE CCc1nc(CCn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)no1 1764634434 GSSITLGOJCIGGV-UHFFFAOYSA-N 437.592 4.000 10 10 IICE Cc1ccc(O)c([C@@H](c2sc3nc(C4CCCCC4)nn3c2O)N(C)CCC(=O)O)c1 1857927674 KBMNVHOQSRNRDM-SFHVURJKSA-N 444.557 4.054 10 10 IICE CCn1cc(OCC(=O)NC(C)C)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1870944248 AQELQYNXVFROES-UHFFFAOYSA-N 434.540 4.127 10 10 IICE O=C1Nc2cc(N(CCC(F)(F)F)Cc3ccccc3)c(Br)cc2[C@H]1O 2095871781 IQJGJMOMGNXAQA-MRXNPFEDSA-N 429.236 4.394 10 10 IICE C[C@@H](NCc1cccc(Br)c1O)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116250439 GXUXWECRDQAGHZ-WBMJQRKESA-N 425.323 4.492 10 10 IICE COc1ccc(Br)c(CNCCCN(C(=O)OC(C)(C)C)C2CC2)c1O 2227749881 VYTFJDSLDADDBI-UHFFFAOYSA-N 429.355 4.043 10 10 IICE CSc1ncc(CNC(=O)c2cc(Br)sc2Br)s1 2257100395 KREGZNJQNZTCOY-UHFFFAOYSA-N 428.196 4.382 10 10 IICE CCCN1N=C(c2ccc(OC)cc2)C(=Cc2cc(Br)c(O)c(OC)c2)C1=O 2332107486 IMBJWTICFFYXLP-UHFFFAOYSA-N 445.313 4.212 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cc(C)cc(C)c3)C2)sc2c1CCCC2 11356143 AZJOYUZDUZLYKK-MRXNPFEDSA-N 440.565 4.412 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@H](C)C(=O)O)C2=O)ccc1OCc1ccc(C)cc1 33633608 HZWOAPJQURMERP-HIPSJFSSSA-N 443.546 4.257 10 10 IICE Cc1cc(/C=C/C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)c(C)n1-c1ccccc1 109511465 SEUBLMQGGQFVGR-OUKQBFOZSA-N 431.540 4.001 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cc(F)ccc3F)[C@H]2c2ccc(O)c(O)c2)c1 526559397 AZDMSWXOFCELPT-NRFANRHFSA-N 425.387 4.442 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 733974877 NRYNLONQQRTPFD-QYZOEREBSA-N 429.611 4.215 10 10 IICE COc1cc(N2CCN(C(=O)c3sccc3SC(F)F)CC2)cc(OC)c1OC 759240973 FMLPCCRIGSYHNI-UHFFFAOYSA-N 444.525 4.051 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCC(C)(C)C2OCC(C)(C)CO2)C1 774141815 LJOOGGWCOIAUQX-UHFFFAOYSA-N 442.600 4.376 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)cc1 777807075 BQLGYLKFMBUEKU-NRFANRHFSA-N 436.600 4.241 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccc(C(C)=O)cc3)C2=O)cc2c1OCCO2 814292015 JFQMKJWQODVIIP-WQRHYEAKSA-N 427.503 4.075 10 10 IICE COC(=O)/C=C\c1ccc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c([N+](=O)[O-])c1 917087285 WNQTTZSARQSLAK-OCLYVHKGSA-N 443.475 4.146 10 10 IICE CC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1F 1144162604 QZAJUYBLZSIRBL-QGZVFWFLSA-N 434.514 4.275 10 10 IICE C[C@@H](Sc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1148701467 ZFCAOPLZQVZSHZ-OAHLLOKOSA-N 449.414 4.207 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ccc(OC)cc1I 1149880848 WIZKWUHPJQHNNF-UHFFFAOYSA-N 425.266 4.058 10 10 IICE Oc1ccccc1CN(Cc1cn(-c2ccc(Cl)c(Cl)c2)nn1)C[C@H]1CCCO1 1192011287 AIZOXOODMCEXCJ-GOSISDBHSA-N 433.339 4.461 10 10 IICE CCCNC(=O)OC[C@H]1CCCCN1C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1271709180 VYLQKZZEGZGZMT-GOSISDBHSA-N 441.572 4.046 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccc(F)cc1 1293846245 PNERUVONCFIQAB-CLOONOSVSA-N 435.543 4.253 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)CC2CCOCC2)cc1 1295414509 ZLHCWVQTGHFIKA-UHFFFAOYSA-N 434.588 4.097 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cn3ccccc3n2)n1CCCC(F)(F)F 1298365601 YKRYKDBVVLHWGN-UHFFFAOYSA-N 444.461 4.201 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H](c2ccccc2)[C@H](O)c2ccccc2)N(C)C)cc1 1313409258 BCDJRHJZYNODRR-KKUQBAQOSA-N 446.595 4.129 10 10 IICE CC(C)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1434908140 AXNNIIFNRQJYIJ-NQIIRXRSSA-N 447.620 4.276 10 10 IICE COc1ccc([C@H](NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)cc1 1459861668 JGPGNVRNZDXQKA-RUZDIDTESA-N 442.515 4.396 10 10 IICE COc1ccc(CN(Cc2ccc(N3CCC(OC)CC3)cc2)[C@H](CO)C(C)C)cc1 1459866160 PTMOWPDJHIRCHX-AREMUKBSSA-N 426.601 4.330 10 10 IICE COc1ccc(CN2CCCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1466667967 DPWVKJRIORWDAC-UHFFFAOYSA-N 445.563 4.286 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(N(C)C(=O)OC(C)(C)C)s3)C2)cc1 1469281156 ZDHIUFMOFMKMKQ-MRXNPFEDSA-N 445.585 4.384 10 10 IICE O=C(Cc1ccc(Br)c([N+](=O)[O-])c1)NCc1ccc(N2CCCCC2)cc1 1469303517 RMLQYWKMNULYMX-UHFFFAOYSA-N 432.318 4.207 10 10 IICE CCN1CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C[C@@H]1C 1515920266 JLTDHTWHNORBBG-INIZCTEOSA-N 448.687 4.100 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1516400950 GOMSYECGKAVGPG-KNQAVFIVSA-N 443.661 4.398 10 10 IICE COc1ccc(N2CCN(C(=O)c3cn(-c4ccccc4)nc3C(C)(C)C)CC2)c(OC)c1 1530967399 BPTQLEJCKDDEAT-UHFFFAOYSA-N 448.567 4.149 10 10 IICE O=C(N[C@@H](C(=O)Nc1ccc(Br)cc1F)c1ccccc1)c1cc(O)cs1 1544900414 UAKLMSNDPWDDAF-QGZVFWFLSA-N 449.301 4.465 10 10 IICE C[C@@H]1CCCN(c2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccn2)C1 1545632481 NEZGLHQDCOFJBY-DYESRHJHSA-N 442.991 4.071 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)CCS1 1546761225 RWXJOLBFGVJRSY-KRWDZBQOSA-N 446.671 4.235 10 10 IICE CCO[C@@]1(c2nnc(N3CC[C@H](CC)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1547892600 KUVAMMCBYRIVDN-CPJSRVTESA-N 441.620 4.061 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccsc4)C3=O)c2C)c1 1559366918 QMRSIACITPEBLY-DEOSSOPVSA-N 435.549 4.422 10 10 IICE Brc1cc(CNCc2n[nH]cc2Br)ccc1N1CCCCC1 1560349812 XHVJLRVXRNFTLV-UHFFFAOYSA-N 428.172 4.215 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@](C)(O)c3ccc(F)cc3)cc2Cl)C1 1564650428 WTEYRHLFVAPVFU-HJPURHCSSA-N 433.955 4.422 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](CC(C)C)N2Cc3ccccc3C2=O)cc1F 1565688235 OOOXDEKITKDKTF-HSZRJFAPSA-N 425.548 4.359 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H](C2CC2)C2(CO)CCOCC2)cc1 1570873697 SDADTJBSLPUXLV-QHCPKHFHSA-N 436.556 4.466 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCSC2(CC(C(=O)NCc3cc(Cl)ccc3O)C2)C1 1583820589 IPAJFEQLGHXYOU-JERHATOGSA-N 440.993 4.231 10 10 IICE COCCN(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CCOCC1 1588137829 PPZQSVVGUQTOLU-UHFFFAOYSA-N 435.362 4.124 10 10 IICE Cc1cc(C(=O)NCc2ncc(Cl)s2)c(C)n1-c1ccc(Br)cn1 1594693477 FLDDQFOREAIDPV-UHFFFAOYSA-N 425.739 4.292 10 10 IICE COc1ccccc1[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1nccn1C 1624897222 QNMYASQLWASMIZ-VWLOTQADSA-N 428.536 4.285 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1 1625223423 QWRPFVYGMKNALA-IBGZPJMESA-N 439.581 4.144 10 10 IICE CCOC(=O)CSc1nnc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)s1 1626536596 FCZUBVAZCKZAHW-UHFFFAOYSA-N 444.582 4.470 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)c1 1627721674 HTQGSHZNCQCPLL-KDURUIRLSA-N 443.035 4.378 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(c4cc(F)cc(Br)c4)CC3)CC2)cc1 1630992243 JSLHCMNPTFEBMT-UHFFFAOYSA-N 447.348 4.367 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CC(=O)N(c2ccc(C)c(F)c2)C1 1631167796 ZRXIXXUUBZAUJG-OAHLLOKOSA-N 449.320 4.004 10 10 IICE COC[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(F)c(F)c1 1631912878 PJSXFKBDVRPPQV-HSZRJFAPSA-N 426.463 4.231 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(Nc2nccc(C(F)(F)F)n2)c1 1633818471 IXWANLIUVSMJON-GFCCVEGCSA-N 432.402 4.011 10 10 IICE C[C@H](NC(=O)N1C[C@H](CCNC(=O)C(F)(F)F)c2ccccc21)c1ccc(N(C)C)cc1 1634434369 BJDSLGDIBUZSHO-RDJZCZTQSA-N 448.489 4.196 10 10 IICE C[C@H]1CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC12CCC2 1637328089 KSIHVIYOVSBLKZ-LUJRCDHRSA-N 432.586 4.456 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C(CNC(=O)N(Cc3ccccc3O)C3CCCCC3)[C@@H]2C1 1638218435 QDPCEVQPTZNQIN-SFTDATJTSA-N 443.588 4.349 10 10 IICE CC(C)CNC(=O)c1ccccc1NC(=O)CN1CCCc2cc(OC(F)F)ccc21 1642061866 ZLEZEVTYKWJBJV-UHFFFAOYSA-N 431.483 4.065 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N(C)Cc2ccccc2O)sc2c1CC[C@H](C)C2 1657599117 DILOAXKSVSBPOB-GJZGRUSLSA-N 430.570 4.214 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)NCc2cc(Cl)ccc2O)CC1 1685758789 UOOBUJYYZRCTSL-OAHLLOKOSA-N 425.957 4.272 10 10 IICE COC1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC(F)F)C1 1697213754 AZBFEFSWLCUPJG-UHFFFAOYSA-N 445.514 4.207 10 10 IICE CC[C@@H](C)[C@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1708372073 VPYYXSXAFOFGDU-XXBNENTESA-N 441.620 4.080 10 10 IICE CC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)CC)C1 1709259538 AARGGCPRKYPCCD-OAQYLSRUSA-N 448.615 4.457 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@H]3CCCCCC[C@@H]32)n1CCCSc1nccs1 1723580806 SNPPTKSNDPUJFK-SJORKVTESA-N 448.662 4.214 10 10 IICE COCC1=CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC1 1730530224 DDEBZRWFXMUBNY-UHFFFAOYSA-N 437.613 4.136 10 10 IICE CC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)C1 1744885824 KVQJMRVVXXNJKR-OAQYLSRUSA-N 448.615 4.457 10 10 IICE COCC1(C)CCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)CC1 1749387710 MYGFKHBVJQEIKT-UHFFFAOYSA-N 434.588 4.016 10 10 IICE Cc1nnc(N2CCN([C@H](C)c3ccsc3)CC2)n1CCCSc1nccs1 1751929083 WPGMMHIGOSJRCS-OAHLLOKOSA-N 434.660 4.170 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2c2ccc(C)o2)n1Cc1ccc(N(C)C)c(F)c1 1766365910 LLIQGVMPULXVFA-HXUWFJFHSA-N 427.524 4.311 10 10 IICE CO[C@@H](CCn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)C(F)(F)F 1768068591 RLQLSCCBZRWMMZ-SFHVURJKSA-N 426.483 4.320 10 10 IICE CC(=O)N1CCCc2cc(S(=O)(=O)N3CCn4c5c(c6ccccc64)CCC[C@H]53)ccc21 1858183492 FBWJEVUMAIGMOC-XMMPIXPASA-N 449.576 4.022 10 10 IICE Nc1ccc(NC(=O)CN2C(=O)c3c(Cl)c(Cl)c(Cl)c(Cl)c3C2=O)cc1 1865888819 ZMEFLUCWUAVPSW-UHFFFAOYSA-N 433.078 4.117 10 10 IICE COC(=O)c1ccc(OCc2cccc(C(=O)Nc3cccc(N(C)C)c3)c2)c(OC)c1 1872844808 CQOJJRYPPBQJHG-UHFFFAOYSA-N 434.492 4.379 10 10 IICE CCN1CCc2cc([C@H](N)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999537490 ZMMOJRZVZPEBPT-GMAHTHKFSA-N 425.573 4.179 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cccc(Br)c3O)C[C@@]2(C)C1 2116284822 IBZBAVUHEYYARK-AVYPCKFXSA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CNC[C@H]2C[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c1O 2236055874 SBCNLKOBROFBCV-XJKCOSOUSA-N 441.366 4.041 10 10 IICE CCOc1cccc2ccc(C=C3SC(=S)N([C@H](CCSC)C(=O)O)C3=O)nc12 2296589829 HUNRZRPKVKMEOW-CQSZACIVSA-N 448.591 4.041 10 10 IICE CCOC(=O)c1ccc(NC(=O)CCN2C(=O)C(=Cc3cccs3)SC2=S)cc1 2314827633 JDTYOMYMWPPZNV-UHFFFAOYSA-N 446.575 4.155 10 10 IICE CCCOC(=O)c1cccc(N2C(=O)C(=Cc3ccc(O)c(OC)c3)SC2=S)c1 2321717924 NCWHPBLFRYANGT-UHFFFAOYSA-N 429.519 4.373 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2)c(O)c1Br 2352692804 KMJYTFFWFJCFGW-ZSHCYNCHSA-N 425.367 4.198 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)ccc1OCCC(=O)O 16919489 LDSZSZKGRHDWCY-QGOAFFKASA-N 429.519 4.345 10 10 IICE COc1ccc(CCN2C(=O)/C(=C/C3=Cc4cccc(OC)c4OC3)SC2=S)cc1 33514405 BDULHFZAVFBCRO-MOSHPQCFSA-N 439.558 4.467 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)ccc1OCCC(=O)O 210464159 FHCYSJFLJWXLRI-PDGQHHTCSA-N 447.509 4.484 10 10 IICE COc1cc(/C=C2\SC(=S)N(C)C2=O)ccc1OCc1cc2c(cc1Cl)OCO2 218428154 OBGGDGFEHVFKIR-FXBPXSCXSA-N 449.937 4.487 10 10 IICE Cc1cc(CCNC(=O)CSCC(=O)Nc2ccc(F)cc2)c(C)n1-c1ccccc1 746425084 GCMBOHRDVMRZGF-UHFFFAOYSA-N 439.556 4.264 10 10 IICE CCOC(=O)c1sc([C@H](C)NC(=O)NCc2ccc(N(CC)CC)c(F)c2)nc1C 756935146 NYCIMYXHJCJRPX-AWEZNQCLSA-N 436.553 4.174 10 10 IICE COc1ccc(C)cc1C1(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCOCC1 773246252 MMBHHNFEJXEUNX-LJQANCHMSA-N 425.573 4.178 10 10 IICE Cc1nc2c(s1)[C@H](NC(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)CCC2 780821143 OTKPBQVYXDTFRS-PJIJBLCYSA-N 432.565 4.081 10 10 IICE Cc1nc(CC(C)C)oc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 789793701 HQGYATXIOYJCPI-IBGZPJMESA-N 444.576 4.243 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]([C@@H](O)C(F)(F)F)C3)cc2Cl)C1 799994543 CUTPJOMXJVPAHM-IDHHARJASA-N 447.929 4.421 10 10 IICE COc1cc2c(cc1F)CC[C@@H]2NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 800997796 CCRYWVIEFMGLMI-ZSDSOXJFSA-N 445.510 4.074 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@]4(CCOC4)C3)n2CC(C)C)c(C)n1-c1ccccc1 802665246 JFWPTXVCWOECNX-RUZDIDTESA-N 435.572 4.004 10 10 IICE CCn1c(CCCc2cccs2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 812041473 WCXITZZEYZAMDT-UHFFFAOYSA-N 425.602 4.260 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3ccc(NC(=O)C(F)(F)F)cc3)n2)cc1 917845452 YUTVHAAHEMRJRZ-UHFFFAOYSA-N 441.456 4.420 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(F)c([N+](=O)[O-])c1 1124331833 LKTYTEPPDAYQFT-SXGWCWSVSA-N 449.460 4.103 10 10 IICE CCOc1ccc(-c2nc(CC(=O)N[C@@H]3CCN(c4ccc(OC)cc4)C3)cs2)cc1 1130826557 COGXQVLLSOGXQL-GOSISDBHSA-N 437.565 4.155 10 10 IICE CCc1ccc([C@@H](CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)N(C)C)cc1 1135926701 PPMKIODGQBXLPY-AREMUKBSSA-N 431.580 4.431 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCn2sc3ccccc3c2=O)cc1 1136185221 ROXDKMFAKVHTKN-UHFFFAOYSA-N 435.549 4.341 10 10 IICE Cc1cc(C(=O)NC[C@]2(N3CCOCC3)CCSC2)c(C)n1-c1cccc(C(C)C)c1 1136393039 BEXRGRMHANLNOW-RUZDIDTESA-N 441.641 4.155 10 10 IICE COC(=O)Cc1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1137286503 IODNSDDCRRBCLI-UHFFFAOYSA-N 442.313 4.219 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)c1 1137926360 PARJJZQJJRDQBL-INIZCTEOSA-N 428.492 4.490 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC[C@H](C2CCC2)C1 1147998582 HRWRMNLDRCVOCR-AMRJIULGSA-N 432.586 4.456 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccc3c2OC(F)(F)O3)cc1 1148901918 BNCNACVOXQBWCC-UHFFFAOYSA-N 426.419 4.087 10 10 IICE COc1ccc(N(Cc2ccc(S(=O)(=O)NC3CC3)cc2)Cc2cccs2)cc1 1167673741 FCFTZSSXUYLKTG-UHFFFAOYSA-N 428.579 4.404 10 10 IICE Cc1cccc(-c2nnc(N(C)CCC(F)(F)F)n2Cc2ccc(N(C)C)c(F)c2)n1 1289923655 CATHFZLABOHXTL-UHFFFAOYSA-N 436.457 4.291 10 10 IICE CCCCN(CC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1294243180 VTLDOWOECFKGJW-QFIPXVFZSA-N 427.593 4.031 10 10 IICE C[C@H](c1cccs1)N(C)c1nnc([C@H]2CCC(=O)N2)n1CCCSc1nccs1 1303623451 VXNLFQQTKLELCL-ZIAGYGMSSA-N 448.643 4.127 10 10 IICE COc1ccc(N2CCCN(C(=O)CCCCc3ccc(OC)c(OC)c3)CC2)cc1 1356396591 CHYQPIDLGTWKCC-UHFFFAOYSA-N 426.557 4.164 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(OC)c(C(C)C)c(OC)c3)cc2F)CC1 1435074881 LYENSTJROUMFAS-UHFFFAOYSA-N 443.563 4.038 10 10 IICE CN(Cc1cc(=O)n2cc(Br)ccc2n1)c1ccc(-c2nccs2)cc1 1460207946 MUVAYXKIENTBKP-UHFFFAOYSA-N 427.327 4.217 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCCC[C@@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)c1O 1460387924 LARCOSXPKSRHEA-KBXCAEBGSA-N 446.897 4.404 10 10 IICE CC(C)(C)CCCCNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1464990853 SGMKJHUPKVBSOY-UHFFFAOYSA-N 449.529 4.047 10 10 IICE Cc1cc(Cl)nc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1465324852 JLRIVEVDGBPRBI-SFHVURJKSA-N 432.952 4.105 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2cccc(F)c2)cn1 1466399056 XJLIENDHKSWJJH-UHFFFAOYSA-N 444.846 4.187 10 10 IICE Cc1cccc([C@H](NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C(C)C)c1 1473702667 MESKAPPTFRHVDM-BVFVYWQFSA-N 441.591 4.351 10 10 IICE Cc1ccccc1Cc1nnc(N2C[C@@H](C)O[C@H](C)C2)n1CCCSc1nccs1 1511298367 LYSMXHJYEQJHOS-QZTJIDSGSA-N 443.642 4.430 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(C)(C)c3ccc(Br)cc3)C2)cc1 1529403975 LZFQHTFWVHGMKX-MRXNPFEDSA-N 431.374 4.378 10 10 IICE CSC[C@H]1CCCN1c1nnc(-c2ccc(C)o2)n1Cc1ccc(N(C)C)c(F)c1 1555893703 XGOZTFOTNYXKEK-QGZVFWFLSA-N 429.565 4.432 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1556515873 PZUNFTPXNXJYFR-NRFANRHFSA-N 428.447 4.162 10 10 IICE Cc1cc(C(=O)N[C@@H](C(C)C)[C@H](CO)C(C)C)c(C)n1-c1ccc(Br)cn1 1556712893 ZJHLABHLNPCALK-QUCCMNQESA-N 436.394 4.271 10 10 IICE Cc1cc(C(=O)NC[C@]2(OC(C)C)CCOC2)c(C)n1-c1ccccc1Br 1558478212 LRGWLYVUZMUKGF-OAQYLSRUSA-N 435.362 4.171 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c[nH]c4ccc(Br)cc34)C2)cc1 1558998269 RMWHUEBUKNPGFI-CQSZACIVSA-N 428.330 4.195 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C2CC2)C2CN(C(=O)OC(C)(C)C)C2)c1 1570869908 DHTXDGDKDWJZLU-UHFFFAOYSA-N 437.540 4.131 10 10 IICE Nc1cn(Cc2ccc(C(=O)NCc3c(O)ccc4c3CCCC4)cc2)nc1C(F)(F)F 1595616685 XQMVZGYLHOYHFJ-UHFFFAOYSA-N 444.457 4.047 10 10 IICE CCO[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1616585660 PNOQCYHEPBRNGP-NRFANRHFSA-N 429.634 4.008 10 10 IICE CN(Cc1nnnn1-c1ccccc1Br)c1ccc(-c2nccs2)cc1 1618416902 VTRYDMHKRIIMFK-UHFFFAOYSA-N 427.331 4.185 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3CC[C@H]3c3ccc(Cl)cc3F)CC2)c(OC)c1 1623764109 IZRQOPJTCSCICZ-PKOBYXMFSA-N 432.923 4.339 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)c(OC2CCCC2)c1 1630351616 WHJBFMWGNREOLR-UHFFFAOYSA-N 426.582 4.500 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@H](C(=O)NCc2ccc3cccnc3c2O)C1 1630532097 GXNMTBOPKLKBAM-HXUWFJFHSA-N 433.508 4.091 10 10 IICE CC[C@H](c1ccccc1OC)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635996862 PNEQFRRVAFQVBY-HXUWFJFHSA-N 433.499 4.103 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cccc3c2OCCN(C(=O)OC(C)(C)C)C3)c1 1636061340 NEVUETVCCUYTCB-HNNXBMFYSA-N 442.512 4.021 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCCC23OCCO3)c(C)n1-c1ccccc1Br 1637025432 WXWQQLCXNJEECE-IBGZPJMESA-N 433.346 4.272 10 10 IICE Cc1ccc(C(=O)N(C)C2CCN(CC(F)(F)F)CC2)cc1-n1c(C)cc(C=O)c1C 1637996591 HEEMLOGARWHWHI-UHFFFAOYSA-N 435.490 4.314 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCc2ccccc2N1Cc1ccc(N2CCOCC2)cc1 1643784833 UYATVJRURCBMPS-HSZRJFAPSA-N 437.584 4.369 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1cc(O)ccc1O)c1cccc(Br)c1 1644752745 SLCDWLKAWXNBJR-UHFFFAOYSA-N 441.281 4.043 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)c(F)c1 1644882374 IFMMAFJGKWLJGY-FXAWDEMLSA-N 429.492 4.136 10 10 IICE O=C(NCc1cccc(Cl)c1O)N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1672931130 DLKGUNWVGDLNID-AWEZNQCLSA-N 432.858 4.002 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1685103479 WFUQDIIOEDOPNR-ONTIZHBOSA-N 444.620 4.461 10 10 IICE C#CCN(CC#CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(O)CCC1 1705590422 KTRSKVNHBPCBOY-UHFFFAOYSA-N 441.579 4.121 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)O1 1726715799 YCGJYNHTNQPKFD-INIZCTEOSA-N 443.592 4.188 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1726833899 SLBMAGONLZKPLT-UQBPGWFLSA-N 441.620 4.068 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 1742139770 UXJXFUBQUHQTFL-LJQANCHMSA-N 447.509 4.066 10 10 IICE CC(C)c1nnc(N(C)C[C@@H]2COc3ccccc3O2)n1CCCSc1nccs1 1750613395 OAQBTVMGPIBDCZ-MRXNPFEDSA-N 445.614 4.317 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1750723931 XITDNRPQDRGBSX-IBGZPJMESA-N 443.611 4.373 10 10 IICE CC(C)c1nnc(N2CCCN(C3CCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1760927291 SUSSQHNCEJTSCQ-UHFFFAOYSA-N 428.600 4.110 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1765288217 QYZMOIXWFIWTGN-YKSBVNFPSA-N 448.615 4.162 10 10 IICE CNc1cc(C(=O)N2CCN(Cc3ccccc3)CC2)c(Nc2ccccc2)c(F)c1N 1858181429 PXZWVLDRLSJUQM-UHFFFAOYSA-N 433.531 4.151 10 10 IICE COc1ccc(-c2ncc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c(C)n2)cc1 1859616564 QPCJCXGFYOGTOY-UHFFFAOYSA-N 449.466 4.488 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNCc1cc(Cl)cc(Br)c1O)C(F)(F)F 1965977185 WRXOLGMSPIGTKH-NSHDSACASA-N 447.679 4.353 10 10 IICE CC[C@@H](C)Oc1ccc(C=C2C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1Cl 2294196280 JPEMFESXJMJHJY-GFCCVEGCSA-N 432.904 4.488 10 10 IICE Cc1cc(C=C2C(=O)N(C)C(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(N(C)C)cc1 2313559949 CMAIEGPUIKMPDX-UHFFFAOYSA-N 442.519 4.169 10 10 IICE COc1cc(OC)c(OC)cc1C=C1C(=O)N(Cc2ccccc2F)N=C1C(F)(F)F 2332140977 BDLCRKSDTXWCDL-UHFFFAOYSA-N 438.377 4.196 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@@H](Cc1ccc(Br)cc1)NC(=O)OC(C)(C)C 2362991590 WDVFQZWRAOGCFV-OAHLLOKOSA-N 440.342 4.044 10 10 IICE COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)/C1=C(\C)Nc1ccc(Br)cc1 19644231 UACWUOAPMMRWLY-XDHOZWIPSA-N 446.276 4.240 10 10 IICE C[C@H](Sc1nc2ccccc2[nH]1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 21458050 KXFITARTKJPDAK-ZDUSSCGKSA-N 427.485 4.458 10 10 IICE Cc1ccc(C(N)=O)c(OCC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)c1 22194405 ZXZTZKAJIUWYGE-UHFFFAOYSA-N 428.435 4.365 10 10 IICE CC1=NN(c2ccccc2)C(=O)[C@H]1/C=C1/C(=O)N(c2ccc(C)c(Cl)c2)C(=O)N=C1O 33447137 GUDPBJAHALBPHM-KTZOAPACSA-N 436.855 4.037 10 10 IICE CC(C)(C)c1ccc(Oc2nc3ccccn3c(=O)c2/C=C2/SC(=S)NC2=O)cc1 102846097 NIUXJSXXBNENCI-FOWTUZBSSA-N 437.546 4.273 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3cccc(OC)c3OC(F)F)CC2)cc1 110362049 DHRPRANRLOSYIF-IZZDOVSWSA-N 432.467 4.104 10 10 IICE COc1cc([C@@H](C)NCc2ccc(N3CCOCC3)cc2)ccc1OCc1ccncc1 237382545 RPRPFEFGOISRLK-HXUWFJFHSA-N 433.552 4.357 10 10 IICE COC(=O)c1c(F)ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1F 485147536 NYDXHZZZWCDSNB-UHFFFAOYSA-N 441.478 4.111 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](CNCc2cccc(Br)c2O)C1 717035716 JPQWLHXSCFYIQK-ZDUSSCGKSA-N 435.309 4.137 10 10 IICE CCN(CC)c1ccc(CNC(=O)NC2CCN(c3ccccc3OC)CC2)cc1F 731364258 VNMPGTDQDBJRMC-UHFFFAOYSA-N 428.552 4.149 10 10 IICE Cc1c(CNC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)oc2ccccc12 734525011 FPVXYMQHEYCDRX-HZPDHXFCSA-N 425.504 4.493 10 10 IICE COc1cc(N(C)CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)cc(OC)c1OC 741799345 ZPVXFFQOVVLTIS-QHCPKHFHSA-N 446.547 4.323 10 10 IICE CC(=O)N1CCC[C@H]1C(=O)OCC(=O)c1cc(C)n(-c2cc(Cl)cc(Cl)c2)c1C 750422447 FBPFEZKFKSITCN-IBGZPJMESA-N 437.323 4.138 10 10 IICE COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1 777741658 TYELLYNFSDBKQE-TZIWHRDSSA-N 435.927 4.217 10 10 IICE CN(C)c1ccc(CNC(=O)C(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 785429016 VLWWFYFHVIAAAJ-SANMLTNESA-N 437.543 4.428 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 793801401 VIIBNCCRMGBGKX-HNNXBMFYSA-N 426.513 4.147 10 10 IICE CCCCS(=O)(=O)CC(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OC(C)C 1124859289 KMWGNXXKIQUNSH-UHFFFAOYSA-N 437.583 4.442 10 10 IICE C[C@@H]1CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c2ccccc2O1 1126262728 UKAOAAJFWRRTRS-VCRXTVNUSA-N 442.537 4.231 10 10 IICE Cc1cc([C@H]2CCCN2C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)on1 1141731776 DLYHTJNAKKAGFU-YAJBTMAUSA-N 445.541 4.077 10 10 IICE Cc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(N)c1Cl 1147506377 NXMIDXZXQXBQSC-GOSISDBHSA-N 446.979 4.292 10 10 IICE CCn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(Cl)c(Cl)c4)c3C)cnc21 1189277176 YBTSOXOYUNIINN-UHFFFAOYSA-N 444.322 4.210 10 10 IICE CC(C)c1ccc2c(c1)[C@@H](NC(=O)NCc1ccc(N3CCC(C(N)=O)CC3)cc1)CCC2 1233521394 WTCUESPIVMXPGW-VWLOTQADSA-N 448.611 4.389 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@H]3c3cccc(Cl)c3)cc2)CC1 1251103761 HLUWRCUWQBQUSI-QFIPXVFZSA-N 440.975 4.088 10 10 IICE CCN1CCN(c2ccc(CNC(=O)COc3ccc(-c4ccccc4)cc3)cc2F)CC1 1265012177 QIMDBEVGNWRERI-UHFFFAOYSA-N 447.554 4.330 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H](N(C)C(=O)OC(C)(C)C)C3)c2C)cc1 1294115493 UZIQMWCENHERBA-LJQANCHMSA-N 427.545 4.184 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 1295703249 XBHUKFJSZIFKAF-QGZVFWFLSA-N 431.920 4.483 10 10 IICE O=C(NCCCCOc1ccc(OCc2ccccc2)cc1)c1c(F)ccc(O)c1O 1306308396 HAMLTUWQUQSZSO-UHFFFAOYSA-N 425.456 4.405 10 10 IICE CCC[C@H](C)N(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1306577911 RPDFLAUEAAXBMF-FQEVSTJZSA-N 427.637 4.358 10 10 IICE CCN(CCC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1313793651 AKMAYTHTVVGNGO-UHFFFAOYSA-N 434.588 4.067 10 10 IICE COc1ccc(OCc2nnc(N3CC=CCC3)n2CCCSc2nccs2)cc1 1315527775 AOTFODSWXTXXNB-UHFFFAOYSA-N 443.598 4.271 10 10 IICE Cc1cc(-c2csc(NC(=O)COC3CCN(C)CC3)n2)c(C)n1-c1ccc(F)cc1 1349820202 QKCSDOSENUEDAE-UHFFFAOYSA-N 442.560 4.406 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1441909804 DXDISRISIDKEMP-IBGZPJMESA-N 439.547 4.382 10 10 IICE CCOCCC1(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCC1 1444515892 WMXGNFRFRAPMAW-HXUWFJFHSA-N 433.593 4.032 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H]1CCC[C@@H](C(F)(F)F)O1 1448683732 HXAZZTRQEGLYAZ-PXNSSMCTSA-N 444.494 4.265 10 10 IICE C[C@@H](NC(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2)c1ccccc1O 1454808379 VNTQEVLGFJFIBE-CYBMUJFWSA-N 426.314 4.320 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccc(C)o4)C3=O)c2C)c1 1458942405 MHHWCNQLCNOHIH-VWLOTQADSA-N 433.508 4.262 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2=O)cc1 1461076858 LJCJYJAIXIFIAD-FCHUYYIVSA-N 449.595 4.033 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccc(F)cc4)CC3)c2C)c1 1464035346 ZBBLRPOQHDVKBT-UHFFFAOYSA-N 433.527 4.448 10 10 IICE COCCN(C)CCCC1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 1466180536 NNDNAROXGGYZST-UHFFFAOYSA-N 441.616 4.313 10 10 IICE CCC(C)(C)[C@@H]1CCc2nc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)sc2C1 1467889964 QGFWMJBMUUMMHQ-GFCCVEGCSA-N 437.587 4.014 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1499762557 IWDSUZQVQBWQLJ-YKSBVNFPSA-N 448.615 4.162 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)CCCC1 1515298360 RHLSVNOJTMXPGG-MYGHRHJXSA-N 438.593 4.486 10 10 IICE COc1cc(C)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1519674529 MJIOOOGIAIZCIV-PDGQHHTCSA-N 430.526 4.373 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1527735495 ULVQCILEUXZAST-DENIHFKCSA-N 427.976 4.242 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(C(F)(F)F)c3)CC2)c(OC)c1 1530968456 NNPQUKSHZBDTHS-UHFFFAOYSA-N 428.838 4.338 10 10 IICE COC(=O)c1cc(C)nc2nc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)sc12 1531229172 UPENMRWKQMZJCI-UHFFFAOYSA-N 434.521 4.375 10 10 IICE Cc1cc(CNC(=O)Cc2ccc(NC(=O)C(F)(F)F)cc2)c(C)n1-c1ccccc1 1531623311 WLZBKKFKGUQGNT-UHFFFAOYSA-N 429.442 4.454 10 10 IICE COCCNC(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1532344081 HOBGTLGVOOWQRW-UHFFFAOYSA-N 439.943 4.305 10 10 IICE O=C(CC[C@H]1CCCCO1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1538918847 GKSNLFODSVJBKE-OAHLLOKOSA-N 429.318 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccccc2)Cc2cc[nH]n2)cc1 1542853007 VKFAGRMUYTWQGX-UHFFFAOYSA-N 426.520 4.401 10 10 IICE O=C(N[C@H]1CCc2c(Cl)cccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1543722367 ZUBWNKMPTVQDRI-KRWDZBQOSA-N 448.953 4.325 10 10 IICE Cc1cc(O[C@@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1Cl 1544720961 MDGPWOFQYAENSU-IBGZPJMESA-N 442.003 4.264 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccon2)n1Cc1ccc(N2CCSCC2)cc1 1545344821 ACVZWOQVFIVUQE-KRWDZBQOSA-N 426.590 4.018 10 10 IICE Cc1cc(C(=O)N2CCCN(CC(F)F)CC2)c(C)n1-c1cccc(Br)c1 1545865077 NPSDXOJETWCACO-UHFFFAOYSA-N 440.332 4.270 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC[C@](C)(OC)C2)cc1 1547445164 ZPLLFFDMDQAIKZ-VWLOTQADSA-N 436.604 4.183 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccc(CN(C)Cc4ccccc4)c3)cc2)CC1 1596523106 IDPDJGUWTHQOBG-UHFFFAOYSA-N 442.607 4.000 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c1 1598222473 DYODIHLMOSPXNV-VWLOTQADSA-N 435.543 4.345 10 10 IICE CC(C)[C@@H]1OCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1603137097 MMKDNTIZPJEMNV-RXVVDRJESA-N 441.963 4.397 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C 1613364726 TVJBNTKLBVYZEG-JFIYKMOQSA-N 429.586 4.374 10 10 IICE CCn1cc(Cl)c(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1616573676 XNRTWITXOUOQAP-UHFFFAOYSA-N 445.708 4.281 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3ccccc3)C[C@H]2C)cc1 1628152443 BGOMRYVEIDXCPH-OAQYLSRUSA-N 429.564 4.182 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1C 1629640103 UHUHSQIUBCZXEX-XMSQKQJNSA-N 441.572 4.157 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1 1630790258 BFLYXMAFTVSAPC-UHFFFAOYSA-N 431.536 4.034 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C2)c(C)n1-c1ccccn1 1633043167 BSFIOQBYSXTHDI-HXUWFJFHSA-N 426.561 4.207 10 10 IICE Cc1cc(C(=O)N2CCCC3(CCOCC3)C2)c(C)n1-c1ccc(Br)cn1 1634484889 FQCZNXPKPONHCC-UHFFFAOYSA-N 432.362 4.284 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2CCS(=O)(=O)C(C)(C)C2)cc1 1639737804 MUTIOTMLYBCBEI-QGZVFWFLSA-N 428.558 4.254 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1nn(-c2cccc(Br)c2)c2c1CCC2 1640920508 RZDYZPVWETXALM-UHFFFAOYSA-N 446.732 4.413 10 10 IICE COc1ccc(N2CCN(c3nc(C(F)(F)F)c(Br)s3)CC2)cc1F 1642423586 MDLMSGRDELVMCF-UHFFFAOYSA-N 440.260 4.399 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)c2cccnc2)c(C)n1-c1ccccc1Br 1653443378 GAJFJZBIJAKPAW-FQEVSTJZSA-N 428.330 4.057 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3C[C@H]4CC[C@@H]3N4C(=O)OC(C)(C)C)c2C)cc1 1653592514 YNIGJVLHLCYHGL-COPCDDAFSA-N 439.556 4.373 10 10 IICE CCOc1cccc([C@@H](C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1653924861 PTOSYXCGKGYEEC-MRXNPFEDSA-N 428.488 4.150 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3ccc(Cl)c(F)c3)C[C@H]2C)c([N+](=O)[O-])c1 1655537081 GUZSYHNVSRVPMY-YOIVXCQUSA-N 433.867 4.289 10 10 IICE C[C@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1681827273 DVZFCKADIDTIGP-MSOLQXFVSA-N 435.012 4.024 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O 1682824613 PNNWLNWWGPRLAG-MBSDFSHPSA-N 440.563 4.175 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3ccncc3OCCC(C)(C)C)CC2)cc1 1683103250 GUHQKNCOZHYJFY-UHFFFAOYSA-N 440.588 4.327 10 10 IICE CCCN(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1683420939 BDVRZPNTLWLYRZ-UGKGYDQZSA-N 446.636 4.423 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@H]2CCC(C)(C)CN2C(=O)OC(C)(C)C)c1 1684682562 UOYJDMMWDYFJNO-HZPDHXFCSA-N 435.565 4.187 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(CCc3ccc(C)cc3)C[C@@H]3CCCO3)C2)cc1 1687022868 IIJJAWRBWDLVBM-RDGATRHJSA-N 437.584 4.016 10 10 IICE CC[C@H](C)c1nnc(N2CCN(C3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1694131316 QSFCUHPUXTZCLR-IBGZPJMESA-N 442.627 4.500 10 10 IICE CC(C)c1nnc(N2CC(C)(C)OC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1706287558 WSEHMFJZYOODJS-SFHVURJKSA-N 429.634 4.007 10 10 IICE C[C@@H](CC#N)N(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1706750972 CMLCPGHEQYPRHS-YRISNDGFSA-N 442.583 4.188 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@@H](C)N(CC)C[C@H]2C)cc1 1710026140 YVEMDGRQSZPIIO-NHCUHLMSSA-N 447.631 4.154 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CC1(C)CCOCC1 1729419623 WYOUBDOOUQOOMH-UHFFFAOYSA-N 427.936 4.152 10 10 IICE CC(C)NC(=O)c1nnc(N(C)[C@@H](C)C2CCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1741646559 WHTQZFUFWYATAU-KRWDZBQOSA-N 444.599 4.075 10 10 IICE CN(Cc1ccoc1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1747780134 WCBDLVOVHYKGHI-UHFFFAOYSA-N 437.588 4.062 10 10 IICE CCC[C@@H](Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1763865523 HDGNMXLFBZFFGO-QFIPXVFZSA-N 434.588 4.392 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@@H](COC)C1 1765769454 IMGTYLDVSAVJBG-DENIHFKCSA-N 437.588 4.393 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N(C)C)c(F)c2)C12CCC2 1767670332 MUNRDGNLBOGGNH-NHCUHLMSSA-N 429.584 4.439 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(Cl)cc3)N=C2C(F)(F)F)cc(OC)c1O 1865679794 GZNMFEFYZYHFLT-QPEQYQDCSA-N 426.778 4.411 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4ccc(N(C)C)cc4)cc3)CC2)cc1 1872883970 FRAPTXYWWDUARV-UHFFFAOYSA-N 444.579 4.336 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1ccc(C(=O)O)cc1 2053494322 PZEAOHTUVQYNJE-UHFFFAOYSA-N 426.519 4.005 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(c5cccnc5)SC4=NC3=O)c2C)cc1 2297469475 NNQYKYKVQGOAAH-UHFFFAOYSA-N 440.532 4.465 10 10 IICE CCOc1ccccc1/C=C1\C(=O)N(c2ccc(I)cc2)N=C1C 33436291 WYMKHHJIODBCQV-ATVHPVEESA-N 432.261 4.496 10 10 IICE O=C(NN1C(=O)/C(=C/C=C\c2ccco2)SC1=S)c1ccccc1Br 33615086 UEPZMBBJZKZQCH-RDCALDECSA-N 435.324 4.145 10 10 IICE NS(=O)(=O)c1cc2c3c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N3C[C@H]1CC=C[C@H]21 35337451 FUJFNZKSUFSRDU-MSBWEVJISA-N 449.532 4.137 10 10 IICE Cc1ccccc1/C=C1\SC(=S)N([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 47152390 OIWLZAGZEMUTRM-MFVBVHDHSA-N 427.507 4.132 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3c(C)nn(CC(C)C)c3Cl)CC2)cc1 110360689 XYWVPMCDAHDOJV-MDZDMXLPSA-N 430.980 4.308 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(C(C)=O)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526263324 AIWMBHRYNNZUJB-QHCPKHFHSA-N 431.444 4.366 10 10 IICE COc1ccc(OCc2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)cc1 574941678 JTJWKCYWZPCPHT-UHFFFAOYSA-N 432.524 4.427 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@@H](NCc1ccc(Br)cc1O)C2 701086327 FIJSTXRTDDELGD-VDGAXYAQSA-N 445.357 4.434 10 10 IICE COc1ccc(Cl)cc1CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726609607 CWXAUFYDTUCLMG-UHFFFAOYSA-N 439.890 4.418 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2cnccn2)c(C)n1-c1ccc(OC(F)(F)F)cc1 740968315 WEWULJNCLQIOCZ-FPYGCLRLSA-N 445.397 4.222 10 10 IICE COC(=O)c1cccc(Cc2cnc(NCc3ccc(N4CCOCC4)c(F)c3)s2)c1 758456811 FWPCIYBODTYPIP-UHFFFAOYSA-N 441.528 4.108 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2c(F)cccc2I)cc1 760382916 NWPXQMQDJAPTKM-UHFFFAOYSA-N 426.273 4.207 10 10 IICE CCN(Cc1ccccc1NC(=O)NCc1ccc(OC)cc1O)C(=O)OC(C)(C)C 797628794 VVKVOYYYYJYIDB-UHFFFAOYSA-N 429.517 4.480 10 10 IICE Cc1ccncc1N1CCN(Cc2c(O)ccc3c(=O)c(-c4ccccc4)c(C)oc23)CC1 799154887 JVXWQNLVKRQPNR-UHFFFAOYSA-N 441.531 4.500 10 10 IICE COC(=O)c1ccccc1CC1CCN(C(=O)NCCCSc2nccs2)CC1 813681202 NHPMZRYUTPICEC-UHFFFAOYSA-N 433.599 4.076 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](CN1CCCC1)c1ccccc1 1136546234 ADXNRJYLXHQIGY-HSZRJFAPSA-N 443.538 4.253 10 10 IICE COc1ccc(N2CCN(C(=O)C3(Cc4ccccc4Br)CC3)CC2)cc1F 1137423018 RNHBDGHJBCSSNJ-UHFFFAOYSA-N 447.348 4.268 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c1 1144185045 HVEYCMFXRPIZHO-HSZRJFAPSA-N 436.625 4.183 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2COC(=O)N2CCC[C@H](C)C2)c(C)n1-c1ccccn1 1157242975 LLERELPVUWFPTK-RXVVDRJESA-N 438.572 4.352 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3CSC3=NCCS3)C2)cc1 1162718683 OHTWBQAATSUCMU-KRWDZBQOSA-N 441.622 4.288 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H](CCC(=O)OC(C)(C)C)C3)C2)cc1 1230301135 RCKLPNQPDNBQPJ-UXHICEINSA-N 445.604 4.065 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1ccccc1C(=O)OC(C)(C)C 1251989779 QOIRWSAOKKTNFO-GOSISDBHSA-N 425.573 4.447 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCCC[C@@H]3COC(=O)N3CCCC3)ccc21 1271924338 FHTOTIFIMCTOHZ-OAQYLSRUSA-N 441.572 4.132 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1cn(C(F)F)c2ccccc12 1313124528 RCMBDABVQRUKLK-UHFFFAOYSA-N 442.510 4.245 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccc(C)cn4)cc3)cc2F)CC1 1352970007 PCUSNVMNBHVACP-UHFFFAOYSA-N 448.542 4.393 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1Cc2ccc(Br)cc2C(=O)O1 1353424503 HAESGDYAPHBBOS-HXUWFJFHSA-N 445.357 4.034 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3c(C)nn(Cc4ccc(F)cc4)c3Cl)C2)cc1 1437577088 LNOSNXQTSQGFOM-GOSISDBHSA-N 442.922 4.050 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2C1 1444983384 DAUFXWMOKZIFDV-RDJZCZTQSA-N 445.510 4.302 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(N2CCCCCC2)nc1 1445883801 OBCHHIADJQSJBF-NRFANRHFSA-N 442.991 4.215 10 10 IICE CCOC(=O)COc1ccc(CCNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1465470634 HYHRCBXNDJMZQP-UHFFFAOYSA-N 434.536 4.317 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3c4ccccc4CC[C@H]3C(C)C)CC2)c(OC)c1 1469707166 GVXRMPNWMAQMTI-SQJMNOBHSA-N 437.584 4.495 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@H]2CC)n1Cc1ccc(N(C)C)cc1C 1496812696 NFRWKILFSPMSDB-VGOFRKELSA-N 440.636 4.244 10 10 IICE Cc1cc(Br)cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1518326339 REHRNEFGOSEGTP-UHFFFAOYSA-N 442.401 4.220 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Oc2ccccc2F)nc1 1524851292 MABONYGTAWECOK-UHFFFAOYSA-N 443.425 4.058 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2ccc(F)c(F)c2F)C1 1526856676 SAQWBPZQPNYCOH-UHFFFAOYSA-N 429.486 4.184 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1527735498 ULVQCILEUXZAST-UGKGYDQZSA-N 427.976 4.242 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)[C@@H](C)C(F)(F)F 1538872022 IXQKIBFSYVYYSV-IWQAVIMZSA-N 434.480 4.216 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)COc2ccc3oc4ccccc4c3c2)N(C)C)cc1 1539705630 GUIMKOSLAPMGRR-QHCPKHFHSA-N 431.536 4.450 10 10 IICE Cc1cc(CC(=O)Nc2ccc(F)c(S(C)(=O)=O)c2)c(C)n1-c1ccc(Cl)cc1 1542601438 KSEDGIPWSKZXSJ-UHFFFAOYSA-N 434.920 4.471 10 10 IICE COc1c(Br)cccc1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 1543758885 HPWXGBQIVAQBIO-UHFFFAOYSA-N 444.373 4.242 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)cc1 1544557183 ZDVIRJXASYXJJV-UHFFFAOYSA-N 430.596 4.426 10 10 IICE Cc1cc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)n(Cc2ccccn2)n1 1545182838 NIYBVTRVCDJTSP-UHFFFAOYSA-N 427.508 4.416 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)c1noc(Cc2ccccc2)n1 1545318297 WTWZDBVFRVYRAW-QGZVFWFLSA-N 428.492 4.371 10 10 IICE O=C(CCCOc1ccc(F)cc1F)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632731 UHJDMIVVRUSRAH-GOSISDBHSA-N 438.902 4.264 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1CCc1sccc1C 1545837621 KIAAQSMKCSOAAE-UHFFFAOYSA-N 441.601 4.151 10 10 IICE CCc1nnc(N2CCC(C)=C(Br)C2)n1CCCSc1nccs1 1546463629 ZZVLZVPZRWKBCR-UHFFFAOYSA-N 428.425 4.358 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccccc2Br)c(C)n1-c1ccc(F)cc1 1557011656 NQXPDKAFVOROAP-HXUWFJFHSA-N 431.305 4.459 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H](C)[C@H](OC)C2)sc(C)c1-c1ccccc1 1559757309 YJKOATAEXZARAP-CRAIPNDOSA-N 430.570 4.196 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Br)cs1 1566356990 UFISTCVBUDJUCM-CQSZACIVSA-N 429.767 4.264 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cc1ccccc1NS(C)(=O)=O 1566845191 ADJDMIXFNGRDGR-GOSISDBHSA-N 438.549 4.096 10 10 IICE CCOC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1596483115 SSSZPSGXMHDTQF-XMMPIXPASA-N 433.552 4.376 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3csc(-c4ccc(F)c(F)c4)n3)C2)cc1 1598362694 BXCYDHADTPRAMY-CQSZACIVSA-N 429.492 4.353 10 10 IICE Cc1ccccc1[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 1616786500 JDPDZTKEEFOWJX-XMERXJNXSA-N 441.591 4.351 10 10 IICE CO[C@@H]1CCN(c2nnc(COc3ccc(C)cc3)n2CCCSc2nccs2)C1 1620134048 DXEFSQWQBCQTHG-GOSISDBHSA-N 445.614 4.030 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)cc1 1628468836 MEHHYOGGVUEPLV-NRFANRHFSA-N 439.556 4.129 10 10 IICE Cc1cccc(NS(=O)(=O)c2cc(C(=O)NCc3cc(Cl)ccc3O)ccc2C)c1 1628666543 FRMMDNUZNZUNRQ-UHFFFAOYSA-N 444.940 4.393 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c1 1629809798 FAAQMKCZMQYGML-OPAMFIHVSA-N 439.556 4.282 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CCN(C(=O)OC(C)(C)C)C[C@H]43)cc2)CC1 1633110537 BRVBMBSHCNCPAG-BHDDXSALSA-N 427.589 4.042 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1634218730 JCPBFRMGXQKUGJ-WIYYLYMNSA-N 441.330 4.411 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cn(-c2ccccc2Br)nn1 1635113391 GHRUEBOATHJDPA-UHFFFAOYSA-N 429.318 4.178 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(-c2nnc(C)o2)c1 1635489137 KXRHKOJESGFAQG-UHFFFAOYSA-N 436.512 4.047 10 10 IICE CCOc1ccc(N2CCN(C(=O)CN(C(=O)OC(C)(C)C)c3ccccc3)CC2)cc1 1636702420 RDLQKBQOTUFEQG-UHFFFAOYSA-N 439.556 4.176 10 10 IICE C[C@](O)(C(=O)NCc1cc(Cl)cc(Cl)c1O)c1ccc(F)c(Br)c1 1637134437 NEADCNILHDYXAD-MRXNPFEDSA-N 437.092 4.125 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1 1639522785 VDIOMBPALFRHQF-XMMPIXPASA-N 428.504 4.272 10 10 IICE Cc1cc2[nH]nc(NC(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)c2c(=O)n1C 1643370980 DBRBWHLLOSKTNA-UHFFFAOYSA-N 429.484 4.304 10 10 IICE Cc1cc(CN2CCN(CC(=O)Nc3ccccc3Cl)CC2)ccc1N1CCCCC1 1652961090 NNVBIYBJGNWKFA-UHFFFAOYSA-N 441.019 4.395 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1C 1706057311 FFVCKKWUKPKJTK-IEBWSBKVSA-N 434.588 4.114 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](CNC(C)=O)C2)n1Cc1ccc(N(CC)CC)cc1 1708491076 FPXWMYKUPDLOON-UGKGYDQZSA-N 440.636 4.039 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CCOC[C@@H]2C)cc1 1746089555 QFXLIVPRZRADGT-KRWDZBQOSA-N 440.979 4.113 10 10 IICE CC(C)[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1760953674 OLSHZNQECNYHOS-LJQANCHMSA-N 429.584 4.082 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1761051202 GYMLSUXEZOYYMN-OAQYLSRUSA-N 436.579 4.390 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3OC)SC2=S)cc1[N+](=O)[O-] 1860084627 XWMMOYPJDCFAMA-CXUHLZMHSA-N 432.479 4.026 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cccc(C(=O)OC)c3)C2=O)ccc1OC 1860086955 RPJUWYZDOYZOKJ-WOJGMQOQSA-N 429.519 4.286 10 10 IICE CNC(=O)[C@H]1CCCC[C@H]1C(=O)Nc1sc(C)c(-c2ccc(C)cc2)c1C(=O)OC 1866193012 NVKNKSUGPOWESY-DLBZAZTESA-N 428.554 4.309 10 10 IICE Cn1nc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1-c1cc(F)ccc1F 1868177983 HJIXIBOSJVZSAP-UHFFFAOYSA-N 443.409 4.393 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(C)C)c(C(=O)O)c1I 2079138487 WSBPMRCRGLWEQL-LBPRGKRZSA-N 428.270 4.323 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C3CCC3)c(CO)c2I)cc1C 2079986191 NMKCLWLEBNWJFP-GFCCVEGCSA-N 426.298 4.179 10 10 IICE COCCCN1C(=O)C(=Cc2cc(C)n(-c3c(C)cccc3C)c2C)C(C(=O)OC)=C1C 2294034186 LTOCBFOAYABTNW-UHFFFAOYSA-N 436.552 4.420 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C2=O)c1 2294133935 NRKGKUGNRANRLD-UHFFFAOYSA-N 445.431 4.446 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccs2)SC1=S)NCCc1c[nH]c2ccccc12 2296337034 RNNQBAXOQQOVNT-UHFFFAOYSA-N 441.603 4.180 10 10 IICE O=C1C(=C2SC(=S)N(Cc3ccccc3)C2=O)SC(=S)N1Cc1ccccc1 2297554705 UFIPKQNWSFZCSH-UHFFFAOYSA-N 442.612 4.319 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(OC)cc2OC)SC1=S 2314768282 KFTFUHRZKNHMCQ-IBGZPJMESA-N 443.546 4.209 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccc(O)cc3)SC2=S)cc1 2314836278 CFUFYCWUFDHDMC-CYBMUJFWSA-N 428.535 4.019 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(Cc3ccccc3)C2=O)cc1OC)C(=O)O 2314932746 PHKIMBCYXAXQLD-INIZCTEOSA-N 443.546 4.339 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3F)C2=O)ccc1OCCC(=O)O 2314934357 ZCVOWPSRVYYTAD-UHFFFAOYSA-N 433.482 4.094 10 10 IICE Cc1ccc(CNC(=O)CC2(CNC(=O)OC(C)(C)C)CCC2)c(O)c1Br 2380746287 NUKAEHRKCIRRRS-UHFFFAOYSA-N 441.366 4.164 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCC(=O)Nc3cccc(C)c3)C2=O)ccc1O 15037379 ONLCZLUZPJWVDW-UYRXBGFRSA-N 442.562 4.329 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C/c3c[nH]c4ccccc34)SC2=S)cc1 15037891 IZLYESNUPVHYLP-UNOMPAQXSA-N 437.546 4.407 10 10 IICE O=C1c2ccccc2C(=O)c2c1cc(Cl)c(NC(=O)C(F)(F)F)c2Br 39899514 FWCUQUQOHYKASM-UHFFFAOYSA-N 432.579 4.379 10 10 IICE O=C(N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@H]1CC(=O)N(Cc2ccco2)C1 69260841 RWCHKSPCJPPPRZ-FNZWTVRRSA-N 440.499 4.393 10 10 IICE CCCCn1nc(C)c(/C=C/C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1Cl 109180062 QPEWKTJASLCOBV-SXSDINLZSA-N 430.980 4.372 10 10 IICE Cc1ccnc(-n2nc(C)cc2NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 488219068 MIAXSUBDLLDRSG-UHFFFAOYSA-N 442.567 4.244 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2CNCc1cc(Br)cc(F)c1O 715735937 DYVWEUPFPAQRRE-CQSZACIVSA-N 443.357 4.421 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3c(C)nn(Cc4ccc(C)cc4)c3C)CC2)cc1 730160341 HOVOBJDKHKNIIC-UHFFFAOYSA-N 446.595 4.147 10 10 IICE CCOc1c(Br)cc(Cl)cc1NC(=O)NCCc1ccc(O)c(O)c1 761618957 TUPXIONOERCKSE-UHFFFAOYSA-N 429.698 4.277 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)n1 771271343 CDCSVNDDDQQCLL-HNNXBMFYSA-N 430.555 4.494 10 10 IICE O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1N1CC=C(c2ccc(Cl)nc2)CC1 773247925 OYLDYPOHVNONOB-UHFFFAOYSA-N 447.822 4.230 10 10 IICE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773845422 JEWHPJQKGWOFGK-SFHVURJKSA-N 433.556 4.088 10 10 IICE CC(C)N1CC[C@H](NC(=O)NCCCSc2nccs2)[C@H]1c1ccc(F)c(F)c1 779364768 RGYKUSCVFGUBFO-ZWKOTPCHSA-N 440.585 4.427 10 10 IICE CCNC(=O)N(C)c1cccc(NC(=O)N(CC)Cc2cc(Br)ccc2O)c1 797664493 MAZUKHCDNGCPAZ-UHFFFAOYSA-N 449.349 4.374 10 10 IICE CC(C)OCc1cc(NS(=O)(=O)/C=C/c2ccc(Br)cc2)ccc1O 811704253 BZYMVBBTKQXJJJ-MDZDMXLPSA-N 426.332 4.492 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(OC(F)F)c2)n1C[C@@H]1CCCO1 812258063 YTUULLFHDSSGTJ-SFHVURJKSA-N 430.455 4.068 10 10 IICE COc1cc(CN2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)cc(OC)c1 1126933939 SSKNHJDXINFGPY-UHFFFAOYSA-N 433.552 4.069 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc4c(Br)cccc4cn3)C2)cc1 1131029977 JBUBUEYASRGHQI-OAHLLOKOSA-N 426.314 4.015 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)C1 1138498389 VGMLCHRAHBHULM-XZOQPEGZSA-N 443.632 4.382 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)N(C)C)cc1 1158717281 LZWVWOPLHJRJFQ-RUZDIDTESA-N 427.552 4.329 10 10 IICE O=S1(=O)N=C(Cl)c2ccc(NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc21 1162375017 AMFBZSMHZWXNFA-UHFFFAOYSA-N 441.887 4.057 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)Oc1cccc(Cl)c1Cl 1162539859 NSXJMUQDCINQBG-ZDUSSCGKSA-N 426.296 4.058 10 10 IICE C[C@H](N[C@@H](C)c1ccc(F)c(F)c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1168757263 AIVPHDRXYHVSMP-KBPBESRZSA-N 434.442 4.418 10 10 IICE COc1ccc(N(C)CCN(C)[C@@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)cc1 1195787683 BNHBFRNHRZCCSS-FQEVSTJZSA-N 449.595 4.272 10 10 IICE CC[C@H](C)N(CCc1ccccc1F)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229782600 XCPSEWMBMGZZFO-KRWDZBQOSA-N 449.517 4.493 10 10 IICE Cc1cc(CNC(=O)N[C@H](C)c2ccc(N3CCNC3=O)cc2)c(C)n1-c1ccccc1 1252157833 QCKDWKZIUHEXRK-GOSISDBHSA-N 431.540 4.184 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3cccnc3)nc3ccccc23)N(C)C)cc1 1289600217 NJTBJQPXJWHLEY-SANMLTNESA-N 439.563 4.396 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(I)ccc1O 1291849529 JAAPTNPOUFQHIN-UHFFFAOYSA-N 438.309 4.114 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](c3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1305433252 LQASIIAPDMKQFL-PZJWPPBQSA-N 435.620 4.414 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(SC)c3)C2)sc2c1CCCC2 1351742550 FRVCARCGIQLONO-ZDUSSCGKSA-N 444.578 4.127 10 10 IICE C[C@](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)(C1CC1)C(F)(F)F 1354755260 POCQQQJEMXUMGH-BLSFAOBESA-N 446.491 4.264 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(I)cc1F 1356266613 LHRIZUXSSPCPOF-UHFFFAOYSA-N 438.284 4.303 10 10 IICE CC(C)CCN(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1359919146 YBIKZRCMQDUHTM-NRFANRHFSA-N 443.661 4.256 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1451108653 KJTYFBUKOPDULR-PKOBYXMFSA-N 443.548 4.491 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(-c3ccccn3)nc2O)cc1 1452616799 VDTHPCULGWWGRV-UHFFFAOYSA-N 430.430 4.120 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1cccc(C(N)=O)n1 1457576765 VICSAFNPWCVRAB-QGZVFWFLSA-N 442.441 4.106 10 10 IICE CN(c1ccc(CNC(=O)c2ccncc2NC(=O)C(F)(F)F)cc1)C1CCCCC1 1464540645 QYVGATONCKZJAK-UHFFFAOYSA-N 434.462 4.281 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc3cc(O)c(O)cc3s2)c(C)c1 1464804148 HSUYFUGVDUQJBM-HNNXBMFYSA-N 428.535 4.083 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)C1 1467702700 PUWKEJWRSYGYPJ-OXQOHEQNSA-N 439.556 4.424 10 10 IICE CC(C)(C)OC(=O)[C@@](C)(CNC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccc1 1469790420 TUXHGQVSFYMOGC-QHCPKHFHSA-N 427.522 4.342 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1470774215 XYOUBAVFXSPTIY-IAGOWNOFSA-N 429.948 4.140 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC)c(F)c2)sc2c1CC[C@@H](C)C2 1473250468 JFQSYFFFBFILDN-CYBMUJFWSA-N 434.533 4.272 10 10 IICE CC[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1499652727 PVVHNLCOCAJBJK-NQIIRXRSSA-N 443.661 4.181 10 10 IICE CC[C@@]1(C)CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1513591590 WTVACGRULNZZSP-DEOSSOPVSA-N 429.584 4.270 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1csc(N2CCCCC2)n1 1520922164 FJQQJAVSVJXVII-UHFFFAOYSA-N 436.528 4.134 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)C2CC2)cc1 1524794018 NSHURJAAQWXRIR-RTWAWAEBSA-N 444.373 4.179 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccnn2CCc2ccccc2)cc1 1530325384 XYOXGSNQNPXOIU-UHFFFAOYSA-N 430.474 4.397 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cccc(NC(=O)[C@@H]4CCCO4)c3)c2C)c1 1531611705 FCEPVUJQRPNMLJ-DEOSSOPVSA-N 431.536 4.450 10 10 IICE CCS[C@@H]1CCC[C@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1532501288 FSMYYSHAHHWEEP-BWJIRVQHSA-N 438.615 4.207 10 10 IICE Cc1ncc([C@@H](C)NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)s1 1534717850 JYVILIXHTKEPSD-ZECSTPGPSA-N 437.637 4.372 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(-n4ccc(C(F)(F)F)n4)cc3)C2)cc1 1537108562 AEIPTLHAEXRVGM-INIZCTEOSA-N 444.457 4.156 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)OC(C)C)c1C 1556767310 KAFMJOJSRQSICY-QHCPKHFHSA-N 434.536 4.401 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@H]2CSCCN2Cc2ccccc2)C2CC2)cc1 1564552667 YIABBULDDJCMNX-DEOSSOPVSA-N 438.641 4.044 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@H](COc4ccccc4Cl)C3)C2)cc1 1565055636 HSAHMMABFJJNFS-RBUKOAKNSA-N 443.975 4.428 10 10 IICE CSc1cncc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1 1585436004 RIHIDPOMBIWABB-OQLLNIDSSA-N 435.621 4.485 10 10 IICE Cc1ccccc1CN1CCO[C@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)C1 1587573501 MGVNUFCMRIHOAM-XMMPIXPASA-N 435.543 4.172 10 10 IICE CCc1ccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1S(N)(=O)=O 1597921307 CZEVDZZMJJZSPZ-UHFFFAOYSA-N 445.972 4.139 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)C1 1612775927 KJKJKBGMIINIMK-LJQANCHMSA-N 436.604 4.136 10 10 IICE CCOC(C)(C)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1616058845 KUSJWWHXMWUEPA-UHFFFAOYSA-N 429.609 4.116 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCCc1ccc(Br)cc1 1623451401 ADESORNDOSFRNA-UHFFFAOYSA-N 431.374 4.267 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COc3ccccc3O2)c(C)n1-c1ccc(Br)cc1 1623920248 RJUATQVTBMMRHC-GOSISDBHSA-N 441.325 4.426 10 10 IICE CCCCC[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1627934045 SMYXQXOJHCWEJI-OSBDDZKNSA-N 449.595 4.338 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@@H](c1cccc(Br)c1)N1CCCC1 1630272920 HFVUHDFRTUQPPI-JOCHJYFZSA-N 443.385 4.487 10 10 IICE CC(C)C[C@H](CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)OC(C)(C)C 1636957999 YOKYCZTUBYIAKN-WOJBJXKFSA-N 434.577 4.229 10 10 IICE COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1639165632 DOZCXASKZOSXGR-ORAYPTAESA-N 433.346 4.270 10 10 IICE COC(=O)[C@@H]1C[C@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c2ccccc21 1651115598 OPCUTUXPOGYORB-PKTZIBPZSA-N 430.504 4.346 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccnc1SCc1cccc(Br)c1 1651223156 XWPVEKIDBRAKNH-UHFFFAOYSA-N 445.338 4.478 10 10 IICE COc1cccc(S(=O)(=O)CCN(Cc2cccs2)c2ccc3c(c2)OCCO3)c1 1653578321 RKCCZBTVMZQYIA-UHFFFAOYSA-N 445.562 4.008 10 10 IICE Cc1ccc(C)c([C@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1683196026 XISJTWKKEODFPT-JOCHJYFZSA-N 429.511 4.465 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2CC2CCCC2)c(C)n1-c1ccccc1 1692989074 RBOWZXSVFJPTCP-KRWDZBQOSA-N 434.588 4.243 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1695653517 IVBLEBXVRVABAI-OAQYLSRUSA-N 440.680 4.458 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C1 1696209748 RPMSGCVJVUCCQP-QFIPXVFZSA-N 437.588 4.394 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)CC[C@@H]1C 1705895560 LAOXBRIRIFSWQK-OALUTQOASA-N 446.599 4.280 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CC1CCN(c2ccncc2)CC1 1706379522 SXHXWJNCMRHNNL-UHFFFAOYSA-N 434.588 4.130 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C(N)=O)C3)n2CCCC(C)(C)C)c(C)n1-c1ccccc1 1742119658 OZMFSXFZNFGEHR-HXUWFJFHSA-N 448.615 4.491 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N2CC=CCC2)cc1F 1766914164 QTJXWIPROCBAPE-WIYYLYMNSA-N 427.568 4.216 10 10 IICE CCOCc1nnc(N(C)C2CCCCC2)n1Cc1ccc(N2CCSCC2)cc1 1767761182 LXAIMCICTHECLL-UHFFFAOYSA-N 429.634 4.185 10 10 IICE CCS[C@@H]1CC[C@H](N(C)c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)C1 1768361483 NPBMWJADVSEJHY-LEWJYISDSA-N 431.675 4.298 10 10 IICE CC[C@@H](C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858596724 ZFVZIFLKSHBZAD-XGQUYORUSA-N 432.336 4.289 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(C)cc4)n(CC(C)C)n3)CC2)cc1 1862377208 SKFVBMLNBNNXPS-UHFFFAOYSA-N 432.568 4.486 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C2(C)CC2)c(N)c1I 2080005814 NKFUKZPTYNVLMB-CYBMUJFWSA-N 425.314 4.443 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@@]2(NCc2c(O)cccc2Br)C1 2126044963 BGBLFFDCARFZKL-RBUKOAKNSA-N 429.330 4.126 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H]4CCN(Cc5ccccc5)[C@H]4C3)ccc(N)c2C1 2132362382 GWWHCCTXYDZEGL-NLFFAJNJSA-N 448.611 4.273 10 10 IICE COc1ccc(Br)c(CN[C@@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)c1O 2236054172 FNQDIQGHGUOIIK-OXJNMPFZSA-N 441.366 4.185 10 10 IICE CN(CCN(Cc1ccccc1)Cc1ccc(N2CCNCC2)cc1)Cc1ccccc1 2258196417 XBRVGNIMOLGPLN-UHFFFAOYSA-N 428.624 4.230 10 10 IICE O=C1C(=Cc2ccc(O)c(I)c2)SC(=S)N1c1ccccc1 2294013993 QLZWVIGFWKRXGD-UHFFFAOYSA-N 439.299 4.403 10 10 IICE Cc1ccc(N2NC(=O)C(=Cc3cccc(OC(=O)c4cccs4)c3)C2=O)cc1Cl 2297311073 VSDOZRVVYWGAPM-UHFFFAOYSA-N 438.892 4.391 10 10 IICE O=C(NN1C(=O)C(=Cc2ccccc2F)SC1=S)c1ccc(Br)cc1 2314765024 RUCQGECDUAYSRS-UHFFFAOYSA-N 437.315 4.134 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCCO3)SC(=S)N1c1ccc([N+](=O)[O-])cc1Cl 2321646856 NCWOLWUOWHRZKY-UHFFFAOYSA-N 434.882 4.425 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 251301687 BPZKKQIBBYQNHW-OFAHOWDGSA-N 443.525 4.204 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CC(=O)Nc3ccc(F)cc3)no2)C1 519791189 UNGMCBVCUQSMJS-UHFFFAOYSA-N 447.514 4.159 10 10 IICE C[C@H]1Cc2ccccc2[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 732040097 RBCBGJVKIJSVGQ-ZSEKCTLFSA-N 426.428 4.034 10 10 IICE O=C(CC/C=C/c1ccccc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 737516235 RBRIFQMIFNVLER-RUDMXATFSA-N 445.542 4.052 10 10 IICE COc1cc(N(C)CC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)cc(OC)c1OC 741799344 ZPVXFFQOVVLTIS-HSZRJFAPSA-N 446.547 4.323 10 10 IICE Cc1nc(-c2ccc(OC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)cc2)no1 766367402 JBORXLCJKYRLHK-UHFFFAOYSA-N 430.508 4.372 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CO[C@H]3CCCc4ccccc43)cc2F)C[C@@H](C)O1 797436803 PHRYRZBYVKDTDJ-GGUMNFRJSA-N 426.532 4.150 10 10 IICE C[C@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(N2CCOCC2)c(F)c1 798935327 OAMFHQNXTJVOAY-KRWDZBQOSA-N 433.955 4.003 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1cc(Br)ccc1O)c1ccccc1 804737446 RONPYFPCJKYEDA-QGZVFWFLSA-N 449.345 4.427 10 10 IICE CCN(CC)[C@@H](CNC(=O)NCc1cc(Br)ccc1O)c1ccsc1 804913099 DJPDCLNJOCCLFY-INIZCTEOSA-N 426.380 4.099 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CC(F)(c2ccccc2F)C1 813621897 ISFRHCGQEBWOBB-UHFFFAOYSA-N 437.437 4.286 10 10 IICE CCN(C)Cc1cc(O[C@H]2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)ccn1 856642898 UKJFLXVHGDZFGE-VWLOTQADSA-N 432.568 4.234 10 10 IICE Cc1ccccc1[C@@H](C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918023557 CJOUHBSYLDRNSO-HSALFYBXSA-N 427.564 4.057 10 10 IICE CCc1cnc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1127419282 NICZIMODBWZQSJ-OQLLNIDSSA-N 436.555 4.179 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3ccc(OCCOc4ccccc4)cc3)C2)cc1 1130826536 BSWVPWOVYANHKA-JOCHJYFZSA-N 446.547 4.091 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(Cl)c4ccccc34)CC2)c(OC)c1 1131805218 ZGSFWHFCRZIUAQ-UHFFFAOYSA-N 440.927 4.238 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)OCc3ccccc3)cc2Cl)C1 1139137599 CBVWDTBWNAZSRE-QGZVFWFLSA-N 429.948 4.119 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)N(C)C)cc1 1158716294 ABZONOJTPUNPOO-FQEVSTJZSA-N 445.539 4.264 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CC(C)(C)Oc2ccc(F)cc21 1230650252 WKEWIWRYKCJUJJ-NRFANRHFSA-N 427.520 4.106 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC[C@@H](O)c2ccc(-c3ccccc3)cc2)N(C)C)cc1 1256236296 FLHAWPPBHKLBQR-IZZNHLLZSA-N 446.595 4.055 10 10 IICE COc1ccc(/C=C(\C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1F 1266258413 ACLMXDOBNYELHQ-XDJHFCHBSA-N 437.559 4.086 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(c3ccc(F)cc3)C2=O)c(C)n1-c1ccc(Cl)cc1 1276052380 YCVSXZZTZAJZLD-JOCHJYFZSA-N 439.918 4.351 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1 1290373742 DJCWRQDWNGNXBO-BWAHOGKJSA-N 440.547 4.111 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccc(F)cc1 1293846247 PNERUVONCFIQAB-KBMIEXCESA-N 435.543 4.253 10 10 IICE Cc1ccc(N2CCC[C@H](NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2=O)cc1 1294079315 ZHZDTHPYMYOQTI-QHCPKHFHSA-N 429.520 4.140 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCCN1Cc1ccc(F)cc1 1294684351 GXXYRESZQPPFQC-LJQANCHMSA-N 435.337 4.307 10 10 IICE CCN(CC)[C@H](C)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1295390575 QTPXMUNPTLGGAS-SYYKKAFVSA-N 443.636 4.269 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCOc3cccc(Br)c3)ccc21 1357167516 YRVNRYMVXSZGOB-UHFFFAOYSA-N 445.357 4.476 10 10 IICE O=C(C[C@@H]1CSCCS1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1439873091 MAKFXLWHBSPABK-CYBMUJFWSA-N 449.399 4.336 10 10 IICE CC(=O)N1CCN(c2ccc(CNc3nc4cccc(OC(F)F)c4s3)cc2)CC1 1458361295 AQBSKBOFQUCCRE-UHFFFAOYSA-N 432.496 4.178 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c(C)n1-c1cccc(Br)c1 1464901595 YLMWVJNZVXBOCQ-ZBFHGGJFSA-N 446.389 4.376 10 10 IICE C[C@@H]1Nc2ccnn2[C@H](C)[C@@H]1CCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1465532849 RJCPJUWDFZXNST-PFRQMTDMSA-N 447.530 4.041 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4cc(Br)ccc4[nH]3)CC2)cc1 1466209246 YEHMTNJIWPCUCJ-UHFFFAOYSA-N 428.330 4.292 10 10 IICE CC[C@]1(C)CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1497630406 AVSJFHMPBLNCTE-OXJNMPFZSA-N 437.635 4.164 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N(C)Cc1cc(Br)cs1 1510678849 QRWLBCRCHSMRFX-UHFFFAOYSA-N 434.407 4.470 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CC(=O)Nc2cccc(Cl)c2)CCCC1 1525528287 JLZGWOSAHBNWJB-UHFFFAOYSA-N 439.943 4.279 10 10 IICE Cc1cnc(Cl)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1537393378 INVHHLAIZJWLLQ-DHDCSXOGSA-N 435.933 4.413 10 10 IICE Cc1cnc([C@H](C)CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1538119368 RGQFPBVIGUWHQQ-GFQQVXNGSA-N 449.598 4.102 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2cc(F)ccc2C1 1544914592 JQFGCZCFVIZEDY-YBFXNURJSA-N 444.528 4.141 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1cc(C)ccc1C(C)C 1546151908 LGNHBYNXQSFMGM-MRXNPFEDSA-N 433.932 4.447 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@H](C)C1 1555537097 YHCKAUGXGUIKTJ-PGRDOPGGSA-N 436.604 4.337 10 10 IICE C[C@H](NC(=O)c1cccc(Br)c1I)c1ccccc1O 1557967450 CQNOLBNCCLEACR-VIFPVBQESA-N 446.082 4.250 10 10 IICE Cc1cc(CN2CCC(NS(=O)(=O)c3ccc(F)cc3)CC2)ccc1N1CCCCC1 1559610159 AILQGAAAKNHEFU-UHFFFAOYSA-N 445.604 4.067 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC3(C=Cc4ccccc4O3)CC2)N(C)C)cc1 1565453055 QUMAOQKGCXKKGD-HSZRJFAPSA-N 434.584 4.005 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3c(F)ccc(Br)c3F)CC2)cc1 1566562116 DCKIQKWSKSRISA-UHFFFAOYSA-N 439.300 4.017 10 10 IICE CN(CCC(F)(F)F)[C@H](CNC(=O)Cc1ccc(O)c(O)c1)c1ccc(Cl)cc1 1568970035 MHGJOWIRDLFRAX-MRXNPFEDSA-N 430.854 4.035 10 10 IICE Cc1cc(C(=O)N2C[C@@H](O)C[C@@H]2c2ccccc2)c(C)n1-c1ccc(Br)cn1 1570266377 NJLVSFYAPQQZCP-AZUAARDMSA-N 440.341 4.200 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(CCN4[C@@H](C)CC[C@@H]4C)CC3)c2C)c1 1584484221 FTKUDMRGCJXHNQ-VXKWHMMOSA-N 436.644 4.342 10 10 IICE O=C(CN1CCC[C@H]1C(=O)NCc1ccco1)Nc1ccc(N=Nc2ccccc2)cc1 1615466317 WXBKUKVHQFERMS-QFIPXVFZSA-N 431.496 4.414 10 10 IICE CCO[C@@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1616610928 XVPVMRJUPWOVDF-JOCHJYFZSA-N 439.629 4.358 10 10 IICE CCOCc1nnc(N2C[C@H](C)C[C@@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616731567 PGDNHCNJJNNKLJ-QUCCMNQESA-N 429.634 4.041 10 10 IICE COCc1nc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(-c2ccccc2)s1 1616867290 UEVDFEQGHGKGIA-FQEVSTJZSA-N 438.597 4.055 10 10 IICE Cc1ccc(C)c(N2N=C(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CCC2=O)c1 1628604557 BOUVUSGQDJKRAE-UHFFFAOYSA-N 432.568 4.339 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccc(C(N)=O)cc3)CC2)c(C)n1-c1cccc(C(C)C)c1 1629584346 CWCCULNEKRWJSG-UHFFFAOYSA-N 444.579 4.279 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@H](Oc1ccc(Br)cc1F)c1ccccc1 1633595406 UYNZNGURWGIMCI-HXUWFJFHSA-N 446.272 4.436 10 10 IICE CCOC(=O)c1nc(N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc(C(C)(C)C)n1 1639729560 YURMGHMMMHRTOV-HXUWFJFHSA-N 440.588 4.202 10 10 IICE COc1cccc(Nc2ccccc2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1646435718 UFPIOPUELWKBMT-UHFFFAOYSA-N 431.536 4.330 10 10 IICE Cc1cc(C(=O)Cn2nc(Br)c(=O)c3ccccc32)c(C)n1-c1ccccc1 1651889419 JUTPFYUNVJCAAT-UHFFFAOYSA-N 436.309 4.449 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC[C@H]([C@@H](O)c3ccc(Br)cc3)C2)c1O 1654609287 SIHQREIZQIHTML-YWZLYKJASA-N 436.321 4.442 10 10 IICE C[C@@H](N[C@H](CF)c1ccc(F)cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1655389545 MJWZDFJXWYQCES-SPLOXXLWSA-N 434.442 4.229 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3ccc(Cl)cc3)cc2F)C[C@H](C)O1 1658641040 XAMTZKBAVMGDPQ-IRXDYDNUSA-N 447.982 4.234 10 10 IICE Cc1cc(F)ccc1[C@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683017965 APBDMJKGDOLXSD-OAQYLSRUSA-N 433.474 4.296 10 10 IICE C[C@@H]1N(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCOC1(C)C 1726759640 BAYRWQDJVFKTTN-JKSUJKDBSA-N 437.635 4.162 10 10 IICE O=C(CCCCCC(=O)N1CCCCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866219455 VWQZUJMACIVFBV-UHFFFAOYSA-N 432.520 4.364 10 10 IICE O=C(NOCCCNCc1ccc(O)c(O)c1)OCC1c2ccccc2-c2ccccc21 1928761750 YQENDOOEAPIFNT-UHFFFAOYSA-N 434.492 4.048 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2cccc(Br)c2O)C12CCC2 2120833488 YXLJHVTWXJGEDK-HNNXBMFYSA-N 425.367 4.424 10 10 IICE CC[C@H]1CC[C@@H](NCc2c(Br)ccc(OC)c2O)CN1C(=O)OC(C)(C)C 2236056600 XBDSVNKDRBVZMT-KGLIPLIRSA-N 443.382 4.431 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)C1=Cc1cccn1-c1ccc(Cl)cc1 2293603111 GPMYZINBIBQWPV-UHFFFAOYSA-N 426.259 4.451 10 10 IICE O=C(NN1C(=O)C(=CC2=Cc3ccccc3OC2)SC1=S)c1ccc(Cl)cc1 2296885526 YPPLXSSCYGNEOO-UHFFFAOYSA-N 428.922 4.205 10 10 IICE COC(=O)CCCN1C(=O)C(=Cc2ccccc2OCc2ccccc2)SC1=S 2314739971 CNHOMXFJOCVEQU-UHFFFAOYSA-N 427.547 4.420 10 10 IICE Cc1ccc(CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)c(O)c1Br 2381140462 KTYYQZREBQYQJY-CQSZACIVSA-N 449.336 4.445 10 10 IICE Cc1cc(C)cc(N2C(=O)N=C(O)/C(=C/c3ccc(I)cc3)C2=O)c1 33247515 ZIJQFXRELLBBJY-YBEGLDIGSA-N 446.244 4.415 10 10 IICE N=C1/C(=C\c2ccc(O)c(Br)c2)C(=O)N=C2SC=C(c3ccccc3)N12 102639000 KMBXPKAPHWMXQS-UJTIYTRRSA-N 426.295 4.459 10 10 IICE CC(=O)c1ccc(N2C(=O)/C(=C/c3ccccc3OCCC(=O)O)SC2=S)cc1 210438655 VNZARQRGTNSTHO-PDGQHHTCSA-N 427.503 4.149 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 732409644 FEWQMILHMNDAKW-RBJLQNAWSA-N 443.463 4.052 10 10 IICE Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799934423 YEHDJOQGVVUWMT-HOTGVXAUSA-N 432.012 4.357 10 10 IICE O=C(CCOc1ccccc1Br)NCc1cc(Br)ccc1O 804736401 RFKQCKUXSXRJLP-UHFFFAOYSA-N 429.108 4.003 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCCCC(=O)c3ccccc3)cc2F)C[C@@H](C)O1 918140326 LBGZROZIKXRCMR-KDURUIRLSA-N 426.532 4.499 10 10 IICE CCOC(=O)c1c(NC(=O)c2nc(OC)cc(OC)n2)sc(C)c1-c1ccc(C)cc1 1124484888 QWXHXDPQLVMFGO-UHFFFAOYSA-N 441.509 4.268 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(F)c(C(F)(F)F)c3)cc2F)CC1 1125907528 LOANZEVBRYLVIM-UHFFFAOYSA-N 427.417 4.056 10 10 IICE Cc1c(CNC(=O)OC(C)(C)C)c(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)nn1C 1130770417 YEBDPCGWKNLFRU-UHFFFAOYSA-N 437.544 4.413 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)CCc1cnn(C)n1 1160647127 ZMYWIMHRPICOGW-LJQANCHMSA-N 431.462 4.059 10 10 IICE COc1ccnc(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1F 1167189037 MJUFXXHNURETNR-UHFFFAOYSA-N 432.293 4.329 10 10 IICE CN(Cc1ccc(Cl)cc1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229782609 XFIIDBCZCSAVDN-UHFFFAOYSA-N 444.309 4.450 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251750623 GYNIBFCDBCSBTP-UHFFFAOYSA-N 430.282 4.108 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3ccc(Cl)cn3)CC2)c(C)n1-c1ccccc1 1253807541 FNTJIDZLJBSMLB-UHFFFAOYSA-N 437.975 4.217 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CCN2C(=O)OC(C)(C)C)cc1 1255098078 OFTVMFKZJXTHKZ-HXUWFJFHSA-N 442.560 4.067 10 10 IICE CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)N1CCOc2cc(N(C)C)ccc21 1265456910 BJRBEYQPIQFUFH-SANMLTNESA-N 445.563 4.015 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCC1(C(F)(F)F)CCCC1)c2[N+](=O)[O-] 1287419840 ODLMFLXASCIALM-UHFFFAOYSA-N 446.381 4.223 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccn(CCc3ccccc3)n2)cc1 1292382157 OAFVZBNWRLZEBO-XMMPIXPASA-N 432.568 4.013 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](CC(C)C)c3ccccc3C)CC2)cc1 1293385569 HBROEGRNNJZQCE-AAJFVQQISA-N 449.595 4.112 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc3cnccc3c2)NC(=O)OC(C)(C)C)cc1 1293792409 GKGIGRBQGSUXMU-QHCPKHFHSA-N 448.567 4.226 10 10 IICE CCCCCN(c1nnc(-c2cnccn2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1294114377 UXZQBGCKWMKKLO-UHFFFAOYSA-N 449.603 4.025 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C 1297793007 JJWQVVWFXCSLBA-NOVUIFNWSA-N 425.602 4.110 10 10 IICE CCC(O)(CC)C(C)(C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1302734089 OTQKPYKARVQMBL-SQFISAMPSA-N 440.656 4.175 10 10 IICE C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1 1313171711 XMZUVTAFKLCCJD-SFHVURJKSA-N 444.620 4.462 10 10 IICE CC(C)(C)n1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1Br 1355287774 MOUOVBVMFXJILE-UHFFFAOYSA-N 439.317 4.363 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1361048669 FZPNTYWDXPZKIU-MOPGFXCFSA-N 448.615 4.313 10 10 IICE COC(=O)CCCOc1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1443739333 DJYWCUMNTICQGS-UHFFFAOYSA-N 434.492 4.491 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)c2C)c1 1451057240 QBTGMAHPHJDTQJ-UHFFFAOYSA-N 439.506 4.447 10 10 IICE Cc1ccc(NC(=O)N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1465127083 VCBDKZXVMZSXSK-UHFFFAOYSA-N 444.535 4.205 10 10 IICE COCCCCn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1504797317 GLFRHKDKHITQGT-UHFFFAOYSA-N 434.588 4.312 10 10 IICE CS[C@@H](C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1505164569 ICQFBHFOHOCRLB-SFHVURJKSA-N 429.634 4.160 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(OCCC(C)C)cc3)cc2F)CC1 1528691799 BMMQVEMJADVDFA-UHFFFAOYSA-N 427.564 4.323 10 10 IICE Cc1cc(C(=O)N[C@H](CCO)c2cccs2)c(C)n1-c1ccc(Br)cn1 1545748225 WQKSHHQMOGKREU-MRXNPFEDSA-N 434.359 4.167 10 10 IICE C[C@@H](Cc1ccc(Br)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1586054450 ISSPTSZTQANQMX-HRAATJIYSA-N 432.406 4.113 10 10 IICE COc1ccc(-n2ccnc2SCC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1 1630181058 SIYSTKDFCPWWEL-SFHVURJKSA-N 438.597 4.095 10 10 IICE COc1ccc(N2CCN(C(=O)NCC(C)(C)c3cccc(Cl)c3F)CC2)cc1F 1634577469 GRXNAMZMDRVGCC-UHFFFAOYSA-N 437.918 4.436 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cn(-c2ccc(Br)cc2)nn1 1639522783 VCYWPMGFWXPHPK-UHFFFAOYSA-N 429.318 4.178 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)cc1 1673892676 ULGTWERHYIIUHU-OALUTQOASA-N 435.572 4.376 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cscn2)n1Cc1ccc(N2CCSCC2)cc1 1706379735 AXYIRZHEOVIPLK-UHFFFAOYSA-N 442.658 4.171 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727907568 LJLHJYUATAEUGJ-RUZDIDTESA-N 434.588 4.128 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1C[C@H]1C[C@@H](OC(C)(C)C)C1(C)C 1729419991 BTDVJFTZQCGRFR-SFHLNBCPSA-N 442.604 4.354 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(CC3CC3)CC2)cc1 1746094486 ZAAAYNAOWHFWKL-UHFFFAOYSA-N 438.664 4.293 10 10 IICE CCN(CCc1cccs1)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1746301770 NRFBFCGXLOVQMM-SFHVURJKSA-N 443.592 4.166 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765021372 NXLQMKBRILBKJI-AUSIDOKSSA-N 425.621 4.283 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4[nH]c(-c5ccc(F)cc5)nc4c3)CC2)cc1 1861869440 HFVOOBTWZLUBNI-UHFFFAOYSA-N 430.483 4.340 10 10 IICE O=c1cc(CNc2ccc(Nc3ccccc3)cc2)n(Cc2ccccn2)cc1OCCO 1870791723 IVHIWIURUFKEGW-UHFFFAOYSA-N 442.519 4.018 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)[C@@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 2044751721 DQJXJKACXVJPAW-ZEQKJWHPSA-N 438.616 4.183 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C3CCC3)c(CN)c2I)c(O)c1 2079013181 GNXXSFLXCQHZLD-SFHVURJKSA-N 437.325 4.227 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](NCc1cc(Br)cc(F)c1O)C2 2193314634 UOMXYRQLWGYAND-QCEMKRCNSA-N 447.320 4.262 10 10 IICE CS(=O)(=O)Nc1cccc(C(=O)N[C@@H](c2ccccc2)c2c(O)ccc3ccccc23)c1 10914218 UFHMNNIQRMBSSZ-DEOSSOPVSA-N 446.528 4.436 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 226881727 LIVRQJJFONDDEK-VUMVONDWSA-N 435.549 4.015 10 10 IICE COc1cc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(SC)cc1OC 768670038 LGOGNXUVOWZGQZ-UHFFFAOYSA-N 441.641 4.248 10 10 IICE COc1cc(O)c(CNCc2ccccc2-c2ccc(Cn3cncn3)cc2)cc1OC 780771261 HMEXDTJHQPGNJX-UHFFFAOYSA-N 430.508 4.006 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC)C[C@@]2(CCOC2)O1 801947558 YUIAUPAQYHDAQC-PXDATVDWSA-N 435.572 4.147 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)NCc1cc(Cl)cc(Cl)c1O 805365611 UYTRVPMXONTUCT-XHDPSFHLSA-N 432.348 4.144 10 10 IICE Oc1c(Br)cc(Br)cc1CN1CCC2(C1)Oc1ccccc1O2 809789866 KNQZTPNGBHBFFN-UHFFFAOYSA-N 441.119 4.291 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@]2(C)CC2(Br)Br)C2CC2)cc1 1124835059 BJDHFLRYIGOADC-INIZCTEOSA-N 430.184 4.140 10 10 IICE COc1cccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)nc2)c1 1136959958 GRNWVRHRGDIPOX-UHFFFAOYSA-N 447.535 4.021 10 10 IICE COc1ccccc1C/C(C)=C\C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438540 NDVYRSWNSILNSK-YULVEUEDSA-N 428.960 4.324 10 10 IICE CCN1CCC(n2nccc2NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1292800847 YNJZSCRCEWQUCJ-UHFFFAOYSA-N 433.556 4.321 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)cc1 1293125571 MXIONQOYTCAELV-NRFANRHFSA-N 449.595 4.476 10 10 IICE CCON1CCC(CC(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CC1 1293125903 ULMSNRBYGUBXLD-UHFFFAOYSA-N 425.573 4.348 10 10 IICE CCOc1ccc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 1293794300 ZEUWXQCNHPPGEG-JOCHJYFZSA-N 441.572 4.076 10 10 IICE Cn1cc(Nc2nnc(COc3ccccc3F)n2CCCSc2nccs2)cn1 1298841115 SYDSXJYUWVUMMC-UHFFFAOYSA-N 445.549 4.112 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nc(NCc2ccco2)ncc1Cl 1349106553 NCOLETNVNQHBFX-UHFFFAOYSA-N 425.920 4.208 10 10 IICE CNC(=O)Nc1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1440898769 JTNOLLFLUXSCNN-UHFFFAOYSA-N 442.317 4.255 10 10 IICE C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cc2cc(O)c(O)cc2s1 1443045264 NOOKVSPGZJCOST-CQSZACIVSA-N 439.537 4.060 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OC)c(Br)c(OC)c2)cc1F 1443767607 GDSBBPROCOPIOA-UHFFFAOYSA-N 439.325 4.382 10 10 IICE CC(=O)N1CC[C@@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c2ccccc21 1446195284 VVYJKDHFJUHPIG-HSZRJFAPSA-N 429.520 4.443 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(C4CCCCC4)C3=O)cc2Cl)C1 1469961667 XFQRAYMRPIEWCP-LAUBAEHRSA-N 447.023 4.309 10 10 IICE Cc1ccc([C@H]2CCCCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)o1 1471370030 OTTOUPWFIAFBDT-JOCHJYFZSA-N 438.572 4.117 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1500619373 PWVUZSQAZPHBAC-FQEVSTJZSA-N 437.588 4.394 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C)C(C)C 1517811150 CIMLQWNMYPQVKO-WMZHIEFXSA-N 437.588 4.249 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)c3ccc(Br)c(C)c3)C2)cc1 1528317883 PKWPPPASTFWKAV-KRWDZBQOSA-N 431.374 4.439 10 10 IICE CO[C@@H](C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)c1ccc(Br)s1 1529277051 CXQVVXJQLORFJY-FZKQIMNGSA-N 425.392 4.320 10 10 IICE CCOC(=O)c1c(NC(=O)c2cccc(-n3cncn3)n2)sc(C)c1-c1ccc(C)cc1 1531343134 TXZDZCGIUOXRSS-UHFFFAOYSA-N 447.520 4.437 10 10 IICE COC[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(F)c(F)c1 1535396107 HHMBKTCFPDYCGY-OAQYLSRUSA-N 428.479 4.311 10 10 IICE C[C@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCC1=O 1539360781 HAKPITNIENXGDH-QWHCGFSZSA-N 427.302 4.103 10 10 IICE Cc1ccnc(Nc2cccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)c2)n1 1542490349 LEIGQTZBQIGUQZ-DEOSSOPVSA-N 445.567 4.416 10 10 IICE COc1ccccc1CCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1544268652 MNLYKKBVCBRXBW-NRFANRHFSA-N 441.572 4.076 10 10 IICE CCO[C@@H](CCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1547850446 YPTNWNGOCOQCTF-FCHUYYIVSA-N 428.577 4.457 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)c1ccc(OC)cc1 1556426462 NTMYNJNSLTYXOY-UHFFFAOYSA-N 440.540 4.047 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnc2c(c1)c(C1CC1)nn2-c1ccccc1 1568735938 OOLGRTALFTXDGR-UHFFFAOYSA-N 433.508 4.419 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCO[C@H](c3cnn(C)c3)C2)c(C)n1-c1ccc(Cl)cc1 1569688113 HCUQDGFARROOET-UNMCSNQZSA-N 426.948 4.060 10 10 IICE CCOC(=O)c1nc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)sc1C 1596244786 UUAXKMCGVCEQBY-UHFFFAOYSA-N 427.526 4.109 10 10 IICE COc1ccc(OC)c(CCCNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1610944377 MVBHSJHMYQCKPE-UHFFFAOYSA-N 434.536 4.215 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2CC2(C(C)C)CC2)c(C)n1-c1ccccc1 1611933510 HASWDLLNPIEMBA-SFHVURJKSA-N 448.615 4.489 10 10 IICE O=C(N[C@H](C(=O)NCCCSc1nccs1)c1ccccc1)OCc1ccccc1 1616241740 PYEINWKAPLGCHI-IBGZPJMESA-N 441.578 4.409 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1oc2ccccc2c1CSC 1623928009 APSNTBRMFKGYES-UHFFFAOYSA-N 433.913 4.470 10 10 IICE CC(=O)NCc1ccc(-c2nc(NC(=O)c3ccc(N=NC(N)=O)cc3)sc2C)s1 1628356866 MCQZZWRWYKFODE-UHFFFAOYSA-N 442.526 4.231 10 10 IICE COc1cccc(-c2noc([C@@H](C)NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)n2)c1 1629147233 PQISXOGUMPFPNX-MRXNPFEDSA-N 444.491 4.456 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](C(=O)Nc3cn[nH]c3)c3ccccc3)c2C)c1 1632057818 KOEMKIHIYSYWIN-HSZRJFAPSA-N 427.508 4.235 10 10 IICE CCOc1ccccc1[C@H](CC(=O)NCc1ccc(OC)cc1O)NC(=O)OC(C)(C)C 1633926801 MMIOXOPIPAMYRF-IBGZPJMESA-N 444.528 4.072 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC[C@@H](O)c1ccccc1 1635488934 CCNAPZYSOKGPEV-HSZRJFAPSA-N 426.557 4.279 10 10 IICE CC(C)(CC(=O)NCc1cc(Cl)cc(Cl)c1O)NC(=O)OCc1ccccc1 1637134726 QDWNYHSTAJXTQT-UHFFFAOYSA-N 425.312 4.410 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1CC[C@H](Cc2ccccc2)O1 1639827111 GIEVADCUUXEELD-VWNXMTODSA-N 438.568 4.165 10 10 IICE Cc1ccc([C@H]2[C@H](C)CCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1644683111 ZAKDXRFCDIANNW-FQRUVTKNSA-N 439.575 4.060 10 10 IICE COC(=O)[C@](C)(Cc1ccc(F)cc1)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1651014524 DVIQNODQQXJCRB-DEOSSOPVSA-N 426.463 4.277 10 10 IICE COC(=O)c1ccc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)o1 1651743163 OUNKAJFSOCLSTE-INIZCTEOSA-N 426.494 4.084 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)cc1F 1657763982 ZCXMLTGQQITABT-RBUKOAKNSA-N 439.575 4.101 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC1CN(c2ccc(C(F)(F)F)cc2)C1 1684247099 JPZDNLOMCIEEHE-UHFFFAOYSA-N 432.490 4.336 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccoc2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1726875457 MFWIWPVMJMSFFH-QGZVFWFLSA-N 441.551 4.353 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)C[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1761004712 YXUOLNZBPVPXMF-NHCUHLMSSA-N 439.648 4.216 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)CS(C)(=O)=O 1764107774 RUZKYJVJMDAJLA-SFHVURJKSA-N 443.617 4.022 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O 1764143717 GGRKWGKFKCGGJC-OAQYLSRUSA-N 436.604 4.280 10 10 IICE CCN(CC)[C@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O)c1ccco1 1764929240 UGAYXZTUPNKVEG-OAQYLSRUSA-N 448.571 4.302 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC(NC(C)C)CC3)nnc2C(C)(C)C)cc1 1766613146 DHNFDTGRELOXHD-UHFFFAOYSA-N 426.653 4.437 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC=CCO1 1768106038 ZRMSTYFEYJYJET-QFIPXVFZSA-N 435.572 4.170 10 10 IICE COC[C@@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1769397027 WTEUULQSJDKZQS-HXUWFJFHSA-N 425.621 4.259 10 10 IICE CCCN(CCC)C(=O)COc1ccc(/C=C2/C(=O)N(CC(C)C)N=C2CC)cc1OC 1865675763 YUAQPUINYYUVQD-XSFVSMFZSA-N 443.588 4.370 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(Br)cc1F 1891660673 KAHXCPHVKKGHCY-YOEHRIQHSA-N 439.350 4.055 10 10 IICE Oc1cccc(Br)c1Cn1nc(C2CCC2)cc1I 2070168860 KGSMLRXMDFWHSR-UHFFFAOYSA-N 433.087 4.272 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@@]21CNCc1cccc(Br)c1O 2089360181 VCOYUNABVACMHW-MGPUTAFESA-N 425.367 4.424 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1Br 2188882058 DIGWJFYXHGJLDC-GHTZIAJQSA-N 427.342 4.258 10 10 IICE COc1ccc(Br)c(CNC[C@H](NC(=O)OC(C)(C)C)c2ccco2)c1O 2236052678 KJELOKSNQBVJPZ-AWEZNQCLSA-N 441.322 4.112 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1ccccc1C(=O)O 2295927415 HFWQABYFINSMAW-UHFFFAOYSA-N 446.937 4.268 10 10 IICE Cc1cc(C)cc(Oc2nc3c(C)cccn3c(=O)c2C=C2SC(=S)N(C)C2=O)c1 2314507494 KGJYWXOASWUTRV-UHFFFAOYSA-N 437.546 4.243 10 10 IICE COc1ccc(C=C2SC(=S)N([C@H](C)c3ccccc3)C2=O)c(C(=O)O)c1OC 2314929468 MXHCUPKQUMRYQM-GFCCVEGCSA-N 429.519 4.364 10 10 IICE Cc1ccc(CN[C@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)c(O)c1Br 2352691473 GASRIXIQHDPCBS-QRWLVFNGSA-N 425.367 4.485 10 10 IICE Cc1ccc(N2NC(=O)/C(=C\c3cccc(OC(=O)c4cccs4)c3)C2=O)cc1Cl 1161459 VSDOZRVVYWGAPM-GZTJUZNOSA-N 438.892 4.391 10 10 IICE CCOC(=O)c1ccc(N2N=C(C)/C(=C/Nc3c(C)nn(-c4ccccc4)c3C)C2=O)cc1 59858613 OHYMPUFLQZNKKG-JCMHNJIXSA-N 443.507 4.384 10 10 IICE CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C\C(Cl)=C/c2ccc([N+](=O)[O-])cc2)SC1=S 103946501 PRYFAIRNMBRKEO-SBOOWBEWSA-N 426.903 4.028 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C/NCCc2ccccc2)cc1 104614970 GLLDRGKFRYTSNX-HAVVHWLPSA-N 442.475 4.071 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3cc(Br)ccc3O)CC[C@H]2C1 401125644 NPKMFGUVOKOFEQ-LXZKKBNFSA-N 425.367 4.280 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(Br)c1 726503198 IOTUNGGQFKNWSP-UHFFFAOYSA-N 435.337 4.019 10 10 IICE CCOc1ccccc1[C@H](CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)NC(C)=O 728264382 DHFLLOJGBZQWDC-VWLOTQADSA-N 447.579 4.419 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCSc2nccs2)C[C@@H]2CCCC[C@H]21 733975018 VIWPXQCYGWEGMD-XHSDSOJGSA-N 425.620 4.310 10 10 IICE COc1ccc(Cl)cc1CNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743539001 XGLCJHJSFJJNHR-MRXNPFEDSA-N 439.890 4.418 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCc1c(O)ccc2c1CCCC2)c1ccccc1 743675766 YHBOSWPUWOAJNF-NRFANRHFSA-N 439.556 4.336 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 743808125 LXLSBHQUKYWGML-SJORKVTESA-N 432.314 4.078 10 10 IICE C[C@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)cc(F)c1O 757639035 UGWHHISQSHRFKI-NHYWBVRUSA-N 449.299 4.357 10 10 IICE COc1cc(F)c([C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1OC 773148558 YDITZCOKIKFMRA-GOSISDBHSA-N 427.564 4.226 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(Br)c([N+](=O)[O-])c1 806367964 TYTQDZFZMXQZCI-UHFFFAOYSA-N 445.067 4.147 10 10 IICE COc1cc(/C=C2/C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)ccc1OCCC(C)C 1084047160 HBBKWODPVQHJBI-UYRXBGFRSA-N 436.508 4.403 10 10 IICE Cc1ccccc1-n1c(C)cc(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)c1C 1084196152 LFXHFSDIRXGSMO-AQTBWJFISA-N 433.508 4.373 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)ccc1NC(=O)OC(C)(C)C 1132899028 KFWBZHULHLKORT-UHFFFAOYSA-N 438.572 4.024 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N(CC(F)F)CC(F)F 1134086341 ALTCURNTYBIAQX-YRNVUSSQSA-N 440.509 4.088 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc3c(c2)nc(C)n3[C@@H](C)CO)c1 1140727222 LRCQNYOFFHEONT-INIZCTEOSA-N 430.508 4.370 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H]3c3ncc(Br)cn3)cc2)CC1 1198010175 FGZVWMRNRQQCCQ-HXUWFJFHSA-N 431.378 4.191 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](c1ccc(F)c(Cl)c1)C1CC1 1251189825 HKEIGBARQWYSNU-QFIPXVFZSA-N 431.939 4.391 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@]2(C)Cc2ccc(F)cc2)N(C)C)cc1 1256236649 JHTJNDVBVCCJHK-ILBGXUMGSA-N 426.580 4.301 10 10 IICE CCO[C@H]1C[C@@](CO)(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1296496711 QATYROVLMJONFZ-UGKGYDQZSA-N 449.389 4.153 10 10 IICE CN(Cc1ccccc1)c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1298346204 USBQVCHGAOKWBV-GOSISDBHSA-N 429.615 4.447 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1C[C@@H]1CCCO[C@@H]1C(C)(C)C 1298363919 OLNNWVBGUXWMDL-UGKGYDQZSA-N 437.588 4.467 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](CO)c2ccccc2C(F)(F)F)CCCC1 1303995068 KWOFVTZVIJXQSN-HXUWFJFHSA-N 446.469 4.397 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C[C@@H](C)O1 1306397390 MLWFEHFXJZMOFP-WIYYLYMNSA-N 437.588 4.127 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 1312883991 GAPCTJIJFUIEQU-XLIONFOSSA-N 441.538 4.383 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)cc1 1355695576 DAVMGVZKTGCNLZ-UHFFFAOYSA-N 445.479 4.282 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3csc(-c4cccs4)n3)cc2F)CC1 1359919811 CJNCSORYFLZAGV-UHFFFAOYSA-N 430.574 4.083 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1450410422 MGCIEVVMQGCNAB-SJLPKXTDSA-N 429.521 4.101 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CC3)C3CCCCC3)cc2F)C[C@@H](C)O1 1473148009 XTPQNCJSYZUTLW-KDURUIRLSA-N 431.596 4.100 10 10 IICE CC(C)[C@@H](Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1508866615 KOVCTYKJCPKYSD-HSZRJFAPSA-N 442.567 4.441 10 10 IICE Cc1cc(CC(=O)NCCOc2ccc3c(c2)OCO3)c(C)n1-c1ccc(Cl)cc1 1515380509 ORYDXWFZOHLVIF-UHFFFAOYSA-N 426.900 4.214 10 10 IICE CCN(CC)c1ccc2cc(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)c(=O)oc2c1 1517328809 UVSXXJBZMXFGJF-UHFFFAOYSA-N 449.551 4.000 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnn(-c2cccc(Br)c2)c1 1525761434 BQEVACSMBWWUEC-INIZCTEOSA-N 441.373 4.370 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3cccc(NC(=O)OC(C)(C)C)c3)C2)cc1 1529706365 GNKDVEOIGJYXHN-IBGZPJMESA-N 439.556 4.227 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2c(c1)OC(F)(F)O2 1531504170 PSGFFZCXGZXPLV-CYBMUJFWSA-N 426.366 4.008 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CCCC2 1533779165 ZCXNVLIUYYRVSB-CQSZACIVSA-N 444.528 4.323 10 10 IICE Cc1ncsc1CN(C)c1nnc(C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1542074483 JNYYHPFNHPEUFI-UHFFFAOYSA-N 442.658 4.404 10 10 IICE C[C@@H](CS(=O)(=O)c1ccc(F)cc1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1542412409 ZIHDYFPVJCMGOM-SFHVURJKSA-N 446.588 4.321 10 10 IICE CCCCN1CCCC[C@H]1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1547043768 OJZPACUIIOGCMH-QHCPKHFHSA-N 448.615 4.261 10 10 IICE Cc1cc(CC(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c(C)n1-c1ccccc1 1556612153 RDFPBFIFJOFGSZ-NRFANRHFSA-N 432.442 4.385 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCn3ccc4cc(Cl)ccc43)CC2)cc1 1564716388 BFVZWRMXCBXNGP-UHFFFAOYSA-N 426.948 4.225 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC/C=C/CNC(=O)OC(C)(C)C)c2C)c1 1564856626 RPODFEPANQYRPR-BQYQJAHWSA-N 426.561 4.283 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CC[C@@H](CNC(=O)OC(C)(C)C)C3)ccc21 1570390798 YEVPTMWCIXWKJH-UYAOXDASSA-N 443.588 4.328 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ncccc3Cl)c2C(F)F)cc1 1585443699 CMROXKWFLOWETC-UHFFFAOYSA-N 449.889 4.075 10 10 IICE CCc1nnc(N2CCC(OC(C)(C)C)CC2)n1Cc1ccc(N2CCSCC2)cc1 1613981348 LKHSKCKCFPEASL-UHFFFAOYSA-N 443.661 4.226 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CC(F)(F)CO1 1617893928 WCNIMERTPFYCTF-IBGZPJMESA-N 433.547 4.236 10 10 IICE CCN(CC)C(=O)c1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1625364661 AWALIMNNIZWSRV-UHFFFAOYSA-N 431.536 4.319 10 10 IICE C[C@H](NC(=O)c1ccc(NCCc2ccccn2)cc1)c1ccc(N2CCOCC2)cc1 1626978153 JVJMZVCGRNAUNC-FQEVSTJZSA-N 430.552 4.064 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1c2ccccc2CCN1C(=O)OC(C)(C)C 1629932029 YACZRMMPBQGJGN-JOCHJYFZSA-N 437.540 4.013 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1C(=O)c2ccccc2C1=O 1631530934 BAVXCUWLZOCKMO-GOSISDBHSA-N 428.488 4.168 10 10 IICE Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(I)cc1Cl 1632681955 YFTSMVBPAOCSJR-JTQLQIEISA-N 445.684 4.025 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 1636239999 VUGBAZANRYIYNW-UXHICEINSA-N 432.609 4.366 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COc3ccccc32)c(C)n1-c1ccc(Br)cn1 1637177449 CEMMEASASCAZBH-OAHLLOKOSA-N 426.314 4.158 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCO[C@H]3c3ccc(Cl)cc3)CC2)cc1 1637658650 MSRSZLUELHGWAR-YADHBBJMSA-N 429.948 4.101 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](C(=O)NCc3ccccc3)C2)c(C)n1-c1ccc(Cl)cc1 1638811441 XPQHZOFDNRSBNE-NRFANRHFSA-N 449.982 4.455 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3cccs3)n2)c(C)n1-c1ccc(OC(F)F)cc1 1640747008 JLMILAVCDZCMLP-UHFFFAOYSA-N 429.452 4.293 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccc(C(F)(F)F)cc1 1646164018 ZIDREZPMMXMEOJ-IBGZPJMESA-N 431.414 4.152 10 10 IICE CO[C@@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1650996388 VNIFMPDZNGEYHL-KRWDZBQOSA-N 446.267 4.045 10 10 IICE COc1ccc(N2CCN(CCCc3ccc(Br)cc3OC)CC2)cc1F 1652874082 QJQOLMJUAIJPKK-UHFFFAOYSA-N 437.353 4.360 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)c2cccnc2)c(C)n1-c1ccc(Br)cc1 1653443328 FBAYJRIVFWBQHH-FQEVSTJZSA-N 428.330 4.057 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cc(I)cn3)c2C)cc1C 1656307993 JBYOXXHEFFJKCT-UHFFFAOYSA-N 433.293 4.395 10 10 IICE Cc1cc(CCNC(=O)N2CCCN(C(=O)OCC(C)C)CC2)c(C)n1-c1ccccc1 1684318800 NZNCJEKAPICIAR-UHFFFAOYSA-N 440.588 4.147 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc2c(c1)CCCN2C 1698150061 PPFBLWZKTAIRMV-PMACEKPBSA-N 441.620 4.059 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cccnc4)n3CCC(C)(F)F)CC2)cc1 1711865305 QIDMDZFYEHKGHW-UHFFFAOYSA-N 442.514 4.111 10 10 IICE CSC1(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCC1 1731053508 YJTRHVCZWUNWBN-UHFFFAOYSA-N 429.634 4.160 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1 1747325661 FCIJSODNTFMBNP-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)C[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1761004713 YXUOLNZBPVPXMF-OYRHEFFESA-N 439.648 4.216 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@H]1CCOC1 1766547060 JKUDOUZOOAOLCE-NRFANRHFSA-N 437.588 4.252 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@H](C(F)F)C2)cc1F 1768495208 YJXVDQIGWJSAKK-LPHOPBHVSA-N 437.510 4.255 10 10 IICE COc1ccc(-c2nnc(N3CCC(F)(F)C3)n2CCCSc2nccs2)cc1 1768496005 WEDWVWGMZUKWCX-UHFFFAOYSA-N 437.541 4.438 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCSC(F)(F)F)CC2)cc1 1768703147 CYQKKGVDEOSUHA-UHFFFAOYSA-N 443.539 4.380 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@@H]1OC 1771066139 MLRNFSVFLRCHPJ-OFNKIYASSA-N 437.588 4.250 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1\C(=O)N(Cc2cccc(F)c2)N=C1C(F)(F)F 1865678420 LLTQPUXUKHIBJR-NVNXTCNLSA-N 438.377 4.196 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(NC(=O)C(F)(F)F)cc1 1866037375 UXNWUIVMDJQGIC-UHFFFAOYSA-N 438.361 4.215 10 10 IICE CC(C)(C)OC(=O)N1CC(=O)C[C@H]1c1cc(Br)cc(Br)c1O 1951977773 PCSRLTNXMUSVMV-LBPRGKRZSA-N 435.112 4.168 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2cc(Br)ccc2O)C1 1952459877 RRXKASSNZPPKMB-PBHICJAKSA-N 434.286 4.329 10 10 IICE CCN1CCc2cc([C@H](NC)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044754980 RSVJHOMFXVIURK-VWNXMTODSA-N 439.600 4.440 10 10 IICE CCc1nn([C@H](c2ccc(OC)cc2O)C(C)(C)C)c(I)c1C=O 2079978736 GELHHWLZSWCVQI-MRXNPFEDSA-N 442.297 4.212 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1cc(Br)cc(F)c1O)C2 2103433041 CJPHNMFTRRMRMM-QKDCVEJESA-N 429.330 4.314 10 10 IICE CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1OC)c1cc(Br)ccc1O 2146729552 XMPFRXZKUKWLNR-LZLYRXPVSA-N 443.382 4.220 10 10 IICE CC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)SC1=S 2296881827 BSNTVMXKBADNQE-CYBMUJFWSA-N 432.479 4.228 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccccc2O)SC1=S)Nc1nccs1 2314837293 QNZFBWDUDHIDPS-UHFFFAOYSA-N 433.580 4.249 10 10 IICE CC[C@@H](NCCCOC1CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2362418897 AUJQYJWQMMJUFG-QGZVFWFLSA-N 443.382 4.221 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4ccc([N+](=O)[O-])cc4c3=O)c2C)cc1C 8761505 QGULXEPDDZFDAB-UHFFFAOYSA-N 430.464 4.212 10 10 IICE Nc1ccc(-n2nnc(S(=O)(=O)c3ccc(F)cc3)c2-c2ccc(Cl)cc2)cc1 11730594 IAZQEVLWRPLORC-UHFFFAOYSA-N 428.876 4.142 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccc(F)cc3)C2=O)ccc1O 15046245 YYNJLZVFUYDSCO-SJWFJVLYSA-N 446.525 4.158 10 10 IICE O=C(NN1C(=O)/C(=C/c2c(Cl)cccc2Cl)SC1=S)c1ccc(O)cc1 16929781 UBFPWEIESCUYKJ-ZSOIEALJSA-N 425.318 4.245 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3/SC(N4C[C@H](C)O[C@H](C)C4)=NC3=O)o2)cc1 34982743 VFYXBXWQEYPVBT-WQWSMTKPSA-N 440.521 4.203 10 10 IICE COc1ccc(-n2c(-c3ccc(S(C)(=O)=O)cc3)cc(CC(=O)OC(C)C)c2C)cc1 45368499 DIAXEKVKEMBQHV-UHFFFAOYSA-N 441.549 4.359 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1CCc1cccs1 727861445 UZYUPOONOLONHR-FLIBITNWSA-N 447.344 4.390 10 10 IICE Cc1cc(C(=O)NCc2nnc(C3CCC3)n2C)c(C)n1-c1cccc(Br)c1 753725762 RQHSMNFINLOYLM-UHFFFAOYSA-N 442.361 4.183 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(F)(F)C1CCN(C(=O)OC(C)(C)C)CC1 773887131 ZGDDDCZCLJSQTF-UHFFFAOYSA-N 439.547 4.384 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1 788975976 UFJDPJKFUFEKKJ-LJQANCHMSA-N 430.552 4.088 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccccc1CN1CCSCC1 806242985 GTHGLGAUEPLCLE-UHFFFAOYSA-N 436.375 4.025 10 10 IICE Cc1ccc([C@@H]2CCCN2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1C 920812508 PJCPGEVLCXYCLI-VWNXMTODSA-N 434.584 4.052 10 10 IICE COc1ccc(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cc1 1134750479 AKOTZQLQVXQNIO-UHFFFAOYSA-N 437.297 4.349 10 10 IICE O=C(Nc1ccc(C(=O)NCc2cc(Cl)ccc2O)c(O)c1)c1cc(F)cc(F)c1 1146232513 MNGKYMQLMJANEN-UHFFFAOYSA-N 432.810 4.212 10 10 IICE CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1160600737 YCUKQPPVGDNBRV-KRWDZBQOSA-N 442.318 4.122 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 1179028841 FAAPQDVQIPJULN-QGZVFWFLSA-N 442.437 4.229 10 10 IICE COc1ccc(N(CC(=O)NCc2ccccc2Cn2cccn2)Cc2cccs2)cc1 1191582297 OBAIRJHWIQECHZ-UHFFFAOYSA-N 446.576 4.325 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](c3ccccn3)c3ccccc3OC)C2)cc1 1225526592 QAHYXGKXMVZRLF-DFBJGRDBSA-N 446.551 4.014 10 10 IICE C[C@@H](CSc1ccccc1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251750501 CKDJECQCARRNAK-INIZCTEOSA-N 435.540 4.124 10 10 IICE CC(C)(C)OC(=O)c1ccccc1CNC(=O)NCc1cccc(Br)c1O 1253715951 OAPURYKVEOWPCP-UHFFFAOYSA-N 435.318 4.109 10 10 IICE Cc1ccc(NC(=O)CS[C@H](C)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1 1276284148 QCPWHSDIXTWOKY-RTBURBONSA-N 427.614 4.177 10 10 IICE CCOC(=O)[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1292382269 ONFDVPUCLVITKZ-IBGZPJMESA-N 433.346 4.414 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)cc1C 1316438274 GYVVHWBFNZJACE-RTWAWAEBSA-N 429.634 4.274 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1316441968 GUMASPIJJBNBIR-LSDHHAIUSA-N 425.649 4.100 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C[C@@H]2CCC3(CCOCC3)CO2)cc1 1350088250 RTXNXDAZKPJYQM-QFIPXVFZSA-N 426.557 4.240 10 10 IICE C[C@@H](Cc1ccccc1F)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1351274662 IVEPQNSINZAGBQ-QIQQCEGHSA-N 446.544 4.304 10 10 IICE CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1353910612 LCEUFRWULCEAMD-NLFFAJNJSA-N 433.596 4.245 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cccc(OCCF)c1 1355829950 CCTAIRIMGZUVRT-LDADJPATSA-N 448.516 4.404 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccccc2-c2ccncc2)c1 1359952803 IFCMQEYBMHBSKM-UHFFFAOYSA-N 436.515 4.493 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1(c2ccccc2F)CC1 1360483738 DWQJWVGISWWOTR-AQTBWJFISA-N 444.528 4.362 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN(C(=O)OC(C)(C)C)C2CC2)cc1 1435073774 GUFOHHCCCRMJFR-UHFFFAOYSA-N 429.483 4.043 10 10 IICE Cc1cc(C(=O)NCc2csc(N(C)C)n2)c(C)n1-c1cccc(Br)c1 1445124179 FXSSKMHBMLKGGA-UHFFFAOYSA-N 433.375 4.309 10 10 IICE C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445878783 BWOKVJAXFUYKGT-RHSMWYFYSA-N 449.960 4.215 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1470969043 OWHZHCHVWCLBKH-LAUBAEHRSA-N 440.588 4.334 10 10 IICE C[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1 1512216902 HLYQMDAIWUYTMV-FQEVSTJZSA-N 425.621 4.378 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1 1512653653 SYQUKGNGBJDPMW-KBMIEXCESA-N 437.588 4.129 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)sc2c1CCCC2 1528728202 MXXJFHWWJOGDSC-CQSZACIVSA-N 432.586 4.312 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@@H](c2ccccc2)C1 1535474866 POMQOCKBRDSHJS-WRDGEJPTSA-N 440.565 4.433 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(C(=O)c4ccccc4)C3)cc2Cl)C1 1539911872 DCVYQPPDRAWRJA-RXVVDRJESA-N 439.987 4.355 10 10 IICE COC(=O)C1CCN(CCCNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CC1 1542949262 XMYPVPAAVNXTFV-UHFFFAOYSA-N 439.600 4.222 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2nc(-c3ccccn3)n[nH]2)cc1 1556614905 HMLPTYKKSVWDRJ-UHFFFAOYSA-N 426.484 4.278 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)c(C)n1-c1ccc(Cl)cc1 1557610194 KGDUGFPTZVJXLS-JOCHJYFZSA-N 427.976 4.340 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(F)cc3NS(C)(=O)=O)c2C)c1 1566853538 KDGDETYVPVKJCY-UHFFFAOYSA-N 429.517 4.474 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1ccnc(Cl)c1Br 1570016691 BOVKXDWXFGJBRX-UHFFFAOYSA-N 428.677 4.460 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(I)ccc1C 1584088995 JCOWRNFGQGGQMT-OAHLLOKOSA-N 436.337 4.335 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cncc(-c4ccc(OC)cc4C)c3)C2)cc1 1584444704 XQUHBBFNYGDIBU-IBGZPJMESA-N 431.536 4.331 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@@H](Oc1cccc(Br)c1)c1ccccc1 1593872899 FWINADMNLMOJDE-FQEVSTJZSA-N 428.282 4.297 10 10 IICE CC(=O)c1ccc(-c2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)o2)cc1 1596684529 QWTWPDYGLMURFQ-UHFFFAOYSA-N 440.446 4.194 10 10 IICE Cc1csc([C@H]2CN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)cc3C)CCO2)n1 1612359742 NJMVDQBIJJDAOK-HXUWFJFHSA-N 440.617 4.167 10 10 IICE O=C(NCCCSc1nccs1)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl 1616240562 BVDRGRXJVUQTFP-UHFFFAOYSA-N 447.895 4.308 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)CC(=O)N(C)[C@@H](C)c1ccccc1 1617372335 BZVIPGOVHRLMQP-IBGZPJMESA-N 431.536 4.198 10 10 IICE CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1628102480 UNURWQRNRVUYSD-MRXNPFEDSA-N 434.964 4.425 10 10 IICE Cc1oc(-c2cccs2)nc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257189 QKBLVBIFZBUWHQ-MRXNPFEDSA-N 431.945 4.465 10 10 IICE CC[C@H](CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)NC(=O)OC(C)(C)C 1635466848 OUFLHNYNHQATGS-LJQANCHMSA-N 444.576 4.361 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2ccc(Br)cc2Cl)cc1 1643684369 GVQLCRIKSZITRI-UHFFFAOYSA-N 440.769 4.118 10 10 IICE CCN(CC(=O)Nc1nc2ccc(F)cc2s1)Cc1cc(Br)ccc1O 1644710478 NDIRDOIGFMUBKP-UHFFFAOYSA-N 438.322 4.364 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C(=O)NC(C)C)C2)c(C)n1-c1ccc(Br)cc1 1647773850 GTHOLJCAKMSULM-QGZVFWFLSA-N 446.389 4.233 10 10 IICE Cc1cc(C(=O)NCCOC2CCSCC2)c(C)n1-c1ccccc1Br 1653379062 RBLBHYKCSNWNAX-UHFFFAOYSA-N 437.403 4.499 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(Cc3ccsc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1654201809 MKSLINHDCTZCHZ-QZTJIDSGSA-N 447.620 4.418 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2CCCn3nccc32)sc(C)c1-c1ccccc1 1654610986 RNMFCUINYVVROV-QGZVFWFLSA-N 438.553 4.160 10 10 IICE Brc1cc(CNCC2(N3CCCC3)CCOCC2)ccc1N1CCCCC1 1655555473 KMBWGEGREOTKKK-UHFFFAOYSA-N 436.438 4.174 10 10 IICE COC(=O)c1cc(CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)cc(C(=O)OC)c1 1660711275 NKTJTLGFFLMIQT-UHFFFAOYSA-N 449.503 4.484 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 1682097283 PBZFJJAOVWIPFD-IFMALSPDSA-N 448.611 4.318 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)[C@H](C)c3ccccc3Br)C2)cc1 1683782791 VHPHQSVJMCFWLY-HZPDHXFCSA-N 432.362 4.439 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCCn2c3ccccc3c3ccccc32)N(C)C)cc1 1685847945 QASUCKZLPISYHO-AREMUKBSSA-N 443.595 4.463 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)[C@@H](C)S(C)(=O)=O 1695341128 GGZNEYZQGNVQRK-IEBWSBKVSA-N 443.617 4.020 10 10 IICE C#CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nccc(C(F)F)n1 1705546380 JQXSIVRNTIXZKX-UHFFFAOYSA-N 447.493 4.198 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1[C@@H]1CCC[C@@H](C(F)(F)F)C1 1707860856 RRTQSZWJBWNIDO-UYAOXDASSA-N 437.510 4.353 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCCO[C@H](C)C2)cc1 1710025523 CTSHFRHZNMMPGJ-HXUWFJFHSA-N 434.588 4.158 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H](C(F)F)C1 1724235438 KYLZUCKZGZUPLC-ICSRJNTNSA-N 433.547 4.424 10 10 IICE COC1CCC(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CC1 1730353955 XXZKOBSKPUDEQR-UHFFFAOYSA-N 426.586 4.478 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCSC3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1742118232 XIALBCCDDKTJEY-IBGZPJMESA-N 425.602 4.065 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@H](c3nccs3)C2)n1Cc1ccc(N(C)C)c(F)c1 1761926511 VVTPNACBZAZITN-DNVCBOLYSA-N 444.580 4.079 10 10 IICE CCCCCn1c([C@H]2CCCCO2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1764012733 YNHKFCQWOMODKP-OAQYLSRUSA-N 431.556 4.184 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C[C@@H](C)O1 1765293036 ITEUPQISLMNMEO-GCJKJVERSA-N 439.629 4.357 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1CC1CCC(C(F)(F)F)CC1 1767111826 HRMVPCQREBVAGT-IIIMJFFVSA-N 438.494 4.493 10 10 IICE CSc1ccc(/C=C2/SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)cc1 1860073435 FMEVATOFAUEUED-GIDUJCDVSA-N 431.516 4.211 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)[C@H](O)c1ccc(N2CCCC2)cc1 1999522242 XHPZGOQCIPCANG-DHIUTWEWSA-N 426.557 4.430 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C=Cc3c(Cl)nc4sccn34)cc2F)C[C@@H](C)O1 2041588375 KAVYDEKLLYAIHM-ZIAGYGMSSA-N 448.951 4.132 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@@]2(NCc2cc(Br)ccc2O)C1 2126055414 LWMCVAYTUJFCHQ-RBUKOAKNSA-N 429.330 4.126 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1O 2236053993 CUHGDJCKFHSOCU-FUHWJXTLSA-N 433.390 4.411 10 10 IICE COc1ccc(Br)c(CN[C@@]23CCC[C@@H]2CN(C(=O)OC(C)(C)C)C3)c1O 2236055672 QZKKRALGJBZQLQ-ZUOKHONESA-N 441.366 4.043 10 10 IICE CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCCOc1ccc(OC)cc1 2297335669 FIAGFRVKISFSRZ-UHFFFAOYSA-N 445.562 4.383 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(CCc2ccc(O)cc2)C1=O)C(=O)O 2314933715 XDIWCGIYBMJCGS-QGZVFWFLSA-N 443.546 4.078 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)cc1OC 2321635426 COKQXFBRRRVEOO-UHFFFAOYSA-N 446.506 4.417 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cn2c(=O)oc3cc(Cl)ccc32)cc1 2927643 IZEWPCTXBMJMOB-UHFFFAOYSA-N 439.899 4.136 10 10 IICE Cc1ccc(C2=NC3(CCN(C)CC3)N[C@@H](c3cc(Br)ccc3O)C2)cc1 65298086 IEYMMXJTHXCUSN-HXUWFJFHSA-N 428.374 4.409 10 10 IICE biogenic CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC(CCCn3ccnc3)CC2)C1 444269546 UOSQELDZTLWUFS-UHFFFAOYSA-N 447.627 4.323 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H](O)c2ccco2)c(C)n1-c1cccc(Cl)c1 763772392 GINBAWMQKJVBTM-CTNGQTDRSA-N 428.916 4.305 10 10 IICE C[C@@H](N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(N2CCOCC2)c(F)c1 776931977 OROWHLNAWLTKPR-XMSQKQJNSA-N 432.543 4.327 10 10 IICE O=C1CCN1c1ccc(NCc2cc(Br)cc(Br)c2O)cc1 798961160 ROMMGHNBIZVDFH-UHFFFAOYSA-N 426.108 4.266 10 10 IICE CC(C)n1cnnc1-c1ccccc1NC(=O)NCc1cc(Br)ccc1O 806340045 MRHZSQUOSIIQST-UHFFFAOYSA-N 430.306 4.316 10 10 IICE Cc1cc(CC(=O)NCCNc2ccccc2[N+](=O)[O-])c(C)n1-c1ccc(Cl)cc1 1124500265 OOUVFNJTIWQEPH-UHFFFAOYSA-N 426.904 4.427 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCCN2C(=O)c3cccc4cccc(c34)C2=O)cc1 1125234637 XDYAPQMQJHANSJ-UHFFFAOYSA-N 443.547 4.379 10 10 IICE C[C@@H](OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ncccc1F 1128411705 LDAHIOXOVNTJMP-PILJQMSFSA-N 434.489 4.256 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2occc2CN2c3ccccc3C[C@@H]2C)cc1 1130744530 CUDDRGGIZHDCHA-IBGZPJMESA-N 433.552 4.448 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@H](C)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1146950108 JEBFHZMODZDMCQ-ZCNNSNEGSA-N 445.604 4.063 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cn(CC(C)C)c2ccccc12 1152402290 VKSLVNXYFCZMMH-UHFFFAOYSA-N 428.916 4.472 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1ccc(OC)c(F)c1 1154565672 HQMNDIAMACBCJG-QFIPXVFZSA-N 442.462 4.415 10 10 IICE CC(C)(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)cc1F 1176174418 CAZMXPUQQQDNOC-UHFFFAOYSA-N 434.442 4.204 10 10 IICE COc1ccc(N(CC(=O)N2CCN(Cc3ccc(C(C)C)cc3)CC2)CC2CC2)cc1 1194466869 KXXYISKYOLJKAN-UHFFFAOYSA-N 435.612 4.379 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CC(=O)c3ccccc3O2)cc1 1254306946 CQCPOKBNCBNJSQ-NRFANRHFSA-N 433.508 4.091 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)C3(c4ccccc4)CCCCCC3)cc2)C1 1264738094 OBYWJOCZSNIXSE-JOCHJYFZSA-N 433.596 4.297 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(N)=O)C1 1291349510 QSAYEHOPKFMYES-IBGZPJMESA-N 434.588 4.100 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291492010 QBLSQGNXMDLEDH-UFYCRDLUSA-N 425.621 4.283 10 10 IICE Cc1sc(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1-c1ccco1 1291755635 IKEGTSUCNZZDLV-HUUCEWRRSA-N 443.544 4.323 10 10 IICE CC[C@@](O)(C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1294858230 BLVTZURWPXUHKS-UGKGYDQZSA-N 437.367 4.077 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2C[C@@H](C)CC(C)(C)C2)cc1 1295416406 ZTHOQHPIJGTHBS-IBGZPJMESA-N 435.620 4.446 10 10 IICE CC(C)NC(=O)c1nnc(N2CCC3(CCCCC3)C2)n1CCCSc1nccs1 1303379015 SUKZWUHZBWSACE-UHFFFAOYSA-N 448.662 4.216 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(c4ccc(F)cc4F)CCC3)cc2F)C[C@@H](C)O1 1357834711 AIPSURXRAVQYGK-IYBDPMFKSA-N 432.486 4.456 10 10 IICE Cc1cc(CCNC(=O)C2(CC(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccccc1 1438176269 DDOYAKBXZBRMKL-UHFFFAOYSA-N 440.584 4.281 10 10 IICE COC(=O)c1cnc([C@@H]2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)s1 1456548553 JXJGJIITYAJPEQ-OAHLLOKOSA-N 427.501 4.106 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCC1(OCCO)CCC(F)(F)CC1 1458493802 HMBRITLJCHSCOX-UHFFFAOYSA-N 434.439 4.195 10 10 IICE Cc1ccc(CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ccccc12 1470448906 CWRURRPGNWZGOY-UHFFFAOYSA-N 425.479 4.262 10 10 IICE CCN(CCC1CCN(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1)CC(C)C 1470773901 RNNGBNHTKPRGIS-QFIPXVFZSA-N 430.637 4.064 10 10 IICE COc1cccc(C2=NO[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)c1 1524936355 ARCPZHGPHNGELM-DEOSSOPVSA-N 433.508 4.076 10 10 IICE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1525761709 GCSURYGLQSHLBD-NNPDTBDGSA-N 435.612 4.108 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CCCN3C(=O)Cc3ccccc3)c2C)c1 1534760405 STOHBTXECHBZSW-VWLOTQADSA-N 429.564 4.252 10 10 IICE C[C@H]1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCC1=O 1539360782 HAKPITNIENXGDH-STQMWFEESA-N 427.302 4.103 10 10 IICE Cc1n[nH]cc1CCCn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1542063573 JOQYYKGHIXPRJQ-UHFFFAOYSA-N 435.620 4.477 10 10 IICE CCOCc1nnc(N(C)[C@H]2CC[C@@H](SCC)C2)n1Cc1ccc(N(C)C)c(F)c1 1548076249 QGNALXKSJGAWHT-ZWKOTPCHSA-N 435.613 4.178 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC3CCC(O)(c4cccnc4)CC3)c2C)c1 1564607556 BTJHHRABVXYWMW-UHFFFAOYSA-N 432.568 4.427 10 10 IICE COc1cc(Cl)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1565882186 SAUVHMJDSJZLER-HXUWFJFHSA-N 447.963 4.410 10 10 IICE CCCN1CCC(N(C)c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC1 1614850837 UARSSTMDHSCPRS-UHFFFAOYSA-N 445.662 4.223 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)CC2CC(F)C2)cc1 1615380624 FCXQDCNIPAFCPF-NYLDSWQDSA-N 429.584 4.251 10 10 IICE CSc1ccc(N2C[C@H](C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2=O)cc1 1616687149 QQKQOJOLMFXINF-HXUWFJFHSA-N 437.609 4.314 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1=CC[C@@H](NC(=O)OC(C)(C)C)C1 1622327886 DIWKQSHTKJCUES-MRXNPFEDSA-N 439.350 4.117 10 10 IICE CC(=O)c1ccc(N(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1625061365 OVDOSFCQGWSQDZ-UYRXBGFRSA-N 442.537 4.283 10 10 IICE Cc1ccc(Nc2nccc(C(F)(F)F)n2)cc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1633818451 ILALOAVRSNBSTA-ZDUSSCGKSA-N 446.429 4.320 10 10 IICE CCCc1nc(C(=O)NCc2cccc(Br)c2O)nn1-c1ccccc1Cl 1634725578 ZAYIUPIJZQJNKC-UHFFFAOYSA-N 449.736 4.271 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(=Cc4ccc(F)c(F)c4)CC3)C2)cc1 1674326422 JCUFLMFAJZWWQE-LJQANCHMSA-N 427.495 4.441 10 10 IICE CCN(CC)C(=O)OC[C@H]1CCCCN1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1683254367 PJEGPYBXVADCEP-DENIHFKCSA-N 432.609 4.035 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCCC[C@@H]3c3c(C)n[nH]c3C)C2)cc1 1686854945 KXLRBGSKTPPEPL-SIKLNZKXSA-N 425.577 4.188 10 10 IICE COc1ccccc1CN1CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1687285026 PICLAPPMLBJDMN-UHFFFAOYSA-N 446.595 4.439 10 10 IICE Cc1nnc(N2CCO[C@@H](c3ccccc3Cl)C2)n1CCCSc1nccs1 1693513168 DJEFTCLAFGGUSB-QGZVFWFLSA-N 436.006 4.457 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1 1697088290 VHINEGXRMIPABY-UHFFFAOYSA-N 447.587 4.148 10 10 IICE COC[C@H]1CCN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C1 1730577217 LAUQNMPYRNXFNO-KRWDZBQOSA-N 447.605 4.120 10 10 IICE CC(C)C1CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)CC1 1741394876 NZYOMPGTUSXVEW-UHFFFAOYSA-N 429.619 4.246 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1746012678 UDBJURPDGBGEBA-SANMLTNESA-N 448.615 4.313 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCOC1 1748380230 IOSPYLJWABZDMH-FPOVZHCZSA-N 437.588 4.250 10 10 IICE CSC1(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)CCC1 1750262801 CVOFFQWVCSJSLP-UHFFFAOYSA-N 429.615 4.262 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)cc1C 1752742327 KCFLZYSPNDDUIG-RXVVDRJESA-N 435.620 4.332 10 10 IICE CC[C@@H]1CCCN1c1nnc([C@H]2OCC[C@H]2COC)n1CCCSc1nccs1 1765154975 PZOXBZCBXJCLJL-BBWFWOEESA-N 437.635 4.020 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CCC(F)(F)C1 1767080677 KGZZINBXVAUVSU-LJQANCHMSA-N 447.574 4.484 10 10 IICE C[C@]1(NCc2cccc(Br)c2O)CCCN(C(=O)OCc2ccccc2)C1 1940887325 KMVAXLGQSOYLEW-NRFANRHFSA-N 433.346 4.436 10 10 IICE O=C(N[C@H]1CC12CC(NCc1cc(Br)ccc1O)C2)OCc1ccccc1 2026163753 MZGQYVSZJLOJRB-BIXGBWIQSA-N 431.330 4.092 10 10 IICE O=C(O)CN1C(=O)C(=Cc2ccc(-c3ccccc3Br)s2)SC1=S 2040498342 HZUUPPWLCGCSNZ-UHFFFAOYSA-N 440.365 4.463 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1CO 2079952638 KYHJAQQIHSIGOF-QGZVFWFLSA-N 428.314 4.110 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3Cc3ccc(Cl)cc3)C2=O)cc1 2296397917 HGFLAVOOYIRUOD-UHFFFAOYSA-N 433.895 4.419 10 10 IICE O=C1NC(=O)N(c2cccc(C(F)(F)F)c2)C(=O)C1=Cc1ccc(Br)cc1 2296732958 GGOAEKREPFNFQG-UHFFFAOYSA-N 439.187 4.134 10 10 IICE Cc1cc(Oc2nc3ccccn3c(=O)c2C=C2SC(=S)N(C)C2=O)ccc1Cl 2314509721 XNACBUKVECHZNU-UHFFFAOYSA-N 443.937 4.280 10 10 IICE CCOc1cc(C=C2SC(=S)N(Nc3ccccc3)C2=O)ccc1O[C@H](C)C(=O)O 2314933413 BEJLYMJJQNAWNA-CYBMUJFWSA-N 444.534 4.166 10 10 IICE Cc1ccc(CN(C)C[C@@H]2CC2(Br)Br)c(O)c1Br 2327609916 QGKHKDQYMMUEKO-JTQLQIEISA-N 441.989 4.401 10 10 IICE CC(=O)N[C@@H](CC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1ccccc1 9249684 LERXZDHJJYTISX-QHCPKHFHSA-N 436.483 4.227 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551127 FCGBWFYRUSJTSC-LGVFNWMJSA-N 434.540 4.493 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccc(O)cc3C)=NC2=O)ccc1OCCC(=O)O 16920094 WLPFKQIXHQLAQU-XDHOZWIPSA-N 442.493 4.035 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](C)c3cccc(NS(C)(=O)=O)c3)c2C)c1 108457307 NQLCARGUYVYFBR-KRWDZBQOSA-N 425.554 4.265 10 10 IICE NC(=O)c1ccccc1NC1=NC(=O)/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)S1 208335271 AKAPGSDVQHKYNQ-WQRHYEAKSA-N 434.433 4.036 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)N1CCC(c2ccccc2)=N1 731036791 RBXZFFKCCOCMKK-UHFFFAOYSA-N 448.567 4.101 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(CC(=O)c3cc(C)n(-c4cccc(SC)c4)c3C)[C@@H]2C1 755053511 KNCVVRKXWGDWFE-ZFJSRUIDSA-N 428.598 4.267 10 10 IICE Cc1cc(C)cc(CN(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 765638223 XKNAAMXVKLUFJD-UHFFFAOYSA-N 430.551 4.144 10 10 IICE FC(F)(F)c1cnc(CNCc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 788507819 QKKWAFOEYGYBDE-UHFFFAOYSA-N 425.398 4.307 10 10 IICE O=C(CCc1nnc(-c2cc3ccccc3o2)o1)NCc1cc(Br)ccc1O 804738989 LRELDTYAPWIUKG-UHFFFAOYSA-N 442.269 4.200 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)NC(c1ccc(F)cc1)c1ccc(F)cc1 920056565 ZOUWTFJLSODMHU-UHFFFAOYSA-N 437.490 4.390 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC=CC1 1125878425 SHIVUVGFVNKCOY-UHFFFAOYSA-N 436.499 4.051 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1coc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1 1136744336 POTDXRTYNLQYAH-IBGZPJMESA-N 428.533 4.051 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2cn(C)c3cc(F)ccc23)cc1 1138556881 KWWCRZBPNPZLQO-UHFFFAOYSA-N 431.511 4.439 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC1CCCCC1)C(=O)NCc1ccc2cccnc2c1O 1142730848 FSTAXGJSSJWCEE-LJQANCHMSA-N 427.545 4.420 10 10 IICE COC(=O)c1cnc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C(F)(F)F)c1 1162205925 LAVSVFKXYPZAER-BETUJISGSA-N 441.425 4.252 10 10 IICE COc1ccc(N(CCS(=O)(=O)c2cccc(Br)c2)CC(C)C)cc1 1195258863 SPEGSMGWLXTHJT-UHFFFAOYSA-N 426.376 4.394 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@H]1COC(=O)NC1CCCCC1)c1ccc(N(C)C)cc1 1226647199 RCNKNPFGKQYDQO-GCJKJVERSA-N 430.593 4.437 10 10 IICE Cc1ccc([C@@H]2CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)c(C)c1 1251750507 CPZRMUZUVZCQPU-LJQANCHMSA-N 429.511 4.117 10 10 IICE CC(C)C(C)(C)Cn1c(CC2CC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1287142940 RDWRBYGWTNROGY-UHFFFAOYSA-N 425.621 4.386 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc2cccc(O)c12 1291640055 VUKNTFWZVLHKFG-UHFFFAOYSA-N 430.426 4.331 10 10 IICE CC(C)(C)c1csc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 1297941833 AEGWUROLCCKGGB-UHFFFAOYSA-N 437.568 4.261 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1298842754 VULDRWXLUVNBPW-HTAPYJJXSA-N 449.334 4.364 10 10 IICE CC[C@@H](C)N(CCc1ccccc1F)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065902 ZKLBAIJHHQFMQU-LJQANCHMSA-N 427.564 4.340 10 10 IICE COc1cccc(CN(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1351459956 OTMMABUCHZXBNS-UYRXBGFRSA-N 444.553 4.084 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3CCN(Cc4ccncc4)CC3)c2C)cc1 1452963533 FZVHLUXXIYESMA-UHFFFAOYSA-N 432.568 4.140 10 10 IICE C[C@H]1C(=O)Nc2cc(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)ccc2N1C 1459583999 OVEOFXKUVAXAOQ-CVEARBPZSA-N 440.975 4.283 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C[S@@](=O)c2ccc(Cl)cc2)cc1 1464073631 MEABOOUXTQANBK-GDLZYMKVSA-N 430.957 4.336 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 1478573144 LMJLUCOAOALKQZ-YQHFOJDRSA-N 440.554 4.097 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C(=O)N(C)C)CCCC1 1501451488 DUGYEFPCBIYBSI-UHFFFAOYSA-N 448.615 4.457 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@H](C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1510621704 ZEDHOFWDWPXUEG-LJQANCHMSA-N 439.629 4.457 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@@H](C)[C@H]2C)n1Cc1ccc(N2CCOCC2)cc1 1513095954 WKFJBWPFGMATPN-OTWHNJEPSA-N 429.634 4.007 10 10 IICE CCc1nnc(N(CCC(C)C)C2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1513819212 IYOYHESIZAYUQE-UHFFFAOYSA-N 425.621 4.112 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3cc(F)ccc3Br)C2)cc1 1529708526 PDODTSMIPRXPPT-OAHLLOKOSA-N 435.337 4.172 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3coc(-c4ccc(Cl)cc4)n3)C2)cc1 1529709288 WGJIXQOKKVXSJA-INIZCTEOSA-N 425.916 4.189 10 10 IICE Cc1ccc(-c2ccsc2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1537839950 SGVJBBWECOJHAK-UHFFFAOYSA-N 433.577 4.355 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(c3cccc(OC(F)(F)F)c3)CC2)N(C)C)cc1 1539235011 JUYMVNQWMIIMHB-FQEVSTJZSA-N 435.490 4.102 10 10 IICE CN(c1ccc(CNC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc1)C1CCCCC1 1544246054 HBXNBWYIJLDWJH-UHFFFAOYSA-N 441.959 4.151 10 10 IICE Cc1cc(CC(=O)NCc2cccc(S(C)(=O)=O)c2)c(C)n1-c1ccc(Cl)cc1 1544813302 HCVIMIYCEGVICP-UHFFFAOYSA-N 430.957 4.010 10 10 IICE Cc1cc(C(=O)NCc2cccc(N(C)C)n2)c(C)n1-c1ccccc1Br 1545913168 SWCISLBDEQPQLR-UHFFFAOYSA-N 427.346 4.248 10 10 IICE CCc1nnc(N2CCO[C@@](C)(C(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1546547237 OQBQPNGMKPBZHM-XMMPIXPASA-N 443.661 4.083 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCO[C@H]1CCOC1 1547453911 VLZWLKSIZRYUEZ-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(C)(C)C 1566686231 KNYKIXOAJJUUQQ-UYAOXDASSA-N 434.577 4.229 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1 1584098722 GUIVFESIJVKYIS-UHFFFAOYSA-N 435.543 4.179 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccc(C)c(F)c4)CC3)c2C)c1 1596625788 VQAIRASLKURICR-UHFFFAOYSA-N 433.527 4.448 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccc(Cl)s3)cc2F)C[C@@H](C)O1 1596695241 OBKHRJSALMQPDZ-CHWSQXEVSA-N 448.951 4.474 10 10 IICE CS[C@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C[C@@H]1N1CCCC1 1611064584 LHWGZWLNOKHAGS-VXKWHMMOSA-N 432.033 4.328 10 10 IICE CC[C@](C)(CCCNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)C1OCCO1 1620442497 SLFCHLHCBQRPFO-RUZDIDTESA-N 428.573 4.214 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)c1 1625008519 ALCITZYATKOCJG-DEOSSOPVSA-N 431.580 4.289 10 10 IICE Cc1cc(C(F)(F)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cnc1Cl 1627205375 PGBNGWGCAXOXSF-LJQANCHMSA-N 437.918 4.409 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)NCCCSc3nccs3)CCCC[C@H]12 1632807120 OECVLHBGCMFMLF-MGPUTAFESA-N 425.620 4.311 10 10 IICE CC(=O)c1ccc(Nc2ccccc2C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1633252500 MMBAGNLNHNSUOJ-UHFFFAOYSA-N 442.563 4.315 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ncsc1Nc1cccnc1 1635672706 BLKKBXUPXMDOCT-UHFFFAOYSA-N 433.331 4.412 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc2cc(O)ccc2nc1C 1639827454 VBQDNUSQOZFJES-UHFFFAOYSA-N 435.524 4.251 10 10 IICE COC(=O)/C=C\c1ccc(N2CC(Cc3cccc(Br)c3)C2)c([N+](=O)[O-])c1 1643261831 BDAHNANJWHJHEZ-VURMDHGXSA-N 431.286 4.222 10 10 IICE CC(C)c1ccc(Cn2[nH]ccc2=NC(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)cc1 1644371427 SKCSWUGBWHGMCX-UHFFFAOYSA-N 447.627 4.392 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1 1647830333 SAPQAFWCYGENSF-KRWDZBQOSA-N 429.731 4.042 10 10 IICE COc1ccccc1CN(C[C@H]1CCCO1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1682097274 OXEZSLOFYXLIPZ-GBXCKJPGSA-N 439.600 4.391 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC2(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1694092557 MERDTQOWVYTIMA-LJQANCHMSA-N 425.621 4.427 10 10 IICE CC(C)CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1706486567 ZXWLQQRJUJXGDU-NRFANRHFSA-N 429.634 4.213 10 10 IICE Cc1ccc(CN(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)s1 1761774896 OZTPJMHTVUXZNM-QGZVFWFLSA-N 429.565 4.042 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CCCCS3)CC2)cc1F 1768704812 OVPFVIFSTIXPHK-IBGZPJMESA-N 447.624 4.237 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cc(C)no1 1769684211 NEIOPAMPILGMPV-UHFFFAOYSA-N 434.544 4.170 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cc(Br)cc([N+](=O)[O-])c1 1891288598 RJUIXJPKMUDZQG-KSSFIOAISA-N 430.302 4.276 10 10 IICE OCc1ccc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(Br)c1 2153332578 BZCAAIOJUCDWES-DHIUTWEWSA-N 427.386 4.434 10 10 IICE CCOc1ccc(-n2c(C)cc(C=C3SC(=O)N([C@@H](C)C(=O)OC)C3=O)c2C)cc1 2293998929 MGARAMHNXJNNDO-HNNXBMFYSA-N 428.510 4.091 10 10 IICE COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)C2=C(C)NCCCOC(C)C)cc1 2313683324 XLFYCSGOEQCPFI-UHFFFAOYSA-N 425.504 4.264 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CC(C)(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380757299 QMAJNQYFZRZYOH-CQSZACIVSA-N 443.382 4.409 10 10 IICE COc1cc(/C=C2\SC(N3C[C@H](C)O[C@H](C)C3)=NC2=O)ccc1OCc1ccccc1 15911901 PERNXZAKWQXXKK-DJQLGGTQSA-N 438.549 4.354 10 10 IICE CCN(CC)c1ccc(CN(C(=O)/C=C/c2ccc(C)cc2)[C@H]2CCS(=O)(=O)C2)cc1 54310831 XDSDLUFSFZETIT-ZHSJKAEUSA-N 440.609 4.070 10 10 IICE CC(=O)NCc1ccc(-c2nc(NS(=O)(=O)c3cc(C)sc3C)sc2C)s1 727249246 PUNANSHOCRXKHN-UHFFFAOYSA-N 441.625 4.295 10 10 IICE Cc1ccc(C[C@H](C)N(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 737653276 MMWIIHMQQNZHNR-INIZCTEOSA-N 442.471 4.382 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c1O 740857470 PBSZRTMDRIFXGF-FOIQADDNSA-N 428.529 4.067 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1 757764037 PGCKETHQEAHQCL-IBGZPJMESA-N 427.980 4.146 10 10 IICE O=[N+]([O-])c1cc(CN[C@H](CO)c2cccc(Br)c2)ccc1N1CCCCC1 765288133 ZJOVPPYVIHLLPX-GOSISDBHSA-N 434.334 4.171 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@H](CO)c3cccc(Br)c3)cc2)CC1 766970821 AYPFWSAYKGRMLN-OAQYLSRUSA-N 446.389 4.218 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCS(=O)(=O)c2ccccc2)cc1 772140442 AZKKCTMLWXROEJ-UHFFFAOYSA-N 436.537 4.372 10 10 IICE COc1cccc(CNC(=O)C(C)(C)[C@@H](O)c2ccc(OCc3ccccc3)cc2)c1O 778915327 RRXWSWVRWXDWHT-DEOSSOPVSA-N 435.520 4.356 10 10 IICE Cc1nc2c(s1)[C@H](NC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CCC2 780821130 OTKPBQVYXDTFRS-BIENJYKASA-N 432.565 4.081 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccoc2C(F)(F)F)NC(=O)OC(C)(C)C)cc1 810448235 WYAPZVAFENFUHW-MRXNPFEDSA-N 441.450 4.360 10 10 IICE Cc1cc(Br)c(O)c(CN2CC[C@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c1 856558539 JFTJVOXUZWLXFP-FQEVSTJZSA-N 448.405 4.352 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H](c1ccc(Cl)cc1)C1CC1 918187071 RYGALIIEQXABOP-QHCPKHFHSA-N 427.976 4.499 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1C[C@@H]1c1ccccc1 920226897 RRVGPNDSIOBSGK-DSXONILISA-N 428.604 4.402 10 10 IICE COc1ccc2c(CC(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)coc2c1C 1125258142 FEYHNTOGQKBEPA-HOTGVXAUSA-N 440.515 4.361 10 10 IICE C[C@@H](Oc1ccc(F)cc1Cl)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348679 QSLCYYSGMNSTAG-DYVFJYSZSA-N 441.330 4.386 10 10 IICE Cc1cc(CCNC(=O)NCc2nc(Cc3ccccc3F)no2)c(C)n1-c1ccccc1 1233974564 QEXAGPKZKHPTDR-UHFFFAOYSA-N 447.514 4.249 10 10 IICE CC(=O)c1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)cc2)cc1 1288331252 XRPVDTZDROPWTB-UHFFFAOYSA-N 443.547 4.363 10 10 IICE Cc1ccc2[nH]c(C(=O)NCc3ccc(N4CCOCC4)cc3)cc2c1Br 1292065238 FLSCSLOCZVCNBY-UHFFFAOYSA-N 428.330 4.005 10 10 IICE COc1ccc(C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)cc1S(C)(=O)=O 1295595038 ORNOKLWUOGWFLS-QGZVFWFLSA-N 439.533 4.208 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCCCCCO 1298365081 OCQFCOCDFFUJRK-TZIWHRDSSA-N 430.593 4.091 10 10 IICE CC(C)[C@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1302778310 JNQNPKOFCBUTLY-NHCUHLMSSA-N 447.624 4.351 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3cc(Br)ccc3C)CC2)cc1 1313024616 ZRBYWLQFDNVSHF-UHFFFAOYSA-N 432.362 4.188 10 10 IICE CCOCc1nnc(N2CCC[C@H]2c2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1314380262 YIAXEBGSAMAGFJ-IBGZPJMESA-N 429.565 4.471 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccc(I)cc2F)C2CC2)cc1 1354141286 HXYLHPVPVVCHBV-UHFFFAOYSA-N 438.284 4.301 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(Br)c3F)cc2F)C[C@@H](C)O1 1357835114 CRHXZAFSFKIJDM-CHWSQXEVSA-N 439.300 4.271 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@@H](C)C3)n2CCOC(C)C)c(C)n1-c1ccccc1 1361049678 MHIVLMWZHWYIBT-FQEVSTJZSA-N 437.588 4.393 10 10 IICE COc1ccc(OC(F)F)c(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1435546959 UOEBFMIJNBSFKU-UHFFFAOYSA-N 444.478 4.455 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cn3c(Br)cnc3s2)cc1F 1443764859 BSZUDWFCZJYICX-UHFFFAOYSA-N 425.327 4.074 10 10 IICE CCC[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@@H](O)c1ccccc1 1448956058 DFRGMENRVLQNQI-KCWPFWIISA-N 433.596 4.426 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c(C)n1-c1ccc(F)cc1 1458997904 OKHNHONUMGAJFF-SFLZPUPLSA-N 425.504 4.163 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)cc1 1464072842 IFLVKJUVZZDAFO-UHFFFAOYSA-N 445.479 4.487 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(OC2CCN(C)CC2)cc1 1467919055 IJDPCUCCBCFHNG-UHFFFAOYSA-N 445.563 4.310 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4cncn4C)CC3)cc2Cl)C1 1469958814 HKNKAVXDDYXQIF-QGZVFWFLSA-N 429.996 4.399 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN([C@H](C)C(F)(F)F)CC3)cc2Cl)C1 1478527435 CBDWORVLCFXHRV-JKSUJKDBSA-N 446.945 4.354 10 10 IICE CC1=C(C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1510391863 SBVVKGZKSPAZAL-UHFFFAOYSA-N 427.568 4.146 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1C(F)F 1537482795 ITDJGBRBZFRYMP-OAQYLSRUSA-N 441.526 4.217 10 10 IICE Cc1cc(CC(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccccc1 1538843206 FTMCVICHHJYYEA-QFQXNSOFSA-N 431.580 4.042 10 10 IICE CCOC(=O)C1CCC(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)CC1 1542490404 MIXSSRRAHGMQPW-IRSIHTCSSA-N 430.589 4.020 10 10 IICE COc1ccc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2)cc1 1543385599 JOHHDCZNMAGRMF-UHFFFAOYSA-N 445.563 4.318 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1 1544343261 VIJDRSYJQVPKSY-BKMJKUGQSA-N 431.580 4.422 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)[C@H]1C 1544412784 VZSUWJCWPGACAW-PMACEKPBSA-N 439.648 4.358 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@@H]2c2ccc(Br)cn2)c([N+](=O)[O-])c1 1559207256 HOEYYRCPOGAVJJ-MEMKZHQFSA-N 432.274 4.280 10 10 IICE CCOC(=O)[C@@]1(COC)CCCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1559780864 OLZZNCJYASGXGL-DEOSSOPVSA-N 438.528 4.332 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H](N(C)c4ccc(C)cc4)C3)C2)cc1 1564962042 CVTMTMGVSMJXSY-QPPBQGQZSA-N 436.600 4.140 10 10 IICE Cc1cc(C(=O)NC[C@H]2CSCCS2)c(C)n1-c1ccc(Br)cc1 1587498470 OGUDRSVZMXZMKD-INIZCTEOSA-N 425.417 4.435 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN[C@H](c3ccccc3Cl)C2)cc1 1617568203 NOGFGCIIUJCSEC-DEOSSOPVSA-N 435.955 4.276 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](OCC3CC3)C2)c(C)n1-c1ccc(Br)cn1 1625716938 UCQZQAJICHXGFF-GOSISDBHSA-N 432.362 4.283 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cccc(I)c3N)c2)CC1 1628437931 WNZXELINRYKCJY-UHFFFAOYSA-N 435.309 4.362 10 10 IICE COC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)c1 1631612003 HYZMJNOQQWMETH-OAQYLSRUSA-N 425.529 4.061 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@]1(C)CCNC(=O)C1 1638240767 GWVYFJNPBHWMCR-XMSQKQJNSA-N 433.474 4.214 10 10 IICE COc1cccc(CC2(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)CCCCC2)c1 1641200727 LPDXUWZOFWMKRK-UHFFFAOYSA-N 436.596 4.466 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N2CCC(CCc3ccc(C)cc3)CC2)cc1 1643685461 YVMYZEYSQPOQQH-UHFFFAOYSA-N 437.628 4.243 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCc3ccc(N4CCN(C)CC4)cc3)c2C)c1 1649009065 SLEXRPIVHUHPBG-UHFFFAOYSA-N 430.596 4.127 10 10 IICE COc1ccccc1Nc1nc(N)nc(CN2CCCc3cc(OC(F)(F)F)ccc32)n1 1657614056 YGIQXNHVKABVJP-UHFFFAOYSA-N 446.433 4.057 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COC4(CCCCC4)O3)cc2Cl)C1 1680794038 JRKAQTAYFGYBFG-HKUYNNGSSA-N 435.996 4.451 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H](C)Oc3ccc(C(C)C)cc3)C2)cc1 1680998291 VMNSMRMQXBPVTA-PMACEKPBSA-N 425.573 4.412 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C 1682097106 JZELQVZGHOPAJN-DWLFOUALSA-N 444.620 4.175 10 10 IICE C[C@@H]1CCCCN1CCC1CCN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1685681394 FQHFHZZERUBVEM-BWKNWUBXSA-N 443.680 4.041 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N2CC[C@@H](COC)C2)cc1 1710028613 ZBJSSUMFKZHOBL-JOCHJYFZSA-N 425.621 4.378 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1712798957 DIEZTYFNFPMASP-NQIIRXRSSA-N 443.661 4.181 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3Cc3cscc3C)CC2)cc1F 1730179986 HMTREMVQDPHJJH-UHFFFAOYSA-N 443.592 4.468 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@@H](C)[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1761960129 DKIGXFXWXPVZTL-SJORKVTESA-N 440.592 4.232 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1765070601 BHSOZZHYRMXAMS-VGSWGCGISA-N 435.620 4.187 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC3CC(F)(F)C3)CC2)cc1 1770258561 PSFUOLIPHDJGGK-UHFFFAOYSA-N 433.547 4.247 10 10 IICE Cc1cc(/C=C2/SC(=S)N(c3ccc(N4CCN(C)CC4)cc3)C2=O)ccc1F 1860085749 XSLCUAFIMYBKTO-XSFVSMFZSA-N 427.570 4.292 10 10 IICE CC(C)(C)c1ccc(CNCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1860716322 FJSMIIMMZPVDTB-UHFFFAOYSA-N 426.516 4.488 10 10 IICE COc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1Br 1865964446 UPCFRBUFYZSRNF-UHFFFAOYSA-N 436.261 4.485 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2ccc(Br)cc2O)C1 1952455920 IRYQXXLMEHQQAL-WMLDXEAASA-N 434.286 4.329 10 10 IICE CC[C@@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH]s1)c1cc(Br)ccc1O 2130961492 CNMOCMDNLGKQDT-GFCCVEGCSA-N 443.367 4.016 10 10 IICE COc1ccc(Br)c(CNCC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1O 2227746758 QBVCJMIZKUDSGU-HNNXBMFYSA-N 431.371 4.192 10 10 IICE CC[C@](C)(CNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380759542 OZRRARSSRVZEJM-HXUWFJFHSA-N 443.382 4.363 10 10 IICE Cc1ccc(CNC[C@H]2COC(C)(C)CN2Cc2ccccc2)c(O)c1Br 2381148233 XRCRXBOZCGKEHL-IBGZPJMESA-N 433.390 4.232 10 10 IICE CCn1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c(=O)c2ccc(C)nc21 9514235 LCECFSXQXFJOFU-UHFFFAOYSA-N 444.535 4.226 10 10 IICE O=C(C1=CN(c2cccc(C(F)(F)F)c2)c2cc(F)ccc2S1(=O)=O)N1CCCC1 65096283 FSKBDUAJSGPBMT-UHFFFAOYSA-N 440.418 4.234 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1ccccc1SC[C@H]1CCCO1 108192658 FJPNVXFSFBYLJH-HXUWFJFHSA-N 428.623 4.441 10 10 IICE CCN(CC)c1ccc(/C=C2/C(=O)NC(=S)N(c3cccc(Cl)c3)C2=O)c(OC)c1 254378829 KSQVIGJUVJOYHJ-WQRHYEAKSA-N 443.956 4.026 10 10 IICE CCN1CCN(c2ccc(C(=O)N(Cc3ccco3)Cc3ccccc3O)cc2F)CC1 743428696 HVUFYCKHSSUAEB-UHFFFAOYSA-N 437.515 4.109 10 10 IICE CC(C)c1nn(C)cc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 797762910 ALKZRDVLRVFGSB-GDNBJRDFSA-N 434.612 4.225 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3cscc3Br)cc2F)C[C@@H](C)O1 814405687 DMYKPPRTZLJDKS-CHWSQXEVSA-N 441.366 4.122 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)cc1)C(F)(F)F 917840351 ASKLYTVORKQCTM-UHFFFAOYSA-N 427.429 4.112 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)csc1Br 1127266766 ANBCEIDACDJMQU-UHFFFAOYSA-N 448.430 4.281 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3c(O)cccc32)c(C)n1-c1ccc(Br)cn1 1146792332 WNSKAVMJMPNVOE-SFHVURJKSA-N 426.314 4.375 10 10 IICE Cc1ccncc1/C=C\C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1178393997 BLHIBICTZAKXRI-AFCDSYGPSA-N 425.504 4.273 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2c2ncc(Br)cn2)c(C)n1-c1ccccn1 1178505613 VYNZBNAPIFOZHR-KRWDZBQOSA-N 426.318 4.019 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)Nc1nc(-c2cccs2)cs1 1192014518 SZQZKYRHUNDTQU-INIZCTEOSA-N 429.567 4.197 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](c3cccc(C)c3)N3CCOCC3)c2C)cc1 1290861712 YKWQJNTYEAXTPV-AREMUKBSSA-N 447.579 4.214 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3cccc(SC)c3)C2)cc1F 1293224911 IVVMOALBWDSOJN-KRWDZBQOSA-N 429.561 4.063 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2cccc(Oc3ncc(Br)cn3)c2)cc1 1294671822 LVBVSKXWHNAUOE-UHFFFAOYSA-N 441.245 4.446 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1OCCC1(C)C 1301682139 CFKFYFMSOWIKKN-JOCHJYFZSA-N 437.588 4.250 10 10 IICE C[C@@H](c1cccs1)N(C)c1nnc([C@@H]2CCC(=O)N2)n1CCCSc1nccs1 1303623429 VXNLFQQTKLELCL-KBPBESRZSA-N 448.643 4.127 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(CCc1ccccn1)Cc1cccnc1 1312884973 NTSBWHNTQSXJNK-OAQYLSRUSA-N 431.584 4.237 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(C)c(NC(=O)c4ccco4)c3)C2)cc1 1436971184 LZCRMFFWUHESSO-GOSISDBHSA-N 433.508 4.105 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)/C(F)=C/c1ccc(C(F)(F)F)cc1 1444752907 YQMABOLOEBLBEI-ODLFYWEKSA-N 440.412 4.432 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ncccc3C2)c(C)n1-c1cccc(Br)c1 1471427807 ZHGBHFYQMAVADN-UHFFFAOYSA-N 439.357 4.344 10 10 IICE CCCC(=O)N[C@@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1499876258 SVWYKCGODOAMIK-WIYYLYMNSA-N 440.636 4.099 10 10 IICE CCCN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1500691730 SSPOZBGGXUXNKM-UHFFFAOYSA-N 425.621 4.114 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1503135872 BBNWVPLDMHKJDY-IBGZPJMESA-N 441.551 4.353 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2cccn2C)n1Cc1ccc(N(C)C)cc1C 1505236492 WQHPTMKJLHETQH-GOSISDBHSA-N 426.634 4.284 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@](C)(O)[C@H](C)CC 1513018130 LMITYLAKWNBWDO-RHGYRFJNSA-N 447.599 4.063 10 10 IICE CCCN1CCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1514970222 FHYIUAXYIGPRRY-IBGZPJMESA-N 440.979 4.210 10 10 IICE CCN(CC(C)C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1515460801 PGJMHRXXCUUYCK-NRFANRHFSA-N 443.661 4.256 10 10 IICE CN(CC(C)(C)C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1517093203 YHPAXMKMJMLEFL-HXUWFJFHSA-N 443.661 4.256 10 10 IICE Cc1cc(CC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1523924188 CGQSPOYQFORCDZ-HDICACEKSA-N 432.008 4.294 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cccc(F)c1I 1525114237 YEPXQVMZXHSMDO-UHFFFAOYSA-N 438.284 4.303 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccccc2)cc1 1525919274 YHAXQNNTIOTDKO-QFIPXVFZSA-N 425.573 4.458 10 10 IICE Cc1ccccc1[C@@H]1C[C@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1527705082 OCCKRICURITEBC-WPWRXMBVSA-N 440.565 4.398 10 10 IICE Cc1occc1CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1542084208 LOEDMUXZTXCRAC-NRFANRHFSA-N 427.524 4.311 10 10 IICE Cc1ccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1-n1c(C)cc(C=O)c1C 1542634693 PDZZZWUCKMYLJS-UHFFFAOYSA-N 443.547 4.381 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCC(=O)Nc3ccc(-n4cccn4)cc3)c2C)c1 1542649300 CZESUZRCRAMYIH-UHFFFAOYSA-N 441.535 4.265 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2ncc3cc(C)cnc32)cc1 1543114905 BZWNJRNBGNIZJS-UHFFFAOYSA-N 429.524 4.048 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1546880100 UACWKTQNYWLLLX-KOSHJBKYSA-N 447.599 4.197 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCNC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1557150771 PBGRTNWXRXWAIA-SFHVURJKSA-N 444.535 4.236 10 10 IICE C[C@H](NS(=O)(=O)c1cccc(C(=O)NCc2cc(Cl)ccc2O)c1)c1ccccc1 1557385654 HANFWGBTLMCNME-HNNXBMFYSA-N 444.940 4.015 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@H](c3ccc(C(C)C)cc3)C(C)C)CC2)cc1 1559708312 PQKWROBCYDJACR-VPUSJEBWSA-N 439.644 4.288 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)CC2)cc1 1564405781 RACGNWAPFDLKGW-OAQYLSRUSA-N 427.520 4.358 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H]3Cc3cc(F)ccc3F)C2)cc1 1564962727 OKFSMKAHQBZWLM-DYESRHJHSA-N 429.511 4.216 10 10 IICE C[C@H](CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(Br)cc1 1565412087 QLYHNWZXYFVBHU-QGZVFWFLSA-N 446.389 4.231 10 10 IICE Cc1cc(C(=O)N2CCN(CC(F)(F)C(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 1565766785 HVWHTTMIHNZBFP-UHFFFAOYSA-N 431.861 4.406 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(NC2=NCCC2)cc1 1566357144 XNKCDWXVYHHIEP-FQEVSTJZSA-N 426.948 4.044 10 10 IICE COc1ccc(-c2noc(CCCC(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)n2)cc1 1584087995 BUGYIHDWUYFRQB-GOSISDBHSA-N 436.556 4.190 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccccc4O)CC3)c2C)c1 1588156318 UQFFULCMMFMPQF-UHFFFAOYSA-N 431.536 4.015 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1coc(-c2c(F)cccc2F)n1 1595584501 NVOVLECNOGGKSO-OAHLLOKOSA-N 447.869 4.373 10 10 IICE CCS(=O)(=O)c1cc(Cl)cc(CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1597602824 VOYTVXCOUQAVHY-UHFFFAOYSA-N 444.984 4.400 10 10 IICE CN(c1ccc(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1)C1CCCCC1 1597949338 DBBDTHZRSMTYBK-UHFFFAOYSA-N 439.512 4.455 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](C)Cc3ccc(Br)cc3)C2)cc1 1598363873 JZUYNIRLTLDRAM-FUHWJXTLSA-N 431.374 4.279 10 10 IICE C[C@H]1SCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)[C@@H]1C 1613037473 JSMCRPPUTIPOSY-RTBURBONSA-N 443.661 4.082 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CSC[C@H]3C(=O)N[C@@H](C)C(C)C)c2C)c1 1616945442 HQAFIGWBUKGKOP-AVRDEDQJSA-N 427.614 4.387 10 10 IICE CCCCN(Cc1ccccc1O)C[C@H](O)COc1cc(F)cc(Br)c1 1617539084 RYLZMOYSWMYTNR-SFHVURJKSA-N 426.326 4.336 10 10 IICE COCCCN(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1619833396 SVDFJSDDJYKTOI-UHFFFAOYSA-N 448.615 4.021 10 10 IICE COC(=O)c1cn(-c2cccc(NC(=O)c3cc(C)n(-c4ccccc4C)c3C)c2)nn1 1623916535 GRGGRVSIPPRCPC-UHFFFAOYSA-N 429.480 4.022 10 10 IICE O=C(Cc1c(Cl)cccc1Br)NCc1cccc(Br)c1O 1626821950 HMMNYMHVJAJCRR-UHFFFAOYSA-N 433.527 4.430 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCCC[C@H]3NC(=O)OC(C)(C)C)ccc21 1627000274 FHRKYGQIBOXHKX-NHCUHLMSSA-N 443.588 4.470 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(OC)c(I)c1 1631265858 PRRWPMRPUWDDDF-UHFFFAOYSA-N 438.309 4.028 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(Cn2ccc(C(F)(F)F)n2)cc1 1631438902 OUFTYMDHKVJCEJ-UHFFFAOYSA-N 429.442 4.465 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(NS(C)(=O)=O)cc3Cl)c2C)c1 1631793744 FICXVEPOSZYXHK-UHFFFAOYSA-N 445.972 4.357 10 10 IICE Cc1cc(CC(=O)N[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1633194426 FYGGEMPLTSOVFJ-GGAORHGYSA-N 430.470 4.287 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F 1639341615 WVNPISSHGGFOLB-AUSIDOKSSA-N 429.555 4.266 10 10 IICE C[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(C(=O)c2ccccc2)c1 1641201468 UVSVWENZMNWOPY-FQEVSTJZSA-N 442.559 4.299 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]3OCCC[C@@H]3C2)sc(C)c1-c1ccccc1 1642219370 XGGFHMWPFJWIEC-MOPGFXCFSA-N 442.581 4.340 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCCCC[C@@H]3Cc3ccccc3Cl)nc12 1643240163 FLJXMNWXEMNXDZ-GOSISDBHSA-N 442.947 4.252 10 10 IICE Cc1cc(C(=O)N2C[C@@H](F)C[C@H]2C(F)(F)F)c(C)n1-c1ccc(Br)cn1 1653842568 CUGUXUHMYLRDCK-JSGCOSHPSA-N 434.231 4.367 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N[C@H](C)c2cc(OC)ccc2O)sc2c1CCCC2 1653961806 XRPZYLOZTOFTGI-KGLIPLIRSA-N 446.569 4.196 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)CCc3ccccc3)cc2Cl)C1 1682023247 CLAHTRABAVQMOS-GHTZIAJQSA-N 429.992 4.369 10 10 IICE COc1cccc([C@H](C)N2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1683253214 DZDGJCLFCIDIJX-SFTDATJTSA-N 438.616 4.089 10 10 IICE Cc1cc(-c2nnc(N(CC(C)C)C(C)C)n2Cc2ncn(C)n2)c(C)n1-c1ccccc1 1692982026 JNURAFCDIYINIZ-UHFFFAOYSA-N 446.603 4.400 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1707271987 JFQSBDYBNVBNOS-SFHVURJKSA-N 434.588 4.067 10 10 IICE CCCN(CC1CC1)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1709727981 OXIQICCTEZERFK-UHFFFAOYSA-N 435.620 4.189 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(=O)NC)CC1 1763607036 ROMVJFVEIMSRHN-POHAHGRESA-N 446.599 4.281 10 10 IICE CCC[C@H](C)CN(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763807356 RFEPQDQZARIDNF-PGRDOPGGSA-N 445.583 4.026 10 10 IICE CSCCCN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1770576914 GIFPTXSQOREHKT-UHFFFAOYSA-N 445.677 4.022 10 10 IICE O=C(COc1ccccc1Br)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866135011 BYGMXAXINRAWAS-UHFFFAOYSA-N 436.261 4.242 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H](CNCc2cc(Br)cc(F)c2O)C1(C)C 1885866466 PNRZEOPFSGZVOE-IUODEOHRSA-N 431.346 4.323 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H]2NCc2cccc(Br)c2O)C1 1918886959 BKBFCRMPGMZYOX-OXJNMPFZSA-N 425.367 4.424 10 10 IICE COc1cccc(O)c1[C@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)C[C@H]1C(=O)O 1952756748 HWUMWSNYKZVHEI-FNZWTVRRSA-N 445.471 4.239 10 10 IICE O=C1NC(=S)N(c2ccc(Cl)c(Cl)c2)C(=O)C1=CNCc1ccc(Cl)cc1 2042447171 DIGGYBWAVKHZFI-UHFFFAOYSA-N 440.739 4.068 10 10 IICE Cc1ccc([C@H](n2nc(C(F)F)c(CO)c2I)C2(C)CC2)c(O)c1 2079052812 XEZLVDPFRZFHSW-AWEZNQCLSA-N 448.251 4.321 10 10 IICE CC[C@H](NCCO[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2165422813 ORNVESKWYKENGR-WBVHZDCISA-N 443.382 4.221 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc(Cl)cc3)C(C(=O)OC)=C2C)cc1 2294034405 WVDAGLQRGDBZAU-UHFFFAOYSA-N 425.868 4.394 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccco2)SC1=S)NCCc1c[nH]c2ccccc12 2296550354 GJRJBCRHEGXBFX-UHFFFAOYSA-N 439.562 4.101 10 10 IICE COc1cccc(-n2c(C)cc(C=C3C(=N)N4N=C(C(F)(F)F)SC4=NC3=O)c2C)c1 2297470695 UQFZFTPSHYUWNU-UHFFFAOYSA-N 447.442 4.284 10 10 IICE O=C(COc1ccccc1C=C1SC(=S)NC1=O)Nc1ccccc1C(F)(F)F 2314487494 RICPORNHGWYTAG-UHFFFAOYSA-N 438.452 4.212 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3cccc(OC)c3OC)SC2=S)cc1 2321569888 PAIQVBGEBSODEI-UHFFFAOYSA-N 429.519 4.286 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380763866 YKZUJFYISKUXOY-OTVXOJSOSA-N 441.366 4.115 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccccc2)SC1=S)NCc1cc(-c2ccccc2)no1 40324266 SGACXPSRCKYPIH-MOSHPQCFSA-N 449.557 4.249 10 10 IICE C[C@@H](NC(=O)/C=C\c1ccc(OCc2ccccn2)cc1)c1ccc(N2CCOCC2)cc1 210875480 MNVIQJKPDDGQRP-JLGRQBBPSA-N 443.547 4.388 10 10 IICE COc1ccccc1[C@H](O)CN[C@@H](C)c1cc(Br)cc(Br)c1O 756458174 KCMGNMUANOVCPY-ZUZCIYMTSA-N 445.151 4.310 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC[C@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1Br 764914486 NPLFQZPHICFYKK-SSDOTTSWSA-N 428.161 4.053 10 10 IICE COC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)ccc1Br 775198165 SXWMEXRWAFIASH-UHFFFAOYSA-N 428.286 4.291 10 10 IICE Cc1cc(C(=O)Cn2ccnc2[C@H](O)c2ccc(F)cc2)c(C)n1-c1ccc2c(c1)OCO2 786756436 ICWBIDFLWDYOGA-XMMPIXPASA-N 447.466 4.123 10 10 IICE CC(=O)c1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)s1 792164519 NHOIMTJFUHUVKY-UHFFFAOYSA-N 425.462 4.127 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccc(F)cc2)c1 792238330 PPVZQBKJBUYSGF-LIRRHRJNSA-N 432.492 4.026 10 10 IICE COc1ccc(-c2nc(CN3CCN(Cc4cc5c(cc4O)CCC5)CC3)cs2)cc1 818260722 JSLGGPQWTUBESI-UHFFFAOYSA-N 435.593 4.331 10 10 IICE Cc1nc(-c2cccc(NC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)c2)no1 920783406 JJJIVEBNNOJSHZ-GASCZTMLSA-N 439.491 4.119 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCCC[C@@H]3C)cc2)cc1 1125233273 HIXKJBBLPPXYOV-IBGZPJMESA-N 443.613 4.026 10 10 IICE O=C(NC[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cc2cc(O)c(O)cc2s1 1142052333 QQWLPLDMXYEWNH-LBPRGKRZSA-N 447.354 4.331 10 10 IICE Cc1cc2c(cc1NC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)sc(=O)n2C 1146833788 RRQCVYAFVDYOGQ-UHFFFAOYSA-N 433.533 4.310 10 10 IICE COC(=O)c1ccc2[nH]cc(C3CCN(c4cc(OC)c(OC)cc4[N+](=O)[O-])CC3)c2c1 1187677936 RNZUTEAJGKYOHH-UHFFFAOYSA-N 439.468 4.264 10 10 IICE CCS[C@H]1CCCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 1190936117 VHLKEDXXDZUAKA-IRXDYDNUSA-N 436.577 4.397 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCOc3ccc(C)cc3Br)C2)cc1 1276831849 HBXVHAHJXGBIPK-KRWDZBQOSA-N 447.373 4.178 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H]4[C@@H](COC)[C@@H]4C3)nnc2C(C)(C)C)cc1 1295418011 CAZAUNOCZJNKSH-BHDDXSALSA-N 425.621 4.189 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@@]1(C)OCCc2sccc21 1302847278 HGJHFDDQMZTICE-HSZRJFAPSA-N 426.586 4.368 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](c1ccc(F)cc1F)c1nccn1C 1312883042 ASNUPBSAGRDWCV-KSFYIVLOSA-N 441.526 4.093 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1313678296 HGUJTAJZUNJKMK-FCHUYYIVSA-N 427.593 4.029 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1)C(C)C 1315188705 LBSRGTDCCVRZIZ-WMZHIEFXSA-N 437.588 4.249 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cnc1Br 1442916693 AORROBHUXSLZCI-UHFFFAOYSA-N 440.288 4.153 10 10 IICE CC[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(OC)cc1 1459864067 LLLLLNWRTDPNLG-QHCPKHFHSA-N 428.488 4.150 10 10 IICE Cc1cc(C(=O)NCCCOc2ccccc2)c(C)n1-c1ccc(Br)cn1 1463805374 MTNSJGMVQDMMAJ-UHFFFAOYSA-N 428.330 4.451 10 10 IICE Cc1cc(CC(=O)N2CCCN(CC(F)(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 1464495723 BVTSUJMFFFFDBA-UHFFFAOYSA-N 427.898 4.387 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCOc2ncc(Cl)cc2Cl)c1 1465946644 WHAXIIXGKKXMPM-UHFFFAOYSA-N 432.307 4.417 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3ccccc3NC2=O)c(C)n1-c1ccc(Br)cc1 1471012454 PMPZSJQQPDCNOL-HXUWFJFHSA-N 438.325 4.150 10 10 IICE Cc1c(N[C@H](C)C(C)C)cccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471912674 TVBKMLMROAYKOE-LJQANCHMSA-N 436.600 4.083 10 10 IICE CCOc1cc(CSc2ncc(-c3ccccc3)n2C)nc2nc(C(F)(F)F)nn12 1472953769 XKZGKXYTVBKHLI-UHFFFAOYSA-N 434.447 4.235 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@H](C)c3ccc4ccccc4c3)CC2)c(OC)c1 1473732276 FOLSOUBZXLJKNB-UXHICEINSA-N 447.579 4.245 10 10 IICE CC(=O)c1ccc(Br)c(NC(=O)NCc2cccc(Br)c2O)c1 1477018551 TXTFOPSXYPBXMS-UHFFFAOYSA-N 442.107 4.442 10 10 IICE COC[C@@H](CNC(=O)NCc1cccc(Br)c1O)c1ccc(Cl)cc1 1478659909 HLDXABXACHKMBX-CQSZACIVSA-N 427.726 4.038 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H]2Cc2ccccc2Cl)N(C)C)cc1 1479533662 ICUQKCFBNQQLHN-JTHBVZDNSA-N 429.008 4.425 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCOC1)OC 1497193687 OCSJKPXOFORIIM-RBBKRZOGSA-N 437.588 4.250 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1499936706 AQBDCYBNFPTAJH-CLOONOSVSA-N 437.588 4.129 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2CCC(C)(F)F)c(C)n1-c1ccccc1 1510605853 ZHWFOCPYJSJTNO-HNNXBMFYSA-N 444.530 4.098 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)Cc2cnccn2)cc1 1515529681 YIAGEJADCFZPTB-UHFFFAOYSA-N 433.604 4.332 10 10 IICE COc1cc(N2CCN(C(=O)/C=C/[C@]3(C)CC[C@H](C)C3(C)C)CC2)cc(OC)c1OC 1521501242 JUTDRNXAAYTARX-LYXKQELLSA-N 430.589 4.380 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@H]2Cc3c(Br)cccc3[C@H]21 1525761651 FGKSUOMGLVZHLN-WQAOKWJOSA-N 427.386 4.457 10 10 IICE O=C(C[C@]12CCCC[C@H]1C2(F)F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245788 NPVPHXDWPMNXLH-IEBWSBKVSA-N 432.433 4.374 10 10 IICE COc1ccc(N2CCN(C(=O)COC(c3ccccc3)c3ccccc3)CC2)c(OC)c1 1530968556 ROETVFBNKIDECK-UHFFFAOYSA-N 446.547 4.159 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)sc2c1CCCCC2 1533785114 ZTNWXNIGQUINQZ-AWEZNQCLSA-N 444.528 4.243 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1534543523 YVDAXSZNIUZERQ-QHCPKHFHSA-N 447.554 4.444 10 10 IICE Cc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C2CC2)n1 1544270012 ZTLIJAKADUKFJG-NRFANRHFSA-N 438.572 4.329 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(=O)NC)C1 1546779953 ASBIAJDSYQXZJS-UWAOBNACSA-N 446.599 4.281 10 10 IICE CCCCN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1546998573 VSVMLGHBOWBRQF-UHFFFAOYSA-N 429.584 4.271 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ccccc2OC(F)F)cc1 1556236013 UEXRLTDIRCJQSF-UHFFFAOYSA-N 426.463 4.409 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)/C=C/c3cc4cnn(C(C)C)c4[nH]c3=O)c2C)c1 1557889579 ZBMZHIXFPXWBJK-MDZDMXLPSA-N 443.551 4.351 10 10 IICE COc1ccc(N2CCN(c3ccc([N+](=O)[O-])c(OCc4ccccc4)n3)CC2)cc1F 1559137375 YIOIHLUXVPUXPH-UHFFFAOYSA-N 438.459 4.043 10 10 IICE COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1565273176 OTOSGGOTAXYVJV-YKSBVNFPSA-N 436.600 4.130 10 10 IICE CCOC(=O)[C@@]1(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CCCOC1 1586248306 JRFLPLOWBZXVSJ-RUZDIDTESA-N 426.557 4.307 10 10 IICE CC[C@H](C)NC(=O)c1cccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1596301327 MKVAAZKZRJAVCV-SFHVURJKSA-N 445.563 4.294 10 10 IICE CCCn1cc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)ccc1=O 1596537214 UKPLQVMYZAORLN-UHFFFAOYSA-N 429.318 4.076 10 10 IICE Cc1nc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)c(=O)[nH]c1C 1610124078 UZWVBXBXQQRICL-GOSISDBHSA-N 444.457 4.312 10 10 IICE COc1ccc(N2CC[C@H](CNc3ncnc(C(F)(F)F)c3Br)C2)cc1 1612519127 HUOAPDIDRIYXJU-LLVKDONJSA-N 431.256 4.205 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1Cc1ccc(N(C)C)cc1C 1613174009 RCTOHVJDAKXIPU-HNNXBMFYSA-N 430.000 4.238 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCCc1ccccc1 1616958022 NZPSFDGUJYVDDK-GOSISDBHSA-N 426.516 4.354 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ncsc2C2CC2)NC(=O)OC(C)(C)C)cc1 1629685503 PDWSQMFJXKTAJU-KRWDZBQOSA-N 430.574 4.082 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(Cl)cn1 1633110215 ZGULBOQPEQTTLV-HJPCULJESA-N 449.960 4.343 10 10 IICE COc1cc(CCCNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc(OC)c1O 1633968821 AWDVPBRSMYSJBQ-UHFFFAOYSA-N 426.488 4.319 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)C2 1637134367 MIPHMFPNDDSWQX-PJODQICGSA-N 429.344 4.351 10 10 IICE C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1637301323 WBBGTCJLFPEPTG-SPLOXXLWSA-N 442.562 4.308 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)CCCC1 1641379663 CWDVOEPMCHCSFY-UHFFFAOYSA-N 443.588 4.290 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]2C(O)(c2ccccc2)c2ccccc2)cc1 1641648133 KEINWNOVZOVDEO-JOCHJYFZSA-N 428.492 4.390 10 10 IICE Cc1cc(C(=O)N2CC(Nc3ccc(F)cc3)C2)c(C)n1-c1ccc(Br)cn1 1642205066 MDMKLGWKFUXYFU-UHFFFAOYSA-N 443.320 4.327 10 10 IICE COc1cc(N2CCN(C[C@@H]3CCC[C@@H](c4ccccc4)O3)CC2)cc(OC)c1OC 1653225677 CYISIEWCQFNCAT-VXKWHMMOSA-N 426.557 4.145 10 10 IICE Cn1c(=O)c([N+](=O)[O-])c(NC2CCN(c3ccc(OC(F)F)cc3)CC2)c2ccccc21 1655077642 GTRFYZCAAAFUJO-UHFFFAOYSA-N 444.438 4.129 10 10 IICE CCN(c1ccccc1)S(=O)(=O)c1ccc(NCc2c(O)cccc2F)c([N+](=O)[O-])c1 1655876577 WLXULCXGCOKITI-UHFFFAOYSA-N 445.472 4.267 10 10 IICE COCCN(Cc1nn(-c2ccc(F)cc2)c2c1CCC2)c1ccc(OC)c(OC)c1 1657577192 NMKZIJNIEKSQMS-UHFFFAOYSA-N 425.504 4.170 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](C)CCCCNC(=O)OC(C)(C)C 1673244408 NHNQGGRBXDIVBO-RBUKOAKNSA-N 434.625 4.375 10 10 IICE Cc1cc(CCNC(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c(C)n1-c1ccccc1 1683148855 DWGIWTMCKIZDJQ-SIKLNZKXSA-N 437.506 4.419 10 10 IICE C[C@H]1C[C@H](c2ccccc2)C[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1683300712 UHADICKTVCFEGB-WDJPJFJCSA-N 448.611 4.160 10 10 IICE COc1ccc([C@H]2CN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CCO2)cc1 1684321485 AKTZVOMGOSOAEF-RUZDIDTESA-N 433.552 4.428 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](c1ccc(F)cc1F)c1nccn1C 1684594108 WFQPAGUUPKALRT-JOCHJYFZSA-N 441.526 4.474 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1685141479 GDNSYXJGAFUMOO-HYBUGGRVSA-N 430.593 4.074 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2C[C@@H](C(=O)OC(C)(C)C)C2)cc1 1687345286 QGABXFHMEXBPLO-KDURUIRLSA-N 427.545 4.178 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1ccnc1C 1698013810 KKENMWQOTJAYPZ-UHFFFAOYSA-N 447.587 4.030 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC(C(F)(F)F)CC2)cc1F 1711006097 SDRINPZOZNQOJR-GOSISDBHSA-N 441.473 4.162 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCNC(=O)C(C)C)C1 1744955411 RYIHTUOPVWVCTC-OAQYLSRUSA-N 448.615 4.361 10 10 IICE CSCCCCn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750315100 DFUZSRGTJUSMKZ-UHFFFAOYSA-N 437.617 4.115 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1C 1768309988 NJHPHKMRCGMIGZ-VRFFJNRBSA-N 439.629 4.356 10 10 IICE COCCN(c1nnc(C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@@H](C)C1 1769799917 FYSXKXOIXPIPBC-IEBWSBKVSA-N 431.600 4.470 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(c4ccccc4C(=O)O)C3=O)n12 1860085929 VQWYBBFDCCIUKY-WUXMJOGZSA-N 435.939 4.462 10 10 IICE COC(=O)c1ccc(/C=C2/C(=O)N(Cc3ccc(F)cc3)N=C2c2ccc(OC)cc2)cc1 1865675647 SSLWBMVHXANJEC-HZHRSRAPSA-N 444.462 4.451 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1cc(I)ccc1Br 2225798352 GEEQCNNXUVBYMY-GHMZBOCLSA-N 435.063 4.015 10 10 IICE C[C@H](C(=O)N1CCCC[C@@H]1c1cccnc1)N1C(=O)C(=Cc2cccs2)SC1=S 2296551060 MZIJFTQMUGABSG-RHSMWYFYSA-N 443.619 4.487 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](C(=O)O)c3ccccc3)C2=O)ccc1OC 2314766600 BFJCOHXVCKNPEM-SFHVURJKSA-N 429.519 4.121 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)C(=Cc3ccc(O)cc3)SC2=S)cc1 2314828690 VNARDLRKLNHCQB-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(CCCn3ccnc3)C2=O)cc1OCC 2323840172 UBXSXLKZSBOPTM-UHFFFAOYSA-N 431.583 4.362 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)c(O)c1Br 2380755268 ZRPJSRJSIMYXDP-UKRRQHHQSA-N 441.366 4.115 10 10 IICE O=C(O)C[C@H]1c2cc(O)c(O)cc2CCN1C(=O)OCC1c2ccccc2-c2ccccc21 2530207 GAROZOSQBNFMNR-QFIPXVFZSA-N 445.471 4.421 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3/SC(=S)N(CCCOC)C3=O)o2)cc1 34982597 MFZIEOOLDTYWRU-QGOAFFKASA-N 431.535 4.361 10 10 IICE O=C(O)CN1C(=O)/C(=C\c2cccc(OCc3c(F)cccc3Cl)c2)SC1=S 59167682 CABCWYNPJDFNBN-LZYBPNLTSA-N 437.901 4.344 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3noc(-c4cccs4)n3)CC2)c(C)n1-c1ccccc1 97568247 WROMRYYLZHACGW-UHFFFAOYSA-N 447.564 4.164 10 10 IICE COc1cccc(CN2CCC[C@H](COc3ccccc3C(=O)N3CCCCC3)C2)c1O 169764987 PFZJWGWVUAEBAZ-FQEVSTJZSA-N 438.568 4.318 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)c1 731972783 JSYNKQOLVJPYCU-ACVFHECNSA-N 435.471 4.391 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NCCc3c[nH]c4ccc(F)cc34)cc2F)C[C@@H](C)O1 735096814 ZCUADSBKKRAIEW-HZPDHXFCSA-N 442.510 4.102 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2cccc(-c3ncco3)c2)c(C)n1-c1ccccc1 754484706 WLZOLOVHGQLAIL-UHFFFAOYSA-N 428.492 4.047 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(CC(=O)c3cc(C)n(-c4ccc(OC(F)F)cc4)c3C)[C@@H]2C1 755052237 FABOHIBDEQIPOY-KJXAQDMKSA-N 448.510 4.147 10 10 IICE O=C(CN1CCN(Cc2cc3c(cc2O)CCCC3)CC1)Nc1ccccc1C(F)(F)F 768443170 ZWONAFUVIKGIMR-UHFFFAOYSA-N 447.501 4.046 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3c(Br)cnn3C)SC2=S)cc1Cl 779204037 NYILCYNSKKRNNR-AWNIVKPZSA-N 444.763 4.250 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(C(F)(F)F)c(O)c1 798280771 AMMFJNDYUNFYPX-UHFFFAOYSA-N 448.363 4.196 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCC[C@H](c3ncc4n3CCCC4)C2)cc1F 799926151 XREMZLCTAWMMKC-IBGZPJMESA-N 427.568 4.294 10 10 IICE Cc1oc(C2CC2)nc1C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 803917557 ZADKKACNINOHHJ-UHFFFAOYSA-N 436.464 4.079 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)C2)cc1 1130827343 ZHLNDSYIBUIVMF-LJQANCHMSA-N 446.507 4.224 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)cc1F 1136730551 UFVLUXCMUUTKOJ-UHFFFAOYSA-N 442.535 4.295 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1141901653 JUFMGSRMOPBJEX-GVDBMIGSSA-N 430.495 4.104 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@]34C[C@H](NC(=O)OC(C)(C)C)C[C@H]3C4)cc2)CC1 1144773391 NKCXNCRXPHVJQF-WZOHSFFVSA-N 427.589 4.233 10 10 IICE Cc1cc(C(=O)Nc2n[nH]c3nc(O)ccc23)c(C)n1-c1ccc(Br)cc1 1160152243 KTZIQQZRAFENQJ-UHFFFAOYSA-N 426.274 4.086 10 10 IICE COC(=O)CN(Cc1noc(-c2c(F)cccc2Cl)n1)Cc1cc(Cl)ccc1O 1167740714 NVJCSWNUCFUWDQ-UHFFFAOYSA-N 440.258 4.063 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN([C@H](C)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 1185519303 XXFMDZHQSHCPCE-IGKXFLDPSA-N 429.904 4.318 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1227207228 DXXRMFPVIHQQRS-RYQLBKOJSA-N 435.996 4.496 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccc(Br)s3)C2)cc1 1252117089 VXVGVDDTXQTKGD-AWEZNQCLSA-N 438.391 4.187 10 10 IICE CC(C)c1ccc(-n2cnnc2SCC(=O)NCc2c(O)ccc3c2CCCC3)cc1 1294868739 GYVSPPKDSSFABB-UHFFFAOYSA-N 436.581 4.384 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1c[nH]c2ccc(Br)cc2c1=O 1299478284 LMJPCAPOOZYKQN-CQSZACIVSA-N 442.357 4.026 10 10 IICE CC(C)CCCn1c(C(=O)NC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1303021189 IWAHSFRSXCBWOZ-UHFFFAOYSA-N 426.609 4.089 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cn2c(Cc3ccccc3)nc3ccccc32)cc1 1437387177 XOUQKYWNEXNXMN-UHFFFAOYSA-N 442.563 4.231 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2csc(-c3ccc(F)c(F)c3)n2)N(C)C)cc1 1439959101 CCJOTTQKXVGLFO-FQEVSTJZSA-N 430.524 4.187 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1 1448835770 CKDIZXLDFZYQNK-IIBYNOLFSA-N 439.556 4.424 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCOc3ccc(C(C)C)cc3)cc2F)CC1 1456132033 XCKSCQKTQVGOAR-UHFFFAOYSA-N 427.564 4.176 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCCC[C@H]2c2ncc(-c3cccc(F)c3)[nH]2)cc1 1460041495 UFNJDOWCMCARSV-QHCPKHFHSA-N 435.547 4.125 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4csc(C)n4)s3)CC2)c(OC)c1 1461982225 ZBQVCEPUUYUBTP-UHFFFAOYSA-N 429.567 4.160 10 10 IICE Cc1cc(C(=O)N2CCN(c3cccs3)CC2)c(C)n1-c1ccc(Br)cn1 1465930239 KJJIXIQBAWDUJS-UHFFFAOYSA-N 445.386 4.276 10 10 IICE C[C@H]1CCCc2ccccc2[C@H]1NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1469708540 LKCNFNMCBSFCDF-AOMKIAJQSA-N 429.511 4.314 10 10 IICE CCN(CC)c1nnc(-c2cc(Br)cn2C)n1Cc1ccc(N(C)C)cc1C 1501853397 HYWACYABQXONTI-UHFFFAOYSA-N 445.409 4.315 10 10 IICE CCCOc1ncccc1Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccccc1O 1515190459 UNYCBFADBAQTSC-UHFFFAOYSA-N 444.539 4.223 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(C)C[C@H]3CCCCO3)ccc21 1517410466 FHLNNLFKDLDWRR-OAQYLSRUSA-N 425.621 4.303 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1520277073 XYUVCEBOPWPXJH-QGZVFWFLSA-N 449.640 4.177 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 1528923874 FHLBBNLIGHIFCY-GHTZIAJQSA-N 442.003 4.314 10 10 IICE COC(=O)c1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc([N+](=O)[O-])c1 1539911677 AVJZYPZVAFNCDP-AWEZNQCLSA-N 445.903 4.201 10 10 IICE Cc1sc(CNC(=O)OC(C)(C)C)nc1C(=O)NCc1ccc(N2CCCC2)cc1 1540729481 ZAQABXWQZJCXFX-UHFFFAOYSA-N 430.574 4.006 10 10 IICE COc1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(C)c1 1543978529 FNLALBQCUJCEDT-XDHOZWIPSA-N 444.553 4.050 10 10 IICE O=C(Cc1nc(C2CCCCC2)cs1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1544630687 QMWOWHPCJBBHFY-UHFFFAOYSA-N 431.577 4.150 10 10 IICE COc1cc(OC)cc([C@H](O)CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1545563522 UYHXTUUWOJKKFO-JOCHJYFZSA-N 428.916 4.228 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3cccc(O)c3O)c3ccccc3n2)cc1OC 1558160540 XPKBGWKDKFNLQZ-UHFFFAOYSA-N 430.460 4.260 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 1583281396 SOZDQIIUZIGORZ-UHFFFAOYSA-N 448.445 4.398 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(CC(C)C)c3-c3ccccc3)C2)cc1 1584444522 QKAQZGJFMXXYIE-HXUWFJFHSA-N 432.568 4.471 10 10 IICE Cc1cc(C(=O)NC[C@H](C)CC2(C)OCCO2)c(C)n1-c1cccc(Br)c1 1586802690 MUDDAPRQSZMIGY-CQSZACIVSA-N 435.362 4.376 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnc(OC4CCCCC4)c(Cl)c3)C2)cc1 1587112644 IWFFFSGKFGJAPK-QGZVFWFLSA-N 429.948 4.464 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)CCOC(C)(C)C 1611963715 YKRVLNXDILYSFK-NRFANRHFSA-N 429.609 4.194 10 10 IICE C[C@H]1CC[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1612716619 HQTKTXGMDXMNRF-VQTJNVASSA-N 425.621 4.376 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCN(CC(F)(F)F)C1 1613169726 GZFPONHMOGSWGN-HZPDHXFCSA-N 425.499 4.018 10 10 IICE CCN(CC)c1ccc(CNC(=O)COCCc2ccc(Br)cc2)cc1F 1616924655 LUKZZUSXDLONSS-UHFFFAOYSA-N 437.353 4.310 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCCc4c3cc(Cl)c(C)c4Cl)nc12 1618478166 IVYMFHFNURPWBH-UHFFFAOYSA-N 435.311 4.180 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc(C)o4)n3CCCSC)CC2)cc1 1619301301 FMWRRNCFLWSWOR-UHFFFAOYSA-N 441.601 4.325 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(C)nc1Br 1626511920 RQPYVFYPPPRWND-UHFFFAOYSA-N 448.361 4.155 10 10 IICE COc1ncc(Br)cc1CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1629562756 JITMSFYOUNJWDK-UHFFFAOYSA-N 428.330 4.119 10 10 IICE C[C@H](CCO)n1c(C(F)(F)F)nc2cc(NC(=O)/C=C\c3ccc(O)c(O)c3)ccc21 1641011072 JGMZNHXISYIZLY-AUXFESMGSA-N 435.402 4.062 10 10 IICE CSc1nc2ncn(CC(=O)c3cc(C)n(-c4ccc(C)c(C)c4)c3C)c(=O)c2s1 1656224642 MQIAPJPWGCMLHH-UHFFFAOYSA-N 438.578 4.482 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC[C@H](NC(=O)OC(C)(C)C)C3)c2C)c1 1687285054 PTHMAVWHSPWQPT-FQEVSTJZSA-N 426.561 4.211 10 10 IICE C[C@@H]1CCC[C@@](Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1693632420 ZROBWIDVCZFLEI-FQRUVTKNSA-N 448.615 4.116 10 10 IICE Cc1ccc(-c2nnc(N3CCCN(C(C)C)CC3)n2CCCSc2nccs2)o1 1707364570 PVBXAINFIWSHLW-UHFFFAOYSA-N 446.646 4.406 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCC(C(F)(F)F)(C(F)(F)F)C1 1724234155 ASRGVRPORJEZSV-UHFFFAOYSA-N 435.416 4.330 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccon1 1724236856 WZECRFLBGQSKDE-UHFFFAOYSA-N 437.935 4.041 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1726976305 NRQKKHYKSBPFFL-GHTZIAJQSA-N 429.634 4.008 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H]4OCCC[C@@H]4C3)nnc2C(C)(C)C)cc1 1728383679 RDJDCFAKAKEYOQ-IRLDBZIGSA-N 425.621 4.475 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H](c2cnn(C)c2)C1 1742141707 LYGKLMIAFCAOQY-FQEVSTJZSA-N 435.620 4.017 10 10 IICE C[C@H]1COCCN1c1nnc(-c2ccc(Cl)cc2)n1CCCSc1nccs1 1743355034 HXLFEAYLAFJVMO-AWEZNQCLSA-N 436.006 4.463 10 10 IICE CCS[C@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1747494068 NCOJVGXPKVHDLK-QFIPXVFZSA-N 443.661 4.398 10 10 IICE CC(C)c1nnc(N2CCN(c3cccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1750646109 NMGIVLONJUGOPY-UHFFFAOYSA-N 428.581 4.043 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCOC3)n2CCOC(C)C)c(C)n1-c1ccccc1 1751409880 ONBKMWIKKKFQEZ-OAQYLSRUSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)Cc4c[nH]c5ccccc45)cn3)CC2)cc1 1858421487 URQHOGJGAYKABH-UHFFFAOYSA-N 441.535 4.079 10 10 IICE CC(C)C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858592715 VJUHHEFIENWXPU-ALFJJAPYSA-N 432.336 4.289 10 10 IICE O=C(Nc1nccs1)[C@@H](c1cc(F)ccc1O)n1cc2cccc(Br)c2n1 1887582253 FYUQVOCKEMAGQO-MRXNPFEDSA-N 447.289 4.328 10 10 IICE CC(C)(C)OC(=O)NCCn1cc(NCc2cc(Cl)cc(Br)c2O)cn1 2229343544 VYBZWHGEEVSHIO-UHFFFAOYSA-N 445.745 4.141 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@H](NCc1c(O)cccc1Br)C2 2232271572 SWAPBEOEILJYBN-CLROSIBMSA-N 425.367 4.326 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381134722 HBMSECCTHUAQIU-UKRRQHHQSA-N 441.366 4.115 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14459709 UVOPBZDOGNPAGL-PNLZDCPESA-N 428.554 4.258 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1 20356367 UZKANGKYCYACJP-NHOPXOSBSA-N 446.580 4.383 10 10 IICE Cc1ccc2ccc([C@@H](Nc3ccc(S(N)(=O)=O)cc3)c3ccc(F)cc3)c(O)c2n1 54621264 QBFQPDGTYOJEGY-NRFANRHFSA-N 437.496 4.237 10 10 IICE CN(C)c1ccc(/C=C(/NC(=O)c2ccccc2F)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 103400109 RAHPIYJLXKDPTG-PXLXIMEGSA-N 448.454 4.210 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)Cc3ccccn3)CC2)c(C)n1-c1cccc(C(C)C)c1 110966207 WCAPQAWNGFEHLT-UHFFFAOYSA-N 444.579 4.140 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 250531388 LIVRQJJFONDDEK-YIGJPRQDSA-N 435.549 4.015 10 10 IICE C[C@H]1[C@H](NCc2cc(Br)ccc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709343744 MXTXYFRAPDLOQL-WBQNTZJQSA-N 425.367 4.421 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3cc(Br)cc(F)c3O)C[C@H]1C2 715737062 KDHDOPQBEYWWHE-TUKIKUTGSA-N 429.330 4.171 10 10 IICE Cc1cc(CCNC(=O)Nc2cccc(N3CCCNC3=O)c2)c(C)n1-c1ccccc1 743221781 YGSCNYKUSASVNS-UHFFFAOYSA-N 431.540 4.378 10 10 IICE Cn1ncc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1C(F)F 759863900 FEZYFJMWEFCIQH-WQLSENKSSA-N 442.538 4.039 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(CN2CCCC2)c1 768914575 FNMZTIPHLWTXQI-QFIPXVFZSA-N 427.976 4.036 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1O 779618358 DCFGGSBQEYXCIV-MRXNPFEDSA-N 444.963 4.480 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H](c1ccc(Cl)cc1)C1CC1 918187070 RYGALIIEQXABOP-HSZRJFAPSA-N 427.976 4.499 10 10 IICE CC[C@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125130941 CNBXAOWWJMKPDY-JXFKEZNVSA-N 428.495 4.144 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@](C)(O)c2ccccc2Cl)CCCC1 1138064496 IOQVXWCLHLWMNB-DEOSSOPVSA-N 426.944 4.206 10 10 IICE CCOC(=O)CN(Cc1ccccc1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1142574811 SMSKIWQTVKFVCE-UHFFFAOYSA-N 432.520 4.041 10 10 IICE O=C(/C=C\c1ccccc1)NCCCNC(=O)N(Cc1ccccc1O)C1CCCCC1 1235763027 OCSMMVVRSXUTHK-MSUUIHNZSA-N 435.568 4.456 10 10 IICE CC[C@H](C(=O)N(C)Cc1ccc(N2CCCC2)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1290374478 LMJHAPLLZRONKM-OAQYLSRUSA-N 438.963 4.203 10 10 IICE Cc1cc(C)c(C(=O)NCc2c(O)ccc3c2CCCC3)cc1I 1294870513 VEEPFVRPZDIESU-UHFFFAOYSA-N 435.305 4.422 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](c2cccc(F)c2)c2cccc(Cl)c2)c1 1295053212 KPMKTVIAACITQP-FQEVSTJZSA-N 448.903 4.076 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NCc2cc(Cl)cc(Cl)c2O)c([N+](=O)[O-])c1 1307134163 LVECYDMICSOGIW-UHFFFAOYSA-N 448.328 4.250 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)c2ccc(N3CCNC3=O)cc2)c(C)n1-c1ccccc1 1312906764 QNTOBPRIKLQSDB-LJQANCHMSA-N 445.567 4.227 10 10 IICE Cc1cc(CCNC(=O)NC(C)(C)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1313101394 VEKFUXPKPQDTKI-UHFFFAOYSA-N 428.577 4.239 10 10 IICE CC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccccc1OCC(=O)NC 1350924586 URYHKCOYALTWQB-HSZRJFAPSA-N 433.552 4.029 10 10 IICE COC(=O)c1ccc2c(n1)CCCN2C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1437670416 ZEZMBKCMMTVINE-UHFFFAOYSA-N 437.927 4.451 10 10 IICE C[C@@H](Cc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCSCC2)cc1 1441632020 QVZQSUHTKDQHSK-INIZCTEOSA-N 433.415 4.497 10 10 IICE CC(C)Oc1ncc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1445878312 BKRMGRVLYOXJST-QGZVFWFLSA-N 438.355 4.276 10 10 IICE CCCN1CCN(c2ccc(NC(=O)c3ccc(N=NC(N)=O)cc3)c(OCC)c2)CC1 1447806573 ZUCBPOCCWDXVBS-UHFFFAOYSA-N 438.532 4.032 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3cn(-c4ccc(Cl)cc4)nn3)ccc21 1457568345 UEUKYQGSKARRMQ-UHFFFAOYSA-N 438.915 4.496 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCOC[C@@H]3C)cc2)cc1 1468662632 WYAYLONOLPQBES-IBGZPJMESA-N 431.536 4.313 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@@H](CCOC)C2)cc1 1515526279 NHZSMTYTENVETB-NRFANRHFSA-N 434.588 4.097 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC=C(COC)CC2)cc1 1515534325 ZCCNIDXJTILCKO-QHCPKHFHSA-N 439.604 4.197 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)no2)cc1 1516820069 VWPNLRZQPMQDRD-HZPDHXFCSA-N 439.487 4.033 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N(C)Cc2cc(Cl)ccn2)cc1F 1517003479 JETFGCZDIPPZPG-UHFFFAOYSA-N 428.943 4.169 10 10 IICE COC(=O)[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(F)c(C)c1 1528173630 KWASTXTUNVIQBC-DEOSSOPVSA-N 438.499 4.007 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533327089 AXWGPEKVYVARQM-JKSUJKDBSA-N 441.519 4.019 10 10 IICE CNS(=O)(=O)c1cccc(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c1 1540730676 LQKDSLXWZKWNMI-UHFFFAOYSA-N 439.581 4.056 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)[C@@H]2CCC[C@@H](C)C2)cc1 1547444290 LJOOXBAAEBFPGX-DENIHFKCSA-N 440.636 4.326 10 10 IICE Cc1ccnc(-c2n[nH]c([C@@H](C)NC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)n2)c1 1565162744 YVCCMEYXJUVHEQ-GOSISDBHSA-N 443.555 4.186 10 10 IICE CC[C@@H](C)c1nnc(N(CC)C[C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1613191308 ONCMKLFTOJWPLE-DENIHFKCSA-N 443.661 4.398 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc(=O)c4cc(OC)c(F)cc43)c2C)cc1 1613699202 WBPXQKNEUZYXQM-UHFFFAOYSA-N 449.482 4.233 10 10 IICE O=C(NCCCSc1nccs1)c1ccc2[nH]cc(I)c2c1 1616242757 XSWXZKVBQFRWKF-UHFFFAOYSA-N 443.335 4.141 10 10 IICE COC[C@@]1(C(=O)NCc2ccc(N3CCCCC3)cc2)CCCCN1C(=O)OC(C)(C)C 1630700604 AZRMOCJUNZQZIC-RUZDIDTESA-N 445.604 4.099 10 10 IICE COc1ccc(F)cc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1632692423 XHDQNGNULBSTKA-UHFFFAOYSA-N 433.527 4.451 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-n2cccn2)c(C)c1 1634384802 JQMYABNFFFARAH-UHFFFAOYSA-N 434.540 4.183 10 10 IICE Cc1cc(CNC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)n1-c1ccccc1 1637577886 JPBVDUUXXVBQHD-UHFFFAOYSA-N 445.611 4.338 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cccc(Cl)c1O 1637615847 DTZDQTQCZVSOJJ-GDNBJRDFSA-N 436.917 4.415 10 10 IICE Cc1cc(C(=O)Nc2cc(-c3nccn3C)[nH]n2)c(C)n1-c1ccccc1Br 1640082282 CSUIIIQDUZIJCA-UHFFFAOYSA-N 439.317 4.233 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(Cc4nc(C(C)C)n[nH]4)CC3)c2C)cc1 1640614791 ZPRMPFJKWFPBAZ-UHFFFAOYSA-N 435.572 4.439 10 10 IICE COc1ccc(C)cc1[C@@H](C)N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1643356157 RVIZLUQDXUDGRU-IAGOWNOFSA-N 442.515 4.457 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3CCC3CCCC3)cc2F)C[C@@H](C)O1 1644947626 XSSUUGQFKZBHPZ-ZRCGQRJVSA-N 445.623 4.490 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3CC3CCCC3)cc2F)C[C@@H](C)O1 1654062617 OVRIDJOYDOLJEQ-KNKQGSTJSA-N 431.596 4.100 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@]2(C)Cc2ccccc2C(F)(F)F)cc1 1655134118 MEZIQCXPGZPSNV-HSZRJFAPSA-N 433.518 4.485 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCc3ccccc3NC2=O)cc1 1682375636 UMCITKFAIQYELX-QHCPKHFHSA-N 432.524 4.011 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](COC(=N)O)Cc3ccccc3)c2C)c1 1683304320 WNDLUKSREFSOER-QFIPXVFZSA-N 434.540 4.322 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(CCNC(=O)OC(C)(C)C)CC1 1683424630 GTJWWKZOEUESJR-IBGZPJMESA-N 446.636 4.328 10 10 IICE CCc1nnc(N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)n1Cc1ccc(N(C)C)c(F)c1 1694698423 UJKYRHAWCMYYGU-QFBILLFUSA-N 426.367 4.114 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1 1705653414 GWVSCMYIPSUCEF-JOCHJYFZSA-N 449.624 4.334 10 10 IICE CC(C)Cc1nnc(N(C)C[C@H]2CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1723272420 BPXQUZXUNLTCNV-JOCHJYFZSA-N 425.621 4.234 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1727699639 SKZIGEIGWKCBQR-NPWUYRIISA-N 441.620 4.050 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCSC2)cs1 1742565017 DWRAICZCCOZWMY-INIZCTEOSA-N 429.615 4.119 10 10 IICE CC1(C)CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CC(C)(C)O1 1751295357 PWQBEEFZFORDJU-UHFFFAOYSA-N 444.630 4.373 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(C)CCOCC1 1761877110 GGCCJFANZSIHHG-SFHVURJKSA-N 445.583 4.083 10 10 IICE CCCCN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1764058121 UWIBUACUUOXPOI-UHFFFAOYSA-N 435.551 4.006 10 10 IICE COC(=O)c1c(NC(=O)c2cc(O)c(O)c(O)c2)sc(C)c1-c1ccc(C)c(C)c1 1865876676 ZTDYXSYJQVYRMM-UHFFFAOYSA-N 427.478 4.496 10 10 IICE COC(=O)c1c(C(F)(F)F)nn([C@H](c2ccc(OC)cc2O)C2CC2)c1Br 2079853528 FIKPAPCVWNVRCD-ZDUSSCGKSA-N 449.223 4.165 10 10 IICE CN1C(=O)C(=Cc2ccc(OC(=O)c3cccc(Br)c3)cc2)SC1=S 2293644673 DFQQVJWJBLPDNG-UHFFFAOYSA-N 434.336 4.499 10 10 IICE COc1ccc2nc(C=C3SC(=S)N([C@@H](C(=O)O)c4ccccc4)C3=O)ccc2c1 2296607509 NCLSXSRWTVUNMO-LJQANCHMSA-N 436.514 4.271 10 10 IICE CCOC(=O)c1[nH]c2ccc(OC)cc2c1N=NN1CCN(c2ccccc2OC)CC1 2297679935 UCSMNUVJVRWIKP-UHFFFAOYSA-N 437.500 4.183 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc3c(c2)OCO3)N2CCc3ccccc32)cc1 9529644 FYUUKRNKSCBJKE-QHCPKHFHSA-N 429.520 4.015 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3CCCN(Cc4ccccc4)CC3)ccc(N)c2C1 323461394 IVZBUJWZGZPYCZ-UHFFFAOYSA-N 436.600 4.274 10 10 IICE Cc1cc(CCNC(=O)N2CCN([C@H](C)c3cccnc3)CC2)c(C)n1-c1ccccc1 734213480 MAQRKABTLCSGEE-OAQYLSRUSA-N 431.584 4.120 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3c3ncnc4ccccc34)cc2)CC1 750779259 UTKDRPQIADSBCA-DEOSSOPVSA-N 429.568 4.151 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(F)c1F 768742202 ZXZBTACOJJCJIT-QGZVFWFLSA-N 428.527 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nc(Cc3ccccc3)no2)C1 769663315 NYQZBVUGVLWWPH-UHFFFAOYSA-N 444.535 4.125 10 10 IICE O=c1c(Cl)c(N2CC=C(c3ccc(Cl)nc3)CC2)cnn1-c1ccc([N+](=O)[O-])cc1 773248705 YRUYRMFKNUKDQT-UHFFFAOYSA-N 444.278 4.136 10 10 IICE COc1ccc(N2CCCN(C(=O)CCC(=O)c3ccc(OC)cc3Cl)CC2)cc1 779890841 YZUDPJYVNWVQMW-UHFFFAOYSA-N 430.932 4.059 10 10 IICE CCCCCCOc1ccc(/C=C2/SC(=S)N(CCN3CCOCC3)C2=O)cc1 814273828 DBVBHWXWAHVSRU-LVZFUZTISA-N 434.627 4.179 10 10 IICE COc1ccc(N2CCC(NC[C@H]3CN(Cc4ccccc4)CC34CCOCC4)CC2)cc1 815149327 JBEITSZMUOBECP-DEOSSOPVSA-N 449.639 4.182 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H](c2cccc(Br)c2)N2CCCC2)cc1F 1125534055 AAAOHCMKVQAHMU-FQEVSTJZSA-N 434.353 4.108 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)c1C 1136408046 APNHFGKIFXJPQY-UHFFFAOYSA-N 430.957 4.260 10 10 IICE COC(=O)c1cc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc([N+](=O)[O-])c1 1136960130 KSJHAJFJMYRLBL-UHFFFAOYSA-N 435.436 4.162 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)/C(F)=C\c1ccc(C(F)(F)F)cc1 1141926466 FCDGOIWJVZNTFI-GIJQJNRQSA-N 444.375 4.447 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1n[nH]c2ccc(F)cc12 1143904122 FPFHNPCOMPGTRO-SXGWCWSVSA-N 444.488 4.071 10 10 IICE Cc1ccc(C(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1146305527 BACAKPMXSATPRF-KRWDZBQOSA-N 427.545 4.200 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@H](C)[S@@]1=O 1157481651 CAPKRZJTMTZFGE-PVUPQYDMSA-N 437.403 4.228 10 10 IICE CCN(CC)S(=O)(=O)c1cc(NC(=O)[C@H](C)Sc2ncc(Cl)s2)ccc1C 1189832157 KUKLWBVDCQGSIQ-LBPRGKRZSA-N 448.035 4.255 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)c(C)n1-c1ccccc1 1226383364 OEHSXAZRLOJZGS-XMMPIXPASA-N 436.600 4.260 10 10 IICE C[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1229369935 CRRAIOQMVLEPHG-ICSRJNTNSA-N 449.592 4.166 10 10 IICE CC(C)COc1ncc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1264689025 GYYHNQKMBZFDRW-IYBDPMFKSA-N 449.954 4.453 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 1265093960 NJWIERSSMCLYTI-UHFFFAOYSA-N 435.528 4.439 10 10 IICE CN1CCCc2cc(CNC(=O)C3(c4ccc(I)cc4)CC3)ccc21 1292207055 QHFDDLODWLZERD-UHFFFAOYSA-N 446.332 4.022 10 10 IICE O=C(CCOc1ccc(Cl)c(F)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294858224 BHCGFLDHDZDTCB-MRXNPFEDSA-N 441.330 4.388 10 10 IICE CCSCCCn1c(-c2cnn(C)c2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1297922247 VJYKSHPYSOHQAB-UHFFFAOYSA-N 439.633 4.058 10 10 IICE Cc1cc(CNC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)c(C)n1-c1ccccc1 1302260479 ATHOJEJGWDPRFU-UHFFFAOYSA-N 429.442 4.159 10 10 IICE CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1312669711 CKAWBPHGZDCRJK-GOSISDBHSA-N 439.581 4.448 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@@H](C)C2 1355244940 IFVIKCLDGHWCMW-HUUCEWRRSA-N 444.553 4.018 10 10 IICE CNS(=O)(=O)c1ccc(C)c(NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)c1 1358319274 NQBOOMOUENKLCM-UHFFFAOYSA-N 431.945 4.216 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)cc1 1437386903 VBPDYTYHGXDDCM-UHFFFAOYSA-N 435.499 4.295 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H](c3ccc(Cl)cc3)N(C)C)cc2F)C[C@@H](C)O1 1441786031 POZUSQLFMOWCNG-DMPWYTOCSA-N 433.955 4.012 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)COc2ccc(F)cc2F)cc1 1442225978 QMAIKMMKULWXHS-HNNXBMFYSA-N 426.463 4.311 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)c(Br)cc1C 1446816311 NMBONCYXTFHRBG-UHFFFAOYSA-N 440.721 4.240 10 10 IICE Cc1cc(CC(=O)N(CCO)Cc2ccc(Br)s2)c(C)n1-c1ccccc1 1448974243 WGDYWIVGMPYKEU-UHFFFAOYSA-N 447.398 4.482 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC[C@H]2CC2CC2)sc(C)c1-c1ccccc1 1473823037 OEEIDMYGOBOEMR-LJQANCHMSA-N 442.581 4.340 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(C)(C)SC 1495111088 JFYDXJOUBAEZPU-SFHVURJKSA-N 431.650 4.406 10 10 IICE COCCN(C)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1519110555 NOMOXGNPSAGMDJ-UHFFFAOYSA-N 448.615 4.087 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CC(=O)N(C)[C@@H](C)c2ccccc2)CCCC1 1523800497 SKXGAPKAGBNBOG-IBGZPJMESA-N 447.579 4.207 10 10 IICE CCn1cc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n1 1526370705 REUNPHRHUQSWLH-UHFFFAOYSA-N 431.334 4.167 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccc(C(C)(C)C)cc3)cc2F)C[C@H](C)O1 1527481389 KYTKHLOJBRNCGO-ROUUACIJSA-N 428.548 4.432 10 10 IICE Cc1cc(CC(=O)NCCc2ccccc2S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1537456272 OCZNZRHGLKYWBF-UHFFFAOYSA-N 444.984 4.052 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C3(c4cc(F)cc(Br)c4)CC3)C2)cc1 1538747035 NUIDLMTXNZUYCL-KRWDZBQOSA-N 433.321 4.024 10 10 IICE Cc1nc2c(Cl)cccc2cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1544629877 DEVVCDGVNBIPTA-UHFFFAOYSA-N 427.907 4.227 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@@](=O)CC 1547533480 NUNXZNDUAVLRLF-HKBQPEDESA-N 439.629 4.358 10 10 IICE CC(=O)c1cc(F)cc(CN2CCN(C(=O)c3sc4ccccc4c3C)CC2)c1O 1559554563 FQCWSHWIRZPRAD-UHFFFAOYSA-N 426.513 4.215 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCc2ccnc(Oc3ccccc3)c2)N(C)C)cc1 1565028980 YMNSNWIKUSWTGY-HSZRJFAPSA-N 433.556 4.042 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc4cc(Br)ccc4c3)cc2)CC1 1598277157 LFESYGCPCFOTPL-UHFFFAOYSA-N 438.369 4.284 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C[C@H](C)O1 1612969145 YGBMCQSMSYQANS-GJZGRUSLSA-N 435.644 4.183 10 10 IICE Cc1ccc([C@@H](C)N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)c1 1615239387 CVXDMLMXGZSCEI-QHAWAJNXSA-N 441.591 4.365 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C[C@@H]1F 1620307894 RMLLWDAZEPFGKS-PBHICJAKSA-N 435.569 4.441 10 10 IICE CCN(C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)[C@@H]1CCN(c2ccccc2)C1=O 1627374536 PPCNFCFYEWOJPW-XMMPIXPASA-N 443.547 4.483 10 10 IICE CC(C)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1F 1627775089 VHJPZGAHVXGYGO-UHFFFAOYSA-N 448.541 4.101 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C 1628859970 HUELQPGFZIAVRV-JOCHJYFZSA-N 439.556 4.048 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@H](C(F)(F)F)C2)c(C)n1-c1ccc(Br)cn1 1629963355 KUCHMLGJXWSPIS-NHYWBVRUSA-N 446.267 4.043 10 10 IICE CCc1c(C(=O)NCc2c(O)ccc3c2CCCC3)nnn1-c1ccc(OC(C)C)cc1 1630273507 QJZGSGYIIKPTAB-UHFFFAOYSA-N 434.540 4.131 10 10 IICE Cc1cc(CNC(=O)CNC(=O)Cc2cccc3ccccc23)c(C)n1-c1ccccc1 1631793841 IPSLFCOBGPTZQQ-UHFFFAOYSA-N 425.532 4.222 10 10 IICE Cc1cc(C(=O)NCc2nc3ccccc3n2C)c(C)n1-c1ccc(Br)cn1 1632468755 KHCBNAUARSZOHM-UHFFFAOYSA-N 438.329 4.068 10 10 IICE CC1(C)[C@H](c2cccc(F)c2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1637228869 PPXPKQCFPQOVRI-QHCPKHFHSA-N 425.548 4.265 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](C)SCC(=O)Nc1ccc(F)cc1 1638239130 HRXDPNDJLGXWPI-DLBZAZTESA-N 431.577 4.008 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCN(C)C(=O)OCCOC 1640762634 NIGQSWLPOINSKT-UHFFFAOYSA-N 428.352 4.097 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)Cc1ccccc1 1644441696 YYMZAHJOXRHENJ-NHCUHLMSSA-N 441.591 4.214 10 10 IICE CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2cccc(Br)c2O)CC1 1648755779 IHOKZKORXYLSPM-UHFFFAOYSA-N 448.317 4.229 10 10 IICE COCCN(CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)CC(=O)OC(C)(C)C 1652473386 UQSNFQVXTHLXRF-UHFFFAOYSA-N 426.517 4.331 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]2[C@H]2CCCO2)sc(C)c1-c1ccccc1 1653594125 DCTHKWIFXVOXFQ-RTBURBONSA-N 442.581 4.482 10 10 IICE COc1ccc(N2CCN(CCCC3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1F 1653749346 KZBYNXARGUTYKZ-UHFFFAOYSA-N 435.584 4.384 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(NC(=O)OC(C)(C)C)cc3)C2)cc1 1682646225 PQFVYGPBGQFVMA-LJQANCHMSA-N 440.544 4.120 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCO[C@H](C)C1 1693995504 HSHKWJXQQCIZRC-VWPQPMDRSA-N 441.620 4.080 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCO[C@@H]1C)C(C)C 1695536052 PNEOGIVYRNLPKB-CJFMBICVSA-N 437.588 4.127 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1Cc1cccc(Br)n1 1696699463 BZMRAZVYLNNBPZ-UHFFFAOYSA-N 428.334 4.093 10 10 IICE C[C@H]1CSCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1726750426 AWAZKUGMDQJCDE-KRWDZBQOSA-N 431.675 4.119 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC[C@H](C)C1 1752066506 WFCYNWUDOMOJHI-PZJWPPBQSA-N 438.620 4.089 10 10 IICE CC(C)(C)OC(=O)N1[C@@H](CNCc2cc(Cl)cc(Br)c2O)COC1(C)C 2103031212 MKKCSJQHJXERHD-ZDUSSCGKSA-N 449.773 4.270 10 10 IICE CCCCOc1ccc(Br)cc1C=C1SC(=S)N(CCC(=O)O)C1=O 2293911563 FCZLKGMTVPNUSR-UHFFFAOYSA-N 444.372 4.304 10 10 IICE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12 2296398049 PRWQWYNQGGELGS-UHFFFAOYSA-N 435.483 4.352 10 10 IICE CCOC(=O)CCN1C(=O)C(=Cc2ccc(OCCc3ccccc3)cc2)SC1=S 2314759287 AIAUHAFIHLKSDP-UHFFFAOYSA-N 441.574 4.463 10 10 IICE Cc1ccc(CNC[C@H]2CCN(C(=O)OC(C)(C)C)C23CC3)c(O)c1Br 2352949925 KYMUFAWZYVIZLI-OAHLLOKOSA-N 425.367 4.342 10 10 IICE Cc1ccc(CN(C)C(=O)[C@]2(C)CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380760322 WQDLKZSTUJTZOO-FQEVSTJZSA-N 441.366 4.211 10 10 IICE O=C1/C(=C\c2cccc(F)c2)SC(=S)N1CC(=O)N1CCCC[C@@H]1c1cccnc1 33585399 WNZTTXMNTGEIAJ-LSCADSNKSA-N 441.553 4.176 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)N[C@H](C)c4ccc(F)cc4)cs3)CC2)cc1 65211561 JXQHPEPDMQTTBS-MRXNPFEDSA-N 440.544 4.108 10 10 IICE CC(C)c1cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c2cnn(C(C)C)c2n1 109179706 XOIOIWSOQPJTIF-GOSISDBHSA-N 435.572 4.463 10 10 IICE C[C@@H](NC(=O)c1ccccc1SC[C@@H]1CCCO1)c1ccc(N2CCOCC2)cc1 109179968 RIPOVRQLWVHHQQ-NQIIRXRSSA-N 426.582 4.285 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CCN(c4cccc(OC)c4)C3)ccc21 486221884 ZDTAPZJUGBZUOD-FQEVSTJZSA-N 435.568 4.169 10 10 IICE COc1ccccc1[C@@H](O)CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 725884515 BROPNAHZUFSVJI-FQEVSTJZSA-N 443.341 4.329 10 10 IICE COc1ccc(Nc2nc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cs2)cc1 740740732 ZYXDLIBDYKWXIA-UHFFFAOYSA-N 438.553 4.004 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(C)c(OCC4CCOCC4)c3)CC2)cc1 741402992 HTCCYRHFFUJDAA-UHFFFAOYSA-N 439.556 4.163 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N(Cc1ccco1)Cc1ccccc1O)CC2 759090994 USWLTDPPAYKKEJ-HNNXBMFYSA-N 445.441 4.436 10 10 IICE CN1CC[C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)[C@H]1c1ccc(Cl)cc1 760878941 OKCWKSSNGUYMTL-FUPPJEDESA-N 443.975 4.182 10 10 IICE C[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(N2CCCCCC2)cc1 767157759 WZHJKRKGVAAUIN-ICTDUYRTSA-N 446.639 4.317 10 10 IICE COc1cccc([C@@H]2CCCN2C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 769037498 MYOKJPXYPSTYOG-SANMLTNESA-N 448.611 4.274 10 10 IICE O=C1COc2cc(C(=O)Nc3cccc(N4CCCCC4)c3)c(Br)cc2N1 782589207 QQBHFQNNTNUJLL-UHFFFAOYSA-N 430.302 4.023 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3cnccc3C(F)(F)F)n2)c1 785543127 IWOHCAYPFJJBQO-UHFFFAOYSA-N 445.444 4.042 10 10 IICE CC(C)(C)C(=O)NCc1ccc(Cl)c(C(=O)Nc2cccc(N3CCOCC3)c2)c1 785921837 WQJXLPCQIZEPRD-UHFFFAOYSA-N 429.948 4.091 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3nc(Cl)cs3)c2C)cc1 789220030 OSYGYWGBAVQLOL-UHFFFAOYSA-N 432.885 4.030 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCc2cnn(C(C)C)c2C1 790581506 FFTGZEADYLFBRV-QGZVFWFLSA-N 435.366 4.021 10 10 IICE Cc1cc(-c2nnc(N3CCOC(C)(C)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802694152 FWROSQAHOPWMAZ-OAQYLSRUSA-N 435.572 4.147 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc(Cc3ccsc3)n2C[C@@H]2CCOC2)cc1 802760691 YNFYTADNBCVVEC-NRFANRHFSA-N 439.629 4.450 10 10 IICE C[C@H](NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)c1ccc(N2CCOCC2)cc1 812015495 QXGJXDFMUJPORU-UWJYYQICSA-N 439.560 4.172 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1cccc(C(=O)O)c1 1081114113 LBKIOVMMGNFVOJ-LGMDPLHJSA-N 444.534 4.378 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CC[C@@H](C)C2 1124129669 OIAZEMSWGKSHCN-KGLIPLIRSA-N 444.528 4.180 10 10 IICE Cc1cc(CC(=O)Nc2cc(F)c(N3CCOCC3)cc2F)c(C)n1-c1ccccc1 1128817950 HVIZLYLBVWADCF-UHFFFAOYSA-N 425.479 4.390 10 10 IICE COC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1135727381 GRRZHDBLSLEELZ-UHFFFAOYSA-N 428.286 4.291 10 10 IICE CSc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1Br 1135733239 ZDZUWKJIYDADEM-UHFFFAOYSA-N 435.387 4.280 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H](Cc1ccccc1)c1ccccc1 1138054113 XNJMKRZRIDMISD-PKTZIBPZSA-N 447.531 4.105 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C(C)(C)C2)c(C)n1-c1ccccc1 1142320188 OQBPWCRCZMERPL-UHFFFAOYSA-N 425.573 4.495 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1c[nH]c2c(Cl)cc(Br)cc2c1=O 1146231258 DIIXNBJGLBXWIN-UHFFFAOYSA-N 442.096 4.233 10 10 IICE COC(=O)C[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@H]1C 1155641514 LLQYXRKSIHSHDO-CZUORRHYSA-N 433.346 4.128 10 10 IICE COC(=O)c1cnc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C(F)(F)F)c1 1162205928 LAVSVFKXYPZAER-STQMWFEESA-N 441.425 4.252 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4c(F)cc(Br)cc4[nH]3)C2)cc1 1162724718 IFFYTYLQPXYMIO-ZDUSSCGKSA-N 446.320 4.334 10 10 IICE C[C@@]1(C(=O)NCc2ccc(N3CCCCC3)cc2)CC1(Br)Br 1162800860 PHEZKALTMGGFJP-INIZCTEOSA-N 430.184 4.189 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NC(C)(C)C)c(C)n1-c1ccccc1Br 1178489851 HVRGTLDDPMNQMG-LJQANCHMSA-N 446.389 4.376 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@]12CCN(C(=O)OC(C)(C)C)C2 1251990010 RARNKIXCJVUDPM-CLOONOSVSA-N 444.620 4.177 10 10 IICE O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 1252903109 TZRPIIZLWNGSMQ-UYAOXDASSA-N 443.975 4.263 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(C(F)(F)C(F)(F)F)cc3)cc2)CC1 1288334730 OJAAUBPENIRXOC-UHFFFAOYSA-N 427.417 4.023 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)c(F)c1 1292025890 WMYQXHBVBNSKLN-DLBZAZTESA-N 444.599 4.075 10 10 IICE CCC[C@@](C)(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1293843567 HLSAMPVZRLAGHY-DRMXPCRNSA-N 430.593 4.090 10 10 IICE CC(C)(C)OC(=O)[C@@]1(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC=CCC1 1294858249 BWRVMVUFZDWGHE-DVECYGJZSA-N 448.991 4.194 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)CC[C@@H]3C)n2CCCSc2nccs2)n1 1304751468 LSSIPDHPPHBVLP-WBVHZDCISA-N 445.662 4.403 10 10 IICE COCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C 1315963129 DHPYBOGWYGSKJM-BVZFJXPGSA-N 437.588 4.129 10 10 IICE Cc1cc(CC(=O)NC(C)(C)C(=O)NCC2CCCC2)c(C)n1-c1ccc(Cl)cc1 1357256806 MXYYCESKMNLBJW-UHFFFAOYSA-N 429.992 4.491 10 10 IICE COc1ccc(CN2CCCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2=O)cc1 1447350479 QAVUJTXSOYJNMD-UHFFFAOYSA-N 449.526 4.117 10 10 IICE Cc1ccc(C(=O)N[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1450061684 YWQBWHXVQSSENF-IAGOWNOFSA-N 427.545 4.247 10 10 IICE Cc1cc(C(=O)NCC(C)(C)[C@@H]2COCC23OCCO3)c(C)n1-c1cccc(C(C)C)c1 1451237709 KTNRRSWXUXIDEO-QHCPKHFHSA-N 440.584 4.363 10 10 IICE CCOc1ccccc1[C@](N)(C(=O)NCc1cc(Cl)cc(Cl)c1O)C(F)(F)F 1457854212 JFOLSDQHXNJUBS-KRWDZBQOSA-N 437.245 4.130 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccco3)c3ccc(C)c(C)c3)CC2)cc1 1459720990 CIOJPDWTNHVXSM-RUZDIDTESA-N 449.595 4.095 10 10 IICE CCN1CCN(Cc2ccc(CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)cc2)CC1 1464157654 IJCPCLXSYBLAQS-UHFFFAOYSA-N 430.596 4.162 10 10 IICE COc1ccc(S[C@@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952116 VPKHZSWIDYMZTN-YJBOKZPZSA-N 434.989 4.316 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC[C@@H]1CCCCO1 1495756369 YIBMIHLOEODNJZ-QUCCMNQESA-N 445.583 4.225 10 10 IICE CCCCN1CCCC[C@H]1Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1500534643 GTJSGXNBUKZEGI-VXKWHMMOSA-N 441.620 4.169 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C2CCC2)n1CCC(=O)NC(C)(C)C 1503474252 YMVAEHGAAAGUQZ-UHFFFAOYSA-N 438.620 4.087 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1504963864 ODXLOQKEQBIJFC-QZTJIDSGSA-N 447.599 4.128 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1 1528924128 JMAFVVAERGWVGP-MJGOQNOKSA-N 437.613 4.030 10 10 IICE Cc1ccc(C(=O)NCc2cccc(N3CCCC3=O)c2)cc1-n1c(C)cc(C=O)c1C 1541050224 WFXHQVDVORMGJF-UHFFFAOYSA-N 429.520 4.272 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1544578218 YNPFBKQHMKPJCV-HXUWFJFHSA-N 447.482 4.022 10 10 IICE COC[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1555344234 ZMMUYRWFKMNVOG-HXUWFJFHSA-N 443.661 4.040 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NCc1cccc(Br)c1O 1556481472 UHELTPJMQIOYJU-RTBURBONSA-N 431.374 4.319 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3cc(Br)cs3)C2)cc1 1564962081 FFQCPCJYQMSKCD-CQSZACIVSA-N 438.391 4.187 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cc(Br)ccc3C)C2)cc1 1564962821 OYQIRNGLNGWSBQ-INIZCTEOSA-N 432.362 4.092 10 10 IICE CCN(C)C(=O)OC[C@@H]1CCCCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1568721352 UZOBIHNYXHXHDD-QFIPXVFZSA-N 439.556 4.298 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2cc(=O)n3ccccc3n2)cc1 1585207946 KREJWCOTFCCNKN-UHFFFAOYSA-N 426.480 4.106 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)N(C)C)cc1 1586055076 UUOFVRHCQMMROZ-OAQYLSRUSA-N 442.510 4.038 10 10 IICE CCCCn1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)n1 1586620048 RMGXKGPHKBDTND-NRFANRHFSA-N 443.592 4.053 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(OCc4c(C)noc4C)cc3)C2)cc1 1598364134 NAVCWGSJFSDAGQ-NRFANRHFSA-N 449.551 4.064 10 10 IICE CC(C)[C@@H]1OCCC[C@@H]1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1603172452 WBDWWNGZAZJDIF-YKSBVNFPSA-N 435.572 4.057 10 10 IICE CCN(CC(=O)N(CC(C)C)CC(F)(F)F)Cc1cc(Br)ccc1O 1615674660 UGGKZHLTODSHHU-UHFFFAOYSA-N 425.289 4.024 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1C[C@@H]1CCCC[C@@H]1C(F)(F)F 1617940712 QNCMBQYOODWKLN-SZMVWBNQSA-N 438.494 4.493 10 10 IICE C[C@@H](Cc1ccsc1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1621329827 OOEPGRLUPRBBJT-ZDUSSCGKSA-N 436.580 4.019 10 10 IICE O=C(c1cc(OCc2ccccc2)ccc1O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1623640719 MOVOOXKWAYMYPR-QFIPXVFZSA-N 433.504 4.498 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccccc2Cl)c(C)n1-c1ccc(Br)cn1 1635800867 UHERZGDORXVHRR-SFHVURJKSA-N 448.748 4.368 10 10 IICE COc1cccc(-c2nnn(CC(=O)c3cc(C)n(-c4ccc(F)c(Cl)c4)c3C)n2)c1 1640709676 OWBWPEJYZZQILX-UHFFFAOYSA-N 439.878 4.432 10 10 IICE Cc1cc(C(=O)NC[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1643764855 WIYXKUGJNAOKTL-ACDBMABISA-N 438.572 4.397 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1684224305 JXQVZJJYMJJESK-TZIWHRDSSA-N 444.620 4.321 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC(C)(C)c2ccc(Br)cc2)N(C)C)cc1 1685681414 GEUYJFPXNVSRKQ-HXUWFJFHSA-N 447.421 4.352 10 10 IICE C[C@H]1CCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1693735041 RUTOVVUXZPWHCV-SFHVURJKSA-N 436.579 4.390 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1695292627 MSKYKLSDBBNIHQ-IRLDBZIGSA-N 438.664 4.390 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCO[C@@H]1C)C(C)C 1695536055 PNEOGIVYRNLPKB-NLFFAJNJSA-N 437.588 4.127 10 10 IICE CCOCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC1 1696420654 FXDYFTLHXYVPTD-NRFANRHFSA-N 437.588 4.252 10 10 IICE Cc1nc(CCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)sc1C 1706992309 WUZKMWPGCPLYLM-LJQANCHMSA-N 427.574 4.178 10 10 IICE CCS[C@H]1CCCCN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1747498988 JCQGBRAJYUZEAI-UNMCSNQZSA-N 443.661 4.317 10 10 IICE Cc1ncsc1CN(C)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1751354097 NIMNSCFHZLRORH-UHFFFAOYSA-N 443.627 4.380 10 10 IICE CC(C)(C)Cc1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1760754571 AILTWKKNNQNAIF-UHFFFAOYSA-N 425.621 4.378 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC3CC(F)(F)C3)CC2)cc1F 1770257531 CXQWTPWXTJSWSU-UHFFFAOYSA-N 437.510 4.095 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)/C2=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 1865678009 OQMPDUVWHKUCDL-UDWIEESQSA-N 447.422 4.278 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(Br)cc2O)C[C@H]1C1CC1 1895872824 BLQJFVBUWSVDHE-IRXDYDNUSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3cc(Cl)cc(Br)c3O)[C@H]1C2 2038340299 WLEIWTXHUROHFJ-NZVBXONLSA-N 431.758 4.296 10 10 IICE Cc1ccc([C@H](C2CCC2)n2nc(C(F)F)c(CN)c2I)c(O)c1 2079051768 LAOJYRVUSFNECA-HNNXBMFYSA-N 447.267 4.288 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@H]2CNCc1cc(Cl)cc(Br)c1O 2082897966 JWCRJHKMXDQYQT-ZLDLUXBVSA-N 431.758 4.153 10 10 IICE COc1cc(C=C2SC(=S)NC2=O)cc(Cl)c1OCc1ccc([N+](=O)[O-])cc1 2297357552 HEIMYYSJVQGTOM-UHFFFAOYSA-N 436.898 4.325 10 10 IICE CCOc1cc(C=C2SC(=S)N(NC(=O)c3cccc(Cl)c3)C2=O)ccc1OC 2314765082 UJTIHTFIZMNSLU-UHFFFAOYSA-N 448.953 4.294 10 10 IICE CCc1ccc(-n2c(SCC(=O)c3ccc(O)c(O)c3)nc3ccccc3c2=O)cc1 11199513 VGLUZPKDVAJBAT-UHFFFAOYSA-N 432.501 4.334 10 10 IICE COc1cc(OC)c(/C=C2/C(=O)N(c3ccc(Cl)cc3)C(=S)N=C2O)c(OC)c1 33405996 KKMJUBPYLINABS-XNTDXEJSSA-N 432.885 4.037 10 10 IICE CCOc1ccc(N2C(=O)N=C(O)/C(=C/c3cccn3-c3ccc(OC)cc3)C2=O)cc1 59104729 RNSAPSNSFIUHQG-QNGOZBTKSA-N 431.448 4.391 10 10 IICE NC(=O)c1ccc(N2C(=O)/C(=C/c3cccc(OCC(F)(F)F)c3)SC2=S)cc1 726627109 KCYKDNPJOSPOND-DHDCSXOGSA-N 438.452 4.132 10 10 IICE CCOC(=O)c1ccn(-c2ccccc2NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)n1 731109318 QJNYNYBGIJTSAT-UHFFFAOYSA-N 447.539 4.312 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cc(O)nc2ccc(Br)cc12 737794445 QAPOAUYFMWHVLC-UHFFFAOYSA-N 426.314 4.233 10 10 IICE CN1CCC[C@@H](CNC(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H]1c1cccs1 743555505 ZYMMLJADUYEPBE-SIKLNZKXSA-N 444.670 4.184 10 10 IICE O=C(NCC[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 766615736 PWHTYBKSHJKDEE-FQEVSTJZSA-N 430.464 4.387 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 773285553 NDYJKXKILLXUJD-PXDATVDWSA-N 449.595 4.012 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3CCN(C4C[C@@H]5CC[C@H](C4)N5C)CC3)c2C)cc1C 779342170 QSGXHTBOIDKYML-MAOIWGCQSA-N 448.655 4.136 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 781680485 RHJUWNMIABTUIF-GXVATQTDSA-N 436.386 4.378 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](C(F)(F)F)C(C)(C)C3)cc2F)CC1 790305588 NWUTWUPTQPSWTJ-LJQANCHMSA-N 444.517 4.088 10 10 IICE CC(C)OC(=O)c1cccc(Cn2nc(Cc3ccc(N)cc3)c3ccccc3c2=O)c1 821187396 VOBCPVZUKYLJGZ-UHFFFAOYSA-N 427.504 4.183 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3c(Cl)nc4ccccn34)n2)cc1[N+](=O)[O-] 917866329 FLZMZSQKGOQXCM-UHFFFAOYSA-N 449.901 4.129 10 10 IICE Cc1ccc2c(c1)N(C(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)CC2 1125440102 RHKBRYLLKPQANE-CPNJWEJPSA-N 426.538 4.315 10 10 IICE Cc1ccccc1-n1ncc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1C(F)F 1125518483 HAASQPANEVDKPM-QGZVFWFLSA-N 440.494 4.446 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1129548957 HQGZZFOJABJEBY-UHFFFAOYSA-N 425.479 4.139 10 10 IICE Cc1cc(CCNC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c(C)n1-c1ccccc1 1131781772 NZSJOLHQJNIWFX-BGYRXZFFSA-N 432.568 4.075 10 10 IICE Cc1cc(C(=O)N2CC[C@@H]3[C@H](CCCN3C)C2)c(C)n1-c1ccc(Br)cc1 1137305143 AVYBZTXJGHROCG-DYESRHJHSA-N 430.390 4.413 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 1139585963 YURDKDHUPMYYEG-UHFFFAOYSA-N 445.541 4.076 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cc(Br)sc4[nH]3)CC2)cc1F 1150241274 VZNRHQJCPJZGHP-UHFFFAOYSA-N 438.322 4.102 10 10 IICE Cc1cc(CC(=O)N2CCC3(CC2)CN(C(=O)OC(C)(C)C)C3)c(C)n1-c1ccccc1 1159105353 DCPQKFPWRVYJDF-UHFFFAOYSA-N 437.584 4.496 10 10 IICE Cc1cc(C)n(-c2ccc(Cn3c(N(C)Cc4ccccc4O)nnc3C(C)(C)C)cn2)n1 1290579831 ZKKWVPJXOYDAST-UHFFFAOYSA-N 445.571 4.163 10 10 IICE CCc1nnc(N(C)C[C@H](C)c2nccs2)n1Cc1ccc(N2CCSCC2)cc1 1292819298 HCVCVEPKYXXZME-KRWDZBQOSA-N 442.658 4.138 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(=O)N(C)C 1294185431 SPXNIWNYBZPFEX-UHFFFAOYSA-N 436.604 4.457 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)c1 1295916673 ZSYDYPVTIYRFIH-JOCHJYFZSA-N 431.536 4.252 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(N4C[C@@H](C)O[C@H](C)C4)cc3)c2)CC1 1296014165 RYKQKWHOKOIPMI-NHCUHLMSSA-N 436.600 4.083 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)cc1C 1305463540 NQBJTYNVSXUOQQ-AVRDEDQJSA-N 434.588 4.267 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)cc1C 1305740793 RBAZUWKAJGYSLU-HKUYNNGSSA-N 440.636 4.244 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)c3ccccc3[S@](=O)C(F)(F)F)ccc21 1350629343 WODMUMVLUZWQNX-HKBQPEDESA-N 443.402 4.342 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnn(-c2ccccn2)c1C(F)(F)F 1353911087 NZDVXHNPTPGUBG-UHFFFAOYSA-N 429.446 4.159 10 10 IICE CCCOc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 1354755146 OHKJRYQSDGFJEM-INIZCTEOSA-N 434.483 4.484 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(F)(F)c1cc(F)cc(F)c1 1361063600 QLJWGSPCKFZPMT-HNNXBMFYSA-N 432.364 4.443 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC(Cn2cccn2)CC1 1361097911 LLVHCDBVFGFHIY-UHFFFAOYSA-N 449.647 4.403 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1445639099 PHTUQDWQPBXPPL-YLJYHZDGSA-N 432.492 4.109 10 10 IICE Cc1ccc(C(=O)NCc2cccnc2OCC(F)F)cc1-n1c(C)cc(C=O)c1C 1447233995 LBICUNBSHUETHA-UHFFFAOYSA-N 427.451 4.184 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N(C)Cc3cc(Cl)cc(Cl)c3)CC2)cc1 1459797684 OSZDDWLHVBEQEC-UHFFFAOYSA-N 436.383 4.173 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)c(F)c1 1459877084 KBCAEAOWRZVADU-IEGUWTFLSA-N 445.554 4.244 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2cccc(C(F)(F)F)c2nc1O 1463775840 FLYQRZYASMJNND-UHFFFAOYSA-N 445.441 4.068 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2CCNS(C)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1464312378 NPMWETUHMRJFPZ-NRFANRHFSA-N 445.629 4.152 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C=C(\C)c3ccccc3C(F)(F)F)CC2)cc1 1464537315 FDIOYIQJWGCBLC-ISLYRVAYSA-N 447.501 4.056 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)Oc1ccc(F)cc1 1466568036 YRVXZZIDNUFITB-OAQYLSRUSA-N 444.890 4.237 10 10 IICE Cc1cc(C(=O)N2CCO[C@@]3(CCSC3)C2)c(C)n1-c1ccccc1Br 1469308894 ACFMCYSISUGNIQ-FQEVSTJZSA-N 435.387 4.205 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1471543420 IEUXLMXCUWTJRR-DEOSSOPVSA-N 425.621 4.042 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCOCCC(C)C)CC2)cc1F 1518307675 FULLGWYSYIWJDN-UHFFFAOYSA-N 447.599 4.113 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1530833044 AVFHKOKXGCZERH-UTKZUKDTSA-N 434.367 4.204 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3csc(Cc4ccccc4F)n3)C2)cc1 1537110016 UFVWQVXEQKEUHZ-MRXNPFEDSA-N 425.529 4.138 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2c1 1539581250 ASANMHMJSIIVLR-AWEZNQCLSA-N 445.441 4.388 10 10 IICE CC(C)C[C@@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)N(C)C 1541414101 VOKAPXHCHJQZFA-IBGZPJMESA-N 442.995 4.312 10 10 IICE Cc1cnc([C@@H](C)Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)s1 1542836321 OMHDUUWPEZOGSR-INIZCTEOSA-N 434.569 4.175 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(F)cc2)cc1 1545813536 JHTVQPCNXGCOAF-RSXGOPAZSA-N 433.527 4.150 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CC(C)(OC)C2)cc1 1547441757 FLSDLQYNGHJUKZ-UHFFFAOYSA-N 440.979 4.113 10 10 IICE CCN1C[C@H](C)N(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1547644210 DWNBOZRFNNEXRC-MSOLQXFVSA-N 428.600 4.108 10 10 IICE CC(C)Cc1ncnc(NCc2ccc(N3CC=CC3)cc2)c1I 1559114407 RSXGYDAZWRSZCO-UHFFFAOYSA-N 434.325 4.268 10 10 IICE Cc1cc(C(=O)NC2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1Br 1565715528 KRMOEDBWGHFFPM-UHFFFAOYSA-N 448.361 4.206 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@@H]1CCCOC1 1567449550 BFNATLQBXXIRRU-OFNKIYASSA-N 426.557 4.306 10 10 IICE O=C(NCc1cccc(Cl)c1O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1 1606860382 JYHBPTLFJYBSAT-UHFFFAOYSA-N 428.337 4.102 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@@H]1CCC2(CCC2)O1 1611085217 HKQVHLHMXWPUOL-AATZCTEQSA-N 448.585 4.025 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)NCc1ccc(Cl)cc1 1615674050 CLSUZIFHHXKBGA-ZDUSSCGKSA-N 425.754 4.335 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1F 1616925356 WPJPREZCNFYOFK-MRXNPFEDSA-N 443.510 4.180 10 10 IICE CCc1cnccc1[C@@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1624023003 MZUSZPTWQHNCFS-ONDHQXCVSA-N 443.569 4.252 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](C(=O)N(C)c2ccccc2)C1 1626441215 RJDSQVNYIKNPLW-HXUWFJFHSA-N 429.520 4.032 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCCOC2CCOCC2)cc1 1627425833 QLZKLOXARZOLTJ-UHFFFAOYSA-N 426.557 4.270 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H](CS(C)(=O)=O)c1ccccc1 1632697023 DAGRUDHBUAVJHE-WMZHIEFXSA-N 437.561 4.310 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)N2CCOCC2)c(C)n1-c1cccc(C(C)C)c1 1639906432 TYLMCHKMVNLUHB-DEOSSOPVSA-N 439.600 4.221 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC2CCC2)[C@H](C)CO)sc(C)c1-c1ccccc1 1642865358 DGXFYLMINSQZDR-MRXNPFEDSA-N 444.597 4.322 10 10 IICE O=C(CN(CC1CCC1)CC(F)(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1644715595 AMPWYIAVLXRFBA-UHFFFAOYSA-N 430.426 4.065 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 1644794722 YBYQOCCZVFBISH-UHFFFAOYSA-N 433.955 4.095 10 10 IICE Cc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)NCc3cccc(Cl)c3O)c2)c1 1647827124 YDJBKJAPTQZKCP-UHFFFAOYSA-N 444.940 4.393 10 10 IICE Cc1cccnc1[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)(C)C 1655823843 NEANRBVBQBOCLL-SANMLTNESA-N 441.531 4.481 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N(Cc3cccc(F)c3)C(C)(C)C)CC2)cc1 1657875617 FCBQVXHNJNRUMR-UHFFFAOYSA-N 427.564 4.174 10 10 IICE CCOc1ccc(N2CCN(Cc3nc(-c4cc(Br)cs4)no3)CC2)cc1 1657876541 UZQFJBUDJHHKFA-UHFFFAOYSA-N 449.374 4.282 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@H](c4cccc(Cl)c4)C3(C)C)nc12 1660022762 PZFNUGIUDYXREK-GOSISDBHSA-N 428.920 4.033 10 10 IICE CC[C@@H](C)CN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)cc1C 1694181059 NJQFEOXUHJBNHS-LJQANCHMSA-N 445.615 4.422 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1 1695437371 VGMDBRFBJBRMIP-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1n[nH]c(C)n1)C(C)C 1709934537 YGRNMBNQDMYZAL-UHFFFAOYSA-N 432.576 4.257 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710767709 VBRSKSYYCNPOEZ-UGKGYDQZSA-N 445.583 4.026 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@@H]3CCCCCC[C@@H]32)n1CCCSc1nccs1 1723580805 SNPPTKSNDPUJFK-IRXDYDNUSA-N 448.662 4.214 10 10 IICE CC[C@@H]1CCN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)C1 1727768284 NPEBPQIPHCADQX-QGZVFWFLSA-N 431.635 4.015 10 10 IICE CCC[C@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CCO1 1727981931 DFHSRZJHJVPBOM-INIZCTEOSA-N 433.603 4.491 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1Cc1cccnc1OCC(F)F 1729420742 UEGBRYMGBLRPPW-UHFFFAOYSA-N 443.498 4.365 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1761993767 YXYSZUHGXXDCFU-LJQANCHMSA-N 449.647 4.443 10 10 IICE CC[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1765122398 DBBSWEVHLKPKFX-HXUWFJFHSA-N 425.621 4.378 10 10 IICE CCOCc1nnc(N2Cc3ccoc3CC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1766269854 JRQUNJSUOCJRPC-UHFFFAOYSA-N 437.588 4.419 10 10 IICE CCSc1cc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)ccn1 1766772032 GXFULXNMRVXLNZ-UHFFFAOYSA-N 446.580 4.161 10 10 IICE COc1ccc2c(c1)c(/C=C1/SC(=S)N([C@@H](C(=O)O)c3ccccc3)C1=O)cn2C 1858591174 AJXGYZVXGAWROS-SZVPOVDMSA-N 438.530 4.214 10 10 IICE CC(C)Oc1cccc(CNCCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1860714589 LRDYSTWHMHCAFR-UHFFFAOYSA-N 442.515 4.368 10 10 IICE CN(C)c1ccc([C@H](NC(=O)c2ccccc2C(=O)c2ccccc2)c2nccn2C)cc1 1865887641 SVJVBBFPXJXRRN-DEOSSOPVSA-N 438.531 4.237 10 10 IICE C[C@@H]1CN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)CCN1C(=O)OC(C)(C)C 2044631696 VUUNDWBTAZWUSZ-MRXNPFEDSA-N 446.592 4.008 10 10 IICE CCN[C@@H](CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1)c1ccc(N(C)C)cc1 2044751576 CBFVATBYBNKEJD-DEOSSOPVSA-N 440.632 4.430 10 10 IICE Cc1cc(C(=O)COC(=O)C=Cc2ccccc2[N+](=O)[O-])c(C)n1-c1ccc2c(c1)OCO2 2053515709 GQCCHOQNHPSRMR-UHFFFAOYSA-N 448.431 4.170 10 10 IICE CCOC(=O)c1c(CC)nn([C@H](c2ccc(OC)cc2O)C(C)C)c1Br 2079982519 WNTSIDRIEUVFDO-KRWDZBQOSA-N 425.323 4.344 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C3CCC3)c(CN)c2I)cc1C 2079998626 RZBYJFKBDIBOPB-GFCCVEGCSA-N 425.314 4.146 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@@H]1NCc1cccc(Br)c1O 2144144701 LKDXLQQDKRJCFM-ROUUACIJSA-N 433.346 4.435 10 10 IICE O=C1N=C(N2CCN(Cc3ccccc3)CC2)SC1=Cc1ccc(N2CCCCC2)o1 2314646722 KZGIYFXQXAMQOZ-UHFFFAOYSA-N 436.581 4.058 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314770049 YMPSJKORVOYIMP-KRWDZBQOSA-N 428.491 4.100 10 10 IICE CC[C@H](NC[C@H]1[C@@H]2C[C@H]1CN2C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2333093373 YZEGDZOJHWIRRX-IEAZIUSSSA-N 425.367 4.451 10 10 IICE Cn1nc(Br)c(Br)c1CNCc1cc(Cl)cc(Cl)c1O 2364431844 FTHWXARTCPQLPJ-UHFFFAOYSA-N 443.954 4.247 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccccc3F)SC2=S)cc1 33323842 IQPIPMYNJJYNLZ-QGOAFFKASA-N 430.526 4.454 10 10 IICE C[C@H](C(=O)Nc1ccc2oc(=O)ccc2c1)N1C(=O)/C(=C\c2cccs2)SC1=S 33585391 JHZHTICGCAJFBX-HPUUJOOBSA-N 442.543 4.083 10 10 IICE CCCOc1ccc(/C=C2\SC(=S)N(CCCC(=O)OCC)C2=O)cc1OCC 40938767 WZRYTIARCAFWGN-JXAWBTAJSA-N 437.583 4.419 10 10 IICE CC(C)c1ccc(/C=C2/SC(=S)N(CCC(=O)NCc3cccnc3)C2=O)cc1 102860834 PPLSYFMIXZYFOH-XDHOZWIPSA-N 425.579 4.113 10 10 IICE CCOC(=O)c1ccc(N2N=C(C(F)(F)F)/C(=C\c3ccc(O)c(OCC)c3)C2=O)cc1 103638641 PZNWIEQNQDKLSE-LFIBNONCSA-N 448.397 4.316 10 10 IICE O=C(O)CCCN1C(=O)/C(=C\c2ccc(OCCc3ccccc3)cc2)SC1=S 206855643 PPUWMZWPBKUJHX-XDJHFCHBSA-N 427.547 4.374 10 10 IICE CCCN1C(=O)/C(=C/c2c(Oc3cccc(C)c3)nc3ccccn3c2=O)SC1=S 213145602 NXCSNLZADBLNMB-LGMDPLHJSA-N 437.546 4.406 10 10 IICE Cc1cc2c(n1-c1cc(I)ccc1Br)CCC[C@@H]2N 381777658 CPFKFBDWLRHODK-ZDUSSCGKSA-N 431.115 4.489 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526401500 WKALVWOMQHDSNV-HSZRJFAPSA-N 433.460 4.481 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CC(=O)Nc3ccccc3)no2)C1 564271689 RAAFGEYMQZZQRS-UHFFFAOYSA-N 429.524 4.020 10 10 IICE CCN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1cccc(Cl)c1 586223843 UXMCHLAMLQGYBH-UHFFFAOYSA-N 425.893 4.331 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(Cn3cccn3)c2)C1 683440869 MQPOJEWYFAYYOY-UHFFFAOYSA-N 427.552 4.291 10 10 IICE Cc1occc1C(=O)NC1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 727600665 YXLMDLDIMZBCKZ-UHFFFAOYSA-N 448.567 4.142 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(CNC(C)=O)s2)cc1 732114660 KCNFYLITEUPQAP-UHFFFAOYSA-N 437.565 4.306 10 10 IICE Cc1noc(C)c1CO[C@H]1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 762998904 XCVKCYWJDXPZTB-QHCPKHFHSA-N 436.556 4.242 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(Cc1ccc(O)cc1)CC1CC1 769058036 JISCOGUHYYAHDC-UHFFFAOYSA-N 448.611 4.046 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)cc1 772148886 RVTVNFYNZNDSTR-LJQANCHMSA-N 431.544 4.300 10 10 IICE CCN1CC[C@H](NC(=O)N[C@H](C)c2cc(OC)ccc2O)[C@@H]1c1ccc(Cl)c(F)c1 773808787 GQDYPCGOVVGHCT-XFPJRNFQSA-N 435.927 4.389 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc([C@@H]2CCCOC2)cc1 779853488 QEUNRVQUIQCJPW-HXUWFJFHSA-N 448.485 4.366 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 782015641 XKANCJKNOPBNQH-UHFFFAOYSA-N 445.216 4.327 10 10 IICE Cc1ccc(NCc2ccc(N3CCC(O)CC3)c(F)c2)c([N+](=O)[O-])c1Br 787897257 IVWSCUWAEGKUQK-UHFFFAOYSA-N 438.297 4.378 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)c(O)c1 794378568 YPZZFRWGABERLI-HBGVWJBISA-N 442.943 4.144 10 10 IICE O=C(COc1ccc(Oc2ccccn2)cc1)NCc1cc(Br)ccc1O 804734371 CBOZDYJUOVPEKV-UHFFFAOYSA-N 429.270 4.037 10 10 IICE C[C@H](NC(=O)NCc1ccc(OCc2ccccn2)cc1)c1ccc(N2CCOCC2)cc1 920870478 GMWQIDKSOGMKEZ-FQEVSTJZSA-N 446.551 4.058 10 10 IICE COc1ccc(N2CCCN(C(=O)CCc3ccc(OC)cc3Br)CC2)cc1 1125323248 YIRBUKZVAODGJH-UHFFFAOYSA-N 447.373 4.138 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCOCC1CCCC1 1129620115 YQCSXVCKERLBMW-GHRIWEEISA-N 438.640 4.053 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1 1152396198 VAYXAICBSXGNSH-YKSBVNFPSA-N 443.547 4.429 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(Br)c1Cl 1152402479 YUCDNVFAQDBWBG-UHFFFAOYSA-N 447.112 4.277 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1157103229 XRICQLZIGWFTTJ-GOSISDBHSA-N 441.471 4.038 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@@H]1C 1168229294 YQYWKXFJMXFMFM-SCLBCKFNSA-N 433.346 4.128 10 10 IICE C[C@H](Oc1cccc2ccccc12)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1275224580 OOPOXMRIXDPAQX-INIZCTEOSA-N 426.463 4.038 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCC(C)(C)C(=O)OC(C)(C)C)C1 1276745477 GLSNWAPQAOTHIA-UHFFFAOYSA-N 441.616 4.282 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(F)c1 1287797238 WQUAPXXYPBCDLL-YVLHZVERSA-N 434.489 4.203 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCO[C@H]2C(C)C)cs1 1290392772 QQTKQVFHWJYDBT-GCJKJVERSA-N 441.601 4.037 10 10 IICE CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1295352608 JPAJRJJJMMTVLV-MRXNPFEDSA-N 433.346 4.272 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(CCC(C)C)c1C 1297228171 CDTZCSDEXBIWMA-UHFFFAOYSA-N 428.577 4.240 10 10 IICE CC[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Br)cc1 1301349000 DXTLCJYAZNOPED-NRFANRHFSA-N 431.374 4.220 10 10 IICE Cc1ccc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1I 1356265360 FESDKYCQMWIEMK-UHFFFAOYSA-N 434.321 4.472 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@]12CCCN(C(=O)OC(C)(C)C)C2 1436848302 MJAFNZLOWHBZMC-HMHJJOSWSA-N 429.605 4.145 10 10 IICE Cc1cc(CNC(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1438295819 CWKCNYCXYDGDDU-RXVVDRJESA-N 429.536 4.305 10 10 IICE Cc1cc(C(=O)N2CCN(C)Cc3ccccc32)c(C)n1-c1ccc(Br)cn1 1443764920 LXYHWNBDAVBDQB-UHFFFAOYSA-N 439.357 4.344 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cnn1-c1ccc(C)cc1 1454003467 JIEQUGPXNBTDCH-UHFFFAOYSA-N 432.568 4.024 10 10 IICE Cc1cccc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)c1C 1456089164 PETOEQUABZAIPS-LJQANCHMSA-N 447.501 4.313 10 10 IICE COc1ccc2c(c1)N(C(=O)c1cccc3c1CCN(C(=O)OC(C)(C)C)C3)C[C@@H](C)O2 1456977378 PVSILBNDBKVKGY-MRXNPFEDSA-N 438.524 4.416 10 10 IICE C/C(=C/c1cccnc1)C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1462930745 NBMOORKRYYJDSJ-CFINBHSISA-N 425.504 4.354 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@H]2CCN(C(C)C)C2)sc(C)c1-c1ccccc1 1473544497 ABKMGUGFJHHPQN-LJQANCHMSA-N 443.613 4.253 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2cnc(C)s2)n1Cc1ccc(N2CCOCC2)cc1 1495138018 FTJXAHNWEWXQNL-QGZVFWFLSA-N 440.617 4.078 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(C)(=O)=O 1500033240 SYFKTWSSNNKZGY-KRWDZBQOSA-N 443.617 4.022 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1Cc1nc(C(F)(F)F)cs1 1503487207 IYESEQFFZYNPMV-UHFFFAOYSA-N 448.474 4.149 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@H](C)C1 1503904580 NFCDENIHCMJIEQ-RTBURBONSA-N 437.588 4.391 10 10 IICE CC(C)Cc1nnc(N2CCS[C@@H](C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1509234175 PDPSXIJVULNWRQ-MOPGFXCFSA-N 445.702 4.408 10 10 IICE Cc1cccc(-c2nnc(N(C)C[C@H]3CCCOC3)n2CCCSc2nccs2)n1 1511091535 YKMKCFYPOBCSLI-QGZVFWFLSA-N 444.630 4.150 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(Cl)c1Br 1516760565 DZOUPJMIBLPWAS-UHFFFAOYSA-N 441.728 4.317 10 10 IICE CCN1CCC(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)(C(F)(F)F)CC1 1523308402 VHBLLFQGMLBVIC-UHFFFAOYSA-N 425.495 4.051 10 10 IICE CCCCOc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1OCC 1527857080 IXFROYCNVTUXNF-UHFFFAOYSA-N 448.510 4.309 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(OC4CCCC4)cc3)cc2F)CC1 1530368087 RUGKNLJUNPFOSP-UHFFFAOYSA-N 425.548 4.219 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1540518488 QFKYPFRRNWOFQN-AREMUKBSSA-N 437.584 4.290 10 10 IICE Cc1ccc(C(=O)N2CCCN(Cc3cscn3)CC2)cc1-n1c(C)cc(C=O)c1C 1542795731 DJXVAVJIWJUMJT-UHFFFAOYSA-N 436.581 4.020 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](c2cccs2)C(C)(C)CO)CCCC1 1557216543 OZXYPDCZSNMXAP-HSZRJFAPSA-N 426.582 4.466 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3c(C)cc(C)c(Br)c3C)CC2)cc1F 1566347039 VLHDIVXRFHYJPF-UHFFFAOYSA-N 449.364 4.413 10 10 IICE Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1586812217 CVKSGKPULFTBDK-UHFFFAOYSA-N 430.552 4.219 10 10 IICE CNC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1595548650 YHVVWMXWJGRYKS-UHFFFAOYSA-N 435.524 4.340 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2cccc(F)c2)no1 1595571351 DLTCKBJJIWQKBK-GOSISDBHSA-N 429.879 4.234 10 10 IICE COC(=O)C[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1cccc(C)c1 1597737338 FFIAXLOPTWVPOG-QHCPKHFHSA-N 447.579 4.137 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC(CCN(C)C(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1 1612145108 JXEDGGMHOJTREK-VQHVLOKHSA-N 447.532 4.254 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 1624554469 YDKSZPLBGBWDNM-LJQANCHMSA-N 425.960 4.342 10 10 IICE Cc1cc(C(=O)NCCc2csc(N(C)C)n2)c(C)n1-c1cccc(Br)c1 1626587883 BUAKQQRFXQBZNY-UHFFFAOYSA-N 447.402 4.352 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccc1CCN(C)C(=O)OC(C)(C)C 1627026499 LRLQTVRFBQRNCN-UHFFFAOYSA-N 433.545 4.217 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c1 1628415219 ZKDHFAJZUYJSJJ-UHFFFAOYSA-N 437.565 4.439 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cccc(NS(=O)(=O)C(F)(F)F)c3)c2)CC1 1628437881 UZHJLQAOGDNRGI-UHFFFAOYSA-N 441.475 4.437 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CC[C@H](Nc3cnccn3)CC2)cc1 1629722476 CJPDDMGPWSOXCP-MEMLXQNLSA-N 433.556 4.335 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)N[C@H](C)c3ccccc3O)c2)cc1 1635794113 WVCBWWGQYSQCIB-MRXNPFEDSA-N 440.521 4.083 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)Cc2ccccc21 1636058598 JFXIYXFGYUVVHU-GOSISDBHSA-N 431.529 4.029 10 10 IICE O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN(Cc2ccccc2O)C[C@H]2CCCO2)o1 1644895117 GERXFJDFFJLFCE-MRXNPFEDSA-N 444.875 4.185 10 10 IICE Cc1cc(C(=O)NCc2nc(CN(C)C)cs2)c(C)n1-c1cccc(Br)c1 1645637939 QOXFNXYOYITMBE-UHFFFAOYSA-N 447.402 4.305 10 10 IICE CCN(Cc1ccc(OC)cc1)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652299299 JKYGOFMYPUCLNJ-QGZVFWFLSA-N 442.515 4.320 10 10 IICE COc1ccc(N(CC(=O)Nc2nc(CN3CCC(C)CC3)cs2)CC(C)C)cc1 1654767168 LFPQEHGOTOIZIS-UHFFFAOYSA-N 430.618 4.485 10 10 IICE C[C@@H](C1CCCCC1)N(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1698439601 SNOMZDNEFOKCAN-KRWDZBQOSA-N 439.583 4.337 10 10 IICE CCc1nnc(N2CCO[C@@H](c3ccccc3F)C2)n1CCCSc1nccs1 1709159978 YDWXHVHOSSPMNE-QGZVFWFLSA-N 433.578 4.196 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1728336189 QVNJUEZYWMKARN-UHFFFAOYSA-N 432.576 4.012 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@H](C)N(CC)C[C@@H]2C)cc1 1746089810 HQWBOGGNHAFOAP-SFTDATJTSA-N 447.631 4.154 10 10 IICE Cc1cccc(-c2nc(O)cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)n2)c1 1859707582 URXWDRPFHSATTE-UHFFFAOYSA-N 435.439 4.185 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)C1CN(c2nc3c(F)cccc3s2)C1 1891477328 UMBRLJBEONXGGC-LPHOPBHVSA-N 436.556 4.177 10 10 IICE C[C@H]1CN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)CCN1C(=O)OC(C)(C)C 2044631695 VUUNDWBTAZWUSZ-INIZCTEOSA-N 446.592 4.008 10 10 IICE COc1ccc([C@@H](n2nc(C3CC3)c(N)c2I)C(C)(C)C)c(O)c1 2080012766 UAPLKRGQYIBFQN-MRXNPFEDSA-N 441.313 4.297 10 10 IICE COCC[C@@]1(NCc2ccc(Br)cc2O)CCCN(C(=O)OC(C)(C)C)C1 2157552334 AXNJAFJBHBYKGI-FQEVSTJZSA-N 443.382 4.051 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CCCN2C(=O)OC(C)(C)C)c1O 2227747785 FUNWFXKSQLPNNL-CYBMUJFWSA-N 429.355 4.043 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)c1O 2236051564 VGZHYVJWLITALZ-YVWKXTFCSA-N 431.374 4.164 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1ccc([N+](=O)[O-])cc1 2294082103 AWAHDUZUFPJUAH-UHFFFAOYSA-N 443.253 4.235 10 10 IICE COCCCN1C(=O)C(=C2C(=O)N(Cc3ccc(C)cc3)c3ccccc32)SC1=S 2296684250 QECKEMOMIXWTCO-UHFFFAOYSA-N 438.574 4.150 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380776620 ZBHKSSWNEASSLA-AWEZNQCLSA-N 441.366 4.069 10 10 IICE COc1ccccc1-n1c(C)cc(/C=C2/C(=N)N3C(SC)=NSC3=NC2=O)c1C 4761556 GMFFWAORMYPEQR-QBILMKHKSA-N 425.539 4.042 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 733973108 VAATURBEAWJSHK-CYBMUJFWSA-N 430.521 4.072 10 10 IICE O=C(Nc1ccc(-c2ncon2)cc1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743141851 DTHXJLDALBHZKX-MRXNPFEDSA-N 429.427 4.129 10 10 IICE CO[C@H](C)c1noc(CN(C)C(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1 747933128 JKSBVWSHRVYGTO-CQSZACIVSA-N 447.333 4.219 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1c[nH]c2cccc(Br)c12 763929321 GBTCNJMXAXGPPL-UHFFFAOYSA-N 430.371 4.414 10 10 IICE Cc1cccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1Br 768913575 LOBGWQDXVIXDFJ-UHFFFAOYSA-N 442.401 4.220 10 10 IICE C[C@H](NC(=O)[C@]1(NC(=O)OC(C)(C)C)[C@@H]2CCCO[C@@H]2C1(C)C)c1ccc(N(C)C)cc1 783718197 PNUXGBGYTJRQFR-KHTISZTLSA-N 445.604 4.028 10 10 IICE O=C(CCCNC(=O)NCc1cc(Br)ccc1O)Nc1ccc(Cl)cc1 806477986 OUIZDCPQWDLBCC-UHFFFAOYSA-N 440.725 4.026 10 10 IICE Cc1ccccc1[C@H](C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918023559 CJOUHBSYLDRNSO-ZCNNSNEGSA-N 427.564 4.057 10 10 IICE Cc1nc(-c2cccc(NC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)c2)no1 920783408 JJJIVEBNNOJSHZ-HUUCEWRRSA-N 439.491 4.119 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)/C(=C/c3ccccc3OCc3ccccc3)C2=O)cc1 1084618056 VXJUHCHFKQKWSO-JWGURIENSA-N 442.471 4.331 10 10 IICE O=C(N[C@H]1CCCc2ccc(F)cc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1156855138 GXJZPLWDZSETIO-SFHVURJKSA-N 446.525 4.201 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)CC2)cc1F 1224631457 ZAMRSDCVZUHZAS-LJQANCHMSA-N 431.483 4.107 10 10 IICE COc1cccc([C@@H]2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)C2(C)C)c1 1256237022 PBTCYPFYPMHFME-ZEQRLZLVSA-N 438.616 4.342 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1OC 1264455353 FJFDHQDWIFUIPB-XMHGGMMESA-N 444.553 4.479 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 1299479813 ZTFNYESOVDMXAL-LVXARBLLSA-N 443.591 4.150 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1304190699 UKTOBIXWEPRXEU-UHFFFAOYSA-N 436.604 4.217 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2CCCCCO)c(C)n1-c1ccccc1 1304196868 PIIPKYCHNDIQHV-UHFFFAOYSA-N 425.602 4.068 10 10 IICE COC(=O)/C=C/c1ccc(N(C)C[C@H]2CCN(Cc3ccc(C)s3)C2)c([N+](=O)[O-])c1 1307156046 DRUZUVJMEMSZHN-AHKGRUIUSA-N 429.542 4.109 10 10 IICE COc1ncc(Br)cc1CNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1313027047 OUUDCXMEHZFRPX-UHFFFAOYSA-N 447.377 4.185 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)C(C)C 1314464515 ITKPSPPEDQBFKV-RUZDIDTESA-N 439.604 4.232 10 10 IICE CCN(Cc1ccc(OC)c(OC)c1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1352940358 OTIDPVBZFGABJE-UHFFFAOYSA-N 449.595 4.474 10 10 IICE CS(C)(=O)=Nc1ccccc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354769135 ZAKMDBBOMBNQLZ-HNNXBMFYSA-N 437.512 4.046 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(N(CC)C(C)C)cc3)cc2F)CC1 1359920526 ZCBYHWRTFRNFGH-UHFFFAOYSA-N 426.580 4.132 10 10 IICE Cc1cc(CC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(C)n1-c1ccccc1 1436623360 CKBBYXYQVBBWTF-UHFFFAOYSA-N 439.506 4.068 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1sc(-c2ccccc2F)nc1C 1446812830 AYEVXQNCEKAULG-UHFFFAOYSA-N 448.903 4.432 10 10 IICE COCc1cc(O)ccc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1451257162 WQTZNPYQYGHVOO-UHFFFAOYSA-N 430.302 4.356 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)NCc2ccc3cccnc3c2O)cc1 1451946046 BWEDGUSTEOBJPK-UHFFFAOYSA-N 437.297 4.127 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Cl)c(Br)cc2F)N(C)C)cc1 1463284146 QWMSQNMYDYNSCN-GOSISDBHSA-N 442.760 4.340 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(Cc3ccccc3Br)CC2)N(C)C)cc1 1463287001 WLGRPHJCIKBLLG-NRFANRHFSA-N 444.417 4.257 10 10 IICE COc1cc(C)c(CN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 1463710527 HYOMOTGBIKPXBY-UHFFFAOYSA-N 449.595 4.392 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C/C=C/c4ccccc4)CC3)ccc21 1465010139 IGVFIDGLEBQTOQ-JXMROGBWSA-N 431.580 4.376 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1470555109 BBAMBRCAEMBPKG-NXQMDHLFSA-N 444.620 4.223 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](NC(=O)c1cc(C)n(-c3ccccc3C)c1C)CCS2 1472274186 WQMYCPIIYHBGLV-SZTYLXMGSA-N 426.582 4.350 10 10 IICE COc1cc(OC)c(C[C@@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c(OC)c1 1478667703 QCFCTPLVPBTZCA-QGZVFWFLSA-N 441.572 4.084 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CCC[C@@H](C)C2)cc1 1501847920 ZBZKUCVDHXHEAH-NWSQWKLXSA-N 441.620 4.133 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1C[C@@H](c1ccsc1)N(C)C 1503487906 PDHCLIUFDIWJTF-FQEVSTJZSA-N 434.569 4.047 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ncccc2C(=O)OC(C)(C)C)C1 1532052165 ZCFOUIYBELPSMN-UHFFFAOYSA-N 448.567 4.397 10 10 IICE O=C(/C=C\c1ccccc1C(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1535345665 JLVGXXDEYGIDFR-WAYWQWQTSA-N 426.385 4.150 10 10 IICE CCCOc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1OCCC 1535346795 ZZUDAXIVLJKLTL-UHFFFAOYSA-N 448.510 4.309 10 10 IICE CCOc1ccccc1N1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)CC1 1540328359 SAKWALAVAQXXNV-UHFFFAOYSA-N 431.536 4.268 10 10 IICE Cc1cc(CCNC(=O)c2cncc3nc(C(F)(F)F)n(C)c23)c(C)n1-c1ccccc1 1543592911 BAXKGLODPVVSAJ-UHFFFAOYSA-N 441.457 4.367 10 10 IICE Cc1cc(C(=O)NCC(=O)Nc2ccc(Br)cc2)c(C)n1-c1ccc(F)cc1 1544607826 JLGIZYHLLHJIGM-UHFFFAOYSA-N 444.304 4.364 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCOC[C@@H]1OC 1545332785 OEHPDLROAIAVFQ-RRPUWOKSSA-N 441.620 4.080 10 10 IICE COC(=O)c1cccc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1N 1556402824 FISBNSIVPUFGKT-UHFFFAOYSA-N 442.313 4.478 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCc4nccc(Br)c4C3)ccc21 1558999088 ZBXHPPGNOXWLRC-UHFFFAOYSA-N 442.357 4.261 10 10 IICE CC[C@@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1cccc2ccccc12 1560151051 ULPBRLIRPULJQY-YIXXDRMTSA-N 433.596 4.072 10 10 IICE COCCN(C)CCCC1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CC1 1566515435 XXXJJYZKJODSBY-UHFFFAOYSA-N 439.600 4.117 10 10 IICE Cc1ncsc1/C=C\C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1584901521 OGISXFDIYTWIGN-ZPIQOJFGSA-N 431.533 4.334 10 10 IICE Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)Nc1cccc(Cl)c1 1586856560 RMDCESFXSSBXEO-UHFFFAOYSA-N 446.912 4.042 10 10 IICE Cc1ccc(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1587475779 KIGZNFPTWGOCPS-VWLOTQADSA-N 445.563 4.018 10 10 IICE CCOC(=O)c1[nH]nc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1C 1597817000 SMUQEFFIWJSKIB-UHFFFAOYSA-N 445.317 4.317 10 10 IICE Cc1cc(-c2nnc(N3CCCC[C@@H](C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935294 MOGPRGSFPNHFLC-GOSISDBHSA-N 434.588 4.067 10 10 IICE CC[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1614143765 LBECCMCHTKDBPZ-FQEVSTJZSA-N 439.648 4.459 10 10 IICE Cc1cc(C(=O)N[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c(C)n1-c1ccc(Br)cn1 1620754531 WMAXIBSACNLEDX-IPELMVKDSA-N 432.362 4.185 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@]1(c2ccc(OCC)cc2)CC1(Cl)Cl 1623574594 SLPVHUFCPRQXGE-FQEVSTJZSA-N 429.340 4.408 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H](c3ccncc3)C3CCCC3)cc2F)C[C@@H](C)O1 1625089689 DSOLHYZRKFDWJA-NXMSCROESA-N 425.548 4.425 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc2cccnc2c1O)C1CCCCCC1 1627072538 AHGMGKRBQMEHGK-HXUWFJFHSA-N 427.545 4.420 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4cc(Br)sc4[nH]3)C2)cc1 1630618981 PSBCGLUBLVVMQO-GFCCVEGCSA-N 434.359 4.257 10 10 IICE Cc1cc(CCNC(=O)c2cc(NC(=O)OC(C)(C)C)n(C)n2)c(C)n1-c1ccccc1 1631356722 PGOHOZXNBZFNED-UHFFFAOYSA-N 437.544 4.147 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)N[C@@H](C)c2ccccc2O)cc1 1632250541 WCLLDDDCEACYQQ-HNNXBMFYSA-N 428.485 4.132 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(CCCCCC3)[C@H]2c2ccccc2)c1 1632255521 RFKMIKLAIKXMAK-OAQYLSRUSA-N 428.554 4.301 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c1 1635304155 NEJLPDKVKQVNND-KRWDZBQOSA-N 428.492 4.371 10 10 IICE Cc1ccc(C(=O)NCCCNC(=O)/C=C\c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1639277682 OLTTWONXBOWONN-QBFSEMIESA-N 443.547 4.165 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@@H](C)C(=O)Nc1ccc(-c2cnc[nH]2)cc1 1644710536 NVXKWPGXQVVQGM-AWEZNQCLSA-N 443.345 4.394 10 10 IICE CCOc1ccccc1[C@H](CC(=O)NCc1c(O)cccc1F)NC(=O)OC(C)(C)C 1646038606 FZPBQBSMUYULDM-SFHVURJKSA-N 432.492 4.202 10 10 IICE Cc1cc(CC(=O)N2CCN[C@H](Cc3ccc(F)cc3)C2)c(C)n1-c1ccc(Cl)cc1 1647962337 VDBRKOXFRPKRQJ-HSZRJFAPSA-N 439.962 4.472 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc(N3CCc4ccccc43)cc2)cc1 1653258002 GEKONUPVSWNQSW-UHFFFAOYSA-N 445.519 4.008 10 10 IICE O=C(CN(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2)NCc1ccc(F)cc1 1653578858 ZOGIFLYANBTHHI-QPJJXVBHSA-N 432.495 4.433 10 10 IICE COc1ccc(-n2cc(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)nn2)cc1 1655246868 BFKQUPLVNCBLTR-UHFFFAOYSA-N 429.436 4.027 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H]3COc3ccc(Cl)cc3)C2)cc1 1682188008 DBZZAKLJKAFAHD-NQIIRXRSSA-N 443.975 4.428 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCSc3c(C)[nH]c4ccccc34)CC2)cc1 1684872011 WGUOLEGWNROHNK-UHFFFAOYSA-N 438.597 4.499 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3c(Cl)cc(Cl)cc3C2)N(C)C)cc1 1685608553 CZIMNLTWBXZRIJ-NRFANRHFSA-N 435.399 4.430 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCCn2c3ccccc3c3ccccc32)N(C)C)cc1 1685847946 QASUCKZLPISYHO-SANMLTNESA-N 443.595 4.463 10 10 IICE Cc1nnc(N2CCO[C@H](c3ccc(Cl)s3)C2)n1Cc1ccc(N(C)C)c(F)c1 1693517201 VYRYPDGNDHMAHM-KRWDZBQOSA-N 435.956 4.133 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC[C@H]3CCO[C@H](C)C3)CC2)cc1F 1748849373 NKUHSMLDRZMTLX-MOPGFXCFSA-N 445.583 4.081 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C(C)C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1761676364 HDHHHIVIPKDKEI-NRFANRHFSA-N 448.615 4.313 10 10 IICE CCc1nnc(N2C[C@H](c3ccsc3)O[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1762931385 UIQZOWATSKVXJJ-DYESRHJHSA-N 425.602 4.291 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCOC1 1771022288 JQRUQQQRULZZOY-OAQYLSRUSA-N 437.588 4.252 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccc(OC)c(O)c2)cc1 1865664217 GCKKEMMVFLWIGB-KGENOOAVSA-N 430.460 4.253 10 10 IICE CN(C)c1ccc(-c2nc3cc(C(=O)N4CCC(N5CCCCC5)CC4)ccc3[nH]2)cc1 1873506175 YZTVAWMDGUKOJQ-UHFFFAOYSA-N 431.584 4.386 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC(CN=[N+]=[N-])CC1 2010405412 HVJWTQQXPIIADW-IBGZPJMESA-N 431.537 4.036 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@]1(C)CNCc1ccc(Br)cc1O 2102784894 FTWMGHBDNXZNRP-KRWDZBQOSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@H](NCc3cc(Br)cc(F)c3O)C[C@@H]21 2137342847 FHHSXHYOHXYJCL-LOHUMSBYSA-N 429.330 4.075 10 10 IICE CC(C)(C)NC(=O)CCCN1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2296754850 ISGZKPFNNRJZIY-UHFFFAOYSA-N 441.416 4.345 10 10 IICE CCCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314768574 LBRHVOBVLHHRMA-GOSISDBHSA-N 442.518 4.491 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C)c(O)c1Br 2380755266 ZRPJSRJSIMYXDP-DZGCQCFKSA-N 441.366 4.115 10 10 IICE CCc1ccccc1N1C(=O)N=C(O)/C(=C\c2cc(Br)c(O)c(OC)c2)C1=O 1178312 XCNARNFPVGWJCH-MDWZMJQESA-N 445.269 4.232 10 10 IICE CCOC(=O)c1sc(NC(=O)C(=O)c2cc(C)n(-c3ccc(C)cc3C)c2C)nc1C 15673789 OYIUNWTXWNRBDO-UHFFFAOYSA-N 439.537 4.474 10 10 IICE CCCCN1C(=O)/C(=C/c2cc3cc(C)ccc3nc2N2CCOCC2)SC1=S 38732296 DYSJCPVHZXROTD-RGEXLXHISA-N 427.595 4.381 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cccc5ccccc45)c3N)CC2)cc1 40727711 MFSVBHRILXRFEY-UHFFFAOYSA-N 426.524 4.291 10 10 IICE N=C1/C(=C\c2ccc(-c3cccc(C(=O)O)c3)o2)C(=O)N=C2SC(c3cccs3)=NN12 102467654 IEKJBZGHYSCTTQ-NONNEFQTSA-N 448.485 4.374 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(\C)Nc2cccnc2)cc1 205960042 YNPVIYRJBFWYJV-RCCKNPSSSA-N 429.436 4.135 10 10 IICE CCCCCCOc1ccc(/C=C2/SC(=S)N(CCC(=O)OC)C2=O)cc1OC 206239492 UWJCGYYOBSHXIC-NBVRZTHBSA-N 437.583 4.419 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C/C=C\c2ccc([N+](=O)[O-])cc2)SC1=S 229624096 LAVLUVFDSPKJCP-IAFGHPSKSA-N 440.502 4.048 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](C(=O)Nc4cccc(C)n4)C3)ccc21 484696807 SHIKTXMMJWWZNH-NRFANRHFSA-N 448.567 4.099 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cccs3)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526328695 OSAALSNOMLOACR-FQEVSTJZSA-N 425.462 4.234 10 10 IICE CN(c1ccc(CNC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)cc1)C1CCCCC1 742416540 BEDROSYKRPYNBQ-SFQUDFHCSA-N 441.597 4.157 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2cc(C)c(C)cc2C)cs1 748692962 GTXVQAMNCJIXQQ-UHFFFAOYSA-N 433.511 4.453 10 10 IICE CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)c1csc(Cc2ccc(N)cc2)n1 751935724 CIVKOWXTUMGOSM-QGZVFWFLSA-N 437.565 4.299 10 10 IICE O=C(CN1CCOC[C@@H]1C[C@@H](O)c1ccco1)Nc1ccc(N=Nc2ccccc2)cc1 763664041 KLIOMGRDKCDDPO-FCHUYYIVSA-N 434.496 4.458 10 10 IICE COc1cc([C@H](C)NCCc2cc(C)n(-c3ccccc3)c2C)ccc1S(C)(=O)=O 764717511 QNENIIDDQVCKHL-SFHVURJKSA-N 426.582 4.400 10 10 IICE Cc1ccc2[nH]cc(CCC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)c2c1 768531808 CSSNTCUEPPBLEJ-UHFFFAOYSA-N 430.596 4.257 10 10 IICE CN(Cc1ccccc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769035264 GVKBTVJCWPCNOI-UHFFFAOYSA-N 426.992 4.214 10 10 IICE O=C(NC1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1)C1CCCCC1 769175105 GGPZQGSJIJKECB-UHFFFAOYSA-N 428.577 4.246 10 10 IICE CCN1CC[C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 782498816 FQPLHHJDKNCXGD-GMAHTHKFSA-N 446.517 4.339 10 10 IICE Cn1ncc(Br)c1/C=C1\SC(=S)N(CCCCC(F)(F)F)C1=O 794862707 QWFDOXBETJEJJK-POHAHGRESA-N 428.299 4.116 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CC(F)(c2cccc(Cl)c2)C1 796524560 ORYJLQAQFDOZGD-UHFFFAOYSA-N 435.902 4.142 10 10 IICE C[C@@H]1CCCN(Cc2csc(NC(=O)NCc3cc(Br)ccc3O)n2)C1 796639101 JNTFHXGQCMHCCX-GFCCVEGCSA-N 439.379 4.165 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCCN(C(=O)NCCCSc3nccs3)C2)C1 806959527 WGUWLDRWSDJFER-FQEVSTJZSA-N 440.635 4.058 10 10 IICE COc1ccc([C@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1F 823310174 JEGKUXFXLSQHCF-LBPRGKRZSA-N 448.406 4.009 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(NC(=O)c4ccc(F)cc4)c3)CC2)cc1 915059926 HPAXBFNBKJLXBZ-UHFFFAOYSA-N 433.483 4.049 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CN(Cc3ccccc3)c3ccccc3)C2)cc1 1129991737 WYLLDKNMIUVYHK-QHCPKHFHSA-N 429.564 4.345 10 10 IICE CC(C)Cn1cc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cn1 1134542272 OMOLBMWDUZZNGK-UHFFFAOYSA-N 439.317 4.264 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc(C(=O)OC(C)(C)C)c1 1147838180 QTLFNGCWVKSWEA-UHFFFAOYSA-N 438.568 4.089 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCCN1Cc1ccccc1 1148444219 PSFRLMLGBFLLDD-NZQKXSOJSA-N 443.538 4.428 10 10 IICE Cc1cc(C)n2nc(C)c(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)c2n1 1155726407 GTGRGIWWFGYEFP-CQSZACIVSA-N 425.964 4.474 10 10 IICE Cc1cc(C(=O)N2CCN(C3CC3)C[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1159993391 ZYHNINADWMFRPK-HNNXBMFYSA-N 430.390 4.413 10 10 IICE Cc1ccc(N(Cc2cnn(C)c2)C(=O)/C=C/[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1177596127 LBRBESTXWBBZII-XEDBTPMOSA-N 438.572 4.465 10 10 IICE COC1(c2nccn2C)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 1197457334 CRFITBZXQMLSOQ-UHFFFAOYSA-N 432.528 4.412 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@]3(C)CN(C(=O)OC(C)(C)C)CCO3)c2C)c1 1287660171 BVSGYZLRDRATLZ-RUZDIDTESA-N 441.572 4.045 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCCCNC(=O)OC(C)(C)C 1291445321 KRKHDMDLSLRQIM-KRWDZBQOSA-N 431.581 4.439 10 10 IICE CSC(C)(C)Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1302522234 JUFSKVQICANDCQ-UHFFFAOYSA-N 429.634 4.160 10 10 IICE O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1NCc1ccc(N2CCC(O)CC2)cc1 1307176147 WZCJDUDBTWPKGD-UHFFFAOYSA-N 446.376 4.217 10 10 IICE Cc1cc(CNC(=O)NCCCNC(=O)/C=C/c2ccccc2)c(C)n1-c1ccccc1 1312584931 VPVVCAOVQUXBDG-CCEZHUSRSA-N 430.552 4.113 10 10 IICE O=C(CCOCC(F)(F)C(F)(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1354573930 DBWVOHPBTNPVMI-UHFFFAOYSA-N 427.325 4.005 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(F)c3ncccc3c2)c1 1360125071 XQQJWYQMUCHCHJ-UHFFFAOYSA-N 428.467 4.118 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(c4ccc(F)cc4)CCCCC3)cc2)CC1 1439327448 KNWYYDSJZGUAKP-UHFFFAOYSA-N 437.559 4.046 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)C1=Cc2ccccc2O[C@H]1C(F)(F)F 1441630650 KYAACIGWMLGOJJ-HXUWFJFHSA-N 434.483 4.263 10 10 IICE CC(C)c1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)nc1 1444515870 WDRQTHCHMONCFW-OAQYLSRUSA-N 426.561 4.267 10 10 IICE CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1459990500 RFPZPOXXMFDPBT-URZJWIJPSA-N 448.563 4.362 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2n[nH]c3c(OC)cccc23)cc1 1465013971 WOIIJNLJKCLQBC-UHFFFAOYSA-N 430.508 4.493 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc(Br)cc(Br)c1N 1465034580 XCMAOODARSQBHB-UHFFFAOYSA-N 441.167 4.098 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(N=S(C)(C)=O)c1 1465848828 CWUUDECTJDEGPF-UHFFFAOYSA-N 425.348 4.176 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC3(CC(=O)OC(C)(C)C)CCOCC3)c2C)cc1 1468765490 VQYRTELEIDULGS-UHFFFAOYSA-N 442.556 4.114 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4oc(=O)n(C)c4c3)cc2Cl)C1 1469960550 QBSUMSWFPAIMBX-HNNXBMFYSA-N 442.947 4.021 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1 1478840533 DHPLCUYXHGDLSC-CVDCTZTESA-N 425.573 4.374 10 10 IICE CC(C)CC[C@](C)(O)Cn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1509259246 LNHHDQNEYAFNFF-VWLOTQADSA-N 443.636 4.062 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cn(C)nc3-c3ccc(Cl)s3)C2)cc1 1526246156 CYPBEMNEORDZKQ-AWEZNQCLSA-N 430.961 4.067 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(CN2CCCCC2)o1 1533330490 XXCWYUKVJUGLQZ-QGZVFWFLSA-N 433.499 4.266 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)[C@H](C)C(F)(F)F 1538872024 IXQKIBFSYVYYSV-ZTMOJVSCSA-N 434.480 4.216 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CCC(C)(C)C2CC2)CCOC1 1541718421 PVTKBVCXSBLERU-RUZDIDTESA-N 442.604 4.487 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CC2([S@](C)=O)CC2)c(C)n1-c1ccccc1 1542181140 LLBGKSKBCLJOFV-HKBQPEDESA-N 439.629 4.356 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(-c4cccc(Cl)c4)n3)CC2)c(OC)c1 1543632672 OTMPMCMWPXHUSZ-UHFFFAOYSA-N 443.956 4.443 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H](SC)C(C)(C)C 1546529517 KGTSTCFIEKSNDX-LJQANCHMSA-N 435.613 4.093 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)[C@@H]2CCC[C@H](C)C2)cc1 1547444292 LJOOXBAAEBFPGX-SIKLNZKXSA-N 440.636 4.326 10 10 IICE C[C@@]1(C(=O)NCc2cccc(Br)c2O)CC(c2cccc(Cl)c2F)=NO1 1556481196 NVNJFSNRYWVWPL-SFHVURJKSA-N 441.684 4.147 10 10 IICE COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1565453004 PZXFSKCZAAMDON-FCHUYYIVSA-N 432.996 4.038 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCCCSc2nccs2)[C@H]1c1ccc(Cl)c(Cl)c1 1565620348 PEXVCLXQMYFFPR-MLGOLLRUSA-N 444.409 4.268 10 10 IICE Cc1nn(C)c(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1Cl 1586068439 KBBDKEMUSQXPES-XFXZXTDPSA-N 441.003 4.064 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CCN(C(=O)Nc2ccccc2)CC1 1587742535 IBTLBKBUXUDPLX-UHFFFAOYSA-N 444.535 4.333 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)C(F)(F)c1cccc(Br)c1 1596359738 WQRSKSKOFGFZTC-UHFFFAOYSA-N 441.341 4.411 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@H]2[C@@H]2CCCCC2=O)c(C)n1-c1ccc(Cl)cc1 1597142202 QSYDJILKTAUECO-VXKWHMMOSA-N 428.960 4.277 10 10 IICE Cc1cc(C(=O)NCc2ccnc(OCCN(C)C)c2)c(C)n1-c1cccc(Cl)c1 1598189717 OKKLGHYSJZDYPS-UHFFFAOYSA-N 426.948 4.013 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1C[C@H](c1cccs1)N(C)C 1617940842 RVVWGEXLXGVLJJ-LJQANCHMSA-N 434.569 4.047 10 10 IICE CC(=O)N1CC[C@H](C)c2ccc(S(=O)(=O)N(Cc3ccccc3O)C3CCCC3)cc21 1621833432 PAHNQYVYQFHEBV-KRWDZBQOSA-N 442.581 4.386 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2 1623573605 CMECDWDUVHQBTM-UHFFFAOYSA-N 434.895 4.275 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)cc1 1626107502 YAGCJHMDWYQOIF-LEWJYISDSA-N 437.367 4.301 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H]2CCCN(c3ccccc3)C2)cc1 1626729344 VWDKEOFTQSPQOA-HSZRJFAPSA-N 429.564 4.482 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H](F)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1627467751 QAASNZUVWPTVGM-CTNGQTDRSA-N 433.568 4.134 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCOCCN(C)C(=O)OC(C)(C)C)c2C)c1 1629703841 NGZYNUDSAUVMFQ-UHFFFAOYSA-N 443.588 4.324 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cc(Br)c(Br)[nH]1 1629758713 SFNFJHITSALGLH-UHFFFAOYSA-N 427.140 4.070 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H](N3CCOCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1635245218 XHTGOKJQDUSRCN-JOCHJYFZSA-N 429.992 4.003 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc(-c2ccc(F)c(F)c2)nc1C 1639587910 LEURLKHKQKAMTL-UHFFFAOYSA-N 446.475 4.308 10 10 IICE CC(C)(C)OC(=O)[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)Cc2ccccc21 1641294149 PMIVJRZMANTKMC-INIZCTEOSA-N 425.506 4.394 10 10 IICE CCN(CC(=O)NCc1cccc(COC(C)C)c1)Cc1cc(Br)ccc1O 1641892599 JLZFFFAKTGNDKV-UHFFFAOYSA-N 449.389 4.218 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](COC)c2ccco2)sc(C)c1-c1ccccc1 1642665726 YLNBOYKVUJQHIW-KRWDZBQOSA-N 442.537 4.409 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](C)c3nc(C(F)(F)F)cs3)C2)cc1 1680588819 LXHYTQNMIHSKTR-OLZOCXBDSA-N 428.480 4.057 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)CCc3ccccc3)cc2Cl)C1 1682023249 CLAHTRABAVQMOS-RXVVDRJESA-N 429.992 4.369 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CCC[C@H]3OC)CC2)cc1 1711865237 OBEJACVOAADVJA-NZQKXSOJSA-N 441.620 4.017 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1 1730549689 ZKTSVNFJKRBODV-FQEVSTJZSA-N 434.588 4.016 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCOC[C@@H]1C 1741433380 HZSXQIVABVUVNY-RBBKRZOGSA-N 425.621 4.386 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1751409427 CCKSZNKXLAVOSY-UHFFFAOYSA-N 429.515 4.481 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)C1 1768000487 VDCUGOYNFMWTPL-INIZCTEOSA-N 432.619 4.165 10 10 IICE COCCCN1C(=O)C(Nc2cccc(F)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420960 ZQQPIBBJRLZCIC-UHFFFAOYSA-N 447.510 4.462 10 10 IICE C[C@@H]1N(Cc2ccccc2)CC[C@@]1(CN)N(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 2074363235 CEGCWJOHXOMUQW-FNZWTVRRSA-N 438.616 4.139 10 10 IICE CCOc1ccc(-n2cccc2C=C2C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)cc1 2297346662 HFWGCUJYZILZAT-UHFFFAOYSA-N 429.476 4.105 10 10 IICE CCOc1cc(N2CCOCC2)c(OCC)cc1N=NN1CCN(c2ccccc2)CC1 2318775720 HZGUJZXYBLDQOJ-UHFFFAOYSA-N 439.560 4.142 10 10 IICE Cc1ccc(CNc2ccc(I)cc2N)c(O)c1Br 2352943912 ADRYRZUCMUTTKV-UHFFFAOYSA-N 433.087 4.262 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccc(C(=O)O)cc1 15044446 RUFCPHKILFLFAS-LGMDPLHJSA-N 444.534 4.378 10 10 IICE O=C(O)CCOc1ccc(/C=C2/SC(Nc3ccccc3Br)=NC2=O)cc1 16908061 NNVNINKPPROGNX-LFIBNONCSA-N 447.310 4.385 10 10 IICE CCCCCCN1C(=O)/C(=C2\SC(=S)N(CCCC(=O)O)C2=O)c2ccccc21 40938379 DRKMAZRFCGKLRJ-ZCXUNETKSA-N 432.567 4.050 10 10 IICE O=C(Cn1ncc(=O)c2ccccc21)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 57770800 NISIPDLKTHNYCL-HHHXNRCGSA-N 435.483 4.161 10 10 IICE COc1ccccc1-c1csc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)n1 727251262 QFLYPRAVEYDSBN-UHFFFAOYSA-N 438.914 4.044 10 10 IICE CC[C@@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1nc2ccccc2[nH]1 727476649 ZVAZOTNHGBOBPU-JTDSTZFVSA-N 439.535 4.266 10 10 IICE CCN1CCN(c2ccccc2NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731042379 STBWOUOBBKZFFW-UHFFFAOYSA-N 435.616 4.387 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(O)nc2ccc(Br)cc12 743716726 LHJCDOAWXQQYOX-UHFFFAOYSA-N 427.298 4.217 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1 749705992 LOAZBJQFADQUOK-PZJWPPBQSA-N 430.593 4.074 10 10 IICE C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754660451 GPRHVNXDRUPSCD-WMZOPIPTSA-N 433.499 4.235 10 10 IICE O=S(=O)(Cc1ccc(Cl)cc1Cl)NCc1cccc(Br)c1O 766181979 VLTGUCNESDPLIT-UHFFFAOYSA-N 425.131 4.081 10 10 IICE COC(=O)N(C)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 766481823 BZNXRHZBIRJUAG-UHFFFAOYSA-N 434.540 4.249 10 10 IICE Cc1ncc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(Cl)c1Cl 768914921 KGLIINVIUDYLRZ-UHFFFAOYSA-N 433.383 4.159 10 10 IICE Cc1cc(Br)c(O)c(CNCc2cccc(C(=O)NCc3ccco3)c2)c1 781626835 MLVICFUKYFPQDJ-UHFFFAOYSA-N 429.314 4.276 10 10 IICE C[C@H]1[C@@H](c2ccccc2)C[C@H]1NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 783657589 ZYSFGWYDPWDYLG-NGYIFUPDSA-N 431.559 4.224 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802680072 SMIOTHGESRNSQP-FGZHOGPDSA-N 435.572 4.147 10 10 IICE CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NCc1cc(Br)ccc1O 804735953 MBQLHEIYOJEBQN-UHFFFAOYSA-N 425.304 4.493 10 10 IICE CCN1CCN(c2ccc(CN[C@@H](CCc3ccccc3)c3ccccc3O)cn2)CC1 815560487 IZIYJORUSAEHLG-VWLOTQADSA-N 430.596 4.393 10 10 IICE CCCOC(=O)c1cccc(Cn2nc(Cc3ccc(N)cc3)c3ccccc3c2=O)c1 821187626 ZEORSBCRCQMYJO-UHFFFAOYSA-N 427.504 4.185 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc(C(F)(F)F)cn2)c(C)n1-c1ccc2c(c1)OCO2 844425845 VQNJLJBVYJDFKB-UHFFFAOYSA-N 446.381 4.276 10 10 IICE CC(=O)Nc1cccc(NC(=S)NNc2nnc(-c3ccccc3)n2-c2ccccc2)c1 915121943 UUHSRGWYPGJWKS-UHFFFAOYSA-N 443.536 4.206 10 10 IICE Cc1sc(NC(=O)[C@@H]2CCc3nncn3CC2)c(C(=O)OC(C)C)c1-c1ccccc1 1124793785 JQFBYHBTJRZXSZ-QGZVFWFLSA-N 438.553 4.471 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(OCCCN(C)C)c2)C1 1126240732 ABQJMBCWYDEGKG-UHFFFAOYSA-N 448.611 4.377 10 10 IICE CCc1cccc(C(=O)OC)c1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1126454101 JARRWWDOXQKRFW-UHFFFAOYSA-N 433.552 4.396 10 10 IICE COc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OCC2CC2)c1 1126657967 NKXCNOQGIARSJE-QGZVFWFLSA-N 446.494 4.484 10 10 IICE COc1ccc(C2(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)CCC2)cc1 1137438961 ZIALJZHORVMCEE-FQEVSTJZSA-N 428.960 4.257 10 10 IICE COc1cc(N2CCC3(CC2)CN(C(=O)OC(C)(C)C)[C@H]3C(C)C)c([N+](=O)[O-])cc1OC 1164357846 DZSWQHGNQRDXAA-FQEVSTJZSA-N 449.548 4.474 10 10 IICE CC(=O)NCC(C)(C)C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1182481787 MCVUOHXXYYHCKJ-LJQANCHMSA-N 435.490 4.460 10 10 IICE CNC(=O)[C@]1(C(F)(F)F)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1195739690 ZRXVRWGKNKPMCJ-FQEVSTJZSA-N 433.434 4.041 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@]3(C)Cc3ccc(F)c(F)c3)C2)cc1 1230858187 IWMSIZOJSQUBIJ-HOYKHHGWSA-N 429.511 4.359 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCOc3ccc(Cl)c(Cl)c3)C2)cc1 1251498943 OQBZSHLPESWIRX-HNNXBMFYSA-N 438.355 4.207 10 10 IICE COc1ccc(N2CCN(C(=O)NCCSc3c(C)[nH]c4ccccc34)CC2)cc1F 1251711527 DMQABCVDKASLBG-UHFFFAOYSA-N 442.560 4.248 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H](c1cccnc1)C1CC1 1266792307 JXPZCIITWPINHY-JKALPCAWSA-N 441.553 4.080 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCO[C@@](C)(C(C)(C)C)C1 1289422570 AHIJFDPJLRYJIL-AREMUKBSSA-N 448.615 4.404 10 10 IICE Cc1ccc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1S(N)(=O)=O 1290220372 WQVVIEJXYPAJCW-UHFFFAOYSA-N 425.554 4.426 10 10 IICE COC(=O)[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)Cc1cccc(C)c1 1293146632 WLZFOJWGIJLIAY-HSZRJFAPSA-N 446.547 4.285 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCCC2)nc1 1298363561 GTJGUMIJDUYHPI-UHFFFAOYSA-N 434.588 4.252 10 10 IICE CCCCN(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCC[C@@H](C)C1 1298617599 NGBOJIJEPAHIJZ-VPIVDRORSA-N 441.616 4.107 10 10 IICE CC1CCN(CCCn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CC1 1305103710 MQIMQYFUVQZHSP-UHFFFAOYSA-N 425.621 4.475 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)CCO1 1306442260 ZTVQUUVNSWBXOJ-IBGZPJMESA-N 443.642 4.431 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCSC[C@H]3c3ccc(C)cc3)C2)cc1 1312903058 TZLLCCFJCCSGAA-XXBNENTESA-N 425.598 4.330 10 10 IICE O=C(/C=C/c1ccc(F)c2ccccc12)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436624892 SIRUKOUPEJRPGY-SOFGYWHQSA-N 426.438 4.423 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(F)(F)c1ccc(Br)cc1 1440674945 UAAIHHWLTVMWCP-UHFFFAOYSA-N 439.300 4.036 10 10 IICE O=C(CSCc1nc(O)c2c3c(sc2n1)CCCC3)NCc1cc(Cl)ccc1O 1452946211 NEGWNWPPEIUVKQ-UHFFFAOYSA-N 449.985 4.184 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(CNC(=O)OC(C)(C)C)c1 1469103438 HKHFUQLOHVJLHJ-GOSISDBHSA-N 425.573 4.447 10 10 IICE Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)o1 1470449059 GTJLMQSNDAVDPE-YWZLYKJASA-N 433.499 4.386 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCCO4)n3CCCC(C)C)CC2)cc1F 1504296096 MQLJCSQCVMXQJL-JOCHJYFZSA-N 445.583 4.430 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@H]2CC[C@@H](C)C2)c(C)n1-c1ccccc1 1510604264 UCOWPQXDWLUBJB-OPYAIIAOSA-N 448.615 4.489 10 10 IICE CCOCc1nnc(N2CCC[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1516549436 NLONKZLNZIXMAC-CYBMUJFWSA-N 435.541 4.232 10 10 IICE C[C@@]1(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC1(Cl)Cl 1525997218 HSRGGIYSNYLQPU-OLXGIWCBSA-N 447.384 4.117 10 10 IICE CC[C@H]1CO[C@H](CC)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1531531944 GZGXILYCWWIEDI-FLKQJBRMSA-N 438.640 4.146 10 10 IICE Cc1cc2sc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c(C)c2cc1C 1534540851 RPTYOSFKAQOFDZ-LJQANCHMSA-N 435.593 4.458 10 10 IICE Cc1cc(CCNC(=O)c2nn(CC(C)C)c(=O)c3ccccc23)c(C)n1-c1ccccc1 1534543166 QMZVTXMUPHIIHD-UHFFFAOYSA-N 442.563 4.433 10 10 IICE COC(=O)CCN(C[C@H]1CCCO1)C(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1543790512 YAGPXFLOOLATJL-JOCHJYFZSA-N 426.557 4.402 10 10 IICE CCCCN(CC(=O)Nc1nc(CN2CCC(C)CC2)cs1)Cc1ccccc1O 1559790563 WZJUZSLOEJKGAG-UHFFFAOYSA-N 430.618 4.321 10 10 IICE Cc1cccc2c1CCC[C@H]2NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1585582266 UXLDMYJZOADSIP-LJQANCHMSA-N 442.562 4.370 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Br)c(C)cc1C 1597566817 BNEZGWBUZYWBPL-UHFFFAOYSA-N 440.721 4.240 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1 1616428573 IWQLZNYVYCXCOY-OAQYLSRUSA-N 437.490 4.122 10 10 IICE COc1cc(N2CCN(Cc3ccc4ccc(Cl)cc4n3)CC2)cc(OC)c1OC 1617063781 LNHYZYZMNVMIHY-UHFFFAOYSA-N 427.932 4.236 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2c(Cl)cncc2s1 1623928060 CQUTZBLPCSZKJZ-UHFFFAOYSA-N 425.293 4.124 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCCc1ccsc1 1627962193 ZIAPCHSCUATQAA-ATVHPVEESA-N 434.583 4.228 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@]1(C)CCN(C(=O)OCc2ccccc2)C1 1630181033 RNCWKIUPYBCFHS-FQRUVTKNSA-N 437.584 4.157 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(O)c1 1631434298 ODUAVFITTCBUGE-OAQYLSRUSA-N 426.900 4.487 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)Cc2ccccc2)c(C)n1-c1ccccc1Br 1632438654 XCJYHQJJXJHABL-GOSISDBHSA-N 427.342 4.190 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)C[C@H](O)COCc3ccccc3)c2C)c1 1637578301 ULTSBCGLFPGVIV-VWLOTQADSA-N 435.568 4.122 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(c3ccccc3)[C@H](C)c3ccccc3)CC2)cc1 1645224774 ZLOJOPTUTULPLG-YIXXDRMTSA-N 445.607 4.446 10 10 IICE COc1cc(N2C[C@H]3CCCC[C@@]3(CNC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC 1652337274 VKXKRHILJXVSGJ-IVZQSRNASA-N 435.521 4.133 10 10 IICE C[C@@H](S[C@H](C)C(=O)OC(C)(C)C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652801236 SDQURUJZVUXNOW-ZIAGYGMSSA-N 439.533 4.252 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2Cc1nnnn1-c1ccc(OC(F)F)cc1 1653957385 XVFYLTAXBXQJMA-INIZCTEOSA-N 429.471 4.107 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3ccc(OCC4CCCCC4)cc3)CC2)cc1 1662910491 HOORUYPUWLHSII-UHFFFAOYSA-N 444.597 4.165 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1cc(NC(=O)OC(C)(C)C)ccn1 1676155791 KZHOPHGZFOWKJK-UHFFFAOYSA-N 439.560 4.370 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC2(CC1)CCN2C(=O)OC(C)(C)C 1683254542 PZEKGMLMLWFQAW-IBGZPJMESA-N 444.620 4.177 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)N(C)C)cc1 1685610222 WDBPWVCTJLLJFY-HSZRJFAPSA-N 439.991 4.258 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3ccc(Br)cc3OC)C2)cc1 1686130673 ZFGDNSDLNMCEEW-ZBFHGGJFSA-N 448.361 4.105 10 10 IICE C=CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(N)=O)C1 1705786285 KNALYQCGHMTORB-HXUWFJFHSA-N 446.599 4.267 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(F)(F)C1 1730483409 XYGJOSIPOABSNQ-KRWDZBQOSA-N 433.478 4.183 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CCC(F)(F)CC1 1730815575 BEBBRLVZRSSEJE-INIZCTEOSA-N 438.519 4.170 10 10 IICE CCc1nnc(N(CCOC)[C@H]2CC[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1762915400 BBAADGQUFSQKBN-UGKGYDQZSA-N 443.661 4.083 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H](C)CC 1764560730 BHYHZDBPCZVUBA-SFHVURJKSA-N 436.604 4.361 10 10 IICE CC(=C\c1ccccc1)/C=C1/SC(=S)N([C@@H]2CC(=O)N(c3cccc(C)c3)C2=O)C1=O 1772759328 VQIDPVVZENGYDS-PVFBOYCLSA-N 448.569 4.475 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccc3c(c2)OCCO3)cc1 1865671912 UVLWBOMVTQHYMQ-PXLXIMEGSA-N 442.471 4.310 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccccc3)C(=O)N(C[C@@H]3CCCO3)C2=O)cc1 1873419979 SRRRYWIETBATMQ-QHCPKHFHSA-N 441.531 4.465 10 10 IICE C[C@@]1(NCc2c(O)cccc2Br)CCCN(C(=O)OCc2ccccc2)C1 1940869087 YRSADENLQAUKIV-OAQYLSRUSA-N 433.346 4.436 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1CCNCc1c(O)cccc1Br 2226204660 YQXQNWBPGBEMKL-GFCCVEGCSA-N 435.309 4.279 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1 2297352769 UZKANGKYCYACJP-UHFFFAOYSA-N 446.580 4.383 10 10 IICE CCOc1ccc(C=C2SC(=S)N([C@@H](C(=O)OC)c3ccccc3)C2=O)cc1OC 2314769916 WWMSIDWKYRMONC-LJQANCHMSA-N 443.546 4.209 10 10 IICE Cc1ccc(CNC(=O)[C@H](C(C)C)[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2380721827 MRSJUOAHODHUPR-UKRRQHHQSA-N 443.382 4.265 10 10 IICE Cc1ccc(CNC(=O)C2(C)CCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2380747538 VGNNOTOFRFFGRK-UHFFFAOYSA-N 441.366 4.117 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14472862 WRJUHDOLWODIRD-QEEYODRMSA-N 433.917 4.325 10 10 IICE COc1ccc(N2CCN(c3cc(C(=O)N[C@H](C)C(C)C)c4ccccc4n3)CC2)cc1 23332311 MGOGVRNDFUSYLY-LJQANCHMSA-N 432.568 4.344 10 10 IICE O=C(CNc1ccc(Br)cc1C(=O)c1ccccc1)Nc1ccc(O)cc1 35549353 OJPRQXBELKUTRC-UHFFFAOYSA-N 425.282 4.436 10 10 IICE C/C(=C1/SC(=S)N(c2ccccc2C(N)=O)C1=O)c1ccc(Br)cc1 39861598 LFVRURQHSUDUEJ-GDNBJRDFSA-N 433.352 4.344 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=N)N4C(SC)=NSC4=NC3=O)o2)cc1 104371948 IPLBNCMLNFDBDF-JVDIEWMDSA-N 440.506 4.063 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](c3c(C)nn(C)c3C)C(F)(F)F)ccc21 471095042 LCYHASUAKYSEJX-FQEVSTJZSA-N 436.478 4.288 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)CSCc2ccc(Br)cc2F)c1 728978829 PTCROKTZGITYDL-LLVKDONJSA-N 428.323 4.413 10 10 IICE COc1cc(/C=C2\SC(=S)N([C@@H]3CCOc4ccccc43)C2=O)cc2c1OCCO2 743284438 MRUWETFTNWANRI-VUFYJBQKSA-N 441.530 4.191 10 10 IICE Cc1noc(C2CCC(NC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2)n1 753347071 LDLDQCYXGPZHCK-UHFFFAOYSA-N 437.544 4.475 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cc1Br 768533751 SIKKEUOHRMIZBJ-UHFFFAOYSA-N 446.364 4.050 10 10 IICE O=C(Cc1cccc(C(F)(F)F)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768533794 UHWYGGBLEQCZFM-UHFFFAOYSA-N 431.502 4.096 10 10 IICE C[C@@H](NC(=O)N[C@H]1CCCOc2c(Cl)cccc21)c1ccc(N2CCOCC2)cc1 775729246 SLRWEIDAPANYHA-IERDGZPVSA-N 429.948 4.451 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)Nc2nnn(Cc3ccc(C(F)(F)F)cc3)c2C)c1 801796818 CAZPAFIUNQJFND-GFCCVEGCSA-N 449.433 4.251 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cnc(Cl)c(Br)c1 806419233 NDNHTGYGEXZBCB-UHFFFAOYSA-N 435.503 4.287 10 10 IICE CCOC(=O)c1c(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)noc1C 809944381 NJGRIQKADJHQMS-UHFFFAOYSA-N 429.517 4.137 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc(-n4ccc(C(F)(F)F)n4)cc3)c2)CC1 1128313883 ZSCXXESOPKURPW-UHFFFAOYSA-N 443.473 4.285 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3ccc(Cl)c(Cl)c3)CC2)c(OC)c1 1131804769 PLLMXBZQOJIGQU-UHFFFAOYSA-N 439.339 4.128 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(OCCS(C)(=O)=O)cc3)c2C)c1 1147097632 LJAIMLBQVBDTBH-UHFFFAOYSA-N 440.565 4.387 10 10 IICE CCN(CCCN1CCCC1)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1154504030 PXSFDBCQCKCUAQ-UHFFFAOYSA-N 433.394 4.200 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1 1162539305 AASKQNGKVBHRDE-GOSISDBHSA-N 434.492 4.133 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3ccc(C(F)(F)F)cc3nc2O)cc1 1164596856 DBJVCGDWUWATLO-UHFFFAOYSA-N 433.430 4.176 10 10 IICE COc1ccc(N(CC(=O)NCc2cnn(-c3ccccc3)c2)Cc2cccs2)cc1 1167673800 GDKFISZENHNNDF-UHFFFAOYSA-N 432.549 4.265 10 10 IICE C[C@H](N[C@H](C)COCC1CCCCC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1176345434 NWGNBLNAKQQIIX-MSOLQXFVSA-N 448.563 4.364 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(CCc3ccc(O)cc3)CC2)N(C)C)cc1 1256232890 WRRBVXQDTKWUNS-VWLOTQADSA-N 438.616 4.115 10 10 IICE Cc1nnc(N2CCC(C(=O)C(F)(F)F)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1290760314 TZAVHODEVDXFSJ-UHFFFAOYSA-N 449.521 4.219 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)c1C 1293827950 SPXWZTCXPAZNLF-OAQYLSRUSA-N 430.596 4.343 10 10 IICE COc1ccc(CN(C)c2nnc(C3CC3)n2CCCSc2nccs2)cc1O 1300167052 USNNHJQSBPFSOO-UHFFFAOYSA-N 431.587 4.145 10 10 IICE Cc1cccc(NS(=O)(=O)c2cc(C(=O)NCc3cccc(Cl)c3O)ccc2C)c1 1305069902 UELRYIUPWKJFHA-UHFFFAOYSA-N 444.940 4.393 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 1312529779 WEWYHIPZQJGMDR-VQTJNVASSA-N 430.593 4.264 10 10 IICE CCN(c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1)C1CCCC1 1313617635 OMSHWWNGBUHJIU-UHFFFAOYSA-N 439.583 4.162 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 1355015551 OIBWOUZGOWGXGN-PGRDOPGGSA-N 431.939 4.161 10 10 IICE Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1435783098 FRFVVVRSSLQWFJ-UHFFFAOYSA-N 431.536 4.056 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@H]1CCC(F)(F)C1 1439996182 LSWGVKTVISWMHU-DSQDWWTGSA-N 442.528 4.359 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@@H](C(C)(C)C)c4ccccc43)CC2)cc1 1448666644 DXWJXQJNBAJXPA-OILJVOJPSA-N 447.579 4.077 10 10 IICE CN(c1ccc(CNC(=O)CCNC(=O)c2cc3ccccc3[nH]2)cc1)C1CCCCC1 1464541399 SOOKTINKPNYUCZ-UHFFFAOYSA-N 432.568 4.373 10 10 IICE OC1CCN(c2ccc(CNc3ncncc3-c3ccc(Br)cc3)cc2)CC1 1472839793 NQGAHHJSRVJWJY-UHFFFAOYSA-N 439.357 4.479 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@H]2CCSC2)n1Cc1ccc(N2CCSCC2)cc1 1495071638 ILJWAVSEDHYNSI-XLIONFOSSA-N 431.675 4.335 10 10 IICE CC(C)c1nnc(N(C)CCC2CCOCC2)n1Cc1ccc(N2CCSCC2)cc1 1508922200 JVPRLXRRVZEQHN-UHFFFAOYSA-N 443.661 4.256 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC[C@H](C2CC2)N1C(=O)OC(C)(C)C 1540488218 IWQURSQJBAMHJL-YADHBBJMSA-N 427.589 4.423 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c1 1542619650 SMPGFQKCIKKEHN-UHFFFAOYSA-N 439.506 4.389 10 10 IICE C[C@@H](Cn1c(-c2cc3c(s2)CC[C@@H](C)C3)nnc1N(C)Cc1ccccc1O)N(C)C 1543868696 SWJJLDZGIVLMCE-SJORKVTESA-N 439.629 4.424 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CC[C@H]1c1ccc(Cl)cc1F 1544629885 DIZLLPXSBMGJHR-HKUYNNGSSA-N 434.914 4.389 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1 1544816104 VZJIXKZPDWLIOH-KRWDZBQOSA-N 425.891 4.422 10 10 IICE O=C(c1ccccc1)c1c[nH]c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1545041927 OCCDSMCFSSUQMH-GOSISDBHSA-N 439.462 4.246 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1545654013 ZOHYNKPIURVBAV-OAQYLSRUSA-N 448.615 4.021 10 10 IICE CNc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1F 1546150841 YSJLFRQAIPWYDS-UHFFFAOYSA-N 432.543 4.484 10 10 IICE COC1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCCO)C1 1554700126 SKPASMXILSOSKE-UHFFFAOYSA-N 437.588 4.130 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCC4)C3)cc2F)C[C@H](C)O1 1559528940 YCPKAOZZODXWLI-PMACEKPBSA-N 431.596 4.102 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1564589683 JBMXZMJVCCDUSB-UONOGXRCSA-N 432.348 4.334 10 10 IICE Cc1cc(CCNC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1565162317 SEDYHPFOVPKVAD-RUZDIDTESA-N 440.588 4.335 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccccc2OCCN2CCOCC2)c1C 1583574696 ATNXMSLVCGTOBE-UHFFFAOYSA-N 447.579 4.044 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CCc4cc(Br)ccc43)C2)cc1 1584444733 YZJQUKONGMJPAH-BTYIYWSLSA-N 429.358 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(I)c1C 1585264593 UUCAFDCYCHTETE-CQSZACIVSA-N 436.337 4.335 10 10 IICE C[C@H](NC(=O)[C@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1585423736 KUGZYPKYQIRAHN-HTAPYJJXSA-N 439.556 4.301 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCN1CCN(c2cccc(Cl)c2)CC1 1587552127 KIVVEGPEEOYWHD-UHFFFAOYSA-N 441.019 4.111 10 10 IICE CN1CCCc2cc(CNC(=O)Cc3ccc(OCCOc4ccccc4)cc3)ccc21 1597847945 BXPUZJHYRKIPRD-UHFFFAOYSA-N 430.548 4.386 10 10 IICE C[C@@H](C(=O)NCc1ccc2c(c1)CCCN2C)c1ccc(I)cc1 1597854481 DIIROCMCXMCNHH-CQSZACIVSA-N 434.321 4.094 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(C)(C)c3ccccc3Br)C2)cc1 1598363160 FJMDYCCBMSKSIX-MRXNPFEDSA-N 431.374 4.378 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CS[C@H]3CCOc4ccccc43)cc2F)C[C@@H](C)O1 1613616996 DKRDVZCOPUUVLE-MFEFFIJZSA-N 444.572 4.313 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@H]3/C=C/c3ccccc3)CC2)cc1 1616321545 DSUUIWYPLJBFHU-JRFBLBNDSA-N 449.639 4.136 10 10 IICE Cc1cc(CN2CCC([C@@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)CC2)ccc1N(C)C 1618529675 UCRYJYZYIDIZMX-GGAORHGYSA-N 431.621 4.345 10 10 IICE C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCc2ccc3cccnc3c2O)cc1 1630526011 ASPVZFJYUQEYKK-HDICACEKSA-N 447.535 4.039 10 10 IICE COC[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(F)c(F)c1 1631912879 PJSXFKBDVRPPQV-QHCPKHFHSA-N 426.463 4.231 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C(O)(c1ccccc1)c1ccccc1 1635673138 KNXCGAXEOFVHLO-UHFFFAOYSA-N 440.337 4.439 10 10 IICE Cc1cc(C(=O)NCC2(C3(O)CCC3)CCC2)c(C)n1-c1ccc(Br)cn1 1638094408 SLHHJELASSZEKV-UHFFFAOYSA-N 432.362 4.067 10 10 IICE Cc1ccc(-n2nnnc2SCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)cc1 1643438328 LLMDPWOAHGAJSZ-UHFFFAOYSA-N 438.944 4.402 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCN(CC(F)F)C2)c(C)n1-c1ccccc1Br 1644353029 MCYOZQUBSVUTKY-HNNXBMFYSA-N 440.332 4.173 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)cc1 1646620766 PIBBEBJCOKWSKJ-VWLOTQADSA-N 427.564 4.250 10 10 IICE Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)N[C@@H](C)c3ccccc3O)c2)cc1F 1648892126 NBCOEZPRBMAFTP-HNNXBMFYSA-N 428.485 4.132 10 10 IICE CCOC(=O)CN(Cc1ncc(-c2ccccc2Br)o1)Cc1ccccc1O 1653969997 PIVKKJAJNVOGQB-UHFFFAOYSA-N 445.313 4.375 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC[C@@H]([C@H](O)c3ccc(Br)cc3)C2)c1O 1654609284 SIHQREIZQIHTML-FOIQADDNSA-N 436.321 4.442 10 10 IICE COc1ccc([C@@H](NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c2ccccc2)cc1 1683944317 BYKDZNIFSNFVIO-OFVILXPXSA-N 431.536 4.371 10 10 IICE CCOCCN(C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)[C@@H]1CCc2ccccc21 1685686441 NOSYEOGETKZHHV-JWQCQUIFSA-N 438.616 4.091 10 10 IICE Cc1nnc(N2CC[C@H](C)N(Cc3ccccc3)CC2)n1CCCSc1nccs1 1693476231 KZBCEYRRPWIYJM-SFHVURJKSA-N 442.658 4.326 10 10 IICE CCC[C@@H](C)CN(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1709475075 BOVHUOVRHZMIEB-CTNGQTDRSA-N 443.661 4.256 10 10 IICE CCN(c1nnc(Cc2cn3ccccc3n2)n1CCCSc1nccs1)C(C)C 1728321419 SRULBTHTRKNKGZ-UHFFFAOYSA-N 441.630 4.390 10 10 IICE CO[C@H](Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1729882882 KXVDNNXULKSNHL-IFMALSPDSA-N 441.620 4.080 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CC[C@@H](C)C1 1741434564 ZBCJJPYOTIHLSN-IFMALSPDSA-N 425.621 4.386 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1765282446 JCNMNSQMSHMJHA-NRFANRHFSA-N 445.702 4.410 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)C1 1769404649 ZDZQGQKAHKRZSZ-MRXNPFEDSA-N 432.619 4.165 10 10 IICE COc1ccc(C(=O)N(c2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)cc1[N+](=O)[O-] 1859891415 BABDRJCNZRWKDG-UHFFFAOYSA-N 444.443 4.434 10 10 IICE CC(C)OC(=O)c1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCCO4)SC2=S)c1 1860086678 AFXKWLXOUJFWSU-YBFXNURJSA-N 441.530 4.429 10 10 IICE CCc1cccc(C)c1N1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC)CCCC3)CC1=O 1873427550 YOOGPJIYDSDZTK-MRXNPFEDSA-N 440.565 4.276 10 10 IICE CCOC(=O)c1c(C(F)(F)F)nn([C@H](C)c2ccc(OC)cc2O)c1Br 2079858511 RABKUMZAWNYKDU-MRVPVSSYSA-N 437.212 4.165 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C23CCC3)c1O 2236044786 MACWTKZSOZIZEA-MRXNPFEDSA-N 441.366 4.185 10 10 IICE CCC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 2297328302 GODLRAGMYVGEGJ-AWEZNQCLSA-N 432.479 4.309 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccccc3O[C@@H](C)C(=O)O)SC2=S)cc1 2314931454 ONTAQYWZHQHFHS-ZDUSSCGKSA-N 429.519 4.343 10 10 IICE CC[C@@H](NC[C@@H]1[C@@H]2C[C@@H]2CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2332566807 DUSZTTAQKKNCFD-ODVANORSSA-N 425.367 4.451 10 10 IICE CC[C@@H](C)N(Cc1ccc(N(CC)CC)cc1OS(=O)(=O)CC)C(=O)c1ccco1 37402152 SSUCCYCCVAPKHB-QGZVFWFLSA-N 436.574 4.295 10 10 IICE CCN1CCN(/C=C2\SC(=S)N(c3cc(C(F)(F)F)ccc3Cl)C2=O)CC1 59397579 AYWOFJPWEQCYCJ-UVTDQMKNSA-N 435.924 4.202 10 10 IICE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(\C)Nc1ccc(Cl)c(F)c1 103920020 PCXALFMBXQNRIZ-YBFXNURJSA-N 446.822 4.039 10 10 IICE Cc1cc(C(=O)COC(=O)C[C@@H](C)NC(=O)C2CCCC2)c(C)n1-c1ccc(F)cc1 727200563 LJEHDSIYQPFWDB-OAHLLOKOSA-N 428.504 4.044 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(Cl)s1 748025122 SQEXCHNGYRKBOS-SNVBAGLBSA-N 442.971 4.460 10 10 IICE CCN1CC[C@H](NC(=O)N[C@@H](C)c2cc(OC)ccc2O)[C@H]1c1cc(F)c(F)c(F)c1 782536455 PTAOQISLQYCXRD-JPHFQCMKSA-N 437.462 4.014 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H]([C@@H]2CCCOC2)C(F)(F)F)C1 789646428 OVJQMBIBBLHRRY-OPAMFIHVSA-N 438.490 4.309 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC1CCN(C(=O)CCc2ccccc2)CC1 802000889 BFGGLJNYVUVORS-UHFFFAOYSA-N 437.584 4.328 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)C3CCN(C(=O)c4ccoc4)CC3)c2C)cc1 913314092 LJSSSVJXEKBFBK-UHFFFAOYSA-N 448.519 4.274 10 10 IICE Cc1nc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2c3c(sc2n1)C[C@@H](C)CC3 917391485 VYQIJOCPHXOOBA-MAUKXSAKSA-N 449.624 4.438 10 10 IICE CN(C)c1ccc(/C=C\c2nc3ccccc3c(=O)n2NC(=O)Nc2ccccc2)cc1 1088707414 LWFIOQVSEMYSHT-VKAVYKQESA-N 425.492 4.409 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(-c4ccc(C(F)(F)F)cc4)c3)C2)cc1 1130185298 DKKLHZPLJUDDBK-MRXNPFEDSA-N 444.457 4.156 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1 1141723589 WSDOTZDWEKDVTF-KRWDZBQOSA-N 435.528 4.372 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccccc1CCNC(=O)OC(C)(C)C 1142419095 NCWLRTLQMSHMJK-LJQANCHMSA-N 439.600 4.489 10 10 IICE CC(C)n1cc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)n1 1142713201 RFBBWUJQYMJUJR-SFHVURJKSA-N 449.393 4.114 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)cc1 1152988824 NXHIGDXIAKPRSS-DEOSSOPVSA-N 437.971 4.239 10 10 IICE Cc1cc(CC(=O)NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c(C)n1-c1ccccc1 1156148919 BSXIKNFFXCZOME-SFHVURJKSA-N 430.470 4.021 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](C)c3ccc(S(C)(=O)=O)cc3)c2C)c1 1231260860 LMFNQTUPMXTBPH-SFHVURJKSA-N 439.581 4.366 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CC[C@@H](C2CCOCC2)C1 1289423450 LIQDWAIVVACNPZ-JOCHJYFZSA-N 425.621 4.152 10 10 IICE Cc1cc(C(=O)NCCCN2CCCCCC2=O)c(C)n1-c1cccc(Br)c1 1290304660 GUNZDPYGZWGUTB-UHFFFAOYSA-N 446.389 4.379 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)CS(=O)(=O)CC 1294592680 HOCJRGYLPWZBRS-SFHVURJKSA-N 443.617 4.022 10 10 IICE Cc1cc(C(=O)N[C@@H]2[C@@H](C)CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(C)n1-c1ccccn1 1297536601 AAILZWXBXQMFCJ-RRMPHLOHSA-N 426.561 4.253 10 10 IICE COc1cccc(C(=O)CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1 1302933719 XGNYMAKQRWICSO-UHFFFAOYSA-N 441.325 4.478 10 10 IICE COc1ccc(N2CCN(CCC(=O)NC(c3ccccc3)c3ccccc3)CC2)cc1F 1307574059 LTDMXWWMQVBMJF-UHFFFAOYSA-N 447.554 4.252 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](Oc3ccccc3)c3ccccc3)cc2F)CC1 1352960754 NSLXNPUMMAXQTE-AREMUKBSSA-N 447.554 4.404 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCN(C)C)Cc2ccccc2F)CCCC1 1359844547 AWANLGXYARBNFA-UHFFFAOYSA-N 437.559 4.258 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1 1435032091 MAIARVCRPGAITE-KRWDZBQOSA-N 425.529 4.361 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCc3[nH]c4c(Br)cccc4c3C2)cc1 1442190951 ZBKMYYLDZMHSJR-UHFFFAOYSA-N 426.274 4.291 10 10 IICE COc1ccccc1[C@H]1CN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CCO1 1454720966 DFLYLZLGGYLUPP-RUZDIDTESA-N 432.520 4.437 10 10 IICE COc1ccc(N2CCN(CC(=O)N(Cc3ccc(C(C)C)cc3)C3CC3)CC2)cc1F 1459749521 VMPYCAZAWPRRAD-UHFFFAOYSA-N 439.575 4.271 10 10 IICE Cc1ccc(N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2=O)cc1 1467929339 UTSGIKMRYSAFLM-UHFFFAOYSA-N 429.520 4.012 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnccn1 1504558624 AIYBKFNPNSMLAZ-GOSISDBHSA-N 445.571 4.062 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(C2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1516917118 FZPKRAHHNPGZPS-KRWDZBQOSA-N 447.624 4.147 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)Nc3cccc(N4CCN(CC)CC4)c3)c2)c1C 1523930966 JJQAYPSIONWYEC-UHFFFAOYSA-N 431.584 4.446 10 10 IICE CCCCCn1nc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c2ccccc2c1=O 1529276819 AJAILQZCXWCPOD-LJQANCHMSA-N 434.584 4.322 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4ccccc4Cl)CCOCC3)C2)cc1 1529706321 GBKROAIXYYYQDR-GOSISDBHSA-N 428.960 4.040 10 10 IICE Cc1ccc(I)cc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1531694686 SMQAYENEPQIMFU-UHFFFAOYSA-N 434.321 4.472 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4cccc(Cl)c4)CCOCC3)C2)cc1 1537109004 ILDYEKQIPJHIKW-GOSISDBHSA-N 428.960 4.040 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](Cc3cc4ccccc4o3)C(=O)OC)ccc21 1537824121 QDFSKHDOFLYJGC-QFIPXVFZSA-N 448.519 4.165 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1 1542400110 DTSZMEWISRILRO-UHFFFAOYSA-N 432.524 4.269 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543756493 CBMOZTWKGZYZGF-PMACEKPBSA-N 425.621 4.283 10 10 IICE CC(C)(Cc1ccc(O)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1544434128 HURYNJWXFNAKMI-UHFFFAOYSA-N 436.474 4.133 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](n3cncn3)C2)n1Cc1ccc(N(CC)CC)cc1 1545484630 UESPDPGDOIMTQB-SIKLNZKXSA-N 436.608 4.119 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(C)(C)CCOC 1545538225 XPTWTFBYDKFAGJ-SFHVURJKSA-N 447.599 4.329 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(C2CC2)n1Cc1ccc(N2CCOCC2)cc1 1552595022 RSZXFRJWMRPCIH-SFHVURJKSA-N 429.634 4.008 10 10 IICE CCc1sc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1Br 1566346569 DVINHIVLVXHWDQ-UHFFFAOYSA-N 427.339 4.183 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1567467835 SWRCXXUGSOBIHT-WBVHZDCISA-N 426.513 4.074 10 10 IICE COCc1ccccc1OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1583322080 HCBHOLHOCAHNEM-PDGQHHTCSA-N 431.510 4.169 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(NC(=O)C(C)C)ccc3Cl)C2)cc1 1584444625 UUHNBIPBFXHNOX-MRXNPFEDSA-N 429.948 4.199 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](O)COc2ccccc2Br)cc1 1587954856 RELFHULTFTXSSZ-LJQANCHMSA-N 443.341 4.026 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CCCCS3)CC2)cc1 1619301449 LCDHPFUYENDIKH-QFIPXVFZSA-N 443.661 4.488 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(NC2=NCCC2)cc1 1624914563 NYOSJGCRELJGAG-UHFFFAOYSA-N 446.473 4.076 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](c2ccccc2F)c2nccn2C)cc1 1624936719 BYQLPAGFXNNZPM-RUZDIDTESA-N 444.510 4.228 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cccc(Oc4ccccc4)c3)CC2)cc1 1627049877 DHIZZZVFSCJUSE-UHFFFAOYSA-N 431.536 4.040 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)C3CC(NC(=O)OC(C)(C)C)C3)c2C)cc1 1627811743 DWOMPLWZAQJSSR-UHFFFAOYSA-N 427.545 4.230 10 10 IICE COC(=O)CCCOc1ccc(CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1629279439 LDMWAVNDKFNSKI-UHFFFAOYSA-N 438.499 4.495 10 10 IICE Cc1cc(CC(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1629940759 LFGMDVRSIOPSPD-UHFFFAOYSA-N 425.573 4.495 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](NC(=O)c1ccc(C)cc1)C(C)C 1629968256 COMFKHYDFXMBGV-HXUWFJFHSA-N 447.373 4.266 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc(-c2ccc(F)cc2)nc1C 1630481268 RKXZWFWWAGHUGH-UHFFFAOYSA-N 428.485 4.169 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1nccc2cc[nH]c12 1633128626 SPUPSLIGEUOKDU-KAMYIIQDSA-N 428.564 4.245 10 10 IICE Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1638918009 POGNAMQDHRNPQW-YADHBBJMSA-N 426.609 4.022 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(CN4CC[C@@H](O)C4)cc3)c2C)c1 1641130997 NWYSHVNWAKNBRI-RUZDIDTESA-N 431.580 4.208 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)cc1F 1644919069 AMCFEOBRUBHPAQ-AWEZNQCLSA-N 440.346 4.141 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cccnc3I)c2C)c1 1648963727 NYJKYOCZIIXNDL-UHFFFAOYSA-N 445.304 4.332 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@]3(C)Cc3ccc(F)cc3)C2)cc1 1683504569 XJHSIBVRQMTZPG-NBGIEHNGSA-N 425.548 4.467 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(OC(F)(F)F)c1 1684142041 QJVUBQJUUDEAOL-HNNXBMFYSA-N 437.462 4.107 10 10 IICE CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC[C@H]1c1ccccc1 1685328393 VHEHUGXBZQCSGY-PXDATVDWSA-N 448.611 4.114 10 10 IICE CCc1nnc(N2CCN([C@@H](C)c3ccsc3)CC2)n1Cc1ccc(N(C)C)cc1C 1727601706 KEBVIIIXMVKQHD-IBGZPJMESA-N 438.645 4.208 10 10 IICE C[C@H](Cc1cccs1)Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1761372196 JZESPXQAMRJGIO-IEBWSBKVSA-N 426.586 4.454 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2Cc2ccc(Cl)s2)CCOC1 1765827163 CKMRNQKDDDLTAR-OAQYLSRUSA-N 448.976 4.035 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)C[C@H]2CCOC2)cc1 1766614239 NEFNCCHEPZWICK-OAQYLSRUSA-N 439.629 4.298 10 10 IICE COCCCN1C(=O)C(N[C@@H]2CCCC[C@H]2C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873169450 AXKVAESJGNWJAA-WZONZLPQSA-N 449.595 4.379 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C2(C)CC2)c(I)c1CO 2079952144 DNZWYRLBLGZANJ-QGZVFWFLSA-N 440.325 4.254 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NCc2c(O)cccc2Br)C12CCC2 2118412397 AYMXHGLTJBRQFC-DYVFJYSZSA-N 425.367 4.328 10 10 IICE O=C1NC(=O)N(c2cccc(Br)c2)C(=O)C1=Cc1cccc(C(F)(F)F)c1 2297334978 VVLTYGTVQMKLIL-UHFFFAOYSA-N 439.187 4.134 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=C(C)Nc2cccnc2)cc1 2313683375 YNPVIYRJBFWYJV-UHFFFAOYSA-N 429.436 4.135 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3)C(=O)C2=Cc2ccc3c(c2)OCCO3)cc1 2332127418 WKAWABVQZACSRS-UHFFFAOYSA-N 426.472 4.297 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)C)cc3[C@H]3C=CC[C@H]32)cc1OC 14479395 HVVPXQSGBOCGRG-IXFSTUDKSA-N 428.554 4.217 10 10 IICE Cc1cc(C(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 25820596 SQFWZQIHQSWABF-UHFFFAOYSA-N 433.527 4.402 10 10 IICE CC1=CC2=NC(=O)/C(=C/c3cc(C)n(-c4ccc(Br)cc4)c3C)C(=N)N2O1 96468487 YXXODBNEOKIGTH-YNQUSLBMSA-N 425.286 4.307 10 10 IICE CCN1C(=O)/C(=C/c2c(Oc3ccc(C)cc3C)nc3ccccn3c2=O)SC1=S 213172082 DBHKQIVQOYYGLN-ATVHPVEESA-N 437.546 4.325 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)N[C@H](C)c1cc(OC)ccc1O)O[C@@H](C)C2 730828275 SFOORTMFRLNWIJ-ZZXMYQEDSA-N 426.513 4.039 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)[C@H]2C1 754877970 JVIJNIHHDBFZET-GIVPXCGWSA-N 447.373 4.265 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N[C@H](C)c3ccc4ncsc4c3)cc2F)CC1 776929735 YWGAOMRQRICCJE-MRXNPFEDSA-N 441.576 4.138 10 10 IICE COc1cc(Br)ccc1/C=C1/SC(=S)N(CCCCCC(=O)O)C1=O 781550606 CZMMSDDOQQRFPS-NTEUORMPSA-N 444.372 4.304 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(C)O[C@]2(CCOC2)C1 801963196 FOZZEQQEDSPVBL-RUZDIDTESA-N 435.572 4.147 10 10 IICE CO[C@](C)(c1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1)C1CC1 810336280 GBXBGXCBRLQUAX-RNUYOQPASA-N 435.596 4.237 10 10 IICE CCOC(=O)c1ccc2c(c1)nc(/C(Cl)=C/c1cnc(N3CCOCC3)s1)n2CC 821003344 XQBJXGRDXXWXOE-VBKFSLOCSA-N 446.960 4.263 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 1126582941 OMYNHMAOTBIJJU-INIZCTEOSA-N 447.482 4.037 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1134682141 WWYZZVGVTPMJJA-FQEVSTJZSA-N 443.954 4.072 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(I)cc1N 1135746015 KFMOPKYYTDFIIU-UHFFFAOYSA-N 449.336 4.136 10 10 IICE C[C@H]1Cc2cccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)c2O1 1136903948 PFXYJNYWRASGEK-HRAATJIYSA-N 439.556 4.072 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)cc1 1141271565 XYHSFUWRXIBPGM-VWLOTQADSA-N 444.510 4.228 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1F 1150239391 GLVYVOJRYDXHQJ-GCJKJVERSA-N 447.348 4.223 10 10 IICE O=C(N[C@@H]1CCN(c2cccc(Br)c2)C1)c1cc2cc(O)c(O)cc2s1 1155813721 LZPMNQHQHNZZKE-CYBMUJFWSA-N 433.327 4.084 10 10 IICE Cc1nnc(SCC(=O)NCc2cc(C)n(-c3ccccc3)c2C)n1Cc1ccccc1 1170858695 OYVCQKAUHLZYTK-UHFFFAOYSA-N 445.592 4.451 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC[C@@H]1CC1(Cl)Cl 1280372614 DILBBNLLWBBQCY-VSXLWIIGSA-N 449.450 4.430 10 10 IICE CCOC(=O)[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1292382270 ONFDVPUCLVITKZ-LJQANCHMSA-N 433.346 4.414 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CCCN(CC(F)F)C2)cc1 1293125928 VKNOLYGJLFEVCZ-IBGZPJMESA-N 431.527 4.272 10 10 IICE COCC[C@@H](Cc1ccco1)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1296272327 XSNFQYWQMYNSFD-KRWDZBQOSA-N 446.345 4.222 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1csc(CCNC(=O)OC(C)(C)C)n1 1297006664 YNNXJHNSDRPAMP-UHFFFAOYSA-N 433.574 4.358 10 10 IICE CCc1nnc(N2CC[C@@H](N(C)Cc3ccccc3)C2)n1CCCSc1nccs1 1306138399 DPLPXVHAQKGJER-LJQANCHMSA-N 442.658 4.190 10 10 IICE CCCN(CCC)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1307007284 YQCYCAWNYJOHEM-OAQYLSRUSA-N 429.634 4.358 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cnn(C)c2)n1Cc1ccc(N2CCC(C)CC2)cc1 1359781852 XBPZJKIXLGAPQY-UHFFFAOYSA-N 435.620 4.131 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1csc(I)c1 1436853673 YLWAMJMEVMRHPZ-GFCCVEGCSA-N 428.339 4.088 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1445968285 LPEWWXPINULJFJ-CYBMUJFWSA-N 444.329 4.457 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CCCC[C@@H]2N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1455642358 WEJAHQPXVRFVGM-RDPSFJRHSA-N 444.019 4.297 10 10 IICE CC(C)CN(Cc1ccccn1)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1473817216 KQZHGMNUJDAPLV-SFHVURJKSA-N 441.531 4.342 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1CCC[C@H](c2ccccc2)C1 1478590027 QFXIBNRWNJFJQT-VQTJNVASSA-N 429.511 4.327 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(N2CCSCC2)cc1 1543098689 GTQFJXMFBSGWDO-UHFFFAOYSA-N 433.577 4.390 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)C(F)(F)c1ccccc1Br 1543098786 LFCRDQKLPHOFMU-UHFFFAOYSA-N 441.341 4.411 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3scnc3-c3ccccc3)cc2F)C[C@H](C)O1 1544675791 AQADIOMJPIDPKM-IRXDYDNUSA-N 439.556 4.422 10 10 IICE CC[C@@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1cccc2ccccc12 1560151050 ULPBRLIRPULJQY-WNCULLNHSA-N 433.596 4.072 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)OC(C)(C)C)C2 1564946550 RNYWVHDFGMHURP-GPHNJDIKSA-N 444.620 4.079 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCc2ccccc2)NC(=O)OC(C)(C)C)cc1 1586619075 BBAQIGXVHGGZOX-QFIPXVFZSA-N 425.573 4.458 10 10 IICE CC[C@@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N(C)C(=O)OC(C)(C)C 1587150115 AHSPMVDBIHXMLH-YJBOKZPZSA-N 441.519 4.019 10 10 IICE C[C@H](Cc1cccc(F)c1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1618431077 JDBFYSRPXQFQOS-MRXNPFEDSA-N 430.479 4.103 10 10 IICE CCO[C@@H]1C[C@@](O)(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1626720588 VEGXLSVZEIUDGQ-DENIHFKCSA-N 449.389 4.153 10 10 IICE Cc1cc(C(=O)NCc2nc(C(F)(F)F)no2)c(C)n1-c1ccc(Br)cc1 1633788006 SUFNREPZNJWOGN-UHFFFAOYSA-N 443.223 4.188 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(OCCN(C)C)c(OC)c3)c2C)cc1 1638244513 YSUMAKPQOKLPOB-UHFFFAOYSA-N 437.540 4.304 10 10 IICE CC(C)N(C)c1ccccc1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1639271636 SUWQNPNEMBQXRF-UHFFFAOYSA-N 445.566 4.351 10 10 IICE COc1ccc(C(=O)c2ccccc2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1640232023 HVGIBWQTCIXPKV-RUZDIDTESA-N 445.563 4.025 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3nnc(-c4ccco4)n3)c2C)ccc1Br 1641170670 XBFRKDJRVLBSMB-UHFFFAOYSA-N 440.301 4.294 10 10 IICE CCCOc1cccc(CNC(=O)CN(CC)Cc2cc(Br)ccc2O)c1 1644711398 UXOULXYLGBTZNO-UHFFFAOYSA-N 435.362 4.082 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)CCNC3=O)c(C)n1-c1cccc(Br)c1 1645289381 IEZLIJSBBWZMTD-UHFFFAOYSA-N 438.325 4.395 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)/C=C1\SCC(=O)N1C 1654253754 YUTFKHHNDNMSMB-BYINCCNUSA-N 449.498 4.345 10 10 IICE COC(=O)c1ccc2cc(CCNC(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)oc2c1 1683255147 YLNSUODIJLXIJP-QGZVFWFLSA-N 437.540 4.067 10 10 IICE CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1684142437 ZHDBWEYFQAUOFN-UHFFFAOYSA-N 435.490 4.398 10 10 IICE Cc1cc(CNC(=O)NC[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]23)c(C)n1-c1ccccc1 1684483070 FHIDPUCCIWUPRA-DKUWSORSSA-N 438.572 4.006 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1691930656 JJOXOTMDKYVYEI-OAQYLSRUSA-N 436.579 4.390 10 10 IICE CC(C)CN(c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1706493899 WTUODVMLZZVRPV-UHFFFAOYSA-N 448.615 4.020 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1728384329 OOZTWYJCMNJUDR-FQEVSTJZSA-N 448.615 4.162 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@H]1C[C@H](F)C1 1752608528 DTNNDDGLRISRKK-HMXCVIKNSA-N 429.584 4.403 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCCN(C(C)(C)C)CC1 1761697837 NESOOECCAUXEGR-UHFFFAOYSA-N 435.620 4.007 10 10 IICE COc1ccc(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)c(C)s1 1859572431 HDYNPAQNASOVNQ-UHFFFAOYSA-N 443.550 4.121 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(O)C(=O)N(CCCc3nc4ccccc4[nH]3)C2=O)cc1 1872957747 GEFWIENKUONIGC-UHFFFAOYSA-N 440.503 4.241 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c1O 2236050155 BGIAROGKQJKGDG-BLLLJJGKSA-N 443.382 4.192 10 10 IICE Cc1ccc(OCCCOc2ccccc2C=C2C(=O)NN(c3ccccc3)C2=O)cc1 2293692840 LQSWQFMXKWRSCG-UHFFFAOYSA-N 428.488 4.304 10 10 IICE COC(=O)c1[nH]c2ccccc2c1C=C1SC(=S)N(c2cccc(C(=O)O)c2)C1=O 2296592884 SSMBVHOTILMQPB-UHFFFAOYSA-N 438.486 4.059 10 10 IICE CC1=NN(c2ccc(Br)c(C)c2C)C(=O)C1=CNc1ccc(C(=O)O)c(O)c1 2297316897 JEKWLXZPWDUEGU-UHFFFAOYSA-N 444.285 4.188 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1ccc(Cl)cc1 2297347670 RPQRHHXPDZRNHJ-UHFFFAOYSA-N 437.839 4.018 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)c(C)n1-c1ccc(C(=O)O)cc1 20344745 DHDSBNKKVGECOV-NDENLUEZSA-N 447.422 4.438 10 10 IICE CCCCOC(=O)c1ccc(-c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)o2)cc1 33399130 SOOAGDSANNRJLL-BOPFTXTBSA-N 445.518 4.189 10 10 IICE COc1ccc(C(=O)NN2C(=O)/C(=C/c3cccc(C(F)(F)F)c3)SC2=S)cc1 34107405 FAUSJEICLMVGGC-GDNBJRDFSA-N 438.452 4.260 10 10 IICE CCOC(=O)CCCN1C(=O)/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 210098079 KANRGDUJTWFWSH-ATVHPVEESA-N 446.506 4.399 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1c(Br)cccc1Br 541372923 DIGOPRAFVMLZQV-UHFFFAOYSA-N 440.135 4.317 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)c(C)c1 727241877 KPUYSTGYXVQYPN-UHFFFAOYSA-N 432.523 4.023 10 10 IICE COC(=O)c1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccc(F)cc2)cs1 727242192 VZYZVKZBFUTERC-UHFFFAOYSA-N 426.878 4.190 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 730138276 GKRKWCFIYAFLAL-HXUWFJFHSA-N 432.609 4.321 10 10 IICE CCOc1ccc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 748027971 VGTXNNVRKZEEDK-AWEZNQCLSA-N 446.550 4.144 10 10 IICE COC(=O)CCc1nnc(NC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)s1 772147331 ZWHPLOODNMECRD-UHFFFAOYSA-N 438.513 4.377 10 10 IICE Cc1ccccc1C[C@H](C)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 773215954 SMGZQXHFVYCATE-INIZCTEOSA-N 444.578 4.266 10 10 IICE O=S(=O)(Cc1ccccc1)Nc1ccc(NCc2cc(Br)ccc2O)nc1 793304909 PNYQVIQNSBVOKM-UHFFFAOYSA-N 448.342 4.104 10 10 IICE O=C1NC(=S)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccc(N2CCCC2)o1 1083904025 JGJATLHTNYIXMW-RAXLEYEMSA-N 436.320 4.018 10 10 IICE CCN(CC)c1ccc(/C=C2/C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)c(OC)c1 1084566669 DCXQCKZMLVMLPG-QNGOZBTKSA-N 443.503 4.361 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)C1 1127165742 OEFSHXWOMNLPFQ-HXUWFJFHSA-N 447.579 4.046 10 10 IICE CCc1nc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nn1-c1ccccc1F 1131782053 TZWCCDBKMGNAGO-UHFFFAOYSA-N 431.515 4.349 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C[C@H]2CSCCN2C(=O)OC(C)(C)C)cc1 1135946175 IMTQXEKOPWVCGT-FQEVSTJZSA-N 435.634 4.234 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(C)n1-c1ccccc1Br 1150029406 FCFOLUCHLQIWSV-FXAWDEMLSA-N 430.390 4.413 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)c1ccc(C)s1 1156288011 VIPSQURZJMPMOG-UHFFFAOYSA-N 430.570 4.408 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CC[C@@H](C)N(C(=O)OC(C)(C)C)C1 1230200617 LEDAJVFHIXDDGX-NSHGMRRFSA-N 432.609 4.079 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1CN(c2ccc(C(F)(F)F)cc2)C1 1230201816 USQGVZLMNOYHAA-MRXNPFEDSA-N 434.506 4.199 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(CC(F)(F)F)[C@H](C)C3)cc2Cl)C1 1235836280 ZIMHQERJWKORJM-JKSUJKDBSA-N 446.945 4.354 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H](c2ccc(F)c(F)c2)c2nccn2C)cc1 1251504721 JAWVCQBKIXKAOV-JOCHJYFZSA-N 441.526 4.476 10 10 IICE Cc1cnn(CC2CCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)c(F)c3)CC2)c1 1290270990 DFPBAXCCOQENFK-UHFFFAOYSA-N 439.583 4.076 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1 1290373744 DJCWRQDWNGNXBO-XIEYBQDHSA-N 440.547 4.111 10 10 IICE CCN(CC)CC[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 1313416036 PYRBQSRGYFOUHX-RUZDIDTESA-N 438.616 4.138 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc(C)c1OC(F)F 1356420697 IYGQAUFPGOEITA-UHFFFAOYSA-N 443.538 4.367 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC([C@H]2CCOC2)CC1 1361097703 GPFQRBTUVYZUBT-QFIPXVFZSA-N 425.621 4.152 10 10 IICE Cc1nn(-c2ccccn2)c(C)c1CC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1435073412 DZOLEJQMFBJKAD-UHFFFAOYSA-N 445.489 4.084 10 10 IICE Cc1cc(C(=O)NC[C@H](C2CCCCC2)N(C)C)c(C)n1-c1ccc(Br)cn1 1440998595 IHYGXJFJDITAGT-HXUWFJFHSA-N 447.421 4.492 10 10 IICE COC(=O)c1cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)oc1C 1441257257 VKSOVYGLJAGNDH-UHFFFAOYSA-N 445.313 4.475 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4c(OC(F)(F)F)cccc4[nH]3)C2)cc1 1452028792 NGMPBXZHPOWMIP-AWEZNQCLSA-N 433.430 4.331 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4C)c3C(C)C)CC2)c(OC)c1 1461975166 CFHZFQXFYMGYFL-UHFFFAOYSA-N 448.567 4.284 10 10 IICE CCNC(=O)N1CCc2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc21 1465354141 YQLZHRXTJUPIMV-UHFFFAOYSA-N 444.535 4.180 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1467320733 AHJXQJWJSQFWFN-RUZDIDTESA-N 446.547 4.082 10 10 IICE CCO/C=C/[C@](O)(CNC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468483592 RBEWMADPKBJXBC-XTXLJPNXSA-N 444.881 4.250 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC(C)(C)c3ccc(OC(F)(F)F)cc3)C2)cc1 1478958033 VPMMHUQKFIHICH-MRXNPFEDSA-N 437.462 4.407 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CCCS3)CC2)cc1 1518308780 LJLLYNUAVADCLF-OAQYLSRUSA-N 429.634 4.098 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1nc(C)cc1C 1519454655 LBFRSNPXGKXIOM-UHFFFAOYSA-N 433.560 4.254 10 10 IICE CNC(=O)c1ccc(Cl)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1527582434 OOJRWEBNBUMOIA-UHFFFAOYSA-N 438.959 4.060 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(C(=O)c4cccc(OC)c4)cc3)C2)cc1 1529708035 OKILRLOVTXSLPX-LJQANCHMSA-N 444.531 4.191 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)COc2ccccc2Cc2ccccc2)N(C)C)cc1 1537477725 INPDNOPJPLIEPP-VWLOTQADSA-N 431.580 4.141 10 10 IICE CC(C)Oc1cc(Br)ccc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1537478157 WNPIVGSWFQBJOQ-FQEVSTJZSA-N 448.405 4.335 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cnnn2-c2ccccc2Br)cc1 1540538079 XQZPHOJPISHHTB-UHFFFAOYSA-N 442.361 4.148 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H]2CCOC2)c(C)n1-c1cccc(Br)c1 1558606338 RYTCOHJYUMZTPV-PXNSSMCTSA-N 447.373 4.124 10 10 IICE COC(=O)c1ccc2c(O)nc(CN(CCc3ccccc3)c3ccc(OC)cc3)nc2c1 1559624161 YPOLADJNRMDVSF-UHFFFAOYSA-N 443.503 4.380 10 10 IICE Cc1ccc(C(=O)NCC[C@H]2CCc3ccccc3N2C(=O)OC(C)(C)C)c(O)c1O 1583686985 SGOBPQJXBPQYJP-QGZVFWFLSA-N 426.513 4.283 10 10 IICE CC[C@](C)(C(=O)OC)N(CC1CC1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1585580394 WPUYAKUHVGBHMD-RUZDIDTESA-N 426.557 4.109 10 10 IICE CCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(Cl)cc1 1586061669 UAPLJMJAVXXUGQ-HSZRJFAPSA-N 439.991 4.187 10 10 IICE CC1(C)C[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)CCN(C(=O)OC(C)(C)C)C1 1586864291 YEJNVLHJLOBHSA-AWEZNQCLSA-N 434.558 4.468 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H](NC(=O)OCc4ccccc4)C3)cc2)CC1 1616695912 ZTLAYMPNLATEIE-ZRZAMGCNSA-N 435.568 4.244 10 10 IICE CN(C)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)C[C@H]2CC=CCC2)cc1F 1617667613 QEQMAJVASGIDJP-IBGZPJMESA-N 434.563 4.310 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3ccccn3)C2)c(C)n1-c1ccc(Br)cn1 1617846689 PPHPTHSWWZDQAP-INIZCTEOSA-N 425.330 4.276 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)CC[C@@H]1C1CC1 1629137152 XJOHWARXFLGDKX-CVEARBPZSA-N 429.344 4.493 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC([C@@H](O)c3ccnn3C)CC2)c1 1630178233 PCYYMPHRAVJVCA-JOCHJYFZSA-N 426.948 4.067 10 10 IICE O=C(c1cc(Br)cn2ccnc12)N(Cc1ccco1)Cc1ccccc1O 1631143577 UYLQBUQYBFSGGH-UHFFFAOYSA-N 426.270 4.238 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@H]2Cc3ccc(Cl)cc32)NC(=O)OC(C)(C)C)cc1 1634161856 DXBQGUIRKISXAK-LEWJYISDSA-N 443.975 4.428 10 10 IICE O=C(C[C@@H](c1ccccc1)c1ncc[nH]1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941626 UUADHMNNDBEVMR-RTWAWAEBSA-N 438.959 4.072 10 10 IICE CCOC(=O)c1nc(NC2CCN(c3ccc(OC)cc3)CC2)ccc1Br 1639399505 HZCSWQHYOTUOCB-UHFFFAOYSA-N 434.334 4.110 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3ccc(F)cc3F)CC[C@@H]2C)c([N+](=O)[O-])c1 1640452693 GNWZOFINAFLWFC-LWUPOJRFSA-N 431.439 4.164 10 10 IICE CNC(=O)CC1(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CCCCC1 1642061092 OLHOPXWTPDEIID-UHFFFAOYSA-N 429.992 4.493 10 10 IICE COC(=O)[C@@H](Cc1cncs1)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1644894346 OSCKTHVXHUQYSS-OAQYLSRUSA-N 425.554 4.188 10 10 IICE COC(=O)[C@@H](Cc1cncs1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1651392420 WVJPIXDVZSTJBS-OAQYLSRUSA-N 425.554 4.188 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccccc1 1652609244 DFEMIOIJJAREOM-DEOSSOPVSA-N 435.911 4.397 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](NC(C)C)c1ccc(OC)cc1 1654370002 RJAFFXXALSFHGF-HXUWFJFHSA-N 435.362 4.251 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1CNC(=O)NCc1cc(Cl)ccc1O 1672608271 IRKLTBGWOBTMNS-IBGZPJMESA-N 445.947 4.379 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC3(OC)CCCC3)CC2)cc1 1697470403 FUNXCQPFRBSKQO-UHFFFAOYSA-N 441.620 4.161 10 10 IICE COCCC1(Cn2c(C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCCCC1 1697939679 RIUOYQNPEOTIDQ-UHFFFAOYSA-N 441.620 4.047 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCOC 1708339074 FNMDNPHNGHKYSF-AVRWGWEMSA-N 439.604 4.232 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C1CC1 1708574437 LFQMJBGXZYJAMA-SFHVURJKSA-N 448.615 4.361 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCC2(C)C)CCOC1 1723665660 DMDFSSQIZQEBRG-NBGIEHNGSA-N 442.604 4.487 10 10 IICE C[C@H]1CN(c2nnc(-c3ccc(Cl)cc3)n2CCCSc2nccs2)CCO1 1726668596 SMPVSJLOIOBGGC-AWEZNQCLSA-N 436.006 4.463 10 10 IICE CSC[C@H]1CCCN1c1nnc(-c2ccccn2)n1CCCSc1nccs1 1731092716 SRQABAMLQWLFCG-OAHLLOKOSA-N 432.644 4.311 10 10 IICE CC[C@H](C)NC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1 1743884562 GMDNMHMTPNANQI-SFHVURJKSA-N 434.588 4.258 10 10 IICE Cc1ccc(NC(=O)CN(C)c2nnc(C3CC3)n2CCCSc2nccs2)cc1 1751548223 USEZLEKJVZRLMA-UHFFFAOYSA-N 442.614 4.178 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC[C@@H](C)C1 1752066504 WFCYNWUDOMOJHI-CTNGQTDRSA-N 438.620 4.089 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1767995829 WPXQOBCJIGZBHU-PZJWPPBQSA-N 425.621 4.475 10 10 IICE O=C(N[C@@]1(c2ccc(OCc3ccccc3)cc2O)C[C@H]1C(=O)O)OCc1ccccc1 1952841123 PRXJYIWOTKZQNI-SQJMNOBHSA-N 433.460 4.197 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNCc1ccc(Br)cc1O)CC(F)(F)F 2053661519 GCKVTHJMVHGNBS-GFCCVEGCSA-N 427.261 4.090 10 10 IICE Cc1ccc([C@@H](C2CCC2)n2nc(C(F)F)c(N)c2I)c(O)c1 2079052059 PXTDHTIBCVPWOO-CQSZACIVSA-N 433.240 4.411 10 10 IICE COc1ccccc1CNC(C)=C1C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 2313682955 OKNUBXCIONKMHP-UHFFFAOYSA-N 442.475 4.418 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S)Nc1ccccc1C(F)(F)F 15035628 RFXMOEONMGHHLF-DHDCSXOGSA-N 438.452 4.251 10 10 IICE CN(C)c1ccc([N+](=O)[O-])cc1/C=C1\C(=O)N(c2cccc3ccccc23)C(=S)N=C1O 17085665 HRJGAXPBRVHOCV-AQTBWJFISA-N 446.488 4.486 10 10 IICE O=C1OC(c2ccccc2)OC(=O)C1=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)cc1 27531211 HDHVNZXWOCKKIK-UHFFFAOYSA-N 431.400 4.356 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 35270659 BKRRYNQFMLLPRD-UOEQGAKJSA-N 439.518 4.381 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)cn1 107683843 PNTRYTVTKMOBQR-UHFFFAOYSA-N 434.540 4.037 10 10 IICE COc1ccccc1[C@@H]1CCN(C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)C1 435863723 XRXKNEYDISQALZ-HXUWFJFHSA-N 431.580 4.433 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(OC)c(OC)c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526216166 HDGOVWIVJJXULH-QHCPKHFHSA-N 449.459 4.181 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCOC[C@H]3Cc3c[nH]c4ccccc34)ccc21 669516397 KKEQOWMYKWHGAK-JOCHJYFZSA-N 445.563 4.470 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cccc4c3OCCO4)n2)c1C 727248434 PUMWPHZTFUMIAZ-UHFFFAOYSA-N 433.555 4.210 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2c(O)nc3ccccc32)cc1 732114936 QAJYKWAQZQHSPR-UHFFFAOYSA-N 430.508 4.050 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2c(C)cc(C)cc2C)cs1 748673457 JJCCHBSPWMMPFE-UHFFFAOYSA-N 433.511 4.453 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)Nc1ccc([S@](=O)C(F)(F)F)cc1 750620319 CBNYDFLBIXCIML-LJAQVGFWSA-N 443.516 4.189 10 10 IICE C[C@H](NCc1ccc(CO)c(F)c1)c1cc(Br)cc(Br)c1O 756461314 XTKJSHWCHALVFK-VIFPVBQESA-N 433.115 4.399 10 10 IICE COc1ccc(N2CCC(N[C@@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(F)c3)CC2)cc1 773102055 FFVFCRSWMKOCCG-FYYLOGMGSA-N 431.939 4.018 10 10 IICE COc1cc(OC)cc([C@@H](NCc2cc(C)cc(Br)c2O)c2nccn2C)c1 781626757 MPZNJSCKIYHBBY-LJQANCHMSA-N 446.345 4.093 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccc(C(F)(F)F)nc3)sc2C)cc1 782260226 ABAUNZGLELNEPR-UHFFFAOYSA-N 429.445 4.342 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)c(O)c1 794379874 UJGSULVGOPHTLO-JHVJFLLYSA-N 442.943 4.144 10 10 IICE Cc1c(NCc2ccc(OCc3ccccc3)cc2O)cccc1N1C(=O)N[C@@H](C)C1=O 809787130 ULVBHAWEQLEICL-KRWDZBQOSA-N 431.492 4.336 10 10 IICE Cc1c(Br)ccc(N2C(=O)NC(=O)/C(=C\c3c[nH]c4ccccc34)C2=O)c1C 1083902697 PPRMUDANVKPMIB-OQLLNIDSSA-N 438.281 4.214 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(OCc2ccccc2F)cc1 1083907011 KJRLUHGLKACGAB-MOSHPQCFSA-N 434.398 4.210 10 10 IICE Cc1nc(Br)sc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1125949063 XHUYHADGEDCYNF-UHFFFAOYSA-N 446.317 4.214 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCc2nc(C(F)(F)F)cs2)CCCC1 1126493084 KQRLXTZFQFNSAF-UHFFFAOYSA-N 437.487 4.363 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCCc2cccnc21 1134460494 BGEBXMFXBTYBPB-GFWHJHDHSA-N 441.553 4.006 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C[C@@H]2C(=O)Nc3c(Br)cccc32)cc1 1135735433 ODPNKASAAKBYII-SFHVURJKSA-N 444.373 4.380 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1 1135800445 GMPSZHTULCYCQI-HKOYGPOVSA-N 429.520 4.309 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cc2ccccc2I)cc1F 1136729904 ULTCNUWBYQUSIS-UHFFFAOYSA-N 440.300 4.135 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1141737749 HAMGAKNFYDWFAC-MRXNPFEDSA-N 441.311 4.443 10 10 IICE COc1ccc(N2CCN(C[C@@H]3Cc4ccccc4O[C@H]3C(F)(F)F)CC2)c(OC)c1 1197105030 OESQVYOIZIYSGG-HTAPYJJXSA-N 436.474 4.008 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)sc2c1CCCC2 1264290591 OFIZHJKNYFLXRK-LBPRGKRZSA-N 432.929 4.059 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)CC[C@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1289360014 YPHWAIRGVOCXAE-RTBURBONSA-N 448.615 4.456 10 10 IICE Cc1cc(CC(=O)N2CCC(N(C)C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1293134392 FYHZVEIOCAABAI-UHFFFAOYSA-N 425.573 4.495 10 10 IICE CCOC(=O)Cc1c(C(=O)N(Cc2ccco2)Cc2ccccc2O)[nH]c2ccccc12 1294671906 NKIAFWRYCHFSLV-UHFFFAOYSA-N 432.476 4.415 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1295420896 ZFAWSDUEPPFWCS-AREMUKBSSA-N 448.615 4.164 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1nccs1 1304238174 LLOMTPUXLGEEJF-LJQANCHMSA-N 426.590 4.035 10 10 IICE CC[C@H](C)c1nnc(N2CCC(Nc3cccnn3)CC2)n1Cc1ccc(N(C)C)cc1C 1305452856 AQDVLCCXQBUZDH-SFHVURJKSA-N 448.619 4.085 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)cc1 1307644701 WTGLBGRGJBPIMW-SELNLUPBSA-N 427.564 4.105 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2[C@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1361045279 SCWMNKVQTNCVJG-KKSFZXQISA-N 434.588 4.284 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1c(C)noc1C 1361097860 JOVIVNPDHWIFKD-JOCHJYFZSA-N 438.576 4.184 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(Cn2ccc(C(F)(F)F)n2)cc1 1441187694 PPHJCIOJHNMPNY-UHFFFAOYSA-N 428.458 4.480 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1 1442187475 VSTGNBDBELZEGS-UHFFFAOYSA-N 435.568 4.426 10 10 IICE Cc1nc(SC(F)(F)F)sc1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1442413055 PRCWJLIUJNYTIR-LBPRGKRZSA-N 445.532 4.320 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 1446818601 XBFQQPWNCMTQFL-LBPRGKRZSA-N 429.822 4.370 10 10 IICE Cc1ccc(-n2cc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)c(C(C)(C)C)n2)cc1 1462468866 RSPPTPRLUZHXNC-UHFFFAOYSA-N 445.611 4.160 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 1463751801 KIDCNWCTRAHAAY-DHIUTWEWSA-N 434.609 4.083 10 10 IICE COC(=O)c1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc(Br)c1F 1466860555 LSNJSHXVGLVCFP-UHFFFAOYSA-N 440.246 4.253 10 10 IICE Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1467674307 RTIVCWDPFOJFMF-QHCPKHFHSA-N 429.564 4.467 10 10 IICE C[C@H](CNC(=O)OC(C)(C)C)CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1469492472 VVOYDCQDTGFWJY-SFHVURJKSA-N 444.576 4.218 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)N(C)c2cccc(Cl)c2)c1)c1ccccc1O 1471195057 SWZLRQYPMLCVOY-HNNXBMFYSA-N 444.940 4.362 10 10 IICE CC1CCC2(CC1)OC[C@@H](CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)O2 1478324350 SAUFMVVLITYAQB-UXVFNKRRSA-N 441.572 4.379 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)n1 1492737329 OKTGWBDDLOCUFM-UHFFFAOYSA-N 449.628 4.260 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)sc2c1CCCCC2 1526801699 ZORDROKHZRQGJW-GFCCVEGCSA-N 448.491 4.073 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cccc2nsnc12 1530899109 QJGQOTJYXMICEW-GDNBJRDFSA-N 444.538 4.060 10 10 IICE CCS[C@@H]1CCC[C@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1532501292 FSMYYSHAHHWEEP-ILADNBMGSA-N 438.615 4.207 10 10 IICE CC(C)c1nnc(N2C[C@H](C)C[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543541975 BTWVALCSWWWIJP-WOJBJXKFSA-N 425.621 4.141 10 10 IICE C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)cc2[N+](=O)[O-])C1 1544164451 JFGJMQOOLZAWSQ-HDICACEKSA-N 436.556 4.390 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]([C@H]2CCCO2)C1 1545504668 AOHLZJGYWVUVPO-KAGYGMCKSA-N 446.588 4.326 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nn(Cc2ccc(F)cc2)c2c1COCC2 1548338979 WVOMLBCBZRDBPD-UHFFFAOYSA-N 448.542 4.016 10 10 IICE C[C@H](NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(N(C)C)cc1 1564598098 ZJOROIZZSGENDX-CPJSRVTESA-N 444.579 4.041 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCc4c(Br)cc(C)cc4C3)C2)cc1 1565055617 HAGYEILTJOZSQY-KRWDZBQOSA-N 444.373 4.113 10 10 IICE COc1ccc(N2CCN(C(=O)CCCC(=O)c3c(C)cc(C)cc3C)CC2)cc1F 1566346808 MTLFICMTOPPYON-UHFFFAOYSA-N 426.532 4.461 10 10 IICE CN(Cc1ccc(Cl)nc1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1587312478 MZSZRYXYRKMNFL-MHWRWJLKSA-N 449.960 4.124 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1614103449 QOGIHMWQCBIGIJ-PZJWPPBQSA-N 438.620 4.033 10 10 IICE COc1ccc(-c2nnc(N3CC=CCC3)n2CCCSc2nccs2)c(OC)c1 1619183100 FSINQKQNVOXGJK-UHFFFAOYSA-N 443.598 4.368 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](O)c1ccc(Cl)c(Cl)c1 1622635231 UQTSUKNYGHJHRF-BEFAXECRSA-N 443.758 4.167 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Oc3ccccc3)c3ccccc3)CC2)c(OC)c1 1623760161 SATWXNMWOGKNCS-RUZDIDTESA-N 432.520 4.173 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccccn3)CC2)c(C)n1-c1cccc(Br)c1 1623982992 OENNWZNRLHILIP-UHFFFAOYSA-N 439.357 4.214 10 10 IICE CCN1CCN(Cc2ccccc2CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1624459445 JPTNRKAIPBISNP-UHFFFAOYSA-N 444.623 4.091 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc2c(n1)CCCC2 1625502957 MBQALOVDDUAZKP-QGOAFFKASA-N 441.553 4.330 10 10 IICE CN1CCCc2cc(CNC(=O)[C@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)ccc21 1625847718 DEUAEWLCGQWQHB-QHCPKHFHSA-N 432.486 4.353 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCC2(O)CCN(Cc3ccccc3)CC2)c1C 1630055152 NXKGYZXJVPSSEM-UHFFFAOYSA-N 431.580 4.159 10 10 IICE CCO[C@@H]1C[C@@](O)(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1635726153 LZXJZTLDYZCHQW-DENIHFKCSA-N 449.389 4.153 10 10 IICE Cc1cc(S(N)(=O)=O)cc(C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)c1C 1637243533 APJQGBGYFHGAOO-GOSISDBHSA-N 438.549 4.060 10 10 IICE Cc1cc(C(=O)N[C@@H]2CON(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(C(C)C)cc1 1639908290 MLDGAXBVYUATAP-IBGZPJMESA-N 427.545 4.498 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@H](C)C(=O)OC(C)C)sc(C)c1-c1ccccc1 1653774484 IBDCMRTVLBADGE-HNNXBMFYSA-N 446.569 4.111 10 10 IICE Cc1cccc(OCCN(C)[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1657005802 VSUDCGVCUDGCMD-GOSISDBHSA-N 442.515 4.108 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(C3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1694131318 QSFCUHPUXTZCLR-LJQANCHMSA-N 442.627 4.500 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(C)C)C1 1706057601 MFBFFQIIHZIHMF-QFIPXVFZSA-N 448.615 4.361 10 10 IICE Cc1ccc(Cn2c(N(C)Cc3ccccc3O)nnc2[C@@]2(OC(C)C)CCOC2)s1 1724370688 LVUZVDHOQNQJPD-HSZRJFAPSA-N 442.585 4.079 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1743216583 ZZOGSBURTKNJCA-QGZVFWFLSA-N 431.675 4.119 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccc(C)o4)n3C[C@H](C)SC)CC2)cc1F 1768704384 CBRRSVLVALHJPE-INIZCTEOSA-N 445.564 4.072 10 10 IICE CC1(C)C[C@@H](N(Cc2ccccc2)c2cc3c(cc2Br)[C@H](O)C(=O)N3)CO1 1915453953 HTVUGSPBFIAMOR-KUHUBIRLSA-N 431.330 4.009 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C2CCC2)c(I)c1CO 2079952480 JBYGVRXEAATEFF-GOSISDBHSA-N 440.325 4.254 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)c1O 2227750662 KULRGOUGKURWSB-LBPRGKRZSA-N 429.355 4.041 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(Cc3ccccc3)C[C@H]2C(F)F)c1O 2236046173 USRUDHRDLYYBBT-WBVHZDCISA-N 441.316 4.019 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCCC[C@H]2NC(=O)OC(C)(C)C)c1O 2236054302 HBRLNUGTQHDNQQ-HZPDHXFCSA-N 443.382 4.479 10 10 IICE N=C1C(=Cc2cn(Cc3ccc4c(c3)OCO4)c3ccccc23)C(=O)N=C2SC=CN12 2297317074 KUKKGZNWWRVATD-UHFFFAOYSA-N 428.473 4.195 10 10 IICE Cc1cc([N+](=O)[O-])cc2c1N(C)C(=O)C2=C1SC(N(C)c2ccc(Cl)cc2)=NC1=O 2297368299 MXYXHEJXOIDGNF-UHFFFAOYSA-N 442.884 4.010 10 10 IICE CC[C@H](C)N1C(=O)C(=Cc2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 2314413903 LJUHYEZKISXVTC-AWEZNQCLSA-N 442.610 4.439 10 10 IICE CC(=C1SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O)c1ccc(C)c(C)c1 2314539052 JXOCNRFZDQLSEJ-UHFFFAOYSA-N 427.503 4.496 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2ccccc2C)c1C 1101765 INQNZARQXDIEEM-XOWGOQOESA-N 434.536 4.254 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C\c3cc(C)n(-c4ccccc4OC)c3C)C(=N)N12 4761588 JWCNJCQXEJFLMN-AXPJIBDUSA-N 439.566 4.433 10 10 IICE Cc1cc(/C=C2\C(=N)N3N=C(N4CCCCC4)SC3=NC2=O)c(C)n1-c1ccccc1 20356475 IORCZNSHSQHKFO-IJFTXDGJSA-N 432.553 4.157 10 10 IICE O=C1N=C(N2CCN(c3cccc(C(F)(F)F)c3)CC2)S/C1=C\c1ccc(O)cc1 33332580 FAORAXVXIFVYNL-PDGQHHTCSA-N 433.455 4.204 10 10 IICE CCc1ccc(C(=O)NC[C@H](c2ccco2)N2CCN(c3ccc(OC)cc3)CC2)cc1 38605914 MFFKOGKJFGFAOQ-XMMPIXPASA-N 433.552 4.144 10 10 IICE CN1C(=O)/C(=C/c2ccc(OCC(=O)Nc3nc4ccccc4s3)cc2)SC1=S 39793737 KGVNTVUOWBEPMD-YBEGLDIGSA-N 441.559 4.145 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(OC)c1O)N2 226705852 ZDWGRAJKBSZWAF-DYXJYMTDSA-N 428.554 4.304 10 10 IICE CCOC(=O)c1ccccc1N1C(=O)C(O)=C(c2cccs2)[C@@H]1c1ccc(O)c(O)c1 526527234 ONIQJZGQGIXMIT-FQEVSTJZSA-N 437.473 4.393 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N(Cc3ccco3)C3CCCC3)cc2F)CC1 730133786 FTRJRYWTMQKISQ-UHFFFAOYSA-N 428.552 4.215 10 10 IICE Cc1cc(C(=O)[C@@H](C)OC(=O)/C=C/c2cnccn2)c(C)n1-c1ccc(OC(F)F)cc1 735936735 TXMZDGLTTUOHJI-VCIFKONDSA-N 441.434 4.313 10 10 IICE COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746946512 DNPMTRKOGAKPRG-QHCPKHFHSA-N 441.547 4.014 10 10 IICE Cc1cc(C(=O)NCCc2cnc(C3CC3)nc2)c(C)n1-c1cccc(Br)c1 756086555 GAJBFXNBBZJUDU-UHFFFAOYSA-N 439.357 4.497 10 10 IICE C[C@@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1cc(Br)cc(Cl)c1O 756777229 HABZIIATRDVSPH-RYUDHWBXSA-N 436.737 4.257 10 10 IICE CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccc(N3CCOCC3)cc2)[C@H]2CCCC[C@H]21 769231619 BZVOWAQKYACRKZ-ODXUMFNNSA-N 427.633 4.207 10 10 IICE CCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 774887351 LDTVPUANOKOLDU-UHFFFAOYSA-N 443.548 4.022 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2CC(F)F)c(C)n1-c1cccc(Br)c1 804724140 JRZKSRYZEJBJJS-INIZCTEOSA-N 427.289 4.353 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 808371579 VVASJQIUAWZHBE-UHFFFAOYSA-N 431.361 4.073 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccccc2CN2CCCC2)cc1 1135787129 BEQOCMYXNJEWOQ-UHFFFAOYSA-N 429.564 4.361 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2ccc(C(=O)NC3CC3)cc2)c1 1136154549 DQOWKHUKIPOVAF-UHFFFAOYSA-N 429.520 4.071 10 10 IICE Cc1cc(C(=O)NCCOc2ccc(F)cc2)c(C)n1-c1ccc(Br)cn1 1136206789 PYYVFPXMYSYCJQ-UHFFFAOYSA-N 432.293 4.200 10 10 IICE COC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cn1C 1137047414 SIKHWJKSCCECBT-UHFFFAOYSA-N 430.302 4.234 10 10 IICE COc1ccc2c(c1)c(C(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)c(C)n2C 1141901994 VQJXEHJAHXZMTB-HZPDHXFCSA-N 439.531 4.178 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)cc(C)c1Br 1152401395 LXPJEHJJUONCGC-UHFFFAOYSA-N 440.721 4.240 10 10 IICE Cc1cccc([C@H](CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)NC(N)=O)c1 1155727415 RDFPRQSPKSFNOE-UWJYYQICSA-N 442.991 4.301 10 10 IICE Cc1cc(CC(=O)NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c(C)n1-c1ccccc1 1156148913 BSXIKNFFXCZOME-GOSISDBHSA-N 430.470 4.021 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2[C@@H](C)O)sc(C)c1-c1ccccc1 1190865566 XKEIMISQLXNBSU-QAPCUYQASA-N 430.570 4.074 10 10 IICE COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1ccccn1 1258937556 LFEQECJQAZJZRX-UHFFFAOYSA-N 437.304 4.429 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCCOC(C)C)CC2)cc1 1300247572 NCTXDBCUUKNNHY-UHFFFAOYSA-N 429.609 4.116 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc2ccccc2n1CC(F)(F)F 1301348822 AVAUMBQNFLBYAG-UHFFFAOYSA-N 431.458 4.095 10 10 IICE C[C@H]1[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1302197394 IPENGSBOIQQXJH-ZGKBOVNRSA-N 432.542 4.219 10 10 IICE C[C@H]1CCCC[C@@H]1OCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1305005002 PNXQSZFJSFYCRB-CVDCTZTESA-N 435.572 4.201 10 10 IICE O=C(NCc1cccc(COC[C@@H]2CCCO2)c1)NCc1cc(Cl)cc(Cl)c1O 1313049008 TXGZVJLUQVYQNN-SFHVURJKSA-N 439.339 4.394 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C(F)(F)c3c(F)cccc3F)cc2F)C[C@@H](C)O1 1350932244 FAEMVAIQLOSNEA-CHWSQXEVSA-N 428.401 4.126 10 10 IICE CCOC(=O)c1c(NC(=O)COC2CCN(C)CC2)sc(C)c1-c1ccc(C)cc1 1352235184 DFXYYMVBSQDHMS-UHFFFAOYSA-N 430.570 4.258 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(F)cc3ccncc23)c1 1456145044 LNYOCRADPWZYAM-UHFFFAOYSA-N 428.467 4.118 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cccc(C2CC2)n1 1460288903 XUBIUFNMZYOOSX-ATVHPVEESA-N 427.526 4.328 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(COc4ccccc4OC)o3)C2)cc1 1461080785 ZHWWRNVBVGRYBQ-SFHVURJKSA-N 436.508 4.132 10 10 IICE Cc1ccc(C(=O)N(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1465444463 CQKYMYHTAWZQQI-NRFANRHFSA-N 439.556 4.296 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](c3ccccc3)C3(CO)CCCC3)C2)cc1 1478859239 DBLDNNHNCWFOPW-RDPSFJRHSA-N 437.584 4.115 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)[C@H](C)C2)n1Cc1ccc(N(CC)CC)cc1 1496764710 WSGVNCUYXZPTFI-RTBURBONSA-N 440.636 4.183 10 10 IICE CCN1C[C@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1502250043 SXKWYGCOLKUCSD-IRXDYDNUSA-N 440.567 4.019 10 10 IICE CN(C)c1ccc(Cn2c(C3CCC3)nnc2N(C)Cc2cc(Cl)ccn2)cc1F 1503393156 KRPCXQRQAICOBN-UHFFFAOYSA-N 428.943 4.484 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C(F)(F)c3ccc(Cl)cc3)cc2F)CC1 1530366972 IUYKJYPMZWCJTC-UHFFFAOYSA-N 425.882 4.029 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C\c3ccc4cc(OC)ccc4c3)cc2F)CC1 1530377440 TTZPCTPALRCRCO-WDZFZDKYSA-N 447.554 4.459 10 10 IICE C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1531196623 QNQOPAGPHIMWAW-WBZJUKLNSA-N 446.491 4.216 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(c2cccc(Br)c2)CC(=O)C1 1539467414 ATISPVQZYDYSMY-UHFFFAOYSA-N 441.369 4.309 10 10 IICE CC(C)NC(=O)NC1(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CCCCC1 1542411978 HLZSSJKHIRGWHJ-UHFFFAOYSA-N 428.621 4.482 10 10 IICE CCCCCCNC(=O)[C@H]1CCCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)C1 1542476855 QXMYAGINQZWLKQ-NRFANRHFSA-N 437.584 4.455 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CC(C)(C)CN2CCCC2)n1 1542564274 YIHYBGJLPAVPJR-UHFFFAOYSA-N 434.588 4.113 10 10 IICE Cc1cc(C(=O)N2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)c(C)n1-c1ccc(Cl)cc1 1546245866 JGXWXOSDXSZURO-OALUTQOASA-N 443.035 4.378 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)C[C@H](C)NC(=O)OC(C)(C)C)ccc21 1557181538 KFGVLSIQBPEENT-CVEARBPZSA-N 431.577 4.326 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CSCc3c(F)cccc3F)cc2F)C[C@@H](C)O1 1559420806 HLPTUGOLEXQPCV-HUUCEWRRSA-N 438.515 4.267 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1565986151 SDFAWNQZJQJFTH-XNMGPUDCSA-N 449.639 4.060 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)Cc2cc(F)c(F)c(F)c2)C1 1583508433 OXHOLLKLGFJGTK-UHFFFAOYSA-N 429.486 4.484 10 10 IICE COc1ccc(NS(=O)(=O)c2cc(C(=O)N[C@H](C)c3ccccc3O)ccc2C)cc1 1587445075 UCNVOTOFSMAROO-MRXNPFEDSA-N 440.521 4.001 10 10 IICE CN(C)c1ccc2c(c1)OCCN2CC(=O)NCc1ccc(-c2ccc(Cl)cc2)o1 1616891806 INOJLLTYLDKGHW-UHFFFAOYSA-N 425.916 4.181 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CN(C)c1ccc(C(F)(F)F)cc1C=O 1623549716 JGFAJYKBDFINIC-UHFFFAOYSA-N 433.474 4.213 10 10 IICE CN1CCCc2cc(CNC(=O)CCC(=O)NC(c3ccccc3)c3ccccc3)ccc21 1626940505 JSBJIFLREBASGP-UHFFFAOYSA-N 441.575 4.371 10 10 IICE Cn1c(C(=O)N(Cc2ccco2)Cc2ccccc2O)cc2cc(Br)cnc21 1629943522 DNKPEZVOLMOYMY-UHFFFAOYSA-N 440.297 4.477 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCC12CCN(C(=O)OC(C)(C)C)CC2 1633818090 DOBXYLQJEHBNCX-MJGOQNOKSA-N 446.588 4.353 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](F)CN(Cc1ccccc1)Cc1ccccc1 1633818424 HVRWJUHHAJVDLB-WMZHIEFXSA-N 436.527 4.186 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N(CC(=O)OCC)Cc1ccccc1O 1639584983 JHFAWDFJIZXVJT-YPKPFQOOSA-N 448.519 4.334 10 10 IICE CCc1ccc(N(C[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC(C)(C)C)cc1 1643117204 IUHIVWKTPDUHQX-VWLOTQADSA-N 439.644 4.293 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@]3(C)Cc3ccc(Cl)c(F)c3)nc12 1644178811 KKWWCZIXGHSXPF-QFIPXVFZSA-N 446.910 4.001 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@@H](C)c3cccc4ccccc34)CC2)cc1F 1644919517 QHXKJLCGCMWQSJ-RBUKOAKNSA-N 435.543 4.375 10 10 IICE O[C@H](c1ccc(Br)cc1)[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 1653761984 SDLWTFSDMQKGOM-NFBKMPQASA-N 445.401 4.231 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](c4ccn(C)n4)C3)cc2Cl)C1 1680561976 GVWFWBWLMMIVJW-MJGOQNOKSA-N 429.996 4.399 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3ccc(C)c(Br)c3)C2)cc1 1683340831 ZDPPYYWUUAFQNM-QGZVFWFLSA-N 432.362 4.092 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@H]21 1684693126 TXDBTWBERJSORG-PWRODBHTSA-N 428.374 4.385 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(C)C)cc1C 1694049699 RLADTLAAKVFRDI-QUCCMNQESA-N 435.620 4.017 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@H]1CCCO[C@@H]1C(C)(C)C 1711095223 FKGNUNGEHHRSNL-YKSBVNFPSA-N 449.599 4.447 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@H]1CCO[C@H](C)C1 1742940764 GVULNBWHYYLLDW-RTWAWAEBSA-N 441.620 4.080 10 10 IICE C[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1743084244 RXTVBPSMDFIZEQ-SFHVURJKSA-N 429.584 4.127 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CC(C)(C)SC)CC2)cc1F 1768704532 IKGLXTYLDXEFHS-UHFFFAOYSA-N 449.640 4.483 10 10 IICE CSC(C)(C)Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1771375063 DTUGNZCIFLZGOX-UHFFFAOYSA-N 437.617 4.113 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)C(=O)NC 1772872718 NSUQAJBDFRCLRK-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(Br)c2)N2CCCCC2)cc1 1858074662 PZAVBWOWAPAAND-OAQYLSRUSA-N 430.390 4.472 10 10 IICE O=C(N[C@@H]1CC12CC(NCc1c(O)cccc1Br)C2)OCc1ccccc1 2026141770 GQKSXFSDZITYCD-QOSBUDKSSA-N 431.330 4.092 10 10 IICE Cc1ccc([C@@H](n2nc(C3CC3)c(CN)c2I)C(C)(C)C)c(O)c1 2079002870 PYLOOIRUHVWHLA-QGZVFWFLSA-N 439.341 4.473 10 10 IICE Cc1cc(O)c([C@H](C(C)C)n2nc(C3CC3)c(CO)c2I)cc1C 2079982545 XCXMTAWVZYOFQW-SFHVURJKSA-N 440.325 4.425 10 10 IICE COc1ccc([C@@H](n2nc(C(C)C)c(N)c2I)C2(C)CC2)c(O)c1 2080006591 LMSGGXZEMMCZBV-MRXNPFEDSA-N 441.313 4.297 10 10 IICE CC[C@@H](NC[C@@H](F)C1CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2112915574 HQWLCYXKJTYFBW-HZPDHXFCSA-N 431.346 4.400 10 10 IICE CC(C)(C)OC(=O)NCCCn1cc(NCc2cc(Br)cc(F)c2O)cn1 2237655607 LMPRCZPTZDDIEJ-UHFFFAOYSA-N 443.317 4.017 10 10 IICE COc1cc(C=C2SC(=S)N([C@H](C)C(=O)O)C2=O)ccc1OCc1ccccc1C 2293308647 OZVYHFIZDXLQOA-CQSZACIVSA-N 443.546 4.257 10 10 IICE CC(C)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323813073 VJUHHEFIENWXPU-GFCCVEGCSA-N 432.336 4.289 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380747394 TWOOHGXVPYQCSD-HNNXBMFYSA-N 441.366 4.117 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccccc3SC[C@@H]3CCCO3)CC2)cc1 108428591 UUVKONUEEPKTIQ-NRFANRHFSA-N 426.582 4.319 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1F 726250465 WZABSCQLOZFBJY-QUCCMNQESA-N 448.583 4.213 10 10 IICE CN1CCC[C@H](CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@H]1c1cccs1 745847026 IDJSLBYKRNPDLU-RFWXGWTQSA-N 443.613 4.227 10 10 IICE CCN(Cc1ccccc1)c1ccc(CNCc2cnc(N3CCOCC3)c(F)c2)cc1 764973277 NSGQXEGPLYQGIO-UHFFFAOYSA-N 434.559 4.374 10 10 IICE COc1ccc(C(=O)NCC(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 767971259 ZBLUWVRZZRJPFL-UHFFFAOYSA-N 446.463 4.022 10 10 IICE Cc1cc(CCNC(=O)NCc2ccc(N3CCOC3=O)cc2)c(C)n1-c1ccccc1 783016501 ZQEULTOQDVHQMH-UHFFFAOYSA-N 432.524 4.093 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2cc(C3(C)CCCC3)on2)c(C)n1-c1ccccc1 789356399 ILNXTEGQVIVLKL-UHFFFAOYSA-N 434.540 4.211 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cc(Br)ccc1O)c1ccccc1 804732820 CLGAVAYPQINTLH-QGZVFWFLSA-N 435.318 4.037 10 10 IICE Cc1cc(CCNC(=O)N2CCC(c3nnc4ccccn34)CC2)c(C)n1-c1ccccc1 916221256 VHLVVDGWGLSWEW-UHFFFAOYSA-N 442.567 4.269 10 10 IICE O=C1/C(=C/c2cc([N+](=O)[O-])cc(Br)c2O)SC(=S)N1c1ccccc1 1083944143 QWMRAGMRFCZXDY-QPEQYQDCSA-N 437.296 4.469 10 10 IICE CN(CCc1ccccc1C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)OC(C)(C)C 1125534838 OKEYOXQZWCRDDT-UHFFFAOYSA-N 429.536 4.231 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cn(Cc4cccc(F)c4)nn3)cc2Cl)C1 1128488588 FOUXQGZDFJORQD-INIZCTEOSA-N 441.938 4.285 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@H]3C(=O)Nc4c(F)cccc43)cc2Cl)C1 1128490517 UBUWFZDVQZAXCY-WMLDXEAASA-N 429.923 4.458 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)COc3cc(Cl)c(Cl)cc3Cl)C2)cc1 1130827296 YEXQROMXYFVFEA-GFCCVEGCSA-N 429.731 4.429 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CC[C@@H]2[C@@H](C1)C2(F)F 1131084699 APQSKENCMKXGPR-KVKWXUFPSA-N 442.578 4.280 10 10 IICE Cc1cc(CNC(=O)[C@@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c(C)n1-c1ccccc1 1132264648 ZAKDJDQAHRZAOC-TZRRMPRUSA-N 447.579 4.076 10 10 IICE Cc1cccc(N2CCN(CCCNC(=O)c3sccc3-n3c(C)ccc3C)CC2)c1 1135957480 IOFYKTABTQYHDZ-UHFFFAOYSA-N 436.625 4.406 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2cc(Br)cn2C)cc1 1137540879 XYSDWQKQSWCBHJ-UHFFFAOYSA-N 442.357 4.209 10 10 IICE CCc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)CCN2C(=O)c2ccc(C)c(O)c2O)cc1 1138979928 KVFHPYZZNKJSKI-FQEVSTJZSA-N 440.540 4.403 10 10 IICE CCOC(=O)c1cnn(-c2cccc(NC(=O)c3cc4cc(O)c(O)cc4s3)c2)c1C 1141412117 ZWGFVEJMTYIBBT-UHFFFAOYSA-N 437.477 4.236 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCc2ccc(N3CCCC3)cc2)cs1 1141538011 GISTUYSRYXKABO-OAHLLOKOSA-N 430.574 4.259 10 10 IICE Cc1cc(C)c(NC(=O)CNC(=O)CN(C)c2ccc(OCc3ccccc3)cc2)c(C)c1 1169342376 LLZBFVDOKGSPIS-UHFFFAOYSA-N 445.563 4.382 10 10 IICE COc1ccc(F)cc1CCNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1248697836 VTQZRNOXAIDCIQ-UHFFFAOYSA-N 425.504 4.448 10 10 IICE COc1ccc(C)cc1CN1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CC1 1290268075 VOXAGMIYJOHHNC-UHFFFAOYSA-N 445.563 4.182 10 10 IICE COc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)N2CCOCC2)cc1 1290393508 YGSBSRGGDRRRBM-AREMUKBSSA-N 447.579 4.214 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1 1298012279 UWFTVFLMEVNEOZ-ROUUACIJSA-N 429.520 4.003 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)cc1 1312592664 QUWSYKYDTCGAAG-VQTJNVASSA-N 432.362 4.091 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCN(C(=O)c4ccccc4)CC3)c2C)c1 1313132737 PCPYRWIHBJCXDD-UHFFFAOYSA-N 444.579 4.460 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CSc2ccccc21 1360898202 WMFORTDBMABYEU-YCPFAOKUSA-N 444.578 4.380 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C3CCCCCC3)CC2)cc1 1435578471 SAJPCJPGYNWAHZ-QFIPXVFZSA-N 445.604 4.208 10 10 IICE O=C(Nc1cccc(N2CCCCC2)c1)c1cccc(NS(=O)(=O)C(F)(F)F)c1 1442256130 XQMKVTLLVZZXNH-UHFFFAOYSA-N 427.448 4.191 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H](CCO)CC2)sc(C)c1-c1ccccc1 1460259243 SYGCKBXCIHTIBF-GOSISDBHSA-N 444.597 4.323 10 10 IICE Cc1cc2c(c(Cl)n1)C(=O)N(CC(=O)c1cc(C)n(-c3cccc(F)c3)c1C)C2=O 1473030269 UWCPTNDZOTXPQO-UHFFFAOYSA-N 425.847 4.069 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ncc(C(F)(F)F)cc3Cl)cc2F)C[C@H](C)O1 1516809647 CJUMRGFQWLQZGU-RYUDHWBXSA-N 445.844 4.437 10 10 IICE CN1CCCc2cc(Cn3c(N4CCO[C@H](C(C)(C)C)C4)nnc3C(C)(C)C)ccc21 1517413437 YPXFZMVGMSGWGC-NRFANRHFSA-N 425.621 4.258 10 10 IICE Cc1ccccc1O[C@@H](C)C(=O)N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 1521579289 MAVUVTKQVLIHCL-QFIPXVFZSA-N 445.563 4.154 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCCCc3ccc(Cl)cc3)cc2)CC1 1537838729 FDUGXCQRBAHOSU-UHFFFAOYSA-N 427.976 4.071 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3ccc(C)cc3)c3c2CCCC3)cc1 1538160686 PVJRFMOKMLRBHH-UHFFFAOYSA-N 432.568 4.277 10 10 IICE CC(C)(C)OC(=O)[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)C 1539581913 MCMHMNYCPJATKM-YJBOKZPZSA-N 440.531 4.377 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(F)F 1555264399 HCJDWGDNCZQHOE-KRWDZBQOSA-N 435.494 4.429 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccccn1 1556308454 WDEXCYLHWXTPEK-QHCPKHFHSA-N 425.916 4.351 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCC[C@@H]1C(=O)N1c2ccccc2C[C@H]1C 1556515675 HXFMSPDENKCKIO-RLLQIKCJSA-N 441.568 4.278 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)c2cccs2)N(C)C)cc1 1558723244 KVGDSIHRRLKZPZ-OAQYLSRUSA-N 436.581 4.099 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCc3nc(Cc4ccccc4)no3)c2C)c1 1565193322 VKSMVPUBWOLWCM-UHFFFAOYSA-N 443.551 4.418 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(OC(F)(F)F)c1 1566356517 HDWDDTZYUKRLQS-MRXNPFEDSA-N 428.838 4.339 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)NCCC(C)C)c(C)n1-c1ccc(Cl)cc1 1585060987 IPBKMLWCBJVGNF-FQEVSTJZSA-N 434.005 4.425 10 10 IICE C[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccc1O 1587445052 SLOIFZSDBKRNLQ-LVLBFHFTSA-N 432.592 4.313 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(C)C 1596687632 ISAPUSXFIHUTIT-UHFFFAOYSA-N 436.604 4.361 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(-c4cccc(F)c4)s3)cc2)CC1 1598010510 ZTYOPZCNVNCQOV-UHFFFAOYSA-N 437.540 4.186 10 10 IICE Cc1cc(C(=O)N2CCC([C@H](O)c3cc(F)ccc3F)CC2)c(C)n1-c1ccccn1 1626254958 JZIUCJQYYRFGFP-QHCPKHFHSA-N 425.479 4.353 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)c3nccnc3c2)cc1F 1627604124 AEZBUILFZDMCIL-UHFFFAOYSA-N 431.309 4.308 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1cccc(OC)c1 1628948024 KUNSVNBZEVKYQZ-SANMLTNESA-N 448.519 4.124 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccc(N4CCOC4=O)cc3)c2C)c1 1633523061 XRJXRWZMIQTKMI-UHFFFAOYSA-N 432.524 4.359 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccc(C(F)(F)F)cc1 1646164019 ZIDREZPMMXMEOJ-LJQANCHMSA-N 431.414 4.152 10 10 IICE Cc1ccc(C)c(OC2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CC2)c1 1685610405 XKTFQQUCOJOWOC-DEOSSOPVSA-N 438.616 4.225 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1686826456 IRFJBBQYGIJSOY-WIYYLYMNSA-N 444.620 4.223 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1C[C@@H](C)OC(C)(C)C1 1707305533 CIBSOBRMWLLQQN-LJQANCHMSA-N 425.621 4.437 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC(C)(C)C3)n2CCCSc2nccs2)n1 1707828459 SLFVBMRMQKFLQY-UHFFFAOYSA-N 445.662 4.405 10 10 IICE Cc1nc(C)n([C@@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)n1 1725882342 UXDYPNWIPPSZBC-QGZVFWFLSA-N 446.650 4.090 10 10 IICE CCOC(=O)N[C@H](CC(C)C)Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O 1728708794 SFSDIOKOWWDDSG-LJQANCHMSA-N 429.565 4.048 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1(C)C 1730922547 QEKUMEYVXPLQDT-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)cc1C 1731107754 NSIJGTDSPDTTBH-AZUAARDMSA-N 431.650 4.173 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc3c(c2)OCO3)n1CCCSc1nccs1 1750609739 FDMSSSPRCFOUKU-UHFFFAOYSA-N 431.587 4.406 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](CC(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1750728135 VGDZBXDEOTWAJZ-NRFANRHFSA-N 443.611 4.373 10 10 IICE CC(C)CCN(C)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1750784828 YRZZCRPDPWIIQE-UHFFFAOYSA-N 440.636 4.183 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)C1 1768000488 VDCUGOYNFMWTPL-MRXNPFEDSA-N 432.619 4.165 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1768311642 XTKKFKMNAOFPKC-WJOKGBTCSA-N 437.613 4.278 10 10 IICE COc1ccc(OC)c(-c2cc(C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)n(C)n2)c1 1890925381 RHCRZNCUXHZGPW-ICSRJNTNSA-N 446.551 4.023 10 10 IICE CN(C)c1ccc([C@@H](O)C2(NC(=O)OC(C)(C)C)CCN(Cc3ccccc3)CC2)cc1 2044718620 KLUPQAVBGIUOFU-HSZRJFAPSA-N 439.600 4.346 10 10 IICE CC[C@@H](NC[C@@]1(N(C)Cc2ccccc2)CCOC1)c1cc(Br)ccc1O 2155164639 CJNTUKFXNWUVIT-IRLDBZIGSA-N 433.390 4.487 10 10 IICE CCN1C(=O)C(=CC=CC=CC=C2Sc3ccccc3N2CC)C(=O)N(CC)C1=S 2297612625 WKJXXHUWIYDRSU-UHFFFAOYSA-N 439.606 4.494 10 10 IICE COc1ccc(OC)c(N2C(=O)C(=Cc3cc(OC)c(OC)c(OC)c3)SC2=S)c1 2313610393 XLTWIRINFHUPHK-UHFFFAOYSA-N 447.534 4.135 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)cc1OC)C(=O)O 2314931270 DGBVLVPROAWWQG-HNNXBMFYSA-N 447.509 4.482 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3cccc(OCCC(=O)O)c3)SC2=S)c1 2314932745 YFTIGDOYKPPJLN-UHFFFAOYSA-N 427.503 4.149 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)ccc1OCCC(=O)O 16919660 HNFJWTPASIAPOU-QGOAFFKASA-N 435.567 4.473 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(C2CCCC2)C1=O 33781124 DPTROKCGMCEWTK-SAPNQHFASA-N 442.610 4.440 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C/c2ccccc2OCCC(=O)O)SC1=S 210437757 QUTHEMIBPCYNEN-AQTBWJFISA-N 429.519 4.345 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1 304087408 WPYOZXGHSNSZSG-RBUKOAKNSA-N 434.458 4.218 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@@]3(C2)OCc2ccccc23)C1 435998102 VELYSUXGHBPWBZ-MHZLTWQESA-N 429.564 4.066 10 10 IICE CC(C)(C)OC(=O)NCC1CCC(NCc2cc(Br)cc(F)c2O)CC1 715746649 SFMGNQURMYTHDY-UHFFFAOYSA-N 431.346 4.467 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](CNCc2cc(Br)ccc2O)C1 717030501 CFGSTKGHRLGIFC-ZDUSSCGKSA-N 435.309 4.137 10 10 IICE Oc1cc2c(cc1CN1CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C1)[C@@H](O)CO2 768461794 DZPDKJNAKQRQGU-KKSFZXQISA-N 427.545 4.094 10 10 IICE COc1ccccc1[C@@H]1CCCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769057451 UNYPYCBWEIHBFZ-VWLOTQADSA-N 448.611 4.274 10 10 IICE C[C@H]1CCCN(Cc2csc(NC(=O)NCc3cc(Br)ccc3O)n2)C1 796639102 JNTFHXGQCMHCCX-LBPRGKRZSA-N 439.379 4.165 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802683894 CHGYUKJTRMOOKU-IFMALSPDSA-N 435.572 4.004 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C4CC4)C3)n2C[C@@H]2CCOC2)c(C)n1-c1ccccc1 802756567 RRPXMKRTZMSNPZ-RDPSFJRHSA-N 447.583 4.004 10 10 IICE O=C1N=C(SCCn2nc3ccccn3c2=O)S/C1=C\c1csc2ccccc12 814771391 REBZHKFYNPDJIN-WJDWOHSUSA-N 438.559 4.114 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 912997437 YDFDLKLJFTXLNQ-UHFFFAOYSA-N 440.487 4.243 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)c2ncc(Br)s2)C1 1130369767 IZABMIWUDWUPRW-UHFFFAOYSA-N 447.402 4.290 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(OC(F)(F)F)c(Cl)c2)N(C)C)cc1 1134686784 WNBSABHGSSYFQN-KRWDZBQOSA-N 429.870 4.337 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Oc3cc([S@@](C)=O)c(C)cc3OC)c2C)cc1 1162504781 QTDWYFJOBGDZMP-SSEXGKCCSA-N 427.522 4.376 10 10 IICE CCOC(=O)c1ncc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)s1 1190934232 LQXCEFUYGZFUAW-UHFFFAOYSA-N 431.558 4.297 10 10 IICE COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1F 1192625990 HTEJFEUNFFFDHZ-CABCVRRESA-N 446.478 4.288 10 10 IICE Cc1c(Br)cccc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1264688863 BMOVFERKMUCFAQ-GJZGRUSLSA-N 449.364 4.369 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccccc2OCCn2ccnc2)cc1 1291927945 FTDBUIRNMKWMBJ-UHFFFAOYSA-N 442.519 4.363 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCN(C(=O)CC3CCCC3)CC2)c1 1293063611 UDLUJDYSMUVHIY-UHFFFAOYSA-N 435.568 4.161 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CC(C)C)c3ccccc3C)CC2)cc1 1293385571 HBROEGRNNJZQCE-AHAAGLQNSA-N 449.595 4.112 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1293653651 PNFZAWWONDJLKY-LEWJYISDSA-N 429.634 4.356 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@H]1Oc1ccccc1 1296810647 BAUSHCKKMIQYSL-ICDZXHCJSA-N 436.552 4.259 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cnccn3)n2CCOC(C)C)c(C)n1-c1ccccc1 1304191471 AIEHWIVYTRZOKS-UHFFFAOYSA-N 445.571 4.204 10 10 IICE Cc1nc(O[C@@H](C)C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1356167234 ZOYYAIKGTBYMPK-ZBFHGGJFSA-N 437.462 4.047 10 10 IICE CN(C)CCOc1ccc(N(C)C(=O)c2cccc3c2CCN3C(=O)OC(C)(C)C)cc1 1443907472 MKRTWJVCXBUSEL-UHFFFAOYSA-N 439.556 4.201 10 10 IICE C/C=C/COc1cccc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1445881582 IZGPDDCRBVOFGQ-ATKOVBFVSA-N 428.960 4.324 10 10 IICE COc1ccc(C(=O)CCC(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1F 1452618978 YGBUAKLOUFPGSX-UHFFFAOYSA-N 440.437 4.454 10 10 IICE CCN(C)Cc1cccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1464462565 MQAIXJZYJWBVRO-UHFFFAOYSA-N 432.612 4.176 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1ccncc1 1495638917 IGPCZKRQDLIUNH-FQEVSTJZSA-N 434.588 4.155 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CCC[C@H](C)C2)cc1 1501830550 NOFKQDYJEKNAGK-IBGZPJMESA-N 447.587 4.056 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2CCC(C)(F)F)c(C)n1-c1ccccc1 1510605858 ZHWFOCPYJSJTNO-OAHLLOKOSA-N 444.530 4.098 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1514178830 ZBLFXCLFSCRSRQ-IFMALSPDSA-N 443.661 4.398 10 10 IICE O=C(COc1ccc2c(c1)CCCC2)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1516257194 UCRCRHIBTNJXSO-UHFFFAOYSA-N 448.485 4.116 10 10 IICE C[C@H](C(=O)Nc1c(Cl)ccc2nonc12)c1ccc(I)cc1 1525322185 JXDMRMXHASHKAN-QMMMGPOBSA-N 427.629 4.223 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 1536550260 OIOYLAQETOIXKW-CQSZACIVSA-N 432.446 4.491 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2CC(C)C)c(C)n1-c1ccccc1 1542182532 LZGXTVPUBATDIO-UHFFFAOYSA-N 436.604 4.217 10 10 IICE Cc1cc(C(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)c(C)n1-c1ccc(F)cc1 1542247060 CZUZDGPLZCGXDX-IBGZPJMESA-N 435.543 4.384 10 10 IICE CC[C@@H](C)NC(=O)c1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1542537391 NGCYDDWMKJXTQK-QGZVFWFLSA-N 431.536 4.365 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3cccc(Br)c3O)ccc21 1556480045 APOFXSHXYBMUCW-UHFFFAOYSA-N 431.330 4.303 10 10 IICE CC1(C)[C@@H](c2ccccc2)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1564895643 PNCQWPHGLKBFRE-LJQANCHMSA-N 429.511 4.279 10 10 IICE COc1ccc(CNC(=O)c2nn(-c3ccc(Cl)cc3)c3c2CCCCC3)c(O)c1 1568098174 WCDHEKCCSXGSES-UHFFFAOYSA-N 425.916 4.439 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cnn(C2CCCC2)c1 1598383652 OXWQXZYJESWHQQ-WOJGMQOQSA-N 444.557 4.367 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@@H]1CCC2(CCC2)O1 1611085219 HKQVHLHMXWPUOL-SKQHNDAPSA-N 448.585 4.025 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3cc(F)cc(F)c32)c(C)n1-c1ccc(Br)cn1 1611533836 LUVOLIURPMTDEU-INIZCTEOSA-N 448.267 4.393 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)N(C)C)cc1 1618634920 CIPREAHFJCLNQB-XMMPIXPASA-N 443.551 4.231 10 10 IICE COc1ccccc1-c1nnc(CC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)o1 1625345200 MUQROZOLRAMKFY-UHFFFAOYSA-N 446.507 4.176 10 10 IICE CSc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)ccc1Br 1627463949 HQAAXLYRKKAELX-GOSISDBHSA-N 436.419 4.270 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(C3CCOCC3)nn2C)cc1 1628565548 RGWRDTIELFPUHK-UHFFFAOYSA-N 448.567 4.236 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3cc(O)ccc3O)c3ccccc3n2)cc1OC 1633595073 HBLHZDGQKAQSGU-UHFFFAOYSA-N 430.460 4.260 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(CC(C)C)C[C@H](O)c3ccc(F)cc3)C2)cc1 1636353649 GBEXXNNDVQIQMY-DVECYGJZSA-N 443.563 4.062 10 10 IICE C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1644766399 APTIFLMMVVACLT-QZTJIDSGSA-N 447.982 4.056 10 10 IICE COC(=O)CCC1(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCCCC1 1646486234 DGKCGYGZTDNFQS-UHFFFAOYSA-N 426.557 4.301 10 10 IICE C/C(=C/c1ccccc1)CN(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1654137021 QOQNHBZIPDUKMI-VPHKTSFISA-N 439.575 4.091 10 10 IICE O=C(NCCCCCCc1ccccc1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1673472490 NOGWWKUBZIOTTJ-UHFFFAOYSA-N 431.527 4.404 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCC(F)(F)c1ccc(Br)cc1 1687133282 DIGSGXQOSHNWHR-UHFFFAOYSA-N 426.305 4.449 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)N(C)C)cc1 1687806953 LSIRSPWMXPSJET-UGKGYDQZSA-N 435.572 4.086 10 10 IICE C[C@H](C#N)CN(C)c1nnc(Cc2c(F)cccc2F)n1CCCSc1nccs1 1706078709 ZQNVEHYFWNADCX-CQSZACIVSA-N 448.568 4.382 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnccn2)nnc1N1CCC(Cl)=C(Cl)C1 1707304804 GIJAXNIIZVIJRC-UHFFFAOYSA-N 444.370 4.057 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1712177032 VOTHNEGHJNKTHK-PKOBYXMFSA-N 443.592 4.279 10 10 IICE CC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)NC(C)C)CC1 1742481725 AGZUUKWDNUJXFD-UHFFFAOYSA-N 432.572 4.034 10 10 IICE C[C@H]1CC[C@H](C)N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1742981074 NOPISLQTJDUBCQ-PMACEKPBSA-N 439.648 4.457 10 10 IICE CC[C@H](C)CN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1743858925 VIMFYQLUZPLISI-KRWDZBQOSA-N 441.599 4.266 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)cc1C 1752742037 HUDOQIDPJQJWGK-JXFKEZNVSA-N 437.592 4.290 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)CC(N)=O 1763323033 SPQUBGPDXLKOED-QGZVFWFLSA-N 436.604 4.489 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC(Cl)=C(Cl)C2)cc1F 1766913231 GSYLNIBHOLKSKY-GOSISDBHSA-N 440.350 4.282 10 10 IICE CNC(=O)[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C)CCC1 1769117867 KHMXMGAQKHXUJX-GOSISDBHSA-N 448.615 4.361 10 10 IICE COc1ccccc1-c1nnc(N2CCC[C@@H](OC)C2)n1CCCSc1nccs1 1770406835 UCUSMEVLCTXOCQ-MRXNPFEDSA-N 445.614 4.208 10 10 IICE COC(=O)c1ccc(/C=C2/C(=O)N(Cc3ccccc3)N=C2c2ccc(OC)cc2)cc1 1865675702 WCKGLOMHYXWCFN-XQNSMLJCSA-N 426.472 4.312 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2cc(Br)ccc2O)C1 1952459879 RRXKASSNZPPKMB-WMLDXEAASA-N 434.286 4.329 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)[C@@H](O)c1ccc(N2CCCC2)cc1 1999522243 XHPZGOQCIPCANG-GOTSBHOMSA-N 426.557 4.430 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@@H](F)CNCc2cccc(Br)c2O)CC1 2106960649 ZQKNEIVJQYSQIG-INIZCTEOSA-N 431.346 4.230 10 10 IICE COc1ccc(Br)c(CNCC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1O 2227746759 QBVCJMIZKUDSGU-OAHLLOKOSA-N 431.371 4.192 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C)c(O)c1Br 2380755269 ZRPJSRJSIMYXDP-ZFWWWQNUSA-N 441.366 4.115 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)SC1=S 11290936 AODXBFQMCSQRFJ-SFQUDFHCSA-N 445.518 4.491 10 10 IICE CC[C@@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccc(C)cc3)s2)C1=O 11636322 YJNOBXOVSNXFFV-INIZCTEOSA-N 433.624 4.400 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)ccc1OCCC(=O)O 16911874 UGQFRKTVEUSYRG-LDADJPATSA-N 429.519 4.263 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C\c3ccc(OC(=O)c4ccccc4)cc3)C(=N)N12 20114733 RKSLOIVHMFIKFG-SKQNHENMSA-N 436.518 4.236 10 10 IICE COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 61049527 RFCHASQOOIQOCA-XMMPIXPASA-N 445.519 4.098 10 10 IICE CCN1C(=O)/C(=C/c2c(Oc3ccccc3F)nc3c(C)cccn3c2=O)SC1=S 213188764 IEVDXUZRBLFZPK-WJDWOHSUSA-N 441.509 4.155 10 10 IICE CC[C@@H](NCC[C@H]1CN(Cc2ccccc2)CCO1)c1cc(Br)ccc1O 312364343 YZMXFGVAKPZJJZ-PZJWPPBQSA-N 433.390 4.487 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cnc4c(c3)c(C)nn4C)n2)c1C 727248141 GJEWDWPNTCCZCY-UHFFFAOYSA-N 444.586 4.029 10 10 IICE O=C(CCc1cc2ccccc2nc1O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 767615992 KVPMNJAHTYSSEC-GOSISDBHSA-N 441.478 4.260 10 10 IICE CC(C)(C)OC(=O)N1CCCc2c(C(=O)Nc3cccc(N4CCOCC4)c3)cccc21 778542786 HKHWAINSTNATAP-UHFFFAOYSA-N 437.540 4.463 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 780821681 WEVLZRDALSQIOV-NRFANRHFSA-N 448.596 4.072 10 10 IICE COc1ccc(CNC(=O)c2ccc(COc3ccc4c(C)cc(=O)oc4c3)cc2)c(O)c1 794387944 PMAHDNKSIIMQHL-UHFFFAOYSA-N 445.471 4.325 10 10 IICE COC(=O)c1ccc(Br)cc1CN(Cc1ccccc1O)C[C@H]1CCCO1 801524153 ZPSZXPPGFCYSII-GOSISDBHSA-N 434.330 4.123 10 10 IICE Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NCc1cc(Br)ccc1O 804734373 CFEFJJIRLKZDCM-UHFFFAOYSA-N 425.348 4.439 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1Cc2cc(Cl)ccc2O1 807932207 UEGOFNLZLBLWNV-QFIPXVFZSA-N 430.932 4.032 10 10 IICE Cc1nc(-c2ccc3c(c2)CCN3C(=O)/C=C/c2cc3cnn(C(C)C)c3[nH]c2=O)cs1 1115831072 IKIAURFUBXELJJ-FNORWQNLSA-N 445.548 4.340 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2)cc1 1135946153 HPFADHJRGXNQQU-UHFFFAOYSA-N 437.005 4.397 10 10 IICE CON(C[C@H]1C[C@H]2CC[C@H]1C2)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1141446974 TYSVGHXNPVZWSN-LIFDPNNDSA-N 448.585 4.243 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCCN1Cc1ccc(N2CCOCC2)cc1 1167739306 BTLRPOREBMTPEC-PKTZIBPZSA-N 429.605 4.277 10 10 IICE CC[C@@H](c1cccc(OC)c1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1194109011 ZFBWTGOEPNAHBP-DEOSSOPVSA-N 442.515 4.492 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC2(c3ccc(F)cc3Cl)CC2)N(C)C)cc1 1225548630 HIVHVBTUEIORFG-NRFANRHFSA-N 432.971 4.179 10 10 IICE CN(CCCOc1ccc(Cl)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1251501090 NJUPJRGEKZMOKH-JOCHJYFZSA-N 432.996 4.119 10 10 IICE C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1nc(C(F)(F)F)no1 1251659365 DNVWPDZHHMAUJG-ZDUSSCGKSA-N 437.422 4.220 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCc3cccc(Br)c3)C2)cc1 1252114273 BTQXEDKKXWCNTD-GOSISDBHSA-N 446.389 4.168 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N(C)Cc1scnc1C 1289423178 HGFCWUFEYAMDSO-UHFFFAOYSA-N 435.601 4.108 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1296900445 KLIZKUALYLAXID-HSZRJFAPSA-N 444.535 4.251 10 10 IICE Cc1cccnc1OC1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CC1 1297379011 MBMOVLMYLDQYNM-UHFFFAOYSA-N 431.536 4.223 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC(F)(F)C1 1302575820 RPMKCSGMQHMETF-LJQANCHMSA-N 433.547 4.310 10 10 IICE Cc1cnc([C@@H](C)Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)s1 1304610340 NTIBTMQNPBKRIN-YJBOKZPZSA-N 427.574 4.083 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1(N2CCOCC2)CCCCC1 1305384981 XCZMXYGJSMXWRB-FQEVSTJZSA-N 441.620 4.169 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(-c2ccc(Br)cc2)no1 1360847955 DEZVYBWUMRGWRJ-UHFFFAOYSA-N 428.286 4.209 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCN(c2cccs2)CC1 1361097694 GLIACXGTGLSJRO-UHFFFAOYSA-N 438.645 4.287 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ncccc1C 1459578312 NVHLYKMJGWQMOW-GHRIWEEISA-N 429.542 4.174 10 10 IICE COc1ccc(I)c(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1464555811 FXPLBXRSZYHTDF-UHFFFAOYSA-N 441.246 4.178 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1n[nH]c2nc(C(F)(F)F)ccc12 1472384590 DIRRQZPMVKZKLN-UHFFFAOYSA-N 427.386 4.449 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC([C@@H](O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])c1 1472803276 CJZDOINICPYBCL-DWUINAILSA-N 432.423 4.009 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1502975940 IYRVSYJOTCOFJO-QHCPKHFHSA-N 434.588 4.240 10 10 IICE Cc1onc(-c2cccs2)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1516814565 KEOHJPWCMGOOLG-KBPBESRZSA-N 429.517 4.394 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1 1519586597 OWIGMRYDUKIALK-IRLDBZIGSA-N 429.358 4.084 10 10 IICE Cc1cccc2c1N(C(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)CC2 1543667211 WFBSXLUBWGXXKH-AQTBWJFISA-N 426.538 4.315 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C[C@@H](C(F)(F)F)O1 1544622741 AGGGAWOUJYQOKB-OLZOCXBDSA-N 449.568 4.371 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c(Cl)cccc1Br 1544630530 PGYZFGPMOMXNLN-UHFFFAOYSA-N 441.728 4.133 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(=O)NC)C1 1546779952 ASBIAJDSYQXZJS-DICASGCDSA-N 446.599 4.281 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@H]3CCCCS3)CC2)cc1 1554958763 FYNKCSJHWRKNAJ-NRFANRHFSA-N 429.634 4.413 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCC1CCN(C(=O)OC(C)(C)C)CC1 1556157924 MTTZCGNGYLTKHH-QGZVFWFLSA-N 434.577 4.353 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@H]21 1556481476 ULXKRDAGDZDTBY-FVQBIDKESA-N 437.131 4.119 10 10 IICE C[C@H](NC(=O)N1CCN(c2cccc(Br)c2)CC1)c1ccc(N(C)C)cc1 1564596957 HYZDIXIXSHPFAC-INIZCTEOSA-N 431.378 4.108 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccccc3C)c2C(F)F)cc1 1585450339 UAXUHVUYYPNSKG-UHFFFAOYSA-N 428.483 4.335 10 10 IICE Cc1cccc2c1C[C@H](C(=O)N1CCOc3cc(N(C)C)ccc31)N2C(=O)OC(C)(C)C 1586831950 FNFDDOTWCOXVGZ-OAQYLSRUSA-N 437.540 4.153 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3nc(Cl)c(Cl)c(Cl)c3Cl)cc2)CC1 1598276678 GLPOJJITQRPJRC-UHFFFAOYSA-N 448.181 4.377 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@@H](C)N(CC)C[C@H]3C)nnc2C(C)(C)C)cc1 1615382537 ZTOMEPKFMZSOIM-WOJBJXKFSA-N 426.653 4.389 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)c1 1625223424 QWRPFVYGMKNALA-LJQANCHMSA-N 439.581 4.144 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(N3CCCCC3)nc2)cc1 1625781101 AIZPTVJSQVKEKQ-UHFFFAOYSA-N 430.552 4.151 10 10 IICE CCOC(=O)c1csc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1628157811 OIOPOGBADUSFBF-UHFFFAOYSA-N 449.330 4.137 10 10 IICE Cc1ccc(C2(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)CCC2)cc1 1628462513 NNKUXTNXLNZGRR-UHFFFAOYSA-N 442.562 4.372 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1635801551 LNPFDANXKNPGGA-OAQYLSRUSA-N 442.604 4.218 10 10 IICE CNC(=O)[C@@H](CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C)Cc1ccc(F)cc1C 1638952927 UMFZVDGMYKMURV-OAQYLSRUSA-N 435.543 4.185 10 10 IICE COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCN(c2ccc(OC)cc2OC)CC1 1644225434 LDLFLSGKJZWWQZ-FQEVSTJZSA-N 439.339 4.047 10 10 IICE C[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[C@@H]1c1ccccc1 1644453080 RTQHQJSHCLZDJQ-BJZAYRLRSA-N 439.575 4.139 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cccnc1C1CC1 1647141756 VAUVVILUXXSWOZ-SFQUDFHCSA-N 427.526 4.328 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC1CCN(C(=O)CC(F)(F)F)CC1 1650714798 YIEAFFFUPSSHQW-UHFFFAOYSA-N 435.402 4.181 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1cccc(C(F)(F)F)n1 1673015786 QUSRMFKGOKYNOF-UHFFFAOYSA-N 446.267 4.343 10 10 IICE CCN(C(=O)NCCc1cc(C)n(-c2ccccc2)c1C)[C@H]1CCN(c2ccccc2)C1=O 1684445353 ZHKJSGVHVUOACD-VWLOTQADSA-N 444.579 4.474 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN([C@@H](C)c2ccc(F)cc2F)CC1 1686826598 LITZSCJRHDCQDL-MOPGFXCFSA-N 444.570 4.359 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cc(Cl)cc4c3OCC4)CC2)cc1F 1687705199 WZMGVKIXXFDSEU-AWEZNQCLSA-N 433.911 4.015 10 10 IICE CCOC1CC(O)(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(CC)CC)C1 1696198337 ULRMOOBWSCDYLP-UHFFFAOYSA-N 437.588 4.129 10 10 IICE Cc1cc(-c2nnc(N3CCCC(C)(C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1707275173 XUKCGCZITDHOOM-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CCCCCN(c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1)C(C)C 1745367149 UTKREWFFUKXSQS-UHFFFAOYSA-N 427.572 4.337 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC(C)(C)C1 1745878453 RLSAFWGGBQCYTA-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CO[C@H]1CCN(c2nnc(COc3cccc(C)c3)n2CCCSc2nccs2)C1 1750184747 GBLVLCACDCBFGX-SFHVURJKSA-N 445.614 4.030 10 10 IICE Cc1noc(C2(C)CCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)cc3C)CC2)n1 1751964633 UFYNSRDAZSTAMP-UHFFFAOYSA-N 437.592 4.074 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)[C@H]1C 1752492680 NWTYKIXENSABSQ-HXUWFJFHSA-N 448.615 4.456 10 10 IICE COc1ccc(N2CCN(c3nnc(CC4CC4)n3CCSCC(C)C)CC2)cc1F 1768705129 WOOOFTOUHXWKHW-UHFFFAOYSA-N 447.624 4.094 10 10 IICE CN(CCc1cnccn1)c1nnc(-c2ccccc2)n1CCCSc1nccs1 1768855349 KCKOVIMDHZXMCO-UHFFFAOYSA-N 437.598 4.053 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1 1769198196 OOCRYHOCUCVQDT-GCJKJVERSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](NC(=O)CC3CCCCC3)c3ccccc3)CC2)cc1 1862113472 JHLYNNXMJNYHCD-AREMUKBSSA-N 449.595 4.172 10 10 IICE N=C1C(=Cc2ccc(OCc3ccccc3)cc2)C(=O)N=C2SC(N3CCCCC3)=NN12 2297352811 YZEPOLVZMAUGOD-UHFFFAOYSA-N 445.548 4.328 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc(Cl)c1OC 2313549191 PMCUIKGUGDVZEZ-UHFFFAOYSA-N 436.851 4.177 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C23CCC3)c(O)c1Br 2352684828 TZYIHFRBIRRTGM-LSDHHAIUSA-N 425.367 4.389 10 10 IICE CCOc1cc(/C=C2/C(=O)N(c3ccccc3F)C(=O)N=C2O)cc(Br)c1O 1178099 XGJWAFPDEDAWEU-YRNVUSSQSA-N 449.232 4.199 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3ccc(OC(=O)c4ccc(F)cc4)c(Cl)c3)C(=N)N2O1 20236727 RUGLICUPILMACG-LTQDZZRLSA-N 425.803 4.149 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)sc2c1CCCC2 21450188 IYEJTBUNMAGPOZ-CYBMUJFWSA-N 446.956 4.449 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C/c2cccc(Br)c2)SC1=S 40938884 BMTNZUGSDGJILS-KAMYIIQDSA-N 428.373 4.384 10 10 IICE O=C(O)CCSc1nc2ccc(Cl)cc2c(=O)n1Cc1ccc(N2CCCC2)cc1 73660384 KWKGHVGENAKLMA-UHFFFAOYSA-N 443.956 4.265 10 10 IICE CCOc1cc(/C=C2\C(=N)N3N=C(Cc4ccc(Cl)cc4)SC3=NC2=O)ccc1O 102546557 ZJQMVGPTTUBDLL-DALCUZTNSA-N 440.912 4.306 10 10 IICE COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)/C2=C(\C)NCCc2ccc(O)cc2)cc1 103522240 YZFUTKLBRRKFMK-JJIBRWJFSA-N 445.494 4.397 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc(C(F)(F)F)cnc2O)C1 435564391 CEPHSRDEYHBRJB-UHFFFAOYSA-N 432.446 4.166 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3cccc(OC)c3OC)[C@H]2c2ccc(O)c(O)c2)c1 526145662 VFYJVZXKYCQCMD-JOCHJYFZSA-N 449.459 4.181 10 10 IICE COC[C@]1(CNCc2c(O)cccc2Br)CCCCN1C(=O)OC(C)(C)C 706846656 ORSWFCNGSHHACN-HXUWFJFHSA-N 443.382 4.051 10 10 IICE COC(=O)[C@@H]1CC12CCN([C@@H]1CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C1=O)CC2 733797712 FAEKPIGVMHGBLG-LEWJYISDSA-N 446.507 4.009 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(Br)ncc1F 762764123 BBZNQZCVCJIFNQ-INIZCTEOSA-N 447.396 4.366 10 10 IICE COc1ccc(Cl)cc1NC(=O)CN(C)Cc1cc(Br)cc(C)c1O 775642753 NUIHJBVSLRKBCF-UHFFFAOYSA-N 427.726 4.196 10 10 IICE O=C(CCc1ccc(Br)cc1F)NCc1cc(Br)ccc1O 804737940 WHXUYVSCLQKMOL-UHFFFAOYSA-N 431.099 4.305 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCc2sc(Cl)cc21 813591861 XNMRPHMDTXIYCG-IBGZPJMESA-N 434.005 4.487 10 10 IICE Oc1cc2c(cc1CN1CCN(c3nn4cc(-c5ccc(F)cc5)nc4s3)CC1)CCC2 917617552 KLVMZCYGMQVUIO-UHFFFAOYSA-N 449.555 4.113 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@H](CC(C)C)c3ccc(Cl)cc3)CC2)cc1 1136454390 WDZRIGMIRSWQSK-XMMPIXPASA-N 444.019 4.417 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4c(F)cccc4F)CC3)c2C)c1 1136566604 STFIHRFXYIZODY-UHFFFAOYSA-N 437.490 4.279 10 10 IICE Cc1cc(CC(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)c(C)n1-c1ccccc1 1137135938 OWHINDQRGVNXTD-UHFFFAOYSA-N 443.591 4.234 10 10 IICE Cc1ccccc1[C@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1137766230 BSDKZBUOBCIADC-IBGZPJMESA-N 428.330 4.023 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(I)cc1OC 1142416677 DQCWMENOQWKIHZ-UHFFFAOYSA-N 438.309 4.028 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCOc1ncccc1C(F)(F)F 1151390308 OQKCSIWXVUJREF-UHFFFAOYSA-N 431.414 4.129 10 10 IICE CC(=O)N1CCN(c2ccc(CNc3cc(SCc4ccccc4)ncn3)cc2)CC1 1186373672 PAQPQYOCUHEURU-UHFFFAOYSA-N 433.581 4.050 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3cccnc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1188879402 IUESYNDGUUVJOU-SANMLTNESA-N 444.535 4.262 10 10 IICE CCCCOc1ncccc1Cn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1O 1306752874 WLEMWWOUCKYEBE-UHFFFAOYSA-N 444.539 4.304 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCC2(C)CCC3(CC2)OCCO3)cc1 1313372899 YYBFDFYQQAUXGF-UHFFFAOYSA-N 441.572 4.381 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)C[C@H]2CCCO2)cc1 1313678118 AOLKNRNOHIEWTO-YADHBBJMSA-N 427.593 4.029 10 10 IICE Cc1cnc2nc(C(=O)Nc3sc(C)c(-c4ccccc4)c3C(=O)OC(C)C)nn2c1 1353000352 OVMXUYWHHVCUHF-UHFFFAOYSA-N 435.509 4.287 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@]23CCN(C(=O)OCc2ccccc2)C3)cc1 1354542066 VACBFNCSTHWKBQ-BVAGGSTKSA-N 435.568 4.198 10 10 IICE CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1354578322 WEQAOYUXVYHIAH-FQEVSTJZSA-N 436.508 4.484 10 10 IICE CC(C)CC(CC(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1358428120 KJTVGUAREOTZHD-UHFFFAOYSA-N 441.595 4.267 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)[C@@H]([C@@H]2CCCO2)C1 1439569220 MZNNQXGOOYDLEW-YHYVQYDKSA-N 444.959 4.320 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)c3ccccc3)cc2Cl)C1 1459570200 CPYQRUOSPUWBDF-FDDCHVKYSA-N 439.987 4.497 10 10 IICE CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1463280903 KIBSHOFHNPKYNJ-OAQYLSRUSA-N 430.980 4.033 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cnc(F)c(F)c1 1463388757 CBKLGQXCVNFOMR-JYRVWZFOSA-N 425.507 4.041 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCSC1 1495753018 OPXGOOSPPSWKPR-SJORKVTESA-N 433.597 4.019 10 10 IICE COCCC1(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CC1 1504769116 XDLIVGGOVGOCLN-UHFFFAOYSA-N 427.936 4.152 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCO[C@@H](c3ccco3)C2)cc1F 1517004142 XPKOXDSNESIYSD-OAQYLSRUSA-N 441.551 4.291 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3cc(C)ccc3C(C)C)cc2F)CC1 1530377430 SLMIBUMSCVIYRI-FQEVSTJZSA-N 441.591 4.483 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1noc2ccc(Br)cc12 1531693329 IFIABPXWAUZKEC-UHFFFAOYSA-N 428.330 4.392 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC=C(C(F)(F)F)CC2)cc1F 1552821697 ASBYDRXUBKRXMO-UHFFFAOYSA-N 446.452 4.292 10 10 IICE COc1ccccc1Cc1nnc(N2C[C@@H](C)[C@@H](F)C2)n1CCCSc1nccs1 1555078942 CGVBRFOFVDSFFY-WBVHZDCISA-N 447.605 4.311 10 10 IICE Cc1ccc(N2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2=O)cc1 1556556942 VNUAIDBFMZRWOE-UHFFFAOYSA-N 435.955 4.474 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3NC(=O)c3cccs3)C2)cc1 1557133548 OWQWCBPMAGMGTK-QGZVFWFLSA-N 435.549 4.265 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(Nc3cnccn3)c2)cc1 1557275349 MWAPCPKEHASBBF-UHFFFAOYSA-N 429.446 4.491 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)Nc4ccc(Cl)cc4)CC3)cc2)CC1 1559677197 BPGFIJJFDLMUQM-UHFFFAOYSA-N 442.991 4.305 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1ccc(NC(=O)OC(C)(C)C)cn1 1584095467 NIUFOTFKCIBOKE-QGZVFWFLSA-N 426.561 4.093 10 10 IICE COC(=O)[C@H](C)Oc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1F 1584788917 YJPYYGWXVIDDML-INIZCTEOSA-N 438.455 4.238 10 10 IICE CCCCN1C(=O)c2ccc(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)cc2C1=O 1587461228 KMIPXEOWMKPABH-UHFFFAOYSA-N 443.547 4.463 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)CC2CC(F)C2)cc1 1615380623 FCXQDCNIPAFCPF-KBWCOIMZSA-N 429.584 4.251 10 10 IICE Cc1cc(C(=O)N2CCn3c(Br)cnc3C2)c(C)n1-c1ccc(Cl)cc1 1616226965 OTFWCZJIMKTAFU-UHFFFAOYSA-N 433.737 4.363 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@H](O)C(Cl)(Cl)Cl)cc2Cl)C1 1617900951 NIJHSXDZSKBURS-NHYWBVRUSA-N 428.187 4.314 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)cc(F)c1O 1622327814 BHEHCSRUMXNYNU-UHFFFAOYSA-N 447.098 4.424 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N(C)C2CC2)c(C)n1-c1ccc(C(C)C)cc1 1623582351 OKYWQCQUFFGPNT-QFIPXVFZSA-N 425.598 4.353 10 10 IICE COc1ccc(C(=O)C[C@H](C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1627616764 YAMWRTIQDOZNRX-INIZCTEOSA-N 446.494 4.291 10 10 IICE COCCn1c(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)nc2ccccc21 1632398501 POFPMFCYCVYQAY-UHFFFAOYSA-N 430.508 4.463 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCC(=O)c3cc(Cl)sc3Cl)C2)cc1 1632611618 FWNCROZFNGNBLV-GFCCVEGCSA-N 427.353 4.422 10 10 IICE CCCCN(Cc1c(C)oc(C)c1C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1638007095 DAASJDLRFKODLO-UHFFFAOYSA-N 426.605 4.469 10 10 IICE C[C@](O)(C(=O)NCc1ccc(N2CCCCC2)cc1)c1ccc(F)c(Br)c1 1643398366 OPKWAGDSTHGQNU-OAQYLSRUSA-N 435.337 4.102 10 10 IICE Cc1cc(C(=O)Cn2c(C)nn(C(C)(C)C)c2=O)c(C)n1-c1cccc(C(F)(F)F)c1 1643830234 OWEUMTDSHIWYJQ-UHFFFAOYSA-N 434.462 4.417 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H]2CC[C@@]21CNC(=O)OC(C)(C)C 1673744433 LUWYGNRSXVLXQL-JVFUWBCBSA-N 444.620 4.081 10 10 IICE CCOc1ccc(Cl)cc1CCNC(=O)NCc1cccc(Br)c1O 1679170348 DOVIGNJXUFLJME-UHFFFAOYSA-N 427.726 4.249 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1 1710028389 VZCZRPHAFIDOIG-FGZHOGPDSA-N 441.620 4.275 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1727699634 SKZIGEIGWKCBQR-GCBQAYLCSA-N 441.620 4.050 10 10 IICE CC(C)(C)OC(=O)Nc1cc(OCCNCc2cc(Br)ccc2O)ccn1 2240601210 HDGGJCYNCIVFND-UHFFFAOYSA-N 438.322 4.065 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCCOc1ccccc1OC 2293568222 GTAKLDGBVBXXMN-UHFFFAOYSA-N 431.535 4.041 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2ccccc2C)c1C 2294037473 INQNZARQXDIEEM-OAQYLSRUSA-N 434.536 4.254 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2381130615 BFVXDVQLKYHJAM-DZGCQCFKSA-N 441.366 4.257 10 10 IICE CCC1(CC)C(=O)N(C(=O)c2ccc(Cl)cc2)N(C(=O)c2ccccc2Cl)C1=O 1648838 FVOYDEJWHVOVFB-UHFFFAOYSA-N 433.291 4.366 10 10 IICE Cc1ccc(/C=C/C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(Br)c1 16134843 GSWCGHKKZLIPNY-JXMROGBWSA-N 429.358 4.266 10 10 IICE CC(C)CCNC(=O)[C@]1(C)Cn2c(cc3ccccc32)C(=O)N1Cc1ccc(N(C)C)cc1 21858826 IZVHZMVSJSKRFK-MHZLTWQESA-N 446.595 4.284 10 10 IICE C[C@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S 47152313 FPIQREHFMBXADA-FFCYNSPCSA-N 447.925 4.477 10 10 IICE COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)o1 100288802 NHGYLVJBTIRVNE-XDHOZWIPSA-N 447.403 4.368 10 10 IICE C[C@@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cc(Br)cc(Cl)c1O 790745592 CHUWSSDVNITBAF-DIFFPNOSSA-N 441.728 4.399 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)CC2)cc1 915326746 ICZGKVRUUDTVLF-UHFFFAOYSA-N 444.507 4.375 10 10 IICE COc1ccc(OC)c([C@H]2CCCN2C(=O)NCc2ccc(N3CCSCC3)cc2)c1 916626053 QZNFJIJXOPPRHH-JOCHJYFZSA-N 441.597 4.304 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3ccc(NC(=O)C(F)(F)F)cc3)n2)s1 917873450 ZULVQLDLTHUCPZ-UHFFFAOYSA-N 447.485 4.482 10 10 IICE Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c1C 1083880296 ULJYHABMKGDJIN-LDADJPATSA-N 431.404 4.138 10 10 IICE C[C@@H]1CCN(C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)[C@H](C(F)(F)F)C1 1135296673 CNHVZTYSJXRPAG-BZNIZROVSA-N 446.381 4.173 10 10 IICE C[C@@H]1CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)[C@@H]2CCCC[C@H]12 1137788979 WVFVVGZFZYEHRD-MTQLPGGKSA-N 432.586 4.454 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2N(C(=O)OC(C)(C)C)CCCC2(C)C)cc1 1164596641 ARQDTSMGLYFATN-HXUWFJFHSA-N 433.593 4.016 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3ccc(Br)cc3)C2)cc1 1230301206 UHPORSOFNXMVEB-QGZVFWFLSA-N 432.362 4.126 10 10 IICE Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 1264738060 MRMNKWQZFNBPLV-NRFANRHFSA-N 427.548 4.294 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)c3cccc(C(=O)c4ccccc4)c3)CC2)cc1 1266268431 HKEXLLMDCVAHHD-FQEVSTJZSA-N 428.532 4.379 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc21 1292593531 GLKSLWWXWFFRHA-UHFFFAOYSA-N 444.482 4.323 10 10 IICE Cc1cc(CC(=O)N2CSC[C@H]2C(=O)N[C@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1293236755 RLYJVFBCRNCUFQ-IERDGZPVSA-N 448.032 4.352 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC(n3cc(N(C)C)cn3)CC2)c1 1298552181 NREZEFLOEMBBSW-UHFFFAOYSA-N 425.964 4.487 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 1299479817 ZTFNYESOVDMXAL-RLWLMLJZSA-N 443.591 4.150 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@H](c3ccco3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305553368 BWIVQMHOAQXVRK-IIBYNOLFSA-N 427.524 4.216 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)C[C@@H]1C 1306459982 DBRDYNJGPSEMCN-OEMHODTASA-N 446.599 4.376 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H]3CC3(C)C)CC2)cc1F 1315513637 XYTXUCPTBNOULI-QGZVFWFLSA-N 429.584 4.387 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2cnc(NC(=O)/C=C\c3ccc(O)c(O)c3)s2)CC1 1346131868 UMFBZVIUOJFVJW-ALCCZGGFSA-N 445.541 4.321 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@@H]2C(=O)Nc3ccc(Br)cc32)cc1 1350863591 BKBODDMOZPXRDE-SFHVURJKSA-N 430.346 4.038 10 10 IICE CC(C)(C)n1nccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1351283846 VFOUWWCSFDWMHH-NTCAYCPXSA-N 432.546 4.007 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N(CCN1CCOCC1)c1ccccc1 1351831110 DOFZAVUIBAASEI-OUKQBFOZSA-N 445.563 4.402 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)cc1 1435635805 DJMNCJYTQUTPFB-FQEVSTJZSA-N 428.941 4.348 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl 1451668362 MBXUTEKMMNYMDO-GJZGRUSLSA-N 436.383 4.234 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cncc(N4CCCC4=O)c3)cc2Cl)C1 1459576879 JBNRRJUESHXGOO-MRXNPFEDSA-N 426.948 4.028 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC([C@@H](C)CO)CC2)sc(C)c1-c1ccccc1 1460357845 URLMATFSLTWIIF-INIZCTEOSA-N 444.597 4.179 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@H](C(=O)OC(C)(C)C)CC[C@@H]2C)CCCC1 1461021431 FTLJBPZVXDCXFM-ZWKOTPCHSA-N 440.584 4.498 10 10 IICE Cc1ccc(C(=O)N2CCN(c3cccc(OCc4ccc(F)cc4)c3)CC2)c(O)c1O 1465170406 NFXJTBUNZWXFHX-UHFFFAOYSA-N 436.483 4.087 10 10 IICE COc1ccc(N2CCN(C(=O)C(F)(F)c3cccc(Br)c3)CC2)cc1F 1465931636 KKTOSHHXSDHLKJ-UHFFFAOYSA-N 443.263 4.037 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1469959985 MPHXYYFOUBFNCQ-SJLPKXTDSA-N 435.996 4.450 10 10 IICE Cc1nnc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1492773013 SDIZWTAKQJPMSC-UHFFFAOYSA-N 439.633 4.312 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(CC)C[C@@H]2CCCO2)cc1 1501847328 KOWROLPDEOESFY-FCHUYYIVSA-N 427.593 4.029 10 10 IICE C[C@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1512140754 LSVLWGYGLHFZCY-FQEVSTJZSA-N 439.648 4.459 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCOC)CCO1 1514126549 QFWVKGTZKJQZFB-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@@](C)=O)CC1 1514566796 LAABZBGOAMYUNO-SSEXGKCCSA-N 425.602 4.110 10 10 IICE COC1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC(C)C)C1 1517904771 UPVRILAPZVZFGC-UHFFFAOYSA-N 437.588 4.393 10 10 IICE O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1534129763 MMRNQQIYDOAWSI-UHFFFAOYSA-N 435.471 4.011 10 10 IICE COC(=O)c1cc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc(C(=O)OC)c1 1540497437 JHAUACPLGGEMRF-UHFFFAOYSA-N 448.475 4.041 10 10 IICE CC(C)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541356583 XCUPPYIGCQSQGO-QHCPKHFHSA-N 425.621 4.283 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCc2ccsc2)cs1 1542898430 ROOJQHXVCRGOFZ-UHFFFAOYSA-N 425.583 4.280 10 10 IICE CC[C@]1(C)CCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1546062053 JWKGKPLTLKNRSN-KBMIEXCESA-N 441.620 4.059 10 10 IICE CN(C)c1ccc([C@H](CNc2nc(C3CCOCC3)ns2)NC(=O)OC(C)(C)C)cc1 1559184130 WKMBKIZDAXAOHX-SFHVURJKSA-N 447.605 4.176 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CC(=O)N(c4ccccc4[C@@H](C)CC)C3)CC2)cc1 1566560473 FVFDFABJXWBZLZ-LEWJYISDSA-N 449.595 4.301 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](CC)Nc1cccnc1Cl 1568379339 XYLGTOSXXYUNNR-GOSISDBHSA-N 446.979 4.314 10 10 IICE Cc1cc(C(=O)NCC(=O)c2cncc(Br)c2)c(C)n1-c1ccc(F)cc1 1587174851 MNZYGNZKSIKMQI-UHFFFAOYSA-N 430.277 4.003 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(Cl)cc1O 1610900246 QQILGZBVJNAEKY-SXGWCWSVSA-N 436.917 4.415 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCCC[C@@H]3/C=C\c3ccccc3)CC2)cc1 1616321547 DSUUIWYPLJBFHU-UTUMUSQASA-N 449.639 4.136 10 10 IICE CCOCc1nnc(N(CC)C[C@H]2CCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1616716813 PAQQUBLLECSKPD-HSZRJFAPSA-N 441.620 4.105 10 10 IICE CCc1ccc2c(c1)[C@@H](CCNC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)C(=O)N2 1628128514 XNENDIKEECGYOC-HSZRJFAPSA-N 443.547 4.254 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCc3cccc4c3OC(F)(F)O4)c2C)cc1 1633235085 GSJJCHDDYQCKQD-UHFFFAOYSA-N 428.435 4.397 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(C)ccc(Br)c4[nH]3)CC2)cc1F 1635891394 WPJFTLLYVJCQMP-UHFFFAOYSA-N 446.320 4.349 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1638649607 KQSKDYKAMYIYRV-FQEVSTJZSA-N 431.536 4.172 10 10 IICE Cc1cc(C(=O)NC[C@@H]2C[C@H]2C2CCOCC2)c(C)n1-c1ccc(Br)cn1 1648977769 NBZCWEALJSRKAI-LPHOPBHVSA-N 432.362 4.044 10 10 IICE C/C(=C/c1ccccc1)CN(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1654137023 QOQNHBZIPDUKMI-YABWQAOZSA-N 439.575 4.091 10 10 IICE COC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(Cl)cc1 1654308230 FWJWSLDYSYAOSJ-NRFANRHFSA-N 448.906 4.031 10 10 IICE Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684873808 JSVJTCKKRUVNGO-GOSISDBHSA-N 429.634 4.229 10 10 IICE CC[C@@H](C)c1nnc(N(CCOC)Cc2ccco2)n1Cc1ccc2c(c1)CCCN2C 1726900695 DQFJZMHXWXHZSS-LJQANCHMSA-N 437.588 4.468 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1727820869 VIISRXLYPISDTL-NRFANRHFSA-N 443.661 4.083 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC[C@@H](C)C1 1752066507 WFCYNWUDOMOJHI-TZIWHRDSSA-N 438.620 4.089 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCC1CCOCC1 1768684399 UTXPCHHHNVTQRE-IFMALSPDSA-N 442.604 4.355 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCCOC(C)C)CC2)cc1 1770258308 NYDUAYIIIGOUKO-UHFFFAOYSA-N 429.609 4.332 10 10 IICE CN(C)c1ccc([C@H](NC(=O)c2c3c(nc4ccc(F)cc24)CCC3)c2nccn2C)cc1 1866273220 YFYUNZBESBUSGL-DEOSSOPVSA-N 443.526 4.182 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC[C@@H]2NCc2cc(Br)cc(F)c2O)C1 1918936774 SUYKZPPWXAJKTF-HNNXBMFYSA-N 429.330 4.173 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)CC(F)(F)C1 2127793944 BXTBHVNHPCERHP-INIZCTEOSA-N 429.280 4.293 10 10 IICE CN1CCc2cc([C@H](N)C3(COCc4ccccc4)CN(C(=O)OC(C)(C)C)C3)ccc21 2256692698 VZEUITMXDOHRCM-QHCPKHFHSA-N 437.584 4.133 10 10 IICE COc1ccc(Br)c(CN[C@H](C)[C@H]2CCCN2C(=O)OC(C)(C)C)c1O 2271264293 GASPOEBEUJEQQJ-IUODEOHRSA-N 429.355 4.041 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2ccccc2F)c1C 2294037468 IHHLMAHPYOQRDU-IBGZPJMESA-N 438.499 4.085 10 10 IICE CC(C)C1=NN2C(=N)C(=Cc3cccc(OCCOc4ccccc4)c3)C(=O)N=C2S1 2297334328 UILJCMZUADJGLZ-UHFFFAOYSA-N 434.521 4.420 10 10 IICE Cc1ccccc1-n1c(C)cc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)c1C 2313558847 LFXHFSDIRXGSMO-UHFFFAOYSA-N 433.508 4.373 10 10 IICE COC(=O)c1ccc(C)c(-c2ccc(C=C3C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)c1 2313560422 SMNCXPLFFCRMJE-UHFFFAOYSA-N 444.443 4.050 10 10 IICE CC(C)(C)OC(=O)N[C@H]1[C@H]2C[C@@H](CN(c3ccc(OCc4ccccc4)cc3)C2)[C@@H]1CO 2314471480 MJGDTIYRNXXENL-TZYAJKAJSA-N 438.568 4.224 10 10 IICE CCCOc1ccccc1C=C1SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O 2314926955 WECFOEFMSZJCKC-UHFFFAOYSA-N 443.502 4.278 10 10 IICE COC(=O)c1ccc(C=C2C(=O)N(c3ccc(OC)cc3)N=C2c2ccc(OC)cc2)cc1 2332134836 PVEBTCRODGBNEI-UHFFFAOYSA-N 442.471 4.325 10 10 IICE COC(=O)c1ccc([C@H]2Oc3c(OC)cccc3[C@H]3CC(c4ccccc4O)=NN32)cc1 20071064 JLBGWTJPMBEFJB-HYBUGGRVSA-N 430.460 4.430 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)c3ccc(F)c(F)c3)CC2)c(C)n1-c1ccccc1 62694241 OCZJDLNFGLVPBY-UHFFFAOYSA-N 437.490 4.013 10 10 IICE O=C(O)CN1C(=O)/C(=C/c2cn(Cc3ccc(F)cc3)c3ccccc23)SC1=S 96925485 AEAWPFYURWZWJT-NVMNQCDNSA-N 426.494 4.115 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(NC(=O)N2CCCC2)cc1 586662227 DINGVXSFRDSNMB-UHFFFAOYSA-N 439.471 4.342 10 10 IICE CCN1CCN(c2ccc(CNC(=O)NCc3ccc4[nH]c(C)c(C)c4c3)cc2F)CC1 730122899 AXCZAMIUVJULQW-UHFFFAOYSA-N 437.563 4.065 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 733656899 DZQHGHBKTJYSCS-LJQANCHMSA-N 443.544 4.487 10 10 IICE COc1cccc(N2CCC[C@@H](NC(=O)N(C)Cc3ccc(N4CCCCC4)cc3)C2)c1 735383521 DFMMFRDEXORZMN-JOCHJYFZSA-N 436.600 4.496 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(-c2cccnc2)cc1 747578358 CXJHYCDQWBCSBA-SFHVURJKSA-N 448.542 4.409 10 10 IICE C[C@@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1ccc(Br)cc1O 756477228 YDVRXVARBWPNDF-MRXNPFEDSA-N 431.374 4.429 10 10 IICE CCn1c(O)nnc1C1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 764649819 TUZMLYYVNVHXEL-UHFFFAOYSA-N 441.963 4.013 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 792276812 YSJVAJZPJOGTAW-UHFFFAOYSA-N 440.554 4.478 10 10 IICE COc1ccc(CNC(=O)NCc2ccc(Br)cc2C(F)(F)F)c(O)c1 793025054 BKWGAEVXKKRJEC-UHFFFAOYSA-N 433.224 4.182 10 10 IICE COc1c(C(=O)NCc2cc(Br)ccc2O)sc(C)c1Br 804735741 HUVRJRHWLGIGFL-UHFFFAOYSA-N 435.137 4.226 10 10 IICE CC(=O)Nc1ccc(NC(=O)NCc2cc(Br)ccc2O)c(C(F)(F)F)c1 806182689 ZQEYNYPTRGNDCN-UHFFFAOYSA-N 446.223 4.454 10 10 IICE C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457205 GPNVUJBMLGDJBN-JPYJTQIMSA-N 425.548 4.470 10 10 IICE Cc1nc(COC(C)(C)C)oc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472090 GPTOCYYEYVZJFK-KRWDZBQOSA-N 435.952 4.052 10 10 IICE CC(C)C(=O)Nc1ccc(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 916672341 GVTPICHXLHWLOJ-IAGOWNOFSA-N 442.535 4.356 10 10 IICE COc1ccc(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1Cc1ccccc1 1084536127 HQBCREPSXVMIBI-CYVLTUHYSA-N 446.503 4.256 10 10 IICE CCOC(=O)[C@@H](CC1(OC)CCC1)NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1144913091 KLKVLJDXLFWSQD-HXUWFJFHSA-N 432.948 4.368 10 10 IICE COC(=O)/C=C\c1ccc(N(C)Cc2nc3ccc(C(F)(F)F)cc3[nH]2)c([N+](=O)[O-])c1 1163957375 AKWMUXOCWMSFJS-YWEYNIOJSA-N 434.374 4.313 10 10 IICE C[C@@H](NC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1)c1ccccc1O 1171723190 NVZVMTQBWHZAKV-OAHLLOKOSA-N 433.464 4.088 10 10 IICE Brc1cc(CNC[C@H](c2ccccc2)c2nc[nH]n2)ccc1N1CCCCC1 1181765236 WIUQTWKXTSCAOZ-LJQANCHMSA-N 440.389 4.479 10 10 IICE C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751312 ZTGBSDAVGMOQOZ-UWVAXJGDSA-N 429.511 4.278 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4c(F)cccc4F)CCC3)CC2)cc1F 1251904598 XLGHZYBGOYTKPD-UHFFFAOYSA-N 433.474 4.066 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C\c3csc(C(F)(F)F)c3)cc2F)CC1 1265011912 GLKGVZXUZKFLNQ-XQRVVYSFSA-N 441.494 4.378 10 10 IICE COc1ccc(F)cc1CN1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)CC1 1290260390 WIBZHHVRBNHURW-UHFFFAOYSA-N 449.526 4.012 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)cc2C1 1292382878 WMDCAFHFWGQIQW-AVRDEDQJSA-N 437.584 4.190 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCOC 1296437778 BEIWOZRIKXKOKB-UHFFFAOYSA-N 425.577 4.250 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 1301350764 YSQPTQHMQZMTMZ-UHFFFAOYSA-N 446.507 4.230 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)sc(C)c1-c1ccccc1 1307996544 JYBPRDZIGLUMBT-MBIULKOWSA-N 430.570 4.240 10 10 IICE O=C(Cc1cccnc1)Nc1ccc(C(=O)NCc2ccc(N3CCCCC3)cc2)cc1 1452050103 GVMJIOMSHAQEQU-UHFFFAOYSA-N 428.536 4.183 10 10 IICE Cc1cc(CO)cc(C)c1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1455954051 DOMSVIKXERYRGU-UHFFFAOYSA-N 442.357 4.291 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)Cc2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)c1O 1460318653 SISWYRDODODHQJ-CALCHBBNSA-N 430.976 4.489 10 10 IICE Cc1ccc(C(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)cc1-n1c(C)cc(C=O)c1C 1464875260 ZFKINJOLKCLKOS-DEOSSOPVSA-N 431.536 4.431 10 10 IICE Cc1cc(C)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1CO 1466952135 QOKGWUYFWKWVPE-GRSHGNNSSA-N 444.553 4.165 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@]3(C)Cc3cc(F)c(F)c(F)c3)C2)cc1 1470771341 DGUQNTVDNGKDCS-OSPHWJPCSA-N 447.501 4.498 10 10 IICE Cc1cc(C(=O)CSc2nnnn2-c2ccc(Cl)cc2)c(C)n1-c1ccc(F)cn1 1472942460 VIBSPMFHELGTFY-UHFFFAOYSA-N 442.907 4.232 10 10 IICE Cc1cccc([C@H](NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C(C)C)c1 1473702670 MESKAPPTFRHVDM-XMERXJNXSA-N 441.591 4.351 10 10 IICE CCN(CC)c1ccc(Cn2c(N(C[C@H]3CCOC3)C3CC3)nnc2C(C)(C)C)cc1 1501847517 QTKPAHZVQIAMSA-HXUWFJFHSA-N 425.621 4.475 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)c(F)cc3Br)CC2)cc1 1518370955 SBNFLHYVFGOVBO-UHFFFAOYSA-N 427.701 4.213 10 10 IICE COc1ccc2c(c1)CCN2C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1518985283 CWHWLXDSVDEBHX-UNOMPAQXSA-N 442.537 4.015 10 10 IICE CSCCCN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1520504213 BMEOYKANMPERNI-UHFFFAOYSA-N 443.661 4.085 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(OC(C)C)c1 1526002764 IMOFYPSSKRTMNY-IRXDYDNUSA-N 430.520 4.165 10 10 IICE COc1nc(C)ccc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1538920973 ZABCUMODQVCIBO-UHFFFAOYSA-N 438.285 4.123 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3cccc(Cl)c3)cc2F)C[C@@H](C)O1 1542112800 FJNWOLXJVHDWAB-GASCZTMLSA-N 442.922 4.413 10 10 IICE CCc1c(Br)cc(C(=O)NCc2cccc(OC)c2O)cc1Br 1545682251 YTDDGDORXSPFSS-UHFFFAOYSA-N 443.135 4.418 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@@H]1C 1548264120 LGEQWNRPCUOWRI-FQEVSTJZSA-N 437.588 4.393 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(NC(=O)OC(C)(C)C)n(C)n3)c2C)c1 1557888656 TXWFUYVQOJOQGC-UHFFFAOYSA-N 437.544 4.413 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCc3cn(C)c4cc(Cl)ccc34)CC2)cc1 1564566577 INYXKBFCSYHWQD-UHFFFAOYSA-N 440.975 4.305 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@@H]3CCCC[C@H]32)c(C)n1-c1cccc(C(C)C)c1 1566370533 DHAGSEHQYOADOE-DHIUTWEWSA-N 428.598 4.399 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C(C)C)n(-c2ccccc2)n1 1566849600 NNWYILJQJVZZQE-UHFFFAOYSA-N 441.915 4.170 10 10 IICE Cc1cc(C(=O)NC[C@H]2COC3(CCCCC3)O2)c(C)n1-c1ccc(Br)cn1 1566887950 QBJLQILICMZRTM-KRWDZBQOSA-N 448.361 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(Br)o2)C1 1585469951 ULKKYRYFYWVLDZ-UHFFFAOYSA-N 430.346 4.080 10 10 IICE CCO[C@H]1CCCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1616610110 LVNKCQZSTKLALI-DEOSSOPVSA-N 448.615 4.164 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1sc(-c2ccc(F)cc2)nc1C 1623928968 SZXPYNHKZVRXTC-UHFFFAOYSA-N 448.903 4.432 10 10 IICE CNS(=O)(=O)c1ccc([C@H](C)NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1 1628056644 PITXKWKVOPESKY-SFHVURJKSA-N 439.581 4.110 10 10 IICE Cc1ccc(C(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1628159304 WYNTVWIZJTYGIL-OAQYLSRUSA-N 439.556 4.344 10 10 IICE COc1ccc([C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)N2CCCCC2)cc1 1628503675 RQQIDJWQGWJLHJ-SFHVURJKSA-N 426.538 4.278 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(-c3ccncc3)nn2C)cc1 1633067009 ZHIHBNCWIQKORY-UHFFFAOYSA-N 441.535 4.404 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)sc2c1CCCC2 1633147507 OFUGAEKETYKJTP-UHFFFAOYSA-N 430.482 4.313 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3cccnc3OCC(F)F)c2C)c1 1633916963 HXHYMORXFHPHBW-UHFFFAOYSA-N 428.483 4.441 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)cc1F 1634885050 QMMBHCDODQENBG-LJQANCHMSA-N 435.499 4.473 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1Cl 1637564056 VQQZUEKRVMUWPS-LBPRGKRZSA-N 436.942 4.399 10 10 IICE C[C@@H](CCO)n1c(C(F)(F)F)nc2cc(NC(=O)/C=C\c3ccc(O)c(O)c3)ccc21 1641011073 JGMZNHXISYIZLY-MIBUCLJRSA-N 435.402 4.062 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1 1644438372 OKHLGWFABAMLBZ-UHFFFAOYSA-N 427.545 4.275 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 1673744240 KPNYRRMKNQQQQP-IBGZPJMESA-N 429.008 4.173 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)OC2CCCC2)cc1 1695624313 KOVURJZYRWRLQI-UHFFFAOYSA-N 434.588 4.469 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)[C@H](C)C1 1709570274 BPFHGNBDGAXYAH-LJQANCHMSA-N 434.588 4.210 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@H](CCOC)C2)cc1 1728379221 HHBWIDPUKDSLOX-OAQYLSRUSA-N 434.588 4.097 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CCCc1cnn(C)c1 1747721581 YERVQTJMNSNQLH-UHFFFAOYSA-N 449.647 4.470 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC(C)C)C(C)C 1748269640 LRSDZGITMZUELY-UHFFFAOYSA-N 436.604 4.360 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3Cc3ccsc3)CC2)cc1F 1748849235 JNKOGOLDIPGTOX-UHFFFAOYSA-N 429.565 4.160 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(CC2CCCC2)n1Cc1ccc(N(C)C)cc1C 1765173206 LQNVUFIHWKFYLA-QHCPKHFHSA-N 425.621 4.439 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CCCOC3)CC2)cc1 1768704842 POEFMNMIHGSHDB-FQEVSTJZSA-N 441.620 4.019 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC[C@@H]3CCCCO3)CC2)cc1 1770258571 QASZLTGSLOCBGV-QFIPXVFZSA-N 427.593 4.086 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@@H]2CCC[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1771166846 UKEVETFXRRNBML-JXHRLWIKSA-N 443.636 4.440 10 10 IICE CCN1N=C(C(F)(F)F)/C(=C/c2cc(Br)c(OC(C)C)c(OC)c2)C1=O 1865671606 KQRWWJSTRKYDJW-WDZFZDKYSA-N 435.240 4.409 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(CNCc2cccc(Br)c2O)CC12CCC2 2097949860 FZHFLPCXMRZBBV-HXUWFJFHSA-N 425.367 4.329 10 10 IICE COc1ccc(Br)c(CNCC(C)(C)CN(C)C(=O)OC(C)(C)C)c1O 2227749712 GZBARYBRMFESDU-UHFFFAOYSA-N 431.371 4.146 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N([C@@H](C)CC)C1=O 2314414037 OHFHLJNFDUJCJD-AWEZNQCLSA-N 430.599 4.296 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccc(O)cc2)SC1=S)NCc1ccccc1 2314836203 BLFCNRPKWYQKHY-UHFFFAOYSA-N 440.590 4.470 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H]1C[C@@H]2NCc1cc(Br)cc(F)c1O 2329598699 SWWOXFVOKLOKOW-GREKMHCPSA-N 429.330 4.075 10 10 IICE CCOc1cc(C=C2C(=O)N(CC(C)C)N=C2C(F)(F)F)cc(Br)c1O 2332110733 GORHCOPXRLSUKA-UHFFFAOYSA-N 435.240 4.353 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2381136116 AVSFAIGMDSLOAT-ZFWWWQNUSA-N 441.366 4.163 10 10 IICE CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(OC)c(Cl)c3)c2C)C(C(=O)OC)=C1C 33305435 DHDCBYNHJABLLN-WOJGMQOQSA-N 428.916 4.449 10 10 IICE CC(C)N1C(=O)/C(=C\c2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)SC1=S 33906354 QOCOEENCPDIXAM-LFIBNONCSA-N 441.509 4.236 10 10 IICE COc1cccc(N2CC[C@H](CNC(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)c1 303427553 ZYUDTLFWDXRBII-JOCHJYFZSA-N 436.600 4.257 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1 435639839 VUISKVSYEUFNHD-UHFFFAOYSA-N 444.579 4.283 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC[C@@H]2CC(=O)c2ccco2)C1 444289549 GKVJKFGLRPQHOW-LJQANCHMSA-N 433.552 4.265 10 10 IICE CCCN(C[C@@H]1CCCCO1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 730127125 IMJKTQZWPFKMFE-FQEVSTJZSA-N 425.520 4.248 10 10 IICE CNC(=O)Cn1ccc2ccc(NC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)cc21 743203962 CSBDDXQWBHUPRW-UHFFFAOYSA-N 443.551 4.159 10 10 IICE C[C@@H](NCc1ccc(Cn2ccccc2=O)cc1)c1ccc(N2CCOCC2)cc1Cl 765386886 WPWZGGQYOACCLI-LJQANCHMSA-N 437.971 4.237 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(N3CCOC3=O)cc2)C1 767692947 YFLJIGOCQFIMSM-UHFFFAOYSA-N 432.524 4.003 10 10 IICE CCN1CC[C@@H](NC(=O)NCCCSc2nccs2)[C@H]1c1cc(F)c(F)c(F)c1 782732846 NMUMRXROTOXIDK-NVXWUHKLSA-N 444.548 4.177 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@H]1c1ccccc1 1128474205 OISOHLFWRSNWSQ-HFNXDKSESA-N 426.538 4.089 10 10 IICE CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccc(Cl)nc1 1128583618 FXMJVPNJYXVQMT-GXDHUFHOSA-N 437.999 4.441 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@H](NC(=O)OC(C)(C)C)c3ccccc3)C2)cc1 1130826630 FREKVZGAXVJWCJ-KNQAVFIVSA-N 439.556 4.046 10 10 IICE COCCc1nnc(-c2cccc(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)c2)o1 1132048136 KKMIUTZYFAIQIQ-UHFFFAOYSA-N 430.508 4.263 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(Nc3cnccn3)c2)cc1 1142712964 LLNBWQPKJDHXFC-QHCPKHFHSA-N 431.540 4.108 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2Cl)C1 1155726263 FGCWZIMHRXMSDK-DENIHFKCSA-N 441.019 4.500 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1159439900 GFZPAOOPBWQLPC-OALUTQOASA-N 432.362 4.425 10 10 IICE Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2O)cc1 1180409577 CUQXNBWUUFBKFC-UHFFFAOYSA-N 430.913 4.085 10 10 IICE CCCC[C@H]1NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1=O 1189415738 AYNIVURTCVGFLM-GOSISDBHSA-N 435.446 4.406 10 10 IICE C[C@H]1CCCC[C@H]1OCCNC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1191581689 IHTYYGAIUJMVIL-GHTZIAJQSA-N 444.597 4.237 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1 1276283598 JJRIFLBPFMOYKW-OAHLLOKOSA-N 431.462 4.022 10 10 IICE CN(c1nnc(-c2cccc(Cl)c2)n1CCCSc1nccs1)[C@@H]1CCOC1 1298118221 PTLFGLWTVODBEY-MRXNPFEDSA-N 436.006 4.463 10 10 IICE CO[C@@H]1CCCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C1 1300774103 JPKXMIMQCJNEPM-MRXNPFEDSA-N 435.644 4.185 10 10 IICE COc1ccc(CNC(=O)NCC[C@@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)c(O)c1 1313151148 WWAFJTVOVTZKDG-QGZVFWFLSA-N 441.528 4.129 10 10 IICE Cc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1Br 1356036371 FRDSSALDLKZNBU-IYBDPMFKSA-N 449.364 4.369 10 10 IICE CC(C)(C)OC(=O)[C@@]1(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC=CCC1 1357324254 UCKQDNQHYYSYMV-SANMLTNESA-N 431.488 4.469 10 10 IICE CC(C)[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CCO1 1359753906 UIWXOZYVDJXIFO-QGZVFWFLSA-N 449.671 4.431 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CSC[C@@H]2C(=O)N[C@@H](C)C(C)C)c1 1360236123 HXZZAHKBEZFXSV-OXJNMPFZSA-N 434.005 4.423 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H](CNC(=O)OC(C)(C)C)c3ccc(F)cc3)ccc21 1442387042 OKNDALWLLMBTKK-OAQYLSRUSA-N 441.547 4.133 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3C[C@@H]2O)c(C)n1-c1ccccc1Br 1452670013 UKPXEMUGJYGDQG-SFTDATJTSA-N 425.326 4.245 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C(F)F)nc2ccccn12 1457101976 QWRMVPKQRYULMC-CYBMUJFWSA-N 436.409 4.272 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CC(c2ccc(Cl)cc2)C1 1457825489 ZFTIITBYDKXWJG-UHFFFAOYSA-N 448.953 4.148 10 10 IICE Cc1cc(C(=O)CN2C(=O)CN(/C=C/c3ccccc3)C2=O)c(C)n1-c1cccc(F)c1 1458925475 YJWYSOFFBSJHBG-VAWYXSNFSA-N 431.467 4.351 10 10 IICE COc1ccc(C(=O)C[C@@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952037 TXXRYTFHRYKXNR-OXQOHEQNSA-N 444.959 4.044 10 10 IICE COc1cccc(C[C@H](C)CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1465952208 XUSDBBVJDZMABJ-UWJYYQICSA-N 430.976 4.404 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(OCc4ccccc4)ccc3O)CC2)cc1 1466209089 WEWHPPYOKVIPEA-UHFFFAOYSA-N 432.520 4.332 10 10 IICE COC(=O)c1ccc(F)c2c1CN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)CC2 1470150664 XEDUVGIZYSVPOD-UHFFFAOYSA-N 448.494 4.339 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCN2C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1470176943 JRMXAKNFCQAZSG-LJQANCHMSA-N 445.405 4.388 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2c(C)nn(C)c2C)n1Cc1ccc(N(C)C)c(F)c1 1495088670 IKUHNSPAQBTODJ-HNNXBMFYSA-N 427.572 4.032 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H](C)C(=O)NC 1514404427 XAEDLXLVXCYXME-SFHVURJKSA-N 436.604 4.361 10 10 IICE C[Si](C)(C)c1ccc(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1514716285 QWDCADNKLUDOLJ-GOSISDBHSA-N 432.587 4.161 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C1CC1)C(C)C 1515385890 ZXVOVNRCXXBLFG-UHFFFAOYSA-N 434.588 4.114 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(Cl)cc(Cl)n1 1516257381 XUTROBZFENVYNO-UHFFFAOYSA-N 434.245 4.174 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c(F)c3)cc2Cl)C1 1519551456 NWWHKPCLAXTHCD-AWEZNQCLSA-N 435.883 4.319 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnc(-c3ccc(OC)c(OC)c3)s2)cc1 1530904213 GHAONVGPGYWLGO-UHFFFAOYSA-N 441.553 4.044 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)n3)cc2F)CC1 1537535758 VDNMASMAKGSSTK-UHFFFAOYSA-N 449.574 4.009 10 10 IICE Cc1cc(C(=O)NCCCSc2nccs2)nn1-c1ccccc1Br 1542958146 RTFLYVKCZNLKSJ-UHFFFAOYSA-N 437.388 4.312 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@]2(F)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1544267346 DSQIYLAHBNYHNA-CZSZKKDXSA-N 441.547 4.320 10 10 IICE COc1ccccc1CN(CCO)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1545910111 HOQHVPUAAACYQU-UHFFFAOYSA-N 426.944 4.320 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(Cc2ccccc2)C[C@]2(O)CCc3ccccc32)cc1 1546015512 CFIAHROSMFCMQM-RUZDIDTESA-N 428.492 4.325 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H]3CCCSC3)CC2)cc1 1554959360 MLVQKSFKQKEIKE-LJQANCHMSA-N 429.634 4.270 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](CO)Cc2ccc(Br)cc2)cc1 1556181910 HNLKECJKCQVWBF-LJQANCHMSA-N 441.369 4.438 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3NC(=O)OC(C)(C)C)C2)cc1 1557133313 HJSMVTYODWFMQK-QGZVFWFLSA-N 425.529 4.299 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc3[nH]c(-c4cccs4)nc23)N(C)C)cc1 1558723135 IREOSLLBTDIUSB-FQEVSTJZSA-N 433.581 4.390 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCC4)C3)cc2F)C[C@@H](C)O1 1559528941 YCPKAOZZODXWLI-WOJBJXKFSA-N 431.596 4.102 10 10 IICE CSc1ccc(O[C@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1566356462 FQMHWDPCFITVEN-QAPCUYQASA-N 434.989 4.316 10 10 IICE COc1cc(OC)c(C[C@@H](C)NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c(OC)c1 1583066239 ZNRJYXMXDXVVRP-QGZVFWFLSA-N 436.552 4.410 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc3cccnc3c2)NC(=O)OC(C)(C)C)cc1 1586619123 CGBRDSAPTRGVEI-QHCPKHFHSA-N 448.567 4.226 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)C[C@@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1613201078 XJJFIAPROBGULH-HBFSDRIKSA-N 429.584 4.440 10 10 IICE CC(C)(C)c1ccc(C(F)(F)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1616599446 NUFKPURKOSWDOJ-UHFFFAOYSA-N 443.538 4.094 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCCS3)CC2)cc1 1619301664 SZGFPNFJIGBRFT-FQEVSTJZSA-N 429.634 4.197 10 10 IICE CC(=O)N1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC12CCCCC2 1624602147 CWMSGAVXMFAWFL-UHFFFAOYSA-N 435.568 4.222 10 10 IICE Cc1cc(C(=O)NC[C@H](CCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1636138695 UNSYCFDYZWUDDS-SFHVURJKSA-N 442.357 4.148 10 10 IICE Cc1ccc(C(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)cc1-n1c(C)cc(C=O)c1C 1639361368 SCTPZRNEIWSEGT-UHFFFAOYSA-N 433.508 4.353 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1639585577 FHGZJFLCDFNDAV-WOJBJXKFSA-N 447.963 4.112 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)s1 1640238487 RWPLPEFVYDCHPB-IAGOWNOFSA-N 439.585 4.210 10 10 IICE C[C@@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1644258510 DVNHSDPIEYUKOK-FSPWUOQZSA-N 442.437 4.276 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@H](C(F)(F)F)[C@H]1C 1653473467 FLKODDRFLSGDND-VLXJIEOASA-N 430.426 4.062 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC[C@H]1CCN(C(=O)OC(C)(C)C)C1 1691667839 BRSHYRWWMVOOJB-GOSISDBHSA-N 443.592 4.391 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCS[C@H](C)[C@@H]1C 1693005550 JIAZSKQLCFSITB-RBUKOAKNSA-N 436.629 4.017 10 10 IICE CCCCN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1709616839 RNYOMVXQNGZFEG-UHFFFAOYSA-N 435.620 4.197 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1712725474 AEGQZYQFXOVILQ-SFHVURJKSA-N 425.602 4.331 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1C1CC(C(C)(C)C)C1 1729419332 RZRHOLFPBSSXHT-UHFFFAOYSA-N 434.544 4.265 10 10 IICE CCC(C)(C)Cn1c(-c2cccn2C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1752495887 KWXWIZIIFLVGQY-UHFFFAOYSA-N 440.567 4.194 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C1CC(C(C)(C)C)C1 1767769755 KLYRMGFLEOPTMY-UHFFFAOYSA-N 441.620 4.285 10 10 IICE CN(c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1)[C@@H]1CCSC1 1768556826 KBLWHPDXXYHMJA-CABCVRRESA-N 425.649 4.100 10 10 IICE CCCN(CCC)C(=O)Cn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@H]21 1860347564 XUWUULSWVAALAJ-SANMLTNESA-N 444.579 4.437 10 10 IICE CCOC(=O)c1c(NC(=O)CCCN)sc(C)c1-c1ccc(Br)cc1 1865915680 RPQJLEIFMIMNHY-UHFFFAOYSA-N 425.348 4.340 10 10 IICE COc1ccc([C@@H](n2nc(C(F)F)c(C(=O)O)c2Br)C2(C)CC2)c(O)c1 2079861660 KYTVRRLTBJVWLA-CYBMUJFWSA-N 431.233 4.385 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)cc1OC 2296885345 QBNSGDJZETWEAT-UHFFFAOYSA-N 442.562 4.324 10 10 IICE Cc1ccc(CNC[C@H]2[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)c(O)c1Br 2352944277 FXUZSQWHUKZVRG-JYJNAYRXSA-N 425.367 4.056 10 10 IICE CCc1ccc(C(=O)NC[C@@H](c2ccco2)N2CCN(c3ccc(OC)cc3)CC2)cc1 38605907 MFFKOGKJFGFAOQ-DEOSSOPVSA-N 433.552 4.144 10 10 IICE CCOc1ccc(-c2ccc(/C=C3/C(=N)N4N=C(CC)SC4=NC3=O)o2)c([N+](=O)[O-])c1 96475682 OLXYSUYSSFDMFU-LCJGLDDCSA-N 439.453 4.283 10 10 IICE COc1ccccc1OCCCOc1ccc(/C=C2\C(=N)N3C=CSC3=NC2=O)cc1 103703971 WGGSFCJGPWPFCM-LHKJMMSFSA-N 435.505 4.320 10 10 IICE Cc1c(/C=C2\SC(=S)N(CC(=O)O)C2=O)c2ccccc2n1Cc1ccccc1F 207527480 CVFZRLVJHFLQET-GRSHGNNSSA-N 440.521 4.423 10 10 IICE Cc1cc(/C=C\C(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)c(C)n1-c1ccccc1 208114520 CFQBEDMHVMDUSU-CRAWXWEASA-N 442.607 4.212 10 10 IICE CC[C@@H](NCC1(O)CCN(Cc2ccccc2)CC1)c1cc(Br)ccc1O 397518949 UOFIEWMXXOVJCG-HXUWFJFHSA-N 433.390 4.223 10 10 IICE CCNC(=O)c1ccc(C)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435554339 OSVRBXJJXLIZSB-UHFFFAOYSA-N 432.568 4.105 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742801284 OUWUIFDUQIRTHC-YWMUFLPLSA-N 443.494 4.281 10 10 IICE CN1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 754857852 IMIXJEMMURQCDS-FCHUYYIVSA-N 428.939 4.100 10 10 IICE O=S(=O)(/C=C/c1ccc(Br)cc1)NCc1cccc(Br)c1O 766201921 XVKRZUKLHARCPP-CMDGGOBGSA-N 447.148 4.008 10 10 IICE O=C(Cc1cc(C(F)(F)F)cc(Cl)n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 788663887 ZOCJPQMWYWTJMZ-INIZCTEOSA-N 428.838 4.210 10 10 IICE C[C@H](Cn1ncc2ccccc21)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 790574263 KFZSIRKHZGNDND-SJLPKXTDSA-N 428.483 4.059 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1c[nH]nc1-c1ccc(F)cc1 917380614 HMXUNTQMZVMALC-UHFFFAOYSA-N 448.420 4.001 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)N1CCCN(c3ccc(OC)cc3)CC1)O[C@@H](C)C2 917821399 GQJBHNUVLXYAOB-LFIXQJEJSA-N 436.552 4.169 10 10 IICE Cc1cc(I)cc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1124551482 WMHPTHZXZWZWTE-UHFFFAOYSA-N 434.321 4.472 10 10 IICE Cc1ccc(C(=O)N2CC(OC(=O)Nc3cccc(F)c3)C2)cc1-n1c(C)cc(C=O)c1C 1138275968 MZONGHUWRBBLTB-UHFFFAOYSA-N 449.482 4.427 10 10 IICE CCOC(=O)CCN(C[C@H]1CCCN1CC)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1142138085 KTHGVIBAGFKVDK-HSZRJFAPSA-N 439.600 4.282 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccc(C)o1 1148739514 AOFJGHLIYZKGOD-KRWDZBQOSA-N 432.318 4.271 10 10 IICE C[C@H](NC(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1)c1ccccc1O 1151892617 UEZOSEAPGQOFRE-LBPRGKRZSA-N 429.270 4.491 10 10 IICE CSc1nc2ncn(CC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)c(=O)c2s1 1188635850 VRVNBIUXQPSJFJ-UHFFFAOYSA-N 438.578 4.482 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCCCCCNC(=O)OC(C)(C)C)C2)cc1 1230859187 TTZVYTCFGYUGKS-LJQANCHMSA-N 448.608 4.000 10 10 IICE CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1264689250 NRDLHSGDVMZMEF-GASCZTMLSA-N 444.938 4.233 10 10 IICE CCc1nnc(N2CCC(C)=C(Br)C2)n1Cc1ccc2c(c1)CCCN2C 1292931827 BGTHRVPVAAWLIW-UHFFFAOYSA-N 430.394 4.150 10 10 IICE CCc1nnc(N2CCC[C@H](OC(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1293045122 RDCBDDPEURBAFA-NRFANRHFSA-N 443.661 4.226 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)COc1ccc(I)cc1 1297004901 CGCUFBGJYFGHKP-UHFFFAOYSA-N 439.293 4.205 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCOC[C@@H]2c2cc(F)cc(F)c2)cc1 1300860454 KRWPVEAGTGTJJB-XMMPIXPASA-N 438.474 4.327 10 10 IICE Cc1cc(CCNC(=O)NC[C@](C)(O)c2cccc(Cl)c2)c(C)n1-c1ccccc1 1313100939 PEHAZSQANYHVRZ-DEOSSOPVSA-N 425.960 4.497 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1[C@H]2CCCC[C@H]2CCN1C(=O)OC(C)(C)C 1435285132 BKXCCMIFWCPZFN-JLMWRMLUSA-N 443.588 4.294 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1440664372 IQAAZLFUNONTOB-UUFSLDAJSA-N 439.987 4.459 10 10 IICE Cc1ccc(C(=O)NCCCc2ccc3c(c2)OCCO3)cc1-n1c(C)cc(C=O)c1C 1446135089 BJTOXLCDZMPQGE-UHFFFAOYSA-N 432.520 4.349 10 10 IICE Cc1csc(C(C)(C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1456263037 HTGVJUJCKSVTKN-GDNBJRDFSA-N 449.598 4.233 10 10 IICE CCOc1ccc(N2CCN(CCC(=O)Nc3c(C)nn(-c4ccccc4)c3C)CC2)cc1 1459799584 XVXBZFCHWLLUDQ-UHFFFAOYSA-N 447.583 4.039 10 10 IICE CCOC(=O)CN(CC(=O)N[C@H](CC(C)(C)C)c1ccc(F)cc1)Cc1ccccc1O 1460281456 YVXOSMPZAKGZND-OAQYLSRUSA-N 444.547 4.190 10 10 IICE CCN(Cc1nc2c(s1)C[C@@H](C)CC2)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1470772337 JRMSQPLPQWZWNR-IRXDYDNUSA-N 428.602 4.087 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3Cc3ccncc3Cl)CC2)cc1 1504292315 KZGKKZDPRDNPSQ-UHFFFAOYSA-N 440.979 4.224 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)cc2C)C1 1504480275 DGNHCBZLDMYRCO-FQEVSTJZSA-N 440.979 4.031 10 10 IICE CCOC1(Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCCC1 1516219318 FGWHUBBUPRYMNL-UHFFFAOYSA-N 441.620 4.476 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CCC[C@@H]3C)CC2)cc1F 1518307503 DPDKQJHFJAJYOI-ZWKOTPCHSA-N 429.584 4.486 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCCc1ccccc1F 1520243366 KUPOTLXCOCOTGT-XMHGGMMESA-N 446.544 4.305 10 10 IICE Cc1oc(Br)cc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1526003853 UCXGRELXQZLIQD-VXGBXAGGSA-N 425.298 4.033 10 10 IICE COC(=O)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1Cl 1527055462 BDXINSWUCKXKLH-UHFFFAOYSA-N 439.943 4.487 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cc(Cl)c3O)cc2F)C[C@@H](C)O1 1542113299 UEILTRZNJZYFIR-TXEJJXNPSA-N 427.303 4.382 10 10 IICE Cc1ccccc1Cc1nnc(N2CCC(CO)CC2)n1CCCSc1nccs1 1542746112 OHBDTADNZZPFHD-UHFFFAOYSA-N 443.642 4.025 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCS1 1545538237 XXFQMEJVHSPKBE-WMZOPIPTSA-N 433.597 4.162 10 10 IICE CCc1cc(=O)oc2c(CN(CCCOC)C[C@H]3CCCN4CCCC[C@@H]34)c(O)ccc12 1565539157 TYHDYQQWUXVKAV-OFNKIYASSA-N 442.600 4.164 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCc3nn(C)cc32)c(C)n1-c1cccc(Br)c1 1568147168 LYZLECHFUGXXHV-IBGZPJMESA-N 427.346 4.398 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(-c4noc(CC(C)(C)C)n4)cc3)C2)cc1 1587114544 SSIYIYNHDZJKEV-IBGZPJMESA-N 434.540 4.343 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CC(c4ccc(Cl)cc4Cl)=NO3)CC2)cc1 1596965228 WYOVIQJYPKXGSA-OAQYLSRUSA-N 448.350 4.234 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(Oc3ccccc3)CC2)NC(=O)OC(C)(C)C)cc1 1618252243 BTRDKYFCFUUGOD-NRFANRHFSA-N 439.556 4.046 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1)OC 1619593564 KODIVOLJPIWAIR-GCJKJVERSA-N 437.588 4.250 10 10 IICE COc1ccccc1[C@@H](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)N1CCCC1 1623951579 ZFXDJVAQUNGWOB-RUZDIDTESA-N 445.563 4.482 10 10 IICE CCc1ccc(O)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1624313921 ZUKFFJOEQUKTHX-LDADJPATSA-N 430.526 4.324 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)CC(=O)N(C)[C@H](C)c2ccccc2)cc1 1625866358 FKICIGPHRAONQY-HXUWFJFHSA-N 445.563 4.127 10 10 IICE COc1ccc([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cc1 1631305251 CMBUFUSEXBLGTF-OAQYLSRUSA-N 443.341 4.329 10 10 IICE Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1634854632 OIWMADQAMKZDNK-DEOSSOPVSA-N 443.547 4.088 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc4c(c3)nc(C)n4C(CO)CO)c2C)c1 1636591041 OMJJAIKWBLMRDW-UHFFFAOYSA-N 446.551 4.147 10 10 IICE CC1(C)C[C@H](NC(=O)NCc2cc(Cl)ccc2O)CCN(C(=O)OC(C)(C)C)C1 1637518357 CFBVYFPHUNWMTM-MRXNPFEDSA-N 425.957 4.271 10 10 IICE Cc1cc(C(=O)CSc2nnc(NCC(F)(F)F)s2)c(C)n1-c1ccc(F)cn1 1640886182 IHYTVGKNWLLRIU-UHFFFAOYSA-N 445.467 4.429 10 10 IICE Cc1cc(C(=O)N2CCO[C@@](C)(C(F)F)C2)c(C)n1-c1cccc(Br)c1 1641017818 UAHBBDRUXBBGCN-LJQANCHMSA-N 427.289 4.353 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC/C=C\c3ccc(Br)cc3)C2)cc1 1673024856 JEPUUEAIZWKKKL-LHRDXKRPSA-N 444.373 4.297 10 10 IICE CCC(CC)NC(=O)c1nnc(N(CC)C2CCCC2)n1Cc1ccc(N(C)C)cc1C 1708710082 BSWHZXHBBIJPHF-UHFFFAOYSA-N 440.636 4.388 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)cc1C 1743641182 LBXIMQRXLFHPHV-GCJKJVERSA-N 425.621 4.467 10 10 IICE CC(C)(C)c1ccc(C(=O)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1859466068 DADJLTRUICEUNI-UHFFFAOYSA-N 440.499 4.128 10 10 IICE CC[C@H](C)NC(=O)CCn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@H]21 1860344775 FRQWZLINBHMOCN-GKVSMKOHSA-N 430.552 4.093 10 10 IICE COC(=O)c1c(NC(=O)[C@H](N)Cc2ccc(O)cc2)sc(C)c1-c1ccc(C)c(C)c1 1866018354 VDBSJLHIPULHTG-LJQANCHMSA-N 438.549 4.341 10 10 IICE CC(C)(C)OC(=O)N1CCC(=O)[C@@H]1c1cc(Br)cc(Br)c1O 1951860784 NHXJWZKJRIFAIV-LBPRGKRZSA-N 435.112 4.168 10 10 IICE CC1=NN(c2ccccc2)C(=O)C1=Cc1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 2040490672 QBRGKQUDIIQIBO-UHFFFAOYSA-N 425.444 4.474 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cc(Cl)cc(Br)c2O)COC1(C)C 2103037938 MKKCSJQHJXERHD-CYBMUJFWSA-N 449.773 4.270 10 10 IICE CC[C@H](NCCC1(OC)CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2167024544 YFTNLWGSBNWLLL-INIZCTEOSA-N 443.382 4.221 10 10 IICE CCCCN1C(=O)NC(=O)C(=Cc2ccc3c(c2)CCN3Cc2ccccc2Cl)C1=O 2296946586 XWKMFOXWIQEBNY-UHFFFAOYSA-N 437.927 4.165 10 10 IICE N=C1C(=Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C(=O)N=C2SC(c3ccco3)=NN12 2297358339 RNGNUINCWXTCOY-UHFFFAOYSA-N 433.405 4.115 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3ccc(F)c(F)c3)SC2=S)N(C)C)cc1 2323879830 JSUDTCJEPHCMEG-SFHVURJKSA-N 434.533 4.478 10 10 IICE COC(=O)CN1C(=O)S/C(=C\c2cc(C)n(-c3cccc(Br)c3)c2C)C1=O 1018597 YSYCXBDNUDWPON-PXNMLYILSA-N 449.326 4.066 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459462 WYXNXVSMICNEOM-FHAGJXEFSA-N 435.568 4.299 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 15036311 KDSBYGXAMWLLPJ-DHDCSXOGSA-N 433.898 4.088 10 10 IICE COC(=O)c1ccc(/C=C2\N=C(c3ccc(OC)cc3)N(c3ccc(O)cc3)C2=O)cc1 33304254 NNGIUJHZPMDTMW-JCMHNJIXSA-N 428.444 4.022 10 10 IICE CCN(C(=O)c1cc(Br)ccc1I)c1ccc(N)cc1 233444107 QGGVJSUUFZFOJI-UHFFFAOYSA-N 445.098 4.303 10 10 IICE C[C@H](c1ccccc1)N(CC(=O)NCc1cnn(-c2ccccc2)c1)Cc1ccccc1O 776004380 ORSWGZPTMLRSKC-OAQYLSRUSA-N 440.547 4.458 10 10 IICE Cc1cc(-c2nnc(COC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)o2)c(C)o1 785017837 HULIYSVCEVYMBO-UHFFFAOYSA-N 448.523 4.411 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H]2CCC3(CCOCC3)[C@H]2O)cc1 802244423 URBGUTCRFCHHNR-JPYJTQIMSA-N 436.556 4.466 10 10 IICE CS(=O)(=O)c1cccc(Br)c1N1CC=C(c2ccc(Cl)nc2)CC1 804591434 OGIMUZPGAFOPPO-UHFFFAOYSA-N 427.751 4.195 10 10 IICE CC(=O)NCC(C)(C)C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1124852960 KHDNBILLOLUIEC-UHFFFAOYSA-N 428.533 4.458 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(NC(=O)C(C)C)cc2)CCCC1 1124919226 XMHSTXQVTNQFSQ-UHFFFAOYSA-N 433.552 4.440 10 10 IICE Cc1cc(C(F)(F)F)nn1CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1128385417 WPXSNYCTGBUDLY-CYBMUJFWSA-N 428.886 4.416 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1136546713 TVGNVNPDHATIBO-KRWDZBQOSA-N 438.906 4.312 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCC(=O)Nc1nnc(C2CC2)o1 1152400602 CHMYLIIXPHTOHE-MRXNPFEDSA-N 434.496 4.161 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CN(C)c2nc3ccccc3s2)cc1 1163901565 LBYFKTAGSJWQKK-UHFFFAOYSA-N 436.503 4.390 10 10 IICE O=C(OCc1ccccc1)N1CCC(CN(Cc2ccccc2O)C[C@@H]2CCCO2)CC1 1167983447 MASGHDAWSGVQML-DEOSSOPVSA-N 438.568 4.422 10 10 IICE COc1cccc([C@@H](NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c2nccn2C)c1 1168599882 YAUYZTZSKTYCEI-RUZDIDTESA-N 428.536 4.285 10 10 IICE COC(=O)c1cnc(Sc2c([N+](=O)[O-])cnc3cc(Br)ccc23)s1 1186557292 VDGVPEJDOFMHCL-UHFFFAOYSA-N 426.273 4.300 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)[C@@]4(C)CCCS4(=O)=O)n3)c2C)cc1 1264176206 QFIZRFZMKWJYEH-JOCHJYFZSA-N 443.594 4.432 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cc2ccc(NC(=O)C(F)(F)F)cc2)cc1F 1293225335 QSABUTVQQYDZHH-UHFFFAOYSA-N 425.426 4.032 10 10 IICE CC1(C)CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1303965099 MBGGBIILEYKPLK-UHFFFAOYSA-N 439.648 4.459 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CC(=O)N(c3cccc(F)c3)C2)cc1 1350076788 MKUGAHOPMFQGRH-LJQANCHMSA-N 435.499 4.067 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@H](C2CCCC2)C1 1436907629 CSCAOKJUXZJIHS-AMRJIULGSA-N 432.586 4.456 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)CCc3nccc(C(F)(F)F)n3)ccc21 1440057946 IJAUKVGOFXIVFH-UHFFFAOYSA-N 434.462 4.028 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1 1448835766 CKDIZXLDFZYQNK-HRAATJIYSA-N 439.556 4.424 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 1452948192 VOBRUBKTEWLJIG-MRXNPFEDSA-N 427.715 4.273 10 10 IICE CC(C)(C)OC(=O)[C@]1(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1(C)C 1456077752 RCFVFRDPMXLGRD-HSZRJFAPSA-N 438.515 4.131 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)NCc1ccc(N2CCSCC2)cc1 1464260667 NWQICFLMUJYEHH-UHFFFAOYSA-N 444.963 4.456 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](C)C[C@H]2[C@H](C)O)sc(C)c1-c1ccccc1 1473390021 BAJCDVAAZALRIE-BXWFABGCSA-N 444.597 4.320 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1509160085 LWEMCVZLJFFUHB-HXUWFJFHSA-N 443.611 4.373 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2cc(F)ccc21 1530400449 SCXWLIAEQQMWCZ-WQRHYEAKSA-N 430.501 4.145 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC[C@H](OCC2CC2)C1 1542226713 GVYUHUICOSXJHC-QHCPKHFHSA-N 425.621 4.295 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1546864969 CKBTZEKMYUZIOO-SFHVURJKSA-N 436.604 4.361 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N(c1ccccc1)C1CCC1 1557732658 SPWYERBRVWZFDC-UHFFFAOYSA-N 428.535 4.454 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(Cl)ccc1O 1566639373 VRCQKSXNZZLTHJ-SXGWCWSVSA-N 436.917 4.415 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CNC(=O)Nc1cccc([N+](=O)[O-])c1 1566846400 UUQXFZDPBCPXBP-QGZVFWFLSA-N 448.479 4.212 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(OCc3csc(C)n3)c2)cc1 1585444758 TVPMBPPEIXGDII-UHFFFAOYSA-N 425.554 4.248 10 10 IICE CCOc1ccccc1N1C[C@@H](C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1=O 1587881108 SECVGMMAEICVKL-QFIPXVFZSA-N 445.563 4.471 10 10 IICE Cc1nccn1CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1612451373 WLPHVHRBNQMUEN-UHFFFAOYSA-N 435.620 4.308 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1615380555 CLIPFYYCPYYEAL-DHIUTWEWSA-N 441.620 4.275 10 10 IICE C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623550328 YKKYCXOCZTZPRI-OAHLLOKOSA-N 434.367 4.371 10 10 IICE Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1F 1626479670 LWCTVBHYOQHTNT-UHFFFAOYSA-N 441.381 4.182 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2cc3n(n2)CCCC3)c(C)n1-c1ccc(Br)cn1 1628005178 BCQSBNRJYXHFHA-CQSZACIVSA-N 442.361 4.275 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)cc1 1628519170 SZUHMNSZVMDGOS-UHFFFAOYSA-N 427.508 4.396 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)c1ccccc1 1633061434 GMGMEBPEBXBEHT-SANMLTNESA-N 432.520 4.157 10 10 IICE Cc1ccc(C(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1633624323 PCKOUNQONDJBCP-RUZDIDTESA-N 439.556 4.344 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c[nH]c4cccc(Br)c34)CC2)cc1 1636702705 YWSGIVLIGREBRJ-UHFFFAOYSA-N 428.330 4.292 10 10 IICE CN(C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cccc2cccnc12 1639291949 GXPSLLWICRSDLQ-UHFFFAOYSA-N 439.518 4.079 10 10 IICE COC(=O)/C=C/c1ccc(N2Cc3cc(Br)ccc3C[C@H]2C)c([N+](=O)[O-])c1 1642548715 WRTPUJCCOONCPB-FLUIGGAXSA-N 431.286 4.495 10 10 IICE Cc1cc(C(=O)CN2C(=O)c3ccccc3C(F)(F)C2=O)c(C)n1-c1ccc(F)cc1 1643844224 JWQZQZFEZHKWCK-UHFFFAOYSA-N 426.394 4.190 10 10 IICE Cn1c(C(=O)NCc2c(O)cccc2F)ccc1[C@@H]1CCCCN1C(=O)OC(C)(C)C 1645050301 GOIABERHCQXSSQ-SFHVURJKSA-N 431.508 4.262 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H]3CC[C@H]2[C@@H](C)C(=O)C3)sc(C)c1-c1ccccc1 1648020219 PTHAQWLGQHUJSK-JLSDUUJJSA-N 440.565 4.281 10 10 IICE COc1ccc([C@H](NC(C)C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 1648435830 WHVPCLLNSYJRHS-DQEYMECFSA-N 439.600 4.008 10 10 IICE Cc1cc(C(=O)N2CCOC23CN(C(=O)OC(C)(C)C)C3)c(C)n1-c1cccc(Cl)c1 1648872858 MGZYDUNCEWQJMF-UHFFFAOYSA-N 445.947 4.167 10 10 IICE CN1CCN(c2ccc(CNc3cc(C(F)(F)C(F)(F)F)ncc3[N+](=O)[O-])cc2)CC1 1652170939 BDWPSFKQJQUFAC-UHFFFAOYSA-N 445.392 4.008 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCc3ccccc3SC(F)(F)F)cc2)CC1 1683702099 WMUMJWGWBROZTF-UHFFFAOYSA-N 438.519 4.050 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 1684387504 ZYMLPJMAJAVXLT-HXUWFJFHSA-N 430.593 4.074 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCCO1 1696411663 YDWYLJWFPNSPIV-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)CC[C@H]1C 1696998547 SIHCCZKSOKBSEH-ZWKOTPCHSA-N 434.588 4.114 10 10 IICE COC[C@@H]1CCN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C1 1730577218 LAUQNMPYRNXFNO-QGZVFWFLSA-N 447.605 4.120 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CC[C@H](C)C1 1741434570 ZBCJJPYOTIHLSN-UNMCSNQZSA-N 425.621 4.386 10 10 IICE CCOC(=O)c1c(NC(=O)C2CCN(C(=S)NC)CC2)sc(C)c1-c1ccccc1 1860633494 QJMWVQRJQDRGLU-UHFFFAOYSA-N 445.610 4.055 10 10 IICE COC(=O)c1c(NC(=O)c2cc(=O)c3cc(O)ccc3[nH]2)sc(C)c1-c1ccccc1 1866481829 PVELMMBORMKOAW-UHFFFAOYSA-N 434.473 4.310 10 10 IICE CC[C@@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccccn2)C1=O 1873168039 HFHDUMYNTPXXHD-QGZVFWFLSA-N 428.536 4.157 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(Br)cc2O)C(F)(F)CC1 1967846683 OWCNUXDYMVZRTC-HNNXBMFYSA-N 435.309 4.279 10 10 IICE CCN(CC)c1ccc(C=C2SC(N3CCN(Cc4ccccc4)CC3)=NC2=O)cc1 2053498715 RAMAIAWJSLEKAH-UHFFFAOYSA-N 434.609 4.321 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C(F)F)c(CO)c2I)c(O)c1 2079061957 HNRLJINTLCJOPL-AWEZNQCLSA-N 436.240 4.177 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CC[C@@H]2NCc1cc(Br)cc(F)c1O 2088574241 VLVXZYIMYWCEQV-XPKDYRNWSA-N 429.330 4.171 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)C1=Cc1cc(Br)cs1 2294106429 QGKBRZMEMYDXKK-UHFFFAOYSA-N 446.109 4.484 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)C1=CNC1=CC=C[C@@H]2C(=O)c3ccccc3C(=O)[C@H]12 2297511512 AAUDKFJWTSXTGY-URXFXBBRSA-N 437.499 4.265 10 10 IICE COc1ccc(N2CCN(C=Cc3ccc4c5c3C(=O)C(=O)N5C(C)(C)C=C4C)CC2)cc1 2297660683 AJOIZMOUDPXJFD-UHFFFAOYSA-N 443.547 4.213 10 10 IICE CCCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2[N+](=O)[O-])SC1=S 2314769876 WLQHPQYQYIHBGN-SFHVURJKSA-N 442.518 4.491 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)ccc1OCCC(=O)O 2314931341 FLXVXJHXGQQBEA-UHFFFAOYSA-N 433.482 4.094 10 10 IICE CCC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352637293 QJNRULRSIAXKIA-LJQANCHMSA-N 429.355 4.163 10 10 IICE CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C1\C(=O)N(Cc2ccccc2)c2ccccc21 105035808 BQSVPWABLRJMPT-FCQUAONHSA-N 437.455 4.108 10 10 IICE CC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C/c1ccc(-c2ccc3c(c2)C(=O)OC3)o1 208873882 BUNBCDJWRDZBPF-YBFXNURJSA-N 428.400 4.121 10 10 IICE COc1ccc(N2CCN(CCCNc3ncc(C(F)(F)F)cc3Cl)CC2)cc1 302639216 WVBQATAAWGPKJV-UHFFFAOYSA-N 428.886 4.387 10 10 IICE COCCCOc1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435512694 YIXWDHPIKUPZOP-UHFFFAOYSA-N 435.568 4.462 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cc(OC)ccc3OC)[C@@H]2c2ccc(O)c(O)c2)c1 526226034 BXELESJLCYQYSS-HSZRJFAPSA-N 449.459 4.181 10 10 IICE CCOC(=O)c1ccccc1N1C(=O)C(O)=C(c2ccc(F)cc2)[C@@H]1c1ccc(O)c(O)c1 526524680 DJMHWDOIQXVJOX-QFIPXVFZSA-N 449.434 4.471 10 10 IICE CCc1c(C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)[nH]c(C)c1C(N)=O 748363914 HVTIQHDAZNBVBV-UHFFFAOYSA-N 433.468 4.195 10 10 IICE COc1ccc(N2CCC(NC(=O)Nc3ccc([S@@](=O)C(F)(F)F)cc3)CC2)cc1 750617525 KMIMZSIVMBEMEK-SSEXGKCCSA-N 441.475 4.113 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCCO3)n2C[C@@H]2CCOC2)c(C)n1-c1ccccc1 752832303 FGFGDXVJBSXVGY-UNMCSNQZSA-N 435.572 4.004 10 10 IICE CN1CC[C@@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 754842987 WNNHPHZPKIMWDU-FGZHOGPDSA-N 430.955 4.324 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@@H](NC(=O)c3ccc4ccccc4c3)C2)cc1 755865107 BJUZHDNOYKGBJN-HSZRJFAPSA-N 430.552 4.010 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2/SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)cc1 764884857 HTHHQVXIDQLQIR-SFQUDFHCSA-N 440.546 4.147 10 10 IICE CCN(CC)C(=O)c1cccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 766740872 RKBFVNUJVINKJK-UHFFFAOYSA-N 447.579 4.495 10 10 IICE COC(=O)C(C)(C)[C@@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 767146198 VZKZHHHOVOKJKF-IRLDBZIGSA-N 440.540 4.023 10 10 IICE C[C@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)ccc1O 797101480 FEOVKYDIJMBKIY-NSHDSACASA-N 426.742 4.092 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCC[C@H]1C(F)(F)F 813043015 ZXDAEBQYJGQAQH-AEFFLSMTSA-N 431.474 4.049 10 10 IICE COc1ccc2c(c1)c1c(n2Cc2nc(C3(NC(=O)OC(C)(C)C)CC3)no2)CCCC1 904989987 YBPCJJZIMAVCIF-UHFFFAOYSA-N 438.528 4.474 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 1084408107 UOGKBCUNAPOTBH-GZTJUZNOSA-N 437.795 4.175 10 10 IICE CN(C)c1ccc(CN(C(=O)c2c3ccc(Br)cc3nn2C)C2CC2)cc1 1124836115 QIYSXPJAMWBBMC-UHFFFAOYSA-N 427.346 4.207 10 10 IICE Cc1ccc(Br)c(C)c1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549704 RZESLZZZIIILNV-UHFFFAOYSA-N 439.300 4.111 10 10 IICE CC(C)(C)c1coc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 1134762451 KECBDDLCDYRCNV-UVTDQMKNSA-N 449.623 4.331 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)cc1 1136185270 TYICLNBGWNHPJW-UHFFFAOYSA-N 435.480 4.446 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C1 1146709481 KLJZMJAMENJFGJ-HDICACEKSA-N 439.556 4.377 10 10 IICE COc1ccc(N(C)C[C@H](NS(=O)(=O)c2ccc(C)cc2)c2ccccc2)cc1OC 1190673945 NAXRSXVHOJLYDI-QFIPXVFZSA-N 440.565 4.168 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Nc4nccs4)cc3F)CC2)cc1F 1294824123 QTZAOACRYSILBY-UHFFFAOYSA-N 430.480 4.136 10 10 IICE O=C(NCc1c(O)cccc1F)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 1303877448 DMDWTBKBXOCZFN-UHFFFAOYSA-N 443.272 4.476 10 10 IICE COC(=O)[C@@H](Cc1ccc(OC(F)(F)F)cc1)NCc1cc(Cl)cc(C(C)=O)c1O 1308054042 DPSNQMNJAFOBGX-QGZVFWFLSA-N 445.821 4.021 10 10 IICE COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1313414820 NSUUSTGLZSUCSE-HYBUGGRVSA-N 438.616 4.343 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2scnc2C)cc1 1313678268 GIEUPBGCIYICSY-HXUWFJFHSA-N 440.617 4.425 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4cccs4)nc3C)cc2F)CC1 1352959231 BQHFIYOXGWDHLF-UHFFFAOYSA-N 438.572 4.330 10 10 IICE CC(C)C[C@@H](Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)N(C)C 1359767858 PDOKOEJQJDQNHD-QHCPKHFHSA-N 449.647 4.486 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CC(=O)N(c2cccc3ccccc23)C1 1436853480 LMNHVYMWTYGBJX-KNQAVFIVSA-N 429.564 4.315 10 10 IICE Cc1noc2ncc(NC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)cc12 1442699582 XQPMDGBMGSWIDZ-UHFFFAOYSA-N 426.274 4.349 10 10 IICE Nc1c(Cl)cc(Cl)cc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1446238161 AAFGGTCAORLWII-UHFFFAOYSA-N 433.383 4.038 10 10 IICE CC[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)/C=C/c1cncc(C(=O)NC)c1 1458252711 LZZQJKNJYVTPHI-FQTAANOTSA-N 432.568 4.203 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H]1C[C@@H](OCC)C1(C)C 1459521438 BEYYVAONJMCWHW-DHIUTWEWSA-N 448.563 4.316 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)Cn3ncc4ccc([N+](=O)[O-])cc43)cc2Cl)C1 1459579289 MEBDPWWXTOIZPK-HNNXBMFYSA-N 441.919 4.151 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H](Cc2ccncc2)NC(=O)OC(C)(C)C)cc1 1463776352 KAXBKMZPJIQXNI-QFIPXVFZSA-N 440.588 4.022 10 10 IICE Cc1c(C(=O)NCc2ccc3cccnc3c2O)cnn1-c1ccc(Br)cc1 1469248354 GWTNINCGQWYUJI-UHFFFAOYSA-N 437.297 4.127 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N3CCC(CCc4ccc(C)cc4)CC3)CC2)cc1 1473296895 UBWXDGLEBCFKKQ-UHFFFAOYSA-N 449.639 4.387 10 10 IICE CCN(Cc1ccc(Cl)s1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478785930 BNPXUFRJYIYLDY-UHFFFAOYSA-N 429.920 4.248 10 10 IICE COC(=O)N(C)Cc1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1529220883 NODSZWMHGIAXGH-UHFFFAOYSA-N 435.524 4.366 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCCCOc3ccc(Br)cc3)C2)cc1 1532106098 QOEMVUPHSAEGNH-GOSISDBHSA-N 447.373 4.402 10 10 IICE COc1ccccc1Cn1cnc2cc(C(=O)NCc3ccc(N(C)C)c(F)c3)ccc21 1535620492 YQPMFOHXKNBSOZ-UHFFFAOYSA-N 432.499 4.228 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cn(Cc2ccc(Cl)cc2Cl)nn1 1536550342 PTJJYAJERGMJCD-HNNXBMFYSA-N 446.382 4.369 10 10 IICE Cc1ccn([C@H](C)CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1539360615 DDJOTWKANOQWRG-CQSZACIVSA-N 439.317 4.254 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS(=O)CC1 1541251675 ILPWOYVDYDEMQJ-UHFFFAOYSA-N 437.613 4.278 10 10 IICE CC[C@@H](CO)N(Cc1ccccc1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1546080093 ADRRYRBWWQAYGE-QFIPXVFZSA-N 433.596 4.208 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1 1555333881 HWFBIZZGNPQGFZ-FQEVSTJZSA-N 434.588 4.016 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCO[C@H](C)C1 1555510240 FXQRIOIPBPETJO-CTNGQTDRSA-N 437.588 4.250 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCCNC(=O)/C=C\c3ccccc3)c2C)c1 1564646589 JWHAIWIIZPDXIU-YPKPFQOOSA-N 444.579 4.421 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccn(-c4ccccc4C(F)(F)F)n3)C2)cc1 1584444480 PHNKSXSIXZHUDH-MRXNPFEDSA-N 444.457 4.156 10 10 IICE CC[C@](C)(NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2)C(N)=O 1585333955 OCLHQIBCUYHWHI-ANQUPQIBSA-N 442.563 4.171 10 10 IICE CSc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccn1 1587778270 MPRPJAKXWXVRIH-XNTDXEJSSA-N 433.555 4.173 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C 1613364729 TVJBNTKLBVYZEG-SOLBZPMBSA-N 429.586 4.374 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CCN(C(=O)OC(C)(C)C)C1CC1 1617937327 JGLGCYYHYGWHRN-UHFFFAOYSA-N 443.592 4.317 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN([C@H](C)c3ccccc3F)C2=O)c(C)n1-c1ccccn1 1624785428 XGXLYCYBLOUBIL-VGSWGCGISA-N 434.515 4.110 10 10 IICE CN(c1ccc(CNC(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc1)C1CCCCC1 1625905694 ZKMIWQARMAXYON-XMMPIXPASA-N 433.568 4.421 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2coc3cc(O)ccc23)NC(=O)OC(C)(C)C)cc1 1629685618 PSBNJTLHICBYGH-FQEVSTJZSA-N 439.512 4.200 10 10 IICE Cc1cc(C(=O)N2CCO[C@](C)(C(F)F)C2)c(C)n1-c1ccccc1Br 1630010956 GDHZOPYERJEEAP-IBGZPJMESA-N 427.289 4.353 10 10 IICE Cc1cnccc1OC1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CC1 1635239676 JJXNNDMBNXHXRA-UHFFFAOYSA-N 431.536 4.223 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@@H](c4ccc(F)c(Cl)c4)C3)C2)cc1 1636354439 XQWFPGUBVSABQQ-OPAMFIHVSA-N 447.938 4.097 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@]1(C)CC(c2cccc(Cl)c2F)=NO1 1639341184 OYEXSLRPTIWMJT-WNSKOXEYSA-N 431.939 4.484 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](Cc2ccccc2)c2nccn2C)cc1 1640682954 MDVASUYFZGMENE-VWLOTQADSA-N 440.547 4.283 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1c(Br)cnn1C 1643540809 SVJFBYVGSZERNA-UHFFFAOYSA-N 435.347 4.130 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](c3ccc(F)cc3)C3CCCCC3)nc12 1644158104 LSDIHYOSUAMKPW-OAQYLSRUSA-N 426.492 4.162 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)Nc1ncnc2c1cnn2-c1cccc(Br)c1 1650960409 WDXXAHIMNRZTSZ-LBPRGKRZSA-N 440.301 4.032 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(Cl)cc3Cl)CC2)c(OC)c1 1655378403 AKEJSJUBGLUHJG-CQSZACIVSA-N 438.355 4.160 10 10 IICE Cc1cc(CNC(=O)NCC(F)(F)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1681825982 OGAOTSLLSAVHCS-UHFFFAOYSA-N 436.503 4.053 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC(C)(C)c3ccc(Br)cc3)C2)cc1 1683782617 REQGNPTZBVMGGX-KRWDZBQOSA-N 432.362 4.271 10 10 IICE CCc1ccc(N2CCN(C(=O)N[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2)cc1Cl 1683944992 OJIGFGSBNBSWBZ-LJQANCHMSA-N 442.991 4.022 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1696206657 ONXTVFORBSNSJR-FSSWDIPSSA-N 441.620 4.192 10 10 IICE Cc1cccc(OCc2nnc(Nc3cnn(C)c3)n2CCCSc2nccs2)c1 1724554794 AZENXLDPUUBEHC-UHFFFAOYSA-N 441.586 4.282 10 10 IICE C[C@H]1CCC[C@H](N(C)c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)C1 1726527735 XPFAZXMZZCWOID-IRXDYDNUSA-N 448.662 4.054 10 10 IICE C[C@H]1COCCN1c1nnc(-c2ccccc2Cl)n1CCCSc1nccs1 1752411057 JWBKJTSQFJKNHF-AWEZNQCLSA-N 436.006 4.463 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@@H]2CCC[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1769957222 WYPQZRKUYLCFFA-NLWGTHIKSA-N 447.599 4.270 10 10 IICE NCc1cnc(Sc2cc(I)ccc2Br)s1 1900779027 FKOFNULNUZZIOI-UHFFFAOYSA-N 427.130 4.120 10 10 IICE O=C(O)C[C@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1 1951418240 IOOKTOLHLKXLKH-MRXNPFEDSA-N 433.460 4.195 10 10 IICE CCc1nn(Cc2ccc(Br)cc2O)c(I)c1CC 2079673706 QVYXDQDIXRGAHJ-UHFFFAOYSA-N 435.103 4.129 10 10 IICE Cc1cc(O)ccc1NS(=O)(=O)c1cc(Br)sc1Br 2089617566 UOKYLOVLRRGRSB-UHFFFAOYSA-N 427.139 4.088 10 10 IICE CN(C(=O)c1ccccc1CCNC(=O)OC(C)(C)C)c1cncc(Br)c1 2180927837 UHGKDHDEBVSNMU-UHFFFAOYSA-N 434.334 4.188 10 10 IICE COc1ccc(Br)c(CN[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)c1O 2236048495 DEYDKDQOOWNIGV-CYBMUJFWSA-N 443.382 4.289 10 10 IICE CC1=NN(c2ccccc2)C(=O)C1=Cc1cn(C[C@H](O)CN2CCCCC2)c2ccccc12 2296673568 WAJAAXUKXQAYFT-HSZRJFAPSA-N 442.563 4.294 10 10 IICE CN(c1ccccc1)N1C(=O)C(=C2C(=O)Nc3ccc(Br)cc32)SC1=S 2297456659 QSPYGQCVBGVSNK-UHFFFAOYSA-N 446.351 4.024 10 10 IICE COc1ccc(C2=N/C(=C\c3ccc(OC)c(OC)c3)C(=O)N2c2ccc(O)cc2)cc1 6627080 GDZYMDXQCBPUJV-STZFKDTASA-N 430.460 4.253 10 10 IICE Cc1cccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)c1 47152307 AMHASEITIXXMAK-MFVBVHDHSA-N 427.507 4.132 10 10 IICE COc1ccc(CCN/C=C2/C(=O)N(c3nc4ccccc4s3)N=C2C(F)(F)F)cc1 105684240 KGFAHWJTXZTHTK-NTCAYCPXSA-N 446.454 4.286 10 10 IICE COc1ccc(N2CCC(NC(=O)COc3ccc(Cl)c4cccnc34)CC2)cc1 110470930 HUZCBPQFGZHMAF-UHFFFAOYSA-N 425.916 4.061 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3n[nH]cc3-c3ccc(Cl)cc3Cl)cc2)CC1 114913594 AGUJNBBXRBXPNM-UHFFFAOYSA-N 444.366 4.065 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(Nc4nc(C)cs4)CC3)ccc21 474812644 URDLXUWNAGFRQN-UHFFFAOYSA-N 426.586 4.386 10 10 IICE CS(=O)(=O)N(Cc1ccccc1Cl)c1cccc2c1C(=O)c1ccccc1C2=O 586186380 VHIOKMSACNSMEX-UHFFFAOYSA-N 425.893 4.082 10 10 IICE CCOC(=O)[C@@H](C(C)C)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 606672027 KWMCGNCXTRKJAY-RNQWEJQRSA-N 428.373 4.238 10 10 IICE O=C(/C=C/c1ccnc2ccccc12)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 735430768 HUGTXOZCPDUAAQ-SOFGYWHQSA-N 441.453 4.420 10 10 IICE CC(C)c1cccc(S(=O)(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 742280213 ORLXDAZFQDSSQJ-UHFFFAOYSA-N 442.503 4.144 10 10 IICE CCOC(=O)c1sc([C@@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)nc1C 757271724 LWPZISTUTFIRET-MRXNPFEDSA-N 432.590 4.375 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(Cc1ccccc1F)C1CC1 769037076 YROYJOZHYHIHCZ-UHFFFAOYSA-N 436.575 4.232 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 775977044 YFUYHAGVTAHYQZ-GOSISDBHSA-N 445.844 4.419 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Nc3nc(-c4ccsc4)ns3)cc2F)C[C@@H](C)O1 790522809 JEZSMYLLEPVCCH-CHWSQXEVSA-N 447.561 4.341 10 10 IICE Cc1nn(C)c(C)c1[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)C(F)(F)F 806388023 MMOIPAVREHUZJA-AWEZNQCLSA-N 425.238 4.152 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCCC[C@@H]2c2nnc([C@H]3CCCO3)o2)c1O 808239791 MRAIFXUBPODVSA-WOJBJXKFSA-N 437.496 4.294 10 10 IICE O=C(NCc1ccc(OCc2ccccn2)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 918231043 CBSQTWJVEOSYIA-DEOSSOPVSA-N 447.535 4.257 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2cccc(CS(C)(=O)=O)c2)c1 1115923515 DSQHRTLPTACPQF-UHFFFAOYSA-N 430.957 4.222 10 10 IICE Cc1ccc(S(=O)(=O)C2(C(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)CCCC2)cc1 1124905400 IFQICRKIWIPYAV-UHFFFAOYSA-N 440.609 4.339 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCOc3ccc(Br)cc3)ccc21 1125520788 OSSDQTROWRRRNT-UHFFFAOYSA-N 445.357 4.476 10 10 IICE CC1(C)C[C@@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2cc(F)ccc2O1 1251751095 VVAMZWUPTABFPF-LJQANCHMSA-N 449.473 4.042 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](Oc4ccc(Cl)cc4)C3)C2)cc1 1252117900 YTEIULQXKSKIRN-VGSWGCGISA-N 429.948 4.038 10 10 IICE COc1ccc([C@H](NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccc2)cc1 1256237094 QRNPUFLHZNFHQU-IZZNHLLZSA-N 446.595 4.453 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCOc3ccc(Cl)cc3)cc2F)CC1 1265012198 RFGOXLRHFFHHBM-UHFFFAOYSA-N 433.955 4.096 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1312741811 UOHJWEGGSWNYTA-ZWKOTPCHSA-N 428.577 4.238 10 10 IICE O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cc2cc(O)c(O)cc2s1 1440635339 KEQXBWJCRYLGJN-UHFFFAOYSA-N 441.387 4.081 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)O2 1442408228 GHUYMJUOUUPTSK-SIBVEZHUSA-N 438.568 4.115 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1 1446814260 FZRDJCNLPHCSHR-NSHDSACASA-N 446.714 4.322 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](Cc1ccccc1)[C@H](O)C(F)(F)F 1455215467 RJVBFFIGLDEBJN-IRLDBZIGSA-N 444.453 4.171 10 10 IICE COc1ccc([C@@H](CNC(=O)OC(C)(C)C)CN[C@@H](C)c2cc(OC)ccc2O)cc1 1459848113 GEWVJCFZRPYHJP-FUHWJXTLSA-N 430.545 4.369 10 10 IICE CCCCN(CC(=O)Nc1cccc(I)c1)Cc1ccccc1O 1460025146 PEVJSOFXLKCRFT-UHFFFAOYSA-N 438.309 4.238 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(Br)cncc3s2)N(C)C)cc1 1463281488 MBHBVNCUQDQKJS-KRWDZBQOSA-N 447.402 4.158 10 10 IICE CC(C)c1ncsc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324381 DIHQEMQRTNCRFJ-KRWDZBQOSA-N 432.590 4.328 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1cc(C(C)C)ccc1C 1466398238 FGMCFIBIHCUPGT-MRXNPFEDSA-N 433.932 4.447 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(=O)[nH]ccc3c2)c(C)n1-c1ccc(Br)cn1 1469953179 JMWAOWRCDATVQZ-UHFFFAOYSA-N 437.297 4.345 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(Cc3ccc(F)cc3)c2C)ccc1N(C)C 1473077202 KUUPITYHGRRKBK-UHFFFAOYSA-N 438.499 4.407 10 10 IICE C[C@H](NC(=O)N1CCC(Oc2ccc(C(F)(F)F)cn2)CC1)c1ccc(N(C)C)cc1 1478470811 JWIXZHHWJUUAHS-HNNXBMFYSA-N 436.478 4.480 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3cc(C)ccc3Br)CC2)cc1 1478837580 UIGMGOHSEQEFBO-UHFFFAOYSA-N 432.362 4.188 10 10 IICE Cc1cccc(C[C@@]2(C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1479343397 HFVLHVBRCMPMCN-HHHXNRCGSA-N 448.611 4.004 10 10 IICE CC(C)(C)OC(=O)[C@@]1(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1(C)C 1524065973 BEYQQQDSLCVPLV-CMJOXMDJSA-N 438.515 4.131 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)c2)c1C 1529404224 ROZWOUZRQFZXBT-FQEVSTJZSA-N 432.568 4.316 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4ccc(F)cc4)c3C(F)(F)F)C2)cc1 1531730323 WQLREJTZWPSOBT-HNNXBMFYSA-N 448.420 4.048 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@H]21 1536550936 VLFHOTJCNBPEBN-HFKLLZPISA-N 427.386 4.457 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2nc3ccccc3cc2Br)N(C)C)cc1 1537482980 KIGKMUXVGLFBPH-FQEVSTJZSA-N 441.373 4.096 10 10 IICE CCOC(=O)c1ccc2c(c1)N(C(=O)c1ccc3c(c1)c(C)c(C)n3CCOC)CCO2 1538604133 CIWFWXMBGLIZSQ-UHFFFAOYSA-N 436.508 4.120 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3ccccc3n2CC(F)(F)F)N(C)C)cc1 1539705603 GJDLPYIYWZNOPU-OAQYLSRUSA-N 432.490 4.302 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3ccnn3)cc2)c(C)n1-c1ccc(Br)cn1 1542708895 VNERHQHLGOIQLR-UHFFFAOYSA-N 437.301 4.085 10 10 IICE Cc1ccc2cccc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)c2n1 1542821822 BFECKVJQSHDRKX-UHFFFAOYSA-N 439.518 4.363 10 10 IICE CCOC(=O)CSc1nnc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)s1 1543598190 SCPSANFBKXJGAT-UHFFFAOYSA-N 430.555 4.162 10 10 IICE Cc1c(Br)cncc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1544529769 LVCRMUYUWKSTMY-SFHVURJKSA-N 432.362 4.040 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)n1[C@@H]1CCCOC1 1544676801 MYVYWJFPZUKWKL-BBTUJRGHSA-N 443.563 4.139 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CCCSC1 1554159603 JBBPIVKNZCUXMT-HXUWFJFHSA-N 443.661 4.192 10 10 IICE O=C(Cc1ccccc1Br)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1566357025 VJBHFNWGAVVBAM-KRWDZBQOSA-N 437.765 4.131 10 10 IICE Cc1cc(C(=O)N2CCO[C@](C)(C(F)(F)F)C2)c(C)n1-c1ccc(Br)cn1 1587657624 KAMGHIUDYQIXJJ-KRWDZBQOSA-N 446.267 4.045 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)CC(F)(F)F)cc1 1615381115 QROZOYYQKXDLFI-UHFFFAOYSA-N 432.494 4.157 10 10 IICE Cc1ccc(C(=O)N2CCCC[C@H]2COC(=O)NC(C)C)cc1-n1c(C)cc(C=O)c1C 1623538213 ROKLJLONIMEKNT-QFIPXVFZSA-N 439.556 4.344 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)c3cc4cc(O)c(O)cc4s3)cc2C1 1625311898 IQROGEWYRHGGDO-UHFFFAOYSA-N 440.521 4.493 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@]2(C)CN(C(=O)OC(C)(C)C)CCO2)c1C 1634097825 ZHFRNYUSZHYRME-VWLOTQADSA-N 441.572 4.158 10 10 IICE COc1ccc([C@H](NC(C)C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 1648435834 WHVPCLLNSYJRHS-RPBOFIJWSA-N 439.600 4.008 10 10 IICE CC[C@]1(C(C)C)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(SC)c3)c2C)C1=O 1652650831 HTYIMZVMQLVFRL-HSZRJFAPSA-N 427.570 4.355 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](NCc3ccccc3)C(F)(F)F)ccc21 1654591713 UVCJGAMEKDOWSV-JOCHJYFZSA-N 447.501 4.355 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCn3c(Cc4ccccc4Cl)nnc3C2)c1O 1654820478 VKTSONJTSIGYDX-UHFFFAOYSA-N 431.323 4.100 10 10 IICE COCCN1[C@H]2CC[C@H]1CC(N(C)C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)C2 1683303875 QXWNYCUIEUIZQP-GOTSBHOMSA-N 438.616 4.186 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3[C@@H]3CCC[C@H](C(F)(F)F)C3)CC2)cc1F 1697471464 BURGCRKMOAVWFH-DOTOQJQBSA-N 441.473 4.354 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(C)=C(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726923147 JGZNQLQEBMPXOZ-QGZVFWFLSA-N 427.568 4.362 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccsc3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1742117192 IOXRYZQZLDINDG-UHFFFAOYSA-N 448.596 4.139 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3Cc3ccsc3)CC2)cc1F 1748849751 XEFRRWUKHAEAPG-UHFFFAOYSA-N 443.592 4.451 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1763291173 RWQNADLGOGVUPO-QAPCUYQASA-N 445.662 4.403 10 10 IICE COc1ccc([N+](=O)[O-])cc1N1C(=O)/C(=C\c2cccc(OC)c2OC)SC1=S 1860083878 AZBPBTSATSATCP-CXUHLZMHSA-N 432.479 4.026 10 10 IICE CCCNC(=O)c1c(NS(=O)(=O)c2cc(Cl)ccc2OC)sc2c1CCCC2 1871343438 MBRSJKCVTJHZRF-UHFFFAOYSA-N 442.990 4.230 10 10 IICE CN(Cc1nccn1Cc1ccccc1)c1ccc(C=CC(=O)O)c(Br)c1 1915071049 DQMDLOQVITYOPS-UHFFFAOYSA-N 426.314 4.428 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cccc(Br)c2O)[C@@H]2CCCC[C@H]21 2122806081 WWTZAYWLLNPKIZ-BHYGNILZSA-N 425.367 4.422 10 10 IICE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cc(Br)ccc2I)CC1 2155565385 VYQOBDGUIFYFER-SNVBAGLBSA-N 449.090 4.359 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)C[C@@]2(C)C1 2172909932 QZNOVLDYDSZTNA-AGKSTNPPSA-N 443.357 4.419 10 10 IICE CCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)c(OCC)c1 2296683288 BOJJLOVEJJCFMF-UHFFFAOYSA-N 428.535 4.030 10 10 IICE CCOC(=O)CCCCCN1C(=O)C(=Cc2ccc(OCC)c(OC)c2)SC1=S 2314754775 BFIYEYDUZTYRNM-UHFFFAOYSA-N 437.583 4.419 10 10 IICE CCCCCCN1C(=O)C(=C2SC(=S)N(CCCC(=O)O)C2=O)c2ccccc21 2314759618 DRKMAZRFCGKLRJ-UHFFFAOYSA-N 432.567 4.050 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)C(=Cc3ccccc3O)SC2=S)cc1 2314827828 NBTJHUJIRNJENQ-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cc(Br)ccc2O)C[C@@H]2CCC[C@H]21 2335107031 HCVSQYFITFEMMP-RRQGHBQHSA-N 425.367 4.422 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2380786151 HSQQQGHNXCMCLJ-HNNXBMFYSA-N 443.382 4.361 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)ccc1OCC(=O)O 16915622 KKMWPSVPRNFSQW-WOJGMQOQSA-N 429.519 4.263 10 10 IICE CCCCc1ccc(N2C(=O)S[C@@H](CC(=O)Nc3cc([N+](=O)[O-])ccc3O)C2=O)cc1 16926398 PVBTXUUJVHCREN-SFHVURJKSA-N 443.481 4.240 10 10 IICE Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C4CCCC4)C3=O)c(NCC(C)C)nc12 33351618 DSBIQHBFNAOKTR-GZTJUZNOSA-N 442.610 4.215 10 10 IICE CCCCOc1ccc(/C=C2\SC(=S)N(CCC(=O)OCCC)C2=O)cc1OC 40888433 PYAUOUGDDKZSOR-JXAWBTAJSA-N 437.583 4.419 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C\c2ccccc2Br)SC1=S 70462959 WFKCIIITTKPPTO-YLQKULKDSA-N 448.363 4.346 10 10 IICE CCOc1cccc(CN2CCC[C@H](COc3ccccc3C(=O)N3CCCC3)C2)c1O 169765161 ZAFOFPGPWWRQES-FQEVSTJZSA-N 438.568 4.318 10 10 IICE COc1ccc2nc(NC(=O)CN3C(=O)/C(=C\c4ccccc4)SC3=S)sc2c1 208741678 VUTUJDHKYGJBRG-CXUHLZMHSA-N 441.559 4.145 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N(C[C@@H]3CCCO3)C3CCCC3)cc2F)C[C@@H](C)O1 749553609 JFYCIUKYUDPMBB-OPYAIIAOSA-N 433.568 4.073 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)C2CCC(=O)CC2)sc(C)c1-c1ccccc1 751677696 FCMREKISDBMPBS-UHFFFAOYSA-N 443.521 4.141 10 10 IICE Cc1cc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)nn1[C@H](C)C1CC1 752863939 MNOVPRYGWTZCBY-LJQANCHMSA-N 436.604 4.016 10 10 IICE CC[C@@H](c1ccccc1)N1CC(=O)N(Cc2ccc(N3CCN(CC4CC4)CC3)cc2)C1=O 761929554 KROAOHJBTZLORF-VWLOTQADSA-N 446.595 4.134 10 10 IICE O=C(CSc1nnc(C(F)(F)F)s1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 780356915 FOMCGPNJCGMTBU-UHFFFAOYSA-N 449.435 4.063 10 10 IICE Nc1ccc(N(C(=O)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)C2CCCCC2)cc1 784059212 GVDFGKGORKFCST-UHFFFAOYSA-N 444.539 4.236 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC([C@@H](F)c2ccccc2F)CC1 804975139 GMQSIYSUJORMAU-HSZRJFAPSA-N 429.511 4.295 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(Br)nc1 810229156 UERWFSIGTNJONV-QGZVFWFLSA-N 429.406 4.227 10 10 IICE CC(C)(C)OC(=O)[C@@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(C)(C)C 1125948371 LFLJENIWRCQPTB-GOSISDBHSA-N 440.531 4.377 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Br)cc3cccnc23)N(C)C)cc1 1134882866 WCCRJGBYQYJOOJ-HXUWFJFHSA-N 441.373 4.096 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 1136408787 ADAVWAMDPVCNCO-CPJSRVTESA-N 429.564 4.401 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(CC(=O)NCCCSc3nccs3)cccc2C1 1136661303 AGDPJDIENSJQTL-UHFFFAOYSA-N 447.626 4.277 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(C2CCOCC2)cc1 1137438681 QZILOTOAOLTHRU-QFIPXVFZSA-N 428.960 4.334 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 1142690620 LABCWUHAYZDSLN-UHFFFAOYSA-N 442.512 4.253 10 10 IICE Cc1cc(C(=O)Cn2nnnc2Cc2ccccn2)c(C)n1-c1ccc(Cl)c(Cl)c1 1165781755 ISHKSDVRFUAHQG-UHFFFAOYSA-N 441.322 4.256 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)c3cccc(C(=O)c4ccccc4)c3)CC2)cc1 1266268432 HKEXLLMDCVAHHD-HXUWFJFHSA-N 428.532 4.379 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Br)c(SC)c1 1299698694 KXDGKMQYFSFHRR-UHFFFAOYSA-N 438.343 4.082 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(CC2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1306561934 FVWOTAMTUGBVBI-GOSISDBHSA-N 429.584 4.127 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)C2CC2)cc1 1313348569 MRKMBJNVWKMSEC-FQEVSTJZSA-N 430.593 4.072 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(-c2csnn2)cc1 1354768076 SDNLVEHUGPIGTP-MRXNPFEDSA-N 430.480 4.205 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCO[C@H](c3nccs3)C2)nnc1C(C)(C)C 1361098686 ZKQURBMTSNGLGV-IBGZPJMESA-N 440.617 4.033 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F 1436845518 FUHBRQYZKNZDBQ-CQSZACIVSA-N 449.452 4.161 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2C(=O)N2CCOCC2)c(C)n1-c1ccc(C(C)C)cc1 1443137877 GTSIDJIFLZCSCN-DEOSSOPVSA-N 437.584 4.071 10 10 IICE COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 1444704599 XIMDKVAFKXWNSY-UHFFFAOYSA-N 449.482 4.192 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2ccc(F)cc2)[nH]n1 1444993176 ZDMIQDRJYJUNGN-INIZCTEOSA-N 430.430 4.216 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2csc(C3CC3)n2)NC(=O)OC(C)(C)C)cc1 1465324324 CPOFOIDLQBELKE-LJQANCHMSA-N 444.601 4.011 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1conc1COC 1500658869 IMTOTYQLVVAMBX-UHFFFAOYSA-N 434.544 4.382 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@](C)(O)C1CC1 1503472955 FRMCYPSEGPHDPJ-RUZDIDTESA-N 425.621 4.264 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)S1 1512458147 NXFQHKREMSUDNT-GQIGUUNPSA-N 433.597 4.103 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N2CCCc3c2cccc3[N+](=O)[O-])C1 1521259527 OXIWZWNVKGWCJV-UHFFFAOYSA-N 437.496 4.481 10 10 IICE CCCS(=O)(=O)Nc1cccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1522602271 AREULEMITNKQBE-UHFFFAOYSA-N 425.554 4.427 10 10 IICE Cc1cc(CC(=O)NCc2ccccc2S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1525525267 IONRCZLCDLGWLQ-UHFFFAOYSA-N 430.957 4.010 10 10 IICE CO[C@H](C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)c1ccc(Br)s1 1529277053 CXQVVXJQLORFJY-UGSOOPFHSA-N 425.392 4.320 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)cc(OC(C)C)c3)CC2)cc1 1535589648 NEZDODJJRYKERT-UHFFFAOYSA-N 433.346 4.207 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1Cc2cc(F)ccc2N(C(=O)/C=C/c2cncc(F)c2)C1 1538219174 WNSZEMJCTWZABO-RRGWEWPQSA-N 429.467 4.103 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCOc4ccc(Br)cc43)CC2)cc1 1545931523 LEKKAEOUNQXYCB-LJQANCHMSA-N 445.357 4.063 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc2c(c1)nc(O)n2C1CC1 1566306413 KCJWIZDYIUNXSM-UHFFFAOYSA-N 430.302 4.207 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)Nc4cc(F)ccc43)cc2Cl)C1 1586081889 JYKINNBSAFBCLC-KDOFPFPSSA-N 429.923 4.458 10 10 IICE CCCN1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(CC)CC)cc2)CC1=O 1614872136 WRMMOKFINJWFLM-HXUWFJFHSA-N 440.636 4.135 10 10 IICE Cc1ccccc1[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 1616786499 JDPDZTKEEFOWJX-UNVFRBQDSA-N 441.591 4.351 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@]2(COC)CCCCN2C(=O)OC(C)(C)C)cc1 1623452184 URFVKBOCOKCTEV-RUZDIDTESA-N 447.620 4.297 10 10 IICE CCN1C[C@H](CN(C)C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)Oc2ccccc21 1623538810 PVTVFBJNBFOBDT-NRFANRHFSA-N 431.536 4.266 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccncc2OCC(F)(F)F)c1 1626131928 IXVHNWNGPNAIGK-UHFFFAOYSA-N 431.414 4.173 10 10 IICE CCOC(=O)COc1ccc(CCNC(=O)c2sccc2-n2c(C)ccc2C)cc1 1628899336 WNEZMFBJQFUFLY-UHFFFAOYSA-N 426.538 4.070 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc2nc(O)n(C(C)C)c2c1 1629969261 SENQMTJZXNNRPA-UHFFFAOYSA-N 432.318 4.453 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)c1 1632495448 SFOSOMADVWLRMX-UHFFFAOYSA-N 425.529 4.084 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(OC(F)(F)F)c(C)c1 1632702261 ZGPVMWJHWHEIJZ-UHFFFAOYSA-N 431.794 4.068 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639898002 UDAHHYPGBBPOBN-VQIMIIECSA-N 432.362 4.283 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](NC(=O)C(F)(F)F)[C@@H]2C)c(C)n1-c1ccc(Cl)cc1 1640263779 TUISCUGGSNBZSC-KSSFIOAISA-N 441.881 4.419 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](C)c3ccc(S(C)(=O)=O)cc3)c2C)cc1 1642916258 UPORCAMBRPXPTH-MRXNPFEDSA-N 440.565 4.040 10 10 IICE COc1ccc(-n2nnnc2SCC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc1 1652562176 INQTVZZKTLCMGU-UHFFFAOYSA-N 433.537 4.362 10 10 IICE COc1cc(N2CCN(C[C@H]3CCC[C@@H](c4ccccc4)O3)CC2)cc(OC)c1OC 1653225678 CYISIEWCQFNCAT-YADHBBJMSA-N 426.557 4.145 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(CC=C(C)C)Cc3ccc(Cl)cc3)nc12 1654269015 OWWXCENCKNUOMN-UHFFFAOYSA-N 428.920 4.233 10 10 IICE CC(=O)c1cc(F)cc(CN[C@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)c1O 1658788507 CBMCXBMYIJMXHU-QPPBQGQZSA-N 439.458 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 1673745496 VCUVZYGPHVGYDA-GPUOULLFSA-N 434.628 4.156 10 10 IICE CC(C)[C@@H](CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)Cc1ccccc1 1681763998 PATDJNIJVGHQHX-HXUWFJFHSA-N 431.527 4.116 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC[C@@H](Cc1ccccc1)c1ccccn1 1684805626 UHGLLALGMDROQM-XMMPIXPASA-N 444.579 4.086 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@]3(CCCc4ccccc43)C2)N(C)C)cc1 1687807265 QEYHHMRMHYOXAS-AHKZPQOWSA-N 434.628 4.435 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccoc1)OC 1697753336 FQFJVVMGFOFJGO-QFIPXVFZSA-N 449.555 4.243 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)C[C@H]1C(F)(F)F 1698448129 WVRYVELWROQOJG-HZSPNIEDSA-N 447.552 4.056 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccoc3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1707581067 TWNNESWOHMYMPP-UHFFFAOYSA-N 434.519 4.440 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(CC3CC3)n2Cc2ccc(N(C)C)cc2C)CC1 1709882041 QKNQPONTGHCWCN-HSZRJFAPSA-N 425.621 4.439 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H]2CSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1726984534 RETWBBZROAQTJE-HKUYNNGSSA-N 447.624 4.147 10 10 IICE CCOC(C)(C)Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1746608994 XLTUXYWTFCBZPC-UHFFFAOYSA-N 429.609 4.017 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)cc1C 1749937448 DFHBTZNFJZFKHG-YZGWKJHDSA-N 429.609 4.050 10 10 IICE CC(C)Cc1nnc(N2CCO[C@H](C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1761042080 MWIWDFVRWPXPDU-QFIPXVFZSA-N 425.621 4.159 10 10 IICE C[C@@H]1SCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)[C@@H]1C 1763284603 WPNXFMKGMRNCTG-CABCVRRESA-N 434.660 4.253 10 10 IICE Cc1nc2ccc(C(=O)NCc3ccc(C(=O)Nc4cccc(N(C)C)c4)cc3)cc2[nH]1 1859100606 GHZWVQMAFLYCEA-UHFFFAOYSA-N 427.508 4.120 10 10 IICE CCOc1cc(/C=C2/C(=O)N(CC)N=C2c2ccc(OC)cc2)cc(Br)c1O 1865667435 WRBLCXZSGFKKTM-MHWRWJLKSA-N 445.313 4.212 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3ccc(F)cc3)N=C2c2ccccc2)cc(OC)c1O 1865679993 RCCFQMUZLVLUPU-NDENLUEZSA-N 432.451 4.379 10 10 IICE O=C(O)[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@@H]1c1cccc(O)c1O 1951592213 MREDBZWFRKONFP-RTWAWAEBSA-N 445.471 4.147 10 10 IICE CC[C@H](NC[C@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)c1cc(Br)ccc1O 2087331293 ZMYHVLIPPBDIGL-NXOAAHMSSA-N 425.367 4.308 10 10 IICE Cc1ccccc1OCCOc1ccc([N+](=O)[O-])cc1C=C1SC(=S)N(C)C1=O 2293430061 DUFPWCBFRMPZFG-UHFFFAOYSA-N 430.507 4.192 10 10 IICE Cc1ccc(CN[C@@]2(C)CN(C(=O)OC(C)(C)C)CC2(F)F)c(O)c1Br 2352944647 KPBFKQOUSYLGND-KRWDZBQOSA-N 435.309 4.197 10 10 IICE C[C@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)C1=O 11636165 UWGUCRUWDUWEIX-LLVKDONJSA-N 440.015 4.355 10 10 IICE CCOC(=O)c1cccc(N2C(=O)/C(=C\c3ccc(OC)c(OC)c3)SC2=S)c1 206263370 OFWBXNTZUNRKKD-WOJGMQOQSA-N 429.519 4.286 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 226840771 AWNWHHYDURMGII-XFQAVAEZSA-N 443.525 4.204 10 10 IICE Cc1cc(CCNC(=O)N2CCCN(Cc3cscn3)CC2)c(C)n1-c1ccccc1 727599105 DUMAJGOCHLTHJI-UHFFFAOYSA-N 437.613 4.011 10 10 IICE Cc1csc([C@@H](C)NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 727669176 HUBMQYBSPTZHJF-OJLMPMFISA-N 437.637 4.372 10 10 IICE O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2cccc(Br)c2O)C1)C1CCCC1 779620253 REERCXSZGSMVJC-OAHLLOKOSA-N 447.377 4.386 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCCC1CS(=O)(=O)C1 790312201 YIPDLCRWAOOREL-UHFFFAOYSA-N 443.432 4.495 10 10 IICE CC(C)OCc1cc(NS(=O)(=O)/C=C/c2ccccc2Br)ccc1O 811704105 USUWZHPADJCNEG-MDZDMXLPSA-N 426.332 4.492 10 10 IICE CCOC(=O)c1ccc2c(c1)nc(/C(Cl)=C\c1cnc(N3CCOCC3)s1)n2CC 821003343 XQBJXGRDXXWXOE-FOWTUZBSSA-N 446.960 4.263 10 10 IICE Cc1cccc(N2C(=O)NC(=O)/C(=C\c3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)c1C 1084099673 CNLOVHYCNLKYQX-LDADJPATSA-N 431.404 4.138 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2ccccc2CC1 1126231281 NTIBMCSKKWNUHQ-HKWRFOASSA-N 440.565 4.044 10 10 IICE COc1cc(-n2cccc2)c(Cl)cc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1134682090 UOVOFFLWLMZSBQ-JOCHJYFZSA-N 440.975 4.238 10 10 IICE Cc1c(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc(CNC(=O)OC(C)(C)C)n1C 1136180930 UOYTXAYTVRXNOE-UHFFFAOYSA-N 440.588 4.229 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)c2ccc(OCCN(C)C)cc2)cc1 1136760960 XPOUJDLAFKFDTM-UHFFFAOYSA-N 433.552 4.053 10 10 IICE C[C@@H]1CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)[C@@H]2CCCC[C@@H]12 1137788977 WVFVVGZFZYEHRD-AQROYOQVSA-N 432.586 4.454 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cc(Br)ncc1Br 1141538506 OLMVEDYYPDJTLQ-UHFFFAOYSA-N 439.151 4.137 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(NC(=O)NC3CC3)c2)cc1 1144000405 ULLUVWZMDIKTTA-UHFFFAOYSA-N 434.462 4.241 10 10 IICE Cc1cccn2cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)cc12 1147503530 AGKQFJORXNJUOC-NRFANRHFSA-N 436.556 4.310 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCc3cccnc32)c(C)n1-c1ccc(Br)cn1 1158009342 JVVZOOPMCCWCBW-SFHVURJKSA-N 425.330 4.454 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCCNC(=O)[C@@H]3Cc3ccccc3)c2C)c1 1159815514 GTOONVOUXOFLRR-VWLOTQADSA-N 429.564 4.284 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H](C(=O)OC(C)(C)C)[C@H](C2CC2)C1 1230200809 MANUQONEAWCYDZ-BULFRSBZSA-N 429.605 4.001 10 10 IICE CC(C)[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)[C@@H](O)c1ccc(Cl)cc1 1251501034 MOEYGNUKAHNBAW-VJBWXMMDSA-N 447.023 4.066 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3csc(-c4cccc(F)c4)n3)C2)cc1 1276831701 BUDJASFBIWEPNB-INIZCTEOSA-N 425.529 4.143 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCOc3ccc(C)cc3Br)C2)cc1 1276831850 HBXVHAHJXGBIPK-QGZVFWFLSA-N 447.373 4.178 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1 1290400998 NZCPNEQRMUYRAA-OAQYLSRUSA-N 427.545 4.098 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCOC3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1304192570 ZSYYBJOIZYWXIY-QGZVFWFLSA-N 433.478 4.388 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1 1353014531 YQDAUVAUILJCTB-UHFFFAOYSA-N 438.549 4.124 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(OC)c1 1357835524 GDXIDNFXTUSCOE-IAGOWNOFSA-N 430.520 4.167 10 10 IICE Cc1[nH]nc(C(F)F)c1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1446213570 ZNHUUGPXSZZHRO-XYOKQWHBSA-N 440.472 4.025 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2ccc(Cl)cc2)s1 1466674405 URIAZAFDMLJGDC-INIZCTEOSA-N 445.924 4.384 10 10 IICE C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)c1ccccc1O 1469840393 KHNLSQCCDXDXNH-AWEZNQCLSA-N 435.446 4.076 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CNC(=O)c3ccccc3C(F)(F)F)c2C)c1 1471014971 XDDYONVAWGJHKI-UHFFFAOYSA-N 443.469 4.468 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(OCC3CCCCC3)CC2)N(C)C)cc1 1479532077 AMWGBSTXKYHOQF-XMMPIXPASA-N 430.637 4.126 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)c(F)c2)C1 1500703073 LCTHIHMHIIKRGZ-ICSRJNTNSA-N 430.616 4.213 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1516644411 RCBGWYFEAOZYKA-JTHBVZDNSA-N 441.620 4.277 10 10 IICE CC(C)C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1526259692 KZEKFGRMUQALGG-NFBKMPQASA-N 442.003 4.488 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2[C@H]3CCCC[C@H]3CCN2C(=O)OC(C)(C)C)cc1F 1527013377 AYCVFBZWNHRALP-WFXMLNOXSA-N 433.568 4.324 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F 1528924072 IKLSGMWSSYAEKR-AWEZNQCLSA-N 449.452 4.161 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1 1528924126 JMAFVVAERGWVGP-HKUYNNGSSA-N 437.613 4.030 10 10 IICE Cc1cc(CC(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)c(C)n1-c1ccccc1 1528956307 SHNROWQFCBHBBW-SANMLTNESA-N 431.580 4.044 10 10 IICE C[C@@H]1CC(F)(F)CCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1532074399 IPMJGQJXKPBSPY-XTCQQWIJSA-N 430.567 4.376 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(Cc3ccccc3)C(C)(C)C(=O)OC)ccc21 1538457321 DHNYCPDCEMKHKH-UHFFFAOYSA-N 436.552 4.499 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3ccccc3n2Cc2ccncc2)N(C)C)cc1 1539234906 ISKDZQCHTCJAJY-AREMUKBSSA-N 441.579 4.183 10 10 IICE CC[C@](O)(C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Cl)c1 1545043462 ZWRKPJKCFQUPPB-VGOFRKELSA-N 438.902 4.324 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(NC2=NCCC2)cc1 1546184893 AGZBREOXNYZSJO-UHFFFAOYSA-N 428.483 4.291 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNc3nc(-c4cc(Cl)cc(Cl)c4)no3)cc2)C1 1559076601 GUPDLHAEINEJFQ-CQSZACIVSA-N 446.338 4.357 10 10 IICE COC[C@@H](CNC(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 1564777542 NFUPNKSNTPBPGE-LJQANCHMSA-N 431.964 4.001 10 10 IICE COc1ccc([C@H]2CCCCCN2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1565126063 DQDRHEQALUUUQB-RUZDIDTESA-N 437.584 4.483 10 10 IICE CCOC(=O)C[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1584110847 ALEYLBZGQKWFNM-JOCHJYFZSA-N 434.536 4.339 10 10 IICE CN(C)c1ccc(Cn2c(-c3cc(Br)c[nH]3)nnc2N(C)CC2CC2)cc1F 1617662628 IZNPQQAKAIXLAN-UHFFFAOYSA-N 447.356 4.135 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(N3CCC(C)CC3)nc2)cc1 1625955626 TVDAXGMWUFUXGH-UHFFFAOYSA-N 444.579 4.397 10 10 IICE CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1641203558 FPRWZVJHRNDTEK-UHFFFAOYSA-N 443.569 4.378 10 10 IICE CC(C)(C)c1cc2ncn(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)c(=O)n2n1 1641432786 WHCRWDPRUVQFPE-UHFFFAOYSA-N 429.484 4.243 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(C[C@@H](C)C[C@H](C)C4)C3=O)c2C)cc1F 1651884652 AHELPOSPCOOQGB-GJZGRUSLSA-N 439.531 4.471 10 10 IICE COC1CCN(c2ccc(CN3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)CC4)cc2)CC1 1652990351 PRUDQZLRGVIZBN-VXKWHMMOSA-N 429.605 4.276 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCO2)sc(C)c1-c1ccccc1 1653594122 DCTHKWIFXVOXFQ-MOPGFXCFSA-N 442.581 4.482 10 10 IICE C[C@H](NC(=O)N1CCC[C@@H]2CC[C@]21CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1680281234 WMWABZQEHVDKGU-PDOGEWKWSA-N 430.593 4.293 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)[C@H]1C 1691376621 ZJTXMRGNRUIVJM-OAQYLSRUSA-N 446.599 4.376 10 10 IICE CC(C)c1nnc(N(C)C[C@H]2CC=CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1691677842 OUTRCEDTMGKCCX-IBGZPJMESA-N 427.568 4.218 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1694959567 YUTIKQKKMVFTRN-JOCHJYFZSA-N 434.588 4.158 10 10 IICE COCCN(C)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1698028016 YXCWUWDGRAKGOI-UHFFFAOYSA-N 448.615 4.087 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCS[C@@H](C)C2)cc1 1710026745 OEHJICUITRUWML-ICSRJNTNSA-N 429.634 4.008 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CC4)n3CCCCCSC)CC2)cc1 1711865556 ZIPNBSIOJAILCI-UHFFFAOYSA-N 429.634 4.414 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1728382089 XMSVSVURYDJFSQ-JOCHJYFZSA-N 436.604 4.039 10 10 IICE CCOCC(C)(C)Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1728960488 UNISUZHBQDYDIK-UHFFFAOYSA-N 449.603 4.034 10 10 IICE COCCN(c1nnc(CC(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@@H](C)C1 1730742080 NEEKCYROZNKLKV-UYAOXDASSA-N 431.600 4.371 10 10 IICE CN(CCC1CCOCC1)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1747914953 PCVLZCQKJWTPEY-UHFFFAOYSA-N 446.646 4.175 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2c(O)cccc2Br)C[C@@H]1C1CC1 1895877171 XXQYXTPWVZCBNB-RHSMWYFYSA-N 425.367 4.422 10 10 IICE CN1CCCc2cc([C@H](O)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999524186 WJEMGBBYPICRJE-GGAORHGYSA-N 426.557 4.213 10 10 IICE CCOC(=O)c1c(CC)nn([C@H](c2ccc(OC)cc2O)C2CCC2)c1Br 2079980558 GHUUPEKBYVDCQR-SFHVURJKSA-N 437.334 4.488 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@H]1NCc1cc(Br)ccc1O 2144145373 RMTXEHVTVILOKT-MJGOQNOKSA-N 433.346 4.435 10 10 IICE CCOC(=O)c1ccccc1-c1ccc(C=C2C(=O)NC(=O)N(c3cccc(C)c3)C2=O)o1 2297332350 CZYWFFCVVXDANQ-UHFFFAOYSA-N 444.443 4.098 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)C2=O)cc1 2297350590 ZIKSQZLMYKWSEK-UHFFFAOYSA-N 430.435 4.380 10 10 IICE O=C1NC(=S)N(c2cccc(Cl)c2Cl)C(=O)C1=Cc1ccc(Br)o1 2313575985 CFOVKJMJOCYYDJ-UHFFFAOYSA-N 446.109 4.180 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCC(=O)Nc3ccc(C)cc3)C2=O)ccc1O 2314829217 ZRCQIGWXCLDWPN-UHFFFAOYSA-N 442.562 4.329 10 10 IICE Cc1nc2scc(C)n2c1C=C1SC(=S)N(c2ccc(CC(=O)O)cc2)C1=O 2321582975 QILTZZUKCOKCEH-UHFFFAOYSA-N 429.548 4.046 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(O)c1Br 2380759047 LCPKHIGHZSQHTC-ZFWWWQNUSA-N 441.366 4.067 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccccc3O)SC2=S)cc1 15038118 NBTJHUJIRNJENQ-AQTBWJFISA-N 428.535 4.021 10 10 IICE COc1ccc(CNC(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)cc1 29071806 AMMMRGJZQCFRKR-NRFANRHFSA-N 437.565 4.146 10 10 IICE CCCCN1C(=O)/C(=C2/SC(=S)N(CC)C2=O)c2cc(Br)ccc21 33913974 DOJUGMZFPZXFGT-BUHFOSPRSA-N 425.373 4.187 10 10 IICE CCCOC(=O)CCN1C(=O)/C(=C/c2ccc(OC(C)C)c(OCC)c2)SC1=S 40938267 AUEFQHIAVOZTKZ-AQTBWJFISA-N 437.583 4.417 10 10 IICE CCCCOc1ccc(/C=C2/SC(=S)N(CCC(=O)OCCC)C2=O)cc1OC 206455945 PYAUOUGDDKZSOR-NBVRZTHBSA-N 437.583 4.419 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 726087780 SLSAHANMVVIGIW-HXUWFJFHSA-N 440.588 4.193 10 10 IICE CC(=O)N1CSC[C@@H]1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 747369907 IIXUTNUVWQUQIS-LJQANCHMSA-N 444.557 4.217 10 10 IICE Cc1cc(CCNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)c(C)n1-c1ccccc1 751570484 LAPBWWSJOSMKRN-UHFFFAOYSA-N 446.519 4.204 10 10 IICE CCOC(=O)c1csc(C2CCN(Cc3cc(C)cc(Br)c3O)CC2)n1 763501234 UOXUJUYTSBZCIT-UHFFFAOYSA-N 439.375 4.476 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1OC(F)F 768842431 VSMZPCJGANAULJ-UHFFFAOYSA-N 430.499 4.142 10 10 IICE COc1cccc([C@H]2[C@H](NC(=O)c3cc(C)n(-c4ccccn4)c3C)CCN2C2CC2)c1 778494442 NNWYJSDFECIQFD-NOZRDPDXSA-N 430.552 4.206 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC[C@@H](C(F)(F)F)[C@@H]2C)c([N+](=O)[O-])c1Br 795191576 GVKZBJHJRYADCS-NKWVEPMBSA-N 428.161 4.051 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccc(C(=O)c2cccc(O)c2)cc1 804735627 GAZDZNGYXNDONE-UHFFFAOYSA-N 426.266 4.021 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3C[C@@H](C[C@H]4COCC(=O)N4)c4ccccc43)c2C)c1 807705048 AXDYEJDANHVLOR-RTWAWAEBSA-N 443.547 4.052 10 10 IICE CCOc1ccc([C@@H](O)C2CCN(c3ccc(/C=C/C(=O)OC)cc3[N+](=O)[O-])CC2)cc1 812482422 WXHWVYXSZUJNQU-ZQRDMSKRSA-N 440.496 4.130 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CCCc3cc(C)sc3C)CC2)cc1 1124515094 ZBMKVAPNCXIIRL-UHFFFAOYSA-N 429.630 4.025 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Cl)c(Br)cc3OC)C2)cc1 1130827333 ZBOGBRPAYKCDCH-GFCCVEGCSA-N 439.737 4.128 10 10 IICE COc1cccc(-n2ccnc2SCC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1135800435 GFPWYLRDRVONKD-UHFFFAOYSA-N 436.581 4.232 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccn1Cc1cccs1 1137438927 YSSBEGDTMJNYHH-SFHVURJKSA-N 429.973 4.351 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(S(=O)(=O)N(C)C)c(C)c3)c2C)c1 1157124725 NZUAEJUYQAXNPD-UHFFFAOYSA-N 425.554 4.214 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3cc(Br)sc3[nH]2)N(C)C)cc1 1158717034 KVMIJQIWEVDXJY-INIZCTEOSA-N 435.391 4.091 10 10 IICE CC(=O)N1CCC[C@@H]1C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1160644794 BOKNIDWRMSRWDH-PZJWPPBQSA-N 433.474 4.309 10 10 IICE CC(C)Cn1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1289510890 OUQRKKDRBTUUIM-UHFFFAOYSA-N 439.317 4.264 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N2CCC(C)CC2)cc1 1305578700 BCQXWUHZNXMHEB-LJQANCHMSA-N 435.620 4.446 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCOC1 1306565551 DSXDHCCTSSCPBA-BVZFJXPGSA-N 437.588 4.129 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](CCc1ccccc1)c1ccccn1 1313154449 DOCUAYHMWZVZNL-SANMLTNESA-N 444.579 4.434 10 10 IICE CC[C@H](Cc1ccccc1Br)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1356036694 LRUIVMOZQGXSGT-QGZVFWFLSA-N 449.364 4.310 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1[C@@H]2CCCC[C@@H]2CCN1C(=O)OC(C)(C)C 1435285135 BKXCCMIFWCPZFN-JUXOCIIHSA-N 443.588 4.294 10 10 IICE COc1ccc2c(c1)[C@H](C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CCC2 1445885555 RKYXZDUDXACYSQ-PZJWPPBQSA-N 428.960 4.255 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc(F)cc(I)c1N 1448433725 DPSZNBLYORSXJL-UHFFFAOYSA-N 442.272 4.161 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C)n([C@@H](C)C2CC2)n1 1448682118 DBYWSVCPNYZKOK-KRWDZBQOSA-N 426.561 4.165 10 10 IICE CCCOc1ccccc1C(=O)CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1471230480 XPJGNFKOVLWJCS-UHFFFAOYSA-N 434.536 4.317 10 10 IICE CCN(C)c1ccc(CN2CCn3c(Cc4cccc(Br)c4)nnc3C2)cc1 1473426405 WWDZJWVGTWGMAD-UHFFFAOYSA-N 440.389 4.103 10 10 IICE Brc1ccccc1CN1CCC(NCc2ccc(N3CCOCC3)cc2)CC1 1473958290 ZJQHVYWORDYZDO-UHFFFAOYSA-N 444.417 4.040 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CC1CCC1 1501394982 XZCIGMQYKFRTCC-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCCN1C[C@@H](C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)CC1=O 1524673158 QKJOBFBCQBOXKK-KRWDZBQOSA-N 428.554 4.486 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc(S(=O)(=O)Nc3ccccc3)ccc2Cl)cc1 1539050749 XBTPTYDIYUDPTB-UHFFFAOYSA-N 443.956 4.137 10 10 IICE CSc1cccc(N2C[C@H](C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CC2=O)c1 1539336455 JUSAMSZJHDNOJV-HXUWFJFHSA-N 437.609 4.410 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C)[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541443742 BVNURTZTXOYEPC-LEWJYISDSA-N 439.648 4.216 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)NCc3ccc(N4CCSCC4)cc3)c2)n1 1543099295 XRLUZPKVGHUINU-UHFFFAOYSA-N 449.580 4.026 10 10 IICE C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)cc2[N+](=O)[O-])C1 1544164455 JFGJMQOOLZAWSQ-ROUUACIJSA-N 436.556 4.390 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccccc3NC(=O)OC(C)(C)C)C2)cc1 1557133364 IYOJSSHBQIFCLG-SFHVURJKSA-N 439.556 4.227 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 1565409573 RNEXFOKMGJFJSO-FQEVSTJZSA-N 432.609 4.318 10 10 IICE C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1583318313 JTOXFNTUFBCNOV-VXGBXAGGSA-N 446.381 4.173 10 10 IICE CCc1ccccc1-n1cc(O)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)n1 1583919982 UZLMNJKXDCZLGF-QFIPXVFZSA-N 448.567 4.028 10 10 IICE Cc1onc(-c2cccnc2)c1C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2ccccc21 1595762376 APOYKDPDJFEEQB-QGZVFWFLSA-N 448.523 4.389 10 10 IICE O=C(CCOc1ccc(Cl)c(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1596684399 KZOCZKGOSKJRFA-UHFFFAOYSA-N 445.293 4.194 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(-c4ccc(Cl)cc4Cl)c3)C2)cc1 1598364378 RUENMXZJXJWCAJ-OAHLLOKOSA-N 445.350 4.444 10 10 IICE C[C@@H]1SCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)[C@@H]1C 1613037470 JSMCRPPUTIPOSY-MOPGFXCFSA-N 443.661 4.082 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3CCC3CCCCC3)CC2)cc1 1616347330 PSVZFLYQWCLGSW-UKILVPOCSA-N 429.649 4.003 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1620290252 ZKCIJQJFICHMSV-GOSISDBHSA-N 425.602 4.331 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CN(Cc2ccccc2)CCC1(F)F 1627209289 BNGWFTVBCYBONS-HSZRJFAPSA-N 427.539 4.451 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@]2(C)CCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1629679326 NTUNOPHCTGBMDG-BKMJKUGQSA-N 437.584 4.339 10 10 IICE O=C(CSc1ccccc1Br)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631218995 KKZDIFKLKVIKPK-INIZCTEOSA-N 436.371 4.455 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1 1632185923 TVMJKABDQYPRPS-UHFFFAOYSA-N 445.519 4.001 10 10 IICE Cc1nc(C(C)C)oc1CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1636431248 VWCJMPQQUCVRKZ-LICLKQGHSA-N 447.557 4.153 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CCC(=O)NCc2c(O)ccc3ccccc23)COC1(C)C 1639388040 WAMPKTBXCPLFES-QGZVFWFLSA-N 428.529 4.314 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1C 1639522459 MUTXYFYFZOBOSY-UHFFFAOYSA-N 444.597 4.318 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCCn1cc(Br)cn1 1639985945 TXGQGFPQPJDWAE-UHFFFAOYSA-N 429.274 4.287 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H]2CC[C@@H](C(=O)OC(C)(C)C)C2)CCCC1 1640848818 KRBUKAJFSXEICL-SJORKVTESA-N 426.557 4.155 10 10 IICE Cc1cc(CN2CCC[C@H](C(=O)Nc3ccc(Br)cn3)C2)ccc1N(C)C 1652865758 VTFKUORIYUVRRQ-KRWDZBQOSA-N 431.378 4.069 10 10 IICE COc1cc(N(C)CC(=O)Nc2ccc(N3CCc4ccccc43)cc2)cc(OC)c1OC 1653378725 OGINGRKHPMKRTO-UHFFFAOYSA-N 447.535 4.482 10 10 IICE Cc1cc(C(=O)NC2(CC(N)=O)CCCCC2)c(C)n1-c1ccccc1Br 1653471792 OQKPFIQYTJYNGX-UHFFFAOYSA-N 432.362 4.165 10 10 IICE Cc1cc(C(=O)CSc2nnc(-c3ccncc3)n2C)c(C)n1-c1ccc(Cl)cn1 1656069037 AZCBVFTXBABLEA-UHFFFAOYSA-N 438.944 4.308 10 10 IICE O=C(NCc1cc(Cl)ccc1O)NC[C@H]1c2ccccc2C(=O)N1Cc1ccccc1 1683845731 LCCUHEKXNWIKHS-NRFANRHFSA-N 435.911 4.242 10 10 IICE CC1(C)C[C@@H](c2ccccc2)CN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725517 MRPQYALGXVZCST-LJQANCHMSA-N 429.511 4.279 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCSC1 1694129355 CPSCVYZVTMEPPF-MSOLQXFVSA-N 447.624 4.409 10 10 IICE CC[C@]1(C)CC[C@H](Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)O1 1694426696 IUHVOLJDTDLCHU-RCZVLFRGSA-N 441.620 4.475 10 10 IICE C=C(Cl)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](O)C1 1705746244 RMCNVBGUCVOWHZ-VFNWGFHPSA-N 425.964 4.312 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H](C)C2)n1Cc1ccc(N(CC)CC)cc1 1727210738 JGMDBUSVNPOZRK-LJQANCHMSA-N 440.636 4.327 10 10 IICE CCN(CC(C)C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1728341144 SJLQCJAKSYDXLX-UHFFFAOYSA-N 449.578 4.252 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1741585647 VUGAERMAGRKDFS-KNQAVFIVSA-N 445.583 4.024 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CC[C@@H](C(C)(C)C)C2)cc1 1766608654 RFJRYDCBTCKDHS-HXUWFJFHSA-N 440.636 4.183 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CCC=CO3)CC2)cc1 1768705151 XKQVSDGXBNOGDY-QFIPXVFZSA-N 439.604 4.285 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1770539333 AGXXYMNEXDAJKJ-KRWDZBQOSA-N 442.608 4.480 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)NC(=O)/C=C/c3ccc(C(C)C)cc3)CC2)cc1 1862141465 KOCFOBLXBWTMHG-OVCLIPMQSA-N 449.595 4.075 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2cccc(Br)c2O)C1 1952539166 UBSUCJILWRODLQ-WMLDXEAASA-N 434.286 4.329 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@H](N)c1ccc2c(c1)CCCN2C 2044759498 YYQLBADGRBIYMC-ISKFKSNPSA-N 438.616 4.094 10 10 IICE COc1ccc([C@@H](n2nc(C(F)(F)F)c(CN)c2Br)C2(C)CC2)c(O)c1 2079859331 AMMFYSWSUQHPSD-CQSZACIVSA-N 434.256 4.227 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C3(C)CC3)c(C(=O)O)c2Br)c(O)c1 2080030259 KKRBRUSDJLVADM-MRXNPFEDSA-N 435.318 4.499 10 10 IICE CCOC(=O)[C@H](C)N1C(=O)SC(=Cc2cc(C)n(-c3ccc(N(C)C)cc3)c2C)C1=O 2294010800 LCFYVNGMIUSPIA-INIZCTEOSA-N 441.553 4.148 10 10 IICE CN(C)c1ccc(C=CCN2CCC3(CC[C@H](CNC(=O)c4ccccc4)O3)CC2)cc1 2297516612 VISLHQDOIJQNOT-RUZDIDTESA-N 433.596 4.209 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)CC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1 2315987621 WWYZGQMINKLPNV-UHFFFAOYSA-N 444.580 4.095 10 10 IICE CCc1ccc(Cc2cnc(NC(=O)CCCN3C(=O)[C@H](C)SC3=S)s2)cc1 11636172 FPARTRVAUVMUMX-ZDUSSCGKSA-N 433.624 4.264 10 10 IICE CCCNS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(OC)c(OC)c1)N2 14479435 GTEMQVYYVWFXHU-IXFSTUDKSA-N 428.554 4.219 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)SC1=S 35517162 AODXBFQMCSQRFJ-ATVHPVEESA-N 445.518 4.491 10 10 IICE COc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc(OC)c1OC 435657914 XWWGZZAQUMDJTP-UHFFFAOYSA-N 437.540 4.072 10 10 IICE Cc1cc(C(=O)[C@H](C)N2CCC(C(=O)N(C)C)CC2)c(C)n1-c1ccc(OC(F)F)cc1 727237498 IDWYMKSSBNGUSX-KRWDZBQOSA-N 447.526 4.067 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](c1ccccc1)N1CCc2ccccc21 729653360 OUWCRRDYQXUJHW-AREMUKBSSA-N 445.538 4.083 10 10 IICE Cc1cc(CCNC(=O)c2cc3c(nc2O)CC(C)(C)CC3=O)c(C)n1-c1ccccc1 732054187 LOQKXTZFCZUGCC-UHFFFAOYSA-N 431.536 4.322 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742801280 OUWUIFDUQIRTHC-FPDPHYFHSA-N 443.494 4.281 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2cccc(Cl)c2)c(C)s1 748720249 UMKKAZGVNUZHCH-UHFFFAOYSA-N 439.902 4.490 10 10 IICE COc1ccc(-c2cnc(CCC(=O)NCc3cccc(Br)c3O)o2)cc1 765763581 DTKQNVZUWPMREW-UHFFFAOYSA-N 431.286 4.067 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(C(=O)NCCc3cccs3)CC2)c1 781905017 LRTUKAHXCQSCDH-UHFFFAOYSA-N 437.403 4.096 10 10 IICE Cc1cc(Br)c(O)c(CN(C)CCC2CCN(C3CCN(C)CC3)CC2)c1 781910049 UFQUERJFLHQAMT-UHFFFAOYSA-N 438.454 4.091 10 10 IICE Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 784071317 GQSKVSNPLSOBLQ-OKILXGFUSA-N 435.883 4.239 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CCC(c4ccc(Br)cc4)CC3)cc2N1 799971171 WLKATMXCGMIAMN-UHFFFAOYSA-N 432.274 4.072 10 10 IICE CN(C(=O)c1cccs1)c1ccccc1C(=O)NCc1cc(Br)ccc1O 804739264 CSBIWFCMLHZCAP-UHFFFAOYSA-N 445.338 4.423 10 10 IICE O=C(NCc1nc2cc(Cl)ccc2s1)NCc1cc(Br)ccc1O 804988089 FMMSJTXXAQCNSA-UHFFFAOYSA-N 426.723 4.417 10 10 IICE C[C@@H](Cc1cncc2ccccc12)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 805193942 DVHASHBSECDZNU-NRFANRHFSA-N 442.607 4.262 10 10 IICE CCOCCOCc1cccc(NC(=O)NCc2cc(Br)ccc2O)c1C 806325541 YWBPUOSDQAGIKQ-UHFFFAOYSA-N 437.334 4.338 10 10 IICE CN1CCC[C@@H](CNC(=O)NCc2cc(Br)ccc2O)[C@H]1c1cccs1 806856024 CODZVUABTJDBFM-UGSOOPFHSA-N 438.391 4.099 10 10 IICE CCOC(=O)c1ccc2c(c1)nc(CN(Cc1ccccc1O)C[C@@H]1CCCO1)n2CC 808736243 NYBJXGFORNHRCK-FQEVSTJZSA-N 437.540 4.120 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)c([N+](=O)[O-])c1 814261726 FXDSRDGDWCXVJO-SOFGYWHQSA-N 445.516 4.008 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)nc3)c2C)cc1 918579289 RGHASHSJYBYEMA-OALUTQOASA-N 448.567 4.041 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)cc1 1116545226 BQLGUVSFTKHYAX-OAQYLSRUSA-N 436.600 4.241 10 10 IICE CCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1cccc(Cl)c1 1130185453 IGNAGYOTWNOMBT-KRWDZBQOSA-N 438.959 4.353 10 10 IICE CCOC(=O)C1CCC(CC(=O)N(CC)Cc2cc(Br)ccc2O)CC1 1137350492 OFTLQFSMGGELHJ-UHFFFAOYSA-N 426.351 4.263 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1 1138047185 IQHBXZKAIZMKSR-NIYFSFCBSA-N 429.564 4.086 10 10 IICE Cc1cc(F)c(Br)cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1147838284 UPCCZVMGTPVJIZ-UHFFFAOYSA-N 435.337 4.035 10 10 IICE COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1233603432 DKVPKCBAOPKBIL-NTKDMRAZSA-N 437.584 4.339 10 10 IICE CCOC(=O)C1([C@H](C)NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CCOCC1 1289405688 YUXVAXOVFGTWLX-SFHVURJKSA-N 446.975 4.155 10 10 IICE CC(C)[C@@H](C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)N1C(=O)c2ccccc2C1=O 1292259012 XZEXHCGFRWASRX-DEOSSOPVSA-N 447.579 4.393 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)C(=O)NCC 1294419784 VVOJZNFIJINKDO-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H]([C@H]4CCOC4)C3)nnc2C(C)(C)C)cc1 1295420429 ZYPAVJHZFFSDEN-RTWAWAEBSA-N 425.621 4.333 10 10 IICE CCCCN(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCC[C@@H](C)C1 1298617588 NGBOJIJEPAHIJZ-DOZDWOLESA-N 441.616 4.107 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C(N)=O)C3)n2CC(C)(C)C(C)C)c(C)n1-c1ccccc1 1304194936 FRQDPAYDWXTIPG-FQEVSTJZSA-N 448.615 4.346 10 10 IICE CC(=O)c1cc(Cl)cc(CN2C[C@@H](CCNC(=O)C(F)(F)F)c3ccccc32)c1O 1308012564 MJVDDNMXGXJOPL-CYBMUJFWSA-N 440.849 4.421 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCC[C@@H](O)COCc3ccccc3)c2C)c1 1313133791 WMOKDIJPJOWRMO-RUZDIDTESA-N 435.568 4.170 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3C[C@@H](OC)C(C)(C)C)CC2)cc1F 1315512239 LDLLWXCISMMIGS-OAQYLSRUSA-N 445.583 4.081 10 10 IICE Cc1cc(CC(=O)N2CSC[C@@H]2C(=O)NC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1359998353 GPAFEONOOBQLAM-LJQANCHMSA-N 434.005 4.106 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C)C3)n2CCCOC(F)F)c(C)n1-c1ccccc1 1361049337 AIRGTZLXYJKVAB-KRWDZBQOSA-N 445.514 4.207 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2cc(F)ccc21 1434874070 VIXWWRUSWUVZLR-HDAJJNEKSA-N 444.528 4.360 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c(C)nc(-c4ccco4)nc3SC)C2)cc1 1436970550 JPEQUBKOHXQDIY-MRXNPFEDSA-N 438.553 4.032 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccn(-c3ccc(Cl)cc3)n2)cc1 1442621123 XMCZNEQQUPMKBV-QFIPXVFZSA-N 438.959 4.413 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c(C)n1-c1cccc(Br)c1 1445726669 JRNPKXHNUWDBMK-LEWJYISDSA-N 425.326 4.245 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2cccc(O)c2)c(C)n1-c1ccc(C(C)C)cc1 1445970865 QXYDGWIJTUPILL-UHFFFAOYSA-N 433.552 4.473 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)c1O 1459494194 VLMMKOYIAJMAGF-INIZCTEOSA-N 431.838 4.139 10 10 IICE Cc1ccc(C(=O)N2CCO[C@H](COc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1466855803 REJRXRDNDLDLHB-DEOSSOPVSA-N 432.520 4.135 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4c(F)c(Br)ccc4[nH]3)C2)cc1 1469280930 UXSBNVFVKDYOSY-CYBMUJFWSA-N 446.320 4.334 10 10 IICE Cc1cc(CNC(=O)N2C[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1471036476 CZMKHQJJRURVLG-OXQOHEQNSA-N 426.561 4.291 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3ccncc3OCCC(C)(C)C)C2)cc1 1478763215 FYFMKDFTBKEMJX-IBGZPJMESA-N 440.588 4.231 10 10 IICE CCc1cnc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)s1 1498210354 YOSQHMFBZDHZDF-UHFFFAOYSA-N 425.583 4.340 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1500047900 VCKRZRDKNKULIE-FQEVSTJZSA-N 434.588 4.158 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC=CCO1 1519039373 RTBHDBGXLPUPET-QFIPXVFZSA-N 435.572 4.170 10 10 IICE COC(=O)C(C)(C)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1523976230 MHDZDJLZECXHRP-UHFFFAOYSA-N 447.579 4.497 10 10 IICE CCCCCOc1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 1530367400 MAESYKVSSWKBJF-UHFFFAOYSA-N 427.564 4.467 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](F)c1ccc(C(F)(F)F)cc1 1535345701 KXUCQOOLCTZZLK-KRWDZBQOSA-N 432.364 4.147 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3ccco3)nn2-c2ccccc2)cc1 1538161376 WLVOFYITZFMIKJ-UHFFFAOYSA-N 430.508 4.349 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc4nc(C(F)F)[nH]c34)cc2F)C[C@@H](C)O1 1543233711 QQPDAZCRBFXIHS-BETUJISGSA-N 432.446 4.183 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H](O)c3ccc(Cl)c(Cl)c3)cc2F)C[C@@H](C)O1 1543234197 YVFBHJOUKIOGFI-MTJIALIYSA-N 441.330 4.096 10 10 IICE CCOc1ccc2c(c1)[C@@H](NC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)CCO2 1556275452 PMJBJPICMGZUIL-DEOSSOPVSA-N 432.520 4.488 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3Cc4cc(F)ccc4NC3=O)cc2Cl)C1 1556369235 JILCPMPVLCKFCO-KSSFIOAISA-N 429.923 4.143 10 10 IICE CC(=O)c1ccc(C(F)(F)F)nc1N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1 1559181930 LFYWLMUZSRNSHN-UHFFFAOYSA-N 443.425 4.126 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@@H]1c1ncc(Br)cn1)c1ccc(N(C)C)cc1 1564596674 FDAMKCIUXLZSRZ-RDTXWAMCSA-N 432.366 4.303 10 10 IICE Cc1ccc(NCCCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)nc1 1566180225 HXEDXWLTBXVHPM-UHFFFAOYSA-N 442.361 4.187 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1 1585263702 GMVBBJATJGLNBQ-MRXNPFEDSA-N 437.005 4.014 10 10 IICE CC(=O)c1c(C)cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1C 1596765962 FEHHXTXTNBUQFA-UHFFFAOYSA-N 442.427 4.442 10 10 IICE CCOc1ccccc1[C@@](N)(C(=O)N(C)Cc1ccc(N(CC)CC)cc1)C(F)(F)F 1608432968 WIRUOTBGWGFFDY-JOCHJYFZSA-N 437.506 4.306 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C 1618500425 NXLMTYVVWKXALC-QGZVFWFLSA-N 434.588 4.114 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](c2c(F)cccc2F)N(C)C)c1 1629415058 UDJPWKBIOUCGSV-JOCHJYFZSA-N 425.479 4.218 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cccc4c3O[C@H](C)C(=O)N4)cc2Cl)C1 1635126157 JJEPHTROOVGNER-LSDHHAIUSA-N 427.932 4.226 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(Nc2ccn(C)n2)cc1 1635676628 IADYITJLELLBTK-UHFFFAOYSA-N 429.318 4.294 10 10 IICE Cc1cc(C(=O)Nc2nncn2-c2ccccc2)c(C)n1-c1ccc(Br)cn1 1636587389 MPUDDXXBMHPAOF-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccccc3)[C@@H](O)C(F)(F)F)c2C)cc1 1636710739 SGHOMOMPQUCYJA-FCHUYYIVSA-N 446.469 4.367 10 10 IICE Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1)C2=O 1637244165 VJLPFWXPABPOKG-RTBURBONSA-N 442.515 4.475 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC1CC2(C1)CC2(F)F 1640043709 BIDUYQNTEJFVJT-NTUHNPAUSA-N 428.551 4.034 10 10 IICE Cc1cc(C(=O)Nc2cn(C)nc2-c2ccco2)c(C)n1-c1ccc(Br)cn1 1640770266 OKWWMFMLFNUTJE-UHFFFAOYSA-N 440.301 4.497 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(C(F)(F)F)CC1 1641897316 IPTIUQOLYOQMAQ-CYBMUJFWSA-N 430.426 4.063 10 10 IICE CCN(CC(F)(F)F)C(=O)CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1 1643615859 ZVRFHXFTMGTEAV-INIZCTEOSA-N 427.492 4.232 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC[C@@H](O)c2ccc(C(C)(C)C)cc2)N(C)C)cc1 1648477804 FEOVLHJBHIFGKY-BJKOFHAPSA-N 425.617 4.283 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2cn(C(C)(C)C)c(=O)nc2O)cc1 1651573781 BLCNOLJACBECSS-UHFFFAOYSA-N 448.527 4.115 10 10 IICE CCOc1ccccc1[C@](N)(C(=O)NCc1ccc(N(CC)CC)c(F)c1)C(F)(F)F 1654311887 COBABCHRJPFZPG-NRFANRHFSA-N 441.469 4.103 10 10 IICE CCCN(C[C@@H]1COc2ccccc2O1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1673745894 YOGSARNDDIAEDG-DENIHFKCSA-N 425.573 4.254 10 10 IICE C[C@@H]1CC[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CN1C(=O)OC(C)(C)C 1675001289 IGFXYXCOCDVLDF-MJGOQNOKSA-N 430.593 4.215 10 10 IICE C[C@@H](NC(=O)NC[C@](O)(c1ccc(Cl)cc1)C(F)(F)F)c1ccc(N(C)C)cc1 1686174086 WSKOTEHTRABRQO-YJYMSZOUSA-N 429.870 4.216 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc(Br)ccc2Cl)cc1 1687627799 BZHZJOVJFIWOHT-UHFFFAOYSA-N 440.769 4.389 10 10 IICE CCOCc1nnc(N2CCC([C@H]3CC3(F)F)CC2)n1CCCSc1nccs1 1710681658 ARIKVXKOEGCHCO-OAHLLOKOSA-N 443.589 4.325 10 10 IICE Cc1cccc(-c2nnc(N3C[C@H](C)S[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1724487036 MVYGLGZKEAOLGU-IRXDYDNUSA-N 440.592 4.232 10 10 IICE CCc1nnc(N2CCC(c3ccccc3CO)CC2)n1CCCSc1nccs1 1727547859 WILRWWRCYOVHGA-UHFFFAOYSA-N 443.642 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCN(C3CCCC3)CC2)cc1 1746091671 DWHSNOAZZYOYRP-UHFFFAOYSA-N 438.664 4.436 10 10 IICE CCc1nnc(N2CCN(Cc3cccs3)CC2)n1Cc1ccc(N(CC)CC)cc1 1764933234 XBYFMGYBZRZYQK-UHFFFAOYSA-N 438.645 4.119 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1765523430 MMVPSCZRUVCWNI-UGKGYDQZSA-N 427.593 4.029 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)CC1 1766319054 KQZDHRFCVDWDHP-JOCHJYFZSA-N 436.604 4.481 10 10 IICE O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 1858594389 XBVMIXWHHXLJKN-BMANGOCTSA-N 448.909 4.145 10 10 IICE CCCCN(C)C(=O)CCn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860345094 SVLSBBHEUUEWDM-UHFFFAOYSA-N 428.536 4.223 10 10 IICE COc1ccc([C@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@@H]2C(=O)O)c(O)c1 1952762780 MQKDKURUMGSHGH-ATIYNZHBSA-N 445.471 4.239 10 10 IICE COC(=O)c1c(C(C)C)nn([C@@H](C)c2ccc(C)cc2O)c1I 2078980150 ARRCMVHVBJJAFE-NSHDSACASA-N 428.270 4.021 10 10 IICE COC(=O)c1c(C(F)(F)F)nn([C@H](c2ccc(C)cc2O)C2CC2)c1Br 2079038292 YCULXPTVWYIJHG-ZDUSSCGKSA-N 433.224 4.464 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CNCc3cc(Cl)cc(Br)c3O)[C@@H]2C1 2138818908 RVNRBXLHYHGIGT-QLFBSQMISA-N 445.785 4.401 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1C[C@H]2CNCc1cc(Br)cc(F)c1O 2140716811 FKAYPIZKHYUZDO-PEYYIBSZSA-N 429.330 4.029 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NCc1cc(Br)ccc1O 2144151179 RMTXEHVTVILOKT-IEBWSBKVSA-N 433.346 4.435 10 10 IICE CN1CCN(c2ccc(N3C(=O)C(=Cc4ccccc4Cl)SC3=S)cc2)CC1 2321684691 MOOFTOGHJAPQBR-UHFFFAOYSA-N 429.998 4.498 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3cccc(C(=O)O)c3)C2=O)ccc1OC 2326973177 UJMYNSFOBJTMMC-UHFFFAOYSA-N 429.519 4.194 10 10 IICE COc1ccc(Br)c(CNC[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1O 2336898644 IXURDUQNTIKVQR-OAHLLOKOSA-N 431.371 4.192 10 10 IICE CCC[C@H](C(=O)NCc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2352941749 VIBYJZYYFLUPMG-CQSZACIVSA-N 429.355 4.115 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2N(C(=O)OC(C)(C)C)CCC2(C)C)c(O)c1Br 2380718753 AYAQXHXAZIHWKF-INIZCTEOSA-N 441.366 4.115 10 10 IICE O=C(CNC(=O)c1ccc(F)cc1F)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 11968085 JCHWQRVCVSDVTO-VWLOTQADSA-N 446.453 4.459 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14460014 ZDWGRAJKBSZWAF-PPSDVSMJSA-N 428.554 4.304 10 10 IICE COc1ccc(C(=O)Oc2ccc(/C=C3/C(=N)N4OC(C)=CC4=NC3=O)cc2Cl)cc1 20236724 UMLJWKJCDKMDAE-MEOLDJOHSA-N 437.839 4.018 10 10 IICE CCOc1ccc2c(c1)/C(=C1\SC(=S)N(Cc3ccc(Cl)cc3)C1=O)C(=O)N2 38160415 XWRASXKDJVPHNE-WUKNDPDISA-N 430.938 4.462 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccccc2)SC1=S)Nc1nc2ccc(F)cc2s1 39874946 YWLSKNVSHBVKON-NVNXTCNLSA-N 429.523 4.275 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(NCc3cc(Br)cc(F)c3O)CCC[C@@H]12 715745985 QBPBNXJLOGYFRO-DNVCBOLYSA-N 429.330 4.316 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3cc(Br)cc(F)c3O)C[C@H]2C1 715788871 MTWRVGKLGICJQY-NOLJZWGESA-N 443.357 4.419 10 10 IICE CC(C)N(Cc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769046448 ASFOSZZZAZMQMY-UHFFFAOYSA-N 438.591 4.478 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F 791246602 OYFYVSQQTVCTNW-AZUAARDMSA-N 430.495 4.457 10 10 IICE Cc1cc(C(=O)CONC(=N)c2cccnc2)c(C)n1-c1ccc(OC(F)(F)F)cc1 920400839 WBHVBZANCPOIRE-UHFFFAOYSA-N 432.402 4.117 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccc(Cl)cc1 1126067408 NCMNOQIHAXZXMP-NRFANRHFSA-N 439.918 4.351 10 10 IICE CNC(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1Br 1128748618 BOSNDGYQLVGFDV-UHFFFAOYSA-N 440.341 4.397 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1131031314 ZEHHZGUUWDGBSC-YDTSGJJXSA-N 431.536 4.441 10 10 IICE Cc1cnc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c(C)c1 1133376574 RQPMCRYCUUZMOR-LICLKQGHSA-N 431.608 4.058 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CCNC(=O)OC(C)(C)C)C(F)F)c1 1141286500 RDQCXFVGTNYJHQ-IBGZPJMESA-N 449.498 4.185 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3CC[C@H](N(C)C)C3)cn2)cc1-n1c(C)cc(C=O)c1C 1151424216 UXUYAPYZRDCTOR-QHCPKHFHSA-N 445.567 4.003 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(Oc2ccccc2)cc1C 1153665240 ZFEQHKDLNUTENF-NRFANRHFSA-N 435.476 4.103 10 10 IICE COc1ccccc1[C@@H](C)N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)OC 1176310404 DELVLXFVLQAPHF-MRXNPFEDSA-N 444.487 4.034 10 10 IICE CCOC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)C[C@H]1C(F)(F)F 1177035914 AERTZFNZWMSTEA-QZTJIDSGSA-N 426.410 4.047 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1nc(C(F)(F)F)n2c1CCCC2 1230200638 LNCGFAKQAYUUDG-OAHLLOKOSA-N 437.510 4.043 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1CN(c2ccc(C(F)(F)F)cc2)C1 1230201808 USQGVZLMNOYHAA-INIZCTEOSA-N 434.506 4.199 10 10 IICE Cc1cc(CNC(=O)N[C@H](CO)c2cccc(Br)c2)c(C)n1-c1ccccc1 1234325166 APWOTZMKHQXDOG-OAQYLSRUSA-N 442.357 4.389 10 10 IICE CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1289599430 BCKIKKNFYAZVLA-QFIPXVFZSA-N 445.007 4.423 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@@H](NC(=O)c2ccc(O)cc2)c2ccccc2)cc1 1291711722 UYOPHNXLALXMLO-RUZDIDTESA-N 445.563 4.416 10 10 IICE Cc1cc(C(=O)NC[C@@]2(N(C)C)CCSC2)c(C)n1-c1cccc(Br)c1 1294306154 VWSLKPGHUBQSCW-FQEVSTJZSA-N 436.419 4.024 10 10 IICE CC1(C)CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1303976883 SKIPMKZOXAEELA-OAHLLOKOSA-N 439.676 4.490 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCN3CCCCCC3)CC2)cc1 1315515461 MYKNLJJTUBKGIN-UHFFFAOYSA-N 440.636 4.003 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1350933782 QXHQYEBLFSHHAR-UHFFFAOYSA-N 429.492 4.163 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccnn1C1CCCC1 1352278649 NHSXRWXAPYZXEO-LGMDPLHJSA-N 444.557 4.367 10 10 IICE CC(C)(C)OC(=O)NCCCn1ccc2cc(C(=O)NCc3c(O)cccc3F)ccc21 1456027293 DQPRINUFOZBWRL-UHFFFAOYSA-N 441.503 4.331 10 10 IICE CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1465195867 SRDHUOUZFYWKNP-INIZCTEOSA-N 434.964 4.425 10 10 IICE Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)NCc2c(O)ccc3c2CCCC3)cc1 1465953337 FKSNRZFQWAXXPH-LJQANCHMSA-N 442.357 4.183 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)/C=C/c1cc2cnn(C(C)C)c2[nH]c1=O 1469205551 NHUITGAEHSGYOT-ZGBFETHSSA-N 434.540 4.189 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CO)c2ccccc2C(F)(F)F)c1 1472031811 UUFVKJDFDVQDKN-NRFANRHFSA-N 430.426 4.389 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@H]1CNC(=O)OC(C)(C)C 1478840888 JZGXWIVDUSRYAQ-RXVVDRJESA-N 432.609 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCc3c(ccnc3O)C2)cc1 1501840290 CUEKITQZBHLQNW-UHFFFAOYSA-N 434.588 4.034 10 10 IICE CCN(CC)c1nnc(-c2nnc(O)c3ccccc23)n1CCCSc1nccs1 1501871229 QULDALSJGCUNHL-UHFFFAOYSA-N 441.586 4.079 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1 1519586599 OWIGMRYDUKIALK-UNMCSNQZSA-N 429.358 4.084 10 10 IICE Cc1ccc(-c2nc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)cs2)o1 1526002569 FOMATWXWXOUKBD-GASCZTMLSA-N 429.517 4.394 10 10 IICE COc1ccc(C)cc1N1C[C@@H](C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1=O 1531604583 MXILBRPNVNDUQH-QFIPXVFZSA-N 445.563 4.389 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)cc2)CC1 1535155490 ACPGFFDUDXFRLO-RBUKOAKNSA-N 446.378 4.115 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)N(C)C)cc1 1539234822 GVBFIPOUVVBZBH-HXUWFJFHSA-N 437.481 4.361 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H](C(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543052087 MHMVWTOBYWGSGX-QFIPXVFZSA-N 449.647 4.435 10 10 IICE CN(Cc1ccon1)c1nnc(-c2ccc(Cl)nc2)n1CCCSc1nccs1 1554205539 ULCWEWDVUHQWFI-UHFFFAOYSA-N 447.977 4.257 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@@H]2Cc3c(Br)cccc3[C@H]21 1556481698 YUVBPNZXXWJESY-DAXOMENPSA-N 437.131 4.119 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC1(C)C 1565409575 RNEXFOKMGJFJSO-HXUWFJFHSA-N 432.609 4.318 10 10 IICE CN1C(=O)C[C@H](C(=O)NCCCSc2nccs2)[C@H]1c1ccc(Cl)c(Cl)c1 1565620346 PEXVCLXQMYFFPR-BLLLJJGKSA-N 444.409 4.268 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CCCN(c3ccccc3)C2=O)cc1 1595385217 LNRJSUWRRBSMKB-XMMPIXPASA-N 431.536 4.318 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCC[C@H]2C(C)C)cc1 1615374653 BCUBGEIBAXZHRC-QFIPXVFZSA-N 438.620 4.033 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(C3CC3)[C@@H](C)c3ccc(Cl)cc3)CC2)cc1 1615906770 GRCYCGDVYFMSPP-CYFREDJKSA-N 444.019 4.057 10 10 IICE Cc1ccc(CCC2CCN(C(=O)CN[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)cc1 1616856073 ARQMWDFLTNPVKV-HSZRJFAPSA-N 449.639 4.354 10 10 IICE COc1ccc(-c2cncc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)c2)c(C)c1 1622579407 YTEDTNRTDVVDKD-UHFFFAOYSA-N 435.499 4.176 10 10 IICE CCO[C@H]1C[C@](NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)(C(=O)OC)C1(C)C 1625393110 KWFPWGOEPSHNIR-OFVILXPXSA-N 426.557 4.188 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CCCc2cccnc21 1627180056 UGVXPVDFZZFQNQ-MUBYSKIDSA-N 443.619 4.318 10 10 IICE CCN(C[C@H]1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)C1)CC(F)(F)F 1630724133 DIPFDSRMPCXWLO-GOSISDBHSA-N 435.490 4.253 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2Cc3c(C)cccc3N2C(=O)OC(C)(C)C)c1 1631542945 NOHNUBHTKWUPNJ-MGPUTAFESA-N 426.513 4.253 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C(=O)NCC(F)(F)F)C2)c(C)n1-c1ccc(C(C)C)cc1 1634626516 UIRFPFPNOLNABC-GOSISDBHSA-N 435.490 4.358 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCC(=O)N(c2cccc(F)c2)C1 1635677019 UEWSIGIBRIWLMD-AWEZNQCLSA-N 449.320 4.086 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1636058818 SDFNTZKJVYIKRK-UHFFFAOYSA-N 449.345 4.373 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3cccc(F)c3F)CC2)c(C)n1-c1ccccc1 1637410166 IIVIKTAKFSMLJT-UHFFFAOYSA-N 438.522 4.447 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1638305934 RDIQDOFFJJCZKP-KRWDZBQOSA-N 439.339 4.451 10 10 IICE Cc1cc(C)cc(OCC(=O)N2CCN(Cc3ccc(N4CCCCC4)c(C)c3)CC2)c1 1653793344 ZTDHQCAMDBKLFR-UHFFFAOYSA-N 435.612 4.325 10 10 IICE O=C(NCC1CCN(C2CCOCC2)CC1)N(Cc1ccccc1O)C1CCCCC1 1682624171 AMSNPMFXOPEQHW-UHFFFAOYSA-N 429.605 4.128 10 10 IICE Cc1ccc(C)c([C@@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1683196027 XISJTWKKEODFPT-QFIPXVFZSA-N 429.511 4.465 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCC(C)(C)C(=O)N3CCCC3)cc2Cl)C1 1686269473 QCUSCXIXCCLMEV-QGZVFWFLSA-N 435.012 4.024 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@](C)(OC)C1CC1 1694001041 XEOVZZBUYZSOSS-UQBPGWFLSA-N 441.620 4.080 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H](OC)C(C)C)CC2)cc1F 1697471572 GSXGNWHAYCFXMQ-NRFANRHFSA-N 447.599 4.012 10 10 IICE CCc1nnc(N2CCN(c3ccccc3C)CC2)n1CCCSc1nccs1 1709139852 HGHMPOCEWSUYLT-UHFFFAOYSA-N 428.631 4.114 10 10 IICE CCN(CCc1cccs1)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)cc1C 1710133947 CTMCUVUHJYOFLI-UHFFFAOYSA-N 447.612 4.288 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCC(CCCO)CC1 1724236661 XXARDRIJVKMFJW-UHFFFAOYSA-N 439.648 4.422 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2Cc2sccc2C)cs1 1742566153 RZOZDTZZCMXYPY-UHFFFAOYSA-N 425.583 4.394 10 10 IICE Cc1ccc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)cn1 1761792105 GKZBEMSOAVTQSF-IFMALSPDSA-N 435.572 4.290 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@@](=O)CC)C(C)C 1764745279 AOWLQTQDBGJPGM-PMERELPUSA-N 427.618 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1764937039 MYTIQQJWDNKTOQ-XMMPIXPASA-N 448.615 4.020 10 10 IICE Cn1cc(-c2nnc(N3CC[C@H](C(C)(C)C)C3)n2CCCSc2nccs2)cn1 1769000598 YBXGKOLQFTUWOV-INIZCTEOSA-N 431.635 4.190 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1769713148 HAGIOHDTYCRKLK-GOSISDBHSA-N 425.602 4.331 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(CCc4cccs4)n4ccccc34)CC2)cc1 1858346761 ZCVINZTXWPVIHX-UHFFFAOYSA-N 446.576 4.152 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCc4ccc(C)cc4)cc3)CC2)cc1 1872882404 JMZHUEDLOKYWOT-UHFFFAOYSA-N 429.564 4.256 10 10 IICE C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OCc1ccccc1)c1ccccc1O 2017513994 AHWOLHJUAUVNJE-FVJLSDCUSA-N 428.529 4.068 10 10 IICE O=C(O)CCN1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S 2296882454 VTLCJQQFCODNFA-UHFFFAOYSA-N 438.870 4.184 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(NC(C)=O)c3)C2=O)cc(OC)c1OC 2321683193 UVGMPDGXYIJLQK-UHFFFAOYSA-N 444.534 4.077 10 10 IICE O=C(O)CCCN1C(=O)C(=Cc2cn(C3CCOCC3)c3ccccc23)SC1=S 2326954780 XKDIZWRUCWWGCN-UHFFFAOYSA-N 430.551 4.059 10 10 IICE CCCC1=NN(CCC)C(=O)C1=Cc1ccc(OCC(=O)N(CC)CC)c(OCC)c1 2332139660 FMJXKASIQFPUPI-UHFFFAOYSA-N 429.561 4.124 10 10 IICE Cc1ccc(CN[C@H]2C[C@H](NC(=O)OC(C)(C)C)C23CCC3)c(O)c1Br 2352684824 TZYIHFRBIRRTGM-GJZGRUSLSA-N 425.367 4.389 10 10 IICE O=C1/C(=C\c2ccccc2)SC(=S)N1CCCCCC(=O)N1CCCC[C@H]1CCO 33544395 DNOHGBBVRNMVBK-ZMESVYRVSA-N 446.638 4.212 10 10 IICE COCCNCc1ccc(N2CC[C@@H](COCc3ccccc3)C2)cc1Br 384180052 ZYHFCCWUKURFMJ-LJQANCHMSA-N 433.390 4.228 10 10 IICE C/C(=C\C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccccc1C(F)(F)F 741915282 SKUNIORCWDXZSV-IYICPGQYSA-N 445.485 4.127 10 10 IICE COc1cc(N2CCN(C(=O)/C(C)=C\c3ccc(Cl)cc3)CC2)cc(OC)c1OC 759226043 SHBYTRITQPVXPB-SSZFMOIBSA-N 430.932 4.118 10 10 IICE Cc1ccc(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)c(OC[C@@H]2CCOC2)c1 766557803 SFWHUWJARKWWRS-VQTJNVASSA-N 428.548 4.237 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccccc4C)n3C[C@H]3CCCO3)CC2)cc1 812307709 XRFVFTBQTRPHMA-HSZRJFAPSA-N 447.583 4.158 10 10 IICE Cc1ccccc1-c1csc(NS(=O)(=O)c2ccc(NC(=O)C(F)(F)F)cc2)n1 917886445 VBJJFBFZQQDITG-UHFFFAOYSA-N 441.456 4.420 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)c2csc(-c3ncccn3)n2)c1C 920530666 FKCYPOCXHUZVOT-UHFFFAOYSA-N 432.505 4.356 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)c(F)c3C)cc2F)CC1 1125975991 GRRHZCZMWJYBLD-UHFFFAOYSA-N 441.444 4.364 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cncc(C(=O)OC(C)(C)C)c2)C1 1130436088 VWIDBRZGGVRPOH-UHFFFAOYSA-N 448.567 4.397 10 10 IICE CNC(=O)c1cc2cc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)ccc2[nH]1 1139670421 DYYKCCVIJYGRDM-UHFFFAOYSA-N 428.492 4.308 10 10 IICE COC(=O)C[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C1CCCC1 1155562772 YDLHLYVDNCZYAC-SFHVURJKSA-N 448.361 4.103 10 10 IICE COC(=O)/C=C/c1ccc(N(C)CC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c([N+](=O)[O-])c1 1162644308 JNECDYABBNVEER-QXLXQBSBSA-N 435.521 4.157 10 10 IICE CC(C)(C)Cc1nnc(N2CCN(C3CCC3)CC2)n1CCCSc1nccs1 1287033050 DGPKFJNKXRVVIS-UHFFFAOYSA-N 434.679 4.180 10 10 IICE Cc1ccc(OCC(=O)N2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)cc1 1292695930 MWRUOZQXLMJSPN-UHFFFAOYSA-N 445.563 4.074 10 10 IICE Cc1cc(C(=O)N2CCN3C(=O)N(CC(C)C)C[C@@H]3C2)c(C)n1-c1ccc(C(C)C)cc1 1297400331 IUKJHPNSSDKTJH-QHCPKHFHSA-N 436.600 4.436 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(C(C)(C)C)CC2)cc1F 1298060237 FNVYMUITPVQXFL-UHFFFAOYSA-N 430.616 4.041 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(-n2nc(C)c(Cl)c2C)cc1 1299700662 SRLGELQOBVECBI-UHFFFAOYSA-N 441.915 4.054 10 10 IICE COc1ccc(N2CCN(Cc3c(C)nn(Cc4ccccc4)c3Cl)CC2)cc1F 1307572768 ANWYMGXZAOFASC-UHFFFAOYSA-N 428.939 4.363 10 10 IICE CCc1ccc(-c2nc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cs2)cc1 1355124344 VKTJSIWGHFUIPU-UHFFFAOYSA-N 425.529 4.278 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)[C@H]1CCC[C@@H](OC)C1 1461289790 XZJRLGZJLSRAOP-YRISNDGFSA-N 432.948 4.224 10 10 IICE Cc1cc(CC(=O)Oc2cc(C(N)=O)ccc2Br)c(C)n1-c1ccccc1 1461329958 FEXDASPSKHHWLU-UHFFFAOYSA-N 427.298 4.104 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3sc(COc4ccc(F)cc4)nc3C)C2)cc1 1461498187 YEJVLCQWDXBUAL-KRWDZBQOSA-N 441.528 4.187 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccnc3Nc3ccccc3OC)C2)cc1 1469279991 IWRFPTJKIGAFJJ-GOSISDBHSA-N 432.524 4.099 10 10 IICE Cn1ccc(Nc2nnc(Cc3c(F)cccc3F)n2CCCSc2nccs2)n1 1503663815 RDELMLHJNROFPU-UHFFFAOYSA-N 447.540 4.263 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCC2)nnc1N1C[C@@H](C)O[C@@H](C(F)(F)F)C1 1510671554 DADAOOGKOZFWIS-DNVCBOLYSA-N 437.510 4.124 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cn4ccccc4n3)nnc2N(CC)CC)cc1 1515527186 KCIKVJMVNGUAJM-UHFFFAOYSA-N 431.588 4.257 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)CC1 1517583864 IYQIBRXDBJVUPU-SFHVURJKSA-N 434.588 4.115 10 10 IICE CCn1cc(Br)c(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)n1 1519550922 JPLKOOKKPOZRKN-CYBMUJFWSA-N 439.785 4.485 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(OCC(F)(F)C(F)F)nc1 1525106566 JKXZWBFHAWMSPO-UHFFFAOYSA-N 425.426 4.233 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@H]1c1ccncc1 1540585953 CGVQMTHYSJRNFE-OGBKAESYSA-N 441.553 4.176 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)c(C)ccc4[nH]3)CC2)cc1 1545556429 JFLSUSWCEBMFPR-UHFFFAOYSA-N 428.330 4.210 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1(c2cccc(OC(F)(F)F)c2)CCC1 1557640827 UXADJKHKZRFXJL-UHFFFAOYSA-N 448.485 4.284 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 1558387820 KHBVEAMPKMOVMK-FQEVSTJZSA-N 445.332 4.329 10 10 IICE C[C@H]1CN(CCOc2ccc(CCNC(=O)NCc3cc(Cl)ccc3O)cc2)C[C@@H]1C 1564464804 VBYFKYGHDWYAPF-ROUUACIJSA-N 445.991 4.054 10 10 IICE Cc1nc(COc2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc2)no1 1565699882 GEGVXVISFZQAGF-UHFFFAOYSA-N 430.464 4.429 10 10 IICE CCO[C@@H]1CCCC[C@H]1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1583817518 RJZSVOWBVAHFEV-CKEVDEADSA-N 438.640 4.193 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(N3CCCCC3=O)cc2)cc1 1597474903 PDUWWUCALSTPEC-UHFFFAOYSA-N 443.547 4.282 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCO[C@@](C)(C(C)(C)C)C1 1611964262 QPWRCNASOWATPU-PXDATVDWSA-N 441.620 4.194 10 10 IICE COCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CCC1 1619768443 QGUGTJJFZLRBSB-RUZDIDTESA-N 437.588 4.129 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C3)c2C)c1 1621985028 OGSJEDIIRDEPID-GCJKJVERSA-N 441.572 4.157 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](C)N3CCN(c4ccccc4)CC3)c2C)c1 1624671898 FYNRQZXUKORBRO-JOCHJYFZSA-N 430.596 4.343 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1ncc(Cl)s1 1625484286 LKINHXPITQPCBY-YRNVUSSQSA-N 444.028 4.156 10 10 IICE COC(=O)[C@@H](C)CN(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CC1 1626559147 WZWSWPDWHVXLDO-ZDUSSCGKSA-N 433.346 4.270 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2nccn2Cc2ccccc2)cc1 1628969022 ISQYQIWGSQRPHV-UHFFFAOYSA-N 440.547 4.353 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCCSC[C@H]1c1ccccc1 1635996699 JOWPEFWYPPABNK-NRFANRHFSA-N 447.551 4.191 10 10 IICE Cc1cccc(CCCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1636147632 XGGMNWHAPGOVOK-UHFFFAOYSA-N 427.346 4.318 10 10 IICE Cc1cc(C(=O)NCc2csc(NC(=O)OC(C)(C)C)n2)c(C)n1-c1ccccn1 1636961673 QTVUDWZINOZFRF-UHFFFAOYSA-N 427.530 4.223 10 10 IICE COc1ccccc1CN(OC)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1637185638 WMBNQQAZHXRGGH-UHFFFAOYSA-N 444.329 4.464 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C2CC2)CC[C@@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1643394557 LGAGWJHQEKOXMN-FCHUYYIVSA-N 427.589 4.471 10 10 IICE FC(F)(F)c1cc(N2CCOCC2)ccc1CNc1cc(Cl)nc([C@@H]2CCCO2)n1 1650644186 RRGYLBAKYKEKQB-INIZCTEOSA-N 442.869 4.449 10 10 IICE COC[C@H](SCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1652237256 IDBKOQVVJVBLGT-IXFSTUDKSA-N 446.588 4.176 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(Cc2cccc(Cl)c2)CC1 1673744072 JSWYPSIBQYRXAO-IBGZPJMESA-N 429.008 4.173 10 10 IICE C[C@H](NC(=O)N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1)c1ccc(N(C)C)cc1 1681552552 OSPHINCADMHZEO-ORYQWCPZSA-N 434.506 4.143 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@H]3c3ccc(Cl)cc3)cc2)CC1 1685328276 UWRUHYZBAAUXPW-QFIPXVFZSA-N 440.975 4.088 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]([C@H]1C)N2C(=O)OC(C)(C)C 1687270508 FRYKVFWEEMELAY-UPZYVNNASA-N 444.620 4.461 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1710955823 KVRFJAOKBAJBBG-HKUYNNGSSA-N 449.640 4.393 10 10 IICE COC1(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)CCC(C)CC1 1769777513 HLPHBJFGMUCUPX-UHFFFAOYSA-N 435.572 4.201 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)c(CCC(=O)O)s2)s1 1858070299 NVKXUOCMGVWDKL-UHFFFAOYSA-N 428.582 4.314 10 10 IICE CCN1C(=O)C(Nc2ccccc2C(=O)OC)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422541 CGNPYZAUUXBOGL-UHFFFAOYSA-N 443.503 4.093 10 10 IICE CCOC(=O)c1c(C2CC2)nn([C@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080003822 RNMWMBXGATWISM-SFHVURJKSA-N 435.318 4.413 10 10 IICE CCOc1ccc(C=C2C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc1OCC 2313548767 FLDHDAOAHHSQIL-UHFFFAOYSA-N 430.460 4.304 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3ccccc3[N+](=O)[O-])SC2=S)N(C)C)cc1 2323879973 ANTJXZCSOPUGEH-GOSISDBHSA-N 443.550 4.108 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H](C(C)C)n3cnc4cc(F)c(F)cc43)CC2)cc1 109506882 HGAUYWORFVPCDO-QHCPKHFHSA-N 442.510 4.259 10 10 IICE CCCNC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 586625689 YAQWJSQULCHFIC-UHFFFAOYSA-N 427.460 4.246 10 10 IICE CC(C)(C)OC(=O)Nc1c(C(=O)O)cc(Br)c2c1C(=O)c1ccccc1C2=O 725374249 ACFYTTIMJRWPPT-UHFFFAOYSA-N 446.253 4.270 10 10 IICE CC[C@H](NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1nc2ccccc2[nH]1 727476650 ZVAZOTNHGBOBPU-MDZRGWNJSA-N 439.535 4.266 10 10 IICE COc1ccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cc1OC 729110635 UTSAYXIVVQMJHE-UHFFFAOYSA-N 444.456 4.354 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1F 731365027 ZLOFSERLZMGULV-UHFFFAOYSA-N 432.584 4.042 10 10 IICE COc1ccc(-c2nc3c(s2)[C@H](NC(=O)NCc2cc(OC)ccc2O)CCC3)cc1 734070635 XOIVVHYDWLXVEN-LJQANCHMSA-N 439.537 4.410 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 741216805 MSCIIJSHKCTEQC-SFTDATJTSA-N 448.485 4.214 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ncoc1-c1ccccc1Cl 742079798 NDNWJFLGEKAYQH-UHFFFAOYSA-N 425.916 4.134 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 768237132 KUGHVQPUAOGSCU-FYYLOGMGSA-N 429.605 4.135 10 10 IICE O=C(/C=C/c1ccc2ccccc2n1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768534378 YHBSXUVOECUSNA-SDNWHVSQSA-N 426.564 4.096 10 10 IICE Cc1oc2c(CN3CCC(Oc4cnccn4)CC3)c(O)ccc2c(=O)c1-c1ccccc1 782886339 KYJHFVKENKLYOH-UHFFFAOYSA-N 443.503 4.307 10 10 IICE C[C@H](Cn1ncc2ccccc21)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 790458027 AQCOZFAGTWFTDR-MRXNPFEDSA-N 428.483 4.059 10 10 IICE O=C(NCc1cc(Cl)ccc1N1CCOCC1)NCc1cc(Cl)cc(Cl)c1O 805437743 PCRRXIPMIVLWIY-UHFFFAOYSA-N 444.746 4.188 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1C(C)(C)C 917711280 FOPRKEYZXLORDD-CALCHBBNSA-N 430.568 4.444 10 10 IICE CC(C)N(Cc1ccco1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1124878694 RHMMIXCWTVKDNL-PDGQHHTCSA-N 432.542 4.447 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@@H](C)Cc3cc(C(F)(F)F)cc(Cl)c32)c1 1133395340 ZDGGUFNTRWSPRC-MVZIDQBPSA-N 437.849 4.352 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(OC)cc1 1165498560 NYBVEPZJYGZMHN-REWPJTCUSA-N 444.959 4.450 10 10 IICE C[C@H]1CCCCN1CCCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1291097932 FCKZAMOQZUJVCH-NRFANRHFSA-N 448.615 4.261 10 10 IICE COCC[C@H](Cc1ccco1)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1296272332 XSNFQYWQMYNSFD-QGZVFWFLSA-N 446.345 4.222 10 10 IICE COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCN(c2ccc(OC)c(F)c2)CC1 1307573650 IGVXOSRLCZZFMI-IBGZPJMESA-N 427.303 4.177 10 10 IICE CC(C)=CCC[C@H](C)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1357232236 YZMYHVLABMFVKZ-FQEVSTJZSA-N 439.579 4.331 10 10 IICE CC(C)Cn1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C(F)F)n1 1360045531 KSIKQOKQNCWLMO-UHFFFAOYSA-N 442.457 4.477 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)OCc1ccc(Cl)nc1 1360469210 CXAXMAGHIIKTMQ-OQLLNIDSSA-N 436.917 4.209 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)Nc2ccc(O)cc2)CC1 1445654261 JPBQPZWPJNZXCD-UHFFFAOYSA-N 445.519 4.103 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cn1 1465771195 YXEZYTVGRDJVDV-KRWDZBQOSA-N 448.361 4.198 10 10 IICE O=C(c1cc(F)c(Br)cc1F)N(Cc1ccccc1O)C[C@H]1CCCO1 1466290256 USMMDMBSHUREBH-CYBMUJFWSA-N 426.257 4.254 10 10 IICE Cc1cc(CNC(=O)N2C[C@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1471036469 CZMKHQJJRURVLG-OXJNMPFZSA-N 426.561 4.291 10 10 IICE COCCO[C@]12CCC[C@@]1(NC(=O)c1cc(C)n(-c3cccc(Cl)c3)c1C)CCO2 1472289769 OGMYYRZGHCVDHV-DHIUTWEWSA-N 432.948 4.180 10 10 IICE COc1cc(N2CCN(Cc3csc(-c4ccccc4)n3)CC2)c([N+](=O)[O-])cc1OC 1472677296 NZUHTKANMRMTFC-UHFFFAOYSA-N 440.525 4.058 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(Cc2ccco2)Cc2cccs2)N(C)C)cc1 1479534740 NXCLPPCPWAOBDI-JOCHJYFZSA-N 426.586 4.422 10 10 IICE CC(C)c1csc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1508891625 SCSOJCIFQGKCAP-KRWDZBQOSA-N 427.574 4.142 10 10 IICE COC(=O)[C@@H](C)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1515268983 HCRBLJUCFORHBD-AFMDSPMNSA-N 447.579 4.074 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCc2ccccc2OC(F)F)CCCC1 1523454449 RFHMTHLWYLGUEZ-UHFFFAOYSA-N 428.479 4.489 10 10 IICE CCc1c(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)nnn1-c1cccc(Cl)c1 1525762172 LXAIYFYBDFYVGJ-INIZCTEOSA-N 425.964 4.219 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1COCc1ccccc1 1527481390 KYWDVYQSDPCRBV-UHFFFAOYSA-N 434.511 4.309 10 10 IICE Cc1ccc(C(=O)NCc2cccc(Cn3cccn3)c2)cc1-n1c(C)cc(C=O)c1C 1542198901 ALVDRALUYTWVHJ-UHFFFAOYSA-N 426.520 4.390 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(I)c(F)c2)cc1F 1543251024 DLPNYAMBCWTHBH-UHFFFAOYSA-N 444.263 4.346 10 10 IICE COCCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1 1555409355 RKZTWUTWARPPJC-UHFFFAOYSA-N 437.588 4.252 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)Cc1ccc(O)cc1 1565616416 HFEQMDYENVZQDM-SFHVURJKSA-N 440.927 4.215 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1C 1568939142 LTQWKZVNEZWMNW-UHFFFAOYSA-N 429.517 4.044 10 10 IICE Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NCc1ccc2cccnc2c1O 1570533959 YNFLRLOZQCRUFC-UHFFFAOYSA-N 437.297 4.127 10 10 IICE CN(c1ccccc1)c1ccccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1583379044 LNOLRRJGYBXSSF-UHFFFAOYSA-N 437.490 4.499 10 10 IICE COc1cccc(C(=O)CCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1595582513 DIFMWYGBEFTJCG-HXUWFJFHSA-N 444.959 4.188 10 10 IICE CN(CCc1ccccc1C(=O)NCc1ccc2c(c1)CCCN2C)C(=O)OC(C)(C)C 1597848792 MNJRBEZPEMVHRR-UHFFFAOYSA-N 437.584 4.408 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)Nc1nc(C(F)(F)F)ccc1I 1612240936 GHEHKGNALLBMFF-MRVPVSSYSA-N 438.187 4.159 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H](SC)C(C)(C)C 1613920942 DVQRLSOZGRWJGY-HXUWFJFHSA-N 431.650 4.091 10 10 IICE Cc1ccccc1Nc1nc(N)nc(CN2CCCc3cc(OC(F)(F)F)ccc32)n1 1615954033 GCALESHLHIUMCE-UHFFFAOYSA-N 430.434 4.357 10 10 IICE O=C(Cc1cc(C(F)(F)F)ccn1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1620740508 YBBWMZWLSIEPDR-CQSZACIVSA-N 429.389 4.030 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)c2)n1 1626723039 QQPIRJZZMUHGMX-GOSISDBHSA-N 433.556 4.278 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@@]23CCCN(C(=O)OC(C)(C)C)C3)cc1F 1627604670 NOXGBSHFNVAXAS-MHECFPHRSA-N 433.568 4.325 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)/C(F)=C\c1ccc(F)c(C(F)(F)F)c1 1630486417 LSNWZKILDOHBGD-LICLKQGHSA-N 443.368 4.452 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CC(c2cc(C)ccc2C)=NO1 1635676537 FTZLVXMLZSIPPE-FQEVSTJZSA-N 431.330 4.313 10 10 IICE Cc1ccccc1[C@@H](O)CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1635692516 XQFHIYQQENLXJA-IBGZPJMESA-N 428.330 4.023 10 10 IICE O=C(CN1CCCCC[C@H]1C(F)(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1654778334 YQIFHVSFLPOGMT-SFHVURJKSA-N 430.426 4.207 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)CCc3ccccc3)cc2Cl)C1 1672136506 BNOFEWNATOPHRE-WIYYLYMNSA-N 429.992 4.369 10 10 IICE CCCCN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H](C)c1ccc(C)o1 1685327316 ATQPKNWCENOWQL-IBGZPJMESA-N 440.588 4.363 10 10 IICE CCC1(CC)CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1694463700 OVIAOQKRCZWPIA-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1748477243 NZICZTZAMNFAFE-VWLOTQADSA-N 425.621 4.439 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1763291486 TUCQQCBVGDUKLT-OXJNMPFZSA-N 439.583 4.018 10 10 IICE C[C@H](NC(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)c1ccccc1 1860343559 GOOQRWNJTHNVMY-SFHVURJKSA-N 448.526 4.452 10 10 IICE Cc1cc(C)c2c(=O)cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)[nH]c2c1 1866486917 BPNICYUDLQTALI-XMMPIXPASA-N 446.595 4.168 10 10 IICE CN(C)c1ccc([C@H](O)C2(NC(=O)OC(C)(C)C)CCN(Cc3ccccc3)CC2)cc1 2044718623 KLUPQAVBGIUOFU-QHCPKHFHSA-N 439.600 4.346 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3c(O)cccc3Br)CCC[C@H]12 2087287574 TWPQKFAOLPDJCL-PXNSSMCTSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C2CC2)c1O 2236051517 UKUBKTXSCPSUGM-NVXWUHKLSA-N 441.366 4.041 10 10 IICE CCOC(=O)CN1C(=O)S/C(=C\c2cc(C)n(-c3cc(Cl)ccc3OC)c2C)C1=O 1161470 IMJJYDSLCLYZDR-NVMNQCDNSA-N 448.928 4.356 10 10 IICE Cc1cc(C(=O)COC(=O)c2cccc(C[S@](C)=O)c2)c(C)n1-c1ccc(F)cc1 10236498 BIEDSQQBOKOUFI-SSEXGKCCSA-N 427.497 4.151 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cc(C)ccc3C)C2)sc2c1CCCC2 15464722 CGXOPENESXCBPV-INIZCTEOSA-N 440.565 4.412 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(Nc3ccccc3)C2=O)ccc1OCCC(=O)O 16919695 VNPNKNPYSFTBBA-QGOAFFKASA-N 444.534 4.167 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCCCC3=O)cc2)c(C)n1-c1ccc(C#N)cc1 303200437 OCOWVLPAPFPOCS-UHFFFAOYSA-N 426.520 4.413 10 10 IICE CC(C)N(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C1CCOCC1 740789693 UTSZCQOEWKWJST-LGMDPLHJSA-N 438.640 4.146 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCO[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c1 753205223 ABJHRNVZSYJPTA-VNOPPTIDSA-N 435.524 4.158 10 10 IICE CN1[C@H]2CC[C@H]1CC(N1CCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CC1)C2 757642472 MCAJMJPHURGWRG-ZEQRLZLVSA-N 446.599 4.283 10 10 IICE Cc1nn(C)c(C)c1[C@@H](NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(F)(F)F 757888654 XEEJFNMGRQUYJT-HXUWFJFHSA-N 437.510 4.472 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2ccccc2C)cs1 761344008 VOUOVHZTXIPKFB-UHFFFAOYSA-N 443.550 4.276 10 10 IICE Cc1nn(C)c(C)c1[C@@H]1COCCN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 772380801 FDYOCUUEUITNLZ-QFIPXVFZSA-N 432.528 4.464 10 10 IICE CCOC(=O)c1csc(CCNC(=O)N(Cc2ccccc2O)C2CCCCC2)n1 786848018 VETGPOHNZXXCRJ-UHFFFAOYSA-N 431.558 4.112 10 10 IICE Fc1cc(CNc2ncc(C(F)(F)F)s2)ccc1N1CCN(c2ncccn2)CC1 790765346 MPNDPTJTPFSDOC-UHFFFAOYSA-N 438.454 4.030 10 10 IICE O=C(Nc1cc(F)ccc1C(=O)NCc1cc(Br)ccc1O)c1ccoc1 804738859 HQTWWEFWRADDDN-UHFFFAOYSA-N 433.233 4.069 10 10 IICE CN1CCC[C@@H](CNC(=O)NCc2cc(Br)ccc2O)[C@@H]1c1cccs1 806856023 CODZVUABTJDBFM-SCLBCKFNSA-N 438.391 4.099 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@@H](NC(=O)OC(C)(C)C)C3)c2C)cc1 918681012 AOGUEDKCTQYKJJ-GOSISDBHSA-N 427.545 4.232 10 10 IICE COC(=O)CCN(C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1C 1127875993 VAMHJVYWWFKLSI-UHFFFAOYSA-N 434.536 4.433 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1c(F)cccc1I 1136428612 GEFPYHKCHKFCAW-UHFFFAOYSA-N 426.273 4.159 10 10 IICE CCCn1c(C)c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c2cc(OC)ccc21 1150240024 MSYPMDRRZLLMDY-UHFFFAOYSA-N 439.531 4.478 10 10 IICE CC(C)(C)OC(=O)NCC[C@H]1Cc2ccccc2N(C(=O)/C=C\c2ccc(O)c(O)c2)C1 1156511722 LLNHVIYNJCOFJD-FYGXRCCRSA-N 438.524 4.231 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](Oc3ncccc3F)C2)cc1 1156847392 XNUOJKCSIQNODN-QFIPXVFZSA-N 435.499 4.053 10 10 IICE COC1CCN(c2ccc(CN[C@@H]3CCN(C(=O)OC(C)(C)C)CC3(C)C)cc2)CC1 1169745231 QXRDZGTYSBYIFA-JOCHJYFZSA-N 431.621 4.427 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccn4)CC3)cc2Cl)C1 1227207241 FPBQFWAMLQBVBL-GOSISDBHSA-N 427.980 4.003 10 10 IICE CCN(CC1CCN(c2ccccn2)CC1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1251982830 XFMUINBMSNAKGI-NRFANRHFSA-N 437.632 4.335 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](Cc2ccc(Cl)cc2)C(N)=O)c1 1271692826 TUFCMOYPPCDHLR-HXUWFJFHSA-N 430.335 4.227 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1289602293 ODMBHYKOBQGGTH-HXUWFJFHSA-N 426.561 4.356 10 10 IICE Cc1ccc(-n2nc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2C)cc1 1294859611 MZMKAIWHWYUNOW-HXUWFJFHSA-N 438.959 4.243 10 10 IICE CC[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1312994933 PZNUATAPCVFYSI-RBUKOAKNSA-N 446.389 4.357 10 10 IICE COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1313414821 NSUUSTGLZSUCSE-RDPSFJRHSA-N 438.616 4.343 10 10 IICE CN(C)c1ccc(CNC(=O)c2c(Cl)ccc(I)c2F)cc1 1353504173 PIPMVTNURPBHKE-UHFFFAOYSA-N 432.664 4.080 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C(C)(C)c3ccc(Cl)cc3F)CC2)cc1 1353707223 NDQIETRRAIYHHC-UHFFFAOYSA-N 447.982 4.094 10 10 IICE C=CS(=O)(=O)CCC(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1353905768 CXODCIWFPHHWQK-UHFFFAOYSA-N 433.530 4.244 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cnn(-c2ccc(Br)cc2)n1 1354323868 KIWKPKHYSADAFJ-UHFFFAOYSA-N 442.361 4.147 10 10 IICE CCCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1cccc(C)c1 1436968383 BGPGJEFBBVYZGF-FQEVSTJZSA-N 432.568 4.398 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(Cl)cc4)[nH]n3)cc2F)C[C@@H](C)O1 1441780480 GJUXSPJYNJFYFQ-HUUCEWRRSA-N 442.922 4.413 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c1 1441880453 BDHKZEJHTJSASQ-UHFFFAOYSA-N 445.563 4.032 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cnc(Nc3ccccc3)nc2C(F)(F)F)c1 1445964191 CEBSLCGAJQCEDC-LBPRGKRZSA-N 432.402 4.444 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc(F)c2c1CCCC2 1446815572 MMYQOMJSGVISBD-UHFFFAOYSA-N 433.907 4.198 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@]3(C)CC(c4cccc(Cl)c4F)=NO3)C2)cc1 1452033498 UPVYCOKLYURBFD-IQMFZBJNSA-N 445.922 4.014 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(N(C)C)c(C=O)c2)cc1 1464994740 AKCDGVQVBRCTIR-UHFFFAOYSA-N 431.536 4.487 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2nn(-c3cc(Cl)ccc3F)c3c2CCC3)c1 1465993728 VZFIBUUCWRZOQG-GFCCVEGCSA-N 429.879 4.359 10 10 IICE COc1ccc(N2CCCN(Cc3cn(-c4ccc(Cl)c(Cl)c4)nn3)CC2)cc1 1473116054 VJXKFKYFCIUQTE-UHFFFAOYSA-N 432.355 4.295 10 10 IICE C[C@H]1CN(C(C)(C)Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)C[C@@H](C)O1 1512365912 RAYMIBZXCVBYGA-KDURUIRLSA-N 443.636 4.097 10 10 IICE CC/C=C/Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@@]1(OCC)CCOC1 1514217015 FWQXCNSZMFTUTR-ZHBSTKLQSA-N 439.604 4.133 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC[C@@H](CCOC)C2)cc1 1515524626 GMPHADRGYQOQQV-NRFANRHFSA-N 436.604 4.041 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CC(=O)Nc2c(C)cccc2C)CCCC1 1524617119 LPGURUHOVYYZBV-UHFFFAOYSA-N 433.552 4.243 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-c2ccccc2Cl)on1 1527863947 AGMSTWBFAFLJCS-UHFFFAOYSA-N 433.842 4.040 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(C(=O)c3cscn3)[C@@H](C)C2)c1 1528065158 XHEFNWMBCYCHNJ-INIZCTEOSA-N 442.972 4.191 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2c2ccccc2)c(C)n1-c1ccc(Br)cn1 1544742298 DFLLMRLFDCERIV-HXUWFJFHSA-N 440.341 4.465 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@@H](CSc3ccccc3)C2)N(C)C)cc1 1565452642 IOJPPRKEGYAMIL-AUSIDOKSSA-N 426.630 4.179 10 10 IICE CCCCCCn1nc(C(=O)NCc2ccc3cccnc3c2O)c2ccccc2c1=O 1570531514 HZOGBFDRJDYVLU-UHFFFAOYSA-N 430.508 4.161 10 10 IICE Cc1cc(Br)cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1N 1583281147 OEMBBPCKMRHDRJ-UHFFFAOYSA-N 443.389 4.124 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCOC(C)(C)C1 1611963595 VIJKOMFQIANTHY-UHFFFAOYSA-N 440.979 4.031 10 10 IICE CO[C@@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccccc1 1626509298 QIMDFIRLTDUKKU-IBGZPJMESA-N 428.330 4.369 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(C(F)(F)F)cc4)c3)CC2)cc1 1630992432 PLCJEIMZRMHRSH-UHFFFAOYSA-N 444.457 4.252 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1631906384 OOQRSJCIQVAPFQ-IBGZPJMESA-N 426.561 4.399 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCC(=O)c3cc(Cl)sc3Cl)C2)cc1 1632611619 FWNCROZFNGNBLV-LBPRGKRZSA-N 427.353 4.422 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1cccc(Cl)c1 1633290381 JBHDFSSRWALTCU-FQEVSTJZSA-N 425.891 4.422 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](n3ccnn3)CC2)c(C)n1-c1ccc(Br)cc1 1634165285 MNIGMYALVZOXPI-GOSISDBHSA-N 442.361 4.316 10 10 IICE CC(=O)Nc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1635946434 KIBMKBNRICOGNB-KRWDZBQOSA-N 436.339 4.052 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3cccc(F)c3)C[C@H]2C)cc1 1638376009 JDHFEQXHBDAWHR-LJQANCHMSA-N 433.527 4.326 10 10 IICE CCc1onc(-c2ccccc2Cl)c1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1641204575 UKPUEVQSNKWZCB-UHFFFAOYSA-N 439.943 4.449 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)CN(C)c3ccc(-c4nccs4)cc3)cc2)C[C@H](C)O1 1643359739 BAQRQCYRPYLPRT-ROUUACIJSA-N 436.581 4.499 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@]3(C[C@@H](C)C[C@@H](C)C3)C2=O)c(C)n1-c1cccc(F)c1 1652735655 KHJYHLLFVJPVSK-SFLZPUPLSA-N 425.504 4.163 10 10 IICE CCN(C)c1ccc(CN(CCOC)C2CCN(C(=O)OCc3ccccc3)CC2)cc1 1654098186 YNPJCVUHAAWENJ-UHFFFAOYSA-N 439.600 4.392 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3ccc(Cl)c(F)c3)C[C@@H]2C)c([N+](=O)[O-])c1 1655537080 GUZSYHNVSRVPMY-VCDPDADVSA-N 433.867 4.289 10 10 IICE O=C(NCCOc1ccc(Br)cc1C(F)(F)F)N1Cc2cccc(O)c2C1 1681028060 FLPNXMZKBNBCBO-UHFFFAOYSA-N 445.235 4.278 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3csc(Br)c3)C2)cc1 1682187971 BTSWULXTMQQPBW-CQSZACIVSA-N 438.391 4.187 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2cnn(C)c2C)cc1 1695615551 AKCNTLPEUNJZCE-UHFFFAOYSA-N 447.587 4.419 10 10 IICE COCC1=CCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC1 1697825695 IIUSUIYUYIPGTR-UHFFFAOYSA-N 442.614 4.070 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709218851 WESGHVLGOVGGIC-DENIHFKCSA-N 439.648 4.457 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)O1 1726715811 YCGJYNHTNQPKFD-MRXNPFEDSA-N 443.592 4.188 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1727664234 OSYHCSCEQGVYHA-CVDCTZTESA-N 439.648 4.457 10 10 IICE CC(C)CCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1741506140 YKQKTJZKTPRYPN-QHCPKHFHSA-N 441.620 4.429 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccco1 1764561274 VPRGGJRMKORDDO-UHFFFAOYSA-N 446.555 4.108 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCCC(=O)N4)cs2)cc1 1859574012 JABDOPJZDADHBI-UHFFFAOYSA-N 443.550 4.284 10 10 IICE N=C1C(=Cc2cc(Br)ccc2O)C(=O)N=C2SC=C(c3ccccc3)N12 2293519288 YGAUHFXFADPETH-UHFFFAOYSA-N 426.295 4.459 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1cccn1Cc1c(Cl)cccc1Cl 2296602974 ZKSOPMZQCYNJIB-UHFFFAOYSA-N 444.274 4.098 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccs2)SC1=S)NC12CC3CC(CC(C3)C1)C2 2297554413 NQDAOWUHXYZKMX-UHFFFAOYSA-N 432.636 4.424 10 10 IICE Cc1cccc(COc2ccccc2C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c1 2313558415 AALOYXQHSSAESY-UHFFFAOYSA-N 430.435 4.380 10 10 IICE O=C1N=C(Nc2cccc(C(=O)O)c2)S/C1=C\c1ccc(-c2ccc(C(=O)O)cc2)o1 2997671 XVWCAOUMDSZQPB-WQRHYEAKSA-N 434.429 4.425 10 10 IICE COc1ccc(N2CCN(C(=O)c3oc4ccccc4c3NC(=O)CC(C)C)CC2)cc1 9251210 VRWMPWVTOAHHTC-UHFFFAOYSA-N 435.524 4.388 10 10 IICE COc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)cc1O 14457126 RCGJMINTISAEHC-YZZKKUAISA-N 426.538 4.012 10 10 IICE CN1CCc2cc(CNC3CCN(c4ccc(C(=O)NC5CCCC5)cc4)CC3)ccc21 15005401 DDRPJQIDLJYRCM-UHFFFAOYSA-N 432.612 4.110 10 10 IICE COc1ccc(/C=C2\SC(=S)N(c3ccc(NC(C)=O)cc3)C2=O)c(OC)c1OC 39859241 CWLOAJQRXBTFGV-BOPFTXTBSA-N 444.534 4.077 10 10 IICE COC(=O)C1=CN(c2cccc(SC)c2)c2cc(Br)ccc2S1(=O)=O 64979274 ZCEWDMUDQYBTHA-UHFFFAOYSA-N 440.340 4.111 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4c(c3)nc(C)n4-c3ccccc3)CC2)cc1 247983349 YCVAAUROVOGCIF-UHFFFAOYSA-N 426.520 4.305 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(Br)s3)n2)cc1 320826498 PZAIYUURFBXFEQ-UHFFFAOYSA-N 431.358 4.444 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526331155 ZVTJVYSOHTZLFY-QHCPKHFHSA-N 433.460 4.481 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(COCC(F)(F)C(F)F)no2)C1 580858994 DOSUWATWVGXBRY-UHFFFAOYSA-N 440.441 4.256 10 10 IICE CCOc1ccc(CNC(=O)N(CC)Cc2cc(Br)ccc2O)cc1F 745806600 IYSPWKHPFOLMKU-UHFFFAOYSA-N 425.298 4.424 10 10 IICE CO[C@H](C)c1noc(CN(C)CC(=O)c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)n1 747967404 MGPLCFNGHAVOQM-CQSZACIVSA-N 434.899 4.292 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)CC2 758435102 ZXDCPQFHPFJNMS-KRWDZBQOSA-N 434.506 4.412 10 10 IICE Cc1nn(CC(F)(F)F)cc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 764188205 XGGKRRWOIFFPFV-UHFFFAOYSA-N 437.393 4.340 10 10 IICE COc1ccc([C@H](NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C2CC2)cc1 768679616 ZNTGNLPJUKPYJU-AREMUKBSSA-N 448.611 4.178 10 10 IICE C[C@@H](NC(=O)Nc1ccccc1C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 775360176 MFUGLNNNIFOVFG-QGZVFWFLSA-N 425.529 4.361 10 10 IICE CCCCc1ccc(-c2csc(NS(=O)(=O)c3ccc(C(=O)NC)cc3)n2)cc1 784105540 WITPTAQPCIOPNK-UHFFFAOYSA-N 429.567 4.313 10 10 IICE CCCc1c(NC(=O)NCc2cc(OC)ccc2O)cnn1-c1cc(F)c(OC)cc1F 797684142 WZKZFIDFMAAPDL-UHFFFAOYSA-N 446.454 4.148 10 10 IICE Cc1cc(-c2noc([C@H](C)NC(=O)NCc3cc(Br)ccc3O)n2)ccc1F 805203591 LWQSGBPFTULCHY-NSHDSACASA-N 449.280 4.213 10 10 IICE COc1cc(Br)cc(CN2CCN(c3nccc4sccc34)CC2)c1O 809786634 HLKVFNMCQFWQAF-UHFFFAOYSA-N 434.359 4.095 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)C2CC2)cc1 1124905546 NRUKJKDPRNGGPO-AREMUKBSSA-N 435.568 4.292 10 10 IICE COc1cccc(O[C@@H](C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1126527029 LCIHLOMRYODUHN-IBGZPJMESA-N 435.568 4.000 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2cccc(Cl)c2)[nH]n1 1137438732 SEDWMLJWMPHRTD-SFHVURJKSA-N 445.350 4.484 10 10 IICE Cc1ccc(C2=NO[C@@H](CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1138988206 ZWKVJXAXLLCADS-HSZRJFAPSA-N 429.520 4.446 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cn(-c2cccc(C(F)(F)F)c2)nn1 1141738016 RZLIMUVSCASNMS-UHFFFAOYSA-N 431.201 4.229 10 10 IICE COC(=O)c1nc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)sc1C(C)C 1141751018 AYRBIFVJNODARH-UHFFFAOYSA-N 439.537 4.454 10 10 IICE C[C@@H](NC(=O)Cc1csc(NC2(C)CCCC2)n1)c1ccc(N2CCOCC2)cc1 1142503974 KYLFTJKRQONCQA-QGZVFWFLSA-N 428.602 4.144 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@H]3NC(=O)NC3=O)cc2)c(C)n1-c1cccc(C(C)C)c1 1149229325 OFTDZUGCUFCPRR-JOCHJYFZSA-N 430.508 4.350 10 10 IICE C[C@]1(Cc2ccc(I)cc2)CCCN1C(=O)c1cc(O)cs1 1157749475 CIKFNWHSDQAJOP-QGZVFWFLSA-N 427.307 4.296 10 10 IICE COC(=O)c1cc(OCc2nnc(-c3cc4ccccc4cc3OC)o2)ccc1N(C)C 1166713251 BNBMGUYAMQGYFO-UHFFFAOYSA-N 433.464 4.330 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(Br)c(C)c3)CC2)cc1 1168331260 BFRFNVMNSPWALU-QGZVFWFLSA-N 446.389 4.305 10 10 IICE Cc1cc(CNC(=O)N[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1234335216 AXCRELDJYGYHRW-YADHBBJMSA-N 445.485 4.428 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3sc4cccc(F)c4c3Cl)cc2)CC1 1296401996 VTULRVDLLWELCG-UHFFFAOYSA-N 445.947 4.292 10 10 IICE COC(=O)[C@@]1(C)CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@@H]1C 1302405039 PZKMQZNUVNUMBY-ZSEKCTLFSA-N 433.346 4.128 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@](C)(O)[C@@H](C)CC 1305384742 VEAQXTQSEHTCFY-RLSLOFABSA-N 443.636 4.062 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H]3C[C@@H]32)c(C)n1-c1ccccc1 1313099197 BSBPFVBVCOYWSC-VXKWHMMOSA-N 438.572 4.040 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H](c1ccc(F)cc1F)c1nccn1C 1313393374 XSYIQHZIJQEPDV-JOCHJYFZSA-N 439.510 4.230 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)CC2CC(F)(F)C2)cc1F 1314660854 MZYWBQBZOBQHQE-UHFFFAOYSA-N 430.478 4.075 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1ccc(OCc2ccccc2)cc1 1440675044 WDVYCWUHHHPVFP-UHFFFAOYSA-N 430.548 4.303 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-n2nccc2-c2ccc(F)cc2)cc1 1447564004 OSIDMXKRBUKIBZ-MRXNPFEDSA-N 431.467 4.451 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCOc1ccc2c(c1)OCO2 1459466932 OTXKELWIZCJOAH-UHFFFAOYSA-N 426.513 4.272 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2ccc(Br)c(Cl)c2)cc1 1461336866 JCWQFCFOEQLRKR-UHFFFAOYSA-N 425.754 4.248 10 10 IICE C[C@@H](NC(=O)N1CCC[C@](O)(c2ccc(Br)cc2)C1)c1ccc(N(C)C)cc1 1478471001 LRSVWISHOFYBQP-OPAMFIHVSA-N 446.389 4.269 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@H]2CC2(O)CCCCC2)N(C)C)cc1 1479535653 YAYXILPNKVZPDX-XZOQPEGZSA-N 430.637 4.005 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2c2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1503096857 RKPABMODSGCVMI-HXUWFJFHSA-N 444.580 4.174 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)O[C@H](C(F)(F)F)C2)n1CCCSc1nccs1 1509156659 JSGSVFGNSBZCBB-KBPBESRZSA-N 449.568 4.272 10 10 IICE C[C@@H]1CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)CC1(C)C 1512278304 WFNSBBKEFAJACR-MRXNPFEDSA-N 448.662 4.025 10 10 IICE CCCN(CCC)c1nnc(-c2noc3c2COCC3)n1Cc1ccc(N(C)C)cc1C 1514745935 QRMVMDSFLZXHJS-UHFFFAOYSA-N 438.576 4.055 10 10 IICE CSCCCCCNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1517819220 XZYAWHRURIMSLB-DTQAZKPQSA-N 426.604 4.067 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3nccs3)n2CCCSc2nccs2)n1 1542565901 UZFXOCWUKQIBQC-UHFFFAOYSA-N 443.627 4.380 10 10 IICE CC1(C)Cc2cc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)ccc2O1 1545697464 NELLKVUEUNVJDC-UHFFFAOYSA-N 444.534 4.220 10 10 IICE Cc1ccc(C(=O)NCCC(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)c(O)c1 1546150430 OCIANYGBBGWCHM-LJQANCHMSA-N 432.520 4.316 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C)c(NC(=O)OC(C)(C)C)c3)C2)cc1 1557450080 NEAFDSCDELHKJH-SFHVURJKSA-N 425.529 4.359 10 10 IICE C[C@@H](NC(=O)[C@H](NCC(F)(F)F)c1cc(Br)cs1)c1ccccc1O 1557966629 KZECJNVFEKCEAP-YMTOWFKASA-N 437.281 4.287 10 10 IICE Cc1cc(CNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)c(C)n1-c1ccccc1 1596481783 GFQAMWGDLVZELD-UHFFFAOYSA-N 441.579 4.449 10 10 IICE CCOc1cccc(N2CCC(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)n1 1607320966 UBWDOUVASONEIV-UHFFFAOYSA-N 446.551 4.099 10 10 IICE CC[C@H](C)c1nnc(N(C)CCn2cccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1613182830 COOWVMKPRRLKNG-NRFANRHFSA-N 435.620 4.409 10 10 IICE Cc1nn(C)c2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(Cl)c(Cl)c4)c3C)ncc12 1613847815 DLYCSUNBHKQXAL-UHFFFAOYSA-N 444.322 4.036 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1cccc(OCc2ccccc2Br)c1 1622753204 LQECUDYBQDOGNX-UHFFFAOYSA-N 442.309 4.412 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3c(-n4cccc4)sc(C)c3C)cc2F)CC1 1632994603 SBVZOBFYGDFYDO-UHFFFAOYSA-N 440.588 4.367 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C(=O)c2cccc3ccccc23)cn1C 1633818978 NDRUJEDXPHJNBN-MRXNPFEDSA-N 428.488 4.182 10 10 IICE CCO[C@@H]1C[C@@](O)(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1634606696 GAHNRGHHFLQOBK-DENIHFKCSA-N 449.389 4.153 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@H](c3cccc(F)c3)C2(C)C)N(C)C)cc1 1638918444 VHOPJRUBFWQUOB-DHIUTWEWSA-N 426.580 4.472 10 10 IICE O=C(c1c(F)ccc(O)c1O)N1CCN([C@H](c2ccccc2)c2ccccc2Cl)CC1 1641228329 HGNKTMVSJNYZHJ-JOCHJYFZSA-N 440.902 4.438 10 10 IICE Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)N2CCOCC2)o1 1642001736 CHDIWAOBHMEVGL-QFIPXVFZSA-N 435.480 4.213 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cc(Br)ccc1OCc1ccccc1 1651222482 HPWQBHXUCVXFTG-UHFFFAOYSA-N 428.282 4.369 10 10 IICE COC(=O)c1cnc(CSC2=NC(=O)/C(=C\c3csc4ccccc34)S2)cn1 1652014150 QJKVCHZHWIQOFO-OMCISZLKSA-N 427.532 4.382 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3ncccn3)C2)c(C)n1-c1ccc(Br)cn1 1652073214 NCKGEGKELWYWGH-MRXNPFEDSA-N 440.345 4.061 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1C[C@H](c2ccccc2Cl)C1 1672995789 CFRSZSOOOAKNRH-WKILWMFISA-N 435.902 4.200 10 10 IICE Cc1ccc([C@H]2CCCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1676125272 CNTANSYMEAFJBE-XMMPIXPASA-N 434.584 4.134 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](CCO)c1ccccc1Br 1683421612 UBXCTCMMLBYPPL-KKSFZXQISA-N 448.405 4.177 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NC[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1685281595 JUBVPFGIJAXJTN-KRWDZBQOSA-N 441.519 4.206 10 10 IICE CC[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ncc(-c2ccccc2)[nH]1 1685608759 GDBJIXFJKZMYLD-GMAHTHKFSA-N 434.588 4.196 10 10 IICE CC[C@H](C)[C@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1708380290 ACADNIFFBHSIFR-PMOQBDJRSA-N 441.620 4.427 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCC(C)CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1709112410 IGJFTSLXXRIONZ-NRFANRHFSA-N 442.627 4.042 10 10 IICE CCOCc1nnc(N2C[C@@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1710664511 DKCTWSDTCMMKOB-WOJBJXKFSA-N 443.661 4.429 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1ccsc1 1723139455 JJFNUMUMIVIYFS-UHFFFAOYSA-N 425.602 4.179 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN(C)[C@H](C)CC 1726985512 KFALRLJFFLMRLB-LEWJYISDSA-N 442.652 4.247 10 10 IICE CCN1C[C@@H](C)N(c2nnc(C3CCCC3)n2CCCSc2nccs2)C[C@@H]1C 1746379896 OYBLQRWBGFAUIL-DLBZAZTESA-N 434.679 4.494 10 10 IICE CC1=CCCN(c2nnc([C@@]3(OC(C)C)CCOC3)n2CCCSc2nccs2)C1 1762156589 HMLACTGAXUPFNW-OAQYLSRUSA-N 449.646 4.114 10 10 IICE CCCN(C)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)cc1C 1764231928 GYIYCVRIUSHQOT-UHFFFAOYSA-N 431.382 4.305 10 10 IICE CC(C)(C)OC(=O)N1CCC(N=NNc2ccc(I)cc2)CC1 1860491851 WXAKOWLVVKVPGL-UHFFFAOYSA-N 430.290 4.470 10 10 IICE Cc1cc(C)c2[nH]c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc(=O)c2c1 1866490217 GOFSGPCGWHYJNS-DEOSSOPVSA-N 446.595 4.168 10 10 IICE CC[C@@H](NC(=O)[C@@H](C)C1CCCC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1867020658 DUVHNZWIIHUSIW-MGPUTAFESA-N 432.520 4.122 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@H](NCc3cc(Br)ccc3O)[C@H]2C1 2092949354 WGZDZHFYNYFOKH-JQFCIGGWSA-N 425.367 4.280 10 10 IICE COc1ccc(C=C2C(=O)N(c3ccccc3)C(=S)N(c3ccccc3OC)C2=O)cc1 2297315576 BJGJCTXTQIUSPJ-UHFFFAOYSA-N 444.512 4.452 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)C1=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 2313549362 UOGKBCUNAPOTBH-UHFFFAOYSA-N 437.795 4.175 10 10 IICE O=C(CSc1nc2ccsc2c(=O)n1Cc1ccccc1F)c1ccc(O)c(O)c1 2908980 IYBYGYYAVLJTAQ-UHFFFAOYSA-N 442.493 4.032 10 10 IICE CC[C@@H](C)N(Cc1ccc(N(CC)CC)cc1OS(=O)(=O)CC)C(=O)CC(C)C 6711005 JDBKKKNGCCTLCH-GOSISDBHSA-N 426.623 4.435 10 10 IICE O=C(O)CCOc1ccccc1/C=C1/SC(Nc2ccccc2Br)=NC1=O 16911809 NCMZXVGOQICRIN-LFIBNONCSA-N 447.310 4.385 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1)N2)N1CCOCC1 20699494 UVHIHJSTROXJTD-KNKQGSTJSA-N 430.957 4.187 10 10 IICE CCC[C@H](C)NC(=O)c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc2ccccc12 23331677 KTICFEHITJXTMS-IBGZPJMESA-N 432.568 4.488 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccco3)C2=O)c(C)n1-c1ccc(F)c(Cl)c1 24504296 VBKRZFKSGWJJQA-JOCHJYFZSA-N 443.862 4.130 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)Nc1cccc(Cl)c1 33318312 PVURYIVWGSOHIN-RQZCQDPDSA-N 446.937 4.299 10 10 IICE O=C1/C(=C\c2cccc(F)c2)SC(=S)N1CC(=O)N1CCCC[C@H]1c1cccnc1 33585400 WNZTTXMNTGEIAJ-LPGQDOADSA-N 441.553 4.176 10 10 IICE CCN1CCC2(CC1)N=C(c1ccc3c(c1)OCO3)C[C@@H](c1cc(Cl)ccc1O)N2 65298035 VHRZBYICHQVXJH-IBGZPJMESA-N 427.932 4.110 10 10 IICE biogenic CCOc1cc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)ccc1OCCC(=O)O 210466776 CJXGECXMPBMGFF-UYRXBGFRSA-N 443.546 4.340 10 10 IICE CC(C)Cn1ncc2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cnc21 726567125 LLPRJVQLOIPKMW-UHFFFAOYSA-N 443.498 4.088 10 10 IICE COc1ccc(C)cc1C1(CNC(=O)NCc2c(O)ccc3c2CCCC3)CCOCC1 743561624 LZMXMZXNECHBAU-UHFFFAOYSA-N 438.568 4.136 10 10 IICE COc1ccc(N2CCN(Cc3nc(O)c4c(-c5ccco5)csc4n3)CC2)cc1F 753857752 PMRUYZJCVXUKGY-UHFFFAOYSA-N 440.500 4.127 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nc2ccccc2s1 768727646 BKRWAFYAKVDNLQ-SFHVURJKSA-N 449.624 4.389 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)c1O 769498468 JAVSRDLPLILERI-DBVUQKKJSA-N 442.943 4.144 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ncc(Br)s1 773146969 SIHNWVAYUSSXNC-HNNXBMFYSA-N 435.435 4.288 10 10 IICE C[C@H]1CN(c2ccc(CNC[C@]3(C)CCN(C(=O)OC(C)(C)C)C3)cc2F)C[C@@H](C)O1 798947675 KHVGFPZKZXLACG-RHGYRFJNSA-N 435.584 4.176 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cc3ccccc3n(C)c2=O)C1 816172293 HYNCEKZAAYMHDK-UHFFFAOYSA-N 443.547 4.003 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(NC(=O)c3ccccc3C)CC2)c1O 917445771 YTVNTVLKETYEMP-UHFFFAOYSA-N 432.520 4.035 10 10 IICE CN(c1ccc(CNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1)C1CCCCC1 1136446513 LMCAVGNULKJHDJ-UHFFFAOYSA-N 433.512 4.479 10 10 IICE CCC[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccn1 1136903842 NCSUTUPIYMUIAK-RBBKRZOGSA-N 440.588 4.414 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1NC(=O)c1ccccc1 1148701295 RPZDHBUXENWTPV-UHFFFAOYSA-N 443.547 4.138 10 10 IICE C[C@H](Cn1ccc2ccccc21)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348078 NEZWJJVWACSESU-DYESRHJHSA-N 425.960 4.417 10 10 IICE COc1ccc(C(=O)Nc2ccccc2C(=O)NCc2ccc3cccnc3c2O)cc1 1162607038 FWAXSSXZWRJPNX-UHFFFAOYSA-N 427.460 4.131 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)NCCCOc1ccccc1F 1167755432 PXDLZQCXUJJSTP-UHFFFAOYSA-N 426.410 4.062 10 10 IICE Cc1cc(C(=O)NCC2(CC(N)=O)CCCCC2)c(C)n1-c1ccccc1Br 1167893132 PMIVFPITEHNBGL-UHFFFAOYSA-N 446.389 4.412 10 10 IICE COCCN(Cc1ccc2c(c1)OCO2)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1234325584 DPBJSXUBLQLVDQ-UHFFFAOYSA-N 435.524 4.181 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Cc3ccc(F)c(Br)c3)CC2)cc1 1266269043 VLSPGOJRVHNUIW-OAHLLOKOSA-N 435.337 4.124 10 10 IICE CCOC(=O)[C@H]1[C@H](C)N(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@@H](C)C[C@H]1C 1289761613 JEDSLJMXKATYLK-YJUYQMCSSA-N 428.573 4.343 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(NCc2ccsc2)cc1 1293928485 FBNQODVIHJKVJS-UHFFFAOYSA-N 435.593 4.499 10 10 IICE COc1ccc(N(C)CCN(C)CC2CCN(C(=O)OCc3ccccc3)CC2)cc1 1307897331 NIMACURKFNHQNE-UHFFFAOYSA-N 425.573 4.112 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1355031526 NCZJGAAGZUOPDV-ZEQKJWHPSA-N 435.612 4.282 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 1444993086 YNDBHYQQCUNBBO-GFCCVEGCSA-N 443.809 4.388 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1450061687 YWQBWHXVQSSENF-IRXDYDNUSA-N 427.545 4.247 10 10 IICE Cc1cc(C(=O)Nc2n[nH]c(C(F)(F)F)n2)c(C)n1-c1ccccc1Br 1457511072 JDQJHSYVYSIHDL-UHFFFAOYSA-N 428.212 4.246 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H](CCO)CC2)sc(C)c1-c1ccccc1 1460259246 SYGCKBXCIHTIBF-SFHVURJKSA-N 444.597 4.323 10 10 IICE O=C(Cc1cc(C(F)(F)F)ccn1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1464694216 JBFFMDSNSNUXGB-UHFFFAOYSA-N 429.389 4.030 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c(NC(=O)c2ccco2)sc2c1CCC2 1467839885 GOSBCLPRYMKINE-UHFFFAOYSA-N 431.510 4.203 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC[C@@H](C)c3ccc(Br)cc3)C2)cc1 1470771663 GXBXSQSRHKNYNH-CRAIPNDOSA-N 432.362 4.139 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@]1(Cc2ccc(Cl)cc2)CCOC1 1478841591 ZLZKCVXOYCEAFG-KOSHJBKYSA-N 429.992 4.346 10 10 IICE C[C@@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1512140756 LSVLWGYGLHFZCY-HXUWFJFHSA-N 439.648 4.459 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@@H](CN(C)C)Oc2ccccc21 1517788651 MNLQKGWCMBUBTE-QZMUEMGWSA-N 431.536 4.393 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cccc(S(=O)(=O)C(F)(F)F)c3)c2)CC1 1522840915 CZJOFFCESWJQFP-UHFFFAOYSA-N 426.460 4.469 10 10 IICE C[C@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Br)s1 1527864681 URHJKXTTWHCRCD-NSHDSACASA-N 445.329 4.045 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCCC[C@H]2C(=O)OC(C)(C)C)CCCC1 1532954835 SVADGRLDPHGXSK-QFIPXVFZSA-N 426.557 4.252 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(/C)c3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1534277742 BHRBPESWCCQAAN-PEZBUJJGSA-N 434.458 4.475 10 10 IICE C[C@@H](NC(=O)c1cc2c(Br)cccc2cn1)c1ccc(N2CCOCC2)cc1 1535558701 PQFJPLWIDAFROU-OAHLLOKOSA-N 440.341 4.325 10 10 IICE CCc1ccccc1-n1cnnc1SCC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1539469342 YLZKDNXROVLHLO-UHFFFAOYSA-N 435.597 4.181 10 10 IICE Cc1ccc(N2CCOC2=O)cc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1544322378 KGYWVDCMVFQUIR-UHFFFAOYSA-N 431.492 4.353 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CCN(c3ccccc3Cl)C2)cc1 1544529704 JFJJASBAJHGYHW-UNMCSNQZSA-N 442.003 4.440 10 10 IICE COC(=O)[C@@H](C)CN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CC1 1546229028 VFMOKBCRWPPCSY-ZDUSSCGKSA-N 433.346 4.270 10 10 IICE CCSc1nc(C)c([C@@H](CC)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)s1 1557824512 SPZIRAIEOXBCMS-QGZVFWFLSA-N 449.642 4.423 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@@H]21 1565256058 KWRVONVLQOLPJU-PCCBWWKXSA-N 428.374 4.385 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCCc2cc(Cl)cc(Br)c2)c1 1565268027 ANPCYEMIOJSFER-LLVKDONJSA-N 427.726 4.420 10 10 IICE Cc1ccc(N2CC[C@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1565783985 KMVOWIMPTPUXNB-QHCPKHFHSA-N 429.520 4.059 10 10 IICE CCc1ccc(CN2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)s1 1565811358 OVTPXSWBOLLWNI-UHFFFAOYSA-N 435.593 4.489 10 10 IICE COCc1ccccc1OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1583322079 HCBHOLHOCAHNEM-LDADJPATSA-N 431.510 4.169 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)n(Cc4ccccc4)c3C)cc2F)CC1 1585402876 CDZDPAFMOPEXAH-UHFFFAOYSA-N 448.586 4.364 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1586864856 USOAVSZXDCTJNS-UHFFFAOYSA-N 436.531 4.026 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1610959363 YTZQWGJLNCGVSZ-LJQANCHMSA-N 439.556 4.284 10 10 IICE COc1ccc(N2CCCN(CC(=O)N3CCC(CCc4ccc(C)cc4)CC3)CC2)cc1 1615219468 LHJMTMGPNZQKIT-UHFFFAOYSA-N 449.639 4.387 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1 1615380187 ZCPFOTLSEFJRKN-JOCHJYFZSA-N 436.604 4.419 10 10 IICE O=C(COc1ccccc1C(F)(F)F)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1631425687 MJQZTISVIWINLY-MRXNPFEDSA-N 442.865 4.224 10 10 IICE COc1cccc(CNC(=O)c2ccc([C@@H]3CCCCN3C(=O)OC(C)(C)C)n2C)c1O 1636061463 NXDHKSCNNBLIPX-SFHVURJKSA-N 443.544 4.131 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(Cc2nc(C3CCC3)no2)CC1 1636263027 LOWUUCLNDFIECH-GOSISDBHSA-N 439.604 4.307 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N(C)CCN2CCN(Cc3ccccc3)CC2)c1 1640459992 MTZIPIDEEHRMHS-UHFFFAOYSA-N 444.623 4.292 10 10 IICE CC[C@@H](CCc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1640527432 FFILAQXWMBWLFV-KRWDZBQOSA-N 444.578 4.396 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1C[C@@H](OCC)C1(C)C 1641815483 BQMGZIYANCWYIT-FGZHOGPDSA-N 448.563 4.316 10 10 IICE CC(C)c1ccc(N(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 1652700035 LAAYKKAEFLFAQK-RTBURBONSA-N 427.564 4.315 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCc2c(F)cc(F)cc21 1682798015 KKIONDRGEGGWIC-HSZRJFAPSA-N 429.511 4.050 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3ccc(Cl)cc3OC(C)C)C2)cc1 1683339728 FDMQTYUIOVEBQX-KRWDZBQOSA-N 431.964 4.462 10 10 IICE CCO[C@]12CCC[C@@]1(NC(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)CCO2 1686268260 AXQUCVIIBMKHIN-IMRHEYAYSA-N 435.996 4.451 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCc2cc(F)cc(NC(=O)OC(C)(C)C)c2)c1 1687475906 ALPPXHZVMGCXPV-CYBMUJFWSA-N 433.480 4.447 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@@H]3CCC[C@H](C2)C3O)cc1 1695623416 DCWBFROSIHLOJB-SVGJNIJCSA-N 439.648 4.358 10 10 IICE CSC1(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2ccccc2O)CCOCC1 1698359869 IKIKGDIZUVOEBF-UHFFFAOYSA-N 428.558 4.101 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)n1 1707818035 XGLCUXWYRVJPHX-UHFFFAOYSA-N 435.620 4.189 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC[C@@H](OCCOC)C3)nnc2C(C)(C)C)cc1 1728384118 YDFGXYVRDYVAGZ-JOCHJYFZSA-N 443.636 4.102 10 10 IICE CCOC(=O)N[C@H](CC(C)C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O 1728704545 DIFOTZHZMRMWAX-LJQANCHMSA-N 445.608 4.370 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@H]3C[C@H](C)O[C@H](C)C3)CC2)cc1F 1730179703 BZOLRZLVMCCSIB-REPLKXPHSA-N 445.583 4.079 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](C)N2CCC(C)CC2)n1 1751604314 RNPGIBANWQFTAB-FQEVSTJZSA-N 434.588 4.111 10 10 IICE CCCCN(CCOC)c1nnc(-c2ccccn2)n1Cc1ccc2c(c1)CCCN2C 1764101254 ADVJKQUEPJQGSU-UHFFFAOYSA-N 434.588 4.024 10 10 IICE CC[C@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)NC(=O)OC(C)(C)C 1764282678 TYNUNNCEBKZSFU-QGZVFWFLSA-N 431.581 4.221 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1C[C@@H]1CCCN1C(=O)OC(C)(C)C 1767111949 LDAKKGAHQLOEMC-SFHVURJKSA-N 443.592 4.317 10 10 IICE COc1cc(Br)cc(/C=C2\C(=O)N(CC(C)C)N=C2c2ccccc2)c1O 1865672250 SBRVRIIFKKQIGH-YVLHZVERSA-N 429.314 4.449 10 10 IICE CC1(c2nn(Cc3c(O)cccc3F)c(I)c2C2(C)CC2)CC1 2079747675 WZLUGCQSIYMCOF-UHFFFAOYSA-N 426.273 4.484 10 10 IICE CC[C@H](N[C@H]1CCO[C@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2154211692 LLAUWAQHBZMPJF-ZOBUZTSGSA-N 443.382 4.268 10 10 IICE CC[C@@H](NCC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2181158220 IWDQYPWCFUJMQM-NVXWUHKLSA-N 443.382 4.221 10 10 IICE CC1=NN2C(=N)C(=Cc3ccc(OCCOc4c(C)cccc4C)cc3)C(=O)N=C2S1 2293296193 NJNCHZDYTLXWBG-UHFFFAOYSA-N 434.521 4.400 10 10 IICE COCCCN1C(=O)C(=Cc2ccc(-c3ccc([S@](=N)(=O)O)cc3)o2)SC1=S 2314432574 CNCDWCCLOZGFJB-UHFFFAOYSA-N 438.552 4.063 10 10 IICE COc1cc(C=C2SC(=S)N([C@H](C)[C@@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 2323680408 DABHEVGAQJTHJY-XWUBHJNHSA-N 434.539 4.335 10 10 IICE O=C(O)CN1/C(=C/C=C2\SC(=S)N(c3ccccc3)C2=O)Sc2ccccc21 2813257 OUZFXLQMYQTECB-APGQMXJTSA-N 426.544 4.474 10 10 IICE CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CCN1C(=O)[C@@H](C)SC1=S 11635975 VSAYTGQSBBJRHX-GFCCVEGCSA-N 448.591 4.169 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 229096126 ZNMLODLLBXMMFJ-VJTSUQJLSA-N 431.580 4.377 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cnn(C)c2-c2ccccc2)C1 561796016 YMXMABWSABAGIB-UHFFFAOYSA-N 427.552 4.447 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@H]2CN(Cc3ccccc3)C[C@@H]2C1 705620114 NRPWCQFWSGDKJW-WOJBJXKFSA-N 426.402 4.269 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@H]32)cc1Br 705846067 OZWMAGKEICDCIO-CPDIYIAASA-N 427.386 4.288 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3cc(Br)cc(F)c3O)C[C@H]2C1 715788866 MTWRVGKLGICJQY-DUVNUKRYSA-N 443.357 4.419 10 10 IICE Cn1c(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)nnc1-c1ccccc1 731036185 ISWSLVJXIBMPJS-UHFFFAOYSA-N 433.556 4.460 10 10 IICE O=C1/C(=C\c2nc3ccc(Br)cc3s2)SC(=S)N1Cc1ccon1 772180548 ZFGOMLHDMWVAOY-WUXMJOGZSA-N 438.353 4.448 10 10 IICE COC(=O)c1ccc([C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)C(F)(F)F)cc1 776022683 OAIKNCAYDKRJLO-IBGZPJMESA-N 435.446 4.176 10 10 IICE COc1cccc(CNC(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1O 777750259 HZPFXEKQRPSLJK-UYAOXDASSA-N 435.927 4.217 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 779533977 LRUAYFDXPUBOPH-KSEUIEODSA-N 425.529 4.413 10 10 IICE Cn1c(C(F)F)nc2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccc21 798981894 QZJKELWOGSDQLA-MRXNPFEDSA-N 448.901 4.264 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3cccc(N4C(=O)N[C@@H](C)C4=O)c3C)c2C)c1 811536961 JPWMSEAIDCTXNK-KRWDZBQOSA-N 430.508 4.408 10 10 IICE Cc1cc(Cc2nc([C@H]3COCCN3C(=O)OC(C)(C)C)no2)c(C)n1-c1ccccc1 904701702 FBMRHVYTNOBHGH-HXUWFJFHSA-N 438.528 4.376 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1-c1ccc(F)cc1 1125187340 DEGFROMXMPAIGH-IRXDYDNUSA-N 440.494 4.003 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H](c2cccc(Br)c2)N2CCCC2)cc1F 1125534056 AAAOHCMKVQAHMU-HXUWFJFHSA-N 434.353 4.108 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc2c(C)nn(-c3ccccc3)c2n1 1129814470 GYQJHKPZKSOLRZ-SFHVURJKSA-N 427.552 4.464 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)cc1F 1137422621 FQPZUPJLLKBFIH-UHFFFAOYSA-N 449.526 4.325 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1c(Cl)cccc1Cl 1152400646 DIRMDMBZBSAERI-UHFFFAOYSA-N 430.715 4.487 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 1230196183 VRFREKDVNAHNMO-ZVDOUQERSA-N 446.636 4.327 10 10 IICE CCOC(=O)C1([C@@H](C)NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CCOCC1 1289405686 YUXVAXOVFGTWLX-GOSISDBHSA-N 446.975 4.155 10 10 IICE CC[C@@H](C)c1nnc(N2CC(C)(C)OC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1291467989 GDZIIERTZWYVPQ-MOPGFXCFSA-N 443.661 4.397 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1292056430 HLVGPAFTDGOYFN-GJZGRUSLSA-N 433.394 4.102 10 10 IICE CC[C@]1(C)CCN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)C1 1292344170 SFNAPEJBJCZMIG-OAQYLSRUSA-N 445.662 4.405 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(CCc2ccccc2)ccc1O 1293929192 SYZSYKVWJSYKEB-UHFFFAOYSA-N 444.575 4.316 10 10 IICE Cc1ccc2c(c1)[C@H](NC(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)CCC2 1298697903 RYLDLBCKGINEPC-LJQANCHMSA-N 442.562 4.370 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@@H]1C 1301504227 UKQDLBJCWTZJTI-XJKSGUPXSA-N 433.346 4.128 10 10 IICE Cc1ccc2nc([C@H]3CCCN3C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)[nH]c2c1 1313419936 WDXBYNBJFAENLF-PKTZIBPZSA-N 434.588 4.087 10 10 IICE CN(Cc1cc2ccccc2[nH]1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1324732679 XSAVRJVFVCOMMB-UHFFFAOYSA-N 431.584 4.042 10 10 IICE Cc1nc(O[C@@H](C)C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1356167232 ZOYYAIKGTBYMPK-HOCLYGCPSA-N 437.462 4.047 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cc2ccccc2O[C@@H]2CCOC2)cc1 1359897220 RGDVWENHQWRDPX-HXUWFJFHSA-N 436.474 4.054 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3nccc4c(Br)cccc34)C2)cc1 1436968513 COPTUNJHYGASAP-OAHLLOKOSA-N 440.341 4.262 10 10 IICE COc1cc(Br)c(CNC(=O)c2cc3cc(O)c(O)cc3s2)cc1OC 1443189822 VZZWXDPZGFJXBN-UHFFFAOYSA-N 438.299 4.022 10 10 IICE COC(=O)c1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1Cl 1461235640 QGMOAQKBTANGNC-UHFFFAOYSA-N 439.943 4.487 10 10 IICE Cc1cc(CNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccccc1 1462083177 HQZSEVQRPXVCDO-QHCPKHFHSA-N 429.564 4.192 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1 1470810542 PALQMXJRMMZHMJ-HSZRJFAPSA-N 445.007 4.231 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2Cc2nc(C)c(C)s2)cs1 1511517013 AEWGNGVUHIERQB-UHFFFAOYSA-N 440.598 4.097 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1517764137 MFRCDMGEUBKKCR-XLIONFOSSA-N 425.602 4.329 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCOc2ccccc2Cl)C1 1526652976 IVVAXSORENDJPZ-UHFFFAOYSA-N 425.960 4.256 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)OCC(=O)Nc2ccc(Cl)cc2)CCCC1 1531656107 PUBNSNXWJFQYPQ-UHFFFAOYSA-N 426.900 4.364 10 10 IICE CC1(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)Cc2ccccc2C1 1535875520 XJZNZWPSKGZVCE-UNOMPAQXSA-N 440.565 4.091 10 10 IICE CCCN(C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@H](COC)C(=O)OCC 1537235008 QOOOWIPIVFLFIB-OAQYLSRUSA-N 434.964 4.107 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(Cc4cc(C)ccc4OC)CC3)c2C)cc1 1539102573 CXGNNADOMOKKSH-UHFFFAOYSA-N 447.579 4.378 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)c2C)C1=O 1540007686 YWJCHVCMHMQQHV-UHFFFAOYSA-N 444.535 4.372 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCCN2C(=O)C(F)(F)F)c(C)n1-c1cccc(Cl)c1 1557171249 FHMIOYPYMWOOAN-QGZVFWFLSA-N 441.881 4.421 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H](CCCc3ccccc3)c3ccccc3)nc12 1559606937 SUNRHWDABJMRPB-HSZRJFAPSA-N 444.535 4.465 10 10 IICE Cc1ccc(CNC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c(N2CCCC2)n1 1564539608 COUMARFSVNLPTN-UHFFFAOYSA-N 431.584 4.440 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CC2(N(C)C)CCC2)sc(C)c1-c1ccccc1 1617353407 WVMHITFXKIOPQD-UHFFFAOYSA-N 443.613 4.255 10 10 IICE Cc1cc(C(=O)N[C@@H](c2nc(=O)o[nH]2)C(C)(C)C)c(C)n1-c1cccc(Br)c1 1630795020 VQXJRRUWUBCKFN-INIZCTEOSA-N 447.333 4.050 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@](C)(O)c1cccc(C(F)(F)F)c1 1631166493 HVARBGOMBTVFHE-SFHVURJKSA-N 446.263 4.430 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@@H](c2ccccc2)c2ncc[nH]2)cc1 1631612526 PTQTVQMKAREKBA-ZEQRLZLVSA-N 432.568 4.206 10 10 IICE Cc1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(O[C@@H]2CCOC2)c1 1631630029 HJPIPTPZAAEYNN-RUZDIDTESA-N 446.547 4.242 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CC(c3ccccc3)=NO2)cc1 1633065985 GYZYPCOWAKKZHL-RUZDIDTESA-N 429.520 4.488 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)NCCN(C)C)c(C)n1-c1cccc(C(C)C)c1 1637788591 CKICIMJCPAYRLK-DEOSSOPVSA-N 440.632 4.040 10 10 IICE COc1ccc(N(C)CCN(C)C[C@](C)(O)c2ccc(Br)cc2Cl)cc1 1643684326 FYXVSQQHYUKXKP-FQEVSTJZSA-N 441.797 4.387 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1 1643685267 VIVJROKUNSCWMS-UHFFFAOYSA-N 446.523 4.104 10 10 IICE CC(C)(C)OC(=O)NC[C@]12CCCC[C@@H]1CN(Cc1ccc(N3CCOCC3)cc1)C2 1648669254 VFAQEUBYYZWWPT-BWKNWUBXSA-N 429.605 4.040 10 10 IICE Cc1c([C@@H](C)NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)oc2ccccc12 1667254144 OVPVGRDWYBTCKS-OAHLLOKOSA-N 429.467 4.416 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3C[C@@H](OCc4ccccc4)C3(C)C)CC2)cc1 1671953971 MDJIASNEBXVNMM-BJKOFHAPSA-N 437.584 4.301 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2Cc2cnnn2C)c(C)n1-c1ccccc1 1692989312 SXKCFYFONCKJTE-UHFFFAOYSA-N 432.576 4.012 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)Cc2cccs2)cc1 1695620926 SPXNLRBLLATGLA-UHFFFAOYSA-N 433.585 4.328 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC(Cl)=C(Cl)C2)cc1F 1696608617 ZIHCVQFJSMYREI-UHFFFAOYSA-N 435.334 4.426 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1706326102 WTLISFJDHMLUPA-HXUWFJFHSA-N 443.611 4.472 10 10 IICE CC(C)CN(c1nnc(-c2ccccn2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1706491801 WZGZRKFJRMAPFK-UHFFFAOYSA-N 434.588 4.096 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1723356221 JTUWPOACMZXGJP-MRXNPFEDSA-N 429.619 4.246 10 10 IICE CCc1nnc(N2CCN([C@@H](C)c3ccsc3)CC2)n1CCCSc1nccs1 1727603214 XVQCSXYQHUKYTD-INIZCTEOSA-N 448.687 4.424 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)C[C@@H](C)C1 1745877863 LIFLDWJPZQKBFU-RTBURBONSA-N 448.615 4.313 10 10 IICE Cc1ccc(C)c(N2CCN(c3nnc(C)n3CCCSc3nccs3)CC2)c1 1761719342 VCQLBLDLRDIHQQ-UHFFFAOYSA-N 428.631 4.169 10 10 IICE CN(Cc1ccccn1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1767116281 NZYJATIDLXNQGI-UHFFFAOYSA-N 436.629 4.209 10 10 IICE COCCC1(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCCC1 1769590044 URDUYMPFZZLVOP-NRFANRHFSA-N 428.577 4.459 10 10 IICE CC[C@H](C)[C@H](C(=O)O)N1C(=O)/C(=C\c2c(Cl)nc3scc(C)n23)SC1=S 1858595603 DUGHPUQGNHMQQQ-KATYHTIFSA-N 429.976 4.058 10 10 IICE CCCC1=NN(Cc2ccccc2F)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679326 HMMILPPYZCSETC-MHWRWJLKSA-N 425.416 4.087 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCC(=O)c2ccc(F)cc2)N2CCCCC2)cc1 1865954453 XCROOALXBANINM-HSZRJFAPSA-N 425.548 4.198 10 10 IICE CCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCc2ccc(F)cc2)C1=O 1873170233 ROYIRHHUFXGLPH-UHFFFAOYSA-N 431.511 4.165 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2ccc(O[C@H](C)C(=O)O)cc2)SC1=S 2314929393 LZVGVNIXNYGHNY-CYBMUJFWSA-N 429.519 4.343 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(CCCCCC(=O)O)C3=O)n12 2323808809 CBWQRCZGKRRKTQ-UHFFFAOYSA-N 429.976 4.204 10 10 IICE C[C@@H](Sc1nc2ccccc2n1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 8808064 AZUPVBQNEHDVNF-CQSZACIVSA-N 441.512 4.468 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc(N(C)C)c(Br)c3)C2=O)cc1 33319794 ORWDCTCOIRJZTL-GDNBJRDFSA-N 428.286 4.330 10 10 IICE CC(C)c1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2cnn(C(C)C)c2n1 45536840 MBUAJUUHLSWOAX-UHFFFAOYSA-N 435.572 4.244 10 10 IICE CCNC(=O)Nc1ccc(C)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 487647310 BXBPTOVVUCFDNB-UHFFFAOYSA-N 447.583 4.496 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1C(C1CC1)C1CC1 734881254 YJMTZFYCGNHHQL-YRNVUSSQSA-N 431.320 4.274 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCc4cccc(Br)c4C3)CC2)cc1 735759889 IDOTUCMAYXWPJR-UHFFFAOYSA-N 444.373 4.194 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](C)CC(=O)c1ccc(OC)cc1 753837750 YUYKHPFQNWBYTQ-CQSZACIVSA-N 434.330 4.421 10 10 IICE COc1ccccc1N1CC[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)C1 757295549 QRCRLMZIPOFATM-NRFANRHFSA-N 448.567 4.345 10 10 IICE C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 771545164 IDFVPGXTYOUNQU-ZHRRBRCNSA-N 445.510 4.290 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3nccn3CC(F)(F)F)cc2Cl)C1 799919552 QVULVIGPLMBYOF-AWEZNQCLSA-N 443.901 4.335 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3cc(Cl)ccc3C)n2)cc1 914791469 RNXHWFAHBPWPHL-UHFFFAOYSA-N 449.985 4.251 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(NC(=O)C4CC4)c3)cc2Cl)C1 1128490612 WUOFCPJXCIWROG-HNNXBMFYSA-N 426.948 4.250 10 10 IICE Cc1cc(CC(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)c(C)n1-c1ccc(Cl)cc1 1129370306 MIEBVVNAJDTPSL-IBGZPJMESA-N 439.918 4.351 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1147888873 XMSUBEGCBCMBRS-KRWDZBQOSA-N 437.540 4.407 10 10 IICE Cc1cc(C(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)c(C)n1-c1ccc(Cl)cc1 1147959914 KSXJZQMNURGWLW-RUZDIDTESA-N 437.971 4.114 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1159439899 GFZPAOOPBWQLPC-MOPGFXCFSA-N 432.362 4.425 10 10 IICE CCOc1cc(CN(C)c2ccc(-c3nccs3)cc2)nc2nc(C(F)(F)F)nn12 1194993762 OZVKBEKBKKYEQN-UHFFFAOYSA-N 434.447 4.302 10 10 IICE CC(=O)N1CCCCC[C@@H]1C1CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251980946 DTCMUGOUYJKYOL-CJFMBICVSA-N 442.648 4.205 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCN1Cc1ccc(F)cc1 1294162206 ZLJBIFRDVOFQDH-KNQAVFIVSA-N 447.501 4.177 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccoc2)cc1 1295420453 PNUARNRJTRIMIE-UHFFFAOYSA-N 430.556 4.388 10 10 IICE COC1CCN(c2ccc(CN3CCC(n4cc(Br)cn4)CC3)cc2)CC1 1307458564 SXHBZHIDRSJFLZ-UHFFFAOYSA-N 433.394 4.098 10 10 IICE COCC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1315991851 LSORNCZHBDTDGD-CTNGQTDRSA-N 437.588 4.250 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1358371021 HNPVGFVDYUQLMQ-QGZVFWFLSA-N 431.939 4.335 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCCC3(CCOCC3)C2)nnc1C(C)(C)C 1361098372 SSSUOPSEYPOADX-UHFFFAOYSA-N 425.621 4.395 10 10 IICE O=C(COc1c(Cl)cccc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1435573257 PVTJCULVBVMYMB-UHFFFAOYSA-N 448.394 4.221 10 10 IICE CC(C)(CC(F)(F)F)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1435911837 INRXQYYAZXQXSD-UKTHLTGXSA-N 434.480 4.264 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(N4CCN(C(C)C)CC4)cc3)cc2)CC1 1443664007 KLMHGKYMSULXPV-UHFFFAOYSA-N 434.628 4.383 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1445639097 PHTUQDWQPBXPPL-PXNSSMCTSA-N 432.492 4.109 10 10 IICE CC(C)[C@@H]1N(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC12CCC2 1450392302 GCNYKKIZDKTALY-WPNIOXTASA-N 432.586 4.454 10 10 IICE Cc1cc(C(=O)N2CCO[C@]3(CCSC3)C2)c(C)n1-c1cccc(Br)c1 1452080050 MNUBZOWKNUPMKN-HXUWFJFHSA-N 435.387 4.205 10 10 IICE C/C(=C/C(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)Cc2ccc(F)cc21)c1cnccn1 1458091379 DNWGDNQNHZXMBZ-DDITZMBXSA-N 426.492 4.191 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cc2ccccc2o1 1466896616 KFPQBCQNXSAKSA-CYBMUJFWSA-N 442.518 4.492 10 10 IICE CCc1ccccc1[C@H](CNC(=O)N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1470398386 OPCUYKPEMFUULF-FQEVSTJZSA-N 427.545 4.362 10 10 IICE Cc1nnc(N2CCC[C@@H](CN3CCCC[C@H]3C)C2)n1CCCSc1nccs1 1492846356 FPSVYMBHDUWTAM-MJGOQNOKSA-N 434.679 4.316 10 10 IICE CC(C)CN(C)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)c(F)c1 1509352019 JYDZZXHWJOPROS-UHFFFAOYSA-N 449.372 4.381 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N(C)C)cc1C 1513345032 FDXPZRDGMDISEQ-UHFFFAOYSA-N 440.636 4.246 10 10 IICE CCc1nnc(N2CCC[C@H](OCC(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1513889078 KIBBHRNPTXFGEV-IBGZPJMESA-N 439.526 4.283 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1ccc(F)cc1F 1524915115 BTJBBXKHJJVUKV-MFOYZWKCSA-N 436.480 4.012 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@H]1CCCCC1(F)F 1526958704 HBFYGWVKTBNLRV-DSQDWWTGSA-N 442.528 4.359 10 10 IICE CC(C)=CCOc1cccc(CC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1528267144 SYTFVNYKKLGPDS-UHFFFAOYSA-N 430.495 4.005 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cccc(C(C)(C)C)c3)CC2)c(OC)c1 1534277884 DXNOGVARRWFJQA-GOSISDBHSA-N 426.557 4.117 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3Cl)CC2)cc1 1544314888 IISATSHLKFGSKF-LEWJYISDSA-N 448.394 4.044 10 10 IICE COc1ccc(N2CCN(C(=O)C/C=C/c3ccc(Br)cc3)CC2)cc1F 1545608432 SPQVRBXYJZTYCH-NSCUHMNNSA-N 433.321 4.349 10 10 IICE CCc1nc2ccc(Cl)cn2c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632457 MKLQFOCYMWPEOE-QGZVFWFLSA-N 447.366 4.304 10 10 IICE CO[C@H](C)c1nc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cs1 1554588288 RQQLNNICVJLDTC-DNVCBOLYSA-N 443.573 4.074 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]21 1556481475 ULXKRDAGDZDTBY-CWRNSKLLSA-N 437.131 4.119 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)C1(C(=O)NCc2ccc(N3CCCCC3)cc2)CCOCC1 1557139668 IJOWFKHJXXAMLK-LJQANCHMSA-N 445.604 4.003 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c[nH]nc1-c1c(F)cccc1F 1595584486 NMNGQEBNDKMBMS-OAHLLOKOSA-N 446.885 4.108 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(C)n(C)c1=O 1613164380 BSUPNRYOBGKTHO-IBGZPJMESA-N 448.615 4.084 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)NC(c1ccccc1)c1ccccc1 1624480187 RGKRBQVVBFHEDG-UHFFFAOYSA-N 429.564 4.397 10 10 IICE CN1CCCc2cc(CNC(=O)C[C@H](O)c3ccc(OCc4ccccc4)cc3)ccc21 1625847697 CDTKJEJQOMDEPU-SANMLTNESA-N 430.548 4.388 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C(C)=C/c2cccnc2)cc1 1627166220 ZJBULEAUPCOBGQ-HTXNQAPBSA-N 429.520 4.129 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)cc1 1628468837 MEHHYOGGVUEPLV-OAQYLSRUSA-N 439.556 4.129 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(C(F)(F)F)cc2O)c1 1628579515 QLPPPOOWRYPJDU-UHFFFAOYSA-N 443.425 4.155 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630262667 OHKCFRINCXJTOG-SJORKVTESA-N 437.371 4.065 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1631425333 CCIYBMKQNMVFLL-HXUWFJFHSA-N 444.959 4.395 10 10 IICE O=C(NCCCSc1nccs1)c1ccc(Cn2cc(Br)cn2)s1 1632806812 CLTQKUQCFXGWNJ-UHFFFAOYSA-N 443.417 4.124 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H](CC3CCC3)c3ccccc3)cc2)CC1 1633747574 QRBSFZDFZIAOQS-XMMPIXPASA-N 434.584 4.119 10 10 IICE Cc1cc(C(=O)NCCc2ccc(O)c(CO)c2)c(C)n1-c1ccccc1Br 1644712763 MSDKBRFWRNBDHU-UHFFFAOYSA-N 443.341 4.027 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C)c4ccccc43)cc2F)C[C@@H](C)O1 1645224450 VDXCJPDIDAFTKG-SLFFLAALSA-N 439.575 4.459 10 10 IICE CCN(C)c1ccc(CN2CCC([C@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)CC2)cc1 1646179092 TWAVKVFKBQKFHI-FYYLOGMGSA-N 431.621 4.427 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1nnn(C(C)(C)C)n1 1648494192 WKKSODQUFAKVQM-QGZVFWFLSA-N 446.477 4.353 10 10 IICE COc1cc(N(C)CC(=O)N(Cc2ccc(C(C)C)cc2)C2CC2)cc(OC)c1OC 1657329231 HZCKWFWFDNVKCW-UHFFFAOYSA-N 426.557 4.463 10 10 IICE CC[C@H](CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)NC(=O)OC(C)(C)C 1681307398 BUPSLKVFLYXHLB-HXUWFJFHSA-N 428.577 4.239 10 10 IICE Cc1cccc(C[C@@]2(C)CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1681850283 VGDUCHKHYZNIEA-RUZDIDTESA-N 443.538 4.417 10 10 IICE O=C(NCc1nc(C(F)(F)F)n2c1CCCC2)N(Cc1ccco1)Cc1ccccc1O 1684659272 IKMSGJBXLDGMIW-UHFFFAOYSA-N 448.445 4.449 10 10 IICE CCC1(NC(=O)OC(C)(C)C)CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 1686826764 OTBZWVXHPSVQBG-IBGZPJMESA-N 446.636 4.471 10 10 IICE CN(Cc1ccccc1O)C(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1 1687010980 KJRZYVIFCGTCNR-NHCUHLMSSA-N 439.556 4.327 10 10 IICE CCC(CC)(Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1708669332 LSAXHCFIQWUYER-UHFFFAOYSA-N 429.609 4.332 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H](C)C1 1709839284 BERIFMFOQKBBDK-RBUKOAKNSA-N 448.615 4.361 10 10 IICE Cc1nnsc1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1724148884 SQORIYSSGALHRQ-UHFFFAOYSA-N 425.606 4.020 10 10 IICE CC1=CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)NC(C)C)C1 1742468100 CQNLFPYPBTVURQ-UHFFFAOYSA-N 446.599 4.424 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1760896614 MBEINAXBZWRREU-GOSISDBHSA-N 443.592 4.391 10 10 IICE CC[C@@H]1CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(CC)CC)cc2)C1 1763438714 JMBDOQKHEWYJAP-OAQYLSRUSA-N 435.620 4.271 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ncccc2C)sc(C)c1-c1ccc(C)c(C)c1 1860749183 WQBFRNNYSKLRTL-UHFFFAOYSA-N 437.521 4.408 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](CNCc2c(O)cccc2Br)(C2CC2)C1 1965955976 MUTKSAZETGPATN-FQEVSTJZSA-N 425.367 4.282 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(NCc3cc(Br)cc(F)c3O)C[C@H]2C1 1967824121 FIIOIFJZHLWZBW-DJJJIMSYSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NCc3cc(Cl)cc(Br)c3O)C[C@@H]21 2037301452 ZSMVQOXCPBSBDN-SNPRPXQTSA-N 431.758 4.296 10 10 IICE Cc1ccccc1N1C(=O)/C(=C2\C(=O)Nc3ccc(Br)cc32)SC1=S 1750197 GIHJRKGIEDHBNS-CCEZHUSRSA-N 431.336 4.486 10 10 IICE COC(=O)CCCCCN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 1768413 WYYGNXOXBSZQGA-KAMYIIQDSA-N 428.373 4.384 10 10 IICE O=C(CN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)Nc1ccc2oc(=O)ccc2c1 33582869 MFYIMPWLTJAABX-CVNHQRIKSA-N 448.525 4.189 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3ccc(Br)cc3)C(=O)N=C2O)ccc1OC 59198216 FFQPDHVRJYIKKB-GDNBJRDFSA-N 445.269 4.363 10 10 IICE CCOC(=O)[C@@H]1CCCN([C@@H]2CC(=O)N(c3ccc(/N=N\c4ccccc4)cc3)C2=O)C1 100712836 XMVWGUNIZDVFBX-AZSHUNQPSA-N 434.496 4.009 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(Br)cc3)N=C2C)ccc1OC(C)=O 101535387 BOPQBWJSVXFBIT-YVLHZVERSA-N 429.270 4.189 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3cccc(OC)c3OC(F)F)CC2)cc1 108431885 HLWDUCYKDDQQIA-KPKJPENVSA-N 432.467 4.057 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(F)c3)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526151028 ZYYUXCXGAOICSS-JOCHJYFZSA-N 437.423 4.311 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CCNCc2cc(Br)cc(F)c2O)C1 715813150 MGOPGZCXMDOELE-WFASDCNBSA-N 431.346 4.467 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)c1 743672255 HFNKKZPXYJVYML-DNVCBOLYSA-N 429.517 4.027 10 10 IICE COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 756648679 YDPCFTNNDAUYMX-BXUZGUMPSA-N 443.853 4.176 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H](CC(C)C)c3cccs3)CC2)cc(OC)c1OC 760094974 KLTCNKFLGULHFS-GOSISDBHSA-N 447.601 4.393 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1CCc2cc(Br)ccc21 764766048 FFGCXYQRGSMUTP-OAHLLOKOSA-N 440.135 4.404 10 10 IICE Cc1cncc(/C=C\C(=O)N(C)c2ccc(CNC(=O)/C=C/c3cncc(C)c3)cc2)c1 765480237 LKRGSXYRJAVNLC-QZTBCQRESA-N 426.520 4.099 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nc(-c3ccccc3)no2)C1 766610117 ZIRXXVOQEPZLCE-UHFFFAOYSA-N 430.508 4.201 10 10 IICE O=C(NCCc1cc(F)c(F)c(F)c1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 780046914 IXHPLPGYYMXDBT-UHFFFAOYSA-N 443.416 4.216 10 10 IICE COC(=O)c1ccc(CNC(=S)Nc2cccc(OC(F)(F)F)c2)nc1C1CC1 783750676 WJEQNFFYROSIQI-UHFFFAOYSA-N 425.432 4.131 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1nc(Br)sc1C1CC1 804738846 GWMMSVIXYBRMIE-UHFFFAOYSA-N 432.137 4.181 10 10 IICE CC(C)N(Cc1ccco1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1124878693 RHMMIXCWTVKDNL-LDADJPATSA-N 432.542 4.447 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@]3(C(=O)OC(C)(C)C)CC=CCC3)cc2F)C[C@@H](C)O1 1125188854 VVLBKDYTOOGWQJ-GAKIBJFNSA-N 446.563 4.124 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(OCc4ccccc4)cc3)C2)cc1 1129993319 OYZYQZTUDIJERD-QHCPKHFHSA-N 430.548 4.459 10 10 IICE Cn1ccc(Nc2ccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)n1 1137082090 OQTNLCMYTCZJPH-GOSISDBHSA-N 441.482 4.164 10 10 IICE COc1cc(Br)cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 1138032332 BAWGSBQAGMGTEY-UHFFFAOYSA-N 432.362 4.240 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 1142531365 ZMNMRLJNRDXNAV-UHFFFAOYSA-N 441.281 4.043 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(c4ccc(F)cc4F)C3)c2C)cc1 1144530378 UVWGZPAKZPGWCW-GOSISDBHSA-N 425.479 4.390 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](n3cccn3)C(F)(F)F)cc2Cl)C1 1235835860 XCZAJDYJZPFMNQ-KBXCAEBGSA-N 443.901 4.376 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1253530147 IAEWYBWKUYEIRN-QGZVFWFLSA-N 428.577 4.191 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)C3(c4ccccc4)CCCCCC3)cc2)C1 1264738095 OBYWJOCZSNIXSE-QFIPXVFZSA-N 433.596 4.297 10 10 IICE COc1cc(C)ccc1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1265960010 SUBRCFCGEDBMHP-UNOMPAQXSA-N 444.553 4.050 10 10 IICE COC(=O)[C@H](C)[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1294481964 PVPRDEZMBJGHCR-KOSHJBKYSA-N 432.520 4.495 10 10 IICE CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1295452896 DDJFJHQJCAZRMK-LJQANCHMSA-N 440.565 4.085 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC[C@]2(C1)CC2(F)F 1300222084 LRXLOIWTNMLYKQ-JVVYVMHDSA-N 440.512 4.065 10 10 IICE CC(C)Cc1nnc(N2CCCN(C(C)(C)C)CC2)n1Cc1ccc2c(c1)CCCN2C 1302934130 UTDNBQSQMLLKEL-UHFFFAOYSA-N 438.664 4.218 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCSc2nc3ccccc3s2)N(C)C)cc1 1304768384 LEKZXFBZJJKZSG-IBGZPJMESA-N 428.627 4.264 10 10 IICE CCc1nnc(N2CCC(n3cc(Cl)cn3)CC2)n1CCCSc1nccs1 1306139882 FJJWCLPGZZXORE-UHFFFAOYSA-N 438.026 4.171 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCSC[C@@H]3c3ccc(C)cc3)C2)cc1 1312903055 TZLLCCFJCCSGAA-AUSIDOKSSA-N 425.598 4.330 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC[C@@H]3C)nnc2[C@@]2(OC(C)C)CCOC2)cc1 1313678261 GFBHPBKHVMIVCQ-NBGIEHNGSA-N 441.620 4.202 10 10 IICE CC(C)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 1350934039 WTVLFJRSZYXKQQ-IYBDPMFKSA-N 429.492 4.401 10 10 IICE Cc1ccc(Br)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1361062648 BIXJVCWAKUATOS-ZDUSSCGKSA-N 440.288 4.153 10 10 IICE CCOc1ccc(N2C[C@H](C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CC2=O)cc1 1463785016 LAZRLFWHBUXUJI-OAQYLSRUSA-N 435.568 4.087 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(NC(=O)NC(C)C)cc2)cc1 1464181479 UMOIZASKMCTPLX-UHFFFAOYSA-N 446.551 4.295 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)Cc2ccc(F)cc2)c(C)n1-c1ccccc1Br 1467689893 LSNOYYLBXGSSCF-GOSISDBHSA-N 445.332 4.329 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)CNC(=O)OC(C)(C)C)c(C)n1-c1cccc(C(C)C)c1 1468181971 BMNTUOXCZOFHRW-NRFANRHFSA-N 443.588 4.175 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC(c2ccc(F)cc2)C1 1468361973 XSHHTQQCTHLLBV-WQRHYEAKSA-N 446.594 4.495 10 10 IICE C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1469708543 LKCNFNMCBSFCDF-ZHRRBRCNSA-N 429.511 4.314 10 10 IICE CC(C)C[C@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)CC(=O)OC(C)(C)C 1470871293 QTZIMRGBOWGKIR-PZJWPPBQSA-N 448.604 4.477 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@]12CCN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1472010723 VPRCZSZHPBEKLC-JOCHJYFZSA-N 432.542 4.318 10 10 IICE O=C(NCc1cccc(Br)c1O)NCC1(c2c(F)cccc2F)CCC1 1478824184 GMKVNMZRQUKBQY-UHFFFAOYSA-N 425.273 4.354 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)C2CC2)cc1 1478832499 ADIAGJQHBYZCTR-MOPGFXCFSA-N 430.593 4.120 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](CC)C1)OC 1497190260 GDYANROOUZSDIN-VXKWHMMOSA-N 437.588 4.393 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 1545931515 KYIAABAUNYBQAU-OAQYLSRUSA-N 447.620 4.309 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CC(C)C)C(=O)C1 1547020005 JSSNBXZBXBZKOJ-UHFFFAOYSA-N 448.615 4.457 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCCN(C)C(C)C)CC2)cc1 1554960078 YJLCVPWIYREEHS-UHFFFAOYSA-N 442.652 4.031 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCC2CCOCC2)NC(=O)OC(C)(C)C)cc1 1565882336 WBIRRFCRXGHULG-NRFANRHFSA-N 433.593 4.032 10 10 IICE CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1584444007 BXMAKGGPLXIENP-INIZCTEOSA-N 429.542 4.362 10 10 IICE C[C@@H]1O[C@H](C)[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)[C@H]1C 1585834658 LYZANRHNSYIKSK-JRATXPSKSA-N 429.318 4.157 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CCCN2c2ncnc3sc(C)cc23)cc1 1587459857 KBTKARAJQXEFMR-NRFANRHFSA-N 437.613 4.473 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 1596887299 FREKYKDAIRYKKE-UHFFFAOYSA-N 435.568 4.017 10 10 IICE COc1cccc(Oc2ccc(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)nc2)c1 1597090266 ULANRBLMUNICGB-QFIPXVFZSA-N 434.492 4.410 10 10 IICE CC(C)c1nnc(N2C[C@H](C)S[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1612891699 BSKNEYKYTOUZLY-ROUUACIJSA-N 431.675 4.333 10 10 IICE CCCN(CC)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1614697718 DJVYVQFRGJIVKJ-FQEVSTJZSA-N 429.634 4.010 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1 1624425240 WNGRJJNGPCCAMS-UHFFFAOYSA-N 443.547 4.075 10 10 IICE CCO[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1)C1CCOCC1 1627426038 SVROPJBYYHPLIH-XMMPIXPASA-N 426.557 4.126 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C(F)(F)F)ccc1N 1634385241 UVIJSWHGPKWVKV-UHFFFAOYSA-N 437.462 4.290 10 10 IICE Cc1ccc(C(=O)N2CCn3cnc(C(F)(F)F)c3C2)cc1-n1c(C)cc(C=O)c1C 1636882289 ZEMUJVMHUKUHQP-UHFFFAOYSA-N 430.430 4.086 10 10 IICE O=C(N[C@H]1CCc2ncc(Br)n2C1)N(Cc1ccccc1O)C1CCCCC1 1639046151 BSIAWLQRFVNPKF-INIZCTEOSA-N 447.377 4.211 10 10 IICE CCOC(=O)CN(CC(=O)Nc1ccccc1Oc1ccc(C)cc1)Cc1ccccc1O 1643519017 FFTMVKDAGMWSDZ-UHFFFAOYSA-N 448.519 4.497 10 10 IICE CCC(CC)C(=O)N1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 1646241654 NTWHYGVPTQKHNL-UHFFFAOYSA-N 429.992 4.397 10 10 IICE COC1CCN(c2ccc(CN3CCOc4cc(Br)ccc4C3)cc2)CC1 1647866281 KHQKOEPUIFZBHL-UHFFFAOYSA-N 431.374 4.459 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COC4(CCCCC4)O3)cc2Cl)C1 1680794039 JRKAQTAYFGYBFG-IEBWSBKVSA-N 435.996 4.451 10 10 IICE COc1ccc([C@@H](NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c2ccco2)cc1 1683392917 IRHNEYAHHZYUSG-LADGPHEKSA-N 436.556 4.046 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC3(CCc4ccccc4C3)CC2)N(C)C)cc1 1684607508 QZMBRUNBRUNVAU-VWLOTQADSA-N 434.628 4.336 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3ncccc3C)C(C)(C)C)CC2)c(OC)c1 1685690467 RQSSEIYCIQRZHT-JOCHJYFZSA-N 426.561 4.026 10 10 IICE C[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(OC(F)(F)F)cc1 1686351672 FBUGCULBMKYLNV-YWZLYKJASA-N 438.494 4.314 10 10 IICE Cc1ccc(CN(Cc2ccco2)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)s1 1687441763 XYZNGZHDWZYLQY-UHFFFAOYSA-N 438.597 4.313 10 10 IICE CCc1nc(C)c(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CCOC)o1 1694578205 ZUJABILVNGXLAU-UHFFFAOYSA-N 448.571 4.342 10 10 IICE C#CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnccc1OC 1705606255 YNYGLZYVXQYCFR-UHFFFAOYSA-N 440.551 4.264 10 10 IICE C=C(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)OC)[C@@H](C)C1 1705721468 BDYNVWUGWVBRQY-IBGZPJMESA-N 448.571 4.206 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(SC)CC1 1708396839 OPMPSPLOTAFYKT-SFHVURJKSA-N 429.634 4.160 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1710596217 WWSAPZJQFLAJLU-RTWAWAEBSA-N 431.600 4.370 10 10 IICE Cc1cc(-c2nnc(N(C)C3CC3)n2CC[S@](=O)C(C)(C)C)c(C)n1-c1ccccc1 1742118318 ZWTUUAYOWDWOQA-HKBQPEDESA-N 439.629 4.498 10 10 IICE C[C@H]1CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)CCCO1 1763098776 OVYGFRXYCFRLDK-HNNXBMFYSA-N 433.578 4.338 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1763802132 HTLZSDLZLBMMRS-SFHVURJKSA-N 436.604 4.456 10 10 IICE COCCC1(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)CCCC1 1770998682 VQWBOUXCMMUVNZ-UHFFFAOYSA-N 435.572 4.203 10 10 IICE Cc1cc(S(=O)(=O)Nc2nc(-c3cccs3)c(CCC(=O)O)s2)ccc1F 1858070084 GFWSLCLMWHLJNJ-UHFFFAOYSA-N 426.516 4.137 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 1865678050 QUUPOBZZHQKASQ-DEDYPNTBSA-N 445.431 4.152 10 10 IICE CN(C)c1ccc([C@H](NC(=O)CCc2ccc(Br)cc2)c2nccn2C)cc1 1866089926 ORUWWFOBRXNURW-NRFANRHFSA-N 441.373 4.087 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](CNCc2cc(Br)cc(F)c2O)(C2CC2)C1 1965956718 RVHLWFGUEUIXAX-HXUWFJFHSA-N 443.357 4.421 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C3(C)CC3)c(N)c2I)c(O)c1 2080047999 MDZKVLCJNROVPB-HNNXBMFYSA-N 441.313 4.081 10 10 IICE CC[C@@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080880876 PLABNHQNHAHUIG-XLIONFOSSA-N 442.556 4.361 10 10 IICE NCc1cc(F)c(N2CCCN(Cc3ccccc3)CC(F)(F)C2)cc1Br 2152789924 NFIDHNWLRPEZAF-UHFFFAOYSA-N 442.323 4.395 10 10 IICE NCc1ccc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)cc1Br 2153346180 HOEFWEFFJOTRQO-GOTSBHOMSA-N 426.402 4.400 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@H]2C[C@H]1CN(Cc1ccccc1)C2 2160683262 IYVMMVCJCMCRTK-FPOVZHCZSA-N 426.402 4.412 10 10 IICE O=C1Nc2ccc(Br)cc2C1=C1SC(=S)N(Cc2ccccc2)C1=O 2294499013 GJFMAFXKHJXJPC-UHFFFAOYSA-N 431.336 4.173 10 10 IICE COc1ccc(N2CCN(c3ncc4c(n3)C[C@H](C=Cc3ccccc3)CC4=O)CC2)cc1 2294812028 KVJGRERCXFIDDO-NRFANRHFSA-N 440.547 4.270 10 10 IICE O=C(NN1C(=O)C(=Cc2cccnc2)SC1=S)c1ccc(OCc2ccccc2)cc1 2296303813 KVBMTSZKODBZKZ-UHFFFAOYSA-N 447.541 4.207 10 10 IICE C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)C(=Cc2ccccc2)SC1=S 2296885387 RTIAZHYTOJDMRG-OAHLLOKOSA-N 435.574 4.117 10 10 IICE CCC1=NN2C(=N)C(=Cc3ccc(OCCOc4ccc(C)cc4)cc3)C(=O)N=C2S1 2297306506 DHQLOORBHTZDEL-UHFFFAOYSA-N 434.521 4.482 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccc(C)cc3)C2=O)ccc1O 2314837804 WWQGSXDXEFRNCE-AWEZNQCLSA-N 442.562 4.328 10 10 IICE CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352673621 RTHLCXUDYTZUOS-CQSZACIVSA-N 429.355 4.115 10 10 IICE O=C(NN1C(=O)S/C(=C/c2ccc(Br)cc2)C1=S)c1ccccc1O 8765873 NTHDMIOVZHDKBY-NTEUORMPSA-N 435.324 4.337 10 10 IICE CCN1C(=O)/C(=C2/SC(=S)N(C3CCCC3)C2=O)c2cc(Br)ccc21 33374302 YGLKVAMXRIOAOU-CCEZHUSRSA-N 437.384 4.330 10 10 IICE CCOc1ccc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)cc1Br 59135131 XOKSLSUBMDMZEO-ZROIWOOFSA-N 433.233 4.494 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)N[C@@H](C)c4ccc(F)cc4)cs3)CC2)cc1 65211559 JXQHPEPDMQTTBS-INIZCTEOSA-N 440.544 4.108 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3OCCN(C)C)cs2)cc1 71556396 MEUMBPAUVHWGRD-UHFFFAOYSA-N 431.583 4.114 10 10 IICE CCCCOc1ccc(/C=C2/SC(=S)N(CCCC(=O)OCC)C2=O)cc1OC 206455869 URVXNGAFOBFFAU-NBVRZTHBSA-N 437.583 4.419 10 10 IICE Cc1ccc(-c2nn(-c3ccccc3)cc2/C=C2/SC(=S)N(CC(=O)O)C2=O)c(C)c1 208038126 OPHISYNINYJLRB-YBFXNURJSA-N 449.557 4.442 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cc(-c3ccccc3)nn2C(C)(C)C)cc1 761890404 BNZKNMIKGZWUCR-UHFFFAOYSA-N 447.583 4.406 10 10 IICE CC(C)N1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1ccc(F)c(F)c1 778673854 GUESULVOCFQJFA-BJKOFHAPSA-N 440.538 4.364 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)nc1-c1cccc([N+](=O)[O-])c1 782261954 UHPNJKNKPLQILQ-UHFFFAOYSA-N 444.416 4.241 10 10 IICE CN(Cc1ccccc1O)C(=O)NCc1ccccc1-c1ccc(Cn2cncn2)cc1 919914384 PQMOOKLXSSZWGA-UHFFFAOYSA-N 427.508 4.041 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccc(Cl)cc1 1126067409 NCMNOQIHAXZXMP-OAQYLSRUSA-N 439.918 4.351 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3c(Cl)cccc3OCC3CC3)c2)CC1 1126386611 LJMPKYPOTANEMG-UHFFFAOYSA-N 427.932 4.083 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@]3(C)Cc4ccccc4C(=O)O3)cc2Cl)C1 1128490445 SXQTUQACALFFKD-FYSMJZIKSA-N 426.944 4.364 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(-c4ccc(Br)cc4)no3)C2)cc1 1131030567 SQLGINMZSQBNHM-MRXNPFEDSA-N 442.313 4.121 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N2CCN(c3ccccc3F)CC2)cc1 1167882117 TYFPHQNNKDUTQL-UHFFFAOYSA-N 447.554 4.232 10 10 IICE CCn1c(S)nc2cc(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)ccc2c1=O 1170857711 KHJUDWQYPFVNLF-UHFFFAOYSA-N 446.576 4.351 10 10 IICE O=C(NCc1c(O)cccc1F)c1cccc(NC(=O)c2ccc(Br)o2)c1 1178410596 VFWCIRUGHZEABT-UHFFFAOYSA-N 433.233 4.069 10 10 IICE CC(C)N(Cc1ccco1)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1287946259 DASYAPZIILDVFC-SFHVURJKSA-N 427.524 4.043 10 10 IICE Cc1ccc(NC2CC2)c(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)c1 1293129992 BYWXEWHRJMTNCF-UHFFFAOYSA-N 428.536 4.314 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(C(F)(F)F)CCC2)NC(=O)OC(C)(C)C)cc1 1293792773 IXIOJWJRXIEUIT-INIZCTEOSA-N 429.483 4.167 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1 1299438828 GHRYHCKHARONKF-GHTZIAJQSA-N 439.556 4.330 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CCCSC3)CC2)cc1F 1300246344 FRCMSBAEPLBBBO-QGZVFWFLSA-N 447.624 4.193 10 10 IICE CCC1CCN(c2nnc(C(=O)NC(CC)CC)n2Cc2ccc(N(C)C)c(F)c2)CC1 1306359261 SBOXVACCCUTDNH-UHFFFAOYSA-N 444.599 4.076 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1ccc(C(N)=O)o1 1306450813 LIZKPBWUAPFGRZ-INIZCTEOSA-N 431.414 4.304 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NCC1(c2ccccc2)CCCCC1 1307568695 ZYSWVWIFOIYCRN-DEOSSOPVSA-N 436.596 4.392 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCn3ccc4cc(Cl)ccc43)cc2F)CC1 1443593731 WOPQQIHVAJHDGY-UHFFFAOYSA-N 442.966 4.282 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c4cc(C)oc34)CC2)cc1 1458042230 KUHMNTAZOFWLED-UHFFFAOYSA-N 429.314 4.475 10 10 IICE CCN(CC(=O)N(Cc1ccc(C)cc1)C1CC1)Cc1cc(Br)ccc1O 1459567380 DHJOYKBBXUDSOK-UHFFFAOYSA-N 431.374 4.476 10 10 IICE Cc1cc(NC(=O)CN2CCCc3cc(OC(F)F)ccc32)n(-c2ccc(F)cc2)n1 1459675167 DFBKFIOPXSFUKM-UHFFFAOYSA-N 430.430 4.313 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(Br)cccc3cn2)cc1 1461337414 MEHIKCSIXSWIKF-UHFFFAOYSA-N 428.330 4.214 10 10 IICE CCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)nnc1-c1ccncc1 1472911262 VLRNLSLEQPXXKM-UHFFFAOYSA-N 436.516 4.277 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@H](C)c3ccc4ccccc4c3)CC2)c(OC)c1 1473732278 FOLSOUBZXLJKNB-WOJBJXKFSA-N 447.579 4.245 10 10 IICE C[C@H](NC(=O)N1CCC[C@@H]([C@H]2CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 1478471026 MDCIQUUMCAQRFV-TYPHKJRUSA-N 444.620 4.492 10 10 IICE CCC1(CC)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)C)C1 1497679577 HSTLYTOFGSHZBB-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CC[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1499724746 FFTGVZHLLGTJLV-HOTGVXAUSA-N 439.676 4.490 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@H]1CC[C@H](F)C1 1503474036 VJUAVGHNVHNXCX-SFTDATJTSA-N 443.611 4.478 10 10 IICE CCN(Cc1cccs1)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)cc1C 1515634244 PLGLIVUGXWZCJU-UHFFFAOYSA-N 435.601 4.189 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc3n(n2)CCCC3=O)sc(C)c1-c1ccc(F)cc1 1523603974 UKTPSSVVWDFOSG-UHFFFAOYSA-N 441.484 4.465 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCO[C@@H](c3ccnn3C)C2)c(C)n1-c1ccc(Cl)cc1 1525878393 NKUPKDIVBDIVSD-SIKLNZKXSA-N 426.948 4.060 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 1526247580 ZABMZAAEFTUTBL-ACRUOGEOSA-N 449.595 4.204 10 10 IICE CCN1CCN(c2ccc(CNC(=O)COc3cc(C)ccc3C(C)C)cc2F)CC1 1530366672 HICSWJAYYQRAFM-UHFFFAOYSA-N 427.564 4.095 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CSCN3C(=O)CC(C)(C)C)c2C)c1 1531612962 ZBMJCJWBZCVGAX-OAQYLSRUSA-N 427.614 4.356 10 10 IICE CCCCOCCN(C(=O)/C=C\c1cnc(OC)nc1)c1cccc(Br)c1 1532256415 PEFROFMWRLGPFO-HJWRWDBZSA-N 434.334 4.111 10 10 IICE CCCCN1C(=O)C[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)[C@@H]1c1ccc(OC)cc1 1544165006 SRZQVWMNJYGTJP-BVAGGSTKSA-N 449.595 4.084 10 10 IICE Cc1cc(C(=O)NCc2cc(C3CC3)nn2C)c(C)n1-c1ccc(Br)cc1 1558515386 BZBLQGAOGFQXKO-UHFFFAOYSA-N 427.346 4.398 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccccn3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1559359875 XJMPVQVTWIOIHG-AREMUKBSSA-N 444.535 4.262 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](C)c3ccc(Cl)s3)cc2F)C[C@H](C)O1 1559731992 FPHJAUKKNDDKNP-KKUMJFAQSA-N 439.984 4.121 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1-n1c(C)cc(C=O)c1C 1568471143 AWDRGKUVNKLDKS-RTBURBONSA-N 446.551 4.476 10 10 IICE Cc1cc(C(=O)Nc2n[nH]cc2I)c(C)n1-c1ccc(Cl)cc1 1585209523 UIMFATBNAJLDST-UHFFFAOYSA-N 440.672 4.328 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnnn1-c1cc(Cl)ccc1Cl 1585264147 MWTKWWPCYJDPSF-CQSZACIVSA-N 432.355 4.310 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(CNC(=O)OC(C)(C)C)cc1 1585264235 PDBSZRYKDYLTBH-SFHVURJKSA-N 425.573 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccncc2)Cc2cccnc2)cc1 1585530704 WKVUPMVGALMGSW-UHFFFAOYSA-N 438.531 4.468 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1 1586155769 BFLLYXAKOKWDQJ-MHZLTWQESA-N 431.580 4.112 10 10 IICE COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1598158908 YWFOWKQYFMTSSC-UHFFFAOYSA-N 445.519 4.404 10 10 IICE CCCc1sc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1Br 1598276433 FCNKVNIXUNYMNY-UHFFFAOYSA-N 436.419 4.145 10 10 IICE CCc1nc(CN(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)cs1 1613882238 AZEHBMDOHKEGHW-UHFFFAOYSA-N 447.612 4.418 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3c[nH]c4ccc(Br)cc34)CC2)cc1 1625247926 CETJLNKJRQZHQG-UHFFFAOYSA-N 442.357 4.220 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CCCCN1C(=O)OCc1ccccc1 1627209512 FODCYVFAEDUWER-XMMPIXPASA-N 435.568 4.484 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(CNc2ccncn2)c1 1629968891 MFYMPDNVCVUEKZ-UHFFFAOYSA-N 441.329 4.219 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccccc4Cl)[nH]n3)cc2F)C[C@@H](C)O1 1630549974 FJBHZZRVCLBVOZ-GASCZTMLSA-N 442.922 4.413 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)cc1-n1c(C)cc(C=O)c1C 1630645430 AONYZSAUDNXMPP-JOCHJYFZSA-N 447.510 4.280 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn3c2N[C@@H](C2CC2)C[C@H]3C(F)F)cc1F 1633264271 WNPWVVOJEZFNQG-MJGOQNOKSA-N 435.494 4.199 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](c2cccc(Cl)c2)C2CCCCC2)c1 1636177329 WSSWOULWYQBDIY-HXUWFJFHSA-N 436.961 4.469 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@]1(c2ccccc2)CCCO1 1638607480 VXXGFOZWWKYZSE-OAQYLSRUSA-N 433.346 4.392 10 10 IICE CNC(=O)[C@H](CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C)Cc1ccc(F)cc1C 1638952926 UMFZVDGMYKMURV-NRFANRHFSA-N 435.543 4.185 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@@H]21 1640087521 HRTVVBYMQNSMHF-CWRNSKLLSA-N 437.131 4.119 10 10 IICE COCC1(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCCCC1 1641278395 RYEOERKAPDXWAN-SSZFMOIBSA-N 438.640 4.195 10 10 IICE CC(C)(C)c1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n[nH]1 1653842524 BRTXEBJYJLTXAN-UVTDQMKNSA-N 432.546 4.076 10 10 IICE COc1ccc(N(Cc2cccs2)Cc2c(I)cnn2C)cc1 1657566755 GXURCHQAHCGPQI-UHFFFAOYSA-N 439.322 4.302 10 10 IICE COc1ccc([C@@H]2CN(Cc3ccccc3)C[C@H]2NC(=O)NCc2c(O)cccc2F)cc1 1683307379 DPHYCGPQLAVJEQ-LADGPHEKSA-N 449.526 4.007 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(c4c(Cl)cccc4Cl)CC3)cc2)CC1 1684973419 RJLACAQLHLEMLT-UHFFFAOYSA-N 433.383 4.234 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCS[C@H](C)C1 1693006377 XOJMYGCQCMBJMB-QGZVFWFLSA-N 427.643 4.295 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCCOCC2)cc1 1695623230 ASDOBZCLSAVNHW-UHFFFAOYSA-N 425.602 4.052 10 10 IICE CCc1nnc(N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)n1CCCSc1nccs1 1709098869 AGYVIJJNYNJGEL-BLLLJJGKSA-N 432.446 4.500 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCC[C@@H](COC)C2)cc1 1710027812 LQERNDVDQZUXPL-JOCHJYFZSA-N 448.615 4.021 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCSC2(C)C)n1 1742683900 HEGSQPVKFYIZAA-LJQANCHMSA-N 440.617 4.013 10 10 IICE CCc1nnc(N2CCO[C@H](c3nc(C)cs3)C2)n1Cc1ccc(N(CC)CC)cc1 1764949513 RWWZWOVWXCYRPV-FQEVSTJZSA-N 440.617 4.078 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C[C@H](C)O1 1765293037 ITEUPQISLMNMEO-PGRDOPGGSA-N 439.629 4.357 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccc(F)c(F)c4)n4ccccc34)CC2)cc1 1858341806 MZGYYQSKVJDWIF-UHFFFAOYSA-N 448.473 4.251 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3cccc(OC)c3)SC2=S)N(C)C)cc1 1858594315 ULUZAKNTRQBKJN-CVNFFVDQSA-N 428.579 4.208 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@H](NCc1c(O)cccc1Br)C2 1878874448 IVIAUTWDKGZDHT-MQVNZCODSA-N 429.330 4.123 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCC(C)(C)N2C(=O)OC(C)(C)C)c1O 2236043071 HOVWTJJTEWLNCC-ZDUSSCGKSA-N 443.382 4.431 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CC(=O)Nc3ccc(C(C)=O)cc3)C2=O)cc1 2296885544 ZIWGHSWEXBXBEP-UHFFFAOYSA-N 440.546 4.128 10 10 IICE CCCCCN1C(=O)C(=C2SC(=S)N(CCC(=O)OCCC)C2=O)c2ccccc21 2314761474 UHWGEBBOZDPZNK-UHFFFAOYSA-N 446.594 4.138 10 10 IICE CC(C)(C)c1ccc(C(=O)NN2C(=O)C(=Cc3ccc(C(=O)O)cc3)SC2=S)cc1 2314929236 JQZOHQJNDIQVRG-UHFFFAOYSA-N 440.546 4.229 10 10 IICE CN(C)c1ccc(C2(c3ccc(N(C)C)cc3)O[S@@](=O)c3ccc(N(C)C)cc32)cc1 15774488 XRTRYADCPDCRGX-HKBQPEDESA-N 435.593 4.229 10 10 IICE CCCN(CCC)c1nc2ccccn2c(=O)c1/C=C1/SC(=S)N([C@H](C)CC)C1=O 33919994 VJPJIKOJOFDNSY-PWVLXBNSSA-N 444.626 4.321 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c(C)n1-c1cccc(C(F)(F)F)c1 97605400 RNIDBMAMSWEKIV-OAQYLSRUSA-N 433.430 4.016 10 10 IICE CCOC(=O)c1sc([C@@H](C)NC(=O)NCc2ccc(N(CC)CC)c(F)c2)nc1C 756935147 NYCIMYXHJCJRPX-CQSZACIVSA-N 436.553 4.174 10 10 IICE Cc1nc(C)c2c(C)c(CNCc3ccc(N4CCN(CC5CC5)CC4)cc3)sc2n1 768668683 AKATUASXJHNQAG-UHFFFAOYSA-N 435.641 4.438 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCC(=O)c2ccc(F)cc2F)C1 769662376 ATNYZIJRMRYZDR-UHFFFAOYSA-N 426.463 4.112 10 10 IICE COc1ccc(N2CCN(C(=O)C[C@H](O)c3ccc(OCc4ccccc4)cc3)CC2)cc1 780847752 AIGKPOCRXVOAGS-SANMLTNESA-N 446.547 4.047 10 10 IICE O=C(c1cccc(O)c1O)N1CCO[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 790936307 APZIQZKKAKOKRR-HNNXBMFYSA-N 435.320 4.349 10 10 IICE CN(C)C(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1 799636661 UTFBIXAZPXGIEC-UHFFFAOYSA-N 437.546 4.466 10 10 IICE CCc1nc2cc(CNC(=O)NCc3cc(Br)ccc3O)ccc2n1C1CC1 805464127 DAEDMEQMLRRWDA-UHFFFAOYSA-N 443.345 4.401 10 10 IICE CCCCCCOc1ccc(/C=C2\SC(=S)N(CCN3CCOCC3)C2=O)cc1 814273827 DBVBHWXWAHVSRU-JZJYNLBNSA-N 434.627 4.179 10 10 IICE CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc1OCC 1083973849 FLDHDAOAHHSQIL-RGEXLXHISA-N 430.460 4.304 10 10 IICE CCN1C(=O)NC(=O)/C(=C/c2cn(Cc3ccc(Cl)cc3Cl)c3ccccc23)C1=O 1084170500 XJXUDBOHODFYFK-MFOYZWKCSA-N 442.302 4.478 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1[N+](=O)[O-] 1124340761 KVWBKAFQUCLXMH-LICLKQGHSA-N 445.497 4.272 10 10 IICE Cc1ccc(OCCC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134681865 KPPZHEWICQVUFW-FQEVSTJZSA-N 448.405 4.012 10 10 IICE C[C@@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cnn(C)c1 1134751339 XYSWRACODBHYQZ-ZDUSSCGKSA-N 439.317 4.025 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cn(-c3ccc(Cl)c(Cl)c3)cn2)N(C)C)cc1 1134881609 AXNOMTSBJMGEQH-OAQYLSRUSA-N 446.382 4.278 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CN(Cc3ccccc3)C[C@]23CCOC3)cc1 1135946259 LOVWJVYBRWZBLD-VPUSJEBWSA-N 435.612 4.030 10 10 IICE Cc1cc(C(=O)Nc2cccc(N3CCCCC3)c2)ccc1NS(=O)(=O)C(F)(F)F 1142294861 TVONWSNFHBBUEW-UHFFFAOYSA-N 441.475 4.499 10 10 IICE CC[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@@H](O)c1ccccc1F 1150196652 JOGSWPBUCJFACH-GJZUVCINSA-N 437.559 4.175 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1c[nH]c2nccc-2c1 1154590555 KFUNFPRVGSKUHS-XNTDXEJSSA-N 428.564 4.196 10 10 IICE C[C@@H](NC(=O)c1ccc2n1CCN(C(=O)OC(C)(C)C)[C@@H]2C)c1ccc(N(C)C)cc1 1154669107 RCKXBEVYOKKWPE-IAGOWNOFSA-N 426.561 4.357 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)sc2c1CC[C@H](C)C2 1193574151 DQJKHNMXPCCMDC-HOTGVXAUSA-N 443.613 4.405 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](COC)c1cccc(OC)c1 1230733175 LDUZQICEEQPBPL-GOSISDBHSA-N 437.334 4.083 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C\c1ccc(C)nc1)CCC2 1264933066 GNEMLKCTKMQUJW-KHPPLWFESA-N 432.476 4.341 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1295414499 IWKFCRYFABWHMD-WTIAFYNJSA-N 441.620 4.275 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3NC(=O)c3ccccc3)C2)cc1 1299770938 WRZCCUFFJDVEAT-LJQANCHMSA-N 429.520 4.204 10 10 IICE CCOC(=O)[C@@H](C[C@@H]1CCCO1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1303455296 AIUDVPYJMBMMEZ-JTHBVZDNSA-N 426.557 4.448 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CCc2ccncc2)sc(C)c1-c1ccccc1 1307589092 KEGMPUOMQLXULE-UHFFFAOYSA-N 437.565 4.408 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC/C=C\c3ccc(Br)cc3)C2)cc1 1312995279 UMDDVWIRQCHHIB-VSERLBFKSA-N 444.373 4.439 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCCNC(=O)c2ccc(F)cc2)c1 1360324427 UIFGJFSSLROLQM-UHFFFAOYSA-N 427.907 4.437 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccnc2c1CCN2C(=O)OC(C)(C)C 1451666550 JPEPCJDAPLPSSY-QGZVFWFLSA-N 438.572 4.115 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)Cc1ccc(Cl)cc1 1459384118 DLNWWUIKJPWPKM-HDICACEKSA-N 447.982 4.231 10 10 IICE COc1cc(OC)c(NC(=O)CCN(Cc2ccccc2O)C[C@H]2CCCO2)cc1Cl 1459733173 DXGOYACTGUQRAI-QGZVFWFLSA-N 448.947 4.073 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCCC2)[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1468670392 ZNACLIPEPYIJGJ-MRXNPFEDSA-N 429.344 4.495 10 10 IICE CCC[C@@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N[C@H](C)c1ccccc1O 1471195132 DBGLANMLQFQZTF-RDTXWAMCSA-N 448.361 4.000 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4cc(C)oc4C)C3=O)c2C)c1 1472984985 UJERSENSHZUFNK-VWLOTQADSA-N 433.508 4.262 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC(Cc4ccc(C(F)(F)F)cc4)C3)C2)cc1 1478859981 KBCRXVCXXJNZED-GOSISDBHSA-N 447.501 4.424 10 10 IICE CCc1ccc(-c2nnc(N3CC[C@@H](OC)C3)n2CCCSc2nccs2)cc1 1497980919 SZIKFVCCZOQAEC-GOSISDBHSA-N 429.615 4.372 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)c1ccsc1 1505092323 OBHXMTJMIKGOBR-QHCPKHFHSA-N 437.569 4.319 10 10 IICE C[C@H](NC(=O)CN(C(=O)c1ccccc1)c1ccccc1)c1ccc(N2CCOCC2)cc1 1535557475 ANBJCIYMXOGZRM-NRFANRHFSA-N 443.547 4.047 10 10 IICE Cc1ccc(-c2nnc(N(C)CCc3nccs3)n2Cc2ccc(N(C)C)c(F)c2)o1 1542307569 SZGXTLFDXUWWEY-UHFFFAOYSA-N 440.548 4.235 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(CNC(=O)C(F)(F)F)o3)c2C)c1 1544081487 XBTKEZSHLOMWBX-UHFFFAOYSA-N 433.430 4.104 10 10 IICE CC1CCN(c2ccc(CNC(=O)Cc3ccc(Br)c([N+](=O)[O-])c3)cc2)CC1 1565663774 MORJWBWGKRXXHZ-UHFFFAOYSA-N 446.345 4.453 10 10 IICE O=C(CCc1cccc(F)c1Br)NCc1ccc(N2CCC(CO)CC2)cc1 1565985533 FRXYIKKRFYAVBO-UHFFFAOYSA-N 449.364 4.046 10 10 IICE Cc1cc(Br)ccc1NC(=O)CCNC(=O)c1cc2cc(O)c(O)cc2s1 1584160058 HCQZIZKJRUJWTK-UHFFFAOYSA-N 449.326 4.142 10 10 IICE COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NCc2cc(C)ccc2O)cc1 1584983324 JHINCRHEPZGHPA-UHFFFAOYSA-N 427.504 4.421 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3ccc(Br)cc3F)C2)cc1 1585665258 OYDUOQLYHDLVML-HNNXBMFYSA-N 435.337 4.172 10 10 IICE Cc1ccccc1OCC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1585834872 VIVSMJDCIDSXPR-UHFFFAOYSA-N 437.297 4.485 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ncsc1C1CC1 1610994781 HOHXMXODLIRDOR-NTEUORMPSA-N 433.555 4.390 10 10 IICE Cc1cc(C(=O)Nc2ccc(S(=O)(=O)CCO)cc2)c(C)n1-c1cccc(C(C)C)c1 1623735375 JHMJQDSHDGYPFE-UHFFFAOYSA-N 440.565 4.236 10 10 IICE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1624538113 WWGQWGTWRQGZHV-OAQYLSRUSA-N 447.620 4.057 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C[C@H]1CCCO1)C(F)(F)F 1626510931 CVNDVUVSMCEUQE-MSOLQXFVSA-N 444.494 4.123 10 10 IICE COc1ccc(Cl)cc1NCC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1627989357 LNFHRYPMHFDJMW-UHFFFAOYSA-N 429.870 4.418 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)CN3CCN(c4ccccc4)CC3)c2C)cc1 1629690378 SRTZARVUJBEINZ-HXUWFJFHSA-N 446.595 4.043 10 10 IICE COc1ccc(Br)cc1-c1nc(C(=O)NCc2cccc(OC)c2O)cs1 1636061850 YXLTZMFMPJNSNH-UHFFFAOYSA-N 449.326 4.225 10 10 IICE CC(=O)c1cccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1O 1638108939 GBIZBTDLDOMDIH-WJDWOHSUSA-N 446.575 4.276 10 10 IICE COc1ccc(N2CCCN(c3ccc([N+](=O)[O-])c(OCc4ccccc4)n3)CC2)cc1 1639315335 RCFXOZWPTANRCB-UHFFFAOYSA-N 434.496 4.294 10 10 IICE COCCN(Cc1ccc(N(C)C)c(C)c1)C1CCN(C(=O)OCc2ccccc2)CC1 1643667303 XBXWZMQGZQVLQN-UHFFFAOYSA-N 439.600 4.311 10 10 IICE Cc1cc(S(=O)(=O)Nc2ccc(C(=O)N[C@H](C)c3ccccc3O)cc2)ccc1F 1643738412 AKQPMDOJUMKPCX-OAHLLOKOSA-N 428.485 4.132 10 10 IICE COCn1ccc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1650743806 DGVIJAYIHJVZND-GOSISDBHSA-N 432.446 4.412 10 10 IICE COC[C@@H](SCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1652237255 IDBKOQVVJVBLGT-IEGUWTFLSA-N 446.588 4.176 10 10 IICE CCOC(=O)c1[nH]c(C)c(C(=O)CN(Cc2ccco2)c2ccc(OC)c(F)c2)c1C 1653582290 PEQXMXGKQQYNRB-UHFFFAOYSA-N 428.460 4.438 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1679153635 BTGIQSVMTUWRSY-MRXNPFEDSA-N 433.911 4.302 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4)C(=O)C3)cc2Cl)C1 1681828266 QZYXSTHZYGUGEW-SFHVURJKSA-N 440.975 4.135 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCSC[C@H]3c3ccccc3)C2)cc1 1682188166 ILIWDYBTJAQZJM-XXBNENTESA-N 425.598 4.411 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2 1685720182 RCTNDQWSHSJVDB-SXLOBPIMSA-N 431.577 4.492 10 10 IICE CC[C@H](C)[C@@H](Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1693970944 MYLONTYCGMIUCX-WMZHIEFXSA-N 449.603 4.033 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709443307 DJYGVWOFYXZCQT-VWLOTQADSA-N 436.604 4.071 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)[C@@H]1C 1726777054 ZOOZDFCAINRSKD-QLFBSQMISA-N 425.649 4.099 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ncccc1N(C)C 1741433367 HNEMEBPNGFNEJH-UHFFFAOYSA-N 447.631 4.223 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@H](C)C1 1745777995 OFLWVWDWBKJQFE-RTBURBONSA-N 448.615 4.361 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1771446855 YYXHFGBNGDBWSL-HZPDHXFCSA-N 439.676 4.143 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccc(F)cc4C)n4ccccc34)CC2)cc1 1858343488 IYRVTYSALUUXTJ-UHFFFAOYSA-N 444.510 4.420 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@H]1CN(Cc2ccccc2)C[C@H]1C(F)F 1878709864 JUIBLRAMYVIULV-WBVHZDCISA-N 429.280 4.149 10 10 IICE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@H](N)c1ccc(N2CCCC2)cc1 2044757448 YMZDCDMZBNJEKS-DEOSSOPVSA-N 438.616 4.314 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@]1(C)CNCc1cccc(Br)c1O 2102785230 IHRGSKSEYTZVFA-KRWDZBQOSA-N 435.309 4.279 10 10 IICE CCc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3CCCOc3ccccc3)C2=O)cc1 2264419 DKLMNHSRMHENHB-PTGBLXJZSA-N 443.503 4.186 10 10 IICE CCN1C(=O)/C(=C/C=C2\Sc3ccc(OC)c(NC(C)=O)c3N2CC)SC1=S 15946635 NSQGJURHILHUKX-TYPNBTCFSA-N 435.596 4.191 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(\C)NCc2cccs2)cc1 19647246 NXVDMVFJPHQGQH-RCCKNPSSSA-N 448.504 4.480 10 10 IICE CCCCN1C(=O)/C(=C/c2cc3cccc(C)c3nc2N2CCOCC2)SC1=S 40562471 OQEOXTDNNAZQNY-JXAWBTAJSA-N 427.595 4.381 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCC(=O)OC)C2=O)ccc1OCCC(C)C 206835312 JSSMOGGZNHEBDH-AQTBWJFISA-N 437.583 4.275 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(OC)c(O)c1)N2 226663074 NMFAWQPPLQLABQ-TWFFJXMTSA-N 428.554 4.304 10 10 IICE Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 726432108 VTYDOKUZAHDTLZ-UHFFFAOYSA-N 435.253 4.292 10 10 IICE CC[C@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1nc2ccccc2[nH]1 727476647 ZVAZOTNHGBOBPU-BXWFABGCSA-N 439.535 4.266 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)[C@@H]2CCOC[C@@H]2C)sc(C)c1-c1ccccc1 769253761 CEMDXFYLAYWZNR-WMLDXEAASA-N 445.537 4.055 10 10 IICE Cc1ccc([C@H](CCn2cncn2)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 783266667 XSEDKEGKJOZPPY-MHZLTWQESA-N 444.627 4.040 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(CCc2ccco2)n1C[C@@H]1CCOC1 802754601 DEMYOQMYVIHMPT-QFIPXVFZSA-N 449.599 4.320 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCCC[C@H]3c3nnc(C4CCC4)o3)CC2)cc1 812024809 TUMGOCLPVHXCSW-NRFANRHFSA-N 439.560 4.251 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc2c(Cl)nccc2o1 1125196703 QXJWBAGZBLHFBF-UHFFFAOYSA-N 439.821 4.267 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3coc(-c4ccccc4Cl)n3)cc2F)CC1 1125976257 SFUOBNBBSIYAIM-UHFFFAOYSA-N 442.922 4.206 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C2CC2)nc2c1c(C)nn2-c1ccccn1 1140198698 OVJQILJTAPCYFE-UHFFFAOYSA-N 448.523 4.123 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@H](C)C[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1141736551 RXHBZKMJRRGWOS-HZPDHXFCSA-N 447.421 4.349 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CC(c4ccc(Cl)cc4Cl)=NO3)C2)cc1 1162718789 QQAUQAZMMUAFNS-SPLOXXLWSA-N 448.350 4.138 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC12CCN(C(=O)OC(C)(C)C)CC2 1230199278 AVZFZXRBWJSQMJ-LJQANCHMSA-N 444.620 4.177 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1 1286944942 FFOLOMRTMIEDDQ-SFHVURJKSA-N 434.588 4.115 10 10 IICE CCSc1cc(Cl)ccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1288912766 MALSYUCXRJGTHD-UHFFFAOYSA-N 431.989 4.084 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C(=O)N(C)Cc4ccccc43)cc2Cl)C1 1312591580 YELWZIVDGLXFGE-OPAMFIHVSA-N 440.975 4.089 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F 1312886381 UUECTIRCEJLPFD-GOSISDBHSA-N 432.559 4.044 10 10 IICE CN1C[C@@H](C(=O)Nc2ccc(N=Nc3ccccc3)cc2)N(C(=O)OC(C)(C)C)CC1=O 1350165062 YARPKMYXBZRMLN-IBGZPJMESA-N 437.500 4.118 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)c3cccc(CC(C)C)c3)CC2)cc1 1353707505 UDYICFHKEPTPFJ-QFIPXVFZSA-N 437.628 4.326 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CC[C@H]1c1ccc(F)cc1 1354326860 DJYFKJNWDXQVGB-PMACEKPBSA-N 436.449 4.491 10 10 IICE COc1ccc(N2CCCN(C(=O)c3nccc4c(Br)cccc34)CC2)cc1 1356396568 BLNVPVPEMSRQEN-UHFFFAOYSA-N 440.341 4.358 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(CCc2ccccc2)n1 1361063763 RFZDJQPRFOQTAK-LJQANCHMSA-N 440.494 4.126 10 10 IICE CC(C)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1434908142 AXNNIIFNRQJYIJ-RXVVDRJESA-N 447.620 4.276 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2)c1C 1439960557 MRIDAPHCFSPBHI-RUZDIDTESA-N 433.600 4.150 10 10 IICE COc1cccc(C[C@H](C)CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1465952206 XUSDBBVJDZMABJ-LAUBAEHRSA-N 430.976 4.404 10 10 IICE CCCN(CC(=O)Nc1ccccc1C(=O)NCc1ccc(C)cc1)Cc1ccccc1O 1473196034 PETVMDTXDNZIOO-UHFFFAOYSA-N 445.563 4.481 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C2CCC2)cc1 1473789708 QAWWHOQADYVXSA-PMACEKPBSA-N 439.575 4.423 10 10 IICE C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786004 FCEDIIOFOAHTNL-QVKFZJNVSA-N 433.474 4.233 10 10 IICE Cc1nnc(N2CCO[C@@H](c3cccc(Cl)c3)C2)n1CCCSc1nccs1 1492942618 NULGGDRAKHXORZ-QGZVFWFLSA-N 436.006 4.457 10 10 IICE Cc1ccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(Br)n1 1528428797 YKJKFFOOIRSKHD-UHFFFAOYSA-N 442.357 4.479 10 10 IICE COC(=O)c1ccc2c(c1)CCN2C(=O)c1ccccc1CCN(C)C(=O)OC(C)(C)C 1532226908 LEMMZIWANWUSPJ-UHFFFAOYSA-N 438.524 4.086 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2CC(=O)NCC2CC2)c(C)n1-c1ccccc1 1542180920 DONCUABIUDTMQF-UHFFFAOYSA-N 448.615 4.361 10 10 IICE Cc1cc(-c2nnc(N3CCCC3(C)C)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1542183696 BRVMEHQWDYSPCY-UHFFFAOYSA-N 434.588 4.256 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](OC)CC[C@@H]2C)sc(C)c1-c1ccccc1 1560063967 PQRXTGYETSFDBC-YJBOKZPZSA-N 430.570 4.338 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@](C)(O)c3ccc(F)cc3)cc2Cl)C1 1564650430 WTEYRHLFVAPVFU-QMHKHESXSA-N 433.955 4.422 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1565169101 GRJYIDQCFXQFRV-FQEVSTJZSA-N 432.609 4.320 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2nsc3ccccc23)NC(=O)OC(C)(C)C)cc1 1565884406 QNJYUDYHJULTAO-SFHVURJKSA-N 440.569 4.358 10 10 IICE Cc1cc(C(=O)N2CC[S@](=O)C(C)(C)CC2)c(C)n1-c1cccc(Br)c1 1569100666 PQKNILNYORDPCH-SANMLTNESA-N 437.403 4.230 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1583527484 WZYVDKGPJIVMNZ-JBYIUTFZSA-N 429.992 4.461 10 10 IICE Cc1ccc([C@@H]2C[C@H]2NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1585848106 RTYOWSOHDMWKMG-WPWRXMBVSA-N 440.565 4.398 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 1595435626 IRIIEWIVVYASTH-HSZRJFAPSA-N 435.568 4.438 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCCC[C@@H]3C)C2)n1Cc1ccc(N(C)C)cc1C 1613997732 FEVKYCMUYJFMPQ-FCHUYYIVSA-N 438.664 4.354 10 10 IICE CC(C)(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)c(F)c1 1616737495 BNSQKIIZSNVPGW-UHFFFAOYSA-N 434.442 4.204 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC[C@@H]2CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1618252215 BCXQJONKUJHWCG-WBVHZDCISA-N 444.403 4.409 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)nc(-c2ccc(Cl)cc2)n1 1618644421 XVDUWZUBLVNSNT-QFIPXVFZSA-N 437.975 4.204 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccc(C)o4)n3CCCSC)CC2)cc1F 1619302210 KZUQGACBHYHMKA-UHFFFAOYSA-N 445.564 4.074 10 10 IICE COc1ccc(N2CCN(C(=O)C3(C(=O)OC(C)(C)C)CCCCCC3)CC2)cc1F 1630202461 YJDXZBKOIBRRNQ-UHFFFAOYSA-N 434.552 4.165 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(c3cc(C(F)(F)F)ccn3)CC2)cc1 1634650512 VORKXPVFRASDAH-UHFFFAOYSA-N 428.458 4.470 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccccc2F)c(C)n1-c1ccccc1Br 1635451274 GRIGTHLDAVKRJX-FQEVSTJZSA-N 431.305 4.459 10 10 IICE CCCOc1ccc(C(=O)Nc2ccc(N3CCC(O)CC3)cc2OCCC)c(OC)c1 1639827117 GNFZVAKNPMGXSI-UHFFFAOYSA-N 442.556 4.486 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCC1(n2cc(Br)cn2)CC1 1651397332 ZLIVAUCFZXPZKM-UHFFFAOYSA-N 441.285 4.386 10 10 IICE COC(=O)C1=C(CSc2ncc(-c3ccccc3)n2C)N(C)C(=O)N[C@@H]1c1ccccc1 1651686429 SQRAMVKKGXEVJL-OAQYLSRUSA-N 448.548 4.003 10 10 IICE C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1676126623 TWBPYJSQUBMWGK-FQEVSTJZSA-N 448.611 4.461 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCC3CCN(C4CCOCC4)CC3)c2C)c1 1683766168 SVCGRSHGNNVZQF-UHFFFAOYSA-N 438.616 4.093 10 10 IICE Cc1ccccc1CN1CCO[C@@H](CNC(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1687286262 AVWDHTGEPNLYOU-SANMLTNESA-N 446.595 4.103 10 10 IICE CCN1CCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)C[C@@H]1C 1695882032 NXZKEKRGQWORQF-KRWDZBQOSA-N 434.679 4.180 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1746090450 ZAQWUIJIOWCHTJ-CYFREDJKSA-N 448.615 4.404 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2[C@@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1751408815 OISKPMSRVUPFMU-HTAPYJJXSA-N 434.588 4.142 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1768158857 BSYMLTSZZQYGCQ-DEOSSOPVSA-N 441.551 4.495 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)Oc2cccnc2NC(=O)Oc2ccc(N)cc2)cc1 1858686572 AFNGGDPJHLUPGM-OAHLLOKOSA-N 436.468 4.079 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)/C2=C/c2ccc(C(=O)O)cc2)cc1 1865675317 ATKMTOHIOXAYMJ-KGENOOAVSA-N 430.435 4.363 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCCC3)C(=O)N(CCCN(C)C)C2=O)cc1 1873165076 AXOXWTQWKSEPBH-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CCOC(=O)c1c(C(F)F)nn([C@H](c2ccc(OC)cc2O)C2CC2)c1Br 2079872592 CCLVMCROECDFMM-HNNXBMFYSA-N 445.260 4.474 10 10 IICE CC[C@@H]1[C@@H](NCc2c(Br)ccc(OC)c2O)CCN1C(=O)OC(C)(C)C 2227747975 HZUCBALKDQHDRB-LSDHHAIUSA-N 429.355 4.041 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3cccs3)SC2=S)cc1 2314836909 LQBDVQWVNUUXLE-LBPRGKRZSA-N 446.575 4.153 10 10 IICE COc1ccc(C=C2SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)cc1OC 2321730197 YBPLCZAOCOBBAH-UHFFFAOYSA-N 425.535 4.024 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](C1)[C@H](NCc1cc(Br)cc(F)c1O)C2 2329450766 UQPBQMJGBVNJLR-DETPVDSQSA-N 429.330 4.029 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)c(O)c(O)c1 1951855175 LZVWTNQHUPTZHH-RUZDIDTESA-N 449.459 4.032 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@H](c3ccc(Br)cc3)C2)c([N+](=O)[O-])c1 301128475 RXNUWERGAYTZEB-VZJZHNIPSA-N 447.285 4.121 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1O 1951965048 WEAIBAMMRWBNEJ-RUZDIDTESA-N 449.459 4.032 10 10 IICE O=C1N=C(N2CCN(Cc3ccccc3)CC2)S/C1=C\c1ccc(N2CCCCC2)o1 38704575 KZGIYFXQXAMQOZ-FXBPSFAMSA-N 436.581 4.058 10 10 IICE CC[C@@H](C)N1C(=O)/C(=C\c2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 33752410 DOVJPOZRRSIXKI-BRYYZUPOSA-N 430.599 4.071 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2cccc(OCc3ccccc3C)c2)SC1=S 40937975 BRCMFVHJGMUDEW-CPNJWEJPSA-N 427.547 4.338 10 10 IICE C[C@@H](NC(=O)N1CCC[C@]2(CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 805311153 YKQHCSKSJLDCES-KOSHJBKYSA-N 430.593 4.246 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc4c(cc3Cl)CCC4=O)n2)cc1 800924650 DMCLWSZIIPFAKY-UHFFFAOYSA-N 434.926 4.402 10 10 IICE O=C1N=C(SCCn2nc3ccccn3c2=O)S/C1=C/c1csc2ccccc12 814771390 REBZHKFYNPDJIN-LFIBNONCSA-N 438.559 4.114 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](c3ccccc3)c3ccncc3)cc2F)C[C@@H](C)O1 728596164 AULHVIDEYDGJHF-MPCDZSKCSA-N 448.542 4.423 10 10 IICE O=C(Cc1ccc(Br)s1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799901 NGLPXCJWCZUKSN-LBPRGKRZSA-N 445.329 4.440 10 10 IICE C[C@H](N[C@H](C)c1cc(Br)cc(F)c1O)c1cccc(NS(C)(=O)=O)c1 756494787 NSRURCFVHVEQPH-WDEREUQCSA-N 431.327 4.077 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3COCc3ccccc3)c2)CC1 1128145050 UPUGGEAXUJOZNZ-UHFFFAOYSA-N 443.547 4.324 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 1129814324 FFUOPGJAWNXBQJ-GOSISDBHSA-N 428.598 4.138 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc1 1124885577 XZIMXLVETCBPQV-UHFFFAOYSA-N 446.473 4.279 10 10 IICE CCN(CC)CCNC(=O)c1cccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 1125108066 UZSRQFMKAJEFAE-UHFFFAOYSA-N 432.568 4.418 10 10 IICE O=C(NCc1ccnc(OC(F)F)c1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 793101318 MCWZWYWVZBQSCA-UHFFFAOYSA-N 425.395 4.353 10 10 IICE C[C@@H]1CN(c2ccc(CNC[C@@]3(C)CCN(C(=O)OC(C)(C)C)C3)cc2F)C[C@@H](C)O1 798947674 KHVGFPZKZXLACG-QZTZHPFYSA-N 435.584 4.176 10 10 IICE Cc1ccc([C@H](NCc2cc(C)cc(Br)c2O)[C@H](C)S(C)(=O)=O)cc1 798088163 IJVSRBDXBAPIPB-KBXCAEBGSA-N 426.376 4.036 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2c(F)cccc2Cl)cc1 1149975642 XEUBVXFVUBCYIX-NRFANRHFSA-N 428.891 4.091 10 10 IICE Cc1cc(=O)oc2cc(N(C)C(=O)/C=C/[C@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc12 1157108367 XZEUSJMIDHOQGP-VGMNTSGFSA-N 426.513 4.268 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)CCO1 1306618060 VIHQTDASBLWNFM-OAQYLSRUSA-N 437.588 4.129 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](CC)C1 1314457098 ICFZCYBFHAJMEU-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@]3(C)Cc3cccc(Cl)c3)cc2)CC1 1246301918 IUTICGSFXZGPHF-RUZDIDTESA-N 441.019 4.399 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccc3cncc(Br)c3n2)C2CC2)cc1 1354143443 YXDZPFLGNJPLEL-UHFFFAOYSA-N 425.330 4.263 10 10 IICE CS[C@@H]1CCC[C@H](NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1435165195 IBGTVHSVPFVSBQ-BESUYIBZSA-N 438.615 4.207 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccccc2-c2cnn(C)c2)cc1 1447290182 UYHHRDWPKJDWIV-UHFFFAOYSA-N 426.520 4.166 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](C)[C@@H]2CNC(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1445158649 OONHPMKZFUJJLX-JXFKEZNVSA-N 426.561 4.255 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCCN1Cc1ccc(Cl)cc1 1441631634 OFQRBRVYUFAHAJ-JOCHJYFZSA-N 430.017 4.174 10 10 IICE Cc1ccc(C(=O)NCCCN2CCc3ccccc3C2)cc1-n1c(C)cc(C=O)c1C 1464121235 GVKGBQZJZGSUAN-UHFFFAOYSA-N 429.564 4.393 10 10 IICE CCc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)CCN2C(=O)c2cccc(O)c2O)cc1 1467452647 PIIPHFNTHBTJOP-IBGZPJMESA-N 426.513 4.094 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2OCc2csc(C)n2)cc1 1461346820 SSNLGYQKSNLIDW-UHFFFAOYSA-N 425.554 4.248 10 10 IICE CCc1ccc(N2C[C@@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1530889130 HTLHLWURZRTSGV-QHCPKHFHSA-N 429.564 4.368 10 10 IICE CC(C)n1ncc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1Cl 1465325670 WRFPMDWPGWUDQV-GOSISDBHSA-N 449.983 4.179 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3cc(Br)ccc3o2)N(C)C)cc1 1618635877 QYAZHDXYALNMKN-SFHVURJKSA-N 430.346 4.294 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1=CCCOC1 1548250811 VVZQBUJKKWPFKY-UHFFFAOYSA-N 435.572 4.172 10 10 IICE COCCN(Cc1c(C)nn(C)c1C)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1479099509 KQDPTCUYIMPAIZ-UHFFFAOYSA-N 437.588 4.111 10 10 IICE CCN1CCN(c2nnc(-c3ccccc3C)n2CCCSc2nccs2)C[C@@H]1C 1615859654 RIJXIVANZJBFRY-SFHVURJKSA-N 442.658 4.423 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCO[C@H](c3nccs3)C2)cc1 1547443662 CNTYRXPHOFXLCS-FQEVSTJZSA-N 440.617 4.330 10 10 IICE O=C(NCc1c(O)cccc1F)c1nn(-c2ccc(Cl)cc2C(F)(F)F)cc1O 1471976231 UGMBKJLWKIZKQA-UHFFFAOYSA-N 429.757 4.025 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)CCOC(C)(C)C 1611963716 YKRVLNXDILYSFK-OAQYLSRUSA-N 429.609 4.194 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1613206627 IILUOPURVFNDBX-GCJKJVERSA-N 425.621 4.346 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H]3CCC[C@H]32)n1CCCSc1nccs1 1545892577 WPMQNPJNCSQTKA-DOTOQJQBSA-N 448.662 4.214 10 10 IICE CC[C@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1709258701 NAPUSUNIHIMIDY-MOPGFXCFSA-N 429.584 4.442 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1C1CCOCC1 1620753642 LNILVXPONJKAMP-SFHVURJKSA-N 447.526 4.457 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)c1 1625449833 VTKNFNRPFCAOPH-FQEVSTJZSA-N 444.940 4.131 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1624598760 QKKLJUGTEQXSFQ-SFHVURJKSA-N 427.545 4.232 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1cc(Cl)c(NC(=O)c2ccncc2)c(Cl)c1 1627743853 RYDWHDZZIMNHEA-UHFFFAOYSA-N 432.263 4.233 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cnn(Cc2ccccc2)c1Br 1625377448 SHEMLKHFLBWVSQ-UHFFFAOYSA-N 439.357 4.224 10 10 IICE CC(C)(CC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)CC(=O)c1ccccc1 1638688427 QTSSWYZCVCYFJZ-UHFFFAOYSA-N 430.495 4.107 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)c(C)n1-c1cccc(Cl)c1 1636342937 SUUKPXQKWOGESP-IBGZPJMESA-N 428.964 4.158 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)c1 1636061005 BIMDWZBXZWCPCD-LBPRGKRZSA-N 429.879 4.359 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1565305232 LMHLDVKSNCXHRY-VWPQPMDRSA-N 442.604 4.216 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)N(C)C)c1 1637243695 GQWMPNSYWADNSW-GOSISDBHSA-N 438.549 4.046 10 10 IICE COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1648478400 FCFIASSNHVYSFG-SJORKVTESA-N 442.515 4.457 10 10 IICE Cc1cc(C(=O)N2CCN3CC(F)(F)C[C@H]3C2)c(C)n1-c1ccc(Br)cc1 1640003441 MJHSVWUZBNXCDD-KRWDZBQOSA-N 438.316 4.022 10 10 IICE Cc1cc(C(=O)N2CCO[C@](C)(C(F)F)C2)c(C)n1-c1ccc(Br)cc1 1646124402 SJKKAXYYJCFVPZ-IBGZPJMESA-N 427.289 4.353 10 10 IICE CCOC(=O)c1c(NC(=O)Cn2c3ccccc3c(=O)n2C)sc(C)c1-c1ccccc1 1644171681 HKOHWSSUHKVOCV-UHFFFAOYSA-N 449.532 4.192 10 10 IICE Cc1cc(C(=O)COc2ccc3c(c2)CCNC3=O)c(C)n1-c1ccc(F)c(Cl)c1 1641184188 KHPDQFWGLVVISV-UHFFFAOYSA-N 426.875 4.434 10 10 IICE Cc1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1F 1585074095 OEAZOXKPNJERMM-WOJGMQOQSA-N 432.517 4.181 10 10 IICE COc1ccc(N(CC(=O)N2c3ccccc3NC(=O)C2(C)C)Cc2ccco2)cc1F 1653582172 NLYVLYYXDXBCFZ-UHFFFAOYSA-N 437.471 4.198 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Cl)c(C(F)(F)F)c1 1584515670 WWPAEPVIRMEVBR-UHFFFAOYSA-N 434.792 4.404 10 10 IICE Cc1cc(CCNC(=O)N(C)C[C@H]2CN(c3ccccc3)C(=O)O2)c(C)n1-c1ccccc1 1674930598 ZFTHARVSBGGPTG-DEOSSOPVSA-N 446.551 4.303 10 10 IICE CC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)CC1 1760606313 IGUSRGBXQIGCPH-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1C[C@@H]1CCCO[C@@H]1C(C)(C)C 1768681478 KDGVRWTZNCMJBP-VWPQPMDRSA-N 442.604 4.355 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)c2C)c1 1680639428 WPJBKNDFRJVWJK-QGZVFWFLSA-N 428.577 4.363 10 10 IICE COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1682097277 OXEZSLOFYXLIPZ-YKSBVNFPSA-N 439.600 4.391 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)C2CCC2)cc1 1687757847 ZCRFQQODGRYMJX-VWLOTQADSA-N 437.584 4.245 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H](C)C3)n2CCCSc2nccs2)n1 1693433126 NURPSVUVLRISIF-HNNXBMFYSA-N 431.635 4.015 10 10 IICE CC(C)CCN1C(=O)/C(=C\c2cc3ccccc3nc2N2CCOCC2)SC1=S 208277956 KZBBFWMXFTWVEG-XMHGGMMESA-N 427.595 4.319 10 10 IICE CC(=O)N1CCCc2cc(S(=O)(=O)N3CCn4c5c(c6ccccc64)CCC[C@@H]53)ccc21 1858183491 FBWJEVUMAIGMOC-DEOSSOPVSA-N 449.576 4.022 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)c1 1860085504 OJXJZPUMBUEESO-FRKPEAEDSA-N 433.894 4.261 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@H](NCc1cc(Br)cc(F)c1O)C2 2234536878 OUCWRXNCLXMEIM-GDZNZVCISA-N 443.357 4.419 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)c1O 2236051449 SVBKTBKAXZUKPT-KSZLIROESA-N 431.374 4.306 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@H](C)N(C(=O)OC(C)(C)C)C2)c1O 2227748509 AWLCMEHCNSAIOL-STQMWFEESA-N 429.355 4.041 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)NCCc1ccccc1 2296755485 CSKMFDRBUYGIMX-UHFFFAOYSA-N 430.982 4.290 10 10 IICE COc1cccc(C=C2SC(=S)N(CCCC(=O)Nc3nc(C)cs3)C2=O)c1 2297477240 HVZIRDAKUXULTC-UHFFFAOYSA-N 433.580 4.080 10 10 IICE CCN(CC)c1ccc(C=C2SC(=O)N(CNc3ccc(C(=O)OC)cc3)C2=O)cc1 2313507512 QSASDTFUNWIKTQ-UHFFFAOYSA-N 439.537 4.425 10 10 IICE CCC[C@@H](CC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2352638548 XCBQRDPUULHSJZ-AWEZNQCLSA-N 429.355 4.163 10 10 IICE CCn1cc(CN2CCC(C(=O)NCc3ccc(N(C)C)cc3)CC2)c2cc(OC)ccc21 64669640 WRQOSGRJKQOYMS-UHFFFAOYSA-N 448.611 4.264 10 10 IICE CCCOc1c(Cl)cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OCC 104673536 WTYKWWFRGDKVCL-UHFFFAOYSA-N 432.948 4.499 10 10 IICE O=C(/C=C\c1ccc(Br)o1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566625 WVLALAGTMGHQBO-VURMDHGXSA-N 441.272 4.442 10 10 IICE CC[S@](=O)CCNC(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 735108820 DLOQCVCIDJXGIS-PBYQXAPXSA-N 441.519 4.250 10 10 IICE CC(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)cc1Cl 748091815 LGWSMYJOYPOTST-UHFFFAOYSA-N 433.942 4.321 10 10 IICE Cc1nccn1-c1ccc([C@H](C)NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 754925988 MFIRQXCKOMKUDM-MBSDFSHPSA-N 434.540 4.338 10 10 IICE CC(C)Cn1ncc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C(C)C 766521284 HLBMJEYRLXXCSE-UHFFFAOYSA-N 431.556 4.084 10 10 IICE Cc1nc(F)ccc1/C=C1/SC(=S)N(C2CCN(Cc3ccccc3)CC2)C1=O 779203526 JGKMLNRHKLDXMC-CPNJWEJPSA-N 427.570 4.395 10 10 IICE C[C@@H]1[C@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C[C@H]1c1ccccc1 783657587 ZYSFGWYDPWDYLG-BPUDTRNYSA-N 431.559 4.224 10 10 IICE C[C@@H](NC(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1)c1ccc(N(C)C)cc1 787535365 VQKDCSKJRBTRST-OAHLLOKOSA-N 429.590 4.248 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CO[C@@H]3CCCc4ccccc43)cc2F)C[C@@H](C)O1 797436809 PHRYRZBYVKDTDJ-QZTZHPFYSA-N 426.532 4.150 10 10 IICE COc1ccc(-c2cnc(CCC(=O)NCc3cc(Br)ccc3O)o2)cc1 804734050 AXIOKSJPGVIYDN-UHFFFAOYSA-N 431.286 4.067 10 10 IICE C[C@@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1cc(Br)ccc1O 809712814 FPXKPFSOJDDWHE-ZDUSSCGKSA-N 446.345 4.010 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(n1)CN(C(=O)OC(C)(C)C)CC2 1136429044 XBXVKKAATSXJBJ-UHFFFAOYSA-N 438.572 4.103 10 10 IICE CCC1(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CCN(C(=O)c2ccccc2)CC1 1142418187 AVAZOVRRLOQLNV-OAQYLSRUSA-N 435.612 4.441 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)cc1 1144705242 YFIOLRMWNSTMLH-UHFFFAOYSA-N 445.479 4.393 10 10 IICE COc1ccc(C(=O)N2CCC[C@@H](C(=O)N[C@@H](C)c3ccccc3O)C2)c2ccccc12 1151892329 NVYWFGLWPIOZAW-ZWKOTPCHSA-N 432.520 4.284 10 10 IICE Cc1cc(CC(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C2)c(C)n1-c1ccccc1 1155303368 NBPBAIZAHFKBNC-OAQYLSRUSA-N 425.573 4.398 10 10 IICE CC(C)Oc1nc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccc1[N+](=O)[O-] 1162189808 IZKUISQFOQOSQK-UHFFFAOYSA-N 440.422 4.245 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1(C)CCN(C(=O)OC(C)(C)C)CC1 1251988221 HDVZVOMIWBQHAB-SFHVURJKSA-N 432.609 4.081 10 10 IICE C[C@@H]1[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)CCN1C(=O)OC(C)(C)C 1253802435 HJOFLCOEGPJNHK-APWZRJJASA-N 429.517 4.095 10 10 IICE C[C@@H](CNC(=O)OC(C)(C)C)Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C 1288720732 BZHPNFBMSJKFHZ-INIZCTEOSA-N 431.581 4.078 10 10 IICE Cc1ccc(C(=O)N2CCC(OC[C@H]3CCCCO3)CC2)cc1-n1c(C)cc(C=O)c1C 1294284874 QALRASLIHXVNBT-XMMPIXPASA-N 438.568 4.405 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1)OC 1305806291 FLIZDSKDEGJLFJ-FCHUYYIVSA-N 437.588 4.393 10 10 IICE CCOc1ccc(C2=CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CC2)cc1 1313410197 FIRUSYZLUHKGFC-RUZDIDTESA-N 436.600 4.253 10 10 IICE CCOCc1nnc(N2CCC(C(F)(F)F)CC2)n1CCCSc1nccs1 1314336568 PNMALAFSQLYMIQ-UHFFFAOYSA-N 435.541 4.232 10 10 IICE Cc1cc(N2CCC[C@H](NC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)C2)n(C)n1 1324667915 UUTXXZKCAOQDPO-SFHVURJKSA-N 425.964 4.188 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@H](C(=O)OC)Oc2ccccc21 1349686225 SHXABHCWOYRKCA-CHHLAKQQSA-N 432.476 4.004 10 10 IICE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1352744435 NYCMJQWRJCRYMM-MRXNPFEDSA-N 436.581 4.214 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CCC(C(C)C)CC1 1361098578 WBUPCPWCUJJUEH-QFIPXVFZSA-N 425.621 4.467 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(C(=O)c3ccco3)c2)cc1 1442609957 DFVQSAQLJOLTGW-QHCPKHFHSA-N 432.520 4.398 10 10 IICE COc1ccc(/C=C(/C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1F 1445887965 WKIBBNHKHSYGLU-DQXUBXGMSA-N 432.923 4.377 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c1 1448628820 IEEFJMYYUJAFIL-GOSISDBHSA-N 430.470 4.401 10 10 IICE Cc1ccc(C(=O)NC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)c(O)c1O 1465273607 PLQMGUJMGOPAQS-UHFFFAOYSA-N 433.504 4.421 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4oc(=O)n(C)c4c3)cc2Cl)C1 1469960552 QBSUMSWFPAIMBX-OAHLLOKOSA-N 442.947 4.021 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccnc(N4CCSCC4)c3)c2C)c1 1470949057 IRSYNIVBLKQFBT-UHFFFAOYSA-N 449.624 4.350 10 10 IICE Cc1ccc(CN2CC[C@H](NC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 1478566408 MUJZDGCMQHEZNM-VWLOTQADSA-N 444.579 4.311 10 10 IICE Cc1ccc([C@H]2CSCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1479534807 OSBUMGIFCGIIOL-DHIUTWEWSA-N 426.630 4.163 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1499751957 OZMLOBSZVCXZCZ-OAQYLSRUSA-N 443.661 4.083 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1504028507 NAQROAKPGNRDBE-VWLOTQADSA-N 425.621 4.303 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCOCC(F)(F)C(F)(F)F)cc1 1524937446 PSLGCICDMVMZLM-UHFFFAOYSA-N 434.405 4.479 10 10 IICE Cc1cc(O[C@H](C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1C(C)C 1527858661 XXKYZUUGUNCUTQ-QGZVFWFLSA-N 432.511 4.317 10 10 IICE CS(C)(=O)=Nc1ccccc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1528583676 PNESPRCDVJZEPZ-UHFFFAOYSA-N 437.512 4.046 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)CCCC1 1534242002 JRDQODINYHPSEM-UZLBHIALSA-N 441.572 4.043 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1 1536549151 BMEUMNQHBVQDOC-QYFOZDBKSA-N 433.596 4.060 10 10 IICE CCCN(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H](CC)c1ccccc1 1544179876 JPTFHSZFAXOILQ-SSVKHQHASA-N 449.595 4.290 10 10 IICE CCOCc1nnc(N2CCC(C(F)(F)F)CC2)n1Cc1ccc(N(C)C)cc1C 1548113066 REYULCYVNNWHNY-UHFFFAOYSA-N 425.499 4.016 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@H](O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cn1 1566326067 YFJHRHYEFCKPPY-XCLFUZPHSA-N 446.320 4.243 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(F)cc(Br)c1C 1566849292 JFBLERJAJFGOMS-UHFFFAOYSA-N 444.684 4.071 10 10 IICE Cc1cc(C(=O)NC[C@]2(OC(C)C)CCOC2)c(C)n1-c1cccc(Br)c1 1597066759 VYMSJMCHUKXDRI-OAQYLSRUSA-N 435.362 4.171 10 10 IICE O=C(Nc1nc2c(s1)CCCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1603527798 JFPIPZWTNPGAKI-UHFFFAOYSA-N 449.579 4.232 10 10 IICE Cc1csc(CN(C)c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)c1 1612367959 DCWPJGVRZBYAPR-SFHVURJKSA-N 443.592 4.432 10 10 IICE CCCCC[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)(C)C 1617322945 NVTKLSVRRJXAET-JXVRESAISA-N 429.605 4.011 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)OC(C)(C)C)C[C@@H]2c2cccnc2)c1O 1617538495 BRVYRJCAEQBOPD-HXUWFJFHSA-N 445.947 4.437 10 10 IICE C[C@]1(CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1(F)F 1618062404 NOVLCKNZCNGUNE-QFSNBGPKSA-N 430.567 4.281 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)CCCC1 1618658106 NZJRZIPOVMOODA-QHCPKHFHSA-N 446.469 4.095 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@]1(C)C[C@@H](NC(=O)OC(C)(C)C)CCO1 1624553760 DJDAMVDVGGXMIW-CPJSRVTESA-N 445.604 4.098 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(O[C@H]2CC2(F)F)cc1 1626511025 DRYVTCMTDYKDSK-QFIPXVFZSA-N 446.494 4.475 10 10 IICE Cc1cc(C(F)(F)F)n2nc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)cc2n1 1628608887 OXRMHOAOWLJCJD-UHFFFAOYSA-N 431.462 4.223 10 10 IICE Cc1ccnc(Oc2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2)c1 1629962832 FZSIJAIXRSBZFW-UHFFFAOYSA-N 435.499 4.213 10 10 IICE COc1ccc(-n2cc(CNC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)nn2)cc1 1631083475 VHOCIDHXVMEPSQ-UHFFFAOYSA-N 429.524 4.230 10 10 IICE CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@@H](C)c1ccccc1O 1632250031 INVKSLZVFOCVGU-SJCJKPOMSA-N 441.380 4.428 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccc1OCc1cn2cc(C)ccc2n1 1640259884 HZEZNKYVFVVTSX-UHFFFAOYSA-N 436.508 4.343 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)CN(C)c3ccc(-c4nccs4)cc3)cc2)C[C@@H](C)O1 1643359737 BAQRQCYRPYLPRT-HDICACEKSA-N 436.581 4.499 10 10 IICE CCn1c(O)nnc1SCC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1651607072 OVADUWJIFJGEOC-UHFFFAOYSA-N 435.347 4.149 10 10 IICE OC1CCN(c2ccc(CNc3ncc(Br)cc3C(F)(F)F)cc2)CC1 1652073827 SRMGUFSFIYCPEU-UHFFFAOYSA-N 430.268 4.436 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2c(Cl)cccc2Cl)CC1 1682986693 MCNZMNDTFDULGO-UHFFFAOYSA-N 434.367 4.443 10 10 IICE CCO[C@@H]1C[C@H](N(C)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C12CCCCC2 1685681202 BZKWKWIIJGVHKO-RJGXRXQPSA-N 430.637 4.125 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1692986065 PZFLRKJFHYRTQB-MOPGFXCFSA-N 448.615 4.360 10 10 IICE CCc1cnc(Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)s1 1694566053 HCLYVDZZXIGVBI-UHFFFAOYSA-N 440.617 4.194 10 10 IICE CC(C)Cc1nnc(N(C)[C@H]2CCSC2)n1Cc1ccc(N2CCSCC2)cc1 1723265975 AXHZAOIJYJGUFM-FQEVSTJZSA-N 431.675 4.020 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1 1728382095 XNUXFVGSGAGQKJ-QHCPKHFHSA-N 448.615 4.486 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1746094592 WGRYMMMBKDCQRT-QHCPKHFHSA-N 448.615 4.020 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCCCS1 1747030320 RPPULOKIPPMMKF-OAQYLSRUSA-N 429.634 4.337 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CCS1 1765264520 MXMPMNGIHGVEAV-OAQYLSRUSA-N 436.629 4.403 10 10 IICE CCOCc1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1767902144 ZBGJWOUDFWORLX-IBGZPJMESA-N 429.634 4.043 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@H](C)C1 1768082715 FJECPDCVKHATRX-WOJBJXKFSA-N 437.588 4.393 10 10 IICE CCCOc1cccc(/C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)c1 1858594066 JRVUFIJBGXUVJV-OGBKAESYSA-N 427.547 4.373 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Oc1ccc(CNC(=O)C2CC2)cc1 1858893247 QXOGPAOOTCGTGY-UHFFFAOYSA-N 440.455 4.099 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1/C(=O)N(c2ccc(Br)cc2)N=C1C 1865678441 MJJHZJAWPXLZOB-CXUHLZMHSA-N 431.286 4.281 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)ccc1O 1951869208 QWKXHXHBGSGAFM-RUZDIDTESA-N 433.460 4.326 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@@H](CCNC(=O)OC(C)(C)C)C2)c1O 2236056173 UOPSYWCOXLEHJG-KBPBESRZSA-N 443.382 4.336 10 10 IICE CCOc1c(Cl)cc(C=C2C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)cc1Cl 2297560522 KXCKXGRPLFBDQN-UHFFFAOYSA-N 439.295 4.363 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(c2ccc(C(=O)O)cc2)C1=O)C(=O)O 2314928550 XXWPYRDFHUCDNM-HNNXBMFYSA-N 443.502 4.033 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccc(O)cc3)C2=O)cc1OC)C(=O)O 2314930935 BCFBJBFWSYSAGU-OAHLLOKOSA-N 445.518 4.049 10 10 IICE COc1cc(C=C2C(=O)N(Cc3ccc(Cl)cc3)N=C2C(F)(F)F)cc(OC)c1O 2332147564 LFSNFNPOXKFVJF-UHFFFAOYSA-N 440.805 4.407 10 10 IICE CCOC(=O)COc1c(/C=C2/SC(=S)N(c3ccc(F)cc3)C2=O)cccc1OC 3000948 CTBLSTJIIGQJJA-GZTJUZNOSA-N 447.509 4.182 10 10 IICE COc1ccc(N2CCN([C@H](c3cccs3)[C@@H](C)NC(=O)c3ccco3)CC2)cc1 4057490 YALGGFXFIBVQKV-VGSWGCGISA-N 425.554 4.032 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14470802 FRVPGFYRPRNZIK-SXGZJXTBSA-N 433.917 4.325 10 10 IICE Cc1cc(C)c2c(N)c(C(=O)O[C@H](C)C(=O)N3CCSc4ccccc43)sc2n1 28776221 GKWNWQVMIOCVDO-CYBMUJFWSA-N 427.551 4.180 10 10 IICE CCCN1C(=O)/C(=C\c2c(Oc3ccccc3F)nc3ccccn3c2=O)SC1=S 39835688 LSJVMZYRHHWCEU-FOWTUZBSSA-N 441.509 4.237 10 10 IICE O=C1N=C(N2CCN(Cc3ccc(F)cc3)CC2)S/C1=C\c1ccc(OC(F)F)cc1 96577736 IZRARXWSSDNCHD-UYRXBGFRSA-N 447.482 4.215 10 10 IICE CCN(C)C(=O)c1cccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c1 729127233 KOCJWTYXIRAFHG-UHFFFAOYSA-N 436.483 4.365 10 10 IICE CC(C)[C@H](NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2)C(N)=O 730509228 RNEQTYXSCBKGFP-UFIOJNINSA-N 442.563 4.027 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2[C@H]3CC[C@H]2CC(O)C3)sc(C)c1-c1ccccc1 732214163 XYISQDDIHSLXJN-ROUUACIJSA-N 442.581 4.217 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc(SC)cc3)cs2)cc1 733730609 AMKXHGXTHGAQDK-UHFFFAOYSA-N 434.564 4.048 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@@H]2[C@@H]2CNC(=O)C2)c(C)n1-c1cccc(C(F)(F)F)c1 764462144 JYVDRRNDXAZNAA-LAUBAEHRSA-N 447.501 4.286 10 10 IICE O=C([C@H]1CCn2c(cnc2C2CCCCC2)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 777808462 BMXMLTWKWVLRSD-NZQKXSOJSA-N 437.584 4.407 10 10 IICE Cc1nc2c(s1)[C@H](NC(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CCC2 780833979 IRBXZQMLPVWBEC-RDTXWAMCSA-N 436.528 4.399 10 10 IICE C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 792034356 YOSALVKNWKGTCN-DOMZBBRYSA-N 439.400 4.024 10 10 IICE O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)N(Cc1ccccc1O)C[C@@H]1CCCO1 798114803 IBRFZFXSXPBMAR-UHOSZYNNSA-N 432.467 4.240 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cc3ccc4n[nH]cc4c3)no2)C1 809496038 DMCVGYGGDYZKIW-UHFFFAOYSA-N 426.524 4.306 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)O[C@H]1CCc2cccnc21 1128192887 DTKAURGKQXRPGE-BQGMYUGNSA-N 428.510 4.043 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H](c1ccncc1)C1CC1 1134646887 YJMISSJRBZBBRP-XEYRCQSKSA-N 443.619 4.392 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnnn2-c2c(Cl)cccc2Cl)cc1F 1136729879 SSOSIIMPQZACMS-UHFFFAOYSA-N 436.318 4.489 10 10 IICE Cc1cc(C(=O)N[C@@H](CCO)c2ccccc2F)c(C)n1-c1ccc(Br)cn1 1143073965 KYTJDAJAUIVYRM-IBGZPJMESA-N 446.320 4.244 10 10 IICE Cc1cccc([C@@H](CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)NC(N)=O)c1 1155727412 RDFPRQSPKSFNOE-DYESRHJHSA-N 442.991 4.301 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])cc2F)C[C@H](C)O1 1264689482 VXLWFAGIKKHINF-GJZGRUSLSA-N 449.910 4.250 10 10 IICE C[C@H](NC(=O)c1ccc(-c2cccc(Cl)c2)nc1O)c1ccc(N2CCOCC2)cc1 1264822554 WEZBSZMTXBGOJH-INIZCTEOSA-N 437.927 4.435 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@H]1CCC[C@H](OC)C1 1277969460 CGVWMKYOIYADMI-JWNTYJGQSA-N 446.975 4.153 10 10 IICE C[C@H](CCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N1CCCCC1 1288567430 VCHRHRAGFVCLAD-DENIHFKCSA-N 427.593 4.126 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1c2ccccc2CCN1C(=O)OC(C)(C)C 1297563115 XHKXJZOONRPBCR-FQEVSTJZSA-N 431.529 4.029 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1315768571 XOKBOIXFEBFZNU-LJQANCHMSA-N 437.588 4.250 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1ccc2c(c1)CCC2 1350595662 ZSUHZWJCQACUAJ-MOSHPQCFSA-N 440.565 4.222 10 10 IICE Cc1cccc(NC[C@H]2CCCN2C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n1 1443882104 XJOLDSWBGKNGEC-XMMPIXPASA-N 430.552 4.256 10 10 IICE COC(=O)c1ccccc1CC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 1464954413 GKBFNQGDIDCABO-UHFFFAOYSA-N 432.520 4.324 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)cc1 1479217570 WCZLWXJZXJLHJO-HNNXBMFYSA-N 425.451 4.433 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1501839446 RORPHEQYZRTOLW-XMMPIXPASA-N 448.615 4.404 10 10 IICE C[C@H](CN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1509997157 APFUTOSBQXJXFB-OAHLLOKOSA-N 439.564 4.223 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CC=C(COC)CC2)cc1 1515534321 ZCCNIDXJTILCKO-HSZRJFAPSA-N 439.604 4.197 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@@H]3C[C@@H](C)c4c(C)cccc43)CC2)cc1 1531524601 NYCAPEOUVCDDPR-YADHBBJMSA-N 435.612 4.313 10 10 IICE COc1cc(Br)c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1OC 1531693565 LGDQISLLJWICIQ-UHFFFAOYSA-N 433.346 4.339 10 10 IICE Cc1cnc(C(C)(C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1532433515 KOKIWHKTVXAYOY-XNTDXEJSSA-N 449.598 4.233 10 10 IICE CC1(C)[C@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1(F)F 1533331764 CYCCXGPIPIAKEB-SRXBQZRASA-N 430.567 4.137 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2cnc3ccccc3n2)C1 1535503738 XVHDMADKSNSKFS-HHNLSAEISA-N 444.535 4.373 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(Br)ccc1C1CC1 1539301700 FJQCEKCMTZYZLF-UHFFFAOYSA-N 429.358 4.435 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@H]1c1ccccc1 1540812608 NOWWZBVWZGFMPV-OWBBTNHHSA-N 426.538 4.391 10 10 IICE CC(C)c1nnc(N2CCN(C3CCCCC3)C(=O)C2)n1CCCSc1nccs1 1541364804 XHWFVJWWZAPACB-UHFFFAOYSA-N 448.662 4.022 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N(C)CCCc1ccccn1 1542226969 OGBTWMOVIZLROM-UHFFFAOYSA-N 429.572 4.160 10 10 IICE CC[C@@H]1NC(=O)N(c2cccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)c2)C1=O 1542525481 KCFMILVXKMHAKL-QFIPXVFZSA-N 430.508 4.110 10 10 IICE CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1544721634 UKXRHTITNKGQHC-ZPZUNKDASA-N 427.633 4.209 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3c(C)nn(-c4ccc(Cl)cc4)c3C)CC2)cc1 1544743039 AUSXLGFMJSJCIT-UHFFFAOYSA-N 438.959 4.042 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC[C@@H](N3CCCC3)C2)cc1 1547447530 YUZMQZWRHDSSHJ-XMMPIXPASA-N 438.664 4.436 10 10 IICE C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1560119736 RBKVYKQKIUUXKR-HUUCEWRRSA-N 443.459 4.048 10 10 IICE C[C@@H](NC(=O)N(C)C[C@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc(N(C)C)cc1 1564597377 LNPPIXDUVKUWBA-KUHUBIRLSA-N 440.371 4.202 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCCNC(=O)/C=C/c3ccccc3)c2C)c1 1564646588 JWHAIWIIZPDXIU-BUHFOSPRSA-N 444.579 4.421 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](CCc1ccccc1)c1ccccn1 1565127002 HSKWPLARTUWPNL-SANMLTNESA-N 444.579 4.216 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(OCc4nnc(C)o4)cc3)ccc21 1565632392 YLVSPNAZPKHOMW-UHFFFAOYSA-N 434.496 4.427 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(C(F)(F)F)c1O 1566154697 GOLLYEGPPQXWQT-GFCCVEGCSA-N 430.373 4.411 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Br)c(Cl)c1F 1585535939 JBZLTYQJDOFJQL-UHFFFAOYSA-N 441.728 4.133 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc([C@H]4CCC(=O)N4)cc3)cc2Cl)C1 1586083178 XALSSKDIJHIARK-IIBYNOLFSA-N 425.960 4.457 10 10 IICE CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)NCc2cccc(Cl)c2O)CC1 1606860837 VVZDOPIMKORIMD-UHFFFAOYSA-N 433.936 4.349 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCCCCC(=O)OC(C)(C)C)cc1 1611521538 FRBHOAZSXKLRFM-UHFFFAOYSA-N 426.557 4.467 10 10 IICE CN(C)c1ccc([C@H](CNc2c(F)c(F)nc(F)c2F)NC(=O)OC(C)(C)C)cc1 1612344784 AYXCWCSAWGQLOD-ZDUSSCGKSA-N 428.430 4.382 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(c4cccc(F)c4)CCCCC3)cc2)CC1 1616600808 VASDLBYMMAZSRW-UHFFFAOYSA-N 437.559 4.046 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2cccc(F)c2)c(C)n1-c1cccc(Br)c1 1625147710 GQDOGVVVVPIGRI-FQEVSTJZSA-N 445.332 4.329 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C/C(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)C1 1633402156 UCHLJLXMIIWLRZ-KQPPXVQYSA-N 429.517 4.467 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1Br 1634423802 LZEHFNQHCTXQOA-UHFFFAOYSA-N 449.364 4.405 10 10 IICE COc1cccc(OCCN2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)c1 1636875575 LHLUHYFYENCLBL-UHFFFAOYSA-N 447.579 4.248 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccccc1 1637410253 JXOSPVDKURRMMH-XMMPIXPASA-N 448.542 4.223 10 10 IICE CC(C)N(CC(F)(F)F)C(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1644790064 RAPSUYCKKQTVOO-UHFFFAOYSA-N 428.476 4.325 10 10 IICE COC1CCN(c2ccc(CN(CCO)Cc3cc(Br)cs3)cc2)CC1 1645266763 XLUFAMVVLVPGCQ-UHFFFAOYSA-N 439.419 4.120 10 10 IICE CC(C)(C)c1ccc(CSCC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1646436328 ZEVARDOTHABGIN-UHFFFAOYSA-N 426.626 4.495 10 10 IICE COC(=O)c1cc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)on1 1654252803 BYBFACYEHNVTFT-MRXNPFEDSA-N 447.413 4.387 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(CCc3ccccc3)Cc3cccnc3)C2)cc1 1673823634 XNAPJNIFFLACDY-DEOSSOPVSA-N 444.579 4.371 10 10 IICE C[C@@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1cccc(OC(F)(F)F)c1 1685090944 OJJJDEUVTQEVCO-QRWLVFNGSA-N 438.494 4.314 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)Cc1cccs1 1707304801 GDTFZTZZQUXUKC-UHFFFAOYSA-N 432.597 4.385 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(C)n(C)c1=O 1709683001 VKSLUWGASKLTRE-UHFFFAOYSA-N 444.583 4.254 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CCC[C@@H](C)C2)cc1 1746093786 OTTAFEWIOMHTKC-LJQANCHMSA-N 435.620 4.271 10 10 IICE CCC[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CCO1 1765652642 YMBWJELBYWUDHZ-JOCHJYFZSA-N 439.629 4.358 10 10 IICE CCOCc1nnc(N2CCSC(CC)(CC)C2)n1Cc1ccc(N(C)C)cc1C 1767981946 ZOSUNNVHPAGJSZ-UHFFFAOYSA-N 431.650 4.349 10 10 IICE O=C(CNCc1ccc(C(F)(F)F)cc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1860717396 KKEKFMXETVGJIW-UHFFFAOYSA-N 438.405 4.209 10 10 IICE CN(C)c1ccc([C@H](NC(=O)CCc2ccc(-c3cccnc3)cc2)c2nccn2C)cc1 1866179809 IAPZDMJLLQSWRC-SANMLTNESA-N 439.563 4.387 10 10 IICE O=C(CCCc1ccc2c(c1)OCCO2)Nc1cccc2c1C(=O)c1ccccc1C2=O 1868167754 ABJZAYACXHZGTD-UHFFFAOYSA-N 427.456 4.195 10 10 IICE CCOCCCN1C(=O)C(NC2CCCC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165645 OFTQNBNJCRWRSE-UHFFFAOYSA-N 435.568 4.133 10 10 IICE CCN(C[C@@H](C)NC(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044743308 LXPHGDJPFDKOFT-MRXNPFEDSA-N 448.608 4.302 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NCc2cc(Cl)cc(Br)c2O)C[C@@H](F)C1 2219144597 QULYZCLDFMSRKE-OLZOCXBDSA-N 437.737 4.245 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@@H](NCc1ccc(Br)cc1O)C2 2232283478 VYKHRTFLUYPQQU-OSMBCOQSSA-N 425.367 4.326 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)Nc1ccccc1C(=O)O 2296881500 KTOBBCXQKIATEY-UHFFFAOYSA-N 444.509 4.144 10 10 IICE CC(=O)c1ccc(NC(=O)CCN2C(=O)C(=Cc3ccccc3F)SC2=S)cc1 2296885164 GQPNCJBZMSJBPG-UHFFFAOYSA-N 428.510 4.258 10 10 IICE COC(=O)C1=C(C)N(CC(C)C)C(=O)C1=Cc1ccc(OCC(=O)Nc2ccccc2)cc1 2297309752 NLDUHQJCATUCEO-UHFFFAOYSA-N 448.519 4.033 10 10 IICE COc1cccc(C(=O)Oc2ccc(C=C3C(=N)N4OC(C)=CC4=NC3=O)cc2Cl)c1 2297347717 WPHJPIWKQQGFNJ-UHFFFAOYSA-N 437.839 4.018 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=Cc1cccn1-c1ccc(Cl)cc1 2313564835 AWHYCUISUFJWDV-UHFFFAOYSA-N 426.259 4.451 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C=C3C(=O)NC(=O)N(Cc4ccccc4)C3=O)c2C)c1 2313631645 UHGBXVMMSOOKSU-UHFFFAOYSA-N 427.504 4.373 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CCOc3ccc(OC)cc3)C2=O)cc1OC 2323719386 OBINWMGDNBAAMI-UHFFFAOYSA-N 445.562 4.383 10 10 IICE Cc1nc2scc(C)n2c1C=C1SC(=S)N(Cc2ccc3c(c2)OCO3)C1=O 2323756669 SHEKPZSSXQPJHG-UHFFFAOYSA-N 429.548 4.143 10 10 IICE CC[C@@H](NC[C@@H]1[C@@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2333093371 YZEGDZOJHWIRRX-BASLNEPJSA-N 425.367 4.451 10 10 IICE CC[C@@H](CCC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2352948747 UBAIHXQVLRXWBJ-AWEZNQCLSA-N 429.355 4.163 10 10 IICE CCC[C@H](C(=O)N(C)Cc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2380790051 OESZOENLKHTWMG-OAHLLOKOSA-N 443.382 4.457 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)c(O)c1Br 2381132513 BRKJPPHCIIMTEN-OAHLLOKOSA-N 443.382 4.266 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1ccccc1 13343480 MWNPMLJWFQNOJV-UYRXBGFRSA-N 443.546 4.340 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)cc(Br)c1O 13914307 SYSVZFJWBHFZLC-NVNXTCNLSA-N 445.269 4.058 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1c[nH]c3ccccc13)N2 14545098 BMMHOFXNJOFTPA-CGOGLYEHSA-N 449.576 4.452 10 10 IICE COc1ccc(O)c(C2=NN3[C@@H](C2)c2cccc(OC)c2O[C@@H]3c2ccc(OC)c(O)c2)c1 20071380 ORUDZAJOEHNUPV-UQBPGWFLSA-N 448.475 4.366 10 10 IICE CC(C)C1=NN2C(=N)/C(=C\c3cccc(OCCOc4ccccc4)c3)C(=O)N=C2S1 33417262 UILJCMZUADJGLZ-IJFTXDGJSA-N 434.521 4.420 10 10 IICE CCCN1C(=O)/C(=C\c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33459288 NRAXMVGCJXBUNK-DTQAZKPQSA-N 428.583 4.050 10 10 IICE CCCCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OC 35363639 LBOODZATKUSYRA-XMHGGMMESA-N 442.562 4.420 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H](C)Oc3ccc(Br)cc3)CC2)cc1 110357502 AJGDXUGDHVKLPH-OAHLLOKOSA-N 433.346 4.010 10 10 IICE COC(=O)c1cccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526470349 KDUOCCBXNZJHGU-JOCHJYFZSA-N 431.444 4.250 10 10 IICE COc1cc(N(C)CC(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)cc(OC)c1OC 741795207 HOXOTGMGRBAXFX-GFCCVEGCSA-N 427.328 4.333 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 764535890 HOVMQBGXFQWCSJ-DENIHFKCSA-N 444.620 4.464 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2noc(-c3ccccc3)n2)C1 766666225 NCWZDOGRMNNMLV-UHFFFAOYSA-N 430.508 4.201 10 10 IICE C[C@@H](NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccc(N(C)C)cc1 776110815 HZALYRRWZPHUQG-OAHLLOKOSA-N 435.494 4.196 10 10 IICE Cc1cccc2nc(C3CCN(C(=O)NCc4ccc(N5CCOCC5)cc4)CC3)oc12 780330253 YFDRAIRLVVOQJC-UHFFFAOYSA-N 434.540 4.062 10 10 IICE CCNC(=O)C[C@@H]1CCCCN1Cc1c(O)ccc2c(=O)c(-c3ccccc3)c(C)oc12 789519576 LWCKCSXPILBCQR-IBGZPJMESA-N 434.536 4.355 10 10 IICE CCOC(=O)[C@@H]1CC[C@H](N[C@H](C)c2cc(Br)cc(Br)c2O)C1 798002482 IMTRJHUGGQDSDT-FOGDFJRCSA-N 435.156 4.300 10 10 IICE CCc1c(C(=O)NCc2ccc(N(CC)CC)cc2)nnn1-c1ccc(OC(C)C)cc1 1125166771 OHMITHWOSSESFL-UHFFFAOYSA-N 435.572 4.393 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccn(-c3cccc(C(F)(F)F)c3)n2)cc1 1130744855 JWCHFOWTTRMQSV-UHFFFAOYSA-N 432.446 4.108 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C)[C@H](n3ccnc3)C2)c(C)n1-c1ccc(Br)cn1 1137483954 JWOQHMOFHXJFDT-AUUYWEPGSA-N 442.361 4.171 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3cc(F)c(Br)cc3C2)c([N+](=O)[O-])c1 1187716093 HAQGAIVBGUDRTH-HYXAFXHYSA-N 435.249 4.245 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1cc(F)cc(F)c1 1194090479 IOANCHPXRSAEDZ-AWEZNQCLSA-N 434.442 4.199 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@@H]3CCN(c4ccccc4F)C3=O)c2C)c1 1234328768 YYCGZULQFKJDFH-XMMPIXPASA-N 448.542 4.489 10 10 IICE C[C@@H](CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1313356972 VZDWUUQFRQUDTC-KKSFZXQISA-N 447.421 4.221 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC2(C(F)(F)F)CC2)NC(=O)OC(C)(C)C)cc1 1322932702 QISLFTUFMJPZMI-MRXNPFEDSA-N 429.483 4.167 10 10 IICE CC(C)Cc1ccc(CCCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 1355064136 GYZRIDHCYVSYBA-XMMPIXPASA-N 435.612 4.226 10 10 IICE Cc1cc(-c2nnc(N3CCN(C)C(=O)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1361050017 RUVMCRVZSMUIIL-UHFFFAOYSA-N 434.588 4.067 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)Oc3ccccc3Cc3ccccc3)C2)cc1 1437573454 BSYDATJRSIGJJH-REWPJTCUSA-N 430.548 4.448 10 10 IICE CCCc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[nH]c(C)c1C(=O)OC 1444993333 ZTQOUMRWIHHJBV-OAHLLOKOSA-N 449.498 4.062 10 10 IICE Nc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880198 FUTCOJNLJNHUHU-OAHLLOKOSA-N 427.854 4.041 10 10 IICE CCOC(=O)COc1ccc(OC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cc1 1456899898 YDKZCQXGMUBZIV-UHFFFAOYSA-N 425.481 4.066 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1459467049 RJMZLRRLHBXPFU-UHFFFAOYSA-N 442.472 4.481 10 10 IICE Cc1cccc(NS(=O)(=O)c2cccc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)c2)c1 1467260038 OZWKFJUDVRPLED-GOSISDBHSA-N 437.565 4.353 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCN2C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1470176942 JRMXAKNFCQAZSG-IBGZPJMESA-N 445.405 4.388 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C)C1CCCC1 1501531669 FVFOTEVXHFZNLI-UHFFFAOYSA-N 434.588 4.210 10 10 IICE CCC(C)(C)Cn1c([C@@H]2CCCOC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1512637175 PWNYQAQKKPYBSM-GOSISDBHSA-N 445.583 4.083 10 10 IICE CCN(CC(C)C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1515460802 PGJMHRXXCUUYCK-OAQYLSRUSA-N 443.661 4.256 10 10 IICE Cc1ccc(Cl)c(O[C@@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1533992063 JNKVZGFJNZUAGH-IBGZPJMESA-N 442.003 4.264 10 10 IICE CCn1ncc2c(C(=O)N(C)CCN(C)c3ccc(OC)cc3)cc(-c3cccs3)nc21 1538160975 SSJAYXDPZHRISH-UHFFFAOYSA-N 449.580 4.397 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)CSc2nc(-c3cccc(OC)c3)no2)cc1 1539309021 XIKHLEPNVODSOS-UHFFFAOYSA-N 440.569 4.342 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC[C@@H](C[C@H]2CCOC2)C1 1542224352 DUCJGYUDACUELW-LEWJYISDSA-N 425.621 4.467 10 10 IICE Cc1ccc(C(=O)Nc2ccccc2N2CCC(O)CC2)cc1-n1c(C)cc(C=O)c1C 1543350470 ZYWHEZUQQVGOHD-UHFFFAOYSA-N 431.536 4.428 10 10 IICE O=C(NC[C@@H]1CCCc2ccccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1543369462 TXUBNASJJFMYRM-INIZCTEOSA-N 442.562 4.104 10 10 IICE CCOC(=O)[C@@H](C)C1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1558238218 RXMBOAGLSSPVNA-AWEZNQCLSA-N 433.346 4.128 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC2)CC1 1558641470 WGQFODLTUJWEDT-QRBZPYHOSA-N 444.572 4.387 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1559097518 BJUAGGPSQSVICC-KRWDZBQOSA-N 432.952 4.212 10 10 IICE COc1ccc(N(CC(=O)Nc2cc(C(F)(F)F)ccc2-n2cncn2)CC(C)C)cc1 1559920473 LSKAMLVSQRSQSM-UHFFFAOYSA-N 447.461 4.396 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H](O)CC23CCC3)sc(C)c1-c1ccccc1 1559925641 YMJYDDYODFEVEV-GOSISDBHSA-N 442.581 4.218 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1 1565702124 UWNGXTANLUQRDX-NRFANRHFSA-N 427.545 4.186 10 10 IICE CCNC(=O)NCc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1566164274 UKJCFTZZRWCFSQ-UHFFFAOYSA-N 432.524 4.286 10 10 IICE O=C(CCc1ccc(F)c2ccccc12)NCc1cc(F)c(N2CCOCC2)c(F)c1 1584515424 QZIXNVHAVHPMKT-UHFFFAOYSA-N 428.454 4.343 10 10 IICE COc1ccccc1Nc1nc2sc(C(=O)NCc3cccc(O)c3O)cc2s1 1593739471 OAUYDNYXIABGAO-UHFFFAOYSA-N 427.507 4.451 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCOC34CN(C(=O)OC(C)(C)C)C4)c2C)c1 1607742686 OTINZQROHGPMAW-UHFFFAOYSA-N 439.556 4.130 10 10 IICE CCn1cnnc1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)(C)C 1615742109 CXNHBSXVMNMIPH-UHFFFAOYSA-N 446.603 4.495 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1C 1618502183 YOHANQZTKPTHGO-PKOBYXMFSA-N 448.615 4.360 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)(C)C)C1 1620128852 FKARLNSMRIMTCP-OAQYLSRUSA-N 437.588 4.393 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1 1623877436 ZQWBLZWSZCQMJI-JOCHJYFZSA-N 435.572 4.495 10 10 IICE CCOC(=O)C(C)(C)c1csc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1629249888 MWIRTVLHRLWJRN-UHFFFAOYSA-N 439.537 4.456 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sc2cc(C)c(C)cc2c1C 1632355889 GIQNGIHVXAZQNH-KRWDZBQOSA-N 427.522 4.142 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2ccncc2Cl)c(C)n1-c1cccc(Cl)c1 1635602472 RQXZPZZLHSYEOF-MRXNPFEDSA-N 432.351 4.377 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](CO)c2ccc(Cl)cc2)CCCC1 1644849472 ILBRSXNHZDMZKY-KRWDZBQOSA-N 426.944 4.074 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCC[C@H]3c3ccccc3C(F)(F)F)nc12 1645315129 SQDHUWUAQLCBNK-MAUKXSAKSA-N 448.445 4.056 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N([C@@H](C)c4ccccc4)C3=O)c2C)c1 1652595849 QXWKVPIUBQGUJT-SFHVURJKSA-N 443.503 4.137 10 10 IICE COc1cc(N2CCN(CCn3ccc4cc(Cl)ccc43)CC2)cc(OC)c1OC 1653225598 BZDQRVAHRASPJJ-UHFFFAOYSA-N 429.948 4.143 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCCc1cccc2c1OC(F)(F)O2 1674536372 UHKWONRPQSOEDF-UHFFFAOYSA-N 431.483 4.383 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)C[C@H]3C)cc2Cl)C1 1682023196 BLXNMTKBSKZNIY-RBUKOAKNSA-N 442.007 4.392 10 10 IICE CCN1CCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)C[C@H]1C 1695882033 NXZKEKRGQWORQF-QGZVFWFLSA-N 434.679 4.180 10 10 IICE C#CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1C 1705525830 WFTAUJMYWMDCMD-UHFFFAOYSA-N 441.583 4.444 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H]2CSC)n1Cc1ccc(N2CCOCC2)cc1 1708505228 URVXMRFAANDJJE-WIYYLYMNSA-N 429.634 4.008 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@@H]2C)n1CCCSc1nccs1 1708723694 BMXKFPFBMIPHPU-CABCVRRESA-N 436.651 4.070 10 10 IICE C[C@@H]1CCC[C@@H](N(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1726519845 AHTFNOKOCKQGRY-HZPDHXFCSA-N 429.619 4.389 10 10 IICE C[C@H]1CCN(c2nnc(CCOc3ccccc3)n2CCCSc2nccs2)C1 1726622051 MUNUKXRKNAXYFN-KRWDZBQOSA-N 429.615 4.385 10 10 IICE COC[C@@H](C)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1730451522 SKIYOFLWCNPXQC-IBGZPJMESA-N 434.588 4.168 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)cc1C 1731107755 NSIJGTDSPDTTBH-ICSRJNTNSA-N 431.650 4.173 10 10 IICE Cc1ccccc1-c1nnc(N(C)Cc2cnn(C)c2)n1CCCSc1nccs1 1742383731 YKCLNBZTGYOFLL-UHFFFAOYSA-N 439.614 4.262 10 10 IICE CCc1nnc(N2CCC(Oc3cc(C)ccn3)CC2)n1CCCSc1nccs1 1744638725 JXOBROFPBPNQEM-UHFFFAOYSA-N 444.630 4.231 10 10 IICE CCOCc1nnc(N2CCC[C@H](C(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1747143454 OQUOKSZIGVWHQR-SFHVURJKSA-N 439.526 4.488 10 10 IICE O=C(O)CCc1sc(NS(=O)(=O)c2ccccc2Cl)nc1-c1cccs1 1858070659 ZQMBVQCQEYLZRG-UHFFFAOYSA-N 428.944 4.343 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(CNCc2c(O)cccc2Br)CC12CCC2 1966052487 FHQYGLDZGAPKGS-FQEVSTJZSA-N 425.367 4.329 10 10 IICE COc1ccc(O)c(Cn2nc(C3CC3)c(C(C)(C)C)c2I)c1 2079779612 BIYBIPIMRXHUGZ-UHFFFAOYSA-N 426.298 4.425 10 10 IICE NCc1ccc(N2CC[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(F)c1Br 2148937724 ZOTWUZFNMZEIRA-PKOBYXMFSA-N 432.381 4.395 10 10 IICE Cc1ccc(CNC(=O)[C@H](C)CCCNC(=O)OC(C)(C)C)c(O)c1Br 2352636813 NKOVPRIZSJMCNX-CYBMUJFWSA-N 429.355 4.020 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3cccc(C)c3)nc3c(C)cccn3c2=O)SC1=S 39835891 KCCOKCSTJLEKTK-SFQUDFHCSA-N 437.546 4.325 10 10 IICE CS(=O)(=O)c1ccc(-c2nc(CN(Cc3ccco3)Cc3ccccc3O)co2)cc1 761681850 YBKVUGNIJJJOIG-UHFFFAOYSA-N 438.505 4.246 10 10 IICE c1cc(OC[C@H]2CCCO2)ccc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768669899 JCIVLERBACCUDF-HHHXNRCGSA-N 435.612 4.066 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1ccc(OC(F)F)c([N+](=O)[O-])c1 781714919 BFDRHAJGLPABOX-UHFFFAOYSA-N 425.351 4.158 10 10 IICE Cc1cc(C(=O)O[C@@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)cnn1 786403213 VASMZGFFFLJTFT-HNNXBMFYSA-N 429.423 4.222 10 10 IICE Oc1ccc2c(n1)CCC[C@@H]2NCc1cc(Br)cc(Br)c1O 809729451 SUHJJRLKRFYZQE-ZDUSSCGKSA-N 428.124 4.185 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccc2Br)n1C[C@H]1CCOC1 812384392 MJTZLLDWJOTEAX-OAHLLOKOSA-N 443.345 4.086 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC(=O)NCc1cc(Cl)cc(Cl)c1O 813807873 FJQSMGWVWBLZKH-HNNXBMFYSA-N 444.359 4.288 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)cc1 918111529 NZXMQVLPZWZUBL-GOSISDBHSA-N 434.506 4.479 10 10 IICE O=C(COCc1cccc(Cl)c1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125131602 KJBXHOOHXQHBHZ-UHFFFAOYSA-N 442.865 4.028 10 10 IICE Cc1ccc(-n2nc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)cc2C)cc1 1125259276 ZFWAJRGTIHTYIV-OALUTQOASA-N 436.531 4.172 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](C)Cc3ccc(OC(F)(F)F)cc3)C2)cc1 1129992967 CSXGJTNGJDRPHL-WMZOPIPTSA-N 436.474 4.415 10 10 IICE CSCC1CCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC1 1134664421 VBQCIDPSHIOREB-SFQUDFHCSA-N 438.615 4.019 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCN(c2ccccc2Cl)C1 1150348980 UCQURSOWARCORI-QFBILLFUSA-N 448.394 4.306 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(-c2ccc(C)cc2)c1C 1156287001 JNAJGFMABAFKNJ-UHFFFAOYSA-N 448.567 4.491 10 10 IICE Cc1c(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cccc1S(=O)(=O)N(C)C 1161664989 PNCMQLUUDUWCBO-UHFFFAOYSA-N 429.517 4.044 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1ccc(Br)cc1Br 1162606989 DGWIQZDSDCMCNF-UHFFFAOYSA-N 436.103 4.395 10 10 IICE COc1ccc(N2CCN(c3ccnc(-c4ccc(Br)cc4)n3)CC2)cc1 1185746855 VXENSAYIUULILL-UHFFFAOYSA-N 425.330 4.241 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccccn3)noc2=O)c(C)n1-c1cccc(C(F)(F)F)c1 1188726690 VQJXQOAYNLZIFQ-UHFFFAOYSA-N 442.397 4.208 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](Oc3cccc(Cl)c3)C(C)C)cc2F)CC1 1265012226 SESXVYMLCXMLPD-HSZRJFAPSA-N 447.982 4.341 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1COCCO1 1293898805 IIGFIXFHALQRNF-AVRDEDQJSA-N 437.588 4.393 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H](C3CCC3)C2)c(C)n1-c1ccc(Br)cn1 1298480270 ZRPWLMHPGOCSLZ-QGZVFWFLSA-N 432.362 4.140 10 10 IICE C[C@@H](NC(=O)NCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 1313151047 GTHKKRUNNRFASH-MJGOQNOKSA-N 427.545 4.279 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc([C@H](C)NC(=O)OC(C)(C)C)cc3)CC2)cc1 1435578452 RPQYYAOGJBYJNR-SFHVURJKSA-N 439.556 4.243 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] 1441627239 AWFZWROOGWZBHG-UHFFFAOYSA-N 434.521 4.140 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4ccc(F)cc4)s3)CC2)cc1 1442467293 FMDUVKCBMUZGPX-UHFFFAOYSA-N 439.556 4.115 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@]3(C)CC(c4cccc(Cl)c4F)=NO3)C2)cc1 1452033510 UPVYCOKLYURBFD-NPMXOYFQSA-N 445.922 4.014 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3c(O)cccc3O)[C@@H]2c2cccs2)cc1 1456235789 OHDLEHYTWOQMMJ-GAJHUEQPSA-N 436.533 4.268 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(C(F)(F)F)no1 1461246804 VPTCVJYYEACWAJ-YRNVUSSQSA-N 445.419 4.063 10 10 IICE CN(CCOc1cccc(C(=O)NCc2ccc(N(C)C)c(F)c2)c1)C(=O)OC(C)(C)C 1464537774 AFBMUAUSCIPXAC-UHFFFAOYSA-N 445.535 4.067 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CO)c3ccc(Br)cc3)c2C)cc1 1468538661 ISRWRLZPTLSIFT-OAQYLSRUSA-N 443.341 4.329 10 10 IICE C[C@H]1C[C@@H](Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CCO1 1512023211 WPFKHLWNTQCCOJ-HOTGVXAUSA-N 427.936 4.151 10 10 IICE C[C@H](CCc1ccco1)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1524802690 DDGFHROWVCPAHU-QFGUUYLXSA-N 432.542 4.148 10 10 IICE CN(C)c1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc2ccccc12 1531501410 BGEJFSJKIOUPRR-MRXNPFEDSA-N 440.494 4.301 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C(F)(F)F)ccc3Br)C2)cc1 1532107020 UKEPAGNHFYOQSK-CYBMUJFWSA-N 443.263 4.485 10 10 IICE CCN(CC)[C@@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccccc1 1539581342 DFCNBMUEVBDEPY-DENIHFKCSA-N 431.527 4.456 10 10 IICE Cc1ccc([C@@H]2COCCN2C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)o1 1543586006 VREUPUQTILXPKP-SFHVURJKSA-N 444.329 4.367 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H](C)N3CCC(Cc4ccccc4)CC3)CC2)cc1 1544891536 FIRYSQDVKJRDGW-JOCHJYFZSA-N 435.612 4.077 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1nc(C(C)C)cs1 1546516166 AFVLDQWWRHAEMW-UHFFFAOYSA-N 440.617 4.194 10 10 IICE Cc1cc(CC(=O)N[C@H](CO)c2ccc(Br)c(F)c2)c(C)n1-c1ccccc1 1556799589 OSTDVKPACJUDDJ-OAQYLSRUSA-N 445.332 4.388 10 10 IICE COc1ccc(N(C)CCN(C)[C@H](C)C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1 1559966920 ONRZHTIYBXCPAM-HXUWFJFHSA-N 445.563 4.321 10 10 IICE CC(C)(C)OC(=O)c1ccccc1CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1565148771 SDKMHDHJOGNNJW-HXUWFJFHSA-N 440.540 4.238 10 10 IICE Cc1cn2c(CN(C)C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)c(C)nc2s1 1566445416 BCCPQZUDYCZDDE-UHFFFAOYSA-N 434.565 4.434 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(N)=O)C2CCCCC2)c(C)n1-c1ccc(Br)cc1 1587479095 GRXXANXNAFBTLG-FQEVSTJZSA-N 446.389 4.411 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(N2C(=O)CCC2=O)cc1 1597566760 AKBNZDDQUXEJKX-SFHVURJKSA-N 428.488 4.449 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H](C)c2nccs2)cs1 1612392767 IFJKMNGBRBYROA-AWEZNQCLSA-N 440.598 4.236 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@]1(C)CCCO1 1613295226 CVRFFOUAMHWYJB-CYFREDJKSA-N 427.593 4.086 10 10 IICE Cc1cc(C)c2c(-c3ccccc3)nc(SCC(=O)NCc3ccc(N(C)C)cc3)n2n1 1613346479 DCLUCMKXYCRKFL-UHFFFAOYSA-N 445.592 4.488 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CCN2C(=O)OC(C)(C)C)cc1 1627420869 FDPGDYLYXVMCJA-JOCHJYFZSA-N 439.556 4.304 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc(-c3cnco3)c2)c1 1628579179 MFLXCLVNNVBIAK-UHFFFAOYSA-N 426.476 4.086 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](c3ccc(Cl)c(F)c3)c3nn[nH]n3)c2C)c1 1632492840 WAYHBCDYLYKKKA-FQEVSTJZSA-N 438.894 4.228 10 10 IICE Cc1nc(C(=O)NCc2c(O)ccc3c2CCCC3)nn1-c1c(Cl)cccc1Cl 1635959400 IJKBOOODOGUVKF-UHFFFAOYSA-N 431.323 4.397 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3cccc4cnccc34)C[C@@H]2C)c([N+](=O)[O-])c1 1639858993 ZNKMRFJWJJUEAW-KMDWOBIYSA-N 432.480 4.044 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2c[nH]c3cc(F)c(F)cc3c2=O)cc1 1650700090 OOJMFWZWUGRWIM-UHFFFAOYSA-N 437.446 4.308 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](NCc3ccccc3)C(F)(F)F)ccc21 1654591714 UVCJGAMEKDOWSV-QFIPXVFZSA-N 447.501 4.355 10 10 IICE O=C(CCN(Cc1ccccc1O)C[C@H]1CCCO1)Nc1ccccc1Br 1657726346 ZFXBNHDZPWTHIO-QGZVFWFLSA-N 433.346 4.165 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCCCc4cc(OC)c(OC)cc43)C2)cc1 1674325772 DDBNUFBQAVJHSR-XMSQKQJNSA-N 439.556 4.058 10 10 IICE CC[C@@H]1[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CCN1C(=O)OC(C)(C)C 1683981545 DMAUBBXQZDMVPM-LEWJYISDSA-N 432.609 4.461 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@H]3C)n2CCCCCCO)c(C)n1-c1ccccc1 1692986293 PLVKZNIRKHEBOY-HXUWFJFHSA-N 437.588 4.130 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](C(=O)OC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1694046944 YDVLOILCYCCPES-TZIWHRDSSA-N 439.604 4.076 10 10 IICE CO[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC[C@H]1C 1712065605 CQLLAPVVQRDAAH-NQIIRXRSSA-N 443.661 4.038 10 10 IICE Cc1ccc(-c2nnc(N3CCS[C@@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1724327327 SVKWSDPOLZUGDE-HOTGVXAUSA-N 429.565 4.430 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)CC[C@@H]1C 1728258762 XTMUAKKMWRYVAU-MOPGFXCFSA-N 448.615 4.456 10 10 IICE CC(C)CN1CCC[C@H](Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1741556780 SNWKUCDGWFZJFZ-FQEVSTJZSA-N 434.588 4.050 10 10 IICE COCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1749854258 QIRHETNQQYIFBF-FGZHOGPDSA-N 441.620 4.080 10 10 IICE C[C@@H]1SCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)[C@H]1C 1763284604 WPNXFMKGMRNCTG-GJZGRUSLSA-N 434.660 4.253 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCC1CC1 1766528549 DQOXXWJCNCMENQ-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCO[C@](C)(CC)C2)cc1 1766611413 FBVYIGHNZIMTEB-RUZDIDTESA-N 434.588 4.240 10 10 IICE CO[C@H]1CCN(c2nnc(COc3ccc(C)cc3)n2CCCSc2nccs2)C1 1771335718 DXEFSQWQBCQTHG-SFHVURJKSA-N 445.614 4.030 10 10 IICE COC(=O)COc1cn(CC(C)C)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1870869907 JXVPDLLXRZSBTI-UHFFFAOYSA-N 435.524 4.412 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)CC(NCc1ccc(Br)cc1O)C2 1913375605 FBROFVBTJJJQGR-UHFFFAOYSA-N 425.367 4.424 10 10 IICE O=C(OCc1ccccc1)N1C[C@H](NCc2ccc(Br)cc2O)C2(CCC2)C1 2028695843 YWHAYVBPBYZWEM-FQEVSTJZSA-N 445.357 4.436 10 10 IICE CNCc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(Br)c1 2186720564 JVUKIHSPHAYTQL-LJQANCHMSA-N 442.323 4.422 10 10 IICE COC(=O)c1ccc(-c2ccc(C=C3C(=O)N(c4cccc(C(=O)O)c4)N=C3C)o2)cc1 2297309344 JBXCRTIWFYRWJZ-UHFFFAOYSA-N 430.416 4.238 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C(C)=O)cc4)o3)C2=O)cc1 2297311005 NBVKTFBANKFACH-UHFFFAOYSA-N 428.444 4.378 10 10 IICE Cc1ccc(-c2ccc(C=C3SC(=S)N([C@@H](CCC(=O)O)C(=O)O)C3=O)o2)cc1C 2314650497 KGIFCIDCBGUBSG-HNNXBMFYSA-N 445.518 4.083 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2352941748 VIBYJZYYFLUPMG-AWEZNQCLSA-N 429.355 4.115 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2381130616 BFVXDVQLKYHJAM-HIFRSBDPSA-N 441.366 4.257 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCC1 13639857 HCTRFWHLEDSEDK-IUKKYPGJSA-N 426.538 4.099 10 10 IICE COc1ccc(CC2=NN3C(=N)/C(=C\c4c[nH]c5ccccc45)C(=O)N=C3S2)cc1OC 16033490 XITAQKVOGXOSPD-GFFRJOGCSA-N 445.504 4.047 10 10 IICE O=C(O)[C@@H](c1ccccc1)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 16930137 UWGHIIVMJODBSH-BAAYTWLHSA-N 434.336 4.476 10 10 IICE O=C(O)c1ccc2c(=O)n3c(nc2c1)/C(=C/c1c(-c2ccccc2)nc2ccccn12)CC3 18064294 FRLMUFRGTAXXIB-BMRADRMJSA-N 434.455 4.354 10 10 IICE CCOc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(OC)cc2)SC1=S 33323837 RNQVOSBOJQJXCW-XMHGGMMESA-N 442.562 4.324 10 10 IICE CC(C)C1=NN2C(=N)/C(=C\c3ccc(OCCOc4ccccc4)cc3)C(=O)N=C2S1 33383447 MUOBWSMMRJNQET-IJFTXDGJSA-N 434.521 4.420 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C\c3ccc(OCc4cccnc4)cc3)CC2)cc1 209664472 DVZROFGASOQWCD-AUWJEWJLSA-N 443.547 4.421 10 10 IICE O=C(O)CC[C@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 226858312 LOAWWKGHFLXCGU-QGZVFWFLSA-N 447.487 4.412 10 10 IICE Cc1ccc(C2=C(O)C(=O)N(c3ccc4c(c3)OCCO4)[C@H]2c2ccc(O)c(O)c2)cc1 526158756 KNGCZHLIHUZGEU-QHCPKHFHSA-N 431.444 4.235 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](NC(=O)OC(C)(C)C)C3)ccc21 728468212 HYPAZVPBZHMAHE-IBGZPJMESA-N 429.561 4.034 10 10 IICE C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc2c(cc1O)CCCC2 756769856 OMXMXVLNNOPJTO-SFHVURJKSA-N 428.598 4.047 10 10 IICE CN1CC[C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@@H]1c1ccc(Cl)cc1 760878939 OKCWKSSNGUYMTL-FUDKSRODSA-N 443.975 4.182 10 10 IICE Cc1ccc(C(=O)CCCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 766158044 HFCRFWRSQUXJFL-UHFFFAOYSA-N 433.596 4.196 10 10 IICE CN(C)c1ccc(CN(C(=O)CSC2CCN(C(=O)OC(C)(C)C)CC2)C2CC2)cc1 778429968 WROZRYVHPQJMCI-UHFFFAOYSA-N 447.645 4.376 10 10 IICE C[C@@H](NS(=O)(=O)Cc1ccc(Cl)cc1Cl)c1ccc(N2CCOCC2)cc1 779613144 GFPCQBYRKWJIMK-CQSZACIVSA-N 429.369 4.011 10 10 IICE CCN1CC[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 782537303 UDKUVMMUWVSZEN-UNMCSNQZSA-N 434.506 4.147 10 10 IICE O=C(N[C@@H]1CCCC[C@H]1c1ccccc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 803131970 VJWULWCOTOMDQP-XZOQPEGZSA-N 432.520 4.357 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OC)c(OC)cc2NC(=O)[C@@H]2C[C@H]2C)cc1 918625372 YXQWEWPEGLMGFN-VQIMIIECSA-N 439.556 4.075 10 10 IICE Cn1nc(-c2ccccc2)cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657906 LYTIKJRSIAYKMR-KRWDZBQOSA-N 426.467 4.087 10 10 IICE Cc1ccc(Br)cc1NC(=O)CCNC(=O)c1cc2cc(O)c(O)cc2s1 1136565931 PPTAFTKYZMWRNG-UHFFFAOYSA-N 449.326 4.142 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1143190767 HVQAGPPTLJEKOP-UHFFFAOYSA-N 431.536 4.314 10 10 IICE CCC(CC)(C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1)c1ccc(OC)c(OC)c1 1150239610 HPMHVJUOEAQPKQ-UHFFFAOYSA-N 444.547 4.258 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 1162206116 PIMLLCXWBSMZRE-HZPDHXFCSA-N 430.524 4.142 10 10 IICE Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)NCc3ccc(O)cc3O)cc12 1162277646 AHLVHRRJGODMQS-UHFFFAOYSA-N 427.913 4.449 10 10 IICE Cc1cc(CCNC(=O)c2c(Br)nc3n2CCCC3)c(C)n1-c1ccccc1 1169943396 MWMJPUUWHJSWPA-UHFFFAOYSA-N 441.373 4.362 10 10 IICE COc1cc(NC(=O)c2ccco2)c(C(=O)NCc2c(O)ccc3ccccc23)cc1OC 1179029875 UTIQRIDVAVLITA-UHFFFAOYSA-N 446.459 4.338 10 10 IICE CN1CCC[C@@H](c2cccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)c2)C1 1182262152 SAJNCAXWZNYBBO-AOYPEHQESA-N 435.612 4.383 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1234173344 WTDMNRJGGRFAEB-LJQANCHMSA-N 438.547 4.179 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 1253510225 DCXRSLRLVDVTPP-LEWJYISDSA-N 433.474 4.022 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC1(N2CCSCC2)CCCC1 1287180873 GXTRRTNLOXWCHX-UHFFFAOYSA-N 429.634 4.105 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 1292719698 KMGOISRJSUNVRW-XMMPIXPASA-N 438.474 4.327 10 10 IICE CCN(CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1295855435 GCUVHLRTCWRZAF-UHFFFAOYSA-N 445.608 4.466 10 10 IICE Cc1cc(C(=O)Nc2ccc(CO)c(CO)c2)c(C)n1-c1ccc(Br)cc1 1301533442 DNPBDJWOYRJLKA-UHFFFAOYSA-N 429.314 4.094 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1)c1ccccc1O 1302532414 BGTIIFXOHNQNLP-SJORKVTESA-N 436.533 4.023 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](c3ccco3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305553369 BWIVQMHOAQXVRK-KKSFZXQISA-N 427.524 4.216 10 10 IICE Cc1nc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)sc1-c1nnc(S)n1C 1306265406 XXQPODRJQHZMIL-UHFFFAOYSA-N 438.582 4.124 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CC[C@@H](C)C2 1348721132 WVTNNZHFJCQRBP-WBVHZDCISA-N 440.565 4.037 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](OCC)[C@@H]2CCOC2)sc(C)c1-c1ccc(F)cc1 1352684892 ZLRTWUIAVOPVJY-BEFAXECRSA-N 435.517 4.419 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3sc(SCC(C)C)nc3C)CC2)cc1 1355446809 TYKRHVXKLKAEJJ-UHFFFAOYSA-N 433.643 4.490 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1356037309 WCJSXMVBVJHHML-HOTGVXAUSA-N 436.474 4.246 10 10 IICE CC(C)Oc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccn1 1435997885 HEWMFGMYVMQOPF-GZTJUZNOSA-N 445.541 4.238 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1F 1443772506 QFSXOEGIUPIGOZ-SFHVURJKSA-N 433.568 4.325 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Br)cc(C)c1C 1446814459 HJCNUAKHFMWRHY-UHFFFAOYSA-N 440.721 4.240 10 10 IICE Cc1ccc(C(=O)NCc2ccc(NC(=O)CCCOc3ccccc3)cc2)c(O)c1O 1464227797 ZANSWQNJMINPIQ-UHFFFAOYSA-N 434.492 4.134 10 10 IICE CC(C)(C)CC[C@@H](CO)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1467486693 SHLPJCCSCZZZJT-QXPQOBGOSA-N 440.656 4.033 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCN([C@@H](C)c4ccc(Cl)cc4)CC3)C2)cc1 1470772354 JWPDDKKLOTZGNB-GHTZIAJQSA-N 442.991 4.016 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1 1470810770 SCWGTLUCKVJHNX-OAQYLSRUSA-N 431.964 4.263 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(C)s2)n1Cc1ccc2c(c1)CCCN2C 1503011546 GQXJRYZHBRBPIF-UHFFFAOYSA-N 425.602 4.252 10 10 IICE Cc1ccccc1Cc1nnc(N2CCOC(C)(C)C2)n1CCCSc1nccs1 1511317152 JSWYBBPMPSJSRO-UHFFFAOYSA-N 443.642 4.431 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 1525107533 VELOWNKRMPKSDV-UHFFFAOYSA-N 426.582 4.275 10 10 IICE O=C(CSCc1ccc(Cl)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015474 QWEKSBNCAXPNLV-UHFFFAOYSA-N 444.044 4.422 10 10 IICE CCN1CCC(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)(C(F)(F)F)CC1 1534070778 LXTVNPVUYKUXAC-UHFFFAOYSA-N 437.506 4.062 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc4cc(Cl)ccc4s3)cc2)CC1 1537838776 FNRYHQFIKGXZRV-UHFFFAOYSA-N 427.957 4.186 10 10 IICE Cc1ccc(CN(C)c2nnc(C(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)o1 1542361478 LQQZFQSMOZSYPP-UHFFFAOYSA-N 437.588 4.196 10 10 IICE C[C@H]1CCCN(CCn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)C1 1544179736 HNORKBZCJCCZRR-KRWDZBQOSA-N 440.979 4.067 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnnc(-c2ccccc2)c1 1556426579 SLSGJINMEXGGSO-UHFFFAOYSA-N 432.524 4.146 10 10 IICE COC(=O)c1cnc(SCC(=O)Nc2nc(-c3c[nH]c4ccccc34)cs2)s1 1559416464 KKAZGMKVQJTFRZ-UHFFFAOYSA-N 430.536 4.265 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cccc(Cl)c2F)NC(=O)OC(C)(C)C)cc1 1565881664 FKTQAQAECAFVHY-IBGZPJMESA-N 449.954 4.470 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccccc1OCc1ccccc1Br 1570462163 HAZMERNCBXNEPM-UHFFFAOYSA-N 428.282 4.369 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(SC(F)(F)F)c1 1583383209 BFPJSWHUGSPZKU-UHFFFAOYSA-N 432.414 4.343 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)c1 1596408257 RGAILSSGTKQCMM-XUZZJYLKSA-N 437.490 4.383 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@]2(COC)CCCCN2C(=O)OC(C)(C)C)cc1 1623452185 URFVKBOCOKCTEV-VWLOTQADSA-N 447.620 4.297 10 10 IICE CCN(CC)CCOc1ccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 1624590224 COQPMVGNEJWQJI-UHFFFAOYSA-N 438.616 4.190 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H](Cc3ccccc3Cl)C(N)=O)c2C)c1 1628159165 SWGZDEMNLKSPRC-FQEVSTJZSA-N 437.971 4.438 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)SCc2nc(O)c3ccccc3n2)cc1 1628857812 NFRXPUYFXFTMTN-KRWDZBQOSA-N 438.597 4.462 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2cccc(C(C)C)c2)o1 1632356429 NOVVIJLYPJJRDL-IBGZPJMESA-N 437.492 4.385 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C(=O)c2cccc3ccccc23)cn1C 1633818977 NDRUJEDXPHJNBN-INIZCTEOSA-N 428.488 4.182 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccccc3OCCC(C)C)CC2)c(OC)c1 1634228123 CQERCDBTMCKVLN-UHFFFAOYSA-N 441.572 4.161 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(C)C[C@@]2(O)CCN(Cc3ccccc3)C2)c1C 1642593704 KDFIDLVJESWHKR-MHZLTWQESA-N 431.580 4.112 10 10 IICE COc1cccc(-c2nnn(CC(=O)c3cc(C)n(-c4cccc(SC)c4)c3C)n2)c1 1656075955 BNROMBHWVLUZQS-UHFFFAOYSA-N 433.537 4.361 10 10 IICE COCCN(CC(=O)N(Cc1cccc(F)c1)C(C)(C)C)c1ccc(OC)c(OC)c1 1657577466 YZRGSHNRLYRGEJ-UHFFFAOYSA-N 432.536 4.123 10 10 IICE CN(CC(=O)Nc1cccc(CN2CCSCC2)c1)c1ccc(-c2nccs2)cc1 1658928250 PYMXVQJGNNVWKT-UHFFFAOYSA-N 438.622 4.434 10 10 IICE CC(C)[C@H](CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)Cc1ccccc1 1681763996 PATDJNIJVGHQHX-FQEVSTJZSA-N 431.527 4.116 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1726709431 IXKZMZIVRROOTD-SFHVURJKSA-N 436.579 4.390 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@H](C)N(CC)C[C@@H]2C)cc1 1728379092 GFOFJFRSXBMRAX-SFTDATJTSA-N 449.647 4.097 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1743858926 VIMFYQLUZPLISI-QGZVFWFLSA-N 441.599 4.266 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCNC(=O)C(C)C)C1 1744955410 RYIHTUOPVWVCTC-NRFANRHFSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCC[C@@](C)(OC)CC2)cc1 1746092326 IZGZSJYHLCDJAT-PXDATVDWSA-N 441.620 4.072 10 10 IICE COCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N([C@H]2CCCC[C@@H]2C)C1=O 1873165714 QWCADKMMVRKGDJ-MBSDFSHPSA-N 449.595 4.379 10 10 IICE Cc1c(C2(C)CC2)nn(Cc2ccc(Br)cc2O)c1I 2079798916 NTHZFRVOVITZQJ-UHFFFAOYSA-N 447.114 4.364 10 10 IICE CN(C)c1ccc([C@H](O)c2ccc(Br)cc2I)cc1 2142280659 HCQRDCUORFTTLW-HNNXBMFYSA-N 432.099 4.201 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C23CCC3)c1O 2236048303 AOPIECZCEANEAA-HZPDHXFCSA-N 441.366 4.089 10 10 IICE CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc(Cl)c1O 2294124651 OSMARGMDUNHWEA-UHFFFAOYSA-N 435.263 4.073 10 10 IICE O=C(NN1C(=O)C(=CC=Cc2ccco2)SC1=S)c1ccc(Br)cc1 2297469400 OKMQCLWZXYOPCX-UHFFFAOYSA-N 435.324 4.145 10 10 IICE Cc1ccccc1-n1c(C)cc(C=C2C(=N)N3N=C(c4cccnc4)SC3=NC2=O)c1C 2297470481 MNZJHZKSMOLEKQ-UHFFFAOYSA-N 440.532 4.465 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)o1 2313553059 BMYRYLMEACLYCS-UHFFFAOYSA-N 445.431 4.392 10 10 IICE COc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3c[nH]c4ccccc34)SC2=S)cc1 2314836994 MTCWKZVYMLIXOE-CYBMUJFWSA-N 437.546 4.405 10 10 IICE COC(=O)c1ccccc1-c1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)o1 1219420 UYMVUDKUMIESQC-CPNJWEJPSA-N 444.443 4.016 10 10 IICE COc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1OC 8608800 UGLFTLSTBIHHIY-XMMPIXPASA-N 445.563 4.304 10 10 IICE CN(C)c1ccc(CNC(=O)CCCN2C(=O)c3cccnc3Sc3ccccc32)cc1 9687904 OAXQOXHRNGAKHF-UHFFFAOYSA-N 446.576 4.356 10 10 IICE Cc1ccc(-n2c(SCC(=O)c3ccc(O)c(O)c3)nc3ccccc3c2=O)cc1C 10410093 VOJQDPQNMWREPJ-UHFFFAOYSA-N 432.501 4.389 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459364 FRKPVXNEQIVIQP-SWDAYOAKSA-N 428.554 4.304 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S)NCc1ccccc1 15043678 AOQIYLMYYHISRL-MOSHPQCFSA-N 435.574 4.466 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CC=C[C@@H]21 20704706 AVPLTBQWZCPHJR-STXHMFSFSA-N 427.888 4.451 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(NCc3cc(Br)cc(F)c3O)CCC[C@H]12 715745987 QBPBNXJLOGYFRO-HNAYVOBHSA-N 429.330 4.316 10 10 IICE COc1ccccc1C(=O)N1[C@H](C(=O)NCc2ccc(N(C)C)cc2C)C[C@H]2CCCC[C@@H]21 734401917 GKTLDGZUXFJUFH-YGOYIFOWSA-N 449.595 4.159 10 10 IICE C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc(Br)ccc1O 756476187 OOBJERIYZZDTKS-INIZCTEOSA-N 431.374 4.429 10 10 IICE CN(c1ccc(CNC(=O)N2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)cc1)C1CCCCC1 764766194 GKILAWNXGOVSPJ-YLJYHZDGSA-N 427.511 4.300 10 10 IICE Cc1ccc(N2CCOC2=O)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 766762835 JBLFBZSNHHHQCH-UHFFFAOYSA-N 446.551 4.312 10 10 IICE FC(F)(F)c1ccc(CN2CCCN(Cc3ccc(N4CCOCC4)cc3)CC2)cc1 768220538 RBPGEVXNEBYWII-UHFFFAOYSA-N 433.518 4.250 10 10 IICE COc1c([N+](=O)[O-])ccc(CNCc2ccc(Br)cc2C(F)(F)F)c1O 775039999 OKYDWFMPIIRHFT-UHFFFAOYSA-N 435.196 4.380 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(F)cc(Br)c3F)CC2)cc1 786477330 DKZBREKDKUKYPU-UHFFFAOYSA-N 426.261 4.090 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2cccc(Cl)c2)cs1 915222027 QVYFTHRFEGAIOS-UHFFFAOYSA-N 425.875 4.181 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCc2ccc(OC(F)F)cc2)CCCC1 1124554460 QXACRYNZJJOLFC-UHFFFAOYSA-N 428.479 4.489 10 10 IICE C[C@H](NC(=O)C(F)(F)c1ccc(Br)cc1)c1ccc(N2CCOCC2)cc1 1125518215 BBXRSAXHGOPZFF-AWEZNQCLSA-N 439.300 4.255 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)c2C)c1 1132264654 ZEJHIQPROHJESM-UHFFFAOYSA-N 429.480 4.426 10 10 IICE CC(C)C[C@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N2CCSCC2)cc1 1136282349 IGPJLIUFOJXIHY-FQEVSTJZSA-N 449.661 4.433 10 10 IICE Cc1cc(N2CCC(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)nc(C)n1 1148354596 HYFGAXXYLKWVGE-UHFFFAOYSA-N 445.567 4.021 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)CCc1cnn(C)n1 1160647125 ZMYWIMHRPICOGW-IBGZPJMESA-N 431.462 4.059 10 10 IICE O=C(Cn1nc([N+](=O)[O-])nc1Br)Nc1ccc(N=Nc2ccccc2)cc1 1166696954 STWVLHOXFSWFAH-UHFFFAOYSA-N 430.222 4.003 10 10 IICE Cc1ccc(S(=O)(=O)N[C@H](CCN(C)c2ccc3c(c2)OCO3)c2ccccc2)cc1 1168216046 ZLABHSZIGSPIGI-JOCHJYFZSA-N 438.549 4.270 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)c3ccc(F)cc3OC(F)F)C2)cc1 1225548192 DZVUXKGQBVJCKQ-LSDHHAIUSA-N 437.462 4.322 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1287484459 JLIJXIYOBHAMCD-UHFFFAOYSA-N 436.474 4.349 10 10 IICE CCOc1ccc(N2CCN(C(=O)COc3ccc(C(=O)c4ccccc4)cc3)CC2)cc1 1295272698 MUVPQXTWFOIYIF-UHFFFAOYSA-N 444.531 4.044 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1NC(=O)CC1(C)C 1295427437 JVMWHOZNHHZPJM-OAQYLSRUSA-N 434.588 4.114 10 10 IICE CC(=O)N1CCN(c2ccc(NC(=O)c3cc(C)n(-c4ccccc4C)c3C)cc2)CC1 1302749714 CPDZCIRWJJJPRA-UHFFFAOYSA-N 430.552 4.323 10 10 IICE CCc1nc(CN(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cs1 1351417817 BCKBQTJNLCEQEW-YBEGLDIGSA-N 449.598 4.095 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)Nc2ccc(C)cc2Cl)CCCC1 1356079821 RONSCRVPOYZZCR-UHFFFAOYSA-N 439.943 4.245 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1C[C@]12CCCN(C(=O)OC(C)(C)C)C2 1356267705 RVDLTMDRAFAHND-OFVILXPXSA-N 427.589 4.282 10 10 IICE CCn1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(-c2ccccc2)n1 1441783741 NKWTVGWIHYXOCS-QZTJIDSGSA-N 436.531 4.253 10 10 IICE Cc1cc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])c(C)n1-c1ccc(Br)cn1 1465335918 HAWKWTDYEXWPJY-UHFFFAOYSA-N 441.285 4.363 10 10 IICE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N(C)Cc1ccccc1O 1465843244 XSLLHKLKYJBUJH-KRWDZBQOSA-N 430.504 4.278 10 10 IICE Cc1cc(N(C)C)cc(C)c1CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1465950796 BPNCAZNTJUOETO-FQEVSTJZSA-N 429.992 4.052 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(Cl)cc3Cl)CC2)cc1F 1473270354 VKACCDXDNKFFSF-ZDUSSCGKSA-N 426.319 4.290 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)Cc1c(C)nn(Cc2ccccc2)c1Cl 1473572194 DBTHMCFYTRUXOG-UHFFFAOYSA-N 427.932 4.164 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC[C@H]1C 1504501529 HGWQHPOKTLVNLZ-CRAIPNDOSA-N 444.630 4.149 10 10 IICE CC(C)OC1CCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1509841239 POLQZMRUQYIVAG-JOCHJYFZSA-N 445.583 4.167 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@H](NC(C)=O)Cc2ccccc21 1519477615 HNVOIYLEBUIEPR-OTDUKCBNSA-N 429.520 4.131 10 10 IICE COc1ccc2cc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cnc2c1 1527246128 RNDMPELFKCKYMY-UHFFFAOYSA-N 445.441 4.029 10 10 IICE COc1ccccc1N1CC[C@H](NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1=O 1535191647 ZMZSKPLSBBIGMT-FQEVSTJZSA-N 437.927 4.291 10 10 IICE Cc1nsc(C)c1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1539361644 ZRFOIFLJTLEDAU-UHFFFAOYSA-N 428.315 4.484 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)C[C@H]1CC=CCC1 1542227299 YJOIQKAKXIDSNQ-QFIPXVFZSA-N 430.600 4.479 10 10 IICE COc1ccc([C@@H]2[C@@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC(=O)N2C)cc1 1544246080 HJEHZQBWCANWIC-AZGAKELHSA-N 449.595 4.300 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H]3CCCN(C(=O)C(F)(F)F)C3)c2C)c1 1557249637 MODSSAZABYCSQR-GOSISDBHSA-N 435.490 4.242 10 10 IICE COc1ccccc1[C@H]1CN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CCO1 1557945100 KEGKUIKJAZYUFG-RUZDIDTESA-N 432.520 4.058 10 10 IICE CC(=O)c1cccc(OCc2cc(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)no2)c1 1585264655 VZUIWRNEVTZIRX-KRWDZBQOSA-N 435.524 4.192 10 10 IICE Cc1cnc(Cl)cc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1586620297 VVZWHJCWGSOCCY-SFHVURJKSA-N 432.952 4.105 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc3c(c2)CCCN3C)cc1I 1597848911 NRDFHEZJYDMONK-UHFFFAOYSA-N 434.321 4.220 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCC3(CCOCC3)O2)c(C)n1-c1ccccc1Br 1598410845 XXZZWQBLSZNTJA-QGZVFWFLSA-N 447.373 4.315 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1([S@@](C)=O)CCC1 1603303508 RKNPOZAQMHGJCO-WJOKGBTCSA-N 443.661 4.014 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C2CC2)c1 1628330865 OYVOSCKPDVYBLT-VWLOTQADSA-N 439.556 4.330 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@]2(C)CCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1629679328 NTUNOPHCTGBMDG-GJZUVCINSA-N 437.584 4.339 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(NC(=O)C(C)C)cc2)cc1 1629797162 YGOGAQKCCCGBSP-UHFFFAOYSA-N 431.536 4.360 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccccc3Cc3ccccc3)CC2)cc1F 1631377436 NNYRWCSOEALSPL-UHFFFAOYSA-N 434.511 4.153 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)c(OC)c(OC)c2)cc1F 1633264118 VGNBYLGBMSYJMZ-UHFFFAOYSA-N 439.325 4.382 10 10 IICE C[C@H]1CO[C@H](C(F)(F)F)CN1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1634719741 FKBVBJRTRDPBOM-GLJUWKHASA-N 433.902 4.438 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)COC(c1ccccc1)c1ccccc1 1638529583 RNPUEUDUBMDGII-UHFFFAOYSA-N 433.504 4.090 10 10 IICE CCOC(=O)c1cnc(Sc2nc3ccccc3c(=O)n2-c2ccccc2F)s1 1641965529 RXPKKOHRIANYKR-UHFFFAOYSA-N 427.482 4.309 10 10 IICE CCOC(=O)c1c(NC(=O)CNC(CC)(CC)C(=O)OC)sc(C)c1-c1ccccc1 1642886288 GRIKFGGINLJSSU-UHFFFAOYSA-N 446.569 4.160 10 10 IICE COC(=O)[C@@H](C[C@H]1CCCOC1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1643523610 DSFFGWITCSKQQE-VGOFRKELSA-N 438.528 4.256 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)cc1F 1644919070 AMCFEOBRUBHPAQ-CQSZACIVSA-N 440.346 4.141 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC(O)(c4ccc(F)cc4)C3)cc2Cl)C1 1680563445 XBVHGTWUPZSEPN-INIZCTEOSA-N 431.939 4.128 10 10 IICE CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NCc1cccc(Cl)c1O 1681018438 GUCJLIUPDYHVTB-APPDUMDISA-N 427.726 4.384 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3cc(Br)cc(F)c32)N(C)C)cc1 1685608877 IZFSFDRPMORQJL-LJQANCHMSA-N 449.368 4.029 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1 1685758434 LEDOWKPUAWANJF-SJORKVTESA-N 435.565 4.188 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1C[C@H](C)CC(C)(C)C1 1724235116 HWJAUVHUGNRNGS-WIYYLYMNSA-N 425.621 4.467 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC[C@@H](OC(C)(C)C)C2)cc1F 1729328980 SZRVCJZXUBRLGS-GOSISDBHSA-N 440.567 4.311 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](CN3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1741455042 HPTBFWCKEKCTEB-NRFANRHFSA-N 442.627 4.042 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@@]3(C)CCCS3)CC2)cc1F 1748848979 AKVQKPHEQWYIQT-JOCHJYFZSA-N 433.597 4.162 10 10 IICE C[C@@H]1SCCN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)[C@@H]1C 1752460407 GDGBNNJPWHBCTC-OWCLPIDISA-N 439.676 4.141 10 10 IICE CC[C@@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1763383341 PKROOVYWQUNDIX-LJQANCHMSA-N 429.584 4.270 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(OC)nc1 1763499218 MBSNKMQZRLYCRJ-IBGZPJMESA-N 434.588 4.480 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)c1 1860085283 AUKWZOILANPOAH-OVCLIPMQSA-N 434.882 4.441 10 10 IICE COc1ccc(N2N=C(C(F)(F)F)/C(=C/c3cc(OC)c(OC)c(OC)c3)C2=O)cc1 1865667908 WCPQGQRLBZNLEN-DHDCSXOGSA-N 436.386 4.070 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3cc(C)ccc3C)N=C2C(F)(F)F)cc(OC)c1O 1865679856 JYUDWJWCLKKMHW-PXNMLYILSA-N 434.414 4.370 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](NCc1cccc(Br)c1O)C2 1878851829 UBSWLOMBQYRMCI-UKMLZYKCSA-N 429.330 4.123 10 10 IICE CCOC(=O)COc1ccc(C=C2SC(=S)N(c3ccccc3)C2=O)cc1OCC 2297350076 SUXPXEBOCBJBFA-UHFFFAOYSA-N 443.546 4.433 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccccc3)C2=O)ccc1O 15045333 KPEQJKPFYQBLRI-CYUIRQCWSA-N 428.535 4.019 10 10 IICE COc1ccc(Cl)cc1C(=O)NC[C@@H](c1ccc2c(c1)CCCN2C)N1CCCC1 16838212 TUZPWMPFLQSORD-QFIPXVFZSA-N 427.976 4.298 10 10 IICE COc1cc(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1NS(C)(=O)=O 71998351 UARWMPBPCQVUMN-UHFFFAOYSA-N 447.944 4.380 10 10 IICE CCCCOc1ccc(/C=C2/SC(=S)N(CC(=O)OCC(C)C)C2=O)cc1OC 206456099 PSNWMMULVBVLHU-WOJGMQOQSA-N 437.583 4.275 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)CC[C@H]2C1 715788863 MTWRVGKLGICJQY-BJJXKVORSA-N 443.357 4.419 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742800965 NSQITLGMUAMJKV-FQELHTAISA-N 443.494 4.281 10 10 IICE CSc1ccc(N2C[C@@H](C(=O)N(Cc3ccco3)Cc3ccccc3O)CC2=O)cc1 743428368 VBETWJOLDXVYOQ-SFHVURJKSA-N 436.533 4.289 10 10 IICE Cc1nn(C)c(C)c1C[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 745280899 ZQMDVMIJEAAQEI-CQSZACIVSA-N 425.504 4.188 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@H]3CCCN(C)[C@@H]3c3cccs3)CC2)cc1 745847385 JKHNVGGGOBTOOI-XXBNENTESA-N 442.629 4.062 10 10 IICE Cc1cc(CCNC(=O)Nc2ccc(CCS(C)(=O)=O)cc2)c(C)n1-c1ccccc1 747375509 NMKMDNOMAHBWGH-UHFFFAOYSA-N 439.581 4.045 10 10 IICE CCc1ccc(-c2csc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3OC)n2)s1 748836444 UFZMFJIKHMNPLO-UHFFFAOYSA-N 425.513 4.152 10 10 IICE Cc1cccc(NC(=O)C[C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C 773143687 CCZPPUOSLYOLAA-NRFANRHFSA-N 434.628 4.342 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc3c(c2)nc(C(F)F)n3C)cc1 798941200 WOUIFWXEDNSSOP-IBGZPJMESA-N 442.510 4.398 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCCC3)cc2)cnn1-c1ccc(C(F)(F)F)cn1 828204505 UIWSRCVURCQQCT-UHFFFAOYSA-N 429.446 4.125 10 10 IICE CCC[C@H](NC(=O)c1cccc(N2C(=O)/C(=C\c3ccccc3)SC2=S)c1)C(=O)O 1081156798 HPUAGKJYLMMMQK-BOFQVRIASA-N 440.546 4.076 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(S(=O)(=O)C(F)F)cc3)c2C)c1 1132264447 RZXXCQFASFHDTP-UHFFFAOYSA-N 432.492 4.329 10 10 IICE COc1cccc(OC)c1OC1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1136492356 ZKIVRUAOHUKWBM-UHFFFAOYSA-N 429.494 4.013 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@]2(C)CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1136903511 FRSLBFJJURMOMH-OXQOHEQNSA-N 444.403 4.409 10 10 IICE CC(C)(C)OC(=O)Nc1ccoc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348304 OSLJBJPDRPXXKX-MRXNPFEDSA-N 449.935 4.380 10 10 IICE Cc1cc(C(=O)NCC(C)(C)CN2CCCC2)c(C)n1-c1ccc(Br)cn1 1156561964 PHBGWSJCWZKREL-UHFFFAOYSA-N 433.394 4.103 10 10 IICE C[C@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])c1ccc(N(C)C)cc1 1186176006 SMZAHQRYACNPKC-KRWDZBQOSA-N 446.573 4.399 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@H]1C[C@@]2(CCN(C(=O)OC(C)(C)C)C2)CO1 1190436684 HEFSEUQKNACFTL-RCZVLFRGSA-N 431.621 4.379 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)cc1 1228489462 ZWDAOWQRJNZGOT-YPAWHYETSA-N 427.593 4.068 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCc2nc(C(F)(F)F)n3c2CCCC3)cc1 1254361790 BYFBUAQJXZRTHU-UHFFFAOYSA-N 437.510 4.426 10 10 IICE Nc1ccc(C(F)(F)F)cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1292593592 IFGPQLHCPKTJTP-UHFFFAOYSA-N 429.389 4.288 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1ccncc1 1301682383 DTLBOTSKFRWODY-UHFFFAOYSA-N 430.556 4.073 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305487552 HSHCFCKKFIAPQY-MAUKXSAKSA-N 441.555 4.120 10 10 IICE C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1312365992 SJPKSIXHGFAZNA-INIZCTEOSA-N 435.490 4.097 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1351697773 YTUXBPORNQYDOS-MRXNPFEDSA-N 433.643 4.456 10 10 IICE COC(=O)[C@@H](C)CN(Cc1ccccc1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1352408524 CDLYCSYHECDTRF-IBGZPJMESA-N 448.563 4.367 10 10 IICE COc1ccc(/C=C(\C)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1F 1356037037 RUPUHPBCEZNKFE-NPTTZVSOSA-N 430.495 4.307 10 10 IICE Nc1c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cccc1C(F)(F)F 1441644636 AOIIXLBCGCUILA-UHFFFAOYSA-N 447.379 4.073 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1445639096 PHTUQDWQPBXPPL-FXAWDEMLSA-N 432.492 4.109 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2C1 1445883874 OIOPIQBYWAPVAE-HNAYVOBHSA-N 443.975 4.056 10 10 IICE CC(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1446563455 GAUCFGVEUSDRQT-UXHICEINSA-N 434.577 4.229 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C)c(C)n1-c1cccc(C(C)C)c1 1468181972 BMNTUOXCZOFHRW-OAQYLSRUSA-N 443.588 4.175 10 10 IICE Cc1cc(C(=O)N2CC(O)(c3cccc(Br)c3)C2)c(C)n1-c1ccc(F)cc1 1471040902 IAKZQXKTJVUUQX-UHFFFAOYSA-N 443.316 4.339 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1cnc(C)s1 1495112318 VKJBZAZQCOKVBV-KRWDZBQOSA-N 440.617 4.078 10 10 IICE CCOCc1nnc(N2CCO[C@@](C)(C(C)(C)C)C2)n1CCCSc1nccs1 1516612953 PXFUBNUEOXZTND-HXUWFJFHSA-N 439.651 4.095 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4c(N(C)C)cccc4s3)cc2F)CC1 1521016016 JJIYDYSOMWFNIU-UHFFFAOYSA-N 440.588 4.178 10 10 IICE COC(=O)c1cnc([C@@H](C)NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)s1 1529527830 RFHPGKOMSGHUPG-CYBMUJFWSA-N 431.945 4.411 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)[C@@H](C)C(F)(F)F 1538872021 IXQKIBFSYVYYSV-HKLRHMNMSA-N 434.480 4.216 10 10 IICE COc1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)ccc1C(F)(F)F 1543753192 QGZZRXFHBFOMQY-UHFFFAOYSA-N 433.474 4.498 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2cccc(Br)c2)c(C)n1-c1ccc(F)cc1 1546098436 FMYDDDJVRKPRHA-FQEVSTJZSA-N 431.305 4.459 10 10 IICE CCC(CC)NC(=O)[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)c2ccccc2O1 1546276134 SPSJPAAYUGMFTC-IBGZPJMESA-N 440.521 4.025 10 10 IICE Cc1cc(C(=O)N2Cc3c[nH]nc3C[C@@H](C)C2)c(C)n1-c1ccc(Br)cc1 1558315004 BOONXNAAHYYOTB-CYBMUJFWSA-N 427.346 4.414 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](C)CN(C)C(=O)OC(C)(C)C 1566306372 JFBNWIMZYLHWCN-CYBMUJFWSA-N 429.355 4.006 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(Oc4cccc(OC)c4)cn3)C2)cc1 1585664571 CPNJOSHVEBLEFY-SFHVURJKSA-N 433.508 4.147 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCSC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 1617302892 PMPQYOOKAWJLEO-HXUWFJFHSA-N 437.531 4.178 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1c1cccc(Cl)c1 1625684741 YDGGSVNBNIYSFG-WMLDXEAASA-N 427.715 4.188 10 10 IICE Cc1cc(CC(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)c(C)n1-c1ccccc1 1626547525 FVAPUIIQOJESQM-NRFANRHFSA-N 431.580 4.174 10 10 IICE COC(=O)[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(C)cc1 1628624912 OMNQNKQRWFMTQW-QHCPKHFHSA-N 432.520 4.210 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(Cl)c(F)c4)C3)cc2)CC1 1633111398 RWOMAKKEBHDDAH-GOSISDBHSA-N 443.950 4.385 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc3scnc3c2)NC(=O)OC(C)(C)C)cc1 1634163323 XXBPDDUZEHPTAF-IBGZPJMESA-N 440.569 4.358 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@H](C(F)(F)F)OC[C@H]3C)cc2Cl)C1 1634719742 FKBVBJRTRDPBOM-HBUWYVDXSA-N 433.902 4.438 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccc(F)cc2)on1 1635941024 MSFCBZIZNGCSIB-GOSISDBHSA-N 429.879 4.234 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCNc2ncc(C(F)(F)F)cc2Cl)cc1 1639814439 YNDDWUMOZDFMMS-UHFFFAOYSA-N 444.885 4.159 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(Br)cc2O)cc1 1640367502 DUIOPLBEELQTTH-UHFFFAOYSA-N 431.252 4.425 10 10 IICE C[C@@H]1CN(C(=O)CN(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)CC(C)(C)O1 1642029370 JYEUTCJGDZAIHI-ROFLEHJCSA-N 436.552 4.004 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Br)c2cc(C)oc12 1643245863 XBRBELGFUYPOOJ-UHFFFAOYSA-N 446.297 4.415 10 10 IICE CO[C@@](C)(CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)COCc1ccccc1 1645158932 OJDMUUFRPRLFKQ-SANMLTNESA-N 434.536 4.258 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]2C[C@@H](C)O)sc(C)c1-c1ccccc1 1649398802 XTEIPUNFFUPIFZ-QAPCUYQASA-N 430.570 4.074 10 10 IICE CN(Cc1c(I)cnn1C)c1ccc(OCc2ccccc2)cc1 1654172413 CDHLYPNQSRXNFK-UHFFFAOYSA-N 433.293 4.240 10 10 IICE Cc1cc(NC(=O)c2ccc(N=NC(N)=O)cc2)n([C@H]2CCN(Cc3ccccc3)C2)n1 1654435959 SPDBTZXCKMNIKK-FQEVSTJZSA-N 431.500 4.053 10 10 IICE COC(=O)c1nc([C@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)sc1C 1683253108 CTBFDLXNKKXYDT-DNVCBOLYSA-N 444.601 4.090 10 10 IICE Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1685328218 SUPOEGJEQSDEAT-LOSJGSFVSA-N 448.611 4.174 10 10 IICE CCC[C@H](Cn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1695109723 BOHRMRCWUVGBCS-LJQANCHMSA-N 447.599 4.156 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1695624027 JDZWYIIARYMJQN-HYBUGGRVSA-N 448.615 4.020 10 10 IICE CCOCCCCn1c(C2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1696400763 XJDFZZXCGLLWNR-UHFFFAOYSA-N 445.583 4.227 10 10 IICE C#CCN1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C/C=C/CC)CC1 1705635120 RTHPZZLFUVZJKQ-YRNVUSSQSA-N 428.584 4.074 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1724196539 RZLNVYVZXCKSMC-PKOBYXMFSA-N 434.588 4.066 10 10 IICE CC[C@H]1CCCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)c(F)c2)C1 1727733534 UFWPTNUQDHWISW-IBGZPJMESA-N 439.583 4.020 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)Cn1c(C(C)C)nnc1N(C)Cc1ccccc1O 1764668316 DEVQXOZIJRPOPL-QGZVFWFLSA-N 431.581 4.389 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cscc1C 1766234600 YNMXDPDWNKYVOS-UHFFFAOYSA-N 425.602 4.469 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N(C)C)c(F)c1 1766815520 DIWKRVNNFNWNLL-SFHVURJKSA-N 427.524 4.105 10 10 IICE CSCCCCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1771467559 FRHGBJUKOHFYMW-UHFFFAOYSA-N 445.677 4.483 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(CCCCCC(=O)O)C3=O)n12 1858590208 CBWQRCZGKRRKTQ-YRNVUSSQSA-N 429.976 4.204 10 10 IICE COc1ccc(-c2nc3cc(C(=O)N4CCN(c5ccc(OC)cc5)CC4)ccc3[nH]2)cc1 1861868963 JINCMXMSIYYEGR-UHFFFAOYSA-N 442.519 4.210 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(OC(F)(F)F)cc1 1891729140 ZYDREGUMDULCKQ-RDJZCZTQSA-N 426.460 4.052 10 10 IICE O=C(O)C[C@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)Cc1ccc(O)c(O)c1 1951414037 NRCRBKFRUACVHG-QGZVFWFLSA-N 447.487 4.270 10 10 IICE Cc1cc(O)c([C@H](n2nc(C)c(C(=O)O)c2I)C2(C)CC2)cc1C 2079932878 NNGXVXCDMLGQBR-HNNXBMFYSA-N 440.281 4.206 10 10 IICE C[C@@H](N)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)c(Br)c1 2144879022 MOQYVIOOCJBYMO-GOSISDBHSA-N 432.406 4.198 10 10 IICE CCCC[C@@H](CNC(=O)OC(C)(C)C)NCc1c(Br)ccc(OC)c1O 2227747687 DXOFSYWKKWPCGX-ZDUSSCGKSA-N 431.371 4.336 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)C2=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 2332144757 LPIAFCYAKTZWDR-UHFFFAOYSA-N 447.422 4.278 10 10 IICE CCN1C(=O)/C(=C\c2ccc(OCc3ccc(F)cc3)c(Br)c2)NC1=S 33315563 GDXDIIQSAJPDRI-MHWRWJLKSA-N 435.318 4.245 10 10 IICE CCN(CC)c1ccc(/C=C2\SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1 33329937 VSWXYNCWQJKYMG-RGEXLXHISA-N 425.579 4.387 10 10 IICE Cc1ccc(NC(=O)COc2ccc(Cl)cc2/C=C2\SC(=S)NC2=O)cc1C 39793985 FQKWTNWVBBAYKK-MFOYZWKCSA-N 432.954 4.463 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 71939542 SAOATMLEZPYVGG-ZDUSSCGKSA-N 441.330 4.177 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1 104914627 BDFVACMHKIBBPT-QHCPKHFHSA-N 447.535 4.419 10 10 IICE O=C1[C@H]2[C@@H](c3cc(Cl)ccc3O)N(Cc3ccccc3)O[C@H]2C(=O)N1Cc1ccccc1 248004869 SOATWEQQEKPCOY-YTFSRNRJSA-N 448.906 4.088 10 10 IICE CC(=O)Nc1cccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526394092 LXTJWXWWWRXIFU-QFIPXVFZSA-N 434.423 4.253 10 10 IICE Cc1cc(C(=O)COC(=O)c2cccn(C)c2=O)c(C)n1-c1cc(Cl)cc(Cl)c1 733507024 AIFLOHGMEPWOJI-UHFFFAOYSA-N 433.291 4.139 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc(N3CCCC3=O)ccc2F)cc1 741558284 CGPABCOZQXQFNN-UHFFFAOYSA-N 437.437 4.223 10 10 IICE CCN(CC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(OC)c(OC)c1 744391415 YKYWSMDXSMDIFE-UHFFFAOYSA-N 442.497 4.201 10 10 IICE CCC1(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)CCN(Cc2ccccc2)CC1 754126932 WFAWAGLWOKSPFJ-IBGZPJMESA-N 425.573 4.453 10 10 IICE Cc1cc(-c2csc(NS(=O)(=O)c3ccccc3Cn3ccnc3)n2)c(F)cc1F 759487100 NRXYSYKUYJXFLB-UHFFFAOYSA-N 446.504 4.442 10 10 IICE O=C1Nc2ccccc2C12CCC(NCc1ccc(N3CCN(CC4CC4)CC3)cc1)CC2 773145566 JVMSMRIEYNDODB-UHFFFAOYSA-N 444.623 4.141 10 10 IICE Cc1cc(Br)cc(Cl)c1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 777946339 HIFJKGIYMAXHRJ-UHFFFAOYSA-N 441.728 4.317 10 10 IICE Cc1c(Br)ccc2[nH]c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc12 1136311623 XBRBHSZOKIZICD-UHFFFAOYSA-N 446.320 4.145 10 10 IICE Cc1ccc(C(=O)NC[C@H](C)N2CCc3ccccc3C2)cc1-n1c(C)cc(C=O)c1C 1142897915 FNHRLMFTYOETDT-FQEVSTJZSA-N 429.564 4.392 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3c(O)cccc3O)c3ccccc3n2)cc1OC 1178905565 PAWPYSZFCMDLNU-UHFFFAOYSA-N 430.460 4.260 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)N=c1cc[nH]n1Cc1ccc(C(C)C)cc1 1192313812 DNCIVBIQQRCOTF-UHFFFAOYSA-N 432.568 4.267 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1)[C@H]1C[C@H]1C 1218450895 XDUJHHUVXLKCQB-HXOBKFHXSA-N 438.597 4.323 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 1230195213 LCDPKKPMLDVZFV-MRXNPFEDSA-N 437.510 4.254 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC(Cc2ccc(C(F)(F)F)cc2)C1 1253512045 QDZKCNUSPIXZNL-UHFFFAOYSA-N 447.501 4.051 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCO[C@H](C(C)(C)C)C1 1289422950 FBEODPYBDBTUIR-QFIPXVFZSA-N 434.588 4.014 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](COC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291538148 MFUINCUEKYUMRQ-TZIWHRDSSA-N 443.661 4.256 10 10 IICE Cc1cnc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(C)n(-c3ccccc3C)c2C)s1 1292841940 SJMKVJIIKRNJGN-IBGZPJMESA-N 440.594 4.321 10 10 IICE CC(C)N(CC(=O)NCc1ccc(F)cc1C(F)(F)F)Cc1ccc(N(C)C)cc1 1307424182 PAGWELVSDOXMTD-UHFFFAOYSA-N 425.470 4.437 10 10 IICE COC(=O)CC1(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CCCC1 1312590421 LBRIUZKVZCMSRR-KRWDZBQOSA-N 435.996 4.499 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)cc2)CC1 1312597913 FJTRKNQSTZQBIA-GHTZIAJQSA-N 433.383 4.101 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@H](OCC(F)(F)F)C2)cc1 1313674635 UTGPZUSBYOGLPO-IBGZPJMESA-N 425.499 4.029 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)COc2ccc(F)cc2F)C1 1355655300 AKMDQPXPZROUDP-QGZVFWFLSA-N 441.522 4.270 10 10 IICE CCOC(=O)c1cc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc([N+](=O)[O-])c1 1438181704 YGOLEYSOTFGISE-UHFFFAOYSA-N 435.480 4.152 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(-c3cnc[nH]3)cc2)NC(=O)OC(C)(C)C)cc1 1444512001 RIJPJJIVNLMDNR-JOCHJYFZSA-N 449.555 4.139 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C 1445651721 COBJNYRJBKWRHO-INIZCTEOSA-N 443.382 4.443 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1451666064 HEFDCIMBDFJOET-LPHOPBHVSA-N 439.547 4.001 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(F)(F)n1cc(-c2ccccc2)nn1 1463782965 DIFIDWGVNVRPQE-UHFFFAOYSA-N 425.483 4.143 10 10 IICE C[C@H](CC(=O)NCc1ccc2c(c1)CCCN2C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1464509975 FDLNHBNLGBDVAR-NQIIRXRSSA-N 429.605 4.359 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(OC(F)(F)F)c(Cl)c1 1465420485 JLODVLMNHQNBCX-UHFFFAOYSA-N 446.828 4.269 10 10 IICE Cc1ccc(I)cc1NC(=O)c1cc2cc(O)c(O)cc2s1 1466975143 MPRJTGRTFVZFOV-UHFFFAOYSA-N 425.247 4.478 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1csc(-c2ccccc2Cl)n1 1469230022 FANJVHWFZKYZIM-UHFFFAOYSA-N 430.913 4.375 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1cccc(CN2CCOCC2)c1 1472662459 UGAFYQKHNNQLRC-UHFFFAOYSA-N 431.492 4.270 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C3)cc2)CC1 1473252197 JSSKLVHZYIXZJD-CTNGQTDRSA-N 431.621 4.427 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NC(C)C 1501696722 UQSKJTWYZXTFSP-UHFFFAOYSA-N 436.604 4.360 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1512865452 QNJJMAINBIZOLL-OALUTQOASA-N 443.661 4.397 10 10 IICE CCOCc1nnc(N2CCC(CC(F)(F)F)CC2)n1Cc1ccc(N(C)C)c(F)c1 1516514771 KFKFASPSQDAYQI-UHFFFAOYSA-N 443.489 4.237 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 1525106804 MPZQHGOKXTVLSU-AUSIDOKSSA-N 443.950 4.257 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(F)(F)c3cccc(Br)c3)C2)cc1 1526247594 ZPPQEECUVWIYKG-CQSZACIVSA-N 439.300 4.192 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3cccc(OC(F)F)c3)cc2F)C[C@@H](C)O1 1527482580 ZFMVCNZQPBOPNA-IYBDPMFKSA-N 436.474 4.290 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CC[C@@H](C)C2 1529700775 HNFRANQGGQSXCD-ZIAGYGMSSA-N 444.528 4.180 10 10 IICE Cc1cc(CNC(=O)[C@]2(CNC(=O)OC(C)(C)C)CCCOC2)c(C)n1-c1ccccc1 1535142450 BCZFLMOWKPNEHH-VWLOTQADSA-N 441.572 4.032 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CO[C@@H]3C[C@@H](C)CC[C@H]3C(C)C)cc2F)CC1 1537534678 FYGUUJCYTXWEFJ-ZCVJKFOLSA-N 433.612 4.061 10 10 IICE COC(=O)c1ccc2c(n1)CN(C(=O)Cc1cc(C)n(-c3ccc(Cl)cc3)c1C)CC2 1537713993 AAONPWWJTIKAFP-UHFFFAOYSA-N 437.927 4.057 10 10 IICE Cc1cc(CC(=O)NCCc2nc(-c3ccccc3)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1556135889 PPZXQKRCULKLFX-UHFFFAOYSA-N 433.943 4.434 10 10 IICE CCCCN(CCC(=O)Nc1sc2c(c1C(N)=O)CCCC2)Cc1ccccc1O 1559790024 GHYXIDJGAAIWFJ-UHFFFAOYSA-N 429.586 4.062 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 1583917647 CJHAOTZKRWXXRQ-FQEVSTJZSA-N 443.519 4.282 10 10 IICE CC[C@@H](C)c1ncc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1585946374 YXEKVMJQXHOYDR-OMJMQIJPSA-N 444.557 4.359 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccc(F)cc1 1596578196 MCALOPQXTYHCMA-CRAIPNDOSA-N 429.536 4.466 10 10 IICE CN1CCN(c2ccc(CCNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)cc2)CC1 1613083167 YVCSNVGDJWCCKZ-UHFFFAOYSA-N 444.535 4.232 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CC3(CCCCCC3)[C@@H]2c2ccccc2)c1 1632255519 RFKMIKLAIKXMAK-NRFANRHFSA-N 428.554 4.301 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(I)cc3N)cc2)CC1 1633111123 NMBRKURPRXNNQW-UHFFFAOYSA-N 449.336 4.040 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](Cc3ccccc3)[C@@H](O)C(F)(F)F)ccc21 1633190435 YQMDFWSXWJUUEF-RBBKRZOGSA-N 448.485 4.169 10 10 IICE CC1(C)[C@H](c2ccc(F)cc2)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635997071 XGCKPNOJCNBOJX-IBGZPJMESA-N 447.501 4.418 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(NC(=O)C(F)(F)F)nc2)c1 1642321626 ZMSHPCHCCQCCEA-UHFFFAOYSA-N 430.430 4.228 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@H](C)Sc2ncc(C(C)(C)C)s2)c1 1643776019 SDMAAFAMHXWJIJ-NSHDSACASA-N 436.555 4.133 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCc4ncc(Br)n4C3)c2C)c1 1648685374 TUFQBWMXAKSQEO-MRXNPFEDSA-N 427.346 4.106 10 10 IICE Cc1cc(C(=O)Cn2cnc(-c3ccccn3)n2)c(C)n1-c1cccc(Br)c1 1656428336 ZOSJWFBEBOKJDC-UHFFFAOYSA-N 436.313 4.393 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)Cc3ccc(F)cc3)cc2Cl)C1 1681828581 UPBXWSXNKPEJOD-UZLBHIALSA-N 433.955 4.118 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cc(C)ccc3Br)C2)cc1 1682084412 PQSDNKZEMBSNGC-INIZCTEOSA-N 432.362 4.092 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCS[C@@H](C)[C@@H]1C 1693005549 JIAZSKQLCFSITB-OALUTQOASA-N 436.629 4.017 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(C(C)C)n2Cc2ccc3c(c2)CCCN3C)C1(C)C 1696191334 PSPPSCRHKJPAOF-FGZHOGPDSA-N 425.621 4.472 10 10 IICE CO[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C 1697691683 DKNNUANBMHNLAN-VGOFRKELSA-N 429.584 4.125 10 10 IICE CC(C)[C@H]1CCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C1 1706342824 UGNNOFQLUCKYRI-SFHVURJKSA-N 428.631 4.385 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(CCc5ccccc5)[nH]c4c3)CC2)cc1 1861865644 LRQPKNVGNZJPJN-UHFFFAOYSA-N 440.547 4.319 10 10 IICE CCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1Cc1cc(C)ccc1C 1862306740 KFYONCCJUHZXBH-UHFFFAOYSA-N 446.595 4.472 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCC(C)CC4)nc(-c4cccnc4)n3)CC2)cc1 1868004284 SHKCPNWMJSNHFE-UHFFFAOYSA-N 444.583 4.110 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc([N+](=O)[O-])cc1Br 1890480560 MTMKSRGPPHPBJU-HOCLYGCPSA-N 430.302 4.276 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2cccc(Br)c2O)C1 1952539167 UBSUCJILWRODLQ-YOEHRIQHSA-N 434.286 4.329 10 10 IICE CC[C@H](NCC1(COC)CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2178020894 ZZNWVPLQWMQHGX-INIZCTEOSA-N 443.382 4.079 10 10 IICE CSc1cccc(NC(=O)CN2C(=O)SC(=Cc3ccc(N(C)C)cc3)C2=O)c1 2293823856 IOUQYPYBMGKZJJ-UHFFFAOYSA-N 427.551 4.150 10 10 IICE CCCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(O)c(OC)c2)SC1=S 2314769048 NWKFNCIHMYNRNG-IBGZPJMESA-N 443.546 4.297 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]3CC[C@H]23)c1O 2358678375 YCDHLAUOJXBAEV-UHOFOFEASA-N 441.366 4.041 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@H](c2ccccc2Cl)N3)CC1 14466112 JNCQFZUXRIAJTR-IEGUWTFLSA-N 444.000 4.103 10 10 IICE COc1ccc(CCN2C(=O)c3ccccc3[C@H](C(=O)O)[C@H]2c2ccccc2O)cc1OC 20583474 FJWBMPGQFPUEPT-BJKOFHAPSA-N 447.487 4.017 10 10 IICE COc1cc(/C=C2/SC(=S)N(C(C)C)C2=O)ccc1OCC(=O)Nc1ccccc1 33606342 JRBOUPFKCVELTH-XDHOZWIPSA-N 442.562 4.322 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 226693985 FRVPGFYRPRNZIK-QEEYODRMSA-N 433.917 4.325 10 10 IICE CC1CCN(c2ccc(CNC(=O)NCCc3csc(N4CCCC4)n3)cc2)CC1 745810935 SKOBVRMSOSZPQB-UHFFFAOYSA-N 427.618 4.022 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCCC[C@H]3c3cccn3C)cc2F)C[C@@H](C)O1 746758648 NPFJWTCVPMGSSN-IXFSTUDKSA-N 428.552 4.215 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)NCc1ccnn1C 916570959 IJDZNGTUOGUSRW-IBGZPJMESA-N 431.462 4.415 10 10 IICE CC(C)(C)O[C@H](C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1 1127268072 QPVWIFAVDZKKBO-VWLOTQADSA-N 435.612 4.391 10 10 IICE C[C@@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1C(F)(F)F 1129661562 OSGVUGANISUORD-CYBMUJFWSA-N 428.401 4.240 10 10 IICE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1131781687 JWDUTTXYMJNALU-RUZDIDTESA-N 445.563 4.066 10 10 IICE C[C@@H]1C[C@@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCS1 1134491331 CFMCQMAODFCIJV-XFUXPEIASA-N 426.654 4.130 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)on2)c1 1134686823 XLSBVQBBIPTUGB-NRFANRHFSA-N 442.947 4.102 10 10 IICE CCOc1cc(O)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1138206509 KPXXUOLVBBCICU-WOJGMQOQSA-N 446.525 4.160 10 10 IICE O=C(NC[C@H](c1ccccc1)C1CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1159628493 ZVHWFNWVYNVNPR-LJQANCHMSA-N 442.562 4.178 10 10 IICE C[C@@H](COCC1CCCCC1)N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1176345709 NWGNBLNAKQQIIX-ROUUACIJSA-N 448.563 4.364 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1cccc(Cl)c1O)CCO2 1248109173 BTVLPGZZABZCHA-UHFFFAOYSA-N 447.919 4.497 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3ccc(Br)cc3F)C2)cc1 1252921798 BZLMJLWEBHRKNM-INIZCTEOSA-N 436.325 4.017 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1 1264933585 AIXFLQAPWPTBED-UHFFFAOYSA-N 431.920 4.316 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCN(C(=O)c3cc(C)cc(C)c3)C2)cc1F 1293224763 GNMNMYDUWAJYQO-OAQYLSRUSA-N 439.575 4.457 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2ncc(-c3ccccc3)[nH]2)cc1 1294558945 VKBZJXGPEJVAFX-UHFFFAOYSA-N 426.520 4.498 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2OC)cc1 1354542697 YPYMUASEFBHTGT-QFIPXVFZSA-N 441.572 4.424 10 10 IICE C[C@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CC(c2ccccc2Cl)=NO1 1441630633 KNCRUJLFXLETSW-JOCHJYFZSA-N 429.973 4.093 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc(CN4CCC[C@H]4C(N)=O)c3)c2C)c1 1442020462 WJXMOKSYGPQWKD-VWLOTQADSA-N 444.579 4.413 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCCc1cccs1 1457989324 LVYSPFVAKVCMCW-LGMDPLHJSA-N 434.583 4.228 10 10 IICE COC(=O)COc1ccc(N(C)Cc2cc(Br)ccc2OC(F)F)cc1 1459931862 HLMLUHFUQRTJII-UHFFFAOYSA-N 430.245 4.239 10 10 IICE CC(C)(C)c1nc(COC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)co1 1459995007 UXAVRUFPPRTADB-UHFFFAOYSA-N 434.404 4.013 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(Cc3ccc(C(F)(F)F)cc3)C(=O)C2)c1O 1460567131 PJRUMGRAATWJCQ-UHFFFAOYSA-N 440.849 4.111 10 10 IICE CCc1nc2ccccc2n1CCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1464598035 SLKXGTGCMRRXCZ-JOCHJYFZSA-N 434.584 4.263 10 10 IICE CN(C)[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Cl)cc1 1465952251 YVCVCTVBZPPQRF-PZJWPPBQSA-N 436.383 4.083 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CCc2ccc(O)cc21 1470248143 FBEDUQLMJDRIBU-KMTKGMGQSA-N 444.603 4.239 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1470248745 GGDNHQZIGRCHHO-SFHVURJKSA-N 439.510 4.051 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc4nc(C(C)(C)CO)[nH]c4c3)c2C)c1 1471018784 VDWASVPIBOWHJY-UHFFFAOYSA-N 430.552 4.479 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)O1 1479233068 UBFGYESWYYDSBQ-DZGCQCFKSA-N 439.272 4.186 10 10 IICE CCc1ccc([C@H]2CCCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)C2)cc1 1479344100 OEOZWKXCKVDCOY-DEOSSOPVSA-N 448.611 4.040 10 10 IICE CCc1nnc(N2CC[C@@H](OCC(C)C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1498992741 DDYMVQCHJSHMHV-HSZRJFAPSA-N 425.621 4.376 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccc(Cl)c(F)c1 1518808376 NXRGIYOPPOLZMP-JOCHJYFZSA-N 428.891 4.460 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCNC(=O)[C@H]2c2ccccc2)cc1 1529584413 TWWFENXXVPROIE-HSZRJFAPSA-N 427.508 4.481 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1Cc1ccccc1 1531792457 JMCXKAHXUJBEDY-LJBWOGQWSA-N 440.565 4.164 10 10 IICE O=C(/C=C/c1ccsc1C(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1535345520 BHMFQCPUPXZRJR-OWOJBTEDSA-N 432.414 4.211 10 10 IICE Cc1cccc(N2CCN(Cc3ccc(NC(=O)/C=C\c4ccc(O)c(O)c4)cc3)CC2)c1 1543836233 TUJUNKLBQBCVOP-WQLSENKSSA-N 443.547 4.380 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCS[C@H](C)[C@H]2C)cc1 1547446589 BRJQDOMRFHHCEA-SFHLNBCPSA-N 443.661 4.397 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](c3ccc(F)cc3)c3cnn(C)c3)c2C)cc1 1556265856 ONEDWLVCWLXFKH-DEOSSOPVSA-N 432.499 4.495 10 10 IICE Cc1cc(CNC(=O)CCCOc2ccc3c(c2)NC(=O)CC3)c(C)n1-c1ccccc1 1587885741 CMWFIAVXTBAXKF-UHFFFAOYSA-N 431.536 4.454 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 1610965369 GZDYLQBKXUCSQR-UHFFFAOYSA-N 428.508 4.177 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)[C@H]2CCSC2)cc1 1615381710 DUXIAVRIEGXWJO-QFIPXVFZSA-N 436.629 4.100 10 10 IICE CCOC(=O)[C@@H]1[C@H](C)C[C@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)[C@@H]1C 1623486209 AWKHUFKGPBUVIP-YPDQXUDRSA-N 440.584 4.353 10 10 IICE Cc1cc(C(=O)NCc2nc3ccccc3o2)c(C)n1-c1ccc(Br)cn1 1625382632 QMLRELPBFKXVIB-UHFFFAOYSA-N 425.286 4.323 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C1 1626511411 MODWZWLBBQAFHI-ZWKOTPCHSA-N 446.588 4.133 10 10 IICE CC[C@H](C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1)c1ccc(Br)cc1 1630202215 PINZUJIOAFMDSG-SFHVURJKSA-N 435.337 4.439 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 1631531450 RMMRDMPOAKTINV-KRWDZBQOSA-N 430.464 4.440 10 10 IICE Cc1ccc(C(=O)NC/C=C/CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1637212256 MHQCAWGWIAOWDK-BQYQJAHWSA-N 425.529 4.026 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)C1 1638251616 PTUQFMPDPNOZGQ-OAHLLOKOSA-N 446.569 4.422 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(F)nc2Br)cc1 1639136263 TXJUIXZSDNLCER-UHFFFAOYSA-N 444.304 4.062 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)C/C=C\c1ccc(Br)cc1 1639588204 XLVWYBPXRDOEIG-WAYWQWQTSA-N 432.314 4.150 10 10 IICE Cc1ccccc1[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCC(C)CC1 1644355211 ZVHYVEYFPLEBLP-DDRXVLGJSA-N 430.570 4.370 10 10 IICE Cc1nc(C)c(Br)c(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 1654991646 MYAKIMRCVROLEP-UHFFFAOYSA-N 445.283 4.323 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCCc2cc(Br)ccc2SC)c1 1685540076 IZRXLAWMOPERRQ-GFCCVEGCSA-N 439.375 4.488 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H]3[C@@H](COC)[C@@H]3C2)n1Cc1ccc(N(CC)CC)cc1 1694157392 CMSAMTFBXKYFBX-YJSIEXFISA-N 425.621 4.405 10 10 IICE Cc1ccc(CN(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)s1 1724345908 NKCIEXLUHMPEJH-LJQANCHMSA-N 425.602 4.211 10 10 IICE CCN(CC1CC1)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N(C)C)c(F)c1 1728457920 ZSKAPRZMJRGNAF-UHFFFAOYSA-N 428.943 4.483 10 10 IICE CCN(CCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1728503387 ALLANNKTHAFQDU-UHFFFAOYSA-N 447.631 4.307 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H](C)C1 1741112341 CQHLLZQUOFUVPR-RBUKOAKNSA-N 448.615 4.361 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H](C)Cc1cccs1 1764717408 UMWVHUPQFVZEHZ-LJQANCHMSA-N 439.629 4.254 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CC[C@@H](F)C3)CC2)cc1 1770258298 NKEJFBNDYRTCHV-RBUKOAKNSA-N 429.584 4.439 10 10 IICE CC[C@H](C)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858596652 YDAVXLYUGDVGAD-YXVQUMHESA-N 432.336 4.289 10 10 IICE COc1ccc(C2=NN(c3ccccn3)C(=O)/C2=C/c2cc(Cl)c(O)c(OC)c2)cc1 1865675157 RBIZCUDSEDPHBT-GZTJUZNOSA-N 435.867 4.292 10 10 IICE CN(CCN(Cc1ccccc1)c1cc2c(cc1Cl)[C@H](N)C(=O)N2)Cc1ccccc1 1946822835 SAURMVZZKCCTEN-DEOSSOPVSA-N 434.971 4.431 10 10 IICE CC(C)(C)OC(=O)c1nn(Cc2cc(C(F)(F)F)ccc2O)c(C(F)(F)F)c1N 2079162979 YCCNJLXNIBILGT-UHFFFAOYSA-N 425.329 4.212 10 10 IICE COc1cccc(Cn2nc(C3CC3)c(C(C)(C)C)c2I)c1O 2079777612 XDTPVSZWDWCQFO-UHFFFAOYSA-N 426.298 4.425 10 10 IICE CCCCc1nnc(NC(=O)CCN2C(=O)C(=Cc3ccc(C)cc3)SC2=S)s1 2296881995 FYYIPOLPVYCRQM-UHFFFAOYSA-N 446.623 4.419 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 2313549281 RPPHJUSTEMGXQZ-UHFFFAOYSA-N 437.795 4.175 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476158 BPZKKQIBBYQNHW-DAAPVNGYSA-N 443.525 4.204 10 10 IICE O=C(NN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)c1ccc(OC(F)F)cc1 33330464 HTKCQMBJKRPSPK-HASPRUBHSA-N 432.473 4.390 10 10 IICE CCc1nc2ccccc2c(=O)n1Cc1noc(-c2ccc(-n3c(C)ccc3C)cc2)n1 64867685 PVVYHBKOKYKFPV-UHFFFAOYSA-N 425.492 4.465 10 10 IICE COc1cc2c(cc1F)CN(C(=O)Cn1c3c(c4ccccc41)CN(C(C)C)CC3)CC2 436035984 RNTLMQSKAMZNRP-UHFFFAOYSA-N 435.543 4.140 10 10 IICE CN(CCCNC(=S)Nc1ccc(-c2nnc3n2CCCCC3)cc1)c1ccccc1 726435241 BTORSOGDFVFTAM-UHFFFAOYSA-N 434.613 4.484 10 10 IICE CNC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(CC(C)C)cc3)cs2)cc1 727248351 BMWMUEJRQZPYAA-UHFFFAOYSA-N 429.567 4.169 10 10 IICE C[C@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)c1cccc(NS(C)(=O)=O)c1 745671506 NHTPXAGESYALBV-KRWDZBQOSA-N 445.585 4.369 10 10 IICE COC1CCC(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 750083520 NMGYFKBVXSCQAQ-SFQUDFHCSA-N 438.640 4.051 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2CC(F)F)c(C)n1-c1cccc(Br)c1 804724142 JRZKSRYZEJBJJS-MRXNPFEDSA-N 427.289 4.353 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccnc(-n4ccnc4)c3)no2)C1 809400859 VQHYUBKFWFVNSQ-UHFFFAOYSA-N 439.523 4.087 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cnn(-c3ccc(Br)cc3)n2)cc1 1135946150 HKQOQGZZGNFSDE-UHFFFAOYSA-N 442.361 4.148 10 10 IICE Cc1cc(C(=O)NCCOc2ccccc2F)c(C)n1-c1ccc(Br)cn1 1136108550 SMZAKMYLZGSGCX-UHFFFAOYSA-N 432.293 4.200 10 10 IICE CCCOc1c(Br)cc(C(=O)NCc2ccc3cccnc3c2O)cc1OC 1142728506 WBMQAWFQOIPVIP-UHFFFAOYSA-N 445.313 4.430 10 10 IICE Cc1ccc(C(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1155390663 REEJXTNICJFEMU-OAQYLSRUSA-N 439.556 4.344 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3C(=O)NC(C)(C)C)cc2Cl)C1 1227208685 PPMIDTPVKILPFD-OXJNMPFZSA-N 435.012 4.165 10 10 IICE CC(C)(CC(=O)Nc1c(-c2ccccn2)nc2ccccn12)NC(=O)OCc1ccccc1 1265741529 VZSCKEBWJNIGPF-UHFFFAOYSA-N 443.507 4.430 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 1290290394 IYIWGEKUDDRDKE-UHFFFAOYSA-N 428.426 4.313 10 10 IICE Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)n1 1291766427 LZDZHAFFXIVBNS-NRFANRHFSA-N 430.552 4.217 10 10 IICE Cc1cc(C(=O)N2C[C@H](CO)Cc3ccccc32)c(C)n1-c1ccc(Br)cn1 1298334462 QILKXLQDVQNLDP-MRXNPFEDSA-N 440.341 4.063 10 10 IICE COC(=O)CN(Cc1ccc(OCc2ccccc2F)nc1)Cc1cc(Cl)ccc1O 1307539729 PRWFEANUDRBGOD-UHFFFAOYSA-N 444.890 4.334 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@H]1CCCCCN1C(=O)OC(C)(C)C 1312884376 JFIGZHGXOKITOF-DENIHFKCSA-N 446.636 4.471 10 10 IICE Cc1cc(CC(=O)N2CCC(n3cc(Br)cn3)CC2)c(C)n1-c1ccccc1 1359969924 ZQLJSBWTWISMOG-UHFFFAOYSA-N 441.373 4.459 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]2C)CCCC1 1436494143 XSDNWTTYGCAUII-QZTJIDSGSA-N 439.600 4.023 10 10 IICE COc1ccccc1N1CC[C@H](CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1442959835 PNURSANWGQTCMX-OAQYLSRUSA-N 445.563 4.480 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2cc(F)cc(Cl)c2)CCCC1 1448826495 SCXKKVNLEOBKMM-JOCHJYFZSA-N 430.907 4.171 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3[nH]c4ccccc4c3Br)C2)cc1 1452035061 YEEVMUVEJWCYMG-CQSZACIVSA-N 428.330 4.195 10 10 IICE COc1ccc(CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1465952304 ZYIWWCMZDYFQGV-SFHVURJKSA-N 437.367 4.421 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)NCCN(C)C)c(C)n1-c1ccc(C(C)C)cc1 1466597775 WVVLDAGYBRNXQR-DEOSSOPVSA-N 440.632 4.040 10 10 IICE Cc1ccc(C(=O)N2CCC(Oc3ncccc3F)CC2)cc1-n1c(C)cc(C=O)c1C 1467702280 IAIIUIFFKMBPBR-UHFFFAOYSA-N 435.499 4.433 10 10 IICE C[C@@H](NC(=O)N1CCC[C@@](O)(c2ccc(Br)cc2)C1)c1ccc(N(C)C)cc1 1478471002 LRSVWISHOFYBQP-ZHRRBRCNSA-N 446.389 4.269 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](c1cccc(Br)c1)N1CCCC1 1530833736 SZYQYPHIMXNBEM-OAQYLSRUSA-N 430.390 4.277 10 10 IICE Cc1c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cccc1N1C(=O)N[C@@H](C)C1=O 1532720528 DYNULNNWXXHFCH-KRWDZBQOSA-N 430.508 4.028 10 10 IICE CN(C)c1ccc([C@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])N(C)C)cc1 1559298580 ZTKXCJQOUYUBTF-HNNXBMFYSA-N 447.408 4.425 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCC(=O)C(C)(C)C)NC(=O)OC(C)(C)C)cc1 1565882263 ULAAUPZCYRSFAR-LJQANCHMSA-N 433.593 4.220 10 10 IICE COC(=O)C[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(F)cc1 1597375515 HHKBMIFEXNEUGL-HSZRJFAPSA-N 436.483 4.009 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2ncc(-c3ccccc3Cl)o2)N(C)C)cc1 1616858200 IZBWPFPVNJXTKG-NRFANRHFSA-N 440.975 4.413 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(NC(=O)CC(C)C)ccc3Cl)C2)cc1 1617263373 VVGBMYPARCWRCE-QGZVFWFLSA-N 429.948 4.342 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCCOC(F)(F)F 1617940951 LSTAGGXNAVNPIO-UHFFFAOYSA-N 426.464 4.199 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1 1624220627 KTMFXJNXCAMXRX-HKUYNNGSSA-N 439.556 4.282 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1c[nH]cc1-c1cc(Cl)c2c(c1)OCCO2 1624480233 SNDIFRUOLUZFMR-UHFFFAOYSA-N 425.916 4.445 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(Cl)nc(C(F)(F)F)c3)cc2F)C[C@@H](C)O1 1625090620 VYJPGPVDWFZJIM-VXGBXAGGSA-N 445.844 4.437 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)cc4nc[nH]c34)cc2)CC1 1627467748 PVPVWYSSNXDJQC-UHFFFAOYSA-N 427.346 4.492 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)CNC(=O)OC(C)(C)C)c(C)n1-c1ccc(C(C)C)cc1 1627896671 VJGBKCCFLSBYHB-NRFANRHFSA-N 443.588 4.175 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(Br)cn(C2CC2)c1=O 1628873884 PEQQSELYNBIBSB-UHFFFAOYSA-N 444.373 4.208 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)C(=O)OC3)c(C)n1-c1ccc(Br)cn1 1629021384 VFVKXCDGMMYGKJ-UHFFFAOYSA-N 426.270 4.174 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCC(=O)N(c2cccc(F)c2)C1 1635677020 UEWSIGIBRIWLMD-CQSZACIVSA-N 449.320 4.086 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(F)c(F)c1O 1638618576 NTCBDJAPFZUBLN-ZROIWOOFSA-N 438.452 4.040 10 10 IICE COC(=O)/C=C/c1ccc(N2CC(Cc3ccc(Br)cc3)C2)c([N+](=O)[O-])c1 1640490267 XLWWVLHZJSNTDD-WEVVVXLNSA-N 431.286 4.222 10 10 IICE CCn1c(O)nnc1SCC(=O)c1cc(C)n(-c2ccc(Br)c(C)c2)c1C 1643430710 UBRULXPWLCCVRH-UHFFFAOYSA-N 449.374 4.457 10 10 IICE COc1ccc(Cn2nnnc2SCC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1643586781 ZCDQNFVPJQYFLW-UHFFFAOYSA-N 447.564 4.421 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3CCC[C@H]3c3ccccc3C(F)(F)F)nc12 1645315131 SQDHUWUAQLCBNK-YJBOKZPZSA-N 448.445 4.056 10 10 IICE CC(C)Cc1ncnc(NCc2ccc3cccnc3c2O)c1I 1651959584 WLDBCGGIDKVIQB-UHFFFAOYSA-N 434.281 4.146 10 10 IICE COc1ccc(N(CC(=O)N(C)CCOc2ccccc2F)Cc2cccs2)cc1 1653578539 WCWXGISPMJPGQQ-UHFFFAOYSA-N 428.529 4.440 10 10 IICE O=C(NCCc1sccc1Br)N(Cc1ccccc1O)C[C@@H]1CCCO1 1684867882 SEGMTGQXHNIKRU-HNNXBMFYSA-N 439.375 4.150 10 10 IICE O=C(NCc1ccc(Br)cc1[N+](=O)[O-])NCc1cc(Cl)cc(Cl)c1O 1684979905 UAPSHQNRNFGOAE-UHFFFAOYSA-N 449.088 4.369 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC3(c4ccc(F)cc4F)CCCC3)C2)cc1 1686182762 DUELGJSOGVPYJU-GOSISDBHSA-N 429.511 4.363 10 10 IICE Cc1ccc(O)c(CNC(=O)NCC[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1 1687328666 MKKPGDIHCOQECN-FQEVSTJZSA-N 427.545 4.026 10 10 IICE CCCCN(CCOC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1695214899 GZERYGPBISWGHG-UHFFFAOYSA-N 445.677 4.430 10 10 IICE CCOC[C@@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1696381231 TXTVQIGIWAHUEB-PZJWPPBQSA-N 443.661 4.256 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CC=CCC3)CC2)cc1F 1697471720 LYAHHJZGHBENDJ-IBGZPJMESA-N 427.568 4.307 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)CC1CC1 1707304839 HTOGJKABKYHEKN-UHFFFAOYSA-N 443.393 4.305 10 10 IICE CO[C@@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1711583326 MDLXZMXJQZVFTO-YADHBBJMSA-N 441.620 4.427 10 10 IICE CC(C)Cc1nnc(N(C)OC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1741439085 QSWHOFQBFLUGBL-UHFFFAOYSA-N 441.620 4.044 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)NC)CC1 1765669479 ATSVNIAIJMNQCV-UHFFFAOYSA-N 449.603 4.004 10 10 IICE COCCN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1771073328 NOVWKTVSZVOCER-UHFFFAOYSA-N 439.629 4.298 10 10 IICE Nc1ccc(OC(=O)Nc2ncccc2OCC(=O)Nc2ccccc2C(F)(F)F)cc1 1858682907 PTMRDBVHGHLQFO-UHFFFAOYSA-N 446.385 4.311 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(c3cccc(O)c3)C2=O)cc1 1860075119 IXJYHCRVZNSIFY-XDHOZWIPSA-N 442.562 4.045 10 10 IICE CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1860600727 DBUVMTGGAGBIJZ-UHFFFAOYSA-N 434.492 4.048 10 10 IICE O=C(CNCc1ccc(Cl)c(Cl)c1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1860718388 PCQMCTJZOWPLEE-UHFFFAOYSA-N 439.298 4.497 10 10 IICE CCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1-c1ccccc1Cl 1862307853 XMODCMBRNKLFHF-UHFFFAOYSA-N 438.959 4.449 10 10 IICE Cc1c(C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cnc(N(C)C)c1Br 1891036788 SEDYFGVKXPIGDM-WMZOPIPTSA-N 443.389 4.137 10 10 IICE O=C(N[C@H]1CC12CC(NCc1c(O)cccc1Br)C2)OCc1ccccc1 2026141773 GQKSXFSDZITYCD-RNFHDMOYSA-N 431.330 4.092 10 10 IICE CN(Cc1ccccc1I)c1ccc(CN)c(Br)c1 2265606797 FFDDHONJMZZYFF-UHFFFAOYSA-N 431.115 4.149 10 10 IICE O=C(CN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1ccc2nccnc2c1 2296586624 YSKQXAFZJRKUPE-UHFFFAOYSA-N 440.937 4.123 10 10 IICE CCOC(=O)COc1ccc(C=C2C(=O)N(c3ccccc3Cl)N=C2C)cc1OC 2297100776 HMSCXSRHWXXISJ-UHFFFAOYSA-N 428.872 4.097 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3cccc(Cl)c3)C(C(=O)OC)=C2C)cc1 2297315353 NGJOCCQONMMTEK-UHFFFAOYSA-N 425.868 4.394 10 10 IICE CCCN(CCC)c1ccc(C=C2C(=O)NC(=O)N(c3ccc(OCC)cc3)C2=O)cc1 2313547944 HCJFDJMLJOFOSB-UHFFFAOYSA-N 435.524 4.378 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)c(F)c4)c3C)C2=O)cc1 8644080 IADIMHFTTVRDFI-SANMLTNESA-N 447.510 4.500 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3F)cs2)cc1)C(F)(F)F 727249874 CIYOOFDZFFUCDR-UHFFFAOYSA-N 445.419 4.251 10 10 IICE CN(C)C(=O)c1ccc(NC(=O)CN2CCCc3cc(OCc4ccccc4)ccc32)cc1 734486424 MAUMYFLKLVJLPQ-UHFFFAOYSA-N 443.547 4.359 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(Cn2ccccc2=O)cc1 745768568 ZJFXHTOUQNFLCX-UHFFFAOYSA-N 432.568 4.083 10 10 IICE CC(C)(c1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1)C(F)(F)F 764842316 ZFSPJRSNKZTJIH-UHFFFAOYSA-N 433.474 4.481 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCCOc2c(Cl)cccc21 775727616 VJQDCPSYVLMGCO-LJQANCHMSA-N 433.911 4.029 10 10 IICE Cc1nc(-c2ccc(CNC(=O)N(C)Cc3ccc(N4CCOCC4)cc3)s2)cs1 789918377 CFSWIONSTOPREM-UHFFFAOYSA-N 442.610 4.358 10 10 IICE COc1ccc(-c2nc3c(s2)[C@@H](NC(=O)NCc2ccc(OC)cc2O)CCC3)cc1 793001735 QHIUCWKPAKMFJV-IBGZPJMESA-N 439.537 4.410 10 10 IICE Cc1nccn1-c1ccc([C@H](C)NC(=O)NCc2cc(Br)ccc2O)cc1 806938119 GXCYKYVADHFKRU-ZDUSSCGKSA-N 429.318 4.209 10 10 IICE CC(C)N(Cc1c(O)ccc2ccc(O)c(CN(C(C)C)[C@H]3CCOC3)c12)[C@H]1CCOC1 812291643 PDUSBVVHWXLVGW-SFTDATJTSA-N 442.600 4.250 10 10 IICE Cc1ccc(O[C@H]2CCN(Cc3cc(Br)cc(Br)c3O)C2)nc1 858013596 UMLCNUNIUCDVLH-AWEZNQCLSA-N 442.151 4.274 10 10 IICE C[C@H]1CN(c2ccc(CNc3ccc(/C=C\C(=O)O)cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 917087271 VQFJIPVFOLUFRX-ZMAHGOAUSA-N 429.448 4.057 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(C)(C)n1cc(NC(=O)OC(C)(C)C)cn1 1129973186 DBCXCSHIFODUMM-QGZVFWFLSA-N 443.592 4.087 10 10 IICE COc1cccc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1C 1130947862 KMMBDPTYCJSPBE-XDHOZWIPSA-N 445.537 4.477 10 10 IICE COCc1nc(OC)c2c(C)c(C(=O)N(C)Cc3ccc(N4CCCC4)cc3)sc2n1 1135800474 HCBBDHYCRIAACR-UHFFFAOYSA-N 440.569 4.027 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3cccc(CN4CCO[C@@H](C)C4)c3)c2C)cc1 1142116264 NXMFAPIBKZDALO-FQEVSTJZSA-N 447.579 4.253 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1C[C@H](c2ccccc2Cl)C1 1228876480 UOLMBIPXIFJKCY-MXVIHJGJSA-N 427.976 4.294 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@H]3CCN(c4ccccc4F)C3=O)c2C)c1 1234328767 YYCGZULQFKJDFH-DEOSSOPVSA-N 448.542 4.489 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCOC12CCCCC2 1289485788 MTLOXNZVDIKQDE-UWXVCKHVSA-N 448.585 4.025 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2c3ccoc3CCN2C(=O)OC(C)(C)C)cc1F 1293225103 MCIKFNFWHLCCNU-OAQYLSRUSA-N 445.535 4.416 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)c(C)n1-c1cccc(Cl)c1 1295255021 YSGOLWKXJKWBAT-QGZVFWFLSA-N 427.854 4.031 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1c1ccc(Cl)c(F)c1 1295562443 KGVMMJGLEWDPSE-PKOBYXMFSA-N 445.882 4.122 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3Cc3sccc3C)CC2)cc1F 1300248122 VGDUEKGMSYQMSE-UHFFFAOYSA-N 429.565 4.294 10 10 IICE Fc1cc(CNc2ncnc3cc(Br)sc23)cc(F)c1N1CCOCC1 1307137669 FEEWQQHTZZODNQ-UHFFFAOYSA-N 441.301 4.181 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(N(C)C)cc1 1307695739 PAXSMBQMPAFLSB-DLBZAZTESA-N 441.531 4.206 10 10 IICE COCC1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1315921608 TWVZJOGXFWYHPL-UHFFFAOYSA-N 429.584 4.127 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cccc4nc(O)n(CC(C)(C)C)c34)CC2)cc1 1358140312 JYOBJBMVDCGDHQ-UHFFFAOYSA-N 436.556 4.149 10 10 IICE C[C@H](NC(=O)c1ccccc1-n1ncc(Cl)c(Cl)c1=O)c1ccc(N(C)C)cc1 1435947253 IOWXFVNFTDUZSP-ZDUSSCGKSA-N 431.323 4.096 10 10 IICE Cc1cc(CC(=O)Nc2nccc(F)c2I)c(C)n1-c1ccccc1 1437671097 ZGHWYKSZPLTNQR-UHFFFAOYSA-N 449.267 4.414 10 10 IICE CC1CCN(c2ccc(CNC(=O)C[C@@H]3CSCCN3C(=O)OC(C)(C)C)cc2)CC1 1443666518 RKYCZQVKALQVRT-OAQYLSRUSA-N 447.645 4.282 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@H](C)[S@]1=O 1449309689 NXVMYUCJYKXLAE-LKOFHKMLSA-N 437.403 4.228 10 10 IICE Cc1cc(C(=O)N2CC3(CCCC3)OC[C@H]2CN(C)C)c(C)n1-c1ccc(Cl)cc1 1454063681 KXFRSEZUSXHMOH-OAQYLSRUSA-N 429.992 4.463 10 10 IICE O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1Cc2cccc(O)c2C1 1455037330 PLQDEYCANFJWRT-UHFFFAOYSA-N 446.887 4.142 10 10 IICE COC1CCN(c2ccc(CN3CCCC[C@H]3COC(=O)NC3CCCC3)cc2)CC1 1460193313 CTITZQQEPCWNAV-QHCPKHFHSA-N 429.605 4.325 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@H](C(=O)OC(C)(C)C)CC[C@H]2C)CCCC1 1461021428 FTLJBPZVXDCXFM-QZTJIDSGSA-N 440.584 4.498 10 10 IICE O=C(Cc1cccnc1)Nc1ccc(C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1 1465841373 UUAYBJOSQORJNC-UHFFFAOYSA-N 441.487 4.404 10 10 IICE Cc1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C)n1C[C@@H]1CCCOC1 1466290285 VNJAETVHPMLPAN-UNMCSNQZSA-N 426.557 4.059 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3C[C@H]3c3ccc(Br)cc3)C2)cc1 1478547938 DYXKKDZUAUIUKL-ONGXBYRLSA-N 444.373 4.139 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1)OC 1504577172 CYPTZULEDKFRIL-QFIPXVFZSA-N 435.572 4.170 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CCO[C@@H](C)C2)cc1 1515527656 MDIZLXMHWWVJCN-KRWDZBQOSA-N 440.979 4.113 10 10 IICE CC(C)(C)CC(C)(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1526480331 CHEUFZONTOMICF-UHFFFAOYSA-N 427.568 4.021 10 10 IICE CC(C)c1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(F)cc1 1539705003 DQCMOWKDNQGHNG-QHCPKHFHSA-N 437.563 4.234 10 10 IICE C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N[C@@H]4CCCC[C@H]43)c2C(=O)OC(C)(C)C)C1 1539725181 QIXLXCLMCHHDMI-YALNPMBYSA-N 446.613 4.462 10 10 IICE CCN1CCN(Cc2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc2)CC1 1540773272 GMXWWHZGGSDTMM-UHFFFAOYSA-N 444.579 4.296 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1C[C@@H](C)O[C@H](C)C1 1543645830 USEGLLXXJWEJJG-WOJBJXKFSA-N 441.620 4.078 10 10 IICE CC(C)(C)OC(=O)NC[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1ccc2ccccc2c1 1556091253 HWNHYUZMSMCXDW-FQEVSTJZSA-N 436.508 4.176 10 10 IICE Cc1cc(C(=O)N[C@H](C)CC(=O)c2ccco2)c(C)n1-c1ccc(Br)cn1 1566416675 YJKQOFJYARAILQ-GFCCVEGCSA-N 430.302 4.236 10 10 IICE Cc1cccc2c(=O)n(CC(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)cnc12 1566846328 RPZCFGVBZNFEPN-IBGZPJMESA-N 427.504 4.201 10 10 IICE Cc1cc(C(=O)NCC2CCN(C3CC3)CC2)c(C)n1-c1cccc(Br)c1 1568418052 RCIYHGMKEYQHAG-UHFFFAOYSA-N 430.390 4.461 10 10 IICE Cc1cc(C(=O)N2C[C@H](O)C[C@@H]2c2ccccc2)c(C)n1-c1ccc(Br)cn1 1570266380 NJLVSFYAPQQZCP-UYAOXDASSA-N 440.341 4.200 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@@H]1CC1(Cl)Cl 1586884500 KKFFWPRXLLHWHN-OJLMPMFISA-N 447.384 4.117 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccccc1 1587461622 RYFFXJQBNWWVTQ-VWLOTQADSA-N 443.591 4.234 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(-c4ccccc4Cl)noc3C)CC2)c(OC)c1 1587487309 ZGKILRPXJLMSRI-UHFFFAOYSA-N 441.915 4.283 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCC[C@H](O)C1 1603303957 XFEZSQKBLOCHCJ-GMAHTHKFSA-N 425.621 4.264 10 10 IICE CCC[C@H](C)CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1614363554 FCAXIEVKFPLHJX-REWPJTCUSA-N 441.620 4.277 10 10 IICE CCOC(=O)N[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)CC(C)C 1625458927 REOZJLYJIXCFMU-NRFANRHFSA-N 427.545 4.106 10 10 IICE Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1627464076 IVKQPMUUZOSLGF-VWLOTQADSA-N 444.579 4.346 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1cccc(OC)c1 1628948023 KUNSVNBZEVKYQZ-AREMUKBSSA-N 448.519 4.124 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3ccc(OC(C)(C)C)cc3)CC2)cc1F 1633456236 KGQYEWSXMXEWMW-UHFFFAOYSA-N 429.536 4.086 10 10 IICE C[C@H](NC(=O)c1ccc2c(c1)OCCN(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 1634448207 LZFCMRHALJIMBO-KRWDZBQOSA-N 439.556 4.373 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCC2(OCCO)CCC(C(F)F)CC2)c1 1636328748 BIYPGYZMQSJFJE-UHFFFAOYSA-N 434.527 4.335 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1csc(Cc2ccc(Cl)cc2)n1 1638529130 FSFKZXLGIGDOBG-UHFFFAOYSA-N 444.940 4.298 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(Oc2ccc(Cl)cn2)c1 1639588223 YNAMELJKIHJPHI-UHFFFAOYSA-N 440.883 4.438 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@]1(F)c1ccccc1 1639654185 SYGOVPONFHSMAT-UVJPYSIPSA-N 444.528 4.171 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)s1 1640238488 RWPLPEFVYDCHPB-IRXDYDNUSA-N 439.585 4.210 10 10 IICE CN(C)c1ccc([C@H](CNc2ncnc(C(F)(F)F)c2Br)N(C)C)cc1 1652309598 CHABUJLUAOGTDM-ZDUSSCGKSA-N 432.288 4.039 10 10 IICE CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1671424419 BUMRXAQEMSNVHT-UKILVPOCSA-N 448.611 4.147 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4cccc(F)c4)CC3)C2)cc1 1673823599 WABJGRYSWVKEND-NRFANRHFSA-N 425.548 4.325 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](O)c2cc(F)cc(Cl)c2)c(C)n1-c1ccccc1 1674922609 CNNPNFXKOBGBKM-QFIPXVFZSA-N 429.923 4.462 10 10 IICE Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1681801385 SQIVIHOWQNPCJG-SFHVURJKSA-N 439.581 4.064 10 10 IICE CCCCN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H](C)c1ccc(C)o1 1685327317 ATQPKNWCENOWQL-LJQANCHMSA-N 440.588 4.363 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@@H](C)CCc2ccc(I)cc2)c1 1686343710 YBUWTPIFHCDOLN-AWEZNQCLSA-N 438.309 4.126 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694024500 HSIZZLIPFCMVHY-MJGOQNOKSA-N 429.584 4.176 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H]3C)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1724198263 NFEVNJMKBBSFME-SFHVURJKSA-N 434.588 4.210 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1 1748076650 ZBFBLAOCLCVZEL-HDICACEKSA-N 448.615 4.217 10 10 IICE CC(C)N(C)CCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750885163 USVBHDDIMQOPDZ-HSZRJFAPSA-N 440.636 4.097 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCc1nc(C)no1 1752610334 WQGHBLLUGVWUPF-GOSISDBHSA-N 437.592 4.352 10 10 IICE CC(C)[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1760953673 OLSHZNQECNYHOS-IBGZPJMESA-N 429.584 4.082 10 10 IICE CCN(c1nnc([C@@H]2CCC(=O)N2)n1CCCSc1nccs1)C1CCCCC1 1764787639 GLJWLLQQFDRHJJ-INIZCTEOSA-N 434.635 4.027 10 10 IICE CCc1nnc(N2CCO[C@@H](c3nc(C)cs3)C2)n1Cc1ccc(N(CC)CC)cc1 1764949514 RWWZWOVWXCYRPV-HXUWFJFHSA-N 440.617 4.078 10 10 IICE COc1ccc(C(=O)c2ccccc2NS(=O)(=O)c2ccc(OC)c(Cl)c2)cc1 1858034790 AKLAHNHVUALGAM-UHFFFAOYSA-N 431.897 4.389 10 10 IICE CCCCOCCCN1C(=O)/C(=C\c2cc(OC)c(OC)c(OC)c2)SC1=S 1858587704 WAEUSBZPVWBSRV-GHRIWEEISA-N 425.572 4.120 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCOC(C)C)C2=O)cc(Br)c1O 1858589905 OUWRJIOGYSZCPF-NTEUORMPSA-N 446.388 4.180 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)/C2=C/c2cccc(OC)c2O)cc1 1865658984 XVVDWLYIRVKFFT-XSFVSMFZSA-N 432.451 4.379 10 10 IICE O=C(OCc1ccccc1)N1CCC[C@@H](NCc2cc(Br)cc(F)c2O)C1 1948128446 CTHQFXWGNMEWOJ-QGZVFWFLSA-N 437.309 4.185 10 10 IICE Cc1ccc(C(=O)NN2C(=O)C(=Cc3cccc(Br)c3)SC2=S)cc1 2297219747 GUMULBSGKTWCED-UHFFFAOYSA-N 433.352 4.304 10 10 IICE COC(=O)c1ccc(N2N=C(C)C(=Cc3ccc(-c4cccc(C(=O)O)c4)o3)C2=O)cc1 2297307396 APGHUSHARVDNKF-UHFFFAOYSA-N 430.416 4.238 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Br)c3O)C2=O)c1 2313510444 HJEGDPLYPFWVOM-UHFFFAOYSA-N 449.688 4.091 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2ccccc2O[C@@H](C)C(=O)O)SC1=S 2314932592 WYENURKPOFQNRK-ZDUSSCGKSA-N 429.519 4.343 10 10 IICE COc1ccc(OC)c(C=C2SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)c1 2321630811 VERYRELTLZGCLY-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CCCN(CCC(=O)NCc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2352620410 PWJIANUSZJDMTG-UHFFFAOYSA-N 429.355 4.117 10 10 IICE Cc1ccc(CNCC2CC(F)(CNC(=O)OC(C)(C)C)C2)c(O)c1Br 2352932873 SHLNAJBJHCXVNR-UHFFFAOYSA-N 431.346 4.196 10 10 IICE CC=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135959 YOEYHQXPUUPJRC-OAHLLOKOSA-N 441.366 4.281 10 10 IICE COc1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(C(=O)O)cc3)C2=O)cc1OC 2430139 YHJSSUBDBNNLKW-XSFVSMFZSA-N 428.444 4.237 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(c3ccc(C(F)(F)F)cn3)CC2)cc1 15536045 WSZJBIFRPBPCNQ-UHFFFAOYSA-N 428.458 4.470 10 10 IICE CC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C/c1ccc(OC(=O)c2cccs2)cc1 104968744 SWTMHFOJGODJSH-XDHOZWIPSA-N 432.457 4.472 10 10 IICE COc1cc(C2(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)CC2)ccc1C 116382485 MCHMYXUBQCMRIF-HDICACEKSA-N 426.532 4.104 10 10 IICE Cc1ccc(OCCN(C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726718043 JLXZQKDMDKIOQJ-UHFFFAOYSA-N 433.499 4.286 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3cc(C)c(C)cc3C)cs2)cc1 733731505 OGAALHHEYNARIF-UHFFFAOYSA-N 430.551 4.252 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1F 743323810 QUOSNLXKDSDXEB-LJQANCHMSA-N 429.536 4.034 10 10 IICE COc1cc(CCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc(OC)c1OC 746425257 HEWNHTDVXMCVPG-UHFFFAOYSA-N 436.552 4.411 10 10 IICE O=C(NCc1cccc(Br)c1O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 764780736 SDRJKLUSTQIBSG-YQQQUEKLSA-N 444.373 4.150 10 10 IICE CCN(CC)c1ccc(CNc2cc(F)ccc2N2CCCN(C(C)=O)CC2)cc1F 790932086 UJAUFPDLBMJIEF-UHFFFAOYSA-N 430.543 4.482 10 10 IICE COc1cc(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)c(OC)c1 800573346 QKSCIPKYZJWQJM-HNNXBMFYSA-N 435.471 4.404 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C1CCN(C(=O)N(C)Cc2ccccc2)CC1 801548363 TYVDHZPOCSMVBN-UHFFFAOYSA-N 437.584 4.485 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cc(N2CCCC2=O)ccc1Cl 806189424 KAJBATTZGBIMBI-UHFFFAOYSA-N 438.709 4.257 10 10 IICE O=C(N[C@@H]1C[C@@H]1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)OCc1ccccc1 814177172 XXEVBKGAUNDJNA-CLJLJLNGSA-N 449.595 4.050 10 10 IICE Cc1cccc2c1CN(C(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)CC2 1127937651 WXDLYUMERLTGQU-MOSHPQCFSA-N 440.565 4.310 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C)c(Br)c3C)CC2)c(OC)c1 1132032028 HVMMDVCYKYWUDX-UHFFFAOYSA-N 433.346 4.046 10 10 IICE C/C(=C\C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(C(F)(F)F)c1 1133626346 HXRCQZMYVFBGNI-DTQAZKPQSA-N 445.485 4.127 10 10 IICE CC(C)Cn1ncc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1-c1ccccc1 1134686116 ASYWXOWFRCKWPR-DEOSSOPVSA-N 433.600 4.305 10 10 IICE COc1ccccc1Oc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)nc1 1137728280 ZFMCBIXBLLWOBA-FQEVSTJZSA-N 434.492 4.410 10 10 IICE Cc1ccc(C(=O)N(Cc2ccc(C(N)=O)cc2F)C2CC2)cc1-n1c(C)cc(C=O)c1C 1141556482 ZAHMVZWKXWKWHX-UHFFFAOYSA-N 447.510 4.258 10 10 IICE COc1cc(/C=C(\C(=O)N2CCOc3cc(N(C)C)ccc32)c2ccccc2)ccc1O 1147888730 VHRUTLGCPZXWMU-QNGOZBTKSA-N 430.504 4.433 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]2C)c1 1152644580 SRKNPRZOKWWIDL-ZWKOTPCHSA-N 439.556 4.377 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@H](C)[S@]1=O 1157481654 CAPKRZJTMTZFGE-BGEIZFTASA-N 437.403 4.228 10 10 IICE CCOC(=O)C1([C@H](C)NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)CCOCC1 1157687382 UQHILLDHFRAGJK-KRWDZBQOSA-N 432.948 4.226 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1(Cc2ccccc2)CCCC1 1229782120 SFXQUWRTSZAGEB-UHFFFAOYSA-N 429.511 4.156 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N(C)Cc1ncc(Cl)n1C 1304238150 KXASWJVXNOJHOE-UHFFFAOYSA-N 444.027 4.313 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1312405838 XNEDFLWRZCLKAM-IEBWSBKVSA-N 447.023 4.309 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(CNC(=O)NCc2cccc(Cl)c2O)c(F)c1 1312957296 DTJHGPQUHPGZCZ-UHFFFAOYSA-N 437.899 4.209 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1C 1313548845 ZZDOSGBMGJIERM-PKOBYXMFSA-N 434.588 4.066 10 10 IICE Cn1ccc(Nc2nnc([C@@H]3CCO[C@H]3C(C)(C)C)n2CCCSc2nccs2)n1 1314911333 AGXUIDBYFOACCR-GDBMZVCRSA-N 447.634 4.313 10 10 IICE COCC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1315991854 LSORNCZHBDTDGD-FPOVZHCZSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCCN(C(=O)CSc3ccccc3Br)CC2)cc1 1356396738 FCJKYLADNHRZAX-UHFFFAOYSA-N 435.387 4.289 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccccc3OC3CCCCC3)cc2)C1 1356433500 NQZIPHUOTYPJJP-HXUWFJFHSA-N 435.568 4.030 10 10 IICE COc1ccc(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1F 1357313648 KLRRWBURGHKUBR-LICLKQGHSA-N 435.473 4.170 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1cc(COC(C)(C)C)on1 1359780969 PBKIESBAUDAVET-UHFFFAOYSA-N 427.549 4.170 10 10 IICE COc1ccccc1Cn1cnc2cc(C(=O)NCc3ccc(N(C)C)cc3C)ccc21 1360075474 FLMHGCGEKHUPMB-UHFFFAOYSA-N 428.536 4.398 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCNC(=O)c2ccc(F)cc2)cc1 1360346783 QGVHFNMGUFMBAR-UHFFFAOYSA-N 433.487 4.467 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)OCc1noc2c1CCCC2 1436982739 YWCCLKKRHKHHPT-WOJGMQOQSA-N 446.525 4.027 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCSc3ccccc3Br)C2)cc1 1437575328 GTRKDPPZTSZUKP-OAHLLOKOSA-N 435.387 4.335 10 10 IICE Cc1nc(SC(F)(F)F)sc1CC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1442413040 PRCWJLIUJNYTIR-GFCCVEGCSA-N 445.532 4.320 10 10 IICE Cc1ccc(C(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1450032309 MCSUOBZDIGENTF-HSZRJFAPSA-N 431.536 4.164 10 10 IICE Cc1cc(CN2CCNC(=O)[C@@H]2c2cccc(Br)c2)ccc1N1CCCCC1 1459769000 HOIRPXUQKCSWQI-QFIPXVFZSA-N 442.401 4.421 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)CC2=O)cc1 1461076864 LJCJYJAIXIFIAD-YADHBBJMSA-N 449.595 4.033 10 10 IICE CSc1nnc(CCCNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)n1CC(C)C 1464129360 OCFHGJTWVJMLJK-UHFFFAOYSA-N 439.629 4.355 10 10 IICE COc1cccc(CNC(=O)c2ccc(Cn3cc(Cl)c(C(F)(F)F)n3)cc2)c1O 1465992055 HMMOGZXTEKUYOV-UHFFFAOYSA-N 439.821 4.248 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](CC(=O)N(C)C)c3ccccc3)c2C)c1 1470208386 LNTNSZPBAVXNEV-DEOSSOPVSA-N 432.568 4.421 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)OC3(CCC3)C2)sc(C)c1-c1ccccc1 1473607446 RHGXXAAVAPFHIH-MRXNPFEDSA-N 442.581 4.482 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)CC1 1494742238 XJUBPWTVOIJSFQ-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCCSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1495190340 KXAZNALMBYLVRF-QGZVFWFLSA-N 435.613 4.005 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1516644410 RCBGWYFEAOZYKA-FYYLOGMGSA-N 441.620 4.277 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3CSC[C@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1526004333 ZOGPELUQNQFKFU-SGLNWRHMSA-N 428.573 4.202 10 10 IICE Cc1sc(Br)nc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533328095 GDGGHWDXPWFQIM-LLVKDONJSA-N 446.317 4.214 10 10 IICE CC(C)(Oc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1533992111 KMYTXKRQPVNRID-UHFFFAOYSA-N 442.003 4.346 10 10 IICE CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1539911725 CGCLAOHXCIVOPT-HMFYCAOWSA-N 449.039 4.413 10 10 IICE Cc1cc(C(=O)NCCc2ccc(Cl)nc2)c(C)n1-c1ccc(Br)cn1 1545383572 UUMUAWNTDSDQAR-UHFFFAOYSA-N 433.737 4.273 10 10 IICE CCc1nnc(N(C)Cc2cc(C)cs2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1546417108 ZGXTWUYHDDYVEM-UHFFFAOYSA-N 439.629 4.104 10 10 IICE CCN(c1nnc(CN2CCCC2=O)n1CCCSc1nccs1)C1CCCCC1 1547382120 JVPVADIOOQHWDH-UHFFFAOYSA-N 448.662 4.198 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CCCCOC(C)C)CC2)cc1F 1554961111 XIWXRPXCUPRHNT-UHFFFAOYSA-N 445.583 4.225 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCc3nn(C)cc32)c(C)n1-c1ccccc1Br 1556371690 HRUJVGHPWBRAOJ-GOSISDBHSA-N 427.346 4.398 10 10 IICE CN(C)c1ccc([C@H](CNc2nc3ccc([N+](=O)[O-])cc3[nH]2)NC(=O)OC(C)(C)C)cc1 1559183816 JXFTXYNEEYDWCZ-IBGZPJMESA-N 440.504 4.215 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)cc1 1566270883 JEYLDISRHWDFJI-CQSZACIVSA-N 425.489 4.365 10 10 IICE CSc1cccc(N2C[C@@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2=O)c1 1587886423 OQOCWMCWQLZYAW-FQEVSTJZSA-N 433.577 4.485 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2cccc(F)c2)no1 1595571353 DLTCKBJJIWQKBK-SFHVURJKSA-N 429.879 4.234 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1603393811 UCYVDAVUOVBBTE-RTWAWAEBSA-N 439.648 4.358 10 10 IICE CSc1ccccc1[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1617648490 VCAVYCNWHAJDHX-CYBMUJFWSA-N 448.591 4.467 10 10 IICE Cc1ccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1-n1c(C)cc(C=O)c1C 1625762832 LANXHZATZZMXOI-UHFFFAOYSA-N 446.507 4.086 10 10 IICE Cc1cc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(C)n1-c1ccc(F)cc1 1627767919 JZCOWKXDEZWULP-KRWDZBQOSA-N 443.441 4.419 10 10 IICE Cc1cccc(-c2nnc3n2C[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)CC3)c1 1629136636 GQGNQURJQBMFKD-AWEZNQCLSA-N 431.323 4.145 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCN(c2cc(C)cc(C)c2)C1=O 1631167260 OAWYOJYKCSQRDM-LJQANCHMSA-N 445.357 4.173 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1 1631533914 LUNLOQGHNBLNLB-ZDUSSCGKSA-N 443.849 4.445 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 1635006922 FEZRHEXGJIJPQB-UHFFFAOYSA-N 425.872 4.254 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 1635947227 RNSCDQQDLLMLMZ-CQSZACIVSA-N 442.274 4.141 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc2cc(O)c(O)cc2s1 1635947253 SKEZNTPLAVEWNJ-OAHLLOKOSA-N 432.929 4.066 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c(OC)n1 1638289345 WERIIBBISJOEDT-UHFFFAOYSA-N 444.329 4.199 10 10 IICE O=C(CCCCCc1ccc(I)cc1)NCc1ccc(O)cc1O 1643104429 YKOXNAICTRPAEI-UHFFFAOYSA-N 439.293 4.122 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCC(C)(C)NC(=O)OC(C)(C)C)c1 1643691418 BCFILIWZQXEFNG-UHFFFAOYSA-N 427.545 4.330 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](C(=O)OC)C3CCCCCC3)ccc21 1646216397 VUDLZZKHESLPKO-QFIPXVFZSA-N 428.573 4.394 10 10 IICE CCC(F)(F)C(C)(C)CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1648749507 UVFCWMJCGXYNQC-UHFFFAOYSA-N 432.514 4.056 10 10 IICE CCCN(CCc1cccc(F)c1)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652480598 QOCRUZYOYLHXGA-UHFFFAOYSA-N 444.506 4.494 10 10 IICE CC[C@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(F)cc1 1655293724 XGYFLSAKZPJCJV-RPPIVITFSA-N 445.554 4.110 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1 1657675803 GVPJOTONQKNPME-UHFFFAOYSA-N 443.547 4.275 10 10 IICE COCc1cccc(OCC2(CN3CCN(c4ccc(OC)cc4OC)CC3)CCC2)c1 1659857052 CDCLSZCQUHKSSL-UHFFFAOYSA-N 440.584 4.222 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1673745258 RRYDOWJHPBRGOP-GHTZIAJQSA-N 446.636 4.327 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC(Cc4cccc(C(F)(F)F)c4)C3)C2)cc1 1682645234 BMGQZFCUOPGMOY-LJQANCHMSA-N 433.474 4.177 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nc(C)c(C)s1 1696247292 CSKBLSOUDZGRRI-UHFFFAOYSA-N 440.617 4.173 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCOc1ccc(Cl)cn1 1696701130 VPORKDITFCFMLV-UHFFFAOYSA-N 427.936 4.405 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1707973664 VTLXIIKMYIDNIG-MZKRTTBSSA-N 441.620 4.230 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H](C)C(=O)NC 1727847336 GZTSHEZBMIXXFQ-XSZJWBAASA-N 434.588 4.137 10 10 IICE CCOCc1nnc(N2CCC([C@H]3CC3(F)F)CC2)n1Cc1ccc(N(C)C)cc1C 1729015562 WIQFGBYAIRZSIC-HXUWFJFHSA-N 433.547 4.109 10 10 IICE Cc1cccc(N(C)c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)c1 1742142341 GNAADJBSFUDCIF-UHFFFAOYSA-N 442.614 4.116 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](CC)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1744932895 ZXYFXJQDPNVUMO-VQTJNVASSA-N 425.621 4.285 10 10 IICE CCOCc1nnc(N2CCC(CC)CC2)n1Cc1ccc(N2CCSCC2)cc1 1766303744 DOKNQRBFIBLOEP-UHFFFAOYSA-N 429.634 4.043 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@H]2NCc2c(O)cccc2Br)CC1 2132776721 BVRNXLDHFHRVSG-QGZVFWFLSA-N 425.367 4.424 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccc(Br)cc34)C2=O)cc1 2293379599 OPPUREUZQIWBHR-UHFFFAOYSA-N 438.281 4.159 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2ccccc2OCc2ccccc2C)SC1=S 2314769989 XQESAEACHUUTLT-UHFFFAOYSA-N 427.547 4.338 10 10 IICE CC(C)c1ccc(C=C2SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 2323809051 ORQZSCSYOWHNHK-SFHVURJKSA-N 427.547 4.413 10 10 IICE C[C@@H]1Oc2ccc(-c3csc(NS(=O)(=O)c4ccc(Cl)s4)n3)cc2NC1=O 11857777 SBWGVVBCKCIYQQ-QMMMGPOBSA-N 441.943 4.045 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471786 NUAVGBMVFGHSST-WFXMLNOXSA-N 427.526 4.498 10 10 IICE C[C@H](NC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21)c1ccc(F)cc1 731037272 ZUOLYARBMOYYHX-KRWDZBQOSA-N 441.547 4.480 10 10 IICE O=C(Nc1cccc(Br)c1)C1CCN(Cc2cc3c(cc2O)CCC3)CC1 738117059 KYHJYOKCESAVDN-UHFFFAOYSA-N 429.358 4.494 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccccc1-n1ccc(C)n1 769146652 IZKJSCPPUXUPFB-UHFFFAOYSA-N 443.345 4.381 10 10 IICE CCN1CC[C@H](NCc2cccc(Br)c2O)[C@@H]1c1cc(F)c(F)c(F)c1 782391238 JPEAAMSNYSVFQM-WMZOPIPTSA-N 429.280 4.497 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3ccc(F)cc3)C(F)(F)F)CC2)cc1F 792500527 FCGMWDRRHJTQOM-GOSISDBHSA-N 429.389 4.109 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCC[C@H]1c1ccccc1 920052132 ZKBHVJDVKGVKOC-GMAHTHKFSA-N 425.548 4.312 10 10 IICE Cc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1125256316 IDFHARBWCOTPNX-OKILXGFUSA-N 435.883 4.239 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F 1129661086 FGFBCFDDLGVHBM-NVXWUHKLSA-N 438.877 4.404 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](C)Cc3ccc(OC(F)(F)F)cc3)C2)cc1 1129992965 CSXGJTNGJDRPHL-FUHWJXTLSA-N 436.474 4.415 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(O)cc(Br)c1 1137350490 OEMYMLLAQNRHDS-UHFFFAOYSA-N 429.108 4.285 10 10 IICE Cc1cc([C@@H]2CCCN2C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)on1 1141731774 DLYHTJNAKKAGFU-JIHKLPAASA-N 445.541 4.077 10 10 IICE COc1ccc2c(c1)c(C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c(C)n2C1CC1 1158718414 XPNMRAHDSZASEV-DEOSSOPVSA-N 434.584 4.392 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1 1160283979 JJPPLGDQQFPBRJ-MHZLTWQESA-N 448.538 4.042 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)NCCOc1cccc(C(F)(F)F)c1 1167716852 JRNRIWGCYMNSMP-UHFFFAOYSA-N 444.400 4.255 10 10 IICE O=S(=O)(CCSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)Nc1ccccc1 1188564795 KRLBRGGRUXWISZ-HXUWFJFHSA-N 443.594 4.263 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@@H](C)C[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291472977 XNILCZKKMXTLQY-CEXWTWQISA-N 429.584 4.298 10 10 IICE CC[C@@]1(C)CCN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)C1 1292344167 SFNAPEJBJCZMIG-NRFANRHFSA-N 445.662 4.405 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)cc([N+](=O)[O-])c3N)cc2)CC1 1293145501 PLFHCYCPSPPYDV-UHFFFAOYSA-N 447.333 4.106 10 10 IICE COc1ncc(Br)cc1CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1300941073 LJZSPMDEGWPZQL-UHFFFAOYSA-N 442.313 4.003 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@](C)(Cc3ccccc3)c3ccccc3)cc2)CC1 1313212266 PUGUNHXFZBOSKT-MUUNZHRXSA-N 442.607 4.396 10 10 IICE CCc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc(Cl)n1 1350759438 BWKOJNWCCMHIBS-UHFFFAOYSA-N 427.854 4.083 10 10 IICE CC(C)Oc1ncc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1Cl 1356036586 KDCPBVAXQNDJGC-GJZGRUSLSA-N 435.927 4.205 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C)C3)n2CCCOC(F)F)c(C)n1-c1ccccc1 1361049338 AIRGTZLXYJKVAB-QGZVFWFLSA-N 445.514 4.207 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)C[C@H]1CCCO1 1361094952 BEWHUPYBDPQBJJ-HXUWFJFHSA-N 440.979 4.031 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H](O)COc3ccc(F)c(F)c3)c2C)c1 1445663097 XOUTVIJQNFAXMI-LJQANCHMSA-N 428.479 4.159 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1452062528 AGNMAEXRIFKUTQ-QFIPXVFZSA-N 439.556 4.421 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1454002796 HNHRHPBWRKRULK-UHFFFAOYSA-N 433.643 4.020 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CSCCN3Cc3ccccc3)c2C)cc1 1466850397 DHNIDVAHQSKBDV-QHCPKHFHSA-N 449.620 4.450 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 1469248441 HXOKJLYULRUIFJ-SFHVURJKSA-N 444.318 4.168 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2C[C@H](N3CCOCC3)C2(C)C)cc1 1469715234 HPPPNOZUNYXLOS-PKTZIBPZSA-N 435.572 4.397 10 10 IICE CC(C)(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)NCc2cc(Cl)ccc2O)cc1 1469875119 UTDZFKYGMSQVOA-SFHVURJKSA-N 432.973 4.175 10 10 IICE Cc1cc(CCNC(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1479063332 DZZSPRNZHFHORQ-KRWDZBQOSA-N 428.577 4.239 10 10 IICE CC[C@H](C)CN(CC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1496065932 MCYZQUZQJVHYCP-SFHVURJKSA-N 431.600 4.472 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCC[C@@H]3C)CC2)cc1F 1518307499 DPDKQJHFJAJYOI-ROUUACIJSA-N 429.584 4.486 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1526246041 AMPWVIBVDINMDE-NVXWUHKLSA-N 449.364 4.418 10 10 IICE COc1ccc(N2CCN(C(=O)CN(Cc3ccccc3)c3ccccc3)CC2)c(OC)c1 1530967344 AVBOELLTJAEYLW-UHFFFAOYSA-N 445.563 4.059 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccn1 1542227151 UTCNFZWTGPRKJB-UHFFFAOYSA-N 447.974 4.448 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccncc2)C[C@H]2CCCO2)cc1 1542923986 NYMVATHUSONTSV-RUZDIDTESA-N 431.536 4.052 10 10 IICE CC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1Cl 1544529646 HVRWXDSRNITVDT-HXUWFJFHSA-N 429.948 4.186 10 10 IICE CCc1nnc(N(C)Cc2ccc(Br)o2)n1Cc1ccc(N(C)C)cc1C 1546417383 JQFLVZVVCLTNAC-UHFFFAOYSA-N 432.366 4.255 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1547444190 LKMRDGFBBWSCJO-WMZHIEFXSA-N 436.604 4.039 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1C[C@H]1CCCO[C@@H]1C(C)(C)C 1554175993 DJLUOXCFTNCKPR-NRSPTQNISA-N 428.577 4.313 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 1564446435 SXNJDDHJENASSW-SJLPKXTDSA-N 432.971 4.363 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]3C)c2C)cc1 1569583315 KRMGSKGKTNMYFG-ROUUACIJSA-N 425.573 4.210 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1(C)C 1570018211 ZSHQOZMQSYTNIZ-DOTOQJQBSA-N 435.528 4.274 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC4(CC(OC)(OC)C4)[C@H]3C(C)C)c2C)cc1 1570876481 LVNBUHBWUXQDPS-JOCHJYFZSA-N 426.557 4.352 10 10 IICE C[C@H]1CCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)[C@H]1C 1612838628 SARQRKFFLMMCRS-GJZGRUSLSA-N 428.943 4.482 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1614116434 IUSLADGXWHQTSO-UYAOXDASSA-N 429.584 4.125 10 10 IICE Cc1cc(CC(=O)N[C@H]2C[C@H](C)S(=O)(=O)c3sccc32)c(C)n1-c1ccccc1 1629188796 AKWCTVOZIPCWLZ-YWZLYKJASA-N 428.579 4.122 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(NC2=NCCC2)cc1 1630280659 PCBPJXAOBFHDGS-GOSISDBHSA-N 428.483 4.291 10 10 IICE CCOC(=O)[C@@H](Cc1cc(Cl)cc(Cl)c1)NC(=O)c1ccc(N=NC(N)=O)cc1 1631392825 OUMKOVAACWYDRP-MRXNPFEDSA-N 437.283 4.060 10 10 IICE CON(Cc1ccccc1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1632639666 WERUKCZKUARTGF-AQTBWJFISA-N 430.526 4.007 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2ccccc2F)nc1 1637247199 HTSRQPSDNNOSQI-UHFFFAOYSA-N 444.846 4.187 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Br)c(C(F)(F)F)cc1F 1638347141 DLIIXDYXNKBYKP-QMMMGPOBSA-N 436.199 4.379 10 10 IICE COC1CCN(c2ccc(CN3CCC(C(=O)Nc4cccc(F)c4)CC3)cc2)CC1 1644864851 YLUVVDFVGYEKJQ-UHFFFAOYSA-N 425.548 4.292 10 10 IICE COc1cnc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nc1 1648493638 JZNNIDTWCLMUHX-GOSISDBHSA-N 430.430 4.411 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]2C[C@H](C)O)sc(C)c1-c1ccccc1 1649398798 XTEIPUNFFUPIFZ-MAUKXSAKSA-N 430.570 4.074 10 10 IICE CCOC(=O)c1cc([N+](=O)[O-])c(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1C 1650651775 YEHIGYFTTAAAEC-HZPDHXFCSA-N 445.491 4.445 10 10 IICE Cc1ccc(C(=O)NCc2sncc2Br)cc1-n1c(C)cc(C=O)c1C 1652474138 XNDDWZCAUYNWPU-UHFFFAOYSA-N 432.343 4.364 10 10 IICE Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1652702897 GWHLUJSZVXINMD-UHFFFAOYSA-N 439.493 4.381 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCc1cnc(SC2CCCC2)nc1 1673149531 JLEIYQCSWKLPMF-GOSISDBHSA-N 441.645 4.359 10 10 IICE C[C@H](NC(=O)N[C@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2)c1ccc(N(C)C)cc1 1680279978 HCPZNTOSJOGEDK-USNOLKROSA-N 430.593 4.291 10 10 IICE Cc1cccc(C[C@]2(C)CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1681850284 VGDUCHKHYZNIEA-VWLOTQADSA-N 443.538 4.417 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCC2(C)C)CCOC1 1723665658 DMDFSSQIZQEBRG-CPJSRVTESA-N 442.604 4.487 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1C[C@](C)(O)c1cccs1 1729420522 SNZKQEIGURBBMV-QHCPKHFHSA-N 426.586 4.322 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H]2CC)n1Cc1ccc(N2CCC(CO)CC2)cc1 1743713902 NDPQFTDRCPIIBF-DENIHFKCSA-N 425.621 4.427 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1cccc(C)n1 1743724499 HMSOVEKOLPIODT-FQEVSTJZSA-N 448.615 4.463 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1[C@H](C)CCN1C(=O)OC(C)(C)C 1750611050 JUUDFDOKXFWUGI-IEBWSBKVSA-N 443.592 4.389 10 10 IICE CC(C)c1nnc(N2CC[C@@](O)(c3cccc(F)c3)C2)n1CCCSc1nccs1 1760914364 JCCOTIVRMARRBE-NRFANRHFSA-N 447.605 4.277 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1c(C)nn(C)c1C 1763500273 QDTXZTZLPYFBLH-SFHVURJKSA-N 435.620 4.427 10 10 IICE CCC[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1763973038 WSFXDICYSJMBNM-IBGZPJMESA-N 443.592 4.189 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@@H](C(C)C)C2)cc1 1766609179 VOLSOVBTBGKTFD-OAQYLSRUSA-N 440.636 4.183 10 10 IICE CN(C[C@@H]1CCCCO1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1767223227 CQJCGZZCNCWIHH-DLBZAZTESA-N 437.635 4.164 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1767995830 WPXQOBCJIGZBHU-TZIWHRDSSA-N 425.621 4.475 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@H]3CCCO[C@@H]3C(C)(C)C)CC2)cc1 1768703469 OTRRSGLXEMFPAZ-OFNKIYASSA-N 441.620 4.153 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CCO[C@H](C)C3)CC2)cc1 1768704492 GRXYGPVJAQQOPI-RTWAWAEBSA-N 441.620 4.017 10 10 IICE COc1ccc(N2CCN(c3nc(Nc4cccc(Cl)c4)ncc3[N+](=O)[O-])CC2)cc1 1871307373 FZLAFOSGGZKUNV-UHFFFAOYSA-N 440.891 4.117 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2060639978 OBWAYDSYHKRMCR-VQTJNVASSA-N 445.564 4.426 10 10 IICE Cc1ccc([C@@H](C2CCC2)n2nc(C(C)C)c(CN)c2I)c(O)c1 2078984402 SNCMKMWGBRBPLH-GOSISDBHSA-N 439.341 4.473 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C2CCC2)c(I)c1CN 2079954231 JLWJDPKHBLAOTI-SFHVURJKSA-N 439.341 4.221 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C3CCC3)c(C(N)=O)c2Br)c(O)c1 2080024839 LESNTUNPROKFDX-SFHVURJKSA-N 434.334 4.116 10 10 IICE COCCNCc1ccc(N(CCCN(C)C)Cc2ccccc2)cc1Br 2152197898 QJEAZXRABSWVGJ-UHFFFAOYSA-N 434.422 4.143 10 10 IICE N=C1C(=Cc2ccc(-c3ccccc3Cl)o2)C(=O)N=C2SC(N3CCCC3)=NN12 2297352858 HJDUXLSNUVNGGK-UHFFFAOYSA-N 425.901 4.272 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(NC(=O)OC(C)(C)C)CC[C@@H](C)C2)c(O)c1Br 2380754043 MMJQEBYTBCMAGC-MPBGBICISA-N 441.366 4.163 10 10 IICE COc1ccccc1/C=C1\SC(=S)N(CCCC(=O)Nc2ccc(F)cc2)C1=O 15039562 UESQGVCHVVRXJD-AQTBWJFISA-N 430.526 4.454 10 10 IICE CCc1ccccc1NC1=NC(=O)/C(=C\c2ccc(OCCC(=O)O)c(OC)c2)S1 16912243 SLFZUPXKXCYGPA-CPNJWEJPSA-N 426.494 4.194 10 10 IICE Cc1cc(N2C(=O)N=C(O)/C(=C/c3ccc(N(C)C)cc3)C2=O)ccc1Br 33291188 PJCSZNOSVPLPSO-WJDWOHSUSA-N 428.286 4.330 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)Nc3cccc(C)c3)c3ccco3)CC2)cc1 38637880 DGLFRGSRJKLIHF-HSZRJFAPSA-N 434.540 4.282 10 10 IICE CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2cccc(Cl)c2)cc1 40394742 AVEOUUKYCPBIQO-UHFFFAOYSA-N 428.897 4.330 10 10 IICE Cc1ccccc1NC(=O)[C@H](C)N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S 47152303 BKEKRQQXDIOUGM-MFVBVHDHSA-N 427.507 4.132 10 10 IICE Nc1ccc(NC(=O)Nc2ccc(I)cc2Br)cc1 311641603 PZAYLRFWVXQPLU-UHFFFAOYSA-N 432.059 4.280 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 731279992 CBRBAZIKRBDYMC-UHFFFAOYSA-N 436.478 4.397 10 10 IICE C[C@H]1CN(c2ccc(CNC3CCN(CCc4ccccc4)CC3)cc2F)C[C@H](C)O1 765117458 FAADCPHQPUKDPX-SFTDATJTSA-N 425.592 4.236 10 10 IICE C[C@]12CCN(C(=O)CCCN3C(=O)/C(=C/c4cccs4)SC3=S)C[C@H]1C2(F)F 816786838 OOFQLGVYJJAMEG-YZHPQUFMSA-N 442.578 4.233 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C\c1ccc(N2CCCCC2)o1 1084591875 FEMRZTSNMBRXAF-QBFSEMIESA-N 434.279 4.243 10 10 IICE Cc1cncc(CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1134542518 ZBGVFQRTKIKUSO-UHFFFAOYSA-N 436.313 4.434 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2scc(Br)c2c1 1142235002 HYGNPLQIVYGWIK-UHFFFAOYSA-N 431.355 4.430 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(CNC(=O)c3ccc(N=NC(N)=O)cc3)cccc2C1 1150955916 OFSGRXPDJIJXDW-UHFFFAOYSA-N 437.500 4.072 10 10 IICE O=C(c1ccnc(Cl)c1Br)N(Cc1ccccc1O)C[C@@H]1CCCO1 1151902679 DEAUEJKYJRCCFX-ZDUSSCGKSA-N 425.710 4.025 10 10 IICE Cc1ccccc1CN1CCO[C@H](CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)C1 1152109556 BXTRUOVPJCLEPI-XMMPIXPASA-N 431.580 4.342 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CO[C@@H](CN(Cc3ccco3)Cc3ccccc3O)C2)C1 1167982631 FMXGMRVQNWBNTF-PXDATVDWSA-N 442.556 4.404 10 10 IICE COCCN(CCC(=O)OC(C)(C)C)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1180238607 IPPUWNSJZLXTJZ-UHFFFAOYSA-N 442.556 4.035 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2cnn(CC(C)C)c2C)o1 1289539757 XLPUCNBQZHEEJN-UHFFFAOYSA-N 434.544 4.398 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3cccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1291608290 LZPQCGJAOKMMQF-QGZVFWFLSA-N 442.608 4.433 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CN(c3ccc(Br)cc3)C2=O)cc1 1298860065 IKNZMJCOIYGOOB-HXUWFJFHSA-N 438.325 4.002 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)CC(C)(C)C)n1CCCSc1nccs1 1302242616 JWPNVEPHSODNPJ-HOTGVXAUSA-N 439.651 4.123 10 10 IICE Clc1cccc(-c2nnc(N3CCCOCC3)n2CCCSc2nccs2)c1 1302923325 XENVFLLHWSYZAA-UHFFFAOYSA-N 436.006 4.464 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cc(C(=O)OCc2ccccc2)[nH]n1 1304567960 PILWKWODAFRDJX-UHFFFAOYSA-N 442.475 4.239 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](c1ccc(F)cc1F)c1nccn1C 1312883045 ASNUPBSAGRDWCV-ZHRRBRCNSA-N 441.526 4.093 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cnc(OC2CCCCC2)c(Cl)c1 1355123396 IQKIKLBFQFSRQO-UHFFFAOYSA-N 447.938 4.352 10 10 IICE Cc1cc(Br)cc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)c1C 1435229238 BBMXCRCQTKMOKV-UHFFFAOYSA-N 430.346 4.020 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccc(COc4cccc(F)c4)c3)cc2)CC1 1462486789 NVINDNJXOXYLSG-UHFFFAOYSA-N 433.527 4.087 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1 1465236927 FISWSQHIUDUVGX-AREMUKBSSA-N 429.564 4.230 10 10 IICE CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc2cc(O)c(O)cc2s1 1466159283 IXGOHWPXXPVMEF-QGZVFWFLSA-N 426.538 4.145 10 10 IICE COc1ccc(CN2CC[C@H]2CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1470246836 VJJZBZUDLGHOKV-DEOSSOPVSA-N 445.563 4.228 10 10 IICE Cc1ccc(O)c(CNC(=O)NCCOc2ccc(Br)cc2C(F)(F)F)c1 1478359290 JPOSOSBKVJZNFN-UHFFFAOYSA-N 447.251 4.360 10 10 IICE C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786005 FCEDIIOFOAHTNL-VFNWGFHPSA-N 433.474 4.233 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)Oc3ccc(Br)cc3)C2)cc1 1532105059 HCPDCVCEILHPDR-MRXNPFEDSA-N 433.346 4.010 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(Br)c1 1534309878 YNVUFPXPJLFEAV-HZPDHXFCSA-N 449.364 4.369 10 10 IICE Cc1csc(N(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C2CC2)n1 1538641727 CBWCOAPLWMSCOW-YBEGLDIGSA-N 447.582 4.378 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)C2CC2)cc1 1540709180 FXULXAXWKZCHIK-SQJMNOBHSA-N 427.589 4.423 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCOc2ncc(Cl)cc2Cl)cc1 1545625268 QLVPNHGQJFTXSD-UHFFFAOYSA-N 446.334 4.346 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1nc(Br)ccc1C 1556426426 MGGSBMRRBLWGDU-UHFFFAOYSA-N 448.361 4.155 10 10 IICE O=C(Nc1nccc2ccccc12)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1556599234 NXELIBWVTXMJAM-UHFFFAOYSA-N 425.491 4.055 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3cccnc3)C2)c(C)n1-c1ccc(Br)cn1 1557172724 ZUGSAJAGPKQTMP-KRWDZBQOSA-N 425.330 4.276 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H](Cc3ccccc3)c3ccccn3)C2)cc1 1564962606 MQLXFARWWGEMCZ-XZOQPEGZSA-N 444.579 4.242 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1565305231 LMHLDVKSNCXHRY-ONTIZHBOSA-N 442.604 4.216 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)CC(=O)c3ccc(Cl)cc3)cc2F)CC1 1565645127 RPOHIGDUZSIDAH-KRWDZBQOSA-N 445.966 4.146 10 10 IICE CC(C)[C@@H](NC(=O)NCc1ccccc1)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1587475520 DPUMVVRXQWKBOP-XMMPIXPASA-N 436.600 4.159 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccc(F)cc4F)CC3)c2C)c1 1611051286 BYXZCVOSENSKHW-UHFFFAOYSA-N 437.490 4.279 10 10 IICE CN(C)S(=O)(=O)CCSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 1613269934 SEDINSONXQRRDA-UHFFFAOYSA-N 436.002 4.235 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC(C)(COC)CC2)cc1 1615379767 LNAZQHRTEZTHEV-UHFFFAOYSA-N 436.604 4.421 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 1625458887 PZISSYBDJBKARF-WEVVVXLNSA-N 438.524 4.323 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(C(F)(F)F)ncn2)cc1 1628565914 UQAZCBBFRHXHAG-UHFFFAOYSA-N 430.430 4.417 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@]1(C)CCN(C(=O)OCc2ccccc2)C1 1630181035 RNCWKIUPYBCFHS-RXFWQSSRSA-N 437.584 4.157 10 10 IICE Cc1cc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2F)c(C)n1-c1ccc(Cl)cc1 1632605022 ZZXKURWXIFPWKY-NRFANRHFSA-N 425.891 4.200 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cccc2cccc(Br)c12 1633789343 IHIBFOMJMJYPFU-UHFFFAOYSA-N 439.353 4.493 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cnc(-c2cccc(Cl)c2)s1 1641204244 PPYFIFYLTOONMY-UHFFFAOYSA-N 427.957 4.355 10 10 IICE CN1C(=O)CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(C(F)(F)F)cc1 1644590981 XTNDIORAIUYPLB-VQIMIIECSA-N 440.849 4.290 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1)c1ccc(N(C)C)cc1 1681552553 OSPHINCADMHZEO-TYCQWZJGSA-N 434.506 4.143 10 10 IICE CCO[C@]1(c2nnc(N3CCCCCCC3)n2Cc2ccc(N(C)C)cc2C)CCOC1 1696071610 HLHMBERJOKIHMD-RUZDIDTESA-N 441.620 4.123 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C1 1741584517 JVNOCDULAJJUKH-QGZVFWFLSA-N 446.646 4.174 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C)[C@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742697356 HWHOCVCGJOWRKA-IEBWSBKVSA-N 435.620 4.045 10 10 IICE CCO[C@@]1(c2nnc(N(CC)C3CCCC3)n2Cc2ccc(N(C)C)cc2C)CCOC1 1746666886 NFFRYZHWBXMYHQ-VWLOTQADSA-N 441.620 4.122 10 10 IICE CC[C@H](C)N(C)CCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1762002957 ASMIYJHZSNTERN-NRFANRHFSA-N 449.647 4.251 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)Cc1ccccc1 1857996831 INIDQIKQGFYYSZ-UHFFFAOYSA-N 429.473 4.251 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2060641868 OBWAYDSYHKRMCR-PMACEKPBSA-N 445.564 4.426 10 10 IICE Cc1ccc([C@H](C2CCC2)n2nc(C3CC3)c(CO)c2I)c(O)c1 2078999953 YDOJGFJJZRBOIG-SFHVURJKSA-N 438.309 4.261 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2Cc1nnc(Br)s1 2106559750 SXVPTQCTNGFQCU-UHFFFAOYSA-N 439.379 4.278 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@H]1C[C@@H]2NCc1cc(Br)cc(F)c1O 2108256707 SWWOXFVOKLOKOW-LZJQFABFSA-N 429.330 4.075 10 10 IICE C[C@@H](NCc1cc(Br)ccc1O)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116250706 IXVNJISBPXSNJM-PXAZEXFGSA-N 425.323 4.492 10 10 IICE CCOc1ccc2ccccc2c1C=C1C(=O)NC(=S)N(c2ccc(OC)cc2)C1=O 2294259184 QTQOGECNMQICIB-UHFFFAOYSA-N 432.501 4.078 10 10 IICE N=C1C(=Cc2ccc(OCC(=O)O)cc2)C(=O)N=C2SC(CCC3CCCCC3)=NN12 2296938582 VRVXKBAAZPZUQS-UHFFFAOYSA-N 440.525 4.130 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)cc1 2296945722 CELZECPHYQQABU-UHFFFAOYSA-N 447.466 4.298 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)cc1 2297341665 WWQOSJOSCLOYKX-UHFFFAOYSA-N 446.434 4.080 10 10 IICE COc1cccc(OCCCOc2c(C=C3SC(=S)N(C)C3=O)cccc2OC)c1 2297347293 PPWBAAXCUOHCAJ-UHFFFAOYSA-N 445.562 4.383 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccccc1 2314827374 CQIMTRHNBFSVSO-UHFFFAOYSA-N 427.507 4.215 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccccc3F)C2=O)cc1OC)C(=O)O 2314933347 VIFUKCVXVRDAPW-HNNXBMFYSA-N 447.509 4.482 10 10 IICE CCCCOc1c(Br)cc(C=C2C(=O)N(C)N=C2C(F)(F)F)cc1OC 2332114522 MUEUNGUUTVKMTK-UHFFFAOYSA-N 435.240 4.410 10 10 IICE Cc1ccc(CNC(=O)c2cnc(NC(=O)OC(C)(C)C)s2)c(O)c1Br 2352645101 GHMDDVCNIRVIDQ-UHFFFAOYSA-N 442.335 4.197 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(OC)c1O)N2 14459710 UVOPBZDOGNPAGL-DRSNIGMVSA-N 428.554 4.258 10 10 IICE Cc1cc(C(=O)NCc2ccc(NC(=O)C(C)C)cc2)c(C)n1-c1ccc2c(c1)OCCO2 33092784 IHGBFALTJICVNY-UHFFFAOYSA-N 447.535 4.390 10 10 IICE C[C@H]1[C@@H](NCc2cccc(Br)c2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709348198 VLYXEYUQGHTRQE-JSQNDZKTSA-N 425.367 4.421 10 10 IICE CC(C)n1ncc2cc(/C=C/C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c(=O)[nH]c21 742417105 UPTMRHOYEZOFIC-SDNWHVSQSA-N 447.583 4.404 10 10 IICE Cc1cc(CCNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)c(C)n1-c1ccccc1 742498395 HXDICMFDNMOKCH-UHFFFAOYSA-N 438.597 4.437 10 10 IICE CS(=O)(=O)c1ccc(-c2nc(CN(Cc3ccccc3O)C3CCCC3)co2)cc1 761670397 UHCVQXBEJORVJJ-UHFFFAOYSA-N 426.538 4.396 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)c2)c1C 766403581 AGPYVDXQNJIFMR-GOSISDBHSA-N 432.568 4.379 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@]1(C)CCCN1C(=O)c1ccccc1 769298139 QQBAHQLOYMWUSF-JOCHJYFZSA-N 445.357 4.198 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCCCSc3nccs3)cc2CC1 789765578 CSNAQNIRECCUGP-UHFFFAOYSA-N 447.626 4.391 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc(-c3cccc(C)n3)n2C[C@@H]2CCCO2)cc1 802683232 FLOOUYQJCWXWPX-QFIPXVFZSA-N 434.588 4.310 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)NCc1ccccc1OCc1ccccc1 919790158 NDHMKODHLYEPEU-UHFFFAOYSA-N 431.536 4.102 10 10 IICE Cc1nc(C2CCC2)sc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1125188871 WOMWZUGOROVMOJ-GASCZTMLSA-N 431.577 4.331 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCC(=O)c1ccc(CC(C)C)cc1 1137816652 NKOREAFAWSVCBE-UHFFFAOYSA-N 445.943 4.409 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)c3ccc(Br)cc3)C2)cc1 1221066985 MEPKCIGDOCRCRS-HZPDHXFCSA-N 432.362 4.344 10 10 IICE Cc1c(Br)cccc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1264688862 BMOVFERKMUCFAQ-GASCZTMLSA-N 449.364 4.369 10 10 IICE CC(C)c1nnc(N2CCN(c3ccccc3)CC2)n1CCCSc1nccs1 1287221284 RSEOKPAZYDHJPV-UHFFFAOYSA-N 428.631 4.367 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCCc3csc4ccccc34)cc2)CC1 1288913385 UPSVCGCJFNJCGW-UHFFFAOYSA-N 435.593 4.242 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1293295819 ARAGFLCOJVPLML-HKUYNNGSSA-N 429.584 4.224 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1Cc1cc(COC(C)(C)C)on1 1298363616 IDIXTQSCTSYUOM-UHFFFAOYSA-N 448.527 4.034 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2C[C@]2(C)CN(C)C2=O)c(C)n1-c1ccccc1 1304191817 GOYYXJKZRVBREI-SANMLTNESA-N 448.615 4.313 10 10 IICE CCN(Cc1ccccc1)c1ccc(CNCc2cccc([C@]3(C)NC(=O)NC3=O)c2)cc1 1320073128 ZILSDZPDAYTVDC-MHZLTWQESA-N 442.563 4.058 10 10 IICE CC1CCC(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)CC1 1350077395 RHHQUTSWULWXOQ-YUVVGHDESA-N 437.584 4.302 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1359781344 DVBNKAJNGYGTBK-UHFFFAOYSA-N 436.629 4.110 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccnc(OCC(F)(F)F)c2)cc1 1441429655 RFGFTWZCRIMNJD-UHFFFAOYSA-N 445.441 4.102 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cccc(C2CC2)n1 1460288904 XUBIUFNMZYOOSX-SFQUDFHCSA-N 427.526 4.328 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCN3CCN(Cc4ccccc4)CC3)c2C)c1 1463763352 LBRZHDTYWXHCGG-UHFFFAOYSA-N 444.623 4.259 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(C)(C)N2C[C@@H](C)C[C@H](C)C2)CCCC1 1464462794 GXCITFKKQAKHRR-OALUTQOASA-N 425.617 4.401 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3ccc(F)c(C)c3)C3CC3)CC2)c(OC)c1 1469448491 PJBHTZRSFFCOLJ-QHCPKHFHSA-N 427.520 4.134 10 10 IICE CC(C)c1nc(CCn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)cs1 1508895311 IYXKHNUJFJXYQE-UHFFFAOYSA-N 448.596 4.429 10 10 IICE CN(C)c1ccc(CN(C(=O)C2(S(=O)(=O)c3ccccc3)CCCCC2)C2CC2)cc1 1526186626 VJKWAYJKUIIYPT-UHFFFAOYSA-N 440.609 4.420 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1C(F)(F)F 1535561341 NFXSUNFPTIJARK-UHFFFAOYSA-N 431.502 4.476 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4ccc(Cl)cc4Cl)c3)C2)cc1 1538747395 RFSPQTJBRYMCSE-MRXNPFEDSA-N 431.323 4.196 10 10 IICE C[C@H]1CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)CC1(C)C 1544370802 KYLVKVYJQPZPGO-HNNXBMFYSA-N 429.619 4.246 10 10 IICE COc1ccc(N2CCN(C(=O)CN(Cc3ccco3)c3cccc(Cl)c3)CC2)cc1 1544746814 ZETWHCRZEKWPQX-UHFFFAOYSA-N 439.943 4.297 10 10 IICE C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632881 YBJPMXFCCHEESX-IERDGZPVSA-N 428.960 4.082 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1556639517 GYDNRMJLPQEIDH-MOPGFXCFSA-N 443.547 4.311 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCOC3(CCC3)C2)c(C)n1-c1ccc(Br)cn1 1556686120 BQOZMEXVGYLPKR-MRXNPFEDSA-N 432.362 4.331 10 10 IICE CCCOc1c(Cl)cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1OCC 1557640289 ZDZQTWOOQJOOHJ-UHFFFAOYSA-N 446.975 4.419 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](CC(F)(F)F)C1 1570485657 LJQHWWRFKMOJHJ-GFCCVEGCSA-N 448.488 4.059 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)C[C@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1613201079 XJJFIAPROBGULH-WSTZPKSXSA-N 429.584 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CC[C@H](C)[C@@H]2C)cc1 1615381990 JLITZYGKKACQTK-RXVVDRJESA-N 435.620 4.269 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)C(C)(C)C1 1622309352 ITEDSTFNCLRRAJ-LJQANCHMSA-N 428.529 4.407 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2ccc(Br)cc2s1 1626693561 OPNZTLLXCYGNBB-UHFFFAOYSA-N 431.355 4.430 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)nc2)c(C)n1-c1ccc(C(C)C)cc1 1629314604 IGDXQTSMLIPQSK-UHFFFAOYSA-N 445.611 4.294 10 10 IICE COc1cc(C)cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1632390843 RBBFQVBLNWWQQA-UHFFFAOYSA-N 428.330 4.499 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 1634065243 QHQGZPIDVGVDPB-QFIPXVFZSA-N 435.911 4.095 10 10 IICE Cc1cc(C(=O)N(C)C(C)(C)CN2CCOCC2)c(C)n1-c1ccc(Br)cc1 1637836964 HMBGFDTYYYBQQU-UHFFFAOYSA-N 448.405 4.039 10 10 IICE Cc1cc(CC(=O)NCCc2nc(-c3ccc(Cl)cc3)n[nH]2)c(C)n1-c1ccccc1 1640386681 JKVRDBRDERUQTP-UHFFFAOYSA-N 433.943 4.434 10 10 IICE COC(=O)c1cccc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)c1 1643615197 BXSOTISBNOIZNG-HXUWFJFHSA-N 436.533 4.491 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)cc1 1646620765 PIBBEBJCOKWSKJ-RUZDIDTESA-N 427.564 4.250 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cc1 1652802772 YKSNHJGVVCLVMY-SANMLTNESA-N 448.538 4.484 10 10 IICE CC(C)N(CC(=O)Nc1cccc(CN2CCSCC2)c1)Cc1ccc(N(C)C)cc1 1653188755 ZMKRTWJDYDQTOH-UHFFFAOYSA-N 440.657 4.151 10 10 IICE CC(C)[C@@](C)(NCC(=O)NCc1ccc(N(C)C)cc1)c1ccc(Br)cc1 1653292411 BTOLBSNBNJTVFD-JOCHJYFZSA-N 432.406 4.292 10 10 IICE COC1CCN(c2ccc(CN3CCC(NC(=O)c4ccc(C)s4)CC3)cc2)CC1 1657603172 RWPZJYBCJHFQQV-UHFFFAOYSA-N 427.614 4.066 10 10 IICE CN(CC(=O)Nc1ccc(Br)cn1)c1ccc(OCc2ccccc2)cc1 1658279440 CAYLVEIZFLHVFI-UHFFFAOYSA-N 426.314 4.498 10 10 IICE COc1cc(Br)ccc1CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1681644241 ZNTWFQZQSJHUTH-HNNXBMFYSA-N 434.378 4.263 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)N(C)C)cc1 1685682283 XVTIKCFZFYDPLS-HJOGWXRNSA-N 442.579 4.056 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(c4ccc(Cl)c(Cl)c4)CC3)C2)cc1 1687024245 ZUWGYIUMCZHYEV-MRXNPFEDSA-N 449.382 4.113 10 10 IICE COC[C@@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1697858772 RUWDZVUNBOWUKZ-LJQANCHMSA-N 443.592 4.047 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1731109661 XDLDLQRHSZCNIK-QGZVFWFLSA-N 447.624 4.147 10 10 IICE CCOCCC1(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)CCCC1 1768064381 HCBMRFFORZTZPU-OAQYLSRUSA-N 428.577 4.459 10 10 IICE CCOc1cc(/C=C2/C(=O)N(Cc3cccc(F)c3)N=C2C)cc(Br)c1O 1865667345 RWAPUSYYBTVFET-LZYBPNLTSA-N 433.277 4.494 10 10 IICE COC(=O)c1c(C(C)(C)C)nn([C@@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080051934 GKWVIAHNSUAADW-MRXNPFEDSA-N 437.334 4.443 10 10 IICE CC[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cc(Br)cc(F)c1O 2093491193 ABLBESCHLJYUHJ-LRDDRELGSA-N 431.346 4.419 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)c1O 2236053869 BDCYXMRTSKBBHP-AWEZNQCLSA-N 443.382 4.290 10 10 IICE COc1c(I)cc(C=C2C=C(c3ccccc3)OC2=O)cc1[N+](=O)[O-] 2294253436 SIGDADFEUGXTIS-UHFFFAOYSA-N 449.200 4.189 10 10 IICE COc1ccc(N(C)CN2C(=O)C(=Cc3cc(OC)ccc3OC)SC2=S)cc1 2313502102 PKGVJHYSCULHDQ-UHFFFAOYSA-N 430.551 4.008 10 10 IICE CCOC(=O)CCN1C(=O)C(=Cc2ccc(OCCC(C)C)c(OC)c2)SC1=S 2314760470 KGYHUVJFOWFPKO-UHFFFAOYSA-N 437.583 4.275 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C2CC2)c(O)c1Br 2352687411 GQYNIUMMIORWMZ-NVXWUHKLSA-N 425.367 4.341 10 10 IICE Cc1ccc(CNC(=O)OC2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2380723348 VFOGMXOATNVKHJ-UHFFFAOYSA-N 443.338 4.089 10 10 IICE CCOC(=O)CN1C(=O)S/C(=C\c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)C1=O 1138153 UBLUEFMPLUDSER-IUXPMGMMSA-N 436.892 4.486 10 10 IICE CCCCn1c(N2CCCC2)c(/C=C2\SC(=S)N(C(C)C)C2=O)c(C)c(C#N)c1=O 39990353 ZFYSAPVZBCQCHN-PDGQHHTCSA-N 444.626 4.038 10 10 IICE COc1ccc([C@@H]2N=C(c3ccc4c(c3)OCO4)C[C@@H](c3ccccc3O)N2)cc1OC 53363257 CLEAOMNBWGEQGZ-UQBPGWFLSA-N 432.476 4.361 10 10 IICE Cc1cc(/C=C2\C(=O)N(Cc3ccccc3Cl)C(=O)N=C2O)c(C)n1C[C@H]1CCCO1 59109293 NMUWFIJAOXMKFK-NPBUNYCVSA-N 441.915 4.440 10 10 IICE CC(=O)[C@H](/N=N/c1ccc(Cl)cc1C(F)(F)F)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 111486983 AEASHRDYTBPWPD-HIUCBWPRSA-N 439.781 4.208 10 10 IICE COc1c(C)cnc(CN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1C 444144036 RSVRQURFWRZDDK-UHFFFAOYSA-N 434.584 4.087 10 10 IICE C[C@@H]1[C@H](NCc2cc(Br)ccc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709343739 MXTXYFRAPDLOQL-BASLNEPJSA-N 425.367 4.421 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCC(=O)N2CCOc3ccccc32)cc1 730276940 FMWUQDIEDBEBKO-UHFFFAOYSA-N 447.535 4.080 10 10 IICE COC(=O)Cc1sc(NS(=O)(=O)c2cccc3ccccc23)nc1-c1ccccc1 752189377 BHUXRBJSLVHVOD-UHFFFAOYSA-N 438.530 4.480 10 10 IICE Cc1ccc(CNC(=O)C2CCN(Cc3cc(C)cc(Br)c3O)CC2)cc1 781906150 VMLCFCZZNTZBBF-UHFFFAOYSA-N 431.374 4.300 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)NCc1cc(Br)ccc1O)O[C@H](C)C2 804734486 NKBIJNZDMFPQSR-PUECVXPYSA-N 446.341 4.297 10 10 IICE Cc1noc(C)c1COc1ccccc1C(=O)NCc1cc(Br)ccc1O 804737480 JFOVJTIIESFTNX-UHFFFAOYSA-N 431.286 4.269 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cc(F)c(N2CCCC2)c(F)c1 806216804 ALKJLJXDXKSZDO-UHFFFAOYSA-N 426.261 4.355 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)N1CCCN(c3ccc(OC)cc3)CC1)O[C@H](C)C2 917821401 GQJBHNUVLXYAOB-PVABEOQZSA-N 436.552 4.169 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)NC3CCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 1125816154 HOPOEGOQVMHSDV-OAQYLSRUSA-N 449.595 4.176 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1nn(-c2ccc(Cl)c(F)c2)c2c1CCC2 1126081445 ABZPTLMPHOYFRM-UHFFFAOYSA-N 426.923 4.458 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1 1140764054 YHDVCZMBVZMAQR-OAQYLSRUSA-N 446.425 4.269 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(Cl)c(N)c3Cl)cc2F)C[C@@H](C)O1 1141901985 VNWHJWFYJZVAGA-TXEJJXNPSA-N 426.319 4.258 10 10 IICE COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1155017320 YNDKXSNNMRIDCN-YJYMSZOUSA-N 433.346 4.270 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1ccc2c(c1)CCO2 1155119656 ZMBFVBFEIMNYGD-DEOSSOPVSA-N 432.520 4.290 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3CC(C)(C)Oc4ccc(F)cc43)C2)cc1 1252114238 BGALYQLJSYTHBD-KKSFZXQISA-N 427.520 4.262 10 10 IICE C[C@H](NC(=O)[C@H]1CCOc2ccc(Br)cc21)c1ccc(N2CCOCC2)cc1 1264822325 NJLVDXAQMCUTMJ-KXBFYZLASA-N 445.357 4.029 10 10 IICE CC(C)[C@H]1CCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1287239948 UCUWVSFDVXKIEA-HXUWFJFHSA-N 429.584 4.224 10 10 IICE Cc1cc(CNC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)c(C)n1-c1ccccc1 1287662244 WRTWLCMKCMPXCU-UHFFFAOYSA-N 440.429 4.019 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC(C)(C)c3ccc(C(C)C)cc3)CC2)cc1 1300752623 MTCLPPMKEFBZAH-PFONDFGASA-N 449.595 4.075 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCCO1 1301581454 CQOJEAVMTVSBSY-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCCCN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1306674397 ZLCPYVLUGCZXTG-UHFFFAOYSA-N 425.621 4.429 10 10 IICE COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1308062154 QQUMGIVKJOCUBU-IRXDYDNUSA-N 442.515 4.457 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1313247342 LXZQELJZKKRFIB-SXLOBPIMSA-N 431.577 4.492 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC(C)(C)c1ccccn1 1314304333 AKQZOQVTPWFRDD-UHFFFAOYSA-N 448.615 4.424 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@H](C(F)(F)F)C2)cc1F 1314660462 JOZREIVFPAYUKP-KRWDZBQOSA-N 448.468 4.372 10 10 IICE C[C@H](CNC(=O)OC(C)(C)C)Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O 1360611680 UXMYVXLLNFTHHQ-MRXNPFEDSA-N 429.565 4.048 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@](C)(O)c2cccc(Cl)c2)C1 1447336781 AZWNGGZDMVIRBL-RUZDIDTESA-N 439.987 4.085 10 10 IICE CC(=O)Nc1ccccc1C(F)(F)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1464608615 WTIFJRQNHRHHJS-HXUWFJFHSA-N 445.510 4.011 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](C)c3ccc(Br)cc3)C2)cc1 1470771664 GXBXSQSRHKNYNH-MAUKXSAKSA-N 432.362 4.139 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1C[C@H](OCC)C12CCCC2 1471191250 OBMSPZBHXJJSIQ-RPWUZVMVSA-N 442.648 4.098 10 10 IICE CC(C)(C)SCCNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1519604072 DKRVCPXQZVSWGT-QINSGFPZSA-N 426.604 4.065 10 10 IICE CCc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1S(C)(=O)=O 1524705767 ZLEZZSOTNPXIGC-INIZCTEOSA-N 449.016 4.472 10 10 IICE CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1529716420 XEGJUHUAHQIYHP-MRXNPFEDSA-N 434.964 4.425 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(C(=O)N=[S@](C)(=O)N(C)C)cc2)cc1 1539033772 RSDPBYLPKFDNAC-HKBQPEDESA-N 438.553 4.061 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cc2cccnc2Br)cc1 1540800378 OPHOWNBHTFTBLV-UHFFFAOYSA-N 428.330 4.275 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)OCc2ccccc2)[C@H](C)O)c(C)n1-c1cccc(C(C)C)c1 1556733139 LMQDNIAQJSLVHL-CPJSRVTESA-N 448.563 4.440 10 10 IICE COC(=O)c1cnc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C(F)(F)F)c1 1559097708 HAYMDVDVANCOLF-OAHLLOKOSA-N 443.853 4.323 10 10 IICE C[C@H](NC(=O)NC(C)(C)COc1ncccc1Br)c1ccc(N(C)C)cc1 1564598007 XCFDMBPFOOKIHT-AWEZNQCLSA-N 435.366 4.128 10 10 IICE C[C@H]1CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC[C@@H]1c1ccccc1 1564895864 XNSGHHWJMCOWPS-PXNSSMCTSA-N 429.511 4.137 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 1564908793 XGEQFFILFNPBRO-TZIWHRDSSA-N 427.976 4.437 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)OC(C)(C)C)C2 1564946552 RNYWVHDFGMHURP-KSCDAYEDSA-N 444.620 4.079 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2nc(C(F)(F)F)n3ccccc23)cc1 1583919621 QTCOHNJMNMZGNQ-GOSISDBHSA-N 446.473 4.241 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1csc(-c2ccc(O)cc2)n1 1595582499 CXEBZSXFGCBRQP-QGZVFWFLSA-N 443.956 4.269 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1615573645 GZSZIEXVWDBXSG-IBGZPJMESA-N 443.592 4.189 10 10 IICE Cc1ccc(C(=O)NCc2ccncc2OCC(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1617845439 KCHNVZJPPNBCMM-UHFFFAOYSA-N 445.441 4.481 10 10 IICE COc1ccc(CN2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1F 1624367791 MYUVNMYODYZZCL-UHFFFAOYSA-N 435.543 4.129 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)[C@@H]1Oc1ccccc1 1625824292 YXTAEPGYSFHJAW-SDHSZQHLSA-N 432.520 4.261 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)cc1 1630365106 NPJRIOKQDXJAQX-UHFFFAOYSA-N 444.579 4.230 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1631906385 OOQRSJCIQVAPFQ-LJQANCHMSA-N 426.561 4.399 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c1 1636715111 ALOVHAMJTJGHGM-FGZHOGPDSA-N 444.453 4.171 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)cc1F 1642235537 GGFUSEXZUUTMHF-ZDUSSCGKSA-N 426.319 4.290 10 10 IICE CN1C(=O)CC[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(C(F)(F)F)cc1 1644590980 XTNDIORAIUYPLB-QFBILLFUSA-N 440.849 4.290 10 10 IICE Brc1cc(CNCc2ccc(N3CCOCC3)cc2)c(Br)s1 1655418925 PVPFKDJRSAITGL-UHFFFAOYSA-N 446.208 4.400 10 10 IICE COc1ccccc1CN(C[C@H]1CCCO1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1682097275 OXEZSLOFYXLIPZ-HYBUGGRVSA-N 439.600 4.391 10 10 IICE C[C@H]1CN(CCOc2ccc(CCNC(=O)NCc3cccc(Cl)c3O)cc2)C[C@@H]1C 1685931807 JQKJYPLKZULYBY-ROUUACIJSA-N 445.991 4.054 10 10 IICE COc1cccc(-c2nnc(N3CCCO[C@@H](C)C3)n2CCCSc2nccs2)c1 1697520358 HEYUXDRWWAWGDU-INIZCTEOSA-N 445.614 4.208 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCOCC2)cc1 1708594854 BCYVTTJSARKMCX-OAQYLSRUSA-N 448.615 4.021 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)cc1C 1708702793 OGJAETTYVNRMFJ-UHFFFAOYSA-N 440.636 4.388 10 10 IICE CCc1nnc(N2CCO[C@H](c3ccccc3F)C2)n1CCCSc1nccs1 1709159977 YDWXHVHOSSPMNE-KRWDZBQOSA-N 433.578 4.196 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1727815158 GBIWEWIDKWCBFW-KJXAQDMKSA-N 441.620 4.070 10 10 IICE CCC[C@H](Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C)OC 1745291994 XANBFKKERBSDRD-OAQYLSRUSA-N 429.609 4.116 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@H]1CCC=CO1 1747754210 NYMLPERKVYPEBI-QKNQBKEWSA-N 426.561 4.231 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@@H]1CCOC1 1766547066 JKUDOUZOOAOLCE-OAQYLSRUSA-N 437.588 4.252 10 10 IICE O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1C[C@H](c1ccccc1)N1CCCC1 1858593863 AWIBEOIREGPEER-KOMLCTQHSA-N 438.574 4.454 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3cc(Br)cc(F)c3O)[C@H]2C1 1962831808 XSPBZPZBGYWMMR-HZUKXOBISA-N 429.330 4.029 10 10 IICE CCOC(=O)c1c(CC)nn([C@@H](c2ccc(OC)cc2O)C2CCC2)c1Br 2079980557 GHUUPEKBYVDCQR-GOSISDBHSA-N 437.334 4.488 10 10 IICE COc1ccc([C@H](n2nc(C3CCC3)c(C(N)=O)c2Br)C2(C)CC2)c(O)c1 2080026565 YAHRBUAYZNVHPR-KRWDZBQOSA-N 434.334 4.116 10 10 IICE CN(Cc1ccccc1I)c1ccc(CN)c(Br)c1F 2280259101 WFUYBXIVICAGDR-UHFFFAOYSA-N 449.105 4.288 10 10 IICE Cc1ccccc1NC(=O)CCN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314827570 HTGCJBZBNHBVBQ-UHFFFAOYSA-N 427.507 4.133 10 10 IICE Cc1ccc(CNC[C@H]2CC(F)(F)CN2C(=O)OC(C)(C)C)c(O)c1Br 2352676665 RLONHUDMPBOMFJ-CYBMUJFWSA-N 435.309 4.197 10 10 IICE CC[C@H]1C[C@@]1(NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380764276 BXOIAODYDQEPPL-XOBRGWDASA-N 441.366 4.115 10 10 IICE Cc1ccc(CN[C@@H]2[C@H]3C[C@@H]4CN(C(=O)OC(C)(C)C)[C@@H]2[C@H]4C3)c(O)c1Br 2381130152 VBWTXXFYVQJNAG-BBZRVKOSSA-N 437.378 4.197 10 10 IICE O=S(=O)(Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1)c1cccc2nsnc12 13351173 OIHZNBUFZGETNR-UHFFFAOYSA-N 435.490 4.209 10 10 IICE COc1ccc(N2CCN(c3ncnc(Sc4ccc(Cl)cc4)c3N)CC2)cc1 40722964 LZEWMPUIDXHAHH-UHFFFAOYSA-N 427.961 4.199 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C[C@@H]2CCCO2)c2ccncc2)C1 435877456 RAICOIDUMJLNDZ-NRFANRHFSA-N 432.568 4.015 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H]3C(=O)Nc3ccc(OC)cc3)ccc21 728464930 BFUWKIJPJPNUNK-DEOSSOPVSA-N 449.551 4.156 10 10 IICE C[C@H]1Cc2ccccc2[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 732040096 RBCBGJVKIJSVGQ-YEJXKQKISA-N 426.428 4.034 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC1CCC(c2nc(C)no2)CC1 753347765 CKIDMDCPVJQMAL-UHFFFAOYSA-N 437.338 4.104 10 10 IICE Cc1noc(C)c1CCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 753665414 XXNROAGOOVIXGZ-SFQUDFHCSA-N 449.623 4.083 10 10 IICE CN1CC[C@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H]1c1ccc(Cl)cc1 760305226 CRZOPVFKDSELBZ-VXKWHMMOSA-N 445.032 4.138 10 10 IICE CN1CC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@@H]1c1ccc(F)c(F)c1 764510014 CIPLBRRUPYANDF-GMAHTHKFSA-N 441.478 4.421 10 10 IICE Cc1cc(C(=O)[C@@H](C)OC(=O)CCc2ccnn2C)c(C)n1-c1ccc(OC(F)F)cc1 772773137 LYFDKPOYDJJNQI-MRXNPFEDSA-N 445.466 4.176 10 10 IICE COc1cc(NC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc(OC)c1C(C)C 779145533 WSUYLWOHWBPBHI-UHFFFAOYSA-N 431.508 4.125 10 10 IICE CCCN(Cc1ccccc1O)C(=O)C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F 784023750 FOBQJNFKRSXDPU-UHFFFAOYSA-N 444.837 4.364 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)cc1 788975973 UFJDPJKFUFEKKJ-IBGZPJMESA-N 430.552 4.088 10 10 IICE CO[C@@](C)(c1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1)C1CC1 810336279 GBXBGXCBRLQUAX-KWRJMZDGSA-N 435.596 4.237 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2cnn(C(C)C)c2n1 919968556 HXVNGWWOJHRFJP-UHFFFAOYSA-N 449.599 4.274 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](C(=O)OC(C)(C)C)C(C)(C)C)cc2F)C[C@@H](C)O1 1125256296 HILCGJZRCDIEDY-QINHECLXSA-N 436.568 4.060 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@H](O)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1137700521 RQFUXIBDIVUDON-SJORKVTESA-N 445.279 4.384 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3cccc(C(F)(F)F)c3nc2O)cc1 1164597361 KWYRQYHPHXBRDN-UHFFFAOYSA-N 433.430 4.176 10 10 IICE Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)NCc3ccc(O)cc3O)cc12 1299571585 ZXFQNOAXZAJYQX-UHFFFAOYSA-N 427.913 4.449 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccccc3COc3cccc(C=O)c3)C2)cc1 1300633805 MLKAYZVOINZZPA-OAQYLSRUSA-N 430.504 4.095 10 10 IICE Cc1cc(C(=O)N2CC(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1Br 1305591841 CCYYLRXRKGATSO-UHFFFAOYSA-N 433.346 4.270 10 10 IICE Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)cc2)nn1 1355131254 VAXRWTSLLUIEAK-HDICACEKSA-N 434.515 4.135 10 10 IICE CSc1cc(Br)ccc1C(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 1360877260 BRLLNIATGYOERA-UHFFFAOYSA-N 448.386 4.125 10 10 IICE COc1cc(C2(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)CC2)ccc1C 1456076748 QLPACMOZRFBKRV-UHFFFAOYSA-N 430.495 4.422 10 10 IICE CCN(CC(F)(F)F)C(=O)CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2 1459664463 RRPZELCPIQUJMJ-TWGQIWQCSA-N 434.458 4.388 10 10 IICE Cc1cc(C(=O)Oc2cccc3c2OCCO3)c(C)n1-c1ccc(Br)cn1 1466722271 QYGZYUFYYMSBSF-UHFFFAOYSA-N 429.270 4.242 10 10 IICE Cc1cc(F)ccc1[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1471754284 ADCMJSVWTKBFCV-CYBMUJFWSA-N 434.514 4.193 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2cnc(C)s2)n1Cc1ccc(N2CCOCC2)cc1 1495138017 FTJXAHNWEWXQNL-KRWDZBQOSA-N 440.617 4.078 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@H](Oc3ncccc3F)C2)cc1 1501834114 HUMGVRLKCYVKBJ-NRFANRHFSA-N 438.551 4.063 10 10 IICE CON(C)c1nnc(-c2cc3c(s2)CC[C@@H](C)C3)n1Cc1ccc(N(C)C)c(F)c1 1505090510 LLKNRKUOEYNCIW-CQSZACIVSA-N 429.565 4.382 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@@H]2CC[C@H](C)C2)c(C)n1-c1ccccc1 1510604271 UCOWPQXDWLUBJB-WAOWUJCRSA-N 448.615 4.489 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3c(C)ccc(Br)c3OC)c2)CC1 1523523694 COWCZAYSJRVFBP-UHFFFAOYSA-N 432.362 4.160 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(C(=O)OC)ccn2)sc(C)c1-c1ccc(F)cc1 1523603135 GFBUCLIMFLVPMR-UHFFFAOYSA-N 442.468 4.473 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1 1528924129 JMAFVVAERGWVGP-PKOBYXMFSA-N 437.613 4.030 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 1536549292 CXJHLGUJDBZEJD-FOMLIJIXSA-N 445.966 4.120 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)Cc3ccc(Br)cc3)C2)cc1 1538747685 UEQJMPUDKXMUTQ-GOSISDBHSA-N 431.374 4.422 10 10 IICE C[C@]1(c2ccccc2)C[C@@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1539522159 UTARUZSRNHJJKL-KGYFJTNRSA-N 440.565 4.263 10 10 IICE Cc1nc(COc2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc2)no1 1543302690 OFGBBFFRHPRGKN-UHFFFAOYSA-N 444.491 4.358 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)C[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543541974 BTWVALCSWWWIJP-PMACEKPBSA-N 425.621 4.141 10 10 IICE CCOCc1nnc(N2CCC(Cl)=C(Cl)C2)n1CCCSc1nccs1 1548126233 MLDDZRVYRQBJLH-UHFFFAOYSA-N 434.418 4.353 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C4CCN(C)CC4)C3)cc2Cl)C1 1564649499 FHGKOOJAGICNIB-GHTZIAJQSA-N 433.040 4.450 10 10 IICE Cc1ccc([C@@H](O)[C@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1570715645 PUCUJYIOISAMCO-BTYIYWSLSA-N 442.357 4.412 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC(Cc2ccsc2)C1 1585587188 YAKCERVNXRMVCH-VCHYOVAHSA-N 446.594 4.180 10 10 IICE Cn1nc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c2ccccc21 1586351506 BKNCPSXLTRNURW-VBKFSLOCSA-N 442.591 4.255 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cc(N(C)C)nc2ccccc12 1586840220 YXQSPYFHFNBESY-UHFFFAOYSA-N 426.520 4.451 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2ccc(-c3ccccc3Cl)s2)CC1 1624432683 VXHKYDOCUOXSHW-UHFFFAOYSA-N 442.968 4.367 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1627210376 QLDUHAWXXPFNSM-QGZVFWFLSA-N 429.923 4.139 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cc2noc3ccc(Br)cc23)cc1F 1628769891 NSCXETANTLTCGZ-UHFFFAOYSA-N 434.309 4.435 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)COc2ccc(F)c(F)c2)c(C)n1-c1cccc(Cl)c1 1631175795 HFGOVZFZHPBGAL-QGZVFWFLSA-N 434.870 4.195 10 10 IICE CCOc1ccccc1-c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)n[nH]1 1631608441 XPLLUVLFGNWGKR-NRFANRHFSA-N 448.567 4.363 10 10 IICE COc1cc(Br)ccc1CCCNC(=O)NCc1cc(Cl)ccc1O 1633553987 CNAOUEAOSYCEJT-UHFFFAOYSA-N 427.726 4.249 10 10 IICE CCCCNc1nc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cs1 1635945814 BJGXQXBWDVRJFS-KRWDZBQOSA-N 437.009 4.037 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3c(O)nnc3O)cc2)c(C)n1-c1cccc(C(C)C)c1 1636077500 AFDSLZUPEDHCNG-UHFFFAOYSA-N 431.496 4.462 10 10 IICE COc1ccc2c(c1)CCN(C(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)C2 1641537997 XOIFXRWSOGCIJY-UHFFFAOYSA-N 440.341 4.459 10 10 IICE CC(C)[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1706337695 PZLSDICCWBVGRJ-JOCHJYFZSA-N 439.648 4.315 10 10 IICE C[C@H](CC#N)N(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1706750971 CMLCPGHEQYPRHS-HGHGUNKESA-N 442.583 4.188 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccoc3)n2Cc2ccc(N(C)C)cc2C)cs1 1725247454 MSLYZNXBYDLCNH-UHFFFAOYSA-N 436.585 4.286 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)CCS1 1745001499 JWWPSTDVGFUGCZ-FQEVSTJZSA-N 439.629 4.455 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@@H](C)[C@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1761678493 GMTMMMVWCNEJRF-MJGOQNOKSA-N 439.629 4.454 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N([C@@H]2CC(=O)N(c3cccc(C)c3)C2=O)C1=O 1772759325 VQIDPVVZENGYDS-BTYIKDLOSA-N 448.569 4.475 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1 1858586500 OLFSIFGDLJDCRQ-XMHGGMMESA-N 432.611 4.468 10 10 IICE CC(C)C(=O)NCc1ccc(OC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1858890679 DTZPGDMNTNJWTM-UHFFFAOYSA-N 442.471 4.345 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)cc1OC 1860087704 OQVGCVCTXHMYLI-GIJQJNRQSA-N 447.534 4.135 10 10 IICE CC(C)Oc1ccccc1NC(=O)CNCc1cc(Cl)cc(Br)c1O 1860721350 PFCSVRGPNUUAOF-UHFFFAOYSA-N 427.726 4.324 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ncc(C)s2)sc(C)c1-c1ccc(F)cc1 1860768041 SIJNDLKEZOSTTI-UHFFFAOYSA-N 447.513 4.381 10 10 IICE CCOc1cc(/C=C2/C(=O)N(Cc3ccccc3)N=C2C)ccc1OCC(=O)N(CC)CC 1865674925 FYPICXKWUYWYNV-PXLXIMEGSA-N 449.551 4.134 10 10 IICE CC[C@@](C)(N)C(=O)Nc1sc(C)c(-c2ccc(Br)cc2)c1C(=O)OC 1866112445 DOIXJQHMHQGAOQ-GOSISDBHSA-N 425.348 4.339 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@H](NCc3ccc(Br)cc3O)[C@H]2C1 2092950233 QYXIMHWHQDXCDM-BHYGNILZSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)ccc2O)C(F)(F)CC1 2093435691 DETBKFMUACOMPK-HNNXBMFYSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](CNCc1cc(Br)ccc1O)C2 2103451280 UVPSPDUBKIBKIQ-FFGGFLGDSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C12CCC2 2175027982 WFFZIEZDFIFPLB-CJNGLKHVSA-N 443.357 4.467 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 2294134194 WGAFYZVUWPXWDA-UHFFFAOYSA-N 437.795 4.175 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(O)c(Cl)c3)C2=O)cc1Cl 2296398013 NARYCXZZLHNNPX-UHFFFAOYSA-N 441.654 4.027 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N([C@H]2CC(=O)N(c3ccccc3)C2=O)C1=O 2314834172 ZVXPEIXTKZGELO-SFHVURJKSA-N 434.542 4.166 10 10 IICE CCN(C[C@@H]1CCCO1)C1CCN(c2cccc(NC(=O)c3ccccc3OC)c2)CC1 12248134 BZSYNZNSNGJSBP-QHCPKHFHSA-N 437.584 4.417 10 10 IICE O=C(C1=CN(c2ccc3c(c2)CCC3)c2cc(F)ccc2S1(=O)=O)N1CCCCC1 65096297 UGYJIJIERKVCKI-UHFFFAOYSA-N 426.513 4.094 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(-n3c(C)nc4ccccc4c3=O)cc2)cc1 195646150 NFNLTILYGAHTHV-UHFFFAOYSA-N 440.547 4.470 10 10 IICE Cc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(C)C2=O)c(C)c1 213207171 RAQNBVPVQGWKOU-BOPFTXTBSA-N 437.546 4.243 10 10 IICE COc1c(C)cc(CN(C)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1C 725863795 ILGHSMSBNKYOCJ-RTBURBONSA-N 443.563 4.406 10 10 IICE C[C@@H](NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(N2CCOCC2)cc1 732456355 OQTRGFNTAOPJOK-IVUDOQJQSA-N 448.611 4.079 10 10 IICE CN(c1ccc(CNC(=O)N2CCC[C@H]([C@@H](O)C(F)(F)F)C2)cc1)C1CCCCC1 764766182 GKILAWNXGOVSPJ-FXAWDEMLSA-N 427.511 4.300 10 10 IICE O=C(NCc1ccc(C(F)F)cc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 765840897 VFRNGBFCMDDGOI-UHFFFAOYSA-N 438.477 4.122 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(-c2cscn2)c1 768532989 KIJNZOMKIMIVOT-UHFFFAOYSA-N 432.593 4.272 10 10 IICE Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 772882928 JMSWYQBGPYAIAI-NRFANRHFSA-N 426.948 4.312 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1CCCN(c2nc3ccccc3s2)C1 804737972 XOUZUFGCMYYGSY-ZDUSSCGKSA-N 446.370 4.297 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(O)cc(C(F)(F)F)c1 857456856 QUZBILDQGIVRNF-CQSZACIVSA-N 430.373 4.411 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)c(C)n1-c1cccc(Cl)c1 919979174 UCIHLROYEUCUEJ-GOSISDBHSA-N 428.945 4.447 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCC(C(=O)N3CCc4ccccc43)CC2)cc1 920765097 WZHGCBOBXXPQAQ-UHFFFAOYSA-N 434.584 4.044 10 10 IICE Cc1nc(-c2ccc(F)cc2)sc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1134882243 NJUYADUQPMYRJY-FQEVSTJZSA-N 426.561 4.356 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccn(-c2ccccc2Cl)n1 1137438298 KNWQTWMYRHFZQM-KRWDZBQOSA-N 445.350 4.279 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCCc2ccc(C(=O)NCCc3ccc(O)c(O)c3)cc21 1150487585 GEIPQOMYKHZLHD-LJQANCHMSA-N 440.540 4.015 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 1156287727 QXYIUSGLHQDXNM-MRXNPFEDSA-N 427.501 4.087 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(C(F)(F)F)cc(Cl)n3)cc2F)C[C@@H](C)O1 1182412950 KERKDDXTXDZWET-TXEJJXNPSA-N 445.844 4.437 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCC4(CCOCC4)O3)cc2Cl)C1 1235832788 GWWQRMVJFAHJAN-IEBWSBKVSA-N 435.996 4.104 10 10 IICE O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 1252903106 TZRPIIZLWNGSMQ-AZUAARDMSA-N 443.975 4.263 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3ccc(F)cc3)CC2)N(C)C)cc1 1256232882 WKNBHQYFTDWANQ-XMMPIXPASA-N 426.580 4.159 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(F)c(Br)c(Cl)c2)N(C)C)cc1 1289601944 HCKJUMPUFJIEOS-QGZVFWFLSA-N 442.760 4.340 10 10 IICE CC[C@H](C)c1nnc(N2CCC(C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291492281 UPACNOLUHSGYIW-FQEVSTJZSA-N 425.621 4.285 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1 1292488090 YELWYWMALIKTGY-UHFFFAOYSA-N 429.520 4.073 10 10 IICE COC(=O)CN(CCc1ccccc1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1296245150 OTFVMNUESVWPIE-UHFFFAOYSA-N 432.520 4.073 10 10 IICE COc1ccc(N2CCN(CCCNc3nc(C(F)(F)F)nc4ccccc34)CC2)cc1 1306918118 LTWFKUDQBYABIR-UHFFFAOYSA-N 445.489 4.281 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)Cc2cccc(O)n2)sc(C)c1-c1ccccc1 1308104073 BZJPZMQLJKBDPY-UHFFFAOYSA-N 439.537 4.071 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCc1cnc(SC2CCCC2)nc1 1312774880 DDVYADLOOKRIDD-UHFFFAOYSA-N 427.618 4.352 10 10 IICE CCN(CC)CCCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1313720640 QMIIHQHYKIKFRV-UHFFFAOYSA-N 442.652 4.033 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CC(=O)N(c3cccc(F)c3)C2)cc1 1350076787 MKUGAHOPMFQGRH-IBGZPJMESA-N 435.499 4.067 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc2c(c1)COC2 1457978008 JJPIZZNCEOBQSS-GIJQJNRQSA-N 428.510 4.086 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC2(c3ncccn3)CCOCC2)cc1 1462976862 MDBNRNKMVPRODQ-UHFFFAOYSA-N 430.512 4.394 10 10 IICE COc1ccc2c(c1)CCN2C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1464514338 SSIUAEXDNOBMFP-UHFFFAOYSA-N 426.314 4.463 10 10 IICE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc2c(c1)CCCN2C 1464517898 GVTMEPMBWASDBP-OAQYLSRUSA-N 427.976 4.183 10 10 IICE Cc1cc(C)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)n1 1465324944 KLYYFIHZOIOUNK-FQEVSTJZSA-N 426.561 4.069 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCN(c4ccc(Cl)cc4Cl)C3)C2)cc1 1470026519 PTHYDRCEZKBCGA-DLBZAZTESA-N 449.382 4.159 10 10 IICE Cc1c(Br)ccc2[nH]c(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc12 1470447025 CUMAHJWBPGMVLJ-UHFFFAOYSA-N 442.357 4.130 10 10 IICE Cc1cc(C)c2[nH]cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)c(=O)c2c1 1472483551 FEVVODNCZYORFS-NRFANRHFSA-N 433.552 4.032 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(C)(C)SC 1495111087 JFYDXJOUBAEZPU-GOSISDBHSA-N 431.650 4.406 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)CCc2cccs2)cc1F 1503394776 XJMTVFDHZQZELE-SFHVURJKSA-N 443.592 4.166 10 10 IICE COc1ccc(-c2nc(C)c(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)s2)cc1 1529404503 VJGUBQIZFUKVQT-QGZVFWFLSA-N 437.565 4.392 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1-c1cnn(C)c1 1539583101 YFGJBIDEULBTEA-IBGZPJMESA-N 440.494 4.396 10 10 IICE CCCN(CC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1547126070 UHMGOXATGJUXFG-UHFFFAOYSA-N 439.648 4.459 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)CCOC(C)(C)C)cc1F 1552831099 HSCCFJHOIYVQEV-UHFFFAOYSA-N 445.608 4.435 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@H](O)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1566636714 LPKHSIUYVNSAEF-IRXDYDNUSA-N 445.279 4.384 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NC(=O)OC(C)(C)C)c1cccc(OC)c1 1583569274 GJCVKIKAEZUALZ-JOCHJYFZSA-N 441.572 4.376 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(CCN4[C@H](C)CC[C@H]4C)CC3)c2C)c1 1584484219 FTKUDMRGCJXHNQ-FGZHOGPDSA-N 436.644 4.342 10 10 IICE O=C(CCCOc1cccc(Cl)c1Cl)NCc1ccc(N2CCC(O)CC2)cc1 1585536285 YDMDNUNPBHWZKW-UHFFFAOYSA-N 437.367 4.430 10 10 IICE C[C@]1(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1(Cl)Cl 1587670837 AWVSQSFSBDDBEF-OQRGYWNNSA-N 449.450 4.430 10 10 IICE CC1(C)CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)CCO1 1611796197 NCUWVFYRKISVSC-UHFFFAOYSA-N 447.605 4.262 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)CCO1 1614439272 VVMOJFGIKYWPIJ-SIKLNZKXSA-N 437.588 4.393 10 10 IICE CN(CCc1ccc(Cl)cc1)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1616832072 LCQQVRVJOLGCKX-UHFFFAOYSA-N 432.907 4.228 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@]3(CCCOC3)C2)c(C)n1-c1cccc(Br)c1 1626294825 YTIWJZSDFWFXCH-OPAMFIHVSA-N 447.373 4.267 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1C[C@@H]1C1CCCC1 1627953421 JRBUQPHEAUXTIH-FYNPWXODSA-N 432.586 4.360 10 10 IICE CCn1cc(Cl)cc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1629685997 UTTKLVDXEIALJS-SFHVURJKSA-N 434.968 4.223 10 10 IICE Cc1cc(C(=O)N2CCC3(CCC3)S(=O)(=O)CC2)c(C)n1-c1cccc(C(C)C)c1 1630042080 VHYFPIJHPNHZTA-UHFFFAOYSA-N 428.598 4.401 10 10 IICE Cc1cc(CC(=O)N[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1633194425 FYGGEMPLTSOVFJ-FYYLOGMGSA-N 430.470 4.287 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3c(OC)ccc4ccccc34)C2)cc1 1636354181 SWAQAVQDWWULAZ-IBGZPJMESA-N 433.552 4.225 10 10 IICE COCn1ccc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1650743807 DGVIJAYIHJVZND-SFHVURJKSA-N 432.446 4.412 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(N)=O)C1 1694979950 LPOCAODYIPDDRX-HGIZVSNUSA-N 432.572 4.021 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1Cc1cccc(C(F)(F)F)n1 1696700198 VJFJARKTEOUNSW-UHFFFAOYSA-N 440.429 4.144 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CC(F)(F)C1 1698065381 FXIIZHUFDNIFDF-UHFFFAOYSA-N 429.515 4.481 10 10 IICE C[C@H]1CCCN1c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)c(F)c1 1726579742 LTFXTWOGYTWXBR-ZDUSSCGKSA-N 447.356 4.278 10 10 IICE CCC[C@@H](C)NC(=O)[C@H]1CCCN(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1727941835 JZCGTAGMKGHXNC-KNQAVFIVSA-N 440.636 4.002 10 10 IICE CCC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1727989408 AUVPHDGJWXNXRC-PKTZIBPZSA-N 441.620 4.420 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1 1743445847 PMBGYGCHRGTNIY-VWLOTQADSA-N 437.588 4.129 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1CC1CC(F)(F)C1 1747719907 DOJXXJFJNMJVMK-UHFFFAOYSA-N 447.574 4.385 10 10 IICE CCO[C@]1(c2nnc(N(C)CC(C)(C)C)n2CCCSc2nccs2)CCOC1 1765812029 CXKYLYFKUOAEOO-HXUWFJFHSA-N 439.651 4.051 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@]3(CCSC3)C2)cc1F 1768496989 VVFKLBDYMZFPAG-HSZRJFAPSA-N 431.625 4.454 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4cccc(OC)c4)cc3)CC2)cc1 1872882934 WQEIDKZUGCJQGB-UHFFFAOYSA-N 431.536 4.278 10 10 IICE COCCCN1C(=O)C(NCc2cccs2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164067 KNSQFFCHWWHWIR-UHFFFAOYSA-N 449.576 4.062 10 10 IICE COc1cccc(N2C(=O)C(=C3C(=O)Nc4ccc(Br)cc43)SC2=S)c1 2053497424 JOWPDPOORRVBNV-UHFFFAOYSA-N 447.335 4.186 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)C[C@@H]2CCCO2)cc1Br 2152224413 XSZQLPCASSGIJQ-NRFANRHFSA-N 433.390 4.371 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)c1O 2236035859 HYFFHXIDVXDTAC-INIZCTEOSA-N 441.366 4.043 10 10 IICE O=C(O)CN1C(=O)C(=Cc2ccc(-c3ccc(F)c(C(F)(F)F)c3)o2)SC1=S 2294821329 BYGISGQHGPWEKP-UHFFFAOYSA-N 431.388 4.390 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1cccc([N+](=O)[O-])c1 2313499133 PLWDHEIWVSDNAP-UHFFFAOYSA-N 443.253 4.235 10 10 IICE Cc1cccc(NC(=O)CCN2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)c1 2314827774 MCLBRFYKKNJOJE-UHFFFAOYSA-N 427.507 4.133 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccc(OC)cc3)C2=O)cc1 2314831641 PARIIYNLHJFNFK-UHFFFAOYSA-N 442.562 4.324 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1C[C@H]2NCc1cc(Cl)cc(Br)c1O 2318636793 IUZCTXIIMQIOOS-CORIIIEPSA-N 431.758 4.296 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)C2=Cc2ccc(OC)c(O)c2)cc1 2332100041 FRPAPPWWNHFRCM-UHFFFAOYSA-N 432.451 4.379 10 10 IICE CN(Cc1ccc(I)c(Br)c1)c1ccc(CN)cc1 2349920775 MFZSLVYPPCLQSH-UHFFFAOYSA-N 431.115 4.149 10 10 IICE CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352635251 CYFMREYRNBYBFG-CQSZACIVSA-N 429.355 4.163 10 10 IICE CCC[C@H](CC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2352638549 XCBQRDPUULHSJZ-CQSZACIVSA-N 429.355 4.163 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C2(C)CC2)c(O)c1Br 2381129274 HVDRBAQJMBWJCE-MRXNPFEDSA-N 441.366 4.115 10 10 IICE O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)cc1 14550784 ZZUZOJCBIFQLHI-JQVVWYNYSA-N 425.510 4.206 10 10 IICE O=C1NC(=S)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/NCc1ccc(Cl)cc1 23324506 DIGGYBWAVKHZFI-UKTHLTGXSA-N 440.739 4.068 10 10 IICE CCN(C)c1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)C3CCCCC3)c2)c1 109685778 ORIAYEPRLGIJEJ-UHFFFAOYSA-N 429.586 4.348 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccccc3F)C2=O)ccc1OCCC(=O)O 210464258 BTOOEORROBCTKD-PDGQHHTCSA-N 447.509 4.484 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(OC)c1O)N2 226721287 PJQPMXCRGSUPTR-IECBHUPTSA-N 435.568 4.299 10 10 IICE O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 732469136 AAYYNWNKPQRBMN-WQYPUDFKSA-N 449.595 4.278 10 10 IICE C[C@H](N[C@H](CO)c1cccc(Br)c1)c1cc(Br)c(F)cc1O 756760945 KULQZSMYSRHRNT-BJOHPYRUSA-N 433.115 4.441 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)cc1 764889074 VSZHQGIJRMXKDF-SSZFMOIBSA-N 435.567 4.488 10 10 IICE COC(=O)C(C)(C)[C@@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 767146200 VZKZHHHOVOKJKF-UNMCSNQZSA-N 440.540 4.023 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OC[C@H](F)C(F)(F)F 800126250 CAYVYDHCZARHDE-BRNRAETOSA-N 427.466 4.173 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N(Cc1cccs1)C1Cc2ccccc2C1 806512741 SVZFNTQJGBCFGL-UHFFFAOYSA-N 447.604 4.464 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC[C@@H](c4ccccc4)O3)cc2F)C[C@H](C)O1 811863937 GTIOCAXBTKJDAW-NIMADECDSA-N 441.547 4.159 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccccc1OCc1ccc(F)cc1 1083988487 HHFIZRNYUBBSIE-MOSHPQCFSA-N 434.398 4.210 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cnc(OCC3CC3)c(Cl)c2)cc1 1142713641 XSEPQZALPGCDNS-OAQYLSRUSA-N 443.975 4.411 10 10 IICE Cc1cc(CC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c(C)n1-c1ccc(Cl)cc1 1264245414 UICZUBUFHSVHDU-UHFFFAOYSA-N 445.972 4.179 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CC(c3c(F)cccc3F)=NO2)cc1 1264452236 GVCZMWHYXQOFTC-JOCHJYFZSA-N 439.462 4.346 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(F)c(Br)ccc2[nH]1 1290324765 YUKWCKCTEVDMDU-UHFFFAOYSA-N 446.320 4.178 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(Br)cc(F)c3O)c2)CC1 1296013133 KZUIDNZEFALFKK-UHFFFAOYSA-N 436.325 4.077 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CC[C@H](F)C3)CC2)cc1 1300247253 KHTIVYBTSMOZHT-UXHICEINSA-N 429.584 4.340 10 10 IICE Cc1cc(CNC(=O)CSc2nnc(-c3cccs3)n2C)c(C)n1-c1ccccc1 1438302842 MWHPVRFDLCANMQ-UHFFFAOYSA-N 437.594 4.360 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nc3cc(Cl)ccc3n2C)cc1 1448042751 ZGMIJGUGCUMLIU-UHFFFAOYSA-N 434.927 4.306 10 10 IICE Cc1cc(C(=O)NC[C@H](C)Oc2ccccc2Br)c(C)n1-c1ccccn1 1465681609 XQSNQJYZKLVMPJ-HNNXBMFYSA-N 428.330 4.449 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c[nH]c4cccc(Br)c34)C2)cc1 1469280867 SJQLDPWFOUDTRC-AWEZNQCLSA-N 428.330 4.195 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ccc(C(F)(F)F)cn2)cc1 1472048581 PPAOPXHAJKWDFM-UHFFFAOYSA-N 429.442 4.222 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2C)cc1 1472281325 VFFXARAYHHHJNK-RUZDIDTESA-N 434.584 4.201 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)Cc1ccc(F)cc1 1473127501 QEMJIDZHIVAJBW-OALUTQOASA-N 445.554 4.107 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@H](c3ccccc3)C3CCCC3)CC2)cc1F 1473270203 PZRDXNFDNRANGW-RUZDIDTESA-N 425.548 4.004 10 10 IICE Cc1cc(CNC(=O)NCCc2ccc(OCC(F)(F)F)nc2)c(C)n1-c1ccccc1 1478490736 PBTIUSVLJQZLJJ-UHFFFAOYSA-N 446.473 4.472 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCOC1)OC 1497193683 OCSJKPXOFORIIM-IFMALSPDSA-N 437.588 4.250 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@H]1C 1503798561 RTWRLDDCNUEULV-NQIIRXRSSA-N 448.615 4.361 10 10 IICE CC(C)(C)Cc1nnc(N2CC[C@@H]([C@H]3CCOC3)C2)n1CCCSc1nccs1 1508556106 BWPQWBCHSANIAU-SJORKVTESA-N 435.663 4.368 10 10 IICE CCOCc1nnc(N2CCC[C@H](C(F)(F)F)C2)n1CCCSc1nccs1 1516549437 NLONKZLNZIXMAC-ZDUSSCGKSA-N 435.541 4.232 10 10 IICE COc1ccc(N2CCC(NC(=O)C[C@@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1537034242 RBILMAZAGWOEKQ-LJQANCHMSA-N 433.593 4.110 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2cccc(F)c2)c(C)n1-c1ccccc1Br 1545584907 KHZLSRKFQMFDTD-HXUWFJFHSA-N 431.305 4.459 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CCCSC3)CC2)cc1 1554960004 WAJYZMWPZISVCA-HXUWFJFHSA-N 443.661 4.345 10 10 IICE COC(=O)c1cc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c2ncccc2c1 1558539003 KUHVIKAPRZQFCN-UHFFFAOYSA-N 427.460 4.494 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c1 1584148585 MYNSTPMMYLJAGL-UHFFFAOYSA-N 445.519 4.254 10 10 IICE Cc1ccc(C(=O)NC(C)(C)CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1585044957 OELNHCQJRMYAPL-UHFFFAOYSA-N 427.545 4.248 10 10 IICE COC(=O)c1ccc(OC)c2c1CCN(C(=O)c1cc(C)n(-c3cccc(C)c3)c1C)C2 1594152103 MYINPGDZFDYFJA-UHFFFAOYSA-N 432.520 4.396 10 10 IICE CCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)nc2ccccc2c1=O 1613263495 DDFSRRXVAWJMBH-UHFFFAOYSA-N 436.512 4.333 10 10 IICE CCCCn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@@]1(OC(C)C)CCOC1 1614529349 ALCGKGBNRCEOEJ-RUZDIDTESA-N 441.620 4.355 10 10 IICE COc1ccc(NC(=O)NC(=O)CN(Cc2cccs2)c2ccc(OC)cc2)cc1 1615887069 MMCDULDKRYUWCB-UHFFFAOYSA-N 425.510 4.120 10 10 IICE CCN(C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)[C@H]1CCN(c2ccccc2)C1=O 1616527493 XTRRPELQLSJWGQ-VWLOTQADSA-N 443.547 4.103 10 10 IICE COc1cccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 1618253700 QASBYCWMTMXDNJ-HXUWFJFHSA-N 427.545 4.065 10 10 IICE CCOC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)c1cc2cc(O)c(O)cc2s1 1625666524 DRJLTXQGWLSVKZ-SFHVURJKSA-N 435.501 4.370 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c1 1627090252 IMBSUMHIYCNECZ-HZPDHXFCSA-N 440.931 4.241 10 10 IICE CC(=O)Nc1cccc2c1CCN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)C2 1627741581 SCMAVHYDYRGDDQ-UHFFFAOYSA-N 429.520 4.372 10 10 IICE CN(C)C1CCN(c2ccc(NC(=O)c3cc4cc(O)c(O)cc4s3)cc2F)CC1 1628085731 YUTQFQLTGZLVFL-UHFFFAOYSA-N 429.517 4.234 10 10 IICE Cc1ccc(C(=O)N2CCC[C@H](NC(=O)c3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1628672644 NUJHPYSSOSKGTK-DEOSSOPVSA-N 443.547 4.250 10 10 IICE O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NCc1ccc(N2CCC(O)CC2)cc1 1630283510 RSBRXFVCQZMEQQ-UHFFFAOYSA-N 439.943 4.205 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](C[C@H]2CCCO2)C(F)(F)F)cc1 1631608345 ULWSSILQHSYYDW-AABGKKOBSA-N 428.495 4.008 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(Br)c(C)cc3OC)CC2)cc1 1632157858 FWYQYLZUBZPFNY-UHFFFAOYSA-N 433.346 4.127 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4Cl)c3CC)CC2)cc1 1632158034 NMMMXAAGEHVCAW-UHFFFAOYSA-N 438.959 4.449 10 10 IICE CC[C@@H](NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)c1ncc(-c2ccccc2)[nH]1 1636353549 DFRQQRBXEIJNQH-XMSQKQJNSA-N 433.556 4.362 10 10 IICE COc1cccc(C=C2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)CC2)c1 1637229262 WUWBLYSGQHDMEM-UHFFFAOYSA-N 435.568 4.045 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc(C)c1OCc1cccnc1 1640232480 RJLIJQHDQMWWMR-VWLOTQADSA-N 446.595 4.376 10 10 IICE COc1ccccc1-n1nnnc1SCC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1651661968 FHOXXQVTVIUXPC-UHFFFAOYSA-N 433.537 4.362 10 10 IICE Cc1cc(C(=O)CSc2nc3cc([N+](=O)[O-])ccc3c(=O)n2C)c(C)n1-c1ccccc1 1651914701 KAHZZEJLYHYIHA-UHFFFAOYSA-N 448.504 4.224 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@]23CCOC3)sc(C)c1-c1ccccc1 1660667180 DZHYTDGEEKQSHV-XMMPIXPASA-N 442.581 4.484 10 10 IICE C[C@@H]1[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)CCCN1C(=O)OC(C)(C)C 1683457127 LICBBCIYRRGYCL-IAQYHMDHSA-N 432.348 4.286 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H](CC)C2)n1Cc1ccc(N(C)C)cc1C 1694846675 CFPCFYKFLAEEKS-IBGZPJMESA-N 440.636 4.246 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)OC2CCCC2)cc1 1695624255 KAJPWLRELOJMBU-UHFFFAOYSA-N 434.588 4.469 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1745629038 KDPPSRNUOCAWTG-UHFFFAOYSA-N 432.576 4.156 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1752143346 ZYIHBARLNJOUHJ-FQEVSTJZSA-N 448.615 4.116 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1763596548 YCUFWUHTIUAJJM-JQVVWYNYSA-N 443.661 4.254 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@@H]1C 1768007042 KFNWEUZUSFWGPM-ICSRJNTNSA-N 437.588 4.391 10 10 IICE Cc1c(OCCOc2ccc(Cl)cc2)c(=O)ccn1CCCOc1ccc(N)cc1 1857919460 ICVGVNWPWMDZST-UHFFFAOYSA-N 428.916 4.319 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)C3CCN(C(=O)c4cccs4)CC3)ccc21 1860587346 JOFGHVAEUCFPEG-UHFFFAOYSA-N 444.512 4.014 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010390456 DPKVWSKHRLGYFE-QXAKKESOSA-N 431.537 4.034 10 10 IICE CN(CC(C)(C)NC(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044634338 YFKXFGWFXBMCEM-UHFFFAOYSA-N 448.608 4.302 10 10 IICE Cc1cc(O)c([C@H](n2nc(C(F)(F)F)c(C(N)=O)c2Br)C2(C)CC2)cc1C 2080032137 AUGMPHQXQXSWRB-AWEZNQCLSA-N 446.267 4.475 10 10 IICE Cc1c(C(=O)O)cccc1-n1c(C)cc(C=C2NC(=O)N(Cc3ccccc3F)C2=O)c1C 2294049444 YUQSQDXOHWLRES-UHFFFAOYSA-N 447.466 4.333 10 10 IICE COc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccc(C)c(Cl)c2)C1=O 2296552801 ZNLCFIFTQAUNAZ-UHFFFAOYSA-N 449.688 4.086 10 10 IICE C[C@@H](C(=O)Nc1ccc2oc(=O)ccc2c1)N1C(=O)C(=Cc2cccs2)SC1=S 2296559510 JHZHTICGCAJFBX-NSHDSACASA-N 442.543 4.083 10 10 IICE Cc1ccc(CN[C@H]2CCCC23CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352931946 GDKUHWZFMITAID-HNNXBMFYSA-N 425.367 4.342 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1)N2 20754784 ZMAAHQOQRSBLTG-CLWLKPMESA-N 428.529 4.110 10 10 IICE C[C@H](NC(=O)/C=C/c1ccc(OCc2ccccn2)cc1)c1ccc(N2CCOCC2)cc1 109181215 MNVIQJKPDDGQRP-MYHKYFONSA-N 443.547 4.388 10 10 IICE Cc1cc(C(=O)N2CCC(CN3C[C@H](C)O[C@H](C)C3)CC2)c(C)n1-c1ccc(F)cc1 110458329 YCBVGHWIXNSWRC-KDURUIRLSA-N 427.564 4.195 10 10 IICE Cc1ccnc(OC2CCN(C(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)CC2)c1 436055415 WJRMKLFCZVOFFR-UHFFFAOYSA-N 446.595 4.181 10 10 IICE CC(C)NC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 586703350 GFQUNIKZDUXVCG-UHFFFAOYSA-N 427.460 4.244 10 10 IICE CC(C)Cn1ncc2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc21 742805902 PLJIHHSTOYWSOE-SFHVURJKSA-N 443.498 4.088 10 10 IICE C[C@H](NCc1ccc(Cn2ccccc2=O)cc1)c1cc(Br)cc(F)c1O 756480436 WPVZRCIRAJUGOU-AWEZNQCLSA-N 431.305 4.355 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N(Cc1ccco1)C1CCCC1 769716806 PZCIOUAWSRPQDL-UHFFFAOYSA-N 446.550 4.433 10 10 IICE Cc1cc(Br)c(O)c(CN[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)c1 786841591 SEBVDWCMBSTRSU-GOSISDBHSA-N 439.300 4.022 10 10 IICE C[C@H](Oc1cccc(Br)c1)C(=O)NCc1cc(Br)ccc1O 804736171 LZSBUXDBDIGIIB-JTQLQIEISA-N 429.108 4.001 10 10 IICE CC(C)N(C)Cc1cc(O[C@H]2CCN(Cc3cc(Br)ccc3O)C2)ccn1 856559358 GBVQGQUUCFHDIW-FQEVSTJZSA-N 434.378 4.043 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)n1 919847098 BPLQTBOCUJLVDT-LJQANCHMSA-N 434.515 4.428 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cccc(C(F)(F)F)c3F)cc2F)CC1 1125975851 CEQDRWRJXWRRTQ-UHFFFAOYSA-N 427.417 4.056 10 10 IICE O=C(Cc1c[nH]c2nccc(Cl)c12)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1136546636 PMMAPRPDIJMWDZ-UHFFFAOYSA-N 434.874 4.145 10 10 IICE COc1ccccc1OC[C@@H](C)CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1137632353 ARPZJLYZQLHDPI-SFHVURJKSA-N 434.536 4.289 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc2cc(OC)ccc2c1 1139585793 VTMCXMVIZKPZEA-UHFFFAOYSA-N 435.524 4.246 10 10 IICE O=C(CC1(CNC(=O)OCc2ccccc2)CCCCC1)NCc1c(O)cccc1F 1178413838 ZFQVFBNBASFMAB-UHFFFAOYSA-N 428.504 4.415 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1180178532 BVIROVSEYYVHJZ-VWLOTQADSA-N 432.568 4.005 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCC1CCN(Cc2ccncc2)CC1 1230733817 ZPHZMNFQZZSLOC-UHFFFAOYSA-N 435.616 4.126 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCCCc3ccc(Br)cc3)cc2)CC1 1288330712 RCGXBBZFLAHLOB-UHFFFAOYSA-N 444.417 4.230 10 10 IICE CCc1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1S(N)(=O)=O 1292244735 CIYVBQLESYASHN-UHFFFAOYSA-N 425.554 4.173 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCO[C@](C)(CC)C2)cc1 1295420175 NLMXPQRMHJOJIX-AREMUKBSSA-N 448.615 4.164 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1[C@@H]1C[C@H]1C(C)C 1299204248 MCZWSVFKLVORNS-RBBKRZOGSA-N 434.588 4.142 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CCOC(C)C)CC2)cc1 1300246409 AGQXYWOSNLWBOY-UHFFFAOYSA-N 427.593 4.086 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCC[C@]2(C)NC(=O)OC(C)(C)C)cc1 1300282627 WRITUBYKKMSIDM-YKSBVNFPSA-N 433.593 4.063 10 10 IICE C[C@H](c1cccs1)N(C)c1nnc([C@@H]2CCC(=O)N2)n1CCCSc1nccs1 1303623444 VXNLFQQTKLELCL-KGLIPLIRSA-N 448.643 4.127 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1306426823 CVEVOSAUMJDWLL-YADHBBJMSA-N 427.593 4.029 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCOc1cccc(C(=O)OC)c1 1307273081 WWEZAXPKRBRGLE-UHFFFAOYSA-N 440.521 4.299 10 10 IICE COc1cc(Br)cc(CNC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c1 1312886548 WYSWMJCJWPITDK-HNNXBMFYSA-N 434.378 4.263 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC/C=C/c3ccc(Br)cc3)C2)cc1 1312995277 UMDDVWIRQCHHIB-GVTIMSHASA-N 444.373 4.439 10 10 IICE COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1313414819 NSUUSTGLZSUCSE-GBXCKJPGSA-N 438.616 4.343 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C(=O)OC)c3ccc(Cl)c(F)c3)ccc21 1435598711 XPEXEFLSPORVHP-NRFANRHFSA-N 446.906 4.341 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1)C1CCCCC1 1442453000 URIMGFUKGNNXJV-SFHVURJKSA-N 441.522 4.403 10 10 IICE CC(C)C[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(=O)OC(C)(C)C 1457800796 GGXZBRDGQUDMPH-OAQYLSRUSA-N 441.616 4.280 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](Cc3ccccc3)CN3CCOCC3)c2C)c1 1465307298 DDOBHSMSRFPULZ-XMMPIXPASA-N 431.580 4.076 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC(=O)c1cc3cc(O)c(O)cc3s1)C2 1471204511 BFIHWWJCMGDCMU-YOWGUQMCSA-N 432.542 4.220 10 10 IICE Cc1cc(CN(CCC(C)C)c2c(O)nc(=O)n(Cc3ccccc3)c2N)ccc1N(C)C 1473266389 LHBHBERRFCFVHU-UHFFFAOYSA-N 449.599 4.007 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H](C)c3cccc(C4CC4)c3)CC2)cc(OC)c1OC 1478720305 QQXYILRHHSMXCF-KRWDZBQOSA-N 439.556 4.183 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1Cc1ccnc(C(F)(F)F)c1 1503488276 SIBBGXLAYBYDMH-UHFFFAOYSA-N 440.429 4.144 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC[C@H]1C[C@H](F)C1 1513020245 UBBVSDWXQNLWBA-KZNAEPCWSA-N 433.547 4.404 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1-c1cnn(C)c1 1527480791 AMOMIVCKJQTEBM-HDICACEKSA-N 436.531 4.078 10 10 IICE COc1ccc([C@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(OC)c1 1529330942 LHDUHCAWOFDFSZ-SFHVURJKSA-N 435.568 4.302 10 10 IICE CCN(CC)[C@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)c1cccc(C(F)(F)F)c1 1531729990 OIFXTTYAHNIHNP-UGKGYDQZSA-N 449.517 4.492 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccnc3Sc3ccccc3)CC2)c(OC)c1 1534586991 KQWXPLVHODJCKA-UHFFFAOYSA-N 435.549 4.212 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)C1CC1 1542227310 YWUCEEKCBRBDIC-UHFFFAOYSA-N 429.366 4.057 10 10 IICE CCCCCn1c([C@H]2CCCOC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1546975277 LCRBLKDUXPQELP-FQEVSTJZSA-N 427.593 4.088 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cn(-c2ccccc2C(F)(F)F)nn1 1556884403 ZHKOFARIAUKPHA-UHFFFAOYSA-N 431.201 4.229 10 10 IICE COC1CCN(c2ccc(CN3CCN(c4ccc(Br)cc4)CC3)cc2)CC1 1559975873 BDINAOYYNYTPHN-UHFFFAOYSA-N 444.417 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC[C@@H](NC(=O)OC(C)(C)C)C(C)C 1564946950 ZBYQDSFWIBLWBW-WIYYLYMNSA-N 434.625 4.231 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(Cl)c(F)c2)NC(=O)OC(C)(C)C)cc1 1565882057 OFTXBIRQIQMNNV-FQEVSTJZSA-N 449.954 4.470 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@@H](OC)C(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1613206826 JPKQNTVPUJRACY-WIYYLYMNSA-N 443.661 4.254 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCc3cc(F)ccc32)NC(=O)OC(C)(C)C)cc1 1618253961 UXXPBNXKQFYPKG-YADHBBJMSA-N 441.547 4.304 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2CC(=O)N1CCCN(Cc2ccc(C)cc2)CC1 1618691206 DPRFPMMFSIIFAD-VWLOTQADSA-N 449.639 4.373 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCc1cccc(OC)c1OC 1626511082 HLLKKFFTVIKHBL-UHFFFAOYSA-N 442.556 4.025 10 10 IICE Cc1cc(Br)cc(C)c1N1CCC[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 1627048426 UKRKZHXZGDSTHY-XOWYPZSQSA-N 445.357 4.276 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1629084248 NODCOYJNTZYVDR-JOCHJYFZSA-N 431.536 4.232 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)C2CCC(O)CC2)NC(=O)OC(C)(C)C)cc1 1629679377 OSJWFGBZQRHKDJ-DQVLVPHSSA-N 447.620 4.012 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)c1 1630135073 NUYCSTCEEBPDMU-QFIPXVFZSA-N 439.556 4.378 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)nn2-c2ccccc2)cc1 1632681254 OEZYQQWSEUGITB-KRWDZBQOSA-N 443.503 4.320 10 10 IICE COC(=O)CC1(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCCC1 1634623046 MOSLRUDJNFDGTG-UHFFFAOYSA-N 433.346 4.462 10 10 IICE Cc1cc(F)cc(-n2nc(C(=O)NCc3cccc(Br)c3O)c3c2CCC3)c1 1634725522 YQGZRCXLNPDWOZ-UHFFFAOYSA-N 444.304 4.207 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(Cc3cccc4ccccc34)CC2)c([N+](=O)[O-])c1 1639220648 UYPLNEAVCLJJRA-BENRWUELSA-N 431.492 4.256 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCOC[C@H]1c1ccc(Br)cc1 1640990912 WBBVGIJTPGZWIX-AWEZNQCLSA-N 434.311 4.289 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@@H]3CCCC(=O)N3C)n2)c(C)n1-c1ccc(F)cc1 1641141975 NWYBBIRALCEOGO-IBGZPJMESA-N 426.517 4.306 10 10 IICE CCOC(=O)C1([C@@H](C)NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)CCOCC1 1648075267 UMANTUVQPHJUOS-QGZVFWFLSA-N 432.948 4.226 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC(C)(C)Cc3cccc(Br)c3)C2)cc1 1674326414 IZQFGUXKPFAWRB-SFHVURJKSA-N 446.389 4.357 10 10 IICE CC[C@@]1(C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCO1 1694455731 MMYXLMWGCQKEHY-VWLOTQADSA-N 425.621 4.303 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1695627681 ZMGJUDNCIXVJJA-CTNGQTDRSA-N 441.620 4.070 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC[C@H]1CC 1696248491 MWEMQYRVGKUMGV-YADHBBJMSA-N 441.620 4.114 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)Cc2cnc(C)s2)cc1 1710026143 YWWNFRUMZHKMLH-UHFFFAOYSA-N 448.600 4.031 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@H]1OC 1710030987 ZJISOVNWOCLFNI-NZQKXSOJSA-N 437.588 4.250 10 10 IICE CC(C)c1nnc(N2CCCN(CC(F)(F)F)CC2)n1CCCSc1nccs1 1741366893 URHWAAKDLOYEDT-UHFFFAOYSA-N 448.584 4.115 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)S1 1752359705 MUDPJOZFERYJAQ-KDURUIRLSA-N 443.661 4.082 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H](C)CC 1764560729 BHYHZDBPCZVUBA-GOSISDBHSA-N 436.604 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccn2)cc1 1764939025 RBNAFTOCZRRQNO-NRFANRHFSA-N 434.588 4.098 10 10 IICE CN(c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1)[C@H]1CCSC1 1768556829 KBLWHPDXXYHMJA-LSDHHAIUSA-N 425.649 4.100 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1769561518 MWLZLCOCOKAQNL-QZTJIDSGSA-N 425.602 4.329 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)[C@@H](C)C1 1770784252 LODFVCXFWTXQPX-ABSDTBQOSA-N 425.552 4.429 10 10 IICE O=C(O)CCc1sc(NS(=O)(=O)c2ccc3c(c2)CCC3)nc1-c1cccs1 1858070109 HPCGVMUNHTYPNI-UHFFFAOYSA-N 434.564 4.178 10 10 IICE Cc1nc2ccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc2nc1C 1866004509 NFQDHFDCMQBSJF-VWLOTQADSA-N 431.584 4.270 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C3CC3)c(C(=O)O)c2I)c(O)c1 2078992606 QNTMWDHRTRFWSB-INIZCTEOSA-N 440.281 4.323 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](NCc2ccc(Br)cc2O)(C(F)(F)F)C1 2103576284 UENZXACJTIHRPT-INIZCTEOSA-N 439.272 4.186 10 10 IICE Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C(C)C)C3=O)c(Oc3ccccc3)nc12 3652411 SPZLIGOHWNFGIP-SFQUDFHCSA-N 437.546 4.405 10 10 IICE CC[C@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)C1=O 11636329 GNRSFNXMPNCQNS-OAHLLOKOSA-N 437.587 4.231 10 10 IICE Cc1cc(C)c(S(=O)(=O)Nc2nc(-c3ccc4c(c3)NC(=O)[C@H](C)O4)cs2)c(C)c1 11857579 SEBMNQGJRJJYCQ-AWEZNQCLSA-N 443.550 4.256 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@@H](C)C(=O)O)C2=O)ccc1OCc1ccc(C)cc1 33633606 HZWOAPJQURMERP-YRIIZNAFSA-N 443.546 4.257 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)Nc3ccccc3F)c3ccco3)CC2)cc1 38637899 DHJKJQZSOZRTQW-JOCHJYFZSA-N 438.503 4.112 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)c4ccccc4F)c(C(=O)O)c3)CC2)cc1 64589513 QOLJSECMUZLTKT-UHFFFAOYSA-N 449.482 4.111 10 10 IICE CCCCOc1ccc(/C=C2/SC(Nc3ccccc3C(N)=O)=NC2=O)cc1OC 208334354 UARLNLSVVMYIPU-CPNJWEJPSA-N 425.510 4.055 10 10 IICE CCN1C(=O)/C(=C/c2c(Oc3cccc(C)c3C)nc3ccccn3c2=O)SC1=S 213164841 DUULDOZWDFVYMB-ATVHPVEESA-N 437.546 4.325 10 10 IICE CC[C@H](C)OC(=O)[C@H]1CC=CC[C@H]1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 725395952 QLRZZMNXCMFWJZ-IPELMVKDSA-N 431.488 4.325 10 10 IICE Cc1csc([C@H](C)NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 727669174 HUBMQYBSPTZHJF-IGVUGNCQSA-N 437.637 4.372 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 735519006 NCEMLCLEDXQOQI-OAQYLSRUSA-N 440.540 4.238 10 10 IICE O=C(NCCCSc1nccs1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 759589240 GLSJNYKSXYGOKS-HNNXBMFYSA-N 447.561 4.404 10 10 IICE CN1CC[C@H](NC(=O)NCc2cccc(Br)c2O)[C@@H]1c1ccc(Cl)cc1 764798173 ASYOLIFHAKSING-IRXDYDNUSA-N 438.753 4.053 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(OCC(F)(F)F)c4ccccc4n3)CC2)cc1 772129978 WUPBNLCEZHSEQC-UHFFFAOYSA-N 445.441 4.147 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3cccnc3C(F)(F)F)sc2C)cc1 808527122 ZBACUBUCZQQKCP-UHFFFAOYSA-N 429.445 4.342 10 10 IICE CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NCc1c(O)ccc2c1CCCC2 1137443346 MFYCOSXFFAZDDC-HHHXNRCGSA-N 444.575 4.424 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(Br)c2ccccc2c1 1142234696 COCJMVPAKMILNB-UHFFFAOYSA-N 425.326 4.369 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](C)N3CCN(c4ccc(F)cc4)CC3)c2C)c1 1151153643 NBMZDQCFYUHOKC-QFIPXVFZSA-N 448.586 4.369 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1160619826 VOUPXNUQJHYAOP-HDJSIYSDSA-N 434.558 4.373 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@](C)(C(F)F)C2)c(C)n1-c1ccc(Br)cn1 1167341460 HMPLPJNACBDIFV-HXPMCKFVSA-N 442.304 4.136 10 10 IICE Cc1cccc([C@@H]2CCCCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 1167458441 TVRNVABFIYIMKN-DEOSSOPVSA-N 439.575 4.204 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(Oc2ccccc2)ccc1O 1293928506 FNRDRYYUGJXNHA-UHFFFAOYSA-N 432.520 4.323 10 10 IICE CCN(CC)[C@H](C)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1295573678 ZQKHGKYUCVKGSJ-HXUWFJFHSA-N 442.652 4.031 10 10 IICE COc1cc(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)cc(OC)c1 1308173301 MQTOZPMVKOFLQH-UHFFFAOYSA-N 436.508 4.366 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CC[C@@H](F)C3)CC2)cc1F 1315512127 JGFVWSRBKGNXRE-DLBZAZTESA-N 433.547 4.188 10 10 IICE Cc1ccc2nc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)ccc2c1 1354329229 SGMOLYMYFOLGCF-UHFFFAOYSA-N 429.442 4.329 10 10 IICE C[C@H](NC(=O)C(F)(F)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 1357126334 AAXFVMSTOPCWFY-AWEZNQCLSA-N 439.300 4.255 10 10 IICE Cc1cc(CC(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)c(C)n1-c1ccc(Cl)cc1 1435519298 KDSHKOMJKITWQW-QHCPKHFHSA-N 444.362 4.460 10 10 IICE CO/C(=C\c1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324415 DSDOAJCNWSARSH-YVUGPFRESA-N 439.556 4.122 10 10 IICE C[C@H](Cc1cccc(F)c1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1468860548 QNIKIHIDZOBCLE-CQSZACIVSA-N 448.541 4.097 10 10 IICE CCOP(=O)(CN(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)OCC 1469439059 TUYKMIIPWLAYTB-UHFFFAOYSA-N 435.505 4.090 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(C)n1-c1ccccc1 1470968763 HJRZWOZUDDPMPS-KNQAVFIVSA-N 440.588 4.334 10 10 IICE C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1478810288 CVACNFCOOXBTGY-UWJYYQICSA-N 439.531 4.345 10 10 IICE CC[C@H](C)c1nnc(N(C)CCCSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1495190339 KXAZNALMBYLVRF-KRWDZBQOSA-N 435.613 4.005 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CC[C@@H](F)C1 1509131289 FDCAOIWEFUWDAS-LEWJYISDSA-N 429.584 4.088 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(F)cccc1-n1cccn1 1524059020 TVLNOIXENUJFGG-HNNXBMFYSA-N 430.430 4.012 10 10 IICE CC(=O)c1ccsc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1527076084 HZVCDHDBYAIGLY-XNTDXEJSSA-N 434.539 4.320 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccccc3)cc2Cl)C1 1530423137 AGLZXRSAJFCHMH-SFHVURJKSA-N 427.976 4.403 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c(OC(C)C)c3)CC2)cc1 1535591252 YUHMEBAIJALFKD-UHFFFAOYSA-N 433.346 4.207 10 10 IICE CC(C)Cc1nnc(N(C)C[C@H]2CC=CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1541430248 NBWNRGSLZLSJOR-FQEVSTJZSA-N 441.595 4.293 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1NS(C)(=O)=O 1543121144 GWISZDWPSWQKQN-UHFFFAOYSA-N 441.553 4.343 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1CC(F)(F)C1 1545332815 OUWNCJJARPUVMZ-QGZVFWFLSA-N 433.547 4.310 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCn1cnc2ccccc21 1556426241 DCOVRUHNRJDHBC-UHFFFAOYSA-N 436.556 4.205 10 10 IICE COc1cccc(N2CCN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1565162031 KCHSWCGDDFVADI-UHFFFAOYSA-N 432.568 4.177 10 10 IICE COc1ccc(N2CCN(C(=O)COC(c3ccccc3)c3ccccc3)CC2)cc1F 1566346711 JDEFTEGCBJNVJU-UHFFFAOYSA-N 434.511 4.289 10 10 IICE CC[C@@H]1[C@@H](NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CCN1C(=O)OC(C)(C)C 1587625733 CHSBYXSEMHJMPA-LEWJYISDSA-N 443.588 4.422 10 10 IICE C[C@@]1(C(F)(F)F)CCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1597098521 CIONALUZSQGPTF-PMXLPMHFSA-N 446.491 4.218 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1CC1CC1 1617941426 XXFHHWGSRTZQHI-LJQANCHMSA-N 441.576 4.145 10 10 IICE Cn1nccc1[C@H](O)C1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 1620444337 ABWMWTXEGSIGJJ-XMMPIXPASA-N 432.528 4.220 10 10 IICE Cc1ccc(OCCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(Br)c1 1632398687 JPDVAHTXVRFHNU-SFHVURJKSA-N 448.357 4.440 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(Nc4cc(F)cc(F)c4)n3)CC2)cc1F 1635890580 OAGHORNOJARDHJ-UHFFFAOYSA-N 448.470 4.275 10 10 IICE COc1n[nH]c(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1Br 1650677066 LWGUBZKRQXSEAN-UHFFFAOYSA-N 437.725 4.423 10 10 IICE Cn1c(-c2ccccc2)cnc1SCC(=O)C1(NC(=O)C(F)(F)F)CCCCC1 1651685847 HNDRUMHWYKOFMQ-UHFFFAOYSA-N 425.476 4.130 10 10 IICE COc1ccc(N2CCCN(CC(=O)N(Cc3ccccc3)c3ccccc3)CC2)cc1 1657023505 FGFDUHGAYXPZPG-UHFFFAOYSA-N 429.564 4.441 10 10 IICE CC(=O)N(c1ccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1)[C@H]1C[C@H]1C 1662054468 QXCJNJDBTOEJRB-GGUMNFRJSA-N 436.556 4.167 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3C[C@H]3c3ccc(Br)cc3)CC2)cc1 1680682217 JAEHGYKCFULONE-LEWJYISDSA-N 444.373 4.236 10 10 IICE CCN(CC)C(=O)OC[C@@H]1CCCCN1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1683254370 PJEGPYBXVADCEP-UGKGYDQZSA-N 432.609 4.035 10 10 IICE COc1cccc(CNC(=O)NCc2c(-c3ccc(F)cc3)nc3ccc(C)cn23)c1O 1685438183 RRDFDRXPFLQMRE-UHFFFAOYSA-N 434.471 4.162 10 10 IICE CCCCCCNC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 1686826285 FHJDRDFFWIMOEQ-IFMALSPDSA-N 430.637 4.110 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N(C)C[C@H]1CCCOC1 1693004824 COLYZRPSFFKMLM-OAQYLSRUSA-N 425.621 4.296 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCO[C@@](C)(C(C)(C)C)C2)cc1F 1696609411 ADWDPJWPDDRUKD-XMMPIXPASA-N 429.584 4.125 10 10 IICE Cc1cccc(-c2nnc(N3C[C@H](C)OC(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1707589586 ZRWNKGINOLQUPG-IBGZPJMESA-N 434.588 4.075 10 10 IICE CC(C)CCCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1723374296 XXFCTOSWILZYQR-UHFFFAOYSA-N 434.588 4.249 10 10 IICE CC(C)OCCCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1723714289 NTNIEQMISYGJBI-UHFFFAOYSA-N 434.588 4.392 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(C3CCCC3)CC2)n1CCCSc1nccs1 1743756488 FDQLDHPBYQDIAQ-QGZVFWFLSA-N 434.679 4.495 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C)C3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1751410777 VVHXSFUQHQYXID-IBGZPJMESA-N 448.615 4.457 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC(Cn2cccn2)CC1 1761697827 FZFMTQYWPKOMNQ-UHFFFAOYSA-N 435.620 4.012 10 10 IICE CN(Cc1ccccc1[N+](=O)[O-])c1nnc(C2CC2)n1CCCSc1nccs1 1768683397 IAIMCFBIPZENKF-UHFFFAOYSA-N 430.559 4.339 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2nccs2)sc(C)c1-c1ccc(F)cc1 1860766204 XRALEFRXVXMSJH-UHFFFAOYSA-N 433.486 4.073 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cc(=O)c(OCc2ccccc2)co1 1890904264 MXNGQTVWDCTHSQ-UNMCSNQZSA-N 430.504 4.138 10 10 IICE Cc1ccn2cc(-c3ccc(C)c(NS(=O)(=O)c4cccc5nsnc45)c3)nc2c1 1892148852 ZREZNBMBXXKGEX-UHFFFAOYSA-N 435.534 4.424 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C)c([N+](=O)[O-])c4)o3)C2=O)cc1 2296565413 SFFZGOOTOGPFSM-UHFFFAOYSA-N 431.404 4.138 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)C2=O)cc1 2297350353 ROYXPNDAERXLTL-UHFFFAOYSA-N 446.434 4.080 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1cccc(Br)c1O)[C@@H]2F 2333285166 UBSWLOMBQYRMCI-OEAJRASXSA-N 429.330 4.123 10 10 IICE CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135024 LDVLOHYERBMHDP-MLGOLLRUSA-N 443.382 4.361 10 10 IICE O=C1NN(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(-c2ccc(Br)cc2)o1 1216504 FYOGRPTVFSIXAA-GZTJUZNOSA-N 427.229 4.310 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2 14549960 ZMAAHQOQRSBLTG-UDSSINMLSA-N 428.529 4.110 10 10 IICE CCOc1cc(/C=C2/C(=N)N3C=CSC3=NC2=O)ccc1OCc1ccc2c(c1)OCO2 20037478 DFCLZAVQQXKXJA-WLYGJILCSA-N 449.488 4.170 10 10 IICE C=CCNc1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N(CCCCCC)C1=O 33475538 NKOCNWVFKASVAG-LGMDPLHJSA-N 442.610 4.382 10 10 IICE COc1ccc(CN2C(=O)/C(=C\C3=Cc4cccc(OC)c4OC3)SC2=S)cc1 33515966 SANYXIKKCGVCDC-YBFXNURJSA-N 425.531 4.424 10 10 IICE COc1ccc(N2C(=O)N=C(O)/C(=C/c3c[nH]c4ccc(Br)cc34)C2=O)cc1 34234079 SUIJOFRTMKFIOY-PXNMLYILSA-N 440.253 4.446 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(-c4ccc(C)c(C)c4)c3O)C2=O)cc1 38170756 ORFBTMYLMRUHOX-NDENLUEZSA-N 430.464 4.318 10 10 IICE COC(=O)C1=C(C)N(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(C(=O)O)cc1 96822638 CCGINJVLLRWTPH-GZTJUZNOSA-N 442.265 4.025 10 10 IICE CC1=NN(c2ccc(Br)c(C)c2C)C(=O)/C1=C/Nc1ccc(C(=O)O)cc1 101128470 BQDMOQIYLYNIMB-MHWRWJLKSA-N 428.286 4.483 10 10 IICE Cc1cnccc1OC1CCN(C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CC1 487253778 KAEWBIWMCTVRML-UHFFFAOYSA-N 446.595 4.181 10 10 IICE COc1cccc(O)c1[C@H](CC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21 687755229 SEESGWGUPNABJP-FQEVSTJZSA-N 433.460 4.455 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cccc4ncccc34)n2)cc1OC 727241699 ATAMYECIDFQRBD-UHFFFAOYSA-N 427.507 4.176 10 10 IICE Oc1cc(OCc2ccccc2)ccc1CN1CCOC[C@@H]1C[C@@H](O)c1cccs1 753548054 AMZIYZLNGHMRMZ-NZQKXSOJSA-N 425.550 4.357 10 10 IICE Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 754913174 BNBRDBBCCXXVOW-OALUTQOASA-N 433.556 4.139 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@@H](c2ccsc2)C1 758815547 REJSYBYXTPVRJU-QFBILLFUSA-N 437.512 4.101 10 10 IICE CN(C)CC(C)(C)CN1C(=O)/C(=C/c2ccc(Br)c(F)c2)SC1=S 763109332 RPESJRGRJIYCRX-ZSOIEALJSA-N 431.396 4.377 10 10 IICE C[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(N2CCCCCC2)cc1 767157760 WZHJKRKGVAAUIN-VYCLJVNGSA-N 446.639 4.317 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(C)c1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768669941 JVAMVFJEIAXJBG-UHFFFAOYSA-N 447.602 4.450 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 914506893 JKEPMKBJZMFJJT-UHFFFAOYSA-N 428.476 4.097 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccc(I)c(O)c2)cc1 1135733091 SZLHWJPEEQWSKG-UHFFFAOYSA-N 438.309 4.115 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(Cn2cc(Br)cn2)cc1 1137444955 QTEMVPLWMVKNLR-UHFFFAOYSA-N 440.341 4.208 10 10 IICE CCCCCc1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n[nH]1 1147506318 NATANIKVDGKYCT-OAQYLSRUSA-N 443.592 4.204 10 10 IICE Cc1cc(C(=O)NC2(CNC(=O)OC(C)(C)C)COC2)c(C)n1-c1ccc(C(C)C)cc1 1148261399 SNDBSELRHYKVNU-UHFFFAOYSA-N 441.572 4.241 10 10 IICE COC(=O)c1cc(OCC(=O)NCCc2c(C)cc(C(C)(C)C)cc2C)ccc1N(C)C 1166713856 KTQOFWPHRNZXBV-UHFFFAOYSA-N 440.584 4.191 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CCC2(CC(C(=O)OC(C)(C)C)C2)O1 1248493879 ZPMBNFCQMKTRAI-CMAULLTDSA-N 446.588 4.373 10 10 IICE COc1ccc2ccccc2c1CCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1255203137 PVHIOCAPZBFBMZ-UHFFFAOYSA-N 447.579 4.099 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1NCC(F)(F)F 1292065676 KRDJJAFMPQNTQM-UHFFFAOYSA-N 427.854 4.081 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@H]1c1ccc(Cl)c(F)c1 1295562441 KGVMMJGLEWDPSE-IEBWSBKVSA-N 445.882 4.122 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CCCCC1 1299233638 OJHLXXNBQGVDJI-UHFFFAOYSA-N 434.588 4.258 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(c2=O)CCCC3)c(C)n1-c1ccc(Br)cc1 1307324048 ALRMGJTWUBOXCL-UHFFFAOYSA-N 440.341 4.175 10 10 IICE CC(C)COc1cccc(OCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1361064048 VZJPIQMHTNTRJB-GOSISDBHSA-N 448.510 4.487 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCC(=O)NCc2ccc(N3CCSCC3)cc2)C1 1441628946 GAIKMFGNMFJSEE-HXUWFJFHSA-N 447.645 4.283 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C=C\c3ccccc3OCc3ccccc3)cc2)CC1 1462487959 QGXZYPBLXLLGNW-SSZFMOIBSA-N 441.575 4.347 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2c(Br)n[nH]c2C)cc1 1464995309 DBVAJLIUIMYGGF-UHFFFAOYSA-N 443.345 4.402 10 10 IICE Cc1cc(C(=O)NCCCNc2ccccn2)c(C)n1-c1cccc(Br)c1 1465395129 OYFVMCQYEVHXPW-UHFFFAOYSA-N 427.346 4.484 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Cn1nc(C(F)F)cc1C1CC1 1465850227 DSJCFAROMCKMLU-UHFFFAOYSA-N 428.277 4.215 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1nn(-c2ccccc2C(F)(F)F)cc1O 1465954289 OOHHGWCJYTYOHE-UHFFFAOYSA-N 431.414 4.111 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)c2ccc(O)cc2)c(C)n1-c1cccc(Br)c1 1469485077 VYZGTRDWZIHYAO-QFIPXVFZSA-N 443.341 4.200 10 10 IICE O=C(Nc1ccsc1C(=O)NCc1c(O)cccc1O)c1ccc(Br)cc1 1472064368 VMTNOBWCTXRTEX-UHFFFAOYSA-N 447.310 4.104 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3scnc3C)n2Cc2ccc(N(C)C)cc2C)n1 1492498843 UWXALRPXFIJMOU-UHFFFAOYSA-N 447.612 4.473 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3Cc3nc(C)cs3)CC2)cc1 1504292318 LEFGILQCJFGCHU-UHFFFAOYSA-N 440.617 4.015 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1519268678 PRYBMHMALULASY-PKOBYXMFSA-N 447.599 4.128 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(-c2cccc(Cl)c2)nc1O 1527482294 XRQLWKFCVHXCIW-UHFFFAOYSA-N 441.890 4.013 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(-c4cccc(Cl)c4)no3)cc2F)CC1 1537534749 INBQFWJCEPFDDJ-UHFFFAOYSA-N 442.922 4.206 10 10 IICE CC(C)(C)OC(=O)NCc1ccccc1C(=O)NCc1ccc(N2CCSCC2)cc1 1543098643 FDKAFJIMEHQWMP-UHFFFAOYSA-N 441.597 4.195 10 10 IICE Cc1cc(C(=O)N(C)[C@H]2CCN(CC(F)(F)F)C2=O)c(C)n1-c1cccc(C(C)C)c1 1543306605 OTFZEPMGYKFPJB-FQEVSTJZSA-N 435.490 4.453 10 10 IICE Cc1cc(CC(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)n1-c1ccc(Cl)cc1 1557939150 QOTKTOZBTFWZJO-HSZRJFAPSA-N 441.915 4.222 10 10 IICE COC(=O)C1(CCCCNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCC1 1558692893 ZTXSQQRMDSBOBK-UHFFFAOYSA-N 426.557 4.159 10 10 IICE COc1ccc([C@@H]2CCCCCN2C(=O)CN(C)CCN(C)c2ccc(OC)cc2)cc1 1559966499 BVEWKCYJWVXWCE-VWLOTQADSA-N 439.600 4.216 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@H](C)c3ccc(Cl)cc3)cc2F)C[C@H](C)O1 1560126961 UXTGLPSSCLFWBB-OKZBNKHCSA-N 447.982 4.402 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@@H]1C(=O)NCc1ccc2cccnc2c1O 1570533777 QAIBEOYDPTYRLG-RBUKOAKNSA-N 427.545 4.420 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc2ccccc2c1 1584506981 KHADNUDDPWSEDJ-UHFFFAOYSA-N 429.564 4.136 10 10 IICE COc1ccc(C2(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CCCC2)cc1OC 1616858461 MVASLOALPHHTJI-QFIPXVFZSA-N 439.600 4.001 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2cccs2)cc1F 1617666924 GIKLHYPPFXATAX-UHFFFAOYSA-N 436.560 4.215 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1ncc(Cl)s1 1625484282 LKINHXPITQPCBY-XFFZJAGNSA-N 444.028 4.156 10 10 IICE O=C(NCCCSc1nccs1)c1c[nH]cc1-c1cc(Cl)c2c(c1)OCCO2 1627198686 HGSRLEAELLEXFI-UHFFFAOYSA-N 435.958 4.475 10 10 IICE Cc1nc(O)c(Br)cc1C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1627989980 OZIVLXULZVCAJL-UHFFFAOYSA-N 446.267 4.129 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H](CC(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1632045066 VRBKSULHAOIHMA-NRFANRHFSA-N 433.593 4.062 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(Cn3ccnn3)c2)cc1 1633066747 SJYDDAQLPUGCMA-UHFFFAOYSA-N 441.535 4.248 10 10 IICE Cc1cc(CC(=O)N2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c(C)n1-c1ccccc1 1638136761 FMTJTBTWCHHLCQ-SANMLTNESA-N 437.584 4.496 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(NC(=O)CC(C)C)ccc1Cl 1643244825 DPVBCGDHBVCJKA-UHFFFAOYSA-N 446.931 4.236 10 10 IICE COc1ccc([C@H](CNC(=O)CN[C@@H](C)c2ccccc2O)c2c[nH]c3ccccc23)cc1 1648054017 MVOIAKRCFJQQPY-MBSDFSHPSA-N 443.547 4.481 10 10 IICE CCOC(=O)c1nc(N(CC)Cc2cc(Br)ccc2O)cc(C(C)(C)C)n1 1651627794 VOZUSHTTXBTKMA-UHFFFAOYSA-N 436.350 4.445 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4F)C3=O)c2C)c1 1651792146 UNZRIHKEOPSPGL-SANMLTNESA-N 447.510 4.500 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3CC3CCCC3)cc2F)C[C@@H](C)O1 1654062619 OVRIDJOYDOLJEQ-WOIUINJBSA-N 431.596 4.100 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@H](c4ccc(Cl)cc4)C3)CC2)c(OC)c1 1672091281 CFVXCINTRGOFPH-UAPYVXQJSA-N 429.948 4.135 10 10 IICE CC1(C)C[C@@H](NC(=O)NCc2c(O)ccc3c2CCCC3)CCN(C(=O)OC(C)(C)C)C1 1687264294 SPPPQBSONGUSPC-SFHVURJKSA-N 445.604 4.496 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccoc2)cc1 1710027433 FNIITOKWUNBCAD-UHFFFAOYSA-N 430.556 4.388 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(C)(C)SC 1727001308 HHEAMTSZFFPWKM-MRXNPFEDSA-N 435.613 4.408 10 10 IICE CC[C@@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)NC)C1 1744223594 GEPOSDBOCLBUFS-VWLOTQADSA-N 434.588 4.115 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1763291172 RWQNADLGOGVUPO-MAUKXSAKSA-N 445.662 4.403 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C1 1768035829 ZSINSEAKBAHMNS-NRFANRHFSA-N 436.604 4.041 10 10 IICE COc1ccccc1OCc1nnc(N2CCC[C@@H]2C)n1CCCSc1nccs1 1770536477 YASKXBONLCQCGD-INIZCTEOSA-N 445.614 4.493 10 10 IICE Cc1cc(=O)c(OCCCOc2ccc(Cl)cc2)cn1CCOc1ccc(N)cc1 1857916781 MLMMDFYSPXBMCY-UHFFFAOYSA-N 428.916 4.319 10 10 IICE CCOc1ccccc1OCCOc1c(C)n(CCCOc2ccc(N)cc2)ccc1=O 1857919819 ZIPSOUJQRNHFHX-UHFFFAOYSA-N 438.524 4.065 10 10 IICE CCCOc1cn(Cc2ccccc2)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870656199 DOPLGXFMQREIPE-UHFFFAOYSA-N 447.579 4.016 10 10 IICE CCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C2CCCCC2)C1=O 2053497184 YUPUBLDAPQVCIV-UHFFFAOYSA-N 442.610 4.359 10 10 IICE CC(C)Cc1cc(I)n(Cc2cc(Br)ccc2O)n1 2070026122 NYWRTDAONUOGHB-UHFFFAOYSA-N 435.103 4.203 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@H](NCc2cccc(Br)c2O)C1 2096261482 KEAVWIDAQFNXIC-MRXNPFEDSA-N 425.367 4.424 10 10 IICE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2cc(I)ccc2Br)CC1 2155566018 ZFOXZIBCTMEEFB-SNVBAGLBSA-N 449.090 4.359 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCC(C)(C)N2C(=O)OC(C)(C)C)c1O 2236043070 HOVWTJJTEWLNCC-CYBMUJFWSA-N 443.382 4.431 10 10 IICE Cc1ccc([C@H](C)NC2CN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C2)c(O)c1 2259425562 DQCLKLHLQKAOSV-KRWDZBQOSA-N 449.592 4.208 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)c(C)n1-c1ccccc1F 2294229246 AWBAHRDHMLSJKP-UHFFFAOYSA-N 437.471 4.204 10 10 IICE COc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(C)SC4=NC3=O)c2C)cc1Cl 2296968907 ZHGDIISPDQOUMR-UHFFFAOYSA-N 427.917 4.395 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457540 DCTOPAUENYQMDX-RNHFSVANSA-N 435.568 4.299 10 10 IICE Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)o1 33912671 SKCXYJJBDROKPM-IREIBJAOSA-N 449.370 4.345 10 10 IICE CCN(CC)CCCN1C(=O)c2oc3ccccc3c(=O)c2[C@@H]1c1ccc(N(C)C)cc1 35483365 PNWAQIFZSCNRNP-QHCPKHFHSA-N 433.552 4.136 10 10 IICE CCC1(CC)CN(C(=O)c2ccccc2SCc2cn3ccccc3n2)CC[S@]1=O 769632982 PIVFIUNDGVAMQP-SSEXGKCCSA-N 441.622 4.390 10 10 IICE Cc1ccccc1C[C@@H](C)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 773215956 SMGZQXHFVYCATE-MRXNPFEDSA-N 444.578 4.266 10 10 IICE c1ccc(-c2cnc(SCCc3nnnn3-c3ccccc3)n2C[C@@H]2CCCO2)cc1 917206756 WCURUAMYWZCIKC-FQEVSTJZSA-N 432.553 4.040 10 10 IICE COc1ccc2c(CC(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)coc2c1 917712282 WLBYIHJKLNYKNE-HOTGVXAUSA-N 426.488 4.053 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)cc1 1124951948 MRUOFEIPZZYKLL-HSZRJFAPSA-N 439.462 4.346 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1-c1ccc(F)cc1 1125187337 DEGFROMXMPAIGH-CALCHBBNSA-N 440.494 4.003 10 10 IICE CC(C)(NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@@H]1CCCCO1 1132742625 ZTWZVIGIXSQHPD-MDJJKAFGSA-N 438.640 4.193 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccc(Br)c(Br)c1 1135690780 YLEDKKDTMHRPFQ-UHFFFAOYSA-N 440.179 4.479 10 10 IICE CC(=O)c1ccc(N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c(F)c1 1135693595 MRNVPIIFQKAFCH-UHFFFAOYSA-N 447.510 4.211 10 10 IICE O=C(NCCCSc1nccs1)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1136661901 TZAXGKFGYJHJNT-GOSISDBHSA-N 430.517 4.410 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3n2CCN(C(=O)OC(C)(C)C)[C@@H]3C)c1 1137473789 VYHCEVJERDGAPC-HUUCEWRRSA-N 429.517 4.005 10 10 IICE CCS[C@@H](C)c1noc(CN(C)C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1137519106 KZVSFFQZWCFLPC-INIZCTEOSA-N 426.542 4.376 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c(C(F)F)nc2ccccn12 1150355489 WACSFFWYBJRVPO-OAHLLOKOSA-N 434.874 4.025 10 10 IICE Cc1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c(O[C@@H]2CCOC2)c1 1150689026 VGWJTFUVFAFOOB-XMMPIXPASA-N 432.520 4.313 10 10 IICE O=C(CC[C@H](NC(=O)OCc1ccccc1)C(F)(F)F)NCc1cccc(Cl)c1O 1159041541 RDLUHKBEMTYMHZ-INIZCTEOSA-N 444.837 4.299 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3ncccn3)C2)c(C)n1-c1ccc(Br)cc1 1178845930 YVOCQUYFXULQKJ-INIZCTEOSA-N 425.330 4.276 10 10 IICE Cc1cc(C(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC23CC3)c(C)n1-c1ccc(F)cc1 1180971244 LHUQEDBQIXAJGV-HXUWFJFHSA-N 427.520 4.363 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H]2COC3(CCC(C)CC3)O2)c(C)n1-c1ccccc1 1225148520 WFJMAVXUAPHYMM-ZOQSAPLSSA-N 425.573 4.258 10 10 IICE CC1CCC(N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1 1291059361 WHJKPEFBNOQTNL-UHFFFAOYSA-N 425.621 4.475 10 10 IICE Cc1ccc(O)c(CNC(=O)Cc2ccc(NC(=O)c3ccc(Br)o3)cc2)c1 1301046773 KLKWOKPWMJJXBT-UHFFFAOYSA-N 443.297 4.167 10 10 IICE C[C@H]1N(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCOC1(C)C 1305244978 YHDYCHUCHGKLTI-MRXNPFEDSA-N 443.592 4.188 10 10 IICE C[C@@H](CCCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccco1)Cc1ccccc1O 1312760723 JUDBMBXPFNTYKV-KRWDZBQOSA-N 431.533 4.390 10 10 IICE CCCOc1ccc(Cl)cc1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 1349006009 TWNWASIKAHIGPS-UHFFFAOYSA-N 445.991 4.080 10 10 IICE O=C(CO[C@H]1CCCc2ccccc21)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333542 RRDCQIXEDFSUFW-GCJKJVERSA-N 430.495 4.467 10 10 IICE CCSc1cccnc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1444516881 ZDQQZKVRTXCOSA-GOSISDBHSA-N 444.601 4.255 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(C3(O)CC3)CC2)sc(C)c1-c1ccccc1 1473617798 BZONQUKDBIQCMZ-UHFFFAOYSA-N 442.581 4.076 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@@]4(CO[C@H](C)C4)O3)cc2Cl)C1 1478529205 XGSDAWMMONZNQX-MOOKXKAQSA-N 435.996 4.102 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)N1C[C@H](C)O[C@H](C)C1 1495138206 UNGLGTSYVQQTPG-QRVBRYPASA-N 429.609 4.021 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1500534641 GTJSGXNBUKZEGI-FCHUYYIVSA-N 441.620 4.169 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC=C(Br)C1 1510671080 BNTWPFQYROJUQJ-UHFFFAOYSA-N 432.410 4.388 10 10 IICE C[C@H]1Cc2ccccc2CN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1514830803 WQKCPMFDMQNNGR-HYTQYMIGSA-N 440.565 4.390 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1516416601 CMRFSYKMELURRJ-FGZHOGPDSA-N 427.593 4.029 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C)C(C)C 1517811141 CIMLQWNMYPQVKO-AUSIDOKSSA-N 437.588 4.249 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCn2cc(Br)ccc2=O)c1 1527335448 NZPVTQNJPWEDDL-UHFFFAOYSA-N 448.748 4.102 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@]3(C)CCN(C(=O)OC(C)(C)C)C3)ccc21 1533082357 UBGXYZQFMHVKRX-XMMPIXPASA-N 429.561 4.034 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(c2ccc(C(F)(F)F)cc2)CC1 1535346009 SSGXXIBQTIEYOU-UHFFFAOYSA-N 440.412 4.168 10 10 IICE Cc1cccc(NS(=O)(=O)c2cc(C(=O)NCc3ccc(N(C)C)cc3)ccc2C)c1 1539049247 DYJZIAUBXBIEFD-UHFFFAOYSA-N 437.565 4.100 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@]2(C)CC2(Br)Br)cc1F 1543251430 OEAGBMZNENIBTG-HNNXBMFYSA-N 436.163 4.184 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cc2cc(Br)cc(Br)c2o1 1558174105 DMMIVZHFISHQSP-UHFFFAOYSA-N 441.075 4.299 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](c3ccc(C(C)C)cc3)C(C)C)CC2)cc1 1559708313 PQKWROBCYDJACR-XNMGPUDCSA-N 439.644 4.288 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCCC(=O)Nc2cc(Cl)cc(Cl)c2)c1 1564841037 KMLBOZNDZXFXKX-LLVKDONJSA-N 426.300 4.097 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)cc1F 1585698053 IBLHQFKGUZZITB-HXUWFJFHSA-N 433.518 4.446 10 10 IICE C/C=C\[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1587552169 MKNHRRQYTSEDAS-FTUSIIHOSA-N 427.589 4.304 10 10 IICE COCCN(Cc1ccco1)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1588305161 IEXWIGWCPBZTFC-UHFFFAOYSA-N 432.318 4.133 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(S(C)(=O)=O)ccc1F 1597567012 FQTVUPXHOHWZJQ-MRXNPFEDSA-N 427.497 4.338 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1603393788 SZTJNMORMABPBF-FQEVSTJZSA-N 425.621 4.234 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1cccs1 1611431262 LQALFRWJQPLLHU-IOMROCGXSA-N 436.577 4.122 10 10 IICE CCOC(=O)N[C@H](CC(C)C)Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C 1616010772 GYQVTAYNEVNVRH-GOSISDBHSA-N 431.581 4.078 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)N(C)C)cc1 1616858097 HIRGCEKWSQEMAF-OAQYLSRUSA-N 426.561 4.132 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCC4)CC3)cc2F)C[C@@H](C)O1 1620413874 JTEAMRYSOOVFQK-BGYRXZFFSA-N 431.596 4.102 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cc(F)c(N2CCOCC2)cc1F 1623580629 MIXUTPJMMRPXKB-UHFFFAOYSA-N 439.462 4.274 10 10 IICE Cc1cc(CC(=O)N2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1625068479 PGFNVUXOPRBQLF-OFNKIYASSA-N 437.584 4.495 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nn(-c2ccc(F)cc2)cc1C 1629969217 RFYBQABPERJILF-UHFFFAOYSA-N 432.293 4.450 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccc(O)cc3)CC2)c(C)n1-c1cccc(Cl)c1 1631151365 LJNABPCFBGSXBE-UHFFFAOYSA-N 437.927 4.051 10 10 IICE COc1cc(N2CCN(C(=O)NCC(C)(C)C3CCCCC3)CC2)cc(OC)c1OC 1633342624 OUQGMNMKQVJVCL-UHFFFAOYSA-N 433.593 4.151 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1coc(-c2ccccc2)n1 1634381533 PXESRGNKTMZEIA-UHFFFAOYSA-N 435.524 4.273 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](C(C)C)N1Cc2ccccc2C1=O 1635676612 HJXMLOHECQAZAU-FQEVSTJZSA-N 445.357 4.184 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1 1639341197 PKZROXZBBCYCJQ-GOSISDBHSA-N 441.531 4.223 10 10 IICE COc1cccc([S@](=O)CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1639535234 YNTSIUVMVTUHFF-HYDGNGQDSA-N 434.989 4.009 10 10 IICE COC(=O)CCCc1nc(CN(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)no1 1642025325 VZPRDBZNGJPVTR-RMKNXTFCSA-N 449.507 4.057 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1NC(=O)c1cccs1 1642155538 VZSWWNLTINSXRI-UHFFFAOYSA-N 449.576 4.200 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(Br)c(C=O)n3C)c2C)c1 1642455869 XWLRCQDRCXXESS-UHFFFAOYSA-N 428.330 4.246 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCOc2ccc(OC)cc21 1681123319 JKFXKUPLFSNSST-QGZVFWFLSA-N 435.318 4.219 10 10 IICE CC(C)CCOc1ccccc1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1681344138 PAYVUAOFIGDWAL-UHFFFAOYSA-N 425.573 4.072 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4O)CC3)cc2Cl)C1 1686269717 XASDLEVMPIGEOA-GOSISDBHSA-N 442.991 4.314 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 1686826276 FFLJELQCFKUDEF-SFHVURJKSA-N 432.609 4.033 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@@H]1COC(=O)N1CCCCC1 1686826375 GZINCSPCNFMNOW-NFBKMPQASA-N 444.620 4.179 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694803828 IYXNGEUSYILQRW-RXVVDRJESA-N 429.584 4.125 10 10 IICE C[C@H]1C[C@H](C)CN(CCCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1726463569 KBXHYXRHTTYOOE-SFTDATJTSA-N 448.615 4.440 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1726976306 NRQKKHYKSBPFFL-NQIIRXRSSA-N 429.634 4.008 10 10 IICE CCOC(C)(C)Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1728728206 YOWKQRMHZKQPMC-UHFFFAOYSA-N 441.620 4.476 10 10 IICE CCc1nnc(N2CCN([C@H](C)c3ccsc3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1744690700 RLXKRPGEYKJFEV-QGZVFWFLSA-N 442.608 4.039 10 10 IICE CC[C@@H]1CCCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(CC)CC)cc1 1765153219 ZGCJQWKVPMEILY-JOCHJYFZSA-N 435.620 4.413 10 10 IICE CCOCc1nnc(N(C)[C@H]2CCSC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1767763134 FQJDSWKQOGCTQF-NRFANRHFSA-N 429.634 4.041 10 10 IICE COc1cc(OC)cc(N2C(=O)/C(=C\c3cc(OC)c(OC)c(OC)c3)SC2=S)c1 1860087486 AYKGDTGXHKDPBO-QGMBQPNBSA-N 447.534 4.135 10 10 IICE CCCCN(C)C(=O)CCn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@@H]21 1860347429 PBHACWNRHJAHNI-AREMUKBSSA-N 444.579 4.437 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2nc(C)cs2)sc(C)c1-c1ccccc1 1860764734 FDJBZVFJBZFLGZ-UHFFFAOYSA-N 429.523 4.242 10 10 IICE Nc1ccc(Oc2ccc(NC(=O)CCCN3C(=O)Cc4ccccc4C3=O)cc2)cc1 1866216953 NXGZWVQUDXWTLG-UHFFFAOYSA-N 429.476 4.005 10 10 IICE CCc1cccc2c(=O)cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)[nH]c12 1866488289 PPJVYIVFHILJRC-XMMPIXPASA-N 446.595 4.114 10 10 IICE O=C(COC(=O)C=Cc1ccccc1)Nc1cc2c(cc1Cl)C(=O)c1ccccc1C2=O 2040425207 RCLSVOATZVOUNG-UHFFFAOYSA-N 445.858 4.311 10 10 IICE CCc1nn([C@@H](c2ccc(C)cc2O)C(C)(C)C)c(I)c1C(=O)O 2079123602 BUDZKFWVYADTGR-HNNXBMFYSA-N 442.297 4.398 10 10 IICE CCc1nn([C@H](c2ccc(C)cc2O)C(C)C)c(I)c1C(=O)OC 2079123912 CBCDXBNFJPUANQ-INIZCTEOSA-N 442.297 4.096 10 10 IICE CC1=NN2C(=N)C(=Cc3cn(Cc4ccccc4[N+](=O)[O-])c4ccccc34)C(=O)N=C2S1 2293131238 OUROVMKBKAEFLO-UHFFFAOYSA-N 444.476 4.237 10 10 IICE CCCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2C(=O)O)SC1=S 2314770168 ZYSBLMUIDCPYPH-GOSISDBHSA-N 441.530 4.281 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(CCc3ccccc3)C2=O)c1)C(=O)O 2314930434 DCDSYDDSQHGBPM-GOSISDBHSA-N 427.547 4.373 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)c1 2321683337 AUKWZOILANPOAH-UHFFFAOYSA-N 434.882 4.441 10 10 IICE O=C1C(=Cc2cc(Cl)cc(Br)c2O)SC(=S)N1C[C@@H]1CCCO1 2323745191 KZHAXKNWAJYXTK-JTQLQIEISA-N 434.764 4.188 10 10 IICE Cc1ccc(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2352619643 HRWCAYINKKJULI-AWEZNQCLSA-N 429.355 4.019 10 10 IICE CCOC(=O)COc1ccc(/C=C2\C(=O)N(c3ccccc3Cl)N=C2C)cc1OC 13914192 HMSCXSRHWXXISJ-WJDWOHSUSA-N 428.872 4.097 10 10 IICE COC(=O)c1ccc([C@H]2Oc3ccccc3[C@H]3CC(c4cc(OC)ccc4O)=NN32)cc1 20071301 JVZMRXCGKOAJSZ-ZJSXRUAMSA-N 430.460 4.430 10 10 IICE Cn1c(/C=C\c2cn(C)c3ccccc23)nc2ccc(I)cc2c1=O 33430701 ZGUHVASTGPSNPJ-YFHOEESVSA-N 441.272 4.200 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3cccc(O)c3)SC2=S)cc1 210718433 VFQSDRLXUGYDNS-QGOAFFKASA-N 428.535 4.021 10 10 IICE COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 756648682 YDPCFTNNDAUYMX-SMDDNHRTSA-N 443.853 4.176 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](OC1CCOCC1)c1ccccc1 759383778 LWMVBMRSUHQVRO-OAQYLSRUSA-N 448.357 4.440 10 10 IICE Cc1ncc(/C=C/C(=O)NCc2ccc(N(C)C(=O)/C=C/c3cnc(C)s3)cc2)s1 765483020 TWFGHCIABNNSOM-GFULKKFKSA-N 438.578 4.222 10 10 IICE Cc1cccc(NC(=O)COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1C 769664047 VMMWIJYHKDTOHJ-UHFFFAOYSA-N 433.552 4.207 10 10 IICE COC(=O)c1ccc([C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C(F)(F)F)cc1 776020807 STOONSVEFFWVJU-IBGZPJMESA-N 436.430 4.160 10 10 IICE CC(=O)[C@H](C)CCCCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 783222119 NWBOWMUIXCBODE-NVXWUHKLSA-N 449.503 4.118 10 10 IICE C[C@H](NC(=O)[C@]1(NC(=O)OC(C)(C)C)[C@@H]2CCCO[C@H]2C1(C)C)c1ccc(N(C)C)cc1 783718203 PNUXGBGYTJRQFR-UOMSLYCOSA-N 445.604 4.028 10 10 IICE COc1ccc(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)c2cc(C)nc(Cl)c2)c(O)c1 794380382 BGEIPWJGNOWUEF-KRWDZBQOSA-N 449.935 4.030 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)Nc3ccc4c(c3)OCC(=O)N4)cc2Cl)C1 800526914 HCGFCKNHLWTHOI-CQSZACIVSA-N 428.920 4.229 10 10 IICE C[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1nc2ccccc2n1C(F)F 804883901 LHMGWZPOIGWKMD-SNVBAGLBSA-N 439.260 4.460 10 10 IICE O=C(NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)NCc1cc(Br)ccc1O 805370846 QZMONWXUDQKKII-UHFFFAOYSA-N 448.195 4.081 10 10 IICE Cc1nn(C)c(C)c1CCNC(=O)c1cc(C)n(-c2ccccc2Br)c1C 918082763 DTNTXHYDZKJLCS-UHFFFAOYSA-N 429.362 4.179 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(C(=O)OC)on2)sc(C)c1-c1ccc(C)cc1 1124484544 OORUQJNGQGPHJZ-UHFFFAOYSA-N 428.466 4.236 10 10 IICE COc1ccc(C(=O)NCCNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)cc1 1125181917 DESBAXYBYMITAM-UHFFFAOYSA-N 445.523 4.336 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(SC(F)(F)F)nc3)cc2F)C[C@@H](C)O1 1125187973 MIDQHAGMSXQZGU-BETUJISGSA-N 443.466 4.376 10 10 IICE CC[C@@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CCCN1C(=O)OC(C)(C)C 1136281348 BQPOCRXRFAMUCI-QHCPKHFHSA-N 433.618 4.036 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc2[nH]cc(I)c2c1 1146197039 PZZHRTQJAMTEQD-UHFFFAOYSA-N 433.293 4.077 10 10 IICE CCc1ccc(C(C)(C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1192719428 NPJIBROIYIBPSM-UHFFFAOYSA-N 426.516 4.488 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1266756513 SOGXMYPYXHWINF-AZUAARDMSA-N 425.573 4.398 10 10 IICE COc1cc(N2CCN(C(=O)c3cc(F)ccc3-c3ccoc3)CC2)cc(OC)c1OC 1267906041 UJPUDVCOMQSFPX-UHFFFAOYSA-N 440.471 4.074 10 10 IICE CC(C)(C)CN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccn1 1275509518 DAIQUQBKHUNHNH-UHFFFAOYSA-N 443.459 4.458 10 10 IICE Cc1ccc(NC(=O)CS[C@@H](C)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1 1276284146 QCPWHSDIXTWOKY-OALUTQOASA-N 427.614 4.177 10 10 IICE C[C@@H]1CCCN(CCCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1291125387 UBXCYMODGUSVJQ-HXUWFJFHSA-N 434.588 4.194 10 10 IICE Cc1cc(C(=O)NCc2cn(C3CCC3)nn2)c(C)n1-c1cccc(Br)c1 1300161288 QBSGQWDQXBGDGJ-UHFFFAOYSA-N 428.334 4.103 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)OC 1301582433 SIIJHJIBZMQJNU-UHFFFAOYSA-N 425.577 4.250 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(c2ccccc2F)CC1 1312834353 XHIBVLDKVNQWDA-UHFFFAOYSA-N 433.474 4.030 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1Cc1ccc(Cl)s1 1314753643 UCFCNMWMHREEEC-UHFFFAOYSA-N 425.945 4.369 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc([C@H](C)C(F)(F)F)cc3)CC2)cc1 1349005918 RVBBPGAFGBRFIJ-SFHVURJKSA-N 449.517 4.303 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(-n3cc(Br)cn3)cc2)cc1 1350864749 NVOVFPVXJBDKGH-UHFFFAOYSA-N 427.346 4.411 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1 1355015555 OIBWOUZGOWGXGN-XMSQKQJNSA-N 431.939 4.161 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(F)c2ccncc12 1355708949 XKYVNGRLKHDVHB-UHFFFAOYSA-N 433.405 4.159 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(=O)c(OC)co2)sc(C)c1-c1ccc(F)cc1 1356323020 ZIUCNLGCGHODQN-UHFFFAOYSA-N 431.441 4.253 10 10 IICE Cc1cc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2F)c(C)n1-c1ccc(Cl)cc1 1357496586 YMOILMVJKMBTFJ-HSZRJFAPSA-N 439.918 4.129 10 10 IICE CC(C)[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1359743412 JMFNTSFFZFLMCV-FQEVSTJZSA-N 443.611 4.373 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)no2)cc1 1435334613 VKVOXKLWTNAHKO-MRXNPFEDSA-N 443.450 4.350 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)COc2ccc(F)cc2F)cc1 1442225983 QMAIKMMKULWXHS-OAHLLOKOSA-N 426.463 4.311 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 1442927249 XVZAEJPXNDTWNB-UHFFFAOYSA-N 443.809 4.388 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)N(C)C)cc1 1463282565 OUIDUEGWYYYQHQ-OAQYLSRUSA-N 435.572 4.133 10 10 IICE CC(C)OC(=O)C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccc1[N+](=O)[O-] 1463784372 MGWIVIHNOLYXHI-AWEZNQCLSA-N 444.465 4.034 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@](C)(Cc2ccccc2)[C@@H](C)O)cc1 1467801830 AXYNWIXEVTYTLI-ZBLYBZFDSA-N 432.564 4.195 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(OCCN4CCCC4)CC3)c2C)c1 1471036755 ZFUYATWJYZUYLM-UHFFFAOYSA-N 438.616 4.189 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1471543422 IEUXLMXCUWTJRR-XMMPIXPASA-N 425.621 4.042 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)cc1 1479217571 WCZLWXJZXJLHJO-OAHLLOKOSA-N 425.451 4.433 10 10 IICE Cc1ccc(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)s1 1510865823 MMNRZKAKVIROFI-UHFFFAOYSA-N 425.602 4.293 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](C)[C@H]2C)n1Cc1ccc(N2CCOCC2)cc1 1513095950 WKFJBWPFGMATPN-IPMKNSEASA-N 429.634 4.007 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@H]1c1cccc(F)c1 1524258786 YGURQYKFZZEYAP-UIKAKUSXSA-N 444.528 4.228 10 10 IICE O=C(Cn1nc(C(F)F)cc1C1CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1531502345 GLBYKHRUKWKVRF-CQSZACIVSA-N 440.441 4.085 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(OCC(C)C)c1 1534308870 IJWHVHVFYFFFFG-QZTJIDSGSA-N 444.547 4.413 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3ccc(F)c4c3CCCC4)CC2)c(OC)c1 1534596514 RGPMKSOMCIIHPX-UHFFFAOYSA-N 426.532 4.003 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nnn(-c2ccc(OC(C)C)cc2)c1C 1536550005 MELAOEPSCQVADB-SFHVURJKSA-N 435.572 4.098 10 10 IICE Cc1nnc(N2CCC(OCCC(C)C)CC2)n1Cc1ccc(N2CCSCC2)cc1 1543243693 KPGZKTJCNJYAPY-UHFFFAOYSA-N 443.661 4.220 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3cc(Br)ccc3F)CC2)cc1 1545931657 QMDGQPIVKMDWNI-UHFFFAOYSA-N 435.337 4.268 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)c(C)n1-c1ccccn1 1546206050 ZMZHSFOJVMAAAV-LJQANCHMSA-N 443.334 4.331 10 10 IICE CCC[C@H](C)N(C)c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1546876145 DDQOVLIBKIOJTC-IBGZPJMESA-N 426.609 4.033 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1546880102 UACWKTQNYWLLLX-UUOWRZLLSA-N 447.599 4.197 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(-n3cnc4ccccc43)cc2)N(C)C)cc1 1558723461 OTCJSERQGYESOV-RUZDIDTESA-N 427.552 4.124 10 10 IICE CC(C)[C@@H](Cc1ccc(F)cc1)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559705113 HLJNTXFTTHIRFM-HSZRJFAPSA-N 444.506 4.397 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCC12CC(CN1C(=O)OC(C)(C)C)C2 1565108851 SENKDICXVOKUCS-UHFFFAOYSA-N 430.593 4.072 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)Cc2cc3c(cc2Br)OCCO3)cc1 1587459547 ALHBGHDNMWSCCZ-UHFFFAOYSA-N 447.373 4.268 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccccc2C)c1C)Cc1ccccc1OC 1596996593 OTDXLQRDDYSMMZ-NRFANRHFSA-N 434.536 4.173 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCC(=O)N3)nnc2N(CC)C2CCCCC2)cc1 1615379535 IZNJROPTJDJARO-JOCHJYFZSA-N 438.620 4.283 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3csc(C)n3)nnc2N2CCC(F)(F)C2)cc1 1615381694 CUUFEAYWZIFDFQ-UHFFFAOYSA-N 446.571 4.374 10 10 IICE CC(=O)N/C(=C/c1cccs1)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1617900719 LIUPHPCFYUTDQR-SLDJAQPHSA-N 431.989 4.431 10 10 IICE CNC(=O)[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCCC1 1618533265 BHCAKORNEPLWLK-SFHVURJKSA-N 448.615 4.361 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@]1(c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1623573848 GMYJHRDYBPZSIS-VWLOTQADSA-N 445.556 4.073 10 10 IICE Cc1ccc(C(=O)NC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1-n1c(C)cc(C=O)c1C 1625096948 SSXXSHWFIQUUNB-ZEQKJWHPSA-N 434.511 4.250 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc(CN3CCCC3=O)c2)cc1 1625276405 IZTKKEMFQBRWKM-UHFFFAOYSA-N 429.520 4.210 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCC(=O)Nc3ccc(F)c(F)c3F)c2C)c1 1629349774 KPDFHYXAIOJXBO-UHFFFAOYSA-N 429.442 4.497 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3CCC(N4CCOCC4)CC3)cc2Cl)C1 1635126285 LBZZZPYKIRJIFE-KMFTYDHNSA-N 434.024 4.084 10 10 IICE Cc1c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cnn1CC(C)C 1636516406 FMFOQXIHEWXNAS-ZDLGFXPLSA-N 446.573 4.217 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(c4ccc(F)cc4)C3=O)cc2Cl)C1 1639534564 QYZCNQCHMGOCSK-OXQOHEQNSA-N 443.950 4.385 10 10 IICE COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1639535235 YNTSIUVMVTUHFF-OFJJUDJNSA-N 434.989 4.009 10 10 IICE Cc1sc2nc(CS[C@@H](C)C(=O)NCc3cc(Cl)ccc3O)nc(O)c2c1C 1644590721 MFCWRSOPEZPDHI-NSHDSACASA-N 437.974 4.311 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@@H]1C[C@H]1CN(C(=O)c2cc(O)cs2)c2ccccc21 1652447834 LTTMZOIVZJOUAE-HOTGVXAUSA-N 444.553 4.224 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1cccc(COC[C@@H]2CCCO2)c1 1673743469 FAURISSFKDBUDI-NLFFAJNJSA-N 439.600 4.187 10 10 IICE Cc1cc(CNC(=O)N(C)Cc2ccccc2N2CCOCC2)c(C)n1-c1ccccc1 1675114332 CRZOGZHICAAQCX-UHFFFAOYSA-N 432.568 4.272 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1681211696 JFXLEDBSQVHJGV-JOCHJYFZSA-N 440.588 4.239 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1685818810 FIBRZKOVMRCZED-YKSBVNFPSA-N 430.593 4.216 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H](c1ccsc1)N(C)C 1694635434 WJKMLLQZKUJNIB-JOCHJYFZSA-N 438.645 4.442 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2C[C@H](C)N(CC)C[C@H]2C)cc1 1695618632 BHDMSTGPBNXPBJ-VQTJNVASSA-N 435.620 4.087 10 10 IICE C=CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1705940430 FFEBELYPBKTZEO-NRFANRHFSA-N 437.613 4.497 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C1CC1 1708574436 LFQMJBGXZYJAMA-GOSISDBHSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1710026955 UKCVYTHQFANVKK-FPOVZHCZSA-N 441.620 4.070 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726909350 QLPNOMXHRLRCDX-OKZBNKHCSA-N 447.624 4.146 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@@H]1CCCCO1 1743563801 MSRVFRZGOVHDHR-REWPJTCUSA-N 441.620 4.224 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOCC)CCO1 1745331264 INOURTWDTVNNHG-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1747750181 NSLOEGHMDPKLHU-QGZVFWFLSA-N 441.576 4.145 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)CC[C@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1751843725 RRLCDSWSOMLNAA-YLJYHZDGSA-N 435.620 4.187 10 10 IICE C[C@@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1763151461 DSXIQTUTYXQHMD-SFHVURJKSA-N 436.579 4.390 10 10 IICE COc1ccccc1N1CCN(C(=O)[C@H]2CCc3c(c4cc(Cl)ccc4n3C)C2)CC1 1858153479 IOOUPDMWERDRKP-KRWDZBQOSA-N 437.971 4.294 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(Cl)cc2)nc1-c1ccc2c(c1)CCC(=O)N2C 1859572237 SWEIYQBTVRZPMU-UHFFFAOYSA-N 447.969 4.482 10 10 IICE CCN(CC)c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc(-c2ccc(F)cc2)n1 1867987375 OBSDRKRJIFZKJC-UHFFFAOYSA-N 435.547 4.464 10 10 IICE CCC[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1Cc2ccccc2C1=O 1874180000 VJQPMXMEBPSGLM-JOCHJYFZSA-N 438.483 4.225 10 10 IICE CC(C)(C(=O)O)[C@H](NC(=O)OCc1ccccc1)c1cc(Br)cc(F)c1O 1951966000 HGTKLUUWVUTXMK-MRXNPFEDSA-N 440.265 4.372 10 10 IICE COC(=O)c1c(C)nn([C@H](c2cc(C)c(C)cc2O)C(C)C)c1I 2079927219 NLSBEQDAKVMHEP-INIZCTEOSA-N 442.297 4.151 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@]2(NCc2c(O)cccc2Br)C1 2126044959 BGBLFFDCARFZKL-OALUTQOASA-N 429.330 4.126 10 10 IICE CN1CCc2cc([C@@H](N)c3ccc(Br)cc3I)ccc21 2207265259 OZBVVPKUHFGVLW-MRXNPFEDSA-N 443.126 4.094 10 10 IICE COc1ccc(Cl)c2ccc(C=C3SC(=S)N([C@@H](C(=O)O)C(C)C)C3=O)nc12 2297500908 RHFBJJRBXZQROT-MRXNPFEDSA-N 436.942 4.207 10 10 IICE Cc1ccc(CN[C@@H]2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c(O)c1Br 2352680341 PZJSPPFUSCEJCC-HRCADAONSA-N 425.367 4.198 10 10 IICE Cc1ccc(CN(C)C(=O)C2(NC(=O)OC(C)(C)C)CC(C)C2)c(O)c1Br 2380774609 SXAGVIACRXSXHI-UHFFFAOYSA-N 441.366 4.115 10 10 IICE CC[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381147462 RKHAAOMCUZKPEP-XJKSGUPXSA-N 441.366 4.115 10 10 IICE COc1cccc(-n2cccc2/C=C2\C(=N)N3N=C(Cc4ccccc4)SC3=NC2=O)c1 32964447 KTDIWAXJAZOPCR-NCNWTYLVSA-N 441.516 4.348 10 10 IICE CCN1C(=O)/C(=C/c2ccc(NC(=O)/C=C\c3cccc([N+](=O)[O-])c3)cc2)SC1=S 96835247 KKAQFDMENGTPQN-HBOFYQPVSA-N 439.518 4.468 10 10 IICE CN(C)c1ccc(CN2C[C@H](O)C[C@@H]2c2nc(-c3ccc(OC(F)(F)F)cc3)no2)cc1 209373788 SPEZHHAOXASHMC-IEBWSBKVSA-N 448.445 4.009 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@H](c3cccs3)N3CCC(C)CC3)CC2)cc1 302903323 VKKPIWDQDBMCHK-JOCHJYFZSA-N 442.629 4.062 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526229130 RWUWCIBEHDWTBW-QHCPKHFHSA-N 433.460 4.481 10 10 IICE CC[C@@H](NC[C@@H]1CN(C)CCN1Cc1ccccc1)c1cc(Br)ccc1O 694741861 MBMMFESSCDTUHC-TZIWHRDSSA-N 432.406 4.012 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C\c1cc(Br)ccc1F 728302205 RKILXVYHMJEKGN-WTKPLQERSA-N 433.321 4.097 10 10 IICE CCCCCC(=O)NC1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731049547 BFACZXUWQHZFFC-UHFFFAOYSA-N 428.621 4.293 10 10 IICE CC1CCN(c2ccc(CNC(=O)NCc3ccc(N4CCCCC4=O)cc3)cc2)CC1 731120282 TUZCWRKEDQIIQO-UHFFFAOYSA-N 434.584 4.439 10 10 IICE COc1ccc([C@@H](C)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1F 743506087 KIFGKXYCLAOCHR-ZBFHGGJFSA-N 437.462 4.465 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc(C(=O)OC)cc3)n2)c1C 747890859 JUCKQRNYKFGPNF-UHFFFAOYSA-N 433.555 4.226 10 10 IICE C[C@H](NC(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1)c1ccc(N2CCOCC2)cc1 750625084 NKDJUGHNTKZWGJ-NGFNCXNUSA-N 441.475 4.033 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1nn(C)cc1[N+](=O)[O-] 772909418 JLHQRNRCQWFGDQ-INIZCTEOSA-N 447.417 4.254 10 10 IICE Fc1cc(CN[C@@H]2CC[C@@H](c3ccccc3)C2)ccc1N1CCN(c2ncccn2)CC1 780511001 MKPPQALUCGPGDI-DHIUTWEWSA-N 431.559 4.368 10 10 IICE Fc1cc(CNc2ccc(Br)c(C(F)(F)F)n2)ccc1N1CCOCC1 804359587 XVYJWECLXZABQH-UHFFFAOYSA-N 434.231 4.451 10 10 IICE CN(Cc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916632212 RCKLNXWNAVIDDS-UHFFFAOYSA-N 425.426 4.023 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(C3CCN(C(C)C)CC3)CC2)c1 1127270375 VPMAJAWCYIISCT-UHFFFAOYSA-N 443.035 4.378 10 10 IICE COCCCOc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1128798202 MMXRRQQYJIWMHU-UHFFFAOYSA-N 449.595 4.140 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)c2C)c1 1132263615 HDKMTTOOVYSWHK-UHFFFAOYSA-N 446.519 4.258 10 10 IICE COc1cc2c(cc1OC)CCN(C(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)CC2 1136388416 RZOXEOLRIUIZMZ-UHFFFAOYSA-N 446.547 4.094 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Oc2ccc(Cl)cc2)cn1 1148705249 DZHVLCXEFMIIGB-UHFFFAOYSA-N 437.927 4.418 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)NCc3ccccc3)cc2Cl)C1 1227207239 FOGJKOLCYAGLMA-SFHVURJKSA-N 442.991 4.082 10 10 IICE CN(C)c1ccc(CN(C(=O)NC2CN(c3ccc(C(F)(F)F)cc3)C2)C2CC2)cc1 1255629809 MEVLKPXICNABCI-UHFFFAOYSA-N 432.490 4.334 10 10 IICE CC(C)N(C)CCCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1287897964 UPJHHLPPNZXHQK-UHFFFAOYSA-N 447.631 4.307 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CC(c4ccc(Cl)cc4Cl)=NO3)CC2)cc1 1295273014 RTLBZUUFCGVAPJ-NRFANRHFSA-N 448.350 4.234 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CNc2ccccc2)c(C)n1-c1ccc(Br)cn1 1306698697 PAKQJGKTNDSTMS-AWEZNQCLSA-N 427.346 4.482 10 10 IICE CCCN(CCc1cccs1)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1307661558 VYSCNEZYDIGBKA-KDURUIRLSA-N 447.620 4.072 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1355131773 ZHSQNNIMNZFTFZ-HOTGVXAUSA-N 440.494 4.003 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)CCCc3ccccc3)CC2)cc1 1435001331 OEAQWRXDWLZQGW-UHFFFAOYSA-N 429.564 4.401 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@@H]1CCC(F)(F)C1 1439996186 LSWGVKTVISWMHU-HNDQUVLASA-N 442.528 4.359 10 10 IICE CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccco1)Cc1ccccc1O 1445639365 UCDGLPSLMMBTSI-GOSISDBHSA-N 434.558 4.160 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc2c(s1)CN(C(=O)OC(C)(C)C)CC2 1449122178 NXZHKNMQAOJJTF-UHFFFAOYSA-N 437.558 4.163 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCc3c(C)nc4cc(O)nn4c3C)c2C)c1 1457971597 KZUMMHKZIXZRGL-UHFFFAOYSA-N 431.540 4.017 10 10 IICE C[C@@H](NC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1O)c1ccc(N(C)C)cc1 1467261002 XYDGPPCJZIKBFT-CQSZACIVSA-N 439.462 4.480 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1499751955 OZMLOBSZVCXZCZ-NRFANRHFSA-N 443.661 4.083 10 10 IICE COc1cc(N2CCN(C(=O)C3(c4ccccc4Cl)CCC3)CC2)cc(OC)c1OC 1514838080 ISGASJAMNANQMQ-UHFFFAOYSA-N 444.959 4.136 10 10 IICE C[C@H](Cc1ccsc1)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1515686296 JHCWDISLGKYLOK-CYBMUJFWSA-N 434.473 4.135 10 10 IICE COCC(C)(C)CCCn1c(C(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1518669220 SNYHFMQFVQKUHF-UHFFFAOYSA-N 447.599 4.329 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 1520922863 SYKXLBZLEDHIPJ-VQTJNVASSA-N 431.439 4.085 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3c(C)ccc(Br)c3C)cc2F)CC1 1530375777 CNUADNGEKADADY-UHFFFAOYSA-N 448.380 4.277 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cccc2nsnc12 1530899112 QJGQOTJYXMICEW-XNTDXEJSSA-N 444.538 4.060 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1535144294 XCKWQZUXFRIUFK-KRWDZBQOSA-N 439.581 4.101 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(-c4ccccc4C)c3C(F)F)C2)cc1 1537109254 LNMXDOUXIJRNCH-QGZVFWFLSA-N 440.494 4.383 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CN(Cc2ccccc2)c2ccccc2)N(C)C)cc1 1537482959 JVWZCIAJIBWDLN-SANMLTNESA-N 430.596 4.178 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cn2c(-c3ccccc3)c(C)sc2=O)cc1F 1543251398 NBSRXBWGNULULX-UHFFFAOYSA-N 427.545 4.187 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(C(=O)NCCN4CCCC4)cc3)c2C)c1 1543417148 YNXKBYKDZAAQHW-UHFFFAOYSA-N 444.579 4.480 10 10 IICE Cc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)n[nH]2)cc1C 1544677542 URIGKOCGDKOUSM-ROUUACIJSA-N 436.531 4.376 10 10 IICE CC[C@@H](C)c1nnc(N(C)C[C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1545360800 DRRTVROOMCOWRM-WIYYLYMNSA-N 429.634 4.008 10 10 IICE Cc1sc(NC(=O)c2ccc(N=NC(N)=O)cc2)nc1-c1ccc2c(c1)CCC(=O)N2 1556389414 TUKDAFVRXVFFAC-UHFFFAOYSA-N 434.481 4.418 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)cc1 1557482287 KJRPMSZBSVBLEG-UHFFFAOYSA-N 441.572 4.211 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H](O)C(=O)OCc2ccccc2)cc1 1558093786 JPOKVFVRKVBZNY-QHCPKHFHSA-N 446.507 4.002 10 10 IICE CC(C)N(CCC(=O)Nc1sc2c(c1C(N)=O)CCCC2)Cc1ccc(N(C)C)cc1 1559492261 KGPVRIMDXIGTLD-UHFFFAOYSA-N 442.629 4.031 10 10 IICE CC(C)CCC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 1559601614 HZFOXGUIBRHOKA-PMACEKPBSA-N 433.612 4.204 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1565438580 UIFJDIZCVQWVQW-HKBOAZHASA-N 430.593 4.213 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@H]1CCCOC1 1583308283 LLDLZANNLRRLDD-BIZBRERQSA-N 438.640 4.051 10 10 IICE COCCN(C(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1cccc(Br)n1 1584667727 FMGRHNFDQBJTAL-UHFFFAOYSA-N 442.357 4.474 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(CCN(C)C)CC2CCCCC2)C1 1597614272 YAGHNULTQPELOK-UHFFFAOYSA-N 438.660 4.378 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H](Cc3ccccc3Cl)C(N)=O)c2C)c1 1628159166 SWGZDEMNLKSPRC-HXUWFJFHSA-N 437.971 4.438 10 10 IICE COc1ccccc1C(=O)N1CCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)CC1 1630149801 NBNRMWVMEUZKFU-UHFFFAOYSA-N 445.563 4.318 10 10 IICE Cc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)nc2ccccc12 1631425542 INIVTZHAKISAQP-KRWDZBQOSA-N 425.916 4.002 10 10 IICE COC(=O)COc1ccc(CN(C)C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1633337696 ZHULYFZQGRCEKO-UHFFFAOYSA-N 448.519 4.039 10 10 IICE CC[C@@H](Cc1cccc(Br)c1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1633790113 XPHFCUQECZNUGI-IBGZPJMESA-N 445.401 4.295 10 10 IICE Cc1ccc(C(=O)NCC2(N(C)C)Cc3ccccc3C2)cc1-n1c(C)cc(C=O)c1C 1634336888 DIMRRLCNDUPRJS-UHFFFAOYSA-N 429.564 4.044 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cc(C)ccc1C 1648030258 JFIGEVCZIXUWKZ-JXALWOEJSA-N 441.591 4.413 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC/C=C\c2ccc(Br)cc2)cc1 1673025246 QVHSWCRKEFHZOH-PLNGDYQASA-N 432.362 4.249 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@@H](c4ccnn4C)C3)cc2Cl)C1 1681828609 VOAAPUXDQINLRH-RADWXHQJSA-N 445.995 4.029 10 10 IICE CC(C)[C@@H](Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1691596522 JMHGGUYYQUZOTR-HSZRJFAPSA-N 442.567 4.441 10 10 IICE CC(C)(C)c1nnc(N2CCO[C@H](c3ccco3)C2)n1CCCSc1nccs1 1706119603 PSBVFBJOYLEKSS-INIZCTEOSA-N 433.603 4.385 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)O[C@H](C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1707274219 SRZVWMIMFHNQBN-RTBURBONSA-N 437.588 4.127 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1728381604 UXGPKNDWHJTBJV-QHCPKHFHSA-N 434.588 4.096 10 10 IICE CCOCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCO1 1729143870 BRFFIOAKCCZFJM-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CC(C)CN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1741542779 GQKQQFRFTIWPCD-UHFFFAOYSA-N 439.648 4.360 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(OC)CCOC1 1745591142 LXGFFPVPWNEBSL-VWLOTQADSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CCO[C@@H](C)C3)CC2)cc1 1768704493 GRXYGPVJAQQOPI-SFTDATJTSA-N 441.620 4.017 10 10 IICE C[C@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)C1(F)F 1770657809 PPEJPUPRXJKRAB-IYBDPMFKSA-N 446.521 4.265 10 10 IICE CCC1=NN(Cc2cccc(F)c2)C(=O)/C1=C/c1cc(Br)c(O)c(OC)c1 1865666657 QWPKGQZBQHFMBN-OVCLIPMQSA-N 433.277 4.494 10 10 IICE CCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C/c1cc(Br)c(O)c(OC)c1 1865666860 WHDKINCKUUBFQT-OQLLNIDSSA-N 431.286 4.368 10 10 IICE CCc1ccc2[nH]cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(=O)c2c1 1866416017 HVHWLDOPQBTCHQ-RUZDIDTESA-N 446.595 4.114 10 10 IICE COc1ccc(Cn2nc(C3CC3)c(C(C)(C)C)c2I)c(O)c1 2079785907 FZGMCWDKEWBEJC-UHFFFAOYSA-N 426.298 4.425 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc(Br)cc2O)[C@@H]2CCCC[C@@H]21 2122810967 DRUGUFUCHYIJEN-ULQDDVLXSA-N 425.367 4.422 10 10 IICE COc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=N)N3N=C(C(C)C)SC3=NC2=O)o1 2296660064 ANPFGPQMFDZZEU-UHFFFAOYSA-N 439.453 4.139 10 10 IICE COc1ccc(C=C2SC(=S)N(C)C2=O)cc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2297297227 QBKJABCLAWJBHF-UHFFFAOYSA-N 447.450 4.135 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCO3)SC(=S)N1CNc1ccccc1Br 2297578548 SFIIMFQJSRSGGI-UHFFFAOYSA-N 449.351 4.449 10 10 IICE CCN1C(=O)NC(=O)C(=Cc2cn(Cc3ccc(Cl)cc3Cl)c3ccccc23)C1=O 2313631712 XJXUDBOHODFYFK-UHFFFAOYSA-N 442.302 4.478 10 10 IICE O=C(CCN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)Nc1ccc(C(=O)O)cc1 33314201 SXEBXUSHYQFNOY-NXGCWKMQSA-N 438.530 4.171 10 10 IICE C=CCNc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N(CCCCCC)C1=O 33475536 MEQHEWLDIQPVIH-VKAVYKQESA-N 442.610 4.382 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3cccc(C)c3)C2=O)cc1OC 34878859 UETHZOFEBNIQFN-CPNJWEJPSA-N 442.562 4.242 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 749798158 OEEQRJHGOMNHKL-BWKNWUBXSA-N 447.583 4.138 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1 778826923 NSWNKWBVTSHTFS-FSJXIACGSA-N 433.499 4.263 10 10 IICE CCN1CC[C@@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1cc(F)c(F)c(F)c1 782498814 FQPLHHJDKNCXGD-FYYLOGMGSA-N 446.517 4.339 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(-c2cnn(C)c2)n1Cc1ccccc1 802085668 NDKANMKERRRLRN-UHFFFAOYSA-N 441.583 4.354 10 10 IICE Cc1ccc(C)c(C2=NO[C@@H](C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)C2)c1 1126657522 JLTIFDFQRKGNCY-VGOFRKELSA-N 443.494 4.183 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ccc2c(n1)CN(C(=O)OC(C)(C)C)CC2 1137346810 MVBIHSRFRKLBEY-UHFFFAOYSA-N 425.529 4.133 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C)N(C(=O)OC(C)(C)C)C[C@@H]3C)ccc21 1137902016 SIZRQLYKOXXJMJ-IRXDYDNUSA-N 443.588 4.374 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)cc1 1141566473 NWJJPDDXPZFTQR-NHCUHLMSSA-N 449.511 4.016 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2c2cccc(Br)c2)c(C)n1-c1ccccn1 1147436842 LFDRCUCVQQANFC-FQEVSTJZSA-N 440.341 4.465 10 10 IICE CCCOc1nc2ccccc2cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1147838203 RGTDPJRMJFWFJN-UHFFFAOYSA-N 433.552 4.162 10 10 IICE Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)cc2)c(C)n1-c1ccc(Br)cn1 1150520485 RCFBLNVCEVETGP-CYBMUJFWSA-N 428.330 4.318 10 10 IICE CCOC1CC2(CCN(C(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)C2)C1 1157148532 RPOVIBXGAWIGRV-UHFFFAOYSA-N 432.362 4.283 10 10 IICE O=C(Nc1ccccc1F)Nc1cccc2c1CCN(C(=O)c1c(F)ccc(O)c1O)C2 1160796105 WQYKLIGLNJNTQG-UHFFFAOYSA-N 439.418 4.219 10 10 IICE Cc1cccnc1[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)(C)C 1176823479 GEERFXNIMAKDDI-AREMUKBSSA-N 441.531 4.481 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(COc3cccc(C=O)c3)c2)N(C)C)cc1 1180178896 HZSSIELRLOMSSL-AREMUKBSSA-N 445.563 4.177 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(F)c(F)c1 1264800095 GQVODYRCNSBHNI-LICLKQGHSA-N 436.480 4.358 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(-c2ccc(F)cc2F)n1 1265564690 SDERKOWGSSIOHK-HNNXBMFYSA-N 448.420 4.151 10 10 IICE CC(C)N1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1287993629 KBWYUZSEWXOQIO-UHFFFAOYSA-N 442.627 4.185 10 10 IICE C[C@H]1CCC[C@](Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1291066147 KBYZLXQFBIEWSK-DFBJGRDBSA-N 434.588 4.193 10 10 IICE CC1CCN(CCCCn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)CC1 1291180514 FGFIJKMMNKQOGV-UHFFFAOYSA-N 436.604 4.138 10 10 IICE CCCOc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cn1 1291562246 VKSNGXDQJSVLHX-UHFFFAOYSA-N 443.345 4.365 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1nccn1CCc1ccccc1 1294531038 RUTUOLJEBHBJRO-UHFFFAOYSA-N 426.520 4.276 10 10 IICE CCO[C@@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1296987595 OKBPSGRCEWOJPN-HSZRJFAPSA-N 425.621 4.439 10 10 IICE CN(C)c1ccc(CN(C(=O)C[C@@H]2C(=O)Nc3ccc(Br)cc32)C2CC2)cc1 1355435579 CDMSLQSLEXXXGN-IBGZPJMESA-N 442.357 4.132 10 10 IICE Cc1nc2ccnn2c(C)c1CCC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1436049936 YEBALQVHTOXAEL-INIZCTEOSA-N 439.991 4.485 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C)c(NC(=O)c4ccccc4)c3)C2)cc1 1437573535 CDRFJXMMESRYHY-NRFANRHFSA-N 429.520 4.265 10 10 IICE O=Cc1cc(Br)cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 1442192862 PITQYWVHSPOHNS-UHFFFAOYSA-N 442.357 4.046 10 10 IICE Cc1cccc(C(C)(C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1444461755 VIHWXOFGKSYSKX-UHFFFAOYSA-N 430.551 4.228 10 10 IICE Cc1cc(C(=O)N2CCO[C@@]3(CCSC3)C2)c(C)n1-c1ccc(Br)cc1 1452089416 ZHNBFQWRIJFVBF-FQEVSTJZSA-N 435.387 4.205 10 10 IICE COc1ccc(-c2nc(C)sc2CC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1461491463 CSLZOOPBAFGLGW-GOSISDBHSA-N 437.565 4.073 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@](C)(O)c2cccc(Cl)c2)CCCC1 1466665101 DLAPVAPVRHCZKA-DEOSSOPVSA-N 426.944 4.206 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4c(cccc4C(F)(F)F)C3)C2)cc1 1470594085 RGQQYEHKRCQXLI-MRXNPFEDSA-N 433.474 4.308 10 10 IICE CC(C)c1ccc2c(c1)[C@@H](NC(=O)NCc1cc(F)c(N3CCOCC3)c(F)c1)CC2 1478493598 DVQBEUNJRWXSGI-QFIPXVFZSA-N 429.511 4.412 10 10 IICE CCC[C@H]1CN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1500232222 JHPTVXDKSKBUKR-UGKGYDQZSA-N 443.661 4.398 10 10 IICE COc1cc(N2CCN(C(=O)/C=C\[C@]3(C)CC[C@H](C)C3(C)C)CC2)cc(OC)c1OC 1521501251 JUTDRNXAAYTARX-ZQSYQWPWSA-N 430.589 4.380 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCc1ccc(Cl)cc1 1521697218 GQYZRHJDXZZNCI-QGOAFFKASA-N 448.972 4.429 10 10 IICE CC1(C2CC2)CCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC1 1527591661 GIDVVRRXNMSMQR-NBVRZTHBSA-N 432.586 4.456 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4ccc(C(F)(F)F)cc4)c3C)C2)cc1 1531740184 FULVUDMSCOGSFZ-QGZVFWFLSA-N 444.457 4.217 10 10 IICE COC(=O)c1ccc2c(c1)CCN(C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)C2 1565192726 DTJSDNQDELVKSQ-UHFFFAOYSA-N 431.536 4.457 10 10 IICE Cc1cc(CC(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)c(C)n1-c1ccccc1 1598374606 LQDBFHGTWOIKLL-NRFANRHFSA-N 445.563 4.120 10 10 IICE CCOc1ccc(N(Cc2cc(=O)n3cc(Br)ccc3n2)CC2CC2)cc1 1620499309 LTDWTQYZWXNSJB-UHFFFAOYSA-N 428.330 4.272 10 10 IICE COc1cc(Br)c(N)c(C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 1622311791 XGEDTIDHNFKDFT-UHFFFAOYSA-N 431.286 4.181 10 10 IICE Cc1cc(CC(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)n1-c1ccccc1 1626600952 QOUCFWKMUABYOI-UHFFFAOYSA-N 430.596 4.197 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc3ccncc3c2)NC(=O)OC(C)(C)C)cc1 1628496365 XDYWSTSQMBWXSP-QFIPXVFZSA-N 434.540 4.297 10 10 IICE CN(Cc1coc(-c2ccc(I)cc2)n1)c1ccc2c(c1)OCO2 1642299710 DDOLFQBGPIATEW-UHFFFAOYSA-N 434.233 4.311 10 10 IICE CN1CCN(Cc2ccc(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)cc2)CC1 1650629826 SQOMXKGXENHSOH-UHFFFAOYSA-N 444.535 4.185 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]3[C@H](C2)C3(F)F)sc(C)c1-c1ccccc1 1653831043 ZCWXMKSTHJPBRK-HOTGVXAUSA-N 434.508 4.426 10 10 IICE C[C@@H]1CN(c2ccc(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)cn2)CCO1 1654973030 MRZHDVZQNLQSEV-QGZVFWFLSA-N 432.480 4.058 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(OCCCN(C)C)CC3)c2C)c1 1683302953 FZOFWDQSZDHXRO-UHFFFAOYSA-N 426.605 4.045 10 10 IICE Cc1cc(CNC(=O)N2CCN(C(=O)CCC3CCCC3)CC2)c(C)n1-c1ccccc1 1684479072 RMVHKLGDNIRXAX-UHFFFAOYSA-N 436.600 4.418 10 10 IICE CC(C)CCN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1692328547 ZULIIGZAMRQTDD-QFIPXVFZSA-N 445.583 4.026 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC[C@@H]1CC 1696248489 MWEMQYRVGKUMGV-VXKWHMMOSA-N 441.620 4.114 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2060638819 BFPASTKVMLJIHM-AUSIDOKSSA-N 443.548 4.132 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2(C)CC2)c(C(=O)O)c1I 2079016938 VHMLCVJMFYPGGG-GFCCVEGCSA-N 440.281 4.251 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C3CCC3)c(C(=O)O)c2I)cc1C 2079983710 FXTJHARWJAOCTD-LLVKDONJSA-N 440.281 4.385 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C(F)(F)F)c(N)c1I 2080047839 JYDXNDRKRGWCDA-SNVBAGLBSA-N 439.219 4.411 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)ccc2O)[C@@H]2CCCC[C@@H]21 2122805268 OYSGSWIRNXURCM-ULQDDVLXSA-N 425.367 4.422 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)ccc1O[C@@H](C)C(=O)O 2314934535 IAYZQAGMVKLOMN-LBPRGKRZSA-N 447.509 4.482 10 10 IICE CC(=O)N[C@H](CC(=O)OCC(=O)c1cc(C)n(-c2cccc(F)c2)c1C)c1ccccc1 9249711 FKSSFYGBDSJUFN-HSZRJFAPSA-N 436.483 4.227 10 10 IICE CCCN1C(=O)/C(=C2/SC(=S)N(C(C)C)C2=O)c2cc(Br)ccc21 33374297 WRSRNZPGHFNNOW-BUHFOSPRSA-N 425.373 4.186 10 10 IICE CCCCn1c(N2CCCCC2)c(/C=C2\SC(=S)N(CC)C2=O)c(C)c(C#N)c1=O 39990318 LTZJVUYCENRGAQ-AQTBWJFISA-N 444.626 4.040 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 96748299 YKTUZKIBKBXTRO-HNNXBMFYSA-N 434.492 4.048 10 10 IICE CCOc1cc(/C=C2/SC(N)=NC2=O)ccc1OCC(=O)Nc1ccc2ccccc2c1 210902711 BEDHOVHCDDJQBQ-CIAFOILYSA-N 447.516 4.185 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)NCc2c(O)ccc3c2CCCC3)C1 743601090 UKWHCSCZJWSYGH-QGZVFWFLSA-N 431.577 4.107 10 10 IICE Cc1cc(CCNC(=O)c2ccccc2CSc2nc[nH]n2)c(C)n1-c1ccccc1 746431017 UUCIKWPOXCURSB-UHFFFAOYSA-N 431.565 4.477 10 10 IICE CCOCc1cc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)ccc1OC 754890600 JCFQRQHRRWPBOH-UHFFFAOYSA-N 431.334 4.069 10 10 IICE O=C(NCCCSc1nccs1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 759589242 GLSJNYKSXYGOKS-OAHLLOKOSA-N 447.561 4.404 10 10 IICE Nc1c(Cl)cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Cl 768917126 ZORMXMAAGJBVFQ-UHFFFAOYSA-N 433.383 4.038 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CC[C@@H](c2cccc(F)c2)C1 769049626 ZMDBYKWACXUTIC-HSZRJFAPSA-N 436.575 4.057 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)cc1 772148410 RVTVNFYNZNDSTR-IBGZPJMESA-N 431.544 4.300 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 773285551 NDYJKXKILLXUJD-BWKNWUBXSA-N 449.595 4.012 10 10 IICE CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3ccc4ncsc4c3)n2)cc1 775139574 LFZKOHCVBZZRQS-UHFFFAOYSA-N 430.536 4.179 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@H](C(=O)NCc3cc(Br)ccc3O)C2)c1 804736708 YDSFWHPJQAWVLP-HNNXBMFYSA-N 446.345 4.023 10 10 IICE CC[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)cc(Cl)c1O 806142824 GEKOUZQZKZIROM-BBTUJRGHSA-N 448.394 4.339 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@@H]4Cc5ccccc5O4)n3CC(C)C)CC2)cc1 812219928 UAJIIGWLVLDWIA-DEOSSOPVSA-N 447.583 4.336 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccsc3Br)cc2F)C[C@@H](C)O1 1125188720 UXRHPLDBCORGGX-TXEJJXNPSA-N 427.339 4.193 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccsc3)cc2Cl)C1 1128487686 HHIYMRFWYKKFPA-INIZCTEOSA-N 434.005 4.464 10 10 IICE O=C(COc1ccccc1Cc1ccccc1)NCc1cccc(Br)c1O 1139974805 NEBSAVCPSIWPMZ-UHFFFAOYSA-N 426.310 4.441 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(N(C)C)nc3ccccc23)cc1 1142712761 GSLLWYNDPRUDQK-NRFANRHFSA-N 432.568 4.188 10 10 IICE CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H](C)c1cccc(OC)c1 1167131071 KQCLMSABVMFMMZ-QGZVFWFLSA-N 442.515 4.492 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)cc(Br)c3F)CC2)cc1F 1294824854 PGUZJLNUUGBFJT-UHFFFAOYSA-N 425.273 4.007 10 10 IICE Cc1nnc(N(C)Cc2ccc(OC(F)F)cc2)n1CCCSc1nccs1 1304793890 GDOGRCOXXPFRCV-UHFFFAOYSA-N 425.530 4.463 10 10 IICE COCCC1(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CC1 1315989426 VWKDSGOGKNQKRD-TZIWHRDSSA-N 442.604 4.355 10 10 IICE COCCN(Cc1ccco1)c1nnc(-c2ccccn2)n1Cc1ccc(N(C)C)cc1C 1316092917 AHMSCDKHNUNWQF-UHFFFAOYSA-N 446.555 4.009 10 10 IICE COc1ccc(N2CCCN(C(=O)C(F)(F)c3cccc(Br)c3)CC2)cc1 1358140096 FJUPXXOJFPAHKU-UHFFFAOYSA-N 439.300 4.288 10 10 IICE COC(=O)Nc1cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)ccc1F 1435018238 VMBWFSOKUBVOFU-UHFFFAOYSA-N 425.460 4.485 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3c(Cl)cccc3S(C)(=O)=O)c2C)c1 1438316286 YDTGWBBLDSBUEM-UHFFFAOYSA-N 430.957 4.389 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccccc1[N+](=O)[O-] 1463214362 MQUDFRKZEPPUCD-UHFFFAOYSA-N 438.241 4.319 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C)c3ccc(Br)cc3)C2)cc1 1470771666 GXBXSQSRHKNYNH-YJBOKZPZSA-N 432.362 4.139 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(Cc2ccncc2)Cc2cccs2)N(C)C)cc1 1479535677 YLFVYTWYCLINQD-HSZRJFAPSA-N 437.613 4.224 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C[C@H]1C 1502257550 MBZSSKVSGXQFCK-WOJBJXKFSA-N 426.653 4.208 10 10 IICE CC(C)[C@H]1CCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C1 1509066093 SYIHJOCXDJDAIY-KRWDZBQOSA-N 428.631 4.385 10 10 IICE Cc1c(Br)cncc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1514714173 AOTMMPCEJQTLRH-ZDUSSCGKSA-N 440.288 4.153 10 10 IICE CCCN(CCC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1514735410 IZCXJZGHHHNWDC-UHFFFAOYSA-N 427.637 4.459 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCC[C@@H]2CC)CCOC1 1516140248 DQXGFEALJQUMGL-AXHZCLLHSA-N 428.577 4.099 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)cc1 1517943556 XXNWVZRUEYCPAB-UHFFFAOYSA-N 439.581 4.053 10 10 IICE CS[C@H]1CCCCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1519292103 PALUHHQUOGJFMD-BQGMYUGNSA-N 438.615 4.161 10 10 IICE CC(C)(C)OC(=O)NC1(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCC1 1525592945 CIWGKYNAVLWAER-UHFFFAOYSA-N 434.492 4.238 10 10 IICE C[C@H](c1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1)C(F)(F)F 1528261042 CSKHMRMXSDMFBD-CYBMUJFWSA-N 428.401 4.397 10 10 IICE C[C@H]1C/C(=C\c2ccc(N(C)C)cc2)c2nc3ccccc3c(C(=O)N[C@@H](C)C(N)=O)c2C1 1528585344 YWOFPSKISCVVDK-JJWLJCPTSA-N 442.563 4.027 10 10 IICE Cc1cc(-c2nnc(Nc3cnn(C)c3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1542185099 DGPCPSPQNPVHOS-UHFFFAOYSA-N 441.486 4.111 10 10 IICE Cc1ccc(C(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1544637696 OYRMPSXZQQZGDV-HSZRJFAPSA-N 444.453 4.395 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CNC(C)=O)CC1 1547149492 WRXHQOOTRABYCS-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1)OC 1555249345 KIXBQBVSIDIRAM-JOCHJYFZSA-N 437.588 4.250 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1 1556897514 MSPCVPRJHBERBU-HFZDXXHNSA-N 429.564 4.228 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC3(C=Cc4ccccc4O3)CC2)N(C)C)cc1 1565453056 QUMAOQKGCXKKGD-QHCPKHFHSA-N 434.584 4.005 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnn(C(C)C)c1Br 1566306595 PSSUYMVESWELHR-UHFFFAOYSA-N 445.155 4.357 10 10 IICE C[C@H]1CN(c2ccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)cn2)C[C@@H](C)O1 1583699374 JCCWHBGNJKSDHU-BGYRXZFFSA-N 436.600 4.394 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3SC(C)C)C2)cc1 1585664424 BJMXDZAFJODEJW-INIZCTEOSA-N 429.542 4.360 10 10 IICE O=C(NCc1cccc(O)c1O)[C@@H](Oc1ccc(Br)cc1F)c1ccccc1 1593739910 ZAPZUAWFQJCSPG-FQEVSTJZSA-N 446.272 4.436 10 10 IICE COc1cnc(C2(NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CCCC2)nc1O 1597936687 JAXGNGGQIIVOOR-UHFFFAOYSA-N 434.540 4.414 10 10 IICE CCC(O)(CC)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1613667625 HJRNNXIUNHCSEX-UHFFFAOYSA-N 434.588 4.128 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1615380556 CLIPFYYCPYYEAL-GOTSBHOMSA-N 441.620 4.275 10 10 IICE COCC(C)(C)Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1619568156 VCAYKCHIOLSOCO-NRFANRHFSA-N 441.620 4.081 10 10 IICE O=C(N[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1623543480 OBPMYCASIOIHOL-BZUAXINKSA-N 434.583 4.343 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1nc(S(C)(=O)=O)ccc1Cl 1623924515 INPKLBTWCBAIBG-HNNXBMFYSA-N 444.940 4.248 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C[C@@H](C)c2ccccc2)[C@@H](C)CO)C1 1625422267 OFJZSXCYKXKOIL-YADHBBJMSA-N 447.623 4.421 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 1631531473 RYYPYRORQZHODG-UHFFFAOYSA-N 434.876 4.067 10 10 IICE COCC(=O)Nc1ccc(OC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1633242026 KCWNQCVXIFEXCR-UHFFFAOYSA-N 426.900 4.481 10 10 IICE O=C(Cc1csc(NC(=O)Cc2cccs2)n1)NCc1c(O)ccc2ccccc12 1647789017 YBOIGFCEIGECCP-UHFFFAOYSA-N 437.546 4.104 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2CC(=O)NCC1(c2ccccc2)CCOCC1 1653957500 XZPZKJUFFYYGKI-QFIPXVFZSA-N 436.596 4.195 10 10 IICE O=C(CN[C@H]1CS(=O)(=O)Cc2ccccc21)Nc1ccc(N=Nc2ccccc2)cc1 1654307557 PRWYBXKPVOYKIY-QFIPXVFZSA-N 434.521 4.300 10 10 IICE CCCN(C[C@H]1COc2ccccc2O1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1673745896 YOGSARNDDIAEDG-KNQAVFIVSA-N 425.573 4.254 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2C[C@@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1692981279 FRRRRABREMWZRV-RXVVDRJESA-N 448.615 4.217 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3CCC(OC)CC3)CC2)cc1 1697471075 UYBIREYTYKLEDO-UHFFFAOYSA-N 441.620 4.332 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C(N)=O)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1724198372 OPXGVXIICFBBRT-HXUWFJFHSA-N 434.588 4.100 10 10 IICE COc1ccc(CN(C)c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)cc1 1730145815 LWKWFDBTDLKRJU-QGZVFWFLSA-N 445.614 4.066 10 10 IICE CC[C@@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)NC(=O)OC(C)(C)C 1764282677 TYNUNNCEBKZSFU-KRWDZBQOSA-N 431.581 4.221 10 10 IICE CCC[C@@H]1CN(c2nnc(COCC)n2Cc2ccc(N3CCC(C)CC3)cc2)CCO1 1765657268 XFMSSYDNAQIACK-HSZRJFAPSA-N 441.620 4.105 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@H]1COCCO1 1772872709 KPUDXAGZJUIYFW-QFIPXVFZSA-N 437.588 4.394 10 10 IICE O=C(O)c1cccc(CN2C(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c1 1860825020 JAWPLJCCAJBGAO-OVCLIPMQSA-N 434.882 4.348 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@H](N)c1ccc(N2CCCC2)cc1 2044760066 HMLKLUWDGGMTNC-BJKOFHAPSA-N 438.616 4.312 10 10 IICE CCc1nn([C@@H](c2ccc(C)cc2O)C(C)(C)C)c(I)c1CO 2079141075 XGZKHZXAINMTOL-INIZCTEOSA-N 428.314 4.192 10 10 IICE Cc1nn(Cc2cccc(Br)c2O)c(I)c1C(F)F 2079598608 FJFYMVRKHIEICV-UHFFFAOYSA-N 443.029 4.250 10 10 IICE CC[C@@H](NCC[C@H]1CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2181158219 IWDQYPWCFUJMQM-DOTOQJQBSA-N 443.382 4.221 10 10 IICE COc1ccc(Br)c(CNC(C)(C)[C@H]2CCCN2C(=O)OC(C)(C)C)c1O 2236053930 BVNDURFTNFETDP-MRXNPFEDSA-N 443.382 4.431 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2=O)cc1 2293104185 RPMZZHATNUBMQA-UHFFFAOYSA-N 443.503 4.386 10 10 IICE Cc1ccccc1N1C(=O)C(=Cc2cc(C)n(-c3cccc(F)c3)c2C)C(=O)NC1=S 2313560377 RHZWWKJHSNKJNN-UHFFFAOYSA-N 433.508 4.373 10 10 IICE COc1cccc(C=C2SC(=S)N(CCNC(=O)Nc3ccc(Cl)cc3)C2=O)c1 2320656175 MSYZMSMQKQNFHY-UHFFFAOYSA-N 447.969 4.372 10 10 IICE C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 16878178 POEBNCPYPVYAQB-DFBJGRDBSA-N 426.605 4.203 10 10 IICE O=C1N=C(N2CCN(c3ccccc3[N+](=O)[O-])CC2)S/C1=C/c1ccccc1Cl 27515473 FAVBBYSXLBXXLD-QGOAFFKASA-N 428.901 4.041 10 10 IICE CCOC(=O)c1[nH]c2ccccc2c1/C=C1\C(=O)N(c2ccc(OCC)cc2)C(=O)N=C1O 38175663 KXMHZBSZRYRGJF-AQTBWJFISA-N 447.447 4.250 10 10 IICE CN(C)c1ccc([C@H]2CC(c3cccc(Br)c3)=NN2C2=NC(=O)CS2)cc1 72413082 MOAZHYNTWPKFNJ-GOSISDBHSA-N 443.370 4.296 10 10 IICE CCSc1nnc(-c2ccccc2N/C=C2/C(=O)N(c3ccccc3)N=C2C)c(O)n1 103682414 XIOTVQHADGDTLL-GHRIWEEISA-N 432.509 4.075 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 226803229 FCGBWFYRUSJTSC-ZFGGDYGUSA-N 434.540 4.493 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(-n4cccc4)sc4c3CCSC4)CC2)cc1 302808556 DRNDQEZDUDAHKW-UHFFFAOYSA-N 439.606 4.299 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 728303939 NCABZRRHFDMNEI-HXUWFJFHSA-N 425.554 4.015 10 10 IICE O=C(c1ccccc1)c1ccc(O)c(CNC2(c3ccc(F)cc3F)CCOCC2)c1O 764130372 HJVLUIAEDJYSAB-UHFFFAOYSA-N 439.458 4.403 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cccc(COC2CCOCC2)c1 767894711 XWXXBGIYLADMOZ-UHFFFAOYSA-N 449.595 4.167 10 10 IICE Cc1cc(-c2nnc(N(CCCCO)C3CC3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 812273617 FNBCXEUFISLDPW-QHCPKHFHSA-N 449.599 4.273 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3ccc(=O)c4ccccc43)c2C)cc1F 920263965 ZQKMORPXDGBSJL-UHFFFAOYSA-N 446.478 4.283 10 10 IICE CCOC(=O)c1c(NC(=O)c2noc3c2COCC3)sc(C)c1-c1ccc(F)cc1 1124558836 YNUKOXAHKAMQOR-UHFFFAOYSA-N 430.457 4.352 10 10 IICE Cc1cc(Br)c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1Cl 1133123823 YHRVEKINOWZSOL-UHFFFAOYSA-N 436.781 4.093 10 10 IICE Cc1ccc(C(=O)N(C)Cc2cnn(-c3ccccc3)n2)cc1-n1c(C)cc(C=O)c1C 1136929377 LRASLVSVAUYTSO-UHFFFAOYSA-N 427.508 4.068 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(Br)nc3O)cc2Cl)C1 1139139547 WJVXPUGYYKERER-LBPRGKRZSA-N 438.753 4.369 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)cc1 1141566472 NWJJPDDXPZFTQR-LEWJYISDSA-N 449.511 4.016 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C(=O)c1ccc(N=NC(N)=O)cc1 1144985652 NSTGQXLJAKJQSB-UHFFFAOYSA-N 437.500 4.467 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C1 1146709483 KLJZMJAMENJFGJ-QZTJIDSGSA-N 439.556 4.377 10 10 IICE COc1ccc(C[C@@H](C)CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1153485233 FRFLVYYWFPYUFG-GOSISDBHSA-N 448.563 4.461 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3coc(Sc4ncccn4)n3)cc2Cl)C1 1155727234 QMKORTZEJVFSPR-CQSZACIVSA-N 443.960 4.436 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1157102202 KLDTWUATXJMPJF-SFHVURJKSA-N 441.471 4.038 10 10 IICE Cc1ncc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(Cl)c1Cl 1160600278 UOLQSQCLZJXYQA-RYUDHWBXSA-N 426.319 4.380 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(-c2nc3ccccc3s2)o1 1162539608 IBUUMTLWEHMSGR-UHFFFAOYSA-N 436.489 4.467 10 10 IICE Cc1ncc(I)c(N2CC=C(c3c(C)[nH]c4ccccc34)CC2)n1 1162881732 VCTGQMFWIDOMSW-UHFFFAOYSA-N 430.293 4.473 10 10 IICE CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1270432847 RPNGWPIUAVYWAO-OXQOHEQNSA-N 438.037 4.284 10 10 IICE Cc1cc(CC(=O)NCC2(S(C)(=O)=O)CCCCC2)c(C)n1-c1ccc(Cl)cc1 1279482592 ADRNQERRHAVFJW-UHFFFAOYSA-N 437.005 4.154 10 10 IICE Cc1cccnc1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1290229170 HIUSYICGGTUFAW-DENIHFKCSA-N 435.572 4.290 10 10 IICE Cc1cc(C(=O)NCCNC(=O)c2cccs2)c(C)n1-c1cccc(Br)c1 1295099388 XFMJATYXANTWDN-UHFFFAOYSA-N 446.370 4.078 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccn2)cc1 1295418170 BJAYLJALOMIMFX-UHFFFAOYSA-N 441.583 4.190 10 10 IICE CCCN(CCNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)C(=O)OC(C)(C)C 1295824708 SCCRAYHYMAONDJ-UHFFFAOYSA-N 427.545 4.284 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c(C)n1-c1ccccc1Br 1296210219 PDNQTKMADRMBRT-OAQYLSRUSA-N 442.357 4.409 10 10 IICE C[C@@H]1C[C@H]1Cn1c(-c2cc(Br)cn2C)nnc1N(C)Cc1ccccc1O 1304951200 OYMSOXTYLDKEEO-HIFRSBDPSA-N 430.350 4.044 10 10 IICE CN1CCCc2cc(CNc3ncnc4ccc(I)cc34)ccc21 1306945225 VVKHYXBSMZFRTE-UHFFFAOYSA-N 430.293 4.229 10 10 IICE CCOC(C)(C)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1314047651 SLNFXLPCQFHMAH-UHFFFAOYSA-N 434.588 4.392 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc(C)c1Cl 1350933516 OHPCMFVGUHZORB-IAGOWNOFSA-N 434.939 4.405 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1 1357323703 OOBJOUCMVBEQOV-UHFFFAOYSA-N 443.459 4.456 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)oc1Br 1357836241 QLQKDYXDHJTFJO-STQMWFEESA-N 425.298 4.033 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccc(Cl)cn4)cc3)cc2)CC1 1438888846 WRDOODXSLQRGON-UHFFFAOYSA-N 436.943 4.209 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(I)ccc3N)cc2)CC1 1443678880 ZJWLDEPQJYZVBG-UHFFFAOYSA-N 449.336 4.040 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@]3(CCCOC3)C2)c(C)n1-c1ccccc1Br 1448546517 YTZKTTMFASEBMB-OPAMFIHVSA-N 447.373 4.267 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2c[nH]c3ccc(Br)cc23)cc1 1452842573 ZAUIESASLZBUSD-UHFFFAOYSA-N 430.346 4.076 10 10 IICE CCC(C)(C)OC1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1453530001 BRVSGJWOJIOPGB-LFIBNONCSA-N 438.640 4.146 10 10 IICE Cc1ccc(C(=O)NC2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1461950584 FSUIYRHWENWTIF-UHFFFAOYSA-N 429.564 4.366 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3c(NC(=O)OC(C)(C)C)cnn3C)c2C)c1 1462086070 PHYSRVQXDIZZTN-UHFFFAOYSA-N 437.544 4.413 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(Br)=NN2c2ccc(C)cc2)cc1 1464295663 IUWMCMHRFMZDAE-FQEVSTJZSA-N 443.389 4.445 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(Br)=NN2c2ccc(C)cc2)cc1 1464295668 IUWMCMHRFMZDAE-HXUWFJFHSA-N 443.389 4.445 10 10 IICE CCO/C=C/[C@@](O)(CNC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468483590 RBEWMADPKBJXBC-SQUSKLHYSA-N 444.881 4.250 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CCOCC1 1470063349 BUZXDYDCKSMJTF-FQEVSTJZSA-N 435.362 4.028 10 10 IICE CCOc1ccc(C(=O)c2ccccc2C(=O)NCc2cc(O)ccc2O)cc1OCC 1471661150 IQEYWQMUCJFWHL-UHFFFAOYSA-N 435.476 4.056 10 10 IICE CSc1nccn1-c1ccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)cc1 1472541090 CBQGVOYRGKVVGU-UHFFFAOYSA-N 435.597 4.377 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)[C@@H]1Oc1ccccc1 1478472883 VUQRCDDFVZUICF-GVAUOCQISA-N 437.584 4.443 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3C[C@H]3c3ccc(Br)c(F)c3)C2)cc1 1478559777 VXIPBTNGAXYCRX-CFLQYTFWSA-N 448.336 4.031 10 10 IICE CO[C@H](Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1503994605 OGDCLNBWHQRFGU-FYYLOGMGSA-N 441.620 4.080 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCCN(C(C)(C)C)CC1 1510670816 AQIFEMUOXOTOLU-UHFFFAOYSA-N 447.631 4.073 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)c2ccc(N3CCCNC3=O)cc2)c(C)n1-c1ccccc1 1534449755 HAGDVNVDPHTPSU-IBGZPJMESA-N 430.552 4.434 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@H]1C[C@H]2CC[C@H]1C2 1536315699 YUZKMUPPCUVKFJ-NAGBYQCESA-N 432.586 4.360 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)cc1 1540459302 AVOMZOLXGOSTBB-SFHVURJKSA-N 443.975 4.206 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(CN4CCCCC4)c3)cc2F)C[C@@H](C)O1 1542112861 HDNKCISQISXZBH-WOJBJXKFSA-N 439.575 4.355 10 10 IICE CCN1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C[C@@H]1C 1547709662 ZPKFTUHAUZNLBK-NRFANRHFSA-N 438.664 4.391 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1 1557063223 ISRPPOJIZQKVRF-CPJSRVTESA-N 429.564 4.280 10 10 IICE Cc1cccc(CN2CCO[C@@H](CNC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)c1 1557975217 VYPMFHMGKPVQPD-DEOSSOPVSA-N 431.580 4.342 10 10 IICE CCc1nc(C)c([C@@H](C)N(C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)s1 1564895797 VBCPMYLZJAVLLG-CQSZACIVSA-N 438.544 4.031 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CN(Cc4ccccc4)CC[C@H]3CO)c2C)c1 1566358120 VHLMOWGQIFIPJJ-JYFHCDHNSA-N 431.580 4.015 10 10 IICE Cc1cc(C(=O)N(C)CCOCCN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccc(F)cc1 1584796091 NFKMYXIYUHLBAR-UHFFFAOYSA-N 447.551 4.189 10 10 IICE CCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccccc1Cl 1586060687 KESWLDCSFJSGHC-QHCPKHFHSA-N 439.991 4.187 10 10 IICE COc1cccc(Cn2cccc(NC(=O)c3sccc3-n3c(C)ccc3C)c2=O)n1 1607527601 WBXKFXAGOJVHCY-UHFFFAOYSA-N 434.521 4.022 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@](C)(CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1613347439 FMBIWGXWQWNQHI-NTKDMRAZSA-N 443.661 4.398 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(C3CC3)[C@H](C)c3ccc(Cl)cc3)CC2)cc1 1615906771 GRCYCGDVYFMSPP-DVECYGJZSA-N 444.019 4.057 10 10 IICE C[C@@H]1Cc2cc(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)ccc2O1 1616190225 KUDHPAQULXSHIP-LPXFMOJISA-N 442.537 4.379 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1616599748 PWSSVERLWUANDT-QGZVFWFLSA-N 444.630 4.293 10 10 IICE CSCC[C@H](C)N(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1620266092 WJPOLTXFEOOBRZ-SFHVURJKSA-N 449.640 4.078 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(OCCN3CCOCC3)c2)c1 1625743136 QPPKGXLETCJHAG-UHFFFAOYSA-N 447.579 4.044 10 10 IICE Cc1cc(C(=O)NCCc2cnc3c(Cl)cnn3c2)c(C)n1-c1ccc(Cl)cc1 1628777918 RHOBAZDDNOSOGN-UHFFFAOYSA-N 428.323 4.416 10 10 IICE CSc1ccc([C@H](CNC(=O)c2cccc(O)c2O)N2CCc3sccc3C2)cc1 1630139294 XYQURCRFLJYNJT-IBGZPJMESA-N 440.590 4.411 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3ccc(OCc4ccccc4)cc3)CC2)cc1F 1630201889 DWTHZQFJERGIFL-UHFFFAOYSA-N 434.511 4.305 10 10 IICE Cc1ccc(O)c(CNC(=O)c2nn(-c3cccc(Br)c3)c3c2CCC3)c1 1633282919 PBTOLTHRBASRBA-UHFFFAOYSA-N 426.314 4.068 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCN3CSCCSC3)cc2Cl)C1 1634027137 PRBLRPDUWMJVOD-MRXNPFEDSA-N 428.067 4.280 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(N2CCCCCC2)cc1 1634423522 DDPFLZMKMJROGV-UHFFFAOYSA-N 425.548 4.097 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3cc(O)ccc3O)[C@@H]2c2cccs2)cc1 1637122604 JNYPYYYKBVQJED-AUSIDOKSSA-N 436.533 4.268 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccccc1OCc1ccc(Br)cc1 1639441020 GFXBPOMEIOJCMQ-UHFFFAOYSA-N 428.282 4.369 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3ccccc3cc2NC(=O)C2CC2)cc1 1639814407 XIHHUDDZQHWEDD-UHFFFAOYSA-N 431.536 4.405 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@H](c3ccccc3)C3CCCCC3)CC2)cc1F 1657763842 UVRQTNUSAQMLKC-AREMUKBSSA-N 439.575 4.394 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c(C)n1-c1ccccc1 1684319087 ZMEJSLDTFUYVOR-RUZDIDTESA-N 435.568 4.457 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCSCCC(F)(F)F 1684721326 WQDPFDXVGUNWAB-UHFFFAOYSA-N 429.302 4.372 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(c3cnn(C)c3)CC2)n1Cc1ccc(N(C)C)cc1C 1694043581 OXPSWRFTKBNAJJ-GOSISDBHSA-N 435.620 4.332 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1695626393 UICRMJZBNUPYRV-GGAORHGYSA-N 441.620 4.072 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@H]2CC=CCC2)c(C)n1-c1ccccc1 1751414141 DITIDHWSVKNBFL-NQIIRXRSSA-N 446.599 4.409 10 10 IICE CC(C)Cc1cnn(Cc2ccc(Br)cc2O)c1I 2070297568 AWWDVPHBASPOET-UHFFFAOYSA-N 435.103 4.203 10 10 IICE CC(C)(C)OC(=O)N1CCCC2(CC(NCc3ccc(Br)cc3O)C2)C1 2103371953 FNHUMCHJLBBAPS-UHFFFAOYSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2cc(Br)cc(F)c2O)C12CC2 2108028998 GPVDYUWUNKUUSN-ZDUSSCGKSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)C1(C)C 2127901021 YBFADBIKEYDNNL-IUODEOHRSA-N 431.346 4.323 10 10 IICE CN(C)c1ccc(CNc2ncc(I)cc2Br)cc1 2133370395 ALMZZKNKLJVZLM-UHFFFAOYSA-N 432.103 4.127 10 10 IICE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2ccc(Br)cc2I)CC1 2207275709 NWLOPLUCVBKYOX-JTQLQIEISA-N 449.090 4.359 10 10 IICE CCCN1C(=O)C(=Cc2cc(I)c(O)c(OCC)c2)SC1=S 2293806540 LTMYJJZIMMQTNU-UHFFFAOYSA-N 449.335 4.007 10 10 IICE Cc1ccc(CNC(=O)[C@H](CC(C)(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380757298 QMAJNQYFZRZYOH-AWEZNQCLSA-N 443.382 4.409 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14472866 WRJUHDOLWODIRD-STXHMFSFSA-N 433.917 4.325 10 10 IICE COC(=O)CCCCCN1C(=O)/C(=C/c2ccc(OC(C)C)c(OC)c2)SC1=S 40927972 HTCNTDXZWQVQQI-AQTBWJFISA-N 437.583 4.417 10 10 IICE CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OC 98035297 NGGIZIATYFQBTJ-ITRAFESCSA-N 442.562 4.419 10 10 IICE COC(=O)c1cccc(-c2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)c1 436099448 MCUMDVCFFPIFCC-UHFFFAOYSA-N 430.508 4.293 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)CC2)cc1 730160249 FMPJTZWXGIEKQX-UHFFFAOYSA-N 431.323 4.150 10 10 IICE C[C@@H](NC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21)c1ccc(F)cc1 731037273 ZUOLYARBMOYYHX-QGZVFWFLSA-N 441.547 4.480 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1 732469815 RKCFORIEPSQMOM-LJQANCHMSA-N 430.543 4.227 10 10 IICE CCOC(=O)CCc1ccc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 740455961 VERCTDZSJLSZDV-OAQYLSRUSA-N 426.513 4.101 10 10 IICE CO[C@@H](C)c1noc(CN(C)CC(=O)c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)n1 747967401 MGPLCFNGHAVOQM-AWEZNQCLSA-N 434.899 4.292 10 10 IICE COc1cccc([C@H]2[C@H](NC(=O)NCc3ccc(N4CCCC4)cc3)CCN2C2CC2)c1 778620553 NNSDMYKUCXZFFY-RPBOFIJWSA-N 434.584 4.073 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc([C@@H]2CCCOC2)cc1 780656009 DPVXTQFCOWDVGI-DENIHFKCSA-N 428.960 4.334 10 10 IICE CC(=O)[C@@H](C)CCCCC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 783222114 NWBOWMUIXCBODE-DOTOQJQBSA-N 449.503 4.118 10 10 IICE O=C(NCc1cc(Br)ccc1O)C1(c2ccccc2Br)CC1 804733160 KPMJTNXTFUKSEQ-UHFFFAOYSA-N 425.120 4.265 10 10 IICE CC(C)OCc1cc(NS(=O)(=O)/C=C\c2ccccc2Br)ccc1O 811704104 USUWZHPADJCNEG-KTKRTIGZSA-N 426.332 4.492 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1128580785 PDXSQQLZDUHAQE-MRXNPFEDSA-N 431.577 4.280 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4ccc(C)cc4)c3C(F)(F)F)C2)cc1 1130826525 BMMJYKDHRUHYAC-MRXNPFEDSA-N 444.457 4.217 10 10 IICE Cc1cc(CCNC(=O)[C@H](COC(C)C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1132011972 ZTKLBKUAVSUHKU-QFIPXVFZSA-N 443.588 4.071 10 10 IICE Cc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c(O)c1O 1137814790 OWDXYMLIJCJGIV-UHFFFAOYSA-N 431.536 4.023 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1142847578 TZSVKRUXHMQCHM-YXAHYSCSSA-N 427.589 4.496 10 10 IICE COC(=O)c1c(NC(=O)C[C@@H]2CCNC2=O)sc(C)c1-c1ccc(Cl)cc1Cl 1264453625 DPSZXHDTBFAVQO-JTQLQIEISA-N 441.336 4.282 10 10 IICE CCc1ccc(N2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)cc1 1294212475 NYHHDFSIROVYCD-UHFFFAOYSA-N 429.564 4.360 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cnn(C)c3)n2CCOC(C)C)c(C)n1-c1ccccc1 1304192076 KZBYBGFOGLOART-UHFFFAOYSA-N 447.587 4.148 10 10 IICE COCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)sc2cccc(F)c12 1461077387 OMMAMSGRJOOVRD-OAHLLOKOSA-N 428.529 4.452 10 10 IICE Cc1cc(Br)cc2cc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)oc12 1462468838 RJTWTUGHOLIDPB-UHFFFAOYSA-N 442.357 4.186 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccccc3O)CC2)c(C)n1-c1cccc(Cl)c1 1465842771 BBXZRLCBPRNQRB-UHFFFAOYSA-N 437.927 4.051 10 10 IICE Cc1cc(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)c(C)n1-c1cccc(Cl)c1 1466104004 TXACUKSEXQLVOB-UHFFFAOYSA-N 431.005 4.387 10 10 IICE CCC1(N2CCOCC2)CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)CC1 1470859368 YWGNEMDFJHOTNU-UHFFFAOYSA-N 429.992 4.465 10 10 IICE CC(C)c1nnc(N2CCO[C@@H](Cc3ccccc3)C2)n1CCCSc1nccs1 1509025250 NKXVVFIXCBGCHH-IBGZPJMESA-N 443.642 4.488 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1Cc1ccnc(OC(F)F)c1 1517145645 BBSFVWKXIZMDMS-UHFFFAOYSA-N 431.487 4.253 10 10 IICE CCSc1ccc(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)c(Br)c1 1518368054 GAZJZQJQBUZGOS-UHFFFAOYSA-N 449.414 4.461 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)sc(C)c1-c1ccc(C)cc1 1531343382 XOBWGIAOUWINQB-MRXNPFEDSA-N 426.538 4.158 10 10 IICE COc1cccc([C@H](C)N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c1 1543216220 ZQVOKXCWQZZLJP-FQEVSTJZSA-N 445.563 4.434 10 10 IICE C/C(=C/C(=O)N1CCOc2c1cc(Br)cc2C(F)(F)F)c1cnccn1 1585287800 LSADVALUAOIBSU-POHAHGRESA-N 428.208 4.087 10 10 IICE Cc1cccc(C(=O)C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1585834735 OWWXJTUGFUPCBE-UHFFFAOYSA-N 435.281 4.289 10 10 IICE COCCC1(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCC1 1586619219 FNPLMCSGYDNLQE-HXUWFJFHSA-N 433.593 4.032 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Br)s1 1595573503 RKDVSGBZNRMQEM-CYBMUJFWSA-N 429.767 4.264 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1C[C@@H](C)[C@H](C(F)(F)F)C1 1611963226 KJXRQWFAQQKOEG-OXQOHEQNSA-N 444.505 4.397 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CC[C@@H](C)C(C)(C)C2)cc1 1615379200 CXZJSYPPEKBGMI-LJQANCHMSA-N 435.620 4.446 10 10 IICE CCOCc1nnc(N2CC[C@H](C)[C@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616775714 VXLVJYWORJFZFW-GHTZIAJQSA-N 429.634 4.041 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(c4ccccc4Cl)C3=O)c2C)cc1 1617592582 XKIBGLXGZZLHHV-OAQYLSRUSA-N 437.927 4.291 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CCCCS3)CC2)cc1 1619301448 LCDHPFUYENDIKH-JOCHJYFZSA-N 443.661 4.488 10 10 IICE COc1ccc(N(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)Cc2ccccc2)cc1OC 1620686535 LNXGCZVJVVHPBV-UHFFFAOYSA-N 435.480 4.282 10 10 IICE CN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)Nc2ccccc2)ccc1Cl 1622317544 OSOHMXBPVXMIDH-UHFFFAOYSA-N 430.913 4.119 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCC(O)(c2ccccc2C(F)(F)F)CC1 1623454063 SUIVSRXGBFELDI-UHFFFAOYSA-N 437.439 4.455 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C 1625794511 KSKOVTABIYPAKL-QFIPXVFZSA-N 425.573 4.442 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C=C(/C)c3cccc(C(F)(F)F)c3)CC2)cc1 1625951934 QBDLFHCAVMOBCA-VLGSPTGOSA-N 447.501 4.056 10 10 IICE COc1ccc(-c2n[nH]c(CNC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)n2)cc1 1627486288 NBERVZKUKNHOAP-UHFFFAOYSA-N 435.915 4.471 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cccc3ncccc23)NC(=O)OC(C)(C)C)cc1 1628496418 YGUXYSPEKMNLEW-HSZRJFAPSA-N 448.567 4.226 10 10 IICE COc1ccc(C(=O)Nc2ccccc2C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 1628727393 VRKZJCMHOYDACD-UHFFFAOYSA-N 431.492 4.053 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@]1(C(=O)OC(C)(C)C)CC1(C)C 1629969207 QXUNFNXWLLATJJ-FQEVSTJZSA-N 426.351 4.261 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cc2ccc(Br)c([N+](=O)[O-])c2)cc1F 1633263615 KFYWOXWCRDIUJA-UHFFFAOYSA-N 438.297 4.202 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3ccncc3)C2)c(C)n1-c1ccc(Br)cn1 1637002992 XKHXDZXGTBYNQA-QGZVFWFLSA-N 425.330 4.276 10 10 IICE CC(C)(C)OC(=O)N[C@H](C[C@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)C1CCCC1 1637561211 ICTLTGNHONSGPU-UYAOXDASSA-N 446.588 4.353 10 10 IICE CSc1cccnc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1640737062 GSZWHHMDKZERJE-KAMYIIQDSA-N 435.621 4.485 10 10 IICE COc1ccc([C@@H](NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)cc1 1645123360 ADUVUTUFKBQBHK-VWLOTQADSA-N 442.515 4.396 10 10 IICE C[C@H](N[C@H](CF)c1ccc(F)cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1655389543 MJWZDFJXWYQCES-LHSJRXKWSA-N 434.442 4.229 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)C2=O)c(C)c1 1656399039 SYOMKJSUCKQBRZ-SANMLTNESA-N 447.510 4.500 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3cccc(C)c3Br)CC2)cc1 1671713401 YKWBIHXNYPJNKE-UHFFFAOYSA-N 432.362 4.188 10 10 IICE C[C@@H](NC(=O)NC[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)c1ccccc1O 1684950913 UAYUNLMWFCUNKW-VQIMIIECSA-N 425.529 4.114 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1708372070 VPYYXSXAFOFGDU-AUSIDOKSSA-N 441.620 4.080 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1708591539 ULYOTMIPBJYCKQ-FQEVSTJZSA-N 434.588 4.097 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2C[C@@H](C)CC[C@@H]2C)cc1 1710023803 DHUHDIQGYYVMSS-PMACEKPBSA-N 438.620 4.033 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCC(F)(F)C2)cs1 1725250713 GPDVITJVUGXVIP-HNNXBMFYSA-N 433.528 4.411 10 10 IICE COC[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1730562163 NCIQPCJWXIISJP-FQEVSTJZSA-N 425.621 4.160 10 10 IICE C[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)O1 1752381187 PMZLGCJIGOEPIU-KRWDZBQOSA-N 429.584 4.268 10 10 IICE CC[C@@H](c1ccccc1)c1nnc(N2CCOCC2)n1CCCSc1nccs1 1764009082 JQUSFUCIIGSKPO-SFHVURJKSA-N 429.615 4.296 10 10 IICE COC(=O)c1cccc(N2C(=O)/C(=C\c3cn(C)c4ccc(OC)cc34)SC2=S)c1 1860086965 RZYSNGBAHPEEQP-VXLYETTFSA-N 438.530 4.379 10 10 IICE CCCOc1cccc(CNCCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1860714486 HAKMRZLOTGJYLV-UHFFFAOYSA-N 442.515 4.369 10 10 IICE O=C(NCc1ccco1)c1c(NS(=O)(=O)c2ccc(F)cc2)sc2c1CCCC2 1871343412 JRSFMOJINNMAPE-UHFFFAOYSA-N 434.514 4.090 10 10 IICE Cc1cc(O)c([C@@H](C(C)C)n2nc(C)c(C(=O)O)c2I)cc1C 2079928498 GYZAYJOELHNFSC-OAHLLOKOSA-N 428.270 4.062 10 10 IICE CCOC(=O)c1c(C)nn([C@H](c2ccc(OC)cc2O)C(C)(C)C)c1Br 2079957063 MQJBCUIXOMUWMV-MRXNPFEDSA-N 425.323 4.480 10 10 IICE CC[C@@H](NC[C@@]1(O)CCCN(Cc2ccccc2)C1)c1cc(Br)ccc1O 2157531044 ZVSVLZSCVKYJEN-IRLDBZIGSA-N 433.390 4.223 10 10 IICE CCOc1cc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)cc(Cl)c1OCC 2313559483 YZEUCBVRYKELBF-UHFFFAOYSA-N 448.903 4.108 10 10 IICE CC1=NN(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141403 TZCVAVBFUYVUFG-UHFFFAOYSA-N 434.235 4.479 10 10 IICE O=C1C(=Cc2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1cccc(Cl)c1 2332144656 BVYLTSQHVXXPLO-UHFFFAOYSA-N 425.750 4.298 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475853 ZWDZWAUVKNZVHK-PNLZDCPESA-N 443.525 4.157 10 10 IICE CC(C)(C)NC(=O)CCCN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S 33323574 ISGZKPFNNRJZIY-SDNWHVSQSA-N 441.416 4.345 10 10 IICE Cc1ccccc1N1C(=O)N=C(O)/C(=C\c2cccc(I)c2)C1=O 33666461 SUQPROWWINMLME-GXDHUFHOSA-N 432.217 4.106 10 10 IICE C[C@@H]1[C@@H](NCc2cc(Br)ccc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709343743 MXTXYFRAPDLOQL-VDNDLQMASA-N 425.367 4.421 10 10 IICE Cc1cc(CCNC(=O)N2CCN([C@@H](C)c3cccnc3)CC2)c(C)n1-c1ccccc1 734213476 MAQRKABTLCSGEE-NRFANRHFSA-N 431.584 4.120 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 743758478 FMHTZEAQTDTIGN-LJQANCHMSA-N 439.556 4.004 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC2C[C@H]3CC1C[C@@H](C2)C3 744280577 PAHXLJLOWYCHNF-HLVUACMISA-N 437.506 4.262 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1 747847081 QXKHIBULHXIKIZ-UHFFFAOYSA-N 430.463 4.251 10 10 IICE Cc1cc(F)ccc1N1CCC[C@@H](OC(=O)c2csc(Cc3ccc(N)cc3)n2)C1=O 751930792 KOGYLDFMFRBYQP-HXUWFJFHSA-N 439.512 4.116 10 10 IICE C[C@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)c(F)cc1O 757637621 LIQBDZCMNZGCAU-SMDDNHRTSA-N 449.299 4.357 10 10 IICE CN1CC[C@H](NC(=O)NCc2cccc(Br)c2O)[C@H]1c1ccc(Cl)cc1 764798169 ASYOLIFHAKSING-DLBZAZTESA-N 438.753 4.053 10 10 IICE C[C@H](NC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccc(N2CCOCC2)cc1 788757126 UDJWEOWEMCEEOH-ORAYPTAESA-N 425.426 4.168 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2ccccc2N2CCOCC2)c(C)n1-c1ccccc1 789918191 HMOXYRXLWUICKX-UHFFFAOYSA-N 446.595 4.315 10 10 IICE Cn1cc([C@H]2[C@H](c3noc(-c4ccc(-n5cccc5)c(F)c4)n3)CC(=O)N2C(C)(C)C)cn1 797433605 HWPVMTXUMHLZLZ-UTKZUKDTSA-N 448.502 4.256 10 10 IICE O=C(CSCc1cc(-c2cccs2)on1)NCc1cc(Br)ccc1O 804736277 PDYHYIRMTOMPAQ-UHFFFAOYSA-N 439.356 4.421 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NCC1CCN(C(=O)c2ccccc2)CC1 806839985 CWCPAHHLSMHLFP-UHFFFAOYSA-N 436.339 4.051 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)NC(=O)NCc2cc(Br)ccc2O)c(C)c1 807007782 NTDSEQZXUIZYPV-LJQANCHMSA-N 443.345 4.209 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc3c(c2)C(=O)N(Cc2ccccc2)C3=O)cc1 1125233265 HGQNTTADBZSNOM-UHFFFAOYSA-N 441.531 4.259 10 10 IICE C[C@H](NC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F)c1ccc(N2CCOCC2)cc1 1136443170 SQPBZMWNDAOCPB-BTYIYWSLSA-N 432.442 4.107 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3ccc(Br)c(Cl)c3)CC2)cc1 1151503174 NHXPKWDQWFZCKY-UHFFFAOYSA-N 437.765 4.393 10 10 IICE Cc1sc2ncnc(N3CCC(C(=O)NCc4cccc(Cl)c4O)CC3)c2c1C 1159034072 QQWSZYYNINDPBA-UHFFFAOYSA-N 430.961 4.200 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3ccc([N+](=O)[O-])c(F)c3)c2C)cc1 1165569726 CVOXFJSQGOGPMM-UHFFFAOYSA-N 426.400 4.190 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2cccc3ccccc23)cc1 1166169924 HJQLTGPNSMFGHO-AREMUKBSSA-N 426.516 4.452 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H]3[C@@H](O)C(F)(F)F)cc2Cl)C1 1235834056 NAZQKHOBUSHRSG-JEBQAFNWSA-N 433.902 4.174 10 10 IICE CCN(Cc1ccccc1Br)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1252924083 PFTJCUHWDKTXPR-QGZVFWFLSA-N 432.362 4.268 10 10 IICE CC(C)c1nnc(N2CC[C@@H](C)[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1287192298 IOEPMRCCDKGGLR-WOJBJXKFSA-N 425.621 4.141 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC(C)(COC)CC2)cc1 1295413164 LYRLKRQFUKKYBP-UHFFFAOYSA-N 448.615 4.488 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)Cc2nnc3n2CCC[C@@H]3C(F)(F)F)cc1 1303522641 OUSYOQXHNJETFN-SFHVURJKSA-N 431.462 4.398 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@@H]1COc2cccc(Br)c2C1 1313197462 MYVADOLKRDYTQD-NSHDSACASA-N 446.128 4.264 10 10 IICE C[C@]1(c2ccccc2)CCCN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1313304849 MCRJZUUUPZCMPU-MHZLTWQESA-N 448.611 4.042 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)COc3ccc(Cl)c(Cl)c3)cc2F)C[C@@H](C)O1 1356036803 PWDBMWYKGNEQLV-ZIAGYGMSSA-N 441.330 4.441 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCCC[C@H]3c3ccccc3)CC2)cc1 1442747353 UASGRDRHXDKOLM-DACFSCGWSA-N 447.579 4.044 10 10 IICE COC1CCN(c2ccc(CN3CC[C@H]4CC[C@]43CNC(=O)OC(C)(C)C)cc2)CC1 1460905327 INZVTHWFDJGMJJ-NLFFAJNJSA-N 429.605 4.181 10 10 IICE Cc1cc(CC(=O)N(CCO)Cc2cccnc2Cl)c(C)n1-c1ccc(Cl)cc1 1467459146 LNUMOGVYMORMLJ-UHFFFAOYSA-N 432.351 4.360 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)cc1 1468662637 WYAYLONOLPQBES-LJQANCHMSA-N 431.536 4.313 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H](C)C3)nnc2[C@]2(OC(C)C)CCOC2)cc1 1515528000 FHCXUZORQBBIRH-NLFFAJNJSA-N 441.620 4.059 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C=C3CCC(C(C)(C)C)CC3)CC2)cc1 1523442529 GQACYWLYLXFBHK-UHFFFAOYSA-N 427.633 4.486 10 10 IICE CCN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1532695830 DFSGDOGUNBGVPN-VWLOTQADSA-N 431.580 4.233 10 10 IICE Cc1cc(-c2csc(NC(=O)CC3(O)CCOCC3)n2)c(C)n1-c1ccc(F)cc1 1558909895 ZZGPMUJFUNMCQE-UHFFFAOYSA-N 429.517 4.227 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)c3ccc(F)cc3)cc2Cl)C1 1564649306 AJQWNJBFMPFXCW-LPHOPBHVSA-N 433.955 4.291 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)cc1 1565772568 PXCKITFEQBUYLN-UHFFFAOYSA-N 431.855 4.132 10 10 IICE COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1567365483 VCVVZYVHKBIFSM-OFNKIYASSA-N 431.536 4.271 10 10 IICE CC[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)C(=O)NCc1cccs1 1570703644 WBNMNFDSKDSKBX-NRFANRHFSA-N 437.565 4.101 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1613137242 BSBQAMWEMDBBBA-AUSIDOKSSA-N 441.620 4.332 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N2CCO[C@@H](COC(C)C)C2)cc1 1615379317 GARAIFIOOWKNKI-HSZRJFAPSA-N 441.620 4.070 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@](C)(C(=O)OC(C)(C)C)C2)CCCC1 1629296816 LSSDXMLPZKSSSV-VWLOTQADSA-N 426.557 4.109 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)ccc21 1629378530 BWTTWJKOYDJRSW-MRXNPFEDSA-N 431.577 4.137 10 10 IICE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccccc1O 1631540617 YWLJXJKXDYADBL-UHFFFAOYSA-N 430.504 4.326 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)[C@H]1CCC[C@H](OC)C1 1631887777 GQITUHPCFNNHBN-IEIRFRATSA-N 426.557 4.188 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1Cc2ccc(Br)cc2C(=O)O1 1634012800 XJJBYHGKEJTUBX-IBGZPJMESA-N 432.314 4.065 10 10 IICE Cc1cc(N2CCC[C@@H](NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)C2)n(C)n1 1634321935 STCVBKHEGIMSNG-LJQANCHMSA-N 425.964 4.188 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 1636848116 UNESZCZJEOOYRZ-HXUWFJFHSA-N 444.579 4.186 10 10 IICE CCN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H](C)c1cc2ccccc2o1 1638478973 KLYNBVMFASPJFY-SFHVURJKSA-N 448.567 4.427 10 10 IICE C[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1cc(Cl)cc2c1OCC2 1638652389 ZRWHWIGRFHWGBI-BTYIYWSLSA-N 430.980 4.004 10 10 IICE Cc1cc(C(=O)CN2C(=O)C(=O)N(CC(C)C)C2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 1640689311 IZFCWCMPROYLMW-UHFFFAOYSA-N 437.540 4.021 10 10 IICE Cc1ncc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)c(N)n1 1641203052 TXXQGOOBQXWPQN-GOSISDBHSA-N 429.446 4.293 10 10 IICE CCOC(=O)c1sc2nc(CN3CCCc4cc(OC(F)F)ccc43)nc(N)c2c1C 1644806264 MFKJGUWMZAOAKI-UHFFFAOYSA-N 448.495 4.313 10 10 IICE CCOC(=O)[C@H](c1ccc(Br)cc1F)N1CCOc2cc(N(C)C)ccc21 1653144829 OEOAGNNIKSMKLT-IBGZPJMESA-N 437.309 4.157 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CCCn2ccnc2)sc(C)c1-c1ccccc1 1653144882 PLNYWVMNIOVCLN-UHFFFAOYSA-N 440.569 4.057 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@@]2(C)C1 1673743797 GVHDOXKRGABLOC-WBWMCNGVSA-N 434.628 4.156 10 10 IICE COCCN(Cc1ccc(F)cc1Cl)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1683337013 SXLCICDFHZKUAQ-KRWDZBQOSA-N 449.954 4.172 10 10 IICE C[C@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1684168847 GQEBBULUSUHMTK-YADARESESA-N 434.584 4.071 10 10 IICE CCc1noc([C@@H]2CC[C@H](NC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)n1 1684438028 ZRTWVVRYCMRKKC-MOPGFXCFSA-N 437.544 4.339 10 10 IICE CN(C)c1ccc(CN(C(=O)NC2CC3(CC(NC(=O)OC(C)(C)C)C3)C2)C2CC2)cc1 1687867296 FDFBTAPLVMOBOU-UHFFFAOYSA-N 442.604 4.263 10 10 IICE CC(C)[C@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1691987209 YLNJWNVVBNLVDD-OAQYLSRUSA-N 440.592 4.171 10 10 IICE CCCN(CC)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1695297201 ZLONAFJREDSQFT-UHFFFAOYSA-N 437.588 4.340 10 10 IICE CN(C[C@H]1CCCO1)c1nnc(Cc2ccsc2)n1CCCSc1nccs1 1696844839 SFUVZJCQRFLZAM-MRXNPFEDSA-N 435.644 4.185 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1712798959 DIEZTYFNFPMASP-WIYYLYMNSA-N 443.661 4.181 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1727815160 GBIWEWIDKWCBFW-XKCSPQBFSA-N 441.620 4.070 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1CCCCCN1CCCC1 1729420152 IMAAZPYKEPKTLF-JOCHJYFZSA-N 427.593 4.128 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@@H](C)O1 1745029932 GSVNYSJSFPDSDG-WIYYLYMNSA-N 425.621 4.301 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1749273063 AELJVJUNHYYMPP-OAQYLSRUSA-N 437.588 4.250 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCCCN3CCCC3)C(=O)N(C(C)C)C2=O)cc1 1873167368 DFDMLAKQEVUCPL-UHFFFAOYSA-N 448.611 4.048 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3cccc([N+](=O)[O-])c3)C(=O)N(C3CC3)C2=O)cc1 1873422245 NAQWJFBLXCLBEK-UHFFFAOYSA-N 442.475 4.357 10 10 IICE O=C(NC[C@H](NCc1c(O)cccc1Br)C(F)(F)F)OCc1ccccc1 1942700606 FKJCWTMFEOXFDP-INIZCTEOSA-N 447.251 4.102 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(O)cc1 2294028475 MIRGMJHQJKSMSS-UHFFFAOYSA-N 428.282 4.422 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N([C@H]2CC(=O)N(c3ccc(C)cc3)C2=O)C1=O 2314832720 MHYXYOUEGHKRLY-IBGZPJMESA-N 448.569 4.475 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)CC2(F)F)c(O)c1Br 2352942259 BQEFAFJYBCKYIL-CYBMUJFWSA-N 435.309 4.197 10 10 IICE O=C1/C(=C/c2ccc(-c3ccc(F)cc3)s2)SC(=S)N1CCN1CCOCC1 11092325 TZPYFXHGXGJFOR-AQTBWJFISA-N 434.583 4.088 10 10 IICE CCN(CC)c1ccc(/C=C2/C(=O)NN(c3ccc(Cl)c(Cl)c3)C2=O)cc1[N+](=O)[O-] 33436488 LZMQGEIGGNFJFI-ZROIWOOFSA-N 449.294 4.209 10 10 IICE O=C1[C@@H]2ON(Cc3ccccc3)[C@@H](c3cc(Cl)ccc3O)[C@H]2C(=O)N1Cc1ccccc1 43254215 SOATWEQQEKPCOY-XPWALMASSA-N 448.906 4.088 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccc(Br)o2)c(C)n1-c1ccc2c(c1)OCCO2 106253850 DBTZVCCJDHWHBC-UHFFFAOYSA-N 445.313 4.493 10 10 IICE CCN(CC)c1ccc(N2C(=O)/C(=C/c3cccc(OCC(=O)O)c3)SC2=S)cc1 210426765 KOHXBCFGLJEPFC-UYRXBGFRSA-N 442.562 4.402 10 10 IICE CN(C)c1ccc(CNC(=O)CSCc2ccc(Br)cc2F)cc1F 747652969 MYRIEQYAOZJNQD-UHFFFAOYSA-N 429.330 4.343 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc(-c2nc(C3CC3)no2)cc1 751242618 HSIKHASUZAQHAW-UHFFFAOYSA-N 443.551 4.398 10 10 IICE COc1ccc(Br)cc1[C@H](NCc1cc(Cl)cc(Cl)c1O)C(=O)O 756379256 LTMLUUFSLGDDKV-AWEZNQCLSA-N 435.101 4.386 10 10 IICE Cc1cncc(/C=C\C(=O)NCc2ccc(N(C)C(=O)/C=C\c3cncc(C)c3)cc2)c1 765480248 LKRGSXYRJAVNLC-SQXCDDPUSA-N 426.520 4.099 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1 771411072 YFNSQDQAYVFTTA-IBGZPJMESA-N 425.598 4.410 10 10 IICE COc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc(Cl)c1O 785569688 JOSJJAGUWQQKGO-UHFFFAOYSA-N 426.847 4.054 10 10 IICE COc1cc(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)c(OC)c1 800573061 CBHGJXWUOVKTMD-HUUCEWRRSA-N 431.508 4.087 10 10 IICE C[C@@H](Oc1ccccc1F)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCO1 812298008 GBPSEBXIVBUGOS-AEFFLSMTSA-N 426.492 4.078 10 10 IICE CC[C@H](C)c1nc(C)c(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)n1 1125256476 IIEXGOIPNSAFHH-ULQDDVLXSA-N 442.579 4.219 10 10 IICE CCC[C@@]1(C(=O)OCC)CCCN1C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1128523575 QWZVYMHKNLQKQV-VWLOTQADSA-N 426.557 4.253 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CCN(C(=O)OC(C)(C)C)c3ccccc32)C1 1129536625 HDNWMPCHVXQCQL-KRWDZBQOSA-N 443.544 4.388 10 10 IICE COC1CCN(C2(CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CCCC2)CC1 1136824128 ZNAUJDPMRVMJQS-UHFFFAOYSA-N 437.584 4.060 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1143587747 YNUZFQMOOWVQLR-UHFFFAOYSA-N 435.499 4.443 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(C(=O)c2ccco2)c1 1150353983 IJKQJQJRHNFLKF-HXUWFJFHSA-N 438.911 4.264 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@]3(CCCOC3)C2)sc(C)c1-c1ccccc1 1196083970 YGXQNBYCZGBARF-DEOSSOPVSA-N 442.581 4.341 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H]3c3ccc(OC)cc3OC)C2)cc1 1230300847 KGICVSMWNHNACB-FDDCHVKYSA-N 439.556 4.085 10 10 IICE CC(C)CCO[C@H]1CC[C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)CC1 1230976929 BMOUIXAKHHKPCL-HCGLCNNCSA-N 431.621 4.068 10 10 IICE C[C@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)N(C)C(=O)OC(C)(C)C 1288636500 ALFZINVGDOWQEQ-MRXNPFEDSA-N 429.565 4.143 10 10 IICE Cc1ncsc1CCn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1289181360 YJRTTWGKVJGVDE-UHFFFAOYSA-N 425.583 4.280 10 10 IICE CCCCCN(c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1294112139 AGDXEUAOALWBIF-QFIPXVFZSA-N 441.620 4.072 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@@H]2OCC[C@@H]2C1 1304238913 YZFHVVWDPMDHKH-IRLDBZIGSA-N 425.621 4.295 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3c(cccc3C(F)(F)F)C2)N(C)C)cc1 1313394136 JMZHFVCRYZGLLQ-OAQYLSRUSA-N 434.506 4.142 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCOC(C)(C)C)CC2)cc1 1315511456 DKSXEMMBEXUFQX-UHFFFAOYSA-N 429.609 4.017 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)COc3ccccc3OCc3ccccc3)C2)cc1 1461497594 UTYVQFQNPFNQMR-OAQYLSRUSA-N 432.520 4.048 10 10 IICE COc1ccc(N2CCN(C(=O)CC(C)(C)CC(=O)c3ccc(C)cc3)CC2)cc1F 1465930362 ONSLYMAQUBTVAI-UHFFFAOYSA-N 426.532 4.481 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccccc1O 1471195040 SQWDEDQCOKPUDG-AWEZNQCLSA-N 430.913 4.337 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCOCC2)c(F)c1 1513135472 PVIGMACPACLTMD-GOSISDBHSA-N 440.567 4.170 10 10 IICE CS[C@@H]1CCCCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1519292105 PALUHHQUOGJFMD-WISAJEAXSA-N 438.615 4.161 10 10 IICE CCCCC[C@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 1527966118 ALIMUEOWZSJQRI-NRFANRHFSA-N 441.595 4.411 10 10 IICE CC(C)(NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1 1528783930 MMGILLMAHWCQPS-NBVRZTHBSA-N 428.554 4.469 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(C)CCN(C)c1ccc(OC)cc1)O[C@H](C)C2 1531374384 AQAVGUHAHSTMPN-FHZYATBESA-N 438.568 4.116 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 1532656340 RBTSGHNKCDHNRU-QFUCXCTJSA-N 443.588 4.436 10 10 IICE Cc1cccc(C)c1CCNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1534550230 ACKDQUPJCNSEQV-ZHZULCJRSA-N 442.581 4.393 10 10 IICE Cc1nc(N2CCOCC2)ccc1NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1534730008 FUMDNHWGZDFRQW-UHFFFAOYSA-N 438.959 4.469 10 10 IICE Cc1ccc(C(=O)NCCc2ccn(-c3ccccc3)n2)cc1-n1c(C)cc(C=O)c1C 1545060497 YFELSXNIBZTLDY-UHFFFAOYSA-N 426.520 4.373 10 10 IICE CC[C@H](C)c1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCOCC2)c(F)c1 1545349433 APFYPDBHXTYAEM-HNNXBMFYSA-N 443.489 4.204 10 10 IICE COC(=O)[C@]1(c2ccccc2)CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1565162084 LJJGHJJBTDATPH-HHHXNRCGSA-N 445.563 4.163 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3sccc3-n3c(C)ccc3C)C2)cc1F 1567996470 WINVSMYNEUJMPY-INIZCTEOSA-N 427.501 4.226 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCSCC3)cc2)cnn1-c1cccc(F)c1 1596359449 SKZRRQSTHVPDLH-UHFFFAOYSA-N 438.572 4.447 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(CN3CCCCC3)o2)cc1 1598290952 ITIAJSJMSUHFHO-JOCHJYFZSA-N 425.573 4.153 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCO[C@H]1C(C)C 1614012331 QUCNYNDCLFUFHG-RDPSFJRHSA-N 441.620 4.017 10 10 IICE Cc1ccc(C(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)cc1-n1c(C)cc(C=O)c1C 1616470644 HECNHPHMBCVYIN-UGKGYDQZSA-N 436.474 4.428 10 10 IICE COc1ccc(C2(CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CCOCC2)cc1 1625625239 WZPWHRCBRUYGQM-UHFFFAOYSA-N 446.547 4.393 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ccc(I)cc1OC 1629959610 HMXDZUGMJHMOJH-UHFFFAOYSA-N 425.266 4.058 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@@H]2CCC[C@H](C1)N2C(=O)OC(C)(C)C 1636262987 LNFGNRSWHVVSLZ-QIJUGHKUSA-N 444.620 4.175 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])CC2)cc1 1636702247 JJDXOZYBHQXJIB-UHFFFAOYSA-N 432.480 4.018 10 10 IICE CCOc1ccc(N(CC)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1642199915 OOEJMJAIVBEQDE-UHFFFAOYSA-N 428.488 4.326 10 10 IICE CCC(O)(CC)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1649585167 KHNZOJQCJYBBTK-UHFFFAOYSA-N 448.615 4.052 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)OCc2ccccc2)c1O 1658628105 YFHOOXSPGMTOAY-FHQLIMNDSA-N 427.928 4.496 10 10 IICE CC[C@H](c1ccccc1)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(C)C 1659544088 HVWKYYYTFQGOKS-HSZRJFAPSA-N 427.564 4.140 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN([C@H](C)c4cccnc4)CC3)c2C)c1 1683302920 DVBMHCQEEKEQQO-OAQYLSRUSA-N 431.584 4.386 10 10 IICE C[C@@H](CCNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)NC(=O)OC(C)(C)C 1684738392 WKXOCKRQUBXPOR-SFHVURJKSA-N 444.576 4.361 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccco2)cc1 1686813226 VRMOFXQHEKMPIG-RUZDIDTESA-N 449.551 4.086 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)C2)cc1 1687023850 WOPMOBMVVWWCQQ-IEBWSBKVSA-N 433.474 4.492 10 10 IICE CCCN(CC1CC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1695325322 HTEIWNDDILVGKH-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC(C)SCCn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706714571 STJLBFJOXLFJMF-UHFFFAOYSA-N 437.617 4.113 10 10 IICE CCC1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1709290431 VQQHFGPIEIJDFZ-SFHVURJKSA-N 429.584 4.442 10 10 IICE CCCN(CC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1709709758 NNCCSTOVWBEGQT-OAQYLSRUSA-N 429.634 4.358 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)Cc2c(C)noc2C)cc1 1728382149 ZDPVBBCOJBJPEY-UHFFFAOYSA-N 445.571 4.476 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccoc1C 1748270142 SOCXTLDRMXPOQS-UHFFFAOYSA-N 446.555 4.027 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCSC(C)(C)C2)cc1 1764939945 ZHIBUBBQCJAAQE-IBGZPJMESA-N 429.634 4.008 10 10 IICE CN(C)CC(C)(C)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1768504743 BKXVEZOBHCDLMO-UHFFFAOYSA-N 447.631 4.165 10 10 IICE COc1ccccc1-c1nnc(N2C[C@@H](C)[C@@H](F)C2)n1CCCSc1nccs1 1768892931 LTYLQZPWCJTXTH-ZBFHGGJFSA-N 433.578 4.387 10 10 IICE CCCOc1ccc([C@@H](CC(=O)O)N2C(=O)/C(=C\c3ccc[nH]3)SC2=S)cc1OC 1858588132 RLYAIZOUYKMTJV-CLXYIWAZSA-N 446.550 4.229 10 10 IICE COc1ccc(N2CCN(Cc3cc(=O)c(OCCC(C)C)cn3CC(C)C)CC2)cc1 1870351085 MDJHBVJUAJYZTF-UHFFFAOYSA-N 441.616 4.260 10 10 IICE CN1CCc2cc(CNCCNC(=O)OCC3c4ccccc4-c4ccccc43)ccc21 1960163404 NDXNDBDKRUVGTI-UHFFFAOYSA-N 427.548 4.307 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCC[C@H](NCc2cc(Br)cc(F)c2O)C1 1962885066 TZUJVLOERPYHBO-WFASDCNBSA-N 431.346 4.467 10 10 IICE CN(C(=O)OC(C)(C)C)[C@@H]1CCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2044636320 UTTMJLZYZJNJRW-MRXNPFEDSA-N 446.592 4.008 10 10 IICE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@H](O)c1ccc(N2CCCC2)cc1 2044729674 INLUCHANGVJONU-DEOSSOPVSA-N 439.600 4.347 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc(Br)cc2O)[C@H]2CCCC[C@@H]21 2122810960 DRUGUFUCHYIJEN-IKGGRYGDSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@H](NCc3cc(Br)cc(F)c3O)C[C@H]21 2137342850 FHHSXHYOHXYJCL-YZOIGVHSSA-N 429.330 4.075 10 10 IICE CN1CCc2cc([C@@H](N)c3cc(I)ccc3Br)ccc21 2163141460 UUOHCOBCAZWTCI-MRXNPFEDSA-N 443.126 4.094 10 10 IICE Cc1ccc(O)c([C@H](C)NC2CN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C2)c1 2259378718 BKPOAGHVOLGHDV-KRWDZBQOSA-N 449.592 4.208 10 10 IICE Cc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2C=C2SC(=S)N(C)C2=O)cc1 2293689693 QHSOOPQSFKYQGL-UHFFFAOYSA-N 439.967 4.247 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1ccc(C(=O)O)cc1 2295927411 GULPBGYTWVTIST-UHFFFAOYSA-N 446.937 4.268 10 10 IICE Cn1cc(C=C2SC(=S)N(NC(=O)c3ccc(Cl)cc3)C2=O)c2ccccc21 2297469147 ZEDQTTUFTKCJJC-UHFFFAOYSA-N 427.938 4.378 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]2C[C@@H]1CNCc1ccc(Br)cc1O 2335117522 QSXSPZMCFWKJFC-XKQJLSEDSA-N 425.367 4.422 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC23CCC3)c(O)c1Br 2352680499 QJXQTQHNLVVSDI-OAHLLOKOSA-N 425.367 4.342 10 10 IICE COc1ccc(N2CCN(c3ccc(-c4nc(-c5ccc(C)cc5)no4)cn3)CC2)cc1 65097813 SBJSLFLFHBIPQE-UHFFFAOYSA-N 427.508 4.442 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)CCc3ccc(OC(C)C)cc3)CC2)cc1 108408284 ZTDPUKFDZGFCAB-FQEVSTJZSA-N 425.573 4.335 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)C1 435821471 DZHKHSNFWADYFC-HXUWFJFHSA-N 441.579 4.471 10 10 IICE Nc1cc(F)c(O)c([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1 687755001 JJJBSMXMIWQAJE-OAQYLSRUSA-N 436.439 4.168 10 10 IICE O=S(=O)(Nc1nc(-c2ccc(F)cc2)cs1)c1cc2c(cc1Cl)OCCO2 727241771 FOTPSZJPRRQNRS-UHFFFAOYSA-N 426.878 4.175 10 10 IICE CC[C@@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(C)nn(C)c1C 743694801 MCQYGCBFFWTJRV-LJQANCHMSA-N 435.519 4.058 10 10 IICE CO[C@@H](C)c1nc(C)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 749402911 RRFWSXQVPPWNHF-KBPBESRZSA-N 425.501 4.159 10 10 IICE c1ccc(COc2ccccc2CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)nc1 768669920 JEJBXZAXLHYHPE-UHFFFAOYSA-N 442.607 4.482 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(Cc1cccc(F)c1)C1CC1 769048570 KBVJEHXBZRKDDM-UHFFFAOYSA-N 436.575 4.232 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c1C 804647326 NHKNKTMCTKSLRO-UHFFFAOYSA-N 438.959 4.419 10 10 IICE C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1 806221021 WSEQVRCVLGFSAO-AWEZNQCLSA-N 446.345 4.491 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c(C)o1 1125689945 PVPMSNRJWLSMJJ-UHFFFAOYSA-N 433.552 4.267 10 10 IICE COc1ccccc1-c1noc([C@H](C)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1137105966 OUYNUYIQLIWQOZ-INIZCTEOSA-N 444.491 4.456 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cnc(Nc2ccccc2)nc1C(F)(F)F 1162612040 AKROSOZDYFCJHL-UHFFFAOYSA-N 439.397 4.423 10 10 IICE Cc1ccc(Br)c(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 1251965809 QSVDKVBDKFLZRI-SFHVURJKSA-N 433.346 4.354 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](CC(N)=O)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1289359038 HXKQPQWYMZECNZ-OAQYLSRUSA-N 448.615 4.491 10 10 IICE CC[C@@]1(c2ccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)cc2)CCC(=O)NC1=O 1292048965 JPFOSIPSYMEIPT-MHZLTWQESA-N 443.547 4.360 10 10 IICE COC(=O)C1([C@@]2(O)CCCN(C(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)CCC1 1304136940 APJYJDOSHJUGBJ-XMMPIXPASA-N 444.959 4.058 10 10 IICE CCOC(=O)Cc1cc(Cl)c(=O)n(CC(=O)c2cc(C)n(-c3ccccc3C)c2C)c1 1307344955 UPCMTQYVMRHEOK-UHFFFAOYSA-N 440.927 4.206 10 10 IICE CC[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cccc([N+](=O)[O-])c1 1307634037 VLRQNYRMHFJYSB-QFIPXVFZSA-N 443.459 4.050 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](CC)C1 1314457093 ICFZCYBFHAJMEU-JOCHJYFZSA-N 437.588 4.394 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CC(C)(C)Oc4ccccc43)cc2F)C[C@@H](C)O1 1355131217 ULEBRRAOKZUIDU-QKLQHJQFSA-N 426.532 4.400 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc4cc(Cl)ccc4s3)cc2)C1 1356434729 VBZLWUHDHPZSQD-HNNXBMFYSA-N 427.957 4.186 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccn(-c3ccc(Br)cc3)n2)cc1 1357724337 QYYJYNRQMWLNHY-UHFFFAOYSA-N 427.346 4.411 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(Br)c3F)cc2F)C[C@@H](C)O1 1357835113 CRHXZAFSFKIJDM-BETUJISGSA-N 439.300 4.271 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(O[C@H](C)C(F)(F)F)nc3C)CC2)cc1 1359816375 JTCFMDYEMGNSSY-OAHLLOKOSA-N 437.462 4.127 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3ccc4ccccc4c3)cc2F)CC1 1359919680 ABIFLGLLPLIIPS-IBGZPJMESA-N 435.543 4.205 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)S[C@H](C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1361049023 PZDYPVYSFRMCNX-QZTJIDSGSA-N 439.629 4.454 10 10 IICE CCOc1ccc(-c2noc(CCC(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)n2)cc1 1460981342 HAXOMJPISHKNPN-GOSISDBHSA-N 436.556 4.190 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1ccccc1C(F)(F)F 1466398446 NHALJZNOOJFPTM-GFCCVEGCSA-N 445.821 4.034 10 10 IICE Cc1ccc(C[C@@]2(C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1471369929 NRQLNNDGQWRBKJ-HHHXNRCGSA-N 448.611 4.004 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1496021352 ARGGEXPAECDPSM-PZJWPPBQSA-N 443.661 4.256 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@H](c3noc(C(C)C)n3)C2)cc1 1501835618 ZEKUVKPCXIJKGH-FQEVSTJZSA-N 437.592 4.371 10 10 IICE CN(C)c1ccc(Cn2c(N3CC[C@H](C4CCOCC4)C3)nnc2C(C)(C)C)cc1F 1503392004 BEQHTBJCMARTMM-IBGZPJMESA-N 429.584 4.082 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc(Br)cc(Br)c2)cc1F 1519250502 XQEJBOPLODPQAK-UHFFFAOYSA-N 430.115 4.347 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(C(F)(F)F)cc1 1527735720 YQWXKIAMEIQGHY-QGZVFWFLSA-N 447.501 4.001 10 10 IICE CN(C)c1ccc(CN(C(=O)C(C)(C)n2ccc(NC(=O)OC(C)(C)C)n2)C2CC2)cc1 1532946913 SRJXFCKFDBUMCN-UHFFFAOYSA-N 441.576 4.222 10 10 IICE COc1ccc([C@@H]2[C@@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC(=O)N2C)cc1 1535136459 OTDYWCATMGKRFM-AZGAKELHSA-N 445.563 4.247 10 10 IICE COC[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(F)c(F)c1 1535396106 HHMBKTCFPDYCGY-NRFANRHFSA-N 428.479 4.311 10 10 IICE CCn1ncc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1Br 1539912569 JGAPUKINCCVREI-CYBMUJFWSA-N 439.785 4.485 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cccc(I)c3N)cc2)CC1 1565664132 WDJHKKLQURQHEU-UHFFFAOYSA-N 449.336 4.040 10 10 IICE COc1ccc(CNC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)c3ccccc32)c(O)c1 1568097766 PBPHSJHIWAVYMH-MRXNPFEDSA-N 426.513 4.336 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1586800829 YJNMWOCACIFYMZ-UHFFFAOYSA-N 432.568 4.134 10 10 IICE CCc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NCCc2ccc(O)c(O)c2)cc1 1595751486 IYSRRRMXSLATBS-UHFFFAOYSA-N 427.504 4.485 10 10 IICE COc1cc(OCC(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] 1597567816 YCIGLKIVERKXRE-KRWDZBQOSA-N 436.464 4.478 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)CC(=O)OC(C)(C)C)c(C)n1-c1cccc(Cl)c1 1598457494 NOEZSQIJZWNXDI-UHFFFAOYSA-N 433.980 4.093 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)c1cccs1 1620118352 ZQCYWGRENTZMMM-HSZRJFAPSA-N 437.569 4.319 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C)Cc1ccccc1OC 1623581059 SEKSBUBMKNUSLV-OAQYLSRUSA-N 434.536 4.173 10 10 IICE Cc1cc(C(=O)Nc2cc3c(cc2O)n(C)c(=O)n3C)c(C)n1-c1cccc(C(C)C)c1 1625592016 WZOFWIKGFIQDJP-UHFFFAOYSA-N 432.524 4.366 10 10 IICE Cc1cc(CC(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)c(C)n1-c1ccccc1 1625600182 WWVOUNMMXKVFLA-UHFFFAOYSA-N 430.552 4.449 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@H](NC(=O)OC(C)(C)C)C3(C)C)ccc21 1627064656 ZIQHONINBQKIAK-RTWAWAEBSA-N 443.588 4.326 10 10 IICE COc1cccc(-c2noc([C@@H](C)NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)n2)c1 1630375780 DPFUHALPXFRMIQ-MRXNPFEDSA-N 444.491 4.456 10 10 IICE CC(=O)SCCCCCCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1633472792 GQUNJVMCDZZURW-UHFFFAOYSA-N 429.630 4.364 10 10 IICE Cc1cc(O)nc(N2CCC(NC(=O)c3cc(C)n(-c4ccc(C(C)C)cc4)c3C)CC2)n1 1635637749 ZSBRPDFYXBGCMY-UHFFFAOYSA-N 447.583 4.420 10 10 IICE COc1cc(N2CCN(Cc3cc(Cl)ccc3OCC3CC3)CC2)cc(OC)c1OC 1642657384 OIWGETYDCSWMMO-UHFFFAOYSA-N 446.975 4.477 10 10 IICE CON(C[C@@H]1CCC[C@@H](C)C1)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1643308421 KGZILGHARFIPHL-KZNAEPCWSA-N 434.536 4.479 10 10 IICE CS[C@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1712774420 FEVJFMFWOIEWQW-IBGZPJMESA-N 447.624 4.147 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)CCC(F)(F)F)cc1 1728384094 XTMIRULMEAPZLA-GOSISDBHSA-N 425.499 4.413 10 10 IICE CCOC(=O)N[C@@H](CC(C)C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O 1728704542 DIFOTZHZMRMWAX-IBGZPJMESA-N 445.608 4.370 10 10 IICE CC[C@H](C)CN(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1761968536 BLANLLRJBZZZNH-FQEVSTJZSA-N 427.637 4.216 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCc3ccc(F)cc3)C(=O)N(C3CC3)C2=O)cc1 1873162452 WBCYZKMRWHFPEH-UHFFFAOYSA-N 443.522 4.308 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)[C@@H](N)c1ccc2c(c1)CCN2C 1999536024 DYEJLPLEZLFGKA-RTFZILSDSA-N 425.573 4.177 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C(F)F)c(N)c2I)cc1C 2079849460 XMTOUMCCMMGNJH-CQSZACIVSA-N 433.240 4.329 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@@H]1NC(=O)c1ccc(Br)cc1I 2225793214 UIXRDEUJRPEICS-WDEREUQCSA-N 435.063 4.015 10 10 IICE COc1ccc(Br)c(CNC2(C)CCN(C(=O)OC(C)(C)C)CC2)c1O 2227748315 MUNALKXHSRVJNW-UHFFFAOYSA-N 429.355 4.043 10 10 IICE CCCCCCN1C(=O)C(=Cc2c(N3CCCC3)nc3ccccn3c2=O)SC1=S 2296724862 QHKGVZPVRGUVQZ-UHFFFAOYSA-N 442.610 4.076 10 10 IICE O=C1NC(=S)N(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1ccc(N2CCCC2)cc1 2297340196 VDOUDBQCXNTQDF-UHFFFAOYSA-N 446.359 4.425 10 10 IICE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=Cc1ccc(OCc2ccccc2F)cc1 2297341377 RDNINCYCUDEZSY-UHFFFAOYSA-N 434.398 4.210 10 10 IICE CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352635250 CYFMREYRNBYBFG-AWEZNQCLSA-N 429.355 4.163 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]3CC[C@@H]23)c(O)c1Br 2352675941 LDKJXXRSNRLQQI-ARFHVFGLSA-N 425.367 4.341 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381126208 OZLIMUURGKRCDK-JLTOFOAXSA-N 441.366 4.163 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381134723 HBMSECCTHUAQIU-ZFWWWQNUSA-N 441.366 4.115 10 10 IICE C/C=C/C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135958 YOEYHQXPUUPJRC-MVGZEHJDSA-N 441.366 4.281 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc(Br)ccc1O)N2 14461311 AICSEQBLSFOIPN-CKJXQJPGSA-N 443.341 4.357 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccccc3OC)SC2=S)cc1 15039777 PJSCMAGIEQZQQK-RGEXLXHISA-N 442.562 4.324 10 10 IICE COc1cccc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3Cl)C2=O)c1OC 33527144 XPVOFAOSVHCNEU-YBEGLDIGSA-N 448.953 4.212 10 10 IICE CCOC(=O)c1[nH]c2ccccc2c1/C=C1\C(=O)N(c2ccccc2OCC)C(=O)N=C1O 34221979 SWCWANQNOVDFKK-SSZFMOIBSA-N 447.447 4.250 10 10 IICE CC[C@]1(c2ccc(NC(=O)c3cc(C)n(-c4ccccc4)c3C)cc2)CCC(=O)NC1=O 72023172 JHQYNOIZVVZCSO-AREMUKBSSA-N 429.520 4.431 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@@H]3C=CC[C@@H]32)ccc1O 226656786 VYITUVMZDWJWNS-IMWIBFENSA-N 440.565 4.402 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3cccc(C(=O)N(C)C)c3)no2)C1 582870813 PXGJOOBFYQUULD-UHFFFAOYSA-N 443.551 4.208 10 10 IICE CCC(=O)c1ccc(OCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742799874 DSVYICZOTNEFNO-KRWDZBQOSA-N 432.467 4.045 10 10 IICE C[C@@H](Cc1ccc(Br)cc1)N1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 761123754 VMCNXCVFIXKRQK-LBPRGKRZSA-N 437.721 4.204 10 10 IICE C[C@H]1C(=O)N([C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C(=O)N1Cc1ccccc1 761637835 VQPRCPUNFINVIH-LPHOPBHVSA-N 429.467 4.110 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC4)cs2)c(OC)c1 777666412 YFIFOLIBQGMSBH-UHFFFAOYSA-N 446.550 4.125 10 10 IICE COc1cc(Br)ccc1/C=C1\SC(=S)N(CCCCCC(=O)O)C1=O 781550607 CZMMSDDOQQRFPS-ZROIWOOFSA-N 444.372 4.304 10 10 IICE C[C@H](NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1)c1ccc(N(C)C)cc1 791722125 WZGTYVUUTVEAQI-KKSFZXQISA-N 429.536 4.377 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc4c(c3)CCC4)C2=O)cc2c1OCCO2 920471431 AVCYFLICZSGEKT-YBFXNURJSA-N 425.531 4.361 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(OC)c(I)c2)cc1 1125167386 XBFXMXVFGIJJGC-UHFFFAOYSA-N 438.309 4.076 10 10 IICE COc1ccc(NC(=O)[C@H]2CSCN2C(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1125861501 LZWUEJWWLMHEDM-HSZRJFAPSA-N 449.576 4.185 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccn1Cc1cccs1 1137438926 YSSBEGDTMJNYHH-GOSISDBHSA-N 429.973 4.351 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(F)c(Br)cc3F)CC2)cc1 1151503364 RBJRACRFBWSFHH-UHFFFAOYSA-N 425.273 4.088 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(C(=O)OC(C)(C)C)n[nH]3)cc2Cl)C1 1155727921 XITBNPXHWVRCDX-CQSZACIVSA-N 432.952 4.185 10 10 IICE Cc1ccc(N(Cc2cnn(C)c2)C(=O)/C=C\[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1177596126 LBRBESTXWBBZII-KTZABMDBSA-N 438.572 4.465 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)COc3ccc(OCc4ccccc4)cc3)C2)cc1 1276832440 UTHISIBUYWPHOE-JOCHJYFZSA-N 446.547 4.296 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCCN1Cc1ccc(F)cc1 1294684348 GXXYRESZQPPFQC-IBGZPJMESA-N 435.337 4.307 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCC[C@H](NC(=O)OC(C)(C)C)C3)ccc21 1296625792 SYSZWAGROOKRDX-UXHICEINSA-N 443.588 4.470 10 10 IICE CN(Cc1ccccc1O)c1nnc(CNC(=O)c2cccs2)n1CC1CC(C)(C)C1 1298365154 QSDPSNWIEMGOON-UHFFFAOYSA-N 439.585 4.048 10 10 IICE Cc1cc(CC(=O)N[C@@H](c2ccccc2)C2(CO)CCOCC2)c(C)n1-c1ccccc1 1299970918 GOYVMYLZMFQRRD-SANMLTNESA-N 432.564 4.283 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@](C)(CO)Cc2ccc(Br)cc2)c1O 1308117136 HPSSGXRCSVQNOU-IBGZPJMESA-N 426.738 4.094 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CC[C@H](C)C2 1349304981 OMKJDVKMQUDZGS-LSDHHAIUSA-N 432.586 4.169 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(Oc4cccc(OC)c4)cn3)CC2)cc1 1355031265 MLAOWAWDDAYXDZ-UHFFFAOYSA-N 433.508 4.244 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2cc(Cl)cc3c2OCC3)cc1 1442621498 ZNCDEDQJTRIYRQ-JOCHJYFZSA-N 428.960 4.091 10 10 IICE CCC(C)(C)OCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1451012639 YEFTUJYZSCNFAD-SQFISAMPSA-N 426.629 4.051 10 10 IICE CCCN(C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)[C@@H](C)C(=O)OCC 1467578091 KPMSEKMVHYDKMS-HNNXBMFYSA-N 436.350 4.055 10 10 IICE Cc1ccc(C(=O)NCCc2ccccc2N2CCOCC2)cc1-n1c(C)cc(C=O)c1C 1468195760 MXNUXEUUCWLURV-UHFFFAOYSA-N 445.563 4.024 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H](CCc2ccccc2)c2ccccn2)N(C)C)cc1 1471081678 FZBQBIYLJOTFCM-UIOOFZCWSA-N 445.611 4.424 10 10 IICE C[C@H]1N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCOC1(C)C 1512569213 HMSXFYPZCFJQQH-GOSISDBHSA-N 443.661 4.181 10 10 IICE CCN1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C[C@@H]1C 1515912438 HNPCLUDNMCGURY-KRWDZBQOSA-N 428.631 4.114 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)OC(C)(C)C1 1516727719 OFEBGNOKTAHNQA-LJQANCHMSA-N 437.588 4.393 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 1526967565 HNRQYRIPEIIUIO-OAHLLOKOSA-N 431.920 4.236 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(OCC(F)F)n2)C1 1527648502 FJKXCAWETQYDOG-UHFFFAOYSA-N 428.483 4.085 10 10 IICE Cc1cc(CC(=O)NCCc2ccc(OCCN3CCCC3)cc2)c(C)n1-c1ccccc1 1535232347 DVXGQVBTPJHQDA-UHFFFAOYSA-N 445.607 4.470 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[C@@H]1c1ccc(OC)cc1 1538976882 TXBLFNMIXOMPGX-DPQOWFAMSA-N 437.584 4.328 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cccc(Cl)n1 1539361064 NGNODVCCRCXMME-UHFFFAOYSA-N 428.677 4.460 10 10 IICE Cc1ccc(C(=O)NC[C@H](O)c2c(F)cccc2Cl)cc1-n1c(C)cc(C=O)c1C 1545526633 LIFGLRLSBQUMAJ-NRFANRHFSA-N 428.891 4.471 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccsc4)C3=O)c2C)c1 1559366919 QMRSIACITPEBLY-XMMPIXPASA-N 435.549 4.422 10 10 IICE CC(C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cccc(F)c1 1565738765 HRQRLKZMTVVWRW-UHFFFAOYSA-N 434.514 4.059 10 10 IICE Cc1cc(CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1565753742 CNQCZFVNLAJGTI-UHFFFAOYSA-N 431.964 4.416 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc2cc(Br)cnc2n1C 1585263476 DFMBMCXNKMCMHC-AWEZNQCLSA-N 429.362 4.071 10 10 IICE CCCCCn1nc(C)cc1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1587517394 PEKGIOKSQTXUPV-UHFFFAOYSA-N 448.570 4.202 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cc(C(F)(F)F)[nH]n1 1597034303 VGJNKFFMBNRLJG-JXMROGBWSA-N 446.501 4.110 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]3C)ccc21 1597789344 VAMHUDNNUOTQCW-OALUTQOASA-N 443.588 4.374 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCC[C@H]2CSC)cc1 1615380943 NLRSWWDMIYTOAY-CTNGQTDRSA-N 429.634 4.008 10 10 IICE CNC(=O)[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCCC1 1618533264 BHCAKORNEPLWLK-GOSISDBHSA-N 448.615 4.361 10 10 IICE CCOC(=O)[C@H](CC1(OC)CCC1)NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1628496703 MBGWFYHUOYSUCI-FQEVSTJZSA-N 432.948 4.368 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)Cc1ccccc1OC 1631147806 ATZWVQNVQWKJFA-NRFANRHFSA-N 434.536 4.173 10 10 IICE COc1ccc(F)c2[nH]c(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc12 1631425691 MKYCCFRISBVDPR-OAHLLOKOSA-N 431.895 4.069 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc4cccc(Cl)c4s3)cc2)CC1 1634075032 YZSJJLMRICUXSA-UHFFFAOYSA-N 427.957 4.153 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](C)[C@H](C)C(=O)Nc3ncccc3O)c2C)c1 1636133453 ZSZNMGRRWRUQDA-ROUUACIJSA-N 434.540 4.205 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(OCc4ccccc4)cc3)CC2)cc1F 1637325520 XBLLKVFOPKAKTN-UHFFFAOYSA-N 449.526 4.445 10 10 IICE Cc1cc(C)nc(Nc2ccc(Cl)c(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)c2)n1 1638348212 OQHUKYBLRNXDJO-CQSZACIVSA-N 426.904 4.263 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnc2scc(-c3ccccc3)n2c1=O 1639341565 VKSAXVUFDXZLIT-QGZVFWFLSA-N 446.576 4.158 10 10 IICE Cc1cc(C(=O)N[C@@H]2CN(CC(F)(F)F)C[C@H]2c2ccccc2)c(C)n1-c1ccccn1 1642589999 DDLIMWWEIXILAQ-LEWJYISDSA-N 442.485 4.249 10 10 IICE CCOC(=O)C[C@@H](c1ccccc1)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 1653695954 LZYTVULSHSKABQ-SANMLTNESA-N 436.596 4.472 10 10 IICE O[C@@H](c1ccc(Br)cc1)[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 1653761986 SDLWTFSDMQKGOM-OFNKIYASSA-N 445.401 4.231 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(Cl)cc1 1658008037 AYNDMPZLLVESNX-JKSBSHDWSA-N 447.982 4.450 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H]3c3ccc(OC)c(OC)c3)C2)cc1 1673822495 DYAUCKOHKXOETL-GCJKJVERSA-N 439.556 4.085 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1687056385 XNNVJVMACSTOOJ-FQEVSTJZSA-N 430.593 4.216 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@](C)(CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1708721029 BPFSAUNIUMYHPA-DEOSSOPVSA-N 444.599 4.076 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C(C)(C)C)C1 1712457647 GRNNJTBMUFUPPZ-QFIPXVFZSA-N 437.588 4.250 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@](C)(O)c2cc(C)oc2C)n1 1724477658 BVQQDKXMKNZFDR-RUZDIDTESA-N 447.539 4.108 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@@H]1OC 1764228105 HFVZHUQHYXKYMO-OFNKIYASSA-N 437.588 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@H]3[C@@H](COC)[C@@H]3C2)cc1 1764939769 XJKVRINPIYGFNM-YTFSRNRJSA-N 439.648 4.480 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC[C@@H]3CCCO3)C(=O)N(C3CCCCC3)C2=O)cc1 1873166369 NHPDDBKSDGORQK-QHCPKHFHSA-N 447.579 4.275 10 10 IICE C[C@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1cccc([N+](=O)[O-])c1O 1951727302 ZMKZSOLOWMFVQB-XMMPIXPASA-N 448.431 4.139 10 10 IICE CN[C@H](c1ccccc1O)[C@@]1(COCc2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1997460416 WSXCTXCXNNSMRE-RDGATRHJSA-N 426.557 4.497 10 10 IICE Cc1ccc(O)c([C@H](C)NC[C@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c1 2084723466 YPVVYFNTRFYGTN-UNMCSNQZSA-N 439.600 4.473 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](C2CC(NCc3cccc(Br)c3O)C2)C1 2265436236 JULUUZMPCFIOAU-FHERZECASA-N 425.367 4.280 10 10 IICE CCc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)c2C)cc1 2294133909 MFEOZOGZXOJMAA-UHFFFAOYSA-N 431.467 4.462 10 10 IICE CCOc1cccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)c1 2313560163 LNDDIMYHPGJGMC-UHFFFAOYSA-N 447.466 4.298 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381130887 GJARBRXKMMGLFG-WFASDCNBSA-N 441.366 4.067 10 10 IICE CC(C)C1=NN2C(=N)/C(=C\c3cccn3-c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)N=C2S1 32964384 GKYPNKLDWOHAGF-KBFOAYOGSA-N 442.888 4.314 10 10 IICE CCn1cc([C@@H]2CSCCN2C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cn1 683362592 VTFFQFSFUDHMBG-QFIPXVFZSA-N 426.586 4.051 10 10 IICE COc1ccc(N2CCN(Cc3nc(-c4ccc(C(F)(F)F)cc4)no3)CC2)cc1F 753857726 PNWQMGLOFHZTAY-UHFFFAOYSA-N 436.409 4.225 10 10 IICE CN1CC[C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 754842974 WNNHPHZPKIMWDU-FCHUYYIVSA-N 430.955 4.324 10 10 IICE CC1=C(c2ccco2)CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 800999378 XAFNEKHWHOMIEO-ROUUACIJSA-N 427.520 4.421 10 10 IICE O=C1CCN(Cc2cc(Br)cc(Br)c2O)c2ccccc2N1 811508265 JBOPJVHYOOSQSE-UHFFFAOYSA-N 426.108 4.266 10 10 IICE Cc1cc(CC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c(C)n1-c1ccc(Cl)cc1 1128515748 XRXXTFSIVFCSOE-SFHVURJKSA-N 429.992 4.002 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C\C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1142847577 TZSVKRUXHMQCHM-SZRHCGQDSA-N 427.589 4.496 10 10 IICE Cc1cc(C(C)(C)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1Br 1148700681 DQAJTNNSNSTSIZ-UHFFFAOYSA-N 445.401 4.313 10 10 IICE CC(C)(C)OC(=O)NCC1(CC(=O)NCc2ccc3cccnc3c2O)CCCCC1 1162612695 OLJDPRNPXOTLCI-UHFFFAOYSA-N 427.545 4.422 10 10 IICE CC(C)(C)c1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1286995883 RZUXVTYQTSHZBN-IBGZPJMESA-N 443.611 4.472 10 10 IICE CC(C)N(Cc1ccco1)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1287946188 BNYDCISYUNPISM-IBGZPJMESA-N 441.551 4.434 10 10 IICE Nc1ccc(Br)cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294158498 BNRBFHYVIANVIW-ZDUSSCGKSA-N 440.288 4.032 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCC[C@@H](C)CC2)cc1 1295411135 PWDCWTRXSBEQEY-HXUWFJFHSA-N 438.620 4.035 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)Cc2cc(C)on2)cc1 1295412634 CRDDJURHEBFAGS-UHFFFAOYSA-N 431.544 4.167 10 10 IICE Cc1nnc2n[nH]c(NC(=O)c3cc(C)n(-c4cccc(Br)c4)c3C)c2c1C 1297675140 ZENOCEGYESPOBK-UHFFFAOYSA-N 439.317 4.392 10 10 IICE Cc1cc(-c2nnc(N3CCNC(=O)CC3)n2CC(C)(C)C(C)C)c(C)n1-c1ccccc1 1304195464 DWRNYVCOTODZAW-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CC[C@](C)(O)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1305308429 XLXXEMNCDMVOSZ-DEOSSOPVSA-N 439.629 4.328 10 10 IICE CCOc1ccc([C@@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1312833755 NENDWGWHUCXASW-QFIPXVFZSA-N 445.510 4.247 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(CC2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1313776821 GSOSOFHADYINTK-HXUWFJFHSA-N 429.584 4.270 10 10 IICE CC(C)C1CCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1359743658 PHOYPIPBWASORK-UHFFFAOYSA-N 436.579 4.390 10 10 IICE COc1ccc(C)cc1N1C[C@@H](C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1438303258 OEWBPHJRNCKSQZ-NRFANRHFSA-N 431.536 4.080 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1449116506 FVZDMRMZZVEWKB-BFUOFWGJSA-N 442.339 4.021 10 10 IICE Oc1ccccc1CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)C[C@@H]1CCCO1 1459739255 IHJNTWHIRROLIW-OALUTQOASA-N 426.340 4.120 10 10 IICE CC[C@@H](CC(F)(F)F)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465325386 PWCOJWXLDHAGIQ-WMLDXEAASA-N 431.499 4.413 10 10 IICE Cc1cc(Cl)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1[N+](=O)[O-] 1465952241 YQFZJYBSEHNHEF-OAHLLOKOSA-N 438.311 4.310 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(NCc4nc(C)cs4)c3)C2)cc1 1469281259 CWPLVGBNXDLLKM-GOSISDBHSA-N 436.581 4.329 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H](C)c3ccc(Br)cc3)C2)cc1 1478861380 ZRYLMPUSCAEPFM-IAGOWNOFSA-N 446.389 4.387 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC2(CC1)CC2(F)F 1527730522 UDJWXPAZPQXBKF-SDNWHVSQSA-N 442.578 4.377 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1 1529278415 RHZCLTUPPHHMBG-MRXNPFEDSA-N 426.948 4.444 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(C(=O)Nc4ccccc4)cc3)C2)cc1 1529705942 CZDWJSCCJJXCNQ-LJQANCHMSA-N 429.520 4.204 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)c2ccc(Br)nc2)CCCC1 1531480391 DNHNZKWUKVNHBR-UHFFFAOYSA-N 428.330 4.349 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(c3ncccc3[N+](=O)[O-])CC2)c1 1535166879 VZNQGWYXBATMML-UHFFFAOYSA-N 439.903 4.013 10 10 IICE CC(C)c1nc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)co1 1535382445 MLICXSVEVIBYFG-CXUHLZMHSA-N 434.514 4.272 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCCN(c4ccccc4F)C3=O)c2C)cc1 1545799776 SBALJCXARJDIPR-QFIPXVFZSA-N 435.499 4.167 10 10 IICE Clc1ccccc1-c1nnc(N2CCCOCC2)n1CCCSc1nccs1 1555964729 IIWJCMDUDOGPJC-UHFFFAOYSA-N 436.006 4.464 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)CCCC1 1557536776 CGHXHLXTJNKZJR-MJGOQNOKSA-N 440.584 4.355 10 10 IICE Cc1cc(C(=O)NC[C@H](O)C(=O)OCc2ccccc2)c(C)n1-c1ccc(C(C)C)cc1 1558094094 YJVWSBCOWLENNH-DEOSSOPVSA-N 434.536 4.052 10 10 IICE CC[C@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1cccc2ccccc12 1560151049 ULPBRLIRPULJQY-KCWPFWIISA-N 433.596 4.072 10 10 IICE C[C@@H]1CN(CCOc2ccc(CCNC(=O)NCc3cc(Cl)ccc3O)cc2)C[C@H]1C 1564464803 VBYFKYGHDWYAPF-QZTJIDSGSA-N 445.991 4.054 10 10 IICE Cc1cc(N2CCC[C@H](NC(=O)N[C@@H](C)c3ccccc3O)C2=O)ccc1Br 1564515319 FEXYMAFLOXVWTA-KSSFIOAISA-N 446.345 4.019 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2N(C(=O)OC(C)(C)C)CC23CCCC3)cc1F 1565688126 KPPXTKPKBKVISZ-HXUWFJFHSA-N 433.568 4.468 10 10 IICE C/C=C\c1ccc(OCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1566356486 GSRDFMPFFMVKCD-BOYDRYHPSA-N 444.959 4.247 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H]1CCCCN1C(=O)OC(C)(C)C 1583853546 QFPHGGQNQVUDSU-HXUWFJFHSA-N 439.556 4.426 10 10 IICE CC[C@H](C)CN(CC)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1613397801 YZQSLXRATLQDMN-IBGZPJMESA-N 431.600 4.373 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1)OC 1613614546 VUFWHMYHEJQEQM-QFIPXVFZSA-N 447.587 4.148 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1616035627 JCMOUNULGYKPJF-UHFFFAOYSA-N 437.588 4.394 10 10 IICE Clc1cc(Br)cc2c1OCCN(Cc1ccc(N3CCOCC3)cc1)C2 1620649915 HLDGZMKQBAOYPG-UHFFFAOYSA-N 437.765 4.334 10 10 IICE CCCOc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(OC(C)C)c1 1622564071 OOQQMZCWTOGEEF-UHFFFAOYSA-N 430.520 4.373 10 10 IICE O=C(c1cnnn1-c1cccc(Cl)c1Cl)N(Cc1ccccc1O)C[C@@H]1CCCO1 1623640999 QRIRMYUJMLOVQM-HNNXBMFYSA-N 447.322 4.101 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCCCN1Cc1ccc(F)cc1 1624893163 UEWWHAZSUUGYSQ-QHCPKHFHSA-N 427.589 4.050 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cccc(O)c1 1626397913 QGEKGVWHECIBMG-FHNWIRHTSA-N 430.526 4.000 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 1626722727 HANTVLLNGDRIEY-CQSZACIVSA-N 442.357 4.026 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c(C)n1-c1ccc(Br)cc1 1631252491 NCIJTUAULGLMRJ-LAUBAEHRSA-N 430.390 4.413 10 10 IICE Cc1[nH]nc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1Br 1635126787 OFHPTVNLYJRBAC-LLVKDONJSA-N 425.758 4.300 10 10 IICE C[C@H](NC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1)c1ccccc1O 1635798798 BWLVZPJENXZNGX-INIZCTEOSA-N 431.521 4.004 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc2nc(C)c(C)nc2c1 1639827306 ONVUQWSEIIWJEJ-UHFFFAOYSA-N 434.540 4.249 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3cc(Br)ccc3[nH]2)N(C)C)cc1 1648478234 WJYLPPIIPHWESS-FQEVSTJZSA-N 429.362 4.029 10 10 IICE NC(=O)c1ccc(CN(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1 1652703079 KHQDLQHSBIYRIZ-DAXSKMNVSA-N 445.475 4.185 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)N3CCC[C@@H](C)C3)cc2Cl)C1 1681827276 DVZFCKADIDTIGP-ZWKOTPCHSA-N 435.012 4.024 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCCNC(=O)c3cccs3)cc2Cl)C1 1682023628 HTSYKTDSABYUGV-INIZCTEOSA-N 449.020 4.257 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2(C)C)cc1 1683446438 FKHFPJFZBKDVMB-JRGCBEDISA-N 447.620 4.165 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](N3CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694100706 ZVYQHEVIIVLLIA-ICSRJNTNSA-N 428.600 4.110 10 10 IICE CCC(C)(C)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1726789540 AWXPQKAORDIWJO-UHFFFAOYSA-N 434.588 4.249 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccoc3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1742565325 HAGUTZOBCDMCTG-UHFFFAOYSA-N 440.548 4.117 10 10 IICE CC(C)(C)c1nnc(N2CC[C@@H](N3CCCCC3)C2)n1CCCSc1nccs1 1750144458 UZBBIQIRRXNWOQ-QGZVFWFLSA-N 434.679 4.279 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCCN(C(C)(C)C)CC2)nnc1C(C)(C)C 1751433145 UCOSNQDBKTYLON-UHFFFAOYSA-N 426.653 4.309 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc(O)cc3)C2=O)cc(Br)c1O 1860075699 QMWPXGGCIHWZDR-RIYZIHGNSA-N 438.324 4.275 10 10 IICE CCCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1Cc1ccccc1 1862313275 QOOOWCNCTTUXQW-UHFFFAOYSA-N 432.568 4.245 10 10 IICE CN(C)c1ccc([C@H](NC(=O)[C@@H]2CCCN2c2ccc(Cl)cc2)c2nccn2C)cc1 1866145326 KNQAFPBYEQJGRL-VXKWHMMOSA-N 437.975 4.014 10 10 IICE Cc1cc2oc(=O)c(C(=O)N[C@@H](c3ccc(N(C)C)cc3)c3nccn3C)c(C)c2cc1C 1866296150 DJXYCIZSKIESGU-QHCPKHFHSA-N 444.535 4.037 10 10 IICE CC1(c2nn(Cc3cc(F)ccc3O)c(I)c2C2(C)CC2)CC1 2079763026 BEVRTNDVAKPXSY-UHFFFAOYSA-N 426.273 4.484 10 10 IICE CC(C)(C)OC(=O)N1CCCC2(CC(NCc3cccc(Br)c3O)C2)C1 2103377486 JVQWHFNSHDLSDI-UHFFFAOYSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CNC[C@@]2(C)CCCN2C(=O)OC(C)(C)C)c1O 2227750191 XMKHKGYEIGUCNM-LJQANCHMSA-N 429.355 4.043 10 10 IICE COc1ccc(Br)c(CNC2CCC(N(C)C(=O)OC(C)(C)C)CC2)c1O 2236053801 AANHBQVAHQOJKD-UHFFFAOYSA-N 443.382 4.431 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@@H]1[C@@H](NCc1c(O)cccc1Br)C2 2333989297 SWAPBEOEILJYBN-UWWPHRKUSA-N 425.367 4.326 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380736875 HQGMCDBBXJXYNV-CQSZACIVSA-N 441.366 4.117 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)sc2c1CC[C@@H](C(C)(C)C)C2 109403450 RVRYBDABOXUCNR-HNKZQRQQSA-N 431.554 4.147 10 10 IICE CCN1C(=O)/C(=C/c2c(Oc3ccc(F)cc3)nc3c(C)cccn3c2=O)SC1=S 213185666 JTCXNXSJFGJORE-WJDWOHSUSA-N 441.509 4.155 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccccc3F)[C@@H]2c2ccc(O)c(O)c2)c1OC 526203087 JCCYOGXYRLEATN-OAQYLSRUSA-N 437.423 4.311 10 10 IICE O=[N+]([O-])c1cc(I)ccc1NCc1c(O)cccc1Br 706808666 XEFGZEIVXAHBPQ-UHFFFAOYSA-N 449.042 4.280 10 10 IICE O=C1Cc2cc(N[C@@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)ccc2N1 733797727 FNUFRSWKWLAQTB-OAQYLSRUSA-N 425.448 4.341 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1 743808433 UGFSAUXQQNJUPR-SCLBCKFNSA-N 431.330 4.412 10 10 IICE O=C(NCc1ccc2ccccc2n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745825622 QVYCKRJLHDHFHA-GOSISDBHSA-N 426.467 4.304 10 10 IICE COc1cccc(CNC(=O)C(C)(C)[C@H](O)c2ccc(OCc3ccccc3)cc2)c1O 778915331 RRXWSWVRWXDWHT-XMMPIXPASA-N 435.520 4.356 10 10 IICE Cc1cc(Br)c(O)c(CN(C)CC(=O)Nc2ccccc2Br)c1 781894710 MBAWPZFUKCKKRI-UHFFFAOYSA-N 442.151 4.296 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)c(O)c1 794379884 UJGSULVGOPHTLO-NQERJWCQSA-N 442.943 4.144 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1nccnc1-c1nc2ccccc2s1 804737853 RGLQPQBMBUYZEQ-UHFFFAOYSA-N 441.310 4.151 10 10 IICE Cc1cc(CC(=O)N2CCCNC(=O)[C@H]2Cc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1129295679 UAXCLJFKCSREPA-XMMPIXPASA-N 449.982 4.250 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(NC(=O)C3CCCCC3)c2)N(C)C)cc1 1134882804 UZBVUXSRSLTJEV-DEOSSOPVSA-N 436.600 4.304 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1C[C@@]1(C)c1cccc(Br)c1 1135732774 GEMGTHBBCJUKJN-GMAHTHKFSA-N 443.385 4.222 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nc4c(C)ccnc4[nH]3)c2C)cc1 1166086485 TYKZEYCFPURQQL-UHFFFAOYSA-N 434.521 4.435 10 10 IICE CCOCN(C(=O)CN1CCN(c2ccc(OCC)cc2)CC1)c1c(C)cccc1CC 1168331258 BFPJGARBZLCWLU-UHFFFAOYSA-N 439.600 4.105 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2CCCS(=O)(=O)c1ccc(NC(C)=O)cc1 1195324837 SGDNNOUPUGVJSH-FQEVSTJZSA-N 444.597 4.152 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)N(C)C)cc1 1256237204 UGHCAIXQZRBYKG-HXUWFJFHSA-N 434.506 4.363 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2ccnc(-n3cncn3)c2)cc1 1287736932 UAGSNHYOWMRIEU-UHFFFAOYSA-N 426.484 4.074 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccn(CCc3ccccc3)n2)cc1 1292382155 OAFVZBNWRLZEBO-DEOSSOPVSA-N 432.568 4.013 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@@H](C1CCCCC1)N(C)C 1298363597 HNONFRLYUYIPDS-GMAHTHKFSA-N 441.620 4.372 10 10 IICE COCCC(C)(C)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1301433367 XPFAWMDOYKVXHW-UHFFFAOYSA-N 443.636 4.364 10 10 IICE CCN(CC)CC[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1 1313416037 PYRBQSRGYFOUHX-VWLOTQADSA-N 438.616 4.138 10 10 IICE COCc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1352919959 ZLKPLTDEKLXNEN-PDGQHHTCSA-N 430.526 4.202 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(I)ccc2O)cc1 1440671856 FMUURJYTARDWHP-UHFFFAOYSA-N 438.309 4.115 10 10 IICE Cc1ccc(C(=O)NCCOc2ccc(C(F)(F)F)cn2)cc1-n1c(C)cc(C=O)c1C 1446045646 XHGVQNINNJFHIZ-UHFFFAOYSA-N 445.441 4.438 10 10 IICE Cc1cc(CC(=O)Oc2ccc(Cl)cc2S(=O)(=O)N(C)C)c(C)n1-c1ccccc1 1459830781 ZGMOIZHNLUEYGK-UHFFFAOYSA-N 446.956 4.146 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1463784988 KZISPOFPRXMPHE-GOSISDBHSA-N 443.950 4.481 10 10 IICE Cc1cc(C(=O)NC[C@H]2CSCCS2)c(C)n1-c1ccccc1Br 1465650595 OPYJCNDMYQAKTQ-AWEZNQCLSA-N 425.417 4.435 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1 1467496818 AYPXRSBTTRCJKV-UHFFFAOYSA-N 430.570 4.056 10 10 IICE CCOc1ccc(N2CCN(Cc3cn(-c4ccc(Cl)c(Cl)c4)nn3)CC2)cc1 1473296477 OYGCDFQEQJGTLE-UHFFFAOYSA-N 432.355 4.295 10 10 IICE Cc1ccc(NC(=O)CN(C)C(=O)CN(C)c2ccc(OCc3ccccc3)cc2)cc1 1473389908 VLMPMHWHHITCCI-UHFFFAOYSA-N 431.536 4.107 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C[C@@H](C)S1 1494328118 LOCWJDHGZFCYDV-OAGGEKHMSA-N 439.676 4.489 10 10 IICE Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 1517372804 MIWNZLKOANRWOE-KRWDZBQOSA-N 426.520 4.251 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C(N)=O)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1542184068 OPXGVXIICFBBRT-FQEVSTJZSA-N 434.588 4.100 10 10 IICE CN(c1ccc(CNC(=O)C[C@H]2COCCN2C(=O)OC(C)(C)C)cc1)C1CCCCC1 1542411917 FFIDHEKOOUWVDB-QFIPXVFZSA-N 445.604 4.098 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)cc21 1542490411 MKORKGOGZNWKJD-OAQYLSRUSA-N 436.556 4.210 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)CCCC1 1557536777 CGHXHLXTJNKZJR-PKOBYXMFSA-N 440.584 4.355 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2NC(=O)c2cccs2)N(C)C)cc1 1558723242 KVGDSIHRRLKZPZ-NRFANRHFSA-N 436.581 4.099 10 10 IICE CCOC(=O)c1cnc(C)c(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 1585492820 NSNPKIHZADGWBB-UHFFFAOYSA-N 447.535 4.488 10 10 IICE COc1ccc(OC)c(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 1597560248 CEHAVPJDVBJKJO-UHFFFAOYSA-N 445.563 4.321 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@@H](F)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1611936035 MUJQDAACOBOJRX-IERDGZPVSA-N 425.552 4.308 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCC(C)(C)NC(=O)OC(C)(C)C)cc1 1626107535 YNWFDKAKTPLCHM-NRFANRHFSA-N 447.620 4.344 10 10 IICE CC(C)(C)OC(=O)CC[C@H]1C[C@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)CO1 1629944020 ZCXBYKFFSSHHNV-OALUTQOASA-N 429.513 4.041 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NC(=O)c1ccc(C)cc1)C(C)C 1629968255 COMFKHYDFXMBGV-FQEVSTJZSA-N 447.373 4.266 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CN(C(=O)OC(C)(C)C)C(C)C 1631167610 VJBFWUHWQYJOKV-UHFFFAOYSA-N 429.355 4.149 10 10 IICE CCO/C=C/[C@@](O)(CNC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1637578318 UUMYGPBSBZAWST-LCCNJJIFSA-N 439.478 4.045 10 10 IICE CNC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2C)c1C)Cc1ccc(F)cc1C 1638952249 JTCDENXJVCLYGU-OAQYLSRUSA-N 435.543 4.185 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@H](c2cccnc2)C1 1639866343 QAFBTWLKCGXUIW-IQFISFIMSA-N 443.619 4.141 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](c2cnn(C)c2)C2(CO)CCC2)c1 1641310120 CAXGYLUMEHRRTK-NRFANRHFSA-N 426.948 4.115 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC3(CCN(Cc4ccccc4)C3)CC2)c([N+](=O)[O-])c1 1642530612 FGRHPDRUTSNICJ-CSKARUKUSA-N 435.524 4.274 10 10 IICE CCC1(NC(=O)OC(C)(C)C)CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1 1643120918 DQIVNQCZSDWCTL-CSKARUKUSA-N 433.505 4.055 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@@H](C)N(CC(=O)Nc1ccc(N=Nc3ccccc3)cc1)C2 1648364172 SGFHDPQBBCRFNF-QGZVFWFLSA-N 446.511 4.318 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N(CCc3ccccc3)C3CCCC3)cc2)CC1 1684168666 DPYCAVMDZLUURB-UHFFFAOYSA-N 448.611 4.085 10 10 IICE Cc1ccccc1C[C@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1686268229 ADXGGEDPGDNZSR-LAUBAEHRSA-N 429.992 4.288 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCCCCN(Cc4ccccc4)C3)C2)cc1 1687025575 RYZRILCRKBKCPP-GOTSBHOMSA-N 436.600 4.018 10 10 IICE O=C(NCc1cc(C(F)(F)F)cc(Cl)n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1687505006 WONISJRIECNFPR-INIZCTEOSA-N 443.853 4.350 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](C)N(CC)CC 1726982569 BGIMTTNFWSNRAU-SFTDATJTSA-N 442.652 4.247 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@H]1CCCCO1 1743563797 MSRVFRZGOVHDHR-NZQKXSOJSA-N 441.620 4.224 10 10 IICE CCCCN(C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1745408238 FKWYHXYBMYSBFT-UHFFFAOYSA-N 437.588 4.340 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)cc1 1746086213 JIUBATAFCAXPAG-VQIMIIECSA-N 439.526 4.452 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1CCOC(C)(C)C 1747721086 SOFKTGVWYDFXLD-UHFFFAOYSA-N 443.636 4.155 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1749981395 GWEWDUCSLSSHPN-KNQAVFIVSA-N 429.609 4.050 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](CCOC)C1 1771046717 JTCXHIFGVNWNDR-NRFANRHFSA-N 437.588 4.252 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(CCOc3ccc(OC)cc3)C2=O)c1O 1858586553 BEVGKNDVMRQJFS-QGOAFFKASA-N 431.535 4.080 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C(F)(F)F)c(CN)c2Br)c(O)c1 2079864887 YOYGRSMMOYVBPF-CQSZACIVSA-N 434.256 4.227 10 10 IICE Cc1cc(O)c([C@@H](C2CCC2)n2nc(C)c(CO)c2I)cc1C 2079939399 NPROQRRHQRVGNJ-QGZVFWFLSA-N 426.298 4.000 10 10 IICE C[C@@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccc(F)cc1O 2084723940 CEEYLFWRDCOPOF-NQIIRXRSSA-N 443.563 4.303 10 10 IICE Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCCOc4ccccc4)cc3)C2=O)c1 2293618993 RWAZGHVBGBKHKT-UHFFFAOYSA-N 442.471 4.119 10 10 IICE CC1=CC2=NC(=O)C(=Cc3ccc(OC(=O)c4ccccc4F)c(Cl)c3)C(=N)N2O1 2297347536 FNNHDCALAQPBCL-UHFFFAOYSA-N 425.803 4.149 10 10 IICE CCN(CC)c1ccc(C=C2N=C(c3ccc(I)cc3)OC2=O)cc1 2297532005 DBBGTBBVXSHYJG-UHFFFAOYSA-N 446.288 4.482 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(c2cccc(OC)c2)C1=O)C(=O)O 2314933304 VBKVCTPLZQWLDU-INIZCTEOSA-N 429.519 4.343 10 10 IICE O=C(O)[C@H](Cc1ccccc1)N1C(=O)C(=Cc2ccccc2Br)SC1=S 2323866150 WFKCIIITTKPPTO-HNNXBMFYSA-N 448.363 4.346 10 10 IICE C[C@H]1CCc2c(sc(NC(=O)c3ccc(C(=O)C(=O)c4ccccc4)cc3)c2C(N)=O)C1 1940146 IDRHGVPRECCIKI-AWEZNQCLSA-N 446.528 4.290 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3cccs3)SC2=S)cc1 15047093 LQBDVQWVNUUXLE-COOUDCDJSA-N 446.575 4.153 10 10 IICE c1ccc2c(-c3nc(C4CC4)no3)nnc(NCc3ccc(N4CCOCC4)cc3)c2c1 65258308 ISPBNWJLVIBRRW-UHFFFAOYSA-N 428.496 4.006 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)cc1 208700893 QJIYHOPZJTVXCL-MSUUIHNZSA-N 435.549 4.095 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2CNCc1c(O)cccc1Br 706881406 RSUYRRRJYPLZBM-AWEZNQCLSA-N 425.367 4.282 10 10 IICE CCN(C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@@H](C)Cc1ccc(OC)cc1 731403564 OVMVSRFKSJXVSW-PMACEKPBSA-N 425.573 4.256 10 10 IICE Cc1ccc([C@H](C)CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 738460405 PJPSHCRLOYGDHU-QGZVFWFLSA-N 435.490 4.453 10 10 IICE CCCN(CCc1ccccn1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903403 FSAVUEDDSISTML-LJQANCHMSA-N 432.515 4.316 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 763774205 UHHKZJYAKKMEHS-CTNGQTDRSA-N 428.916 4.305 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(Cc2ccccc2)[nH]n1 786048972 HUOCAKWRJQJHOH-UHFFFAOYSA-N 426.467 4.001 10 10 IICE C[C@@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3cccc([N+](=O)[O-])c3)cc2Cl)C1 800148489 MKMKAMKTRSMGFG-OAHLLOKOSA-N 437.949 4.104 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(Cn2ccc(C(F)(F)F)n2)cc1 1126442924 TXKZFJBECPJVMP-UHFFFAOYSA-N 430.430 4.055 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC=CC1 1126658271 RBSBOWDNGOKLGZ-INIZCTEOSA-N 436.499 4.051 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(C2CCOCC2)cc1 1137438680 QZILOTOAOLTHRU-JOCHJYFZSA-N 428.960 4.334 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cccc(Nc3nccc(C(F)(F)F)n3)c2)c1 1137473309 FPSBEYLVTWGUKI-GFCCVEGCSA-N 432.402 4.444 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCC2(C(=O)OC(C)(C)C)CCOCC2)c1C 1143043570 JLVVDTQSFBGDLG-UHFFFAOYSA-N 426.557 4.271 10 10 IICE COc1ccc(Br)cc1C1(C(=O)NCCCSc2nccs2)CC1 1144322168 KAVKOMNJNYFXID-UHFFFAOYSA-N 427.389 4.244 10 10 IICE C[C@H](NC(=O)CSc1nnc(-c2ccco2)n1Cc1ccccc1)c1ccccc1O 1151892075 HTRHFILYFALRSN-INIZCTEOSA-N 434.521 4.262 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)CCC4CCCCC4)CC3)cc2)CC1 1190457227 JLSPWGMKHXYZFR-UHFFFAOYSA-N 427.633 4.307 10 10 IICE C[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1229369937 CRRAIOQMVLEPHG-QUCCMNQESA-N 449.592 4.166 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCC4(CCOCC4)O3)cc2Cl)C1 1235832791 GWWQRMVJFAHJAN-MJGOQNOKSA-N 435.996 4.104 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC(OCc3cccc4ccccc34)C2)N(C)C)cc1 1256236717 KLPJNMWERREETO-SANMLTNESA-N 446.595 4.119 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ncsc3-c3ccccc3)cc2F)C[C@@H](C)O1 1264688934 DFAVXJYHPOJQFC-IYBDPMFKSA-N 425.529 4.493 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)C1(c2cccc(OC(F)(F)F)c2)CC1 1291629831 VFIALNZQZAKDMA-UHFFFAOYSA-N 436.499 4.486 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CC[C@H](Oc3ccccn3)C2)cc1 1295411621 VXGPRRMFVCJYSB-QFIPXVFZSA-N 434.588 4.349 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@H]2O)c(C)n1-c1cccc(Br)c1 1298767514 QGKPOEHTEDWWBS-PZJWPPBQSA-N 441.325 4.081 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2NC(=O)CO3)c(C)n1-c1ccccc1Br 1302904751 PUZZIIVWEUUSFN-UHFFFAOYSA-N 440.297 4.440 10 10 IICE Cc1nnc(N(C)[C@H](C)c2ccc([S@](C)=O)cc2)n1CCCSc1nccs1 1304786174 BNVMVLFOBWLNEJ-SUMNFNSASA-N 435.644 4.160 10 10 IICE Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1313304108 CPOAJKFCBLECFW-CPJSRVTESA-N 448.611 4.380 10 10 IICE COC1CCN(C(C)(C)Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)CC1 1315702206 ADRPGRIJLDHDIW-UHFFFAOYSA-N 443.636 4.098 10 10 IICE CC(C)(C)OC(=O)CC1(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CCC1 1352891740 JURWYNHAAOJYGW-UHFFFAOYSA-N 438.515 4.275 10 10 IICE CC(=O)N[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)c1cccc(Br)c1 1353437323 USSFZZMDOBDTAP-NRFANRHFSA-N 446.389 4.130 10 10 IICE C[C@H](Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)N(C)C(=O)OC(C)(C)C 1360571257 SREKDXGVCBEAII-QGZVFWFLSA-N 445.608 4.464 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2OCC[C@H]3O)c(C)n1-c1ccc(Br)cn1 1447445592 AIFPGLJERFFATC-GOSISDBHSA-N 442.313 4.320 10 10 IICE COc1cc2c(c(OC)c1OC)CCN(C(=O)c1ccc(-n3c(C)ccc3C)cc1)CC2 1457765786 QWLLXPOSICEIKV-UHFFFAOYSA-N 434.536 4.361 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)N(C)CC3)c(C)n1-c1ccc(Br)cn1 1466421584 MPUKEKVGHVCIFX-UHFFFAOYSA-N 425.330 4.496 10 10 IICE O=C(N[C@@H]1CCN(c2ccc(Cl)cc2F)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 1471005154 QYGYFZYWJHSHLJ-RTBURBONSA-N 447.938 4.154 10 10 IICE CCCN(c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1472689011 SOKYFFRVDVATAV-SYJIQKIWSA-N 433.505 4.007 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@H](O)COc3c(C)cccc3C)c2C)c1 1479099292 DRTKRCZLRDVXMX-XMMPIXPASA-N 435.568 4.259 10 10 IICE CC(C)CN(c1nnc([C@H]2CCC(=O)N2)n1CCCSc1nccs1)C1CCCC1 1509377431 KMMBGQNFQODJBL-QGZVFWFLSA-N 448.662 4.273 10 10 IICE Cc1cnn([C@H]2CCCN(c3nnc(CC(C)C)n3Cc3ccc(N(C)C)cc3C)C2)c1 1511404465 IRLNLBLIUIUYEF-QHCPKHFHSA-N 435.620 4.246 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(=O)NC)C1 1514200269 ZRFNZRBXKWPCCE-RACPOZDESA-N 446.599 4.281 10 10 IICE CCN1CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C[C@H]1C 1515920267 JLTDHTWHNORBBG-MRXNPFEDSA-N 448.687 4.100 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(-c3cn[nH]c3)cn2)cc1 1543115845 WLIUBZFLWXOBQM-UHFFFAOYSA-N 427.508 4.393 10 10 IICE C[C@@H]1CCC[C@@](Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1543885589 LQDFULBKCUDMID-RZTXVSJASA-N 441.620 4.372 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCCC1CCOCC1 1544528700 FWWWGUXILDSWTI-VKAVYKQESA-N 438.640 4.053 10 10 IICE CCOC(=O)[C@H](C)C1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1558238221 RXMBOAGLSSPVNA-CQSZACIVSA-N 433.346 4.128 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 1566360003 VJQFIFCTLKKDKW-QHCPKHFHSA-N 432.486 4.342 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2ccccc2)nc1 1566849863 RITAXVTXSWLQFJ-UHFFFAOYSA-N 426.856 4.048 10 10 IICE C[C@H](Nc1ccc(C(=O)NCc2ccc3cccnc3c2O)cc1[N+](=O)[O-])c1ccccn1 1570531730 MRCRAARVQHYMSC-HNNXBMFYSA-N 443.463 4.347 10 10 IICE Cc1cc(CC(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)c(C)n1-c1ccccc1 1595411163 WXONYSSOSNEIOR-IBGZPJMESA-N 447.362 4.500 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCC2(c3ccc(Br)cc3)CCOCC2)cc1 1607769241 DMKOUSTWOZDHTJ-UHFFFAOYSA-N 445.317 4.090 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCC[C@@H](C(F)F)C1 1611963952 GVYKOZUWFGUDMO-HXUWFJFHSA-N 440.542 4.168 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(N3CCCCC3=O)cc2)c1 1625596264 TUFFTZBSBDPVBC-UHFFFAOYSA-N 429.520 4.354 10 10 IICE CC(C)(C)OC(=O)N[C@@]1(C)CCCC[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1625970014 OORTVBVWBPPRTR-RDPSFJRHSA-N 447.645 4.330 10 10 IICE O=C(Cc1cccc(C(F)(F)F)n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1632040195 OBGPUHCURYZQDM-UHFFFAOYSA-N 429.389 4.030 10 10 IICE Cc1ccc(C(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1633624327 PCKOUNQONDJBCP-VWLOTQADSA-N 439.556 4.344 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2c(F)c(Br)ccc2[nH]1 1634725407 WTFHJBUQXANTQU-UHFFFAOYSA-N 442.082 4.468 10 10 IICE Cc1cc(C(=O)Nc2ccc(OCCCO)cc2)c(C)n1-c1ccc(Br)cn1 1636157538 OGIGZNKUMQXYHQ-UHFFFAOYSA-N 444.329 4.265 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCOC3(CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1636281271 GKZVXFATIDEJHW-QGZVFWFLSA-N 432.362 4.473 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](O)CCO3)c(C)n1-c1cccc(Br)c1 1639080653 JCTHHRJTZBBDIW-IBGZPJMESA-N 447.373 4.003 10 10 IICE Cc1cc(C(=O)CN2C(=O)CN(/C=C/c3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cn1 1643647074 NQGJGUOEBWYOLQ-ZHACJKMWSA-N 448.910 4.260 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]2[C@H]2CCCO2)sc(C)c1-c1ccccc1 1653594124 DCTHKWIFXVOXFQ-RBUKOAKNSA-N 442.581 4.482 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)N(C)C)cc1 1685682284 XVTIKCFZFYDPLS-KMDXXIMOSA-N 442.579 4.056 10 10 IICE C[C@H]1C[C@H](C)CN(CCCCn2c(CC3CC3)nnc2N(C)Cc2ccccc2O)C1 1693574823 PUPWNMWPDDZSML-PMACEKPBSA-N 425.621 4.331 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cc(C)on1 1696411738 ZPXOLHSAMVXSOZ-UHFFFAOYSA-N 434.544 4.170 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2C[C@@H](C)O[C@H](C)C2)cc1 1710028511 URWIVCCRAXYUSR-RTBURBONSA-N 439.629 4.439 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1C[C@H](F)CN1Cc1cccs1 1723144812 UNJNUGWFCGUJBO-OALUTQOASA-N 443.592 4.418 10 10 IICE Cc1ccc(CN(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)s1 1724345907 NKCIEXLUHMPEJH-IBGZPJMESA-N 425.602 4.211 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H](c2cnn(C)c2)C1 1742141708 LYGKLMIAFCAOQY-HXUWFJFHSA-N 435.620 4.017 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CC2)nnc1N1CCC[C@@H](OCC(F)(F)F)C1 1751433367 XRHXXFWRMYPTEO-LJQANCHMSA-N 437.510 4.126 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H]2CC)n1Cc1ccc2c(c1)CCCN2C 1762273495 BQHAUELIJPHWAT-NRFANRHFSA-N 438.620 4.006 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@](C)(OC)CC2)n1Cc1ccc(N2CCOCC2)cc1 1763677682 VYBNRFOHBQMCFN-CPJSRVTESA-N 441.620 4.072 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1764295222 ZYXQSJJJHMQPPQ-IBGZPJMESA-N 437.588 4.129 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)ccc1OC 1860084232 RFIPLRKNSAHOMM-VCHYOVAHSA-N 446.506 4.417 10 10 IICE CCC1=NN(Cc2ccc(F)cc2)C(=O)/C1=C/c1cc(Br)c(O)c(OC)c1 1865666504 OHRCIAXYAQVZFJ-OVCLIPMQSA-N 433.277 4.494 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3c[nH]c4c(ccc5cccnc54)c3=O)cccc21 1866430985 GZXJOSYKXLSBFW-UHFFFAOYSA-N 445.434 4.104 10 10 IICE COc1cccc([C@@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@H]2C(=O)O)c1O 1952767960 MCSLIMSLOPECMV-LVXARBLLSA-N 445.471 4.239 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(C)C)c(C(=O)OC)c1I 2078982324 SWHDBRGXHITTFS-CYBMUJFWSA-N 442.297 4.411 10 10 IICE O=S(=O)(Nc1ccc(O)cc1Cl)c1cc(Br)sc1Br 2089618684 NXPLVPLIORYQEA-UHFFFAOYSA-N 447.557 4.433 10 10 IICE COc1ccc(Br)c(CN[C@]23CCC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1O 2236055667 QZKKRALGJBZQLQ-RBZFPXEDSA-N 441.366 4.043 10 10 IICE CC1=NN(c2ccc(Br)c(C)c2C)C(=O)C1=CNc1ccc(C(=O)O)cc1 2297316891 BQDMOQIYLYNIMB-UHFFFAOYSA-N 428.286 4.483 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NC=C2C(=O)N(c3ccc(C)c(C)c3)N=C2C)cc1 2297321432 CPBWAZMTZZLOCS-UHFFFAOYSA-N 440.569 4.052 10 10 IICE COc1ccc(N2CCN([C@@H](c3cccs3)[C@H](C)NC(=O)c3ccco3)CC2)cc1 4057491 YALGGFXFIBVQKV-HTAPYJJXSA-N 425.554 4.032 10 10 IICE COc1cccc(-n2c(C)cc(/C=C3/C(=N)N4C(SC)=NSC4=NC3=O)c2C)c1 20205546 UGBPAYNABKEIDX-CSCXBHOMSA-N 425.539 4.042 10 10 IICE Cc1cccc(OCCOCCOc2ccc(/C=C3/SC(=S)N(C)C3=O)cc2)c1 27531643 RIZCQGMWLVLNGM-HMMYKYKNSA-N 429.563 4.300 10 10 IICE CCS(=O)(=O)c1cc(Nc2cccc(Cl)c2)c2c(c1N)C(=O)c1ccccc1C2=O 31391587 YXIFYSPDGDPJEM-UHFFFAOYSA-N 440.908 4.235 10 10 IICE CCc1ccc(N2N=C(C)/C(=C/c3ccc(-c4ccc5c(c4)C(=O)NC5=O)o3)C2=O)cc1 33323543 OIFXMQMATHDQBP-MOSHPQCFSA-N 425.444 4.199 10 10 IICE CC1CCC(Nc2nc3ccccn3c(=O)c2/C=C2/SC(=S)N(C(C)C)C2=O)CC1 33489170 SZLFAEVOVXSQPH-SFQUDFHCSA-N 442.610 4.295 10 10 IICE CCC(/C=C1\Sc2ccc(OC)cc2N1CC)=C1/SC(=S)N(CC(=O)O)C1=O 33721439 ZIJWUKZCGLJFHC-QTZOOJAOSA-N 436.580 4.078 10 10 IICE O=C1/C(=C2/SC(=S)N(Cc3ccccc3)C2=O)SC(=S)N1Cc1ccccc1 35624534 UFIPKQNWSFZCSH-NXVVXOECSA-N 442.612 4.319 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(F)c(F)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526541476 KYICAJTZERFECP-OAQYLSRUSA-N 425.387 4.442 10 10 IICE O[C@@H](CSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1)CN1CCOCC1 726851170 IMLNEDNFALKHMM-OAQYLSRUSA-N 444.000 4.037 10 10 IICE CC[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C)nn(C)c1C 743695164 VIXRXGYCBVFUNA-LPHOPBHVSA-N 435.519 4.058 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 747503845 FTMFMJBGACSVNU-NRFANRHFSA-N 431.458 4.365 10 10 IICE Cc1ccccc1CC1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 752961206 PBNPPRYNUIJXRW-UHFFFAOYSA-N 429.511 4.449 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1c[nH]cc1-c1ccccc1F 787489402 KHYYBPPZHYUJJN-UHFFFAOYSA-N 432.543 4.283 10 10 IICE Cc1cc(-c2nnc(N3CCOC4(CCC4)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802693802 AESQIJHKCKKTOA-QFIPXVFZSA-N 447.583 4.291 10 10 IICE Cc1ccccc1CO[C@H](C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125197066 ZAJZUQBRZFUQIA-QGZVFWFLSA-N 436.474 4.072 10 10 IICE C[C@@H](Cc1cccs1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1125807451 FGVUPNQBXZFSDC-IGWPVBGESA-N 434.583 4.226 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4c(Br)cncc4s3)C2)cc1 1129993093 HPMXRWGHGSOJIT-CYBMUJFWSA-N 446.370 4.324 10 10 IICE COc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc(Cl)c1OCC(C)C 1134681929 NEWIFNUHAFTUNJ-OAQYLSRUSA-N 448.007 4.482 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ncc(Cc2ccccc2)o1 1136285027 NGFZBGILLNLBFL-UHFFFAOYSA-N 445.441 4.051 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn2ccnc12 1274215293 SMCIPVKFHJISRM-GZTJUZNOSA-N 440.525 4.012 10 10 IICE COC(=O)COc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1Cl 1295249227 PDYJIHPQHMWMNV-UHFFFAOYSA-N 440.883 4.364 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1299538090 IFYHHKVFIGYKSR-QZTJIDSGSA-N 425.602 4.329 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3C[C@@H](OC)C(C)C)CC2)cc1 1300246521 CBMFJJSCDFBINN-HSZRJFAPSA-N 441.620 4.332 10 10 IICE Cc1cc(C(=O)N2CCC([C@@H](O)c3ccnn3C)CC2)c(C)n1-c1ccc(Cl)cc1 1301302310 YOZOBYKVUTXVFV-JOCHJYFZSA-N 426.948 4.067 10 10 IICE Cc1cc(C(=O)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)c(C)n1-c1ccc(F)cc1 1303742273 YHRYSCQTQBFPIM-JTHBVZDNSA-N 441.453 4.213 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](CCNC(=O)OC(C)(C)C)C1 1304264664 SMDQJTRMCWQPSC-LJQANCHMSA-N 439.556 4.284 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@@H](OCC(F)(F)F)C2)cc1 1313674636 UTGPZUSBYOGLPO-LJQANCHMSA-N 425.499 4.029 10 10 IICE CO[C@H](c1ccc(F)cc1)[C@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357613342 YRTQKYOSLABFGC-QYBDOPJKSA-N 437.559 4.439 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1F 1443774541 UYKHCBZEECLSQB-PGRDOPGGSA-N 431.939 4.161 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@@H](O)C(F)(F)F 1447072296 MEYYRNZLALZKNV-JKSUJKDBSA-N 433.268 4.288 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(c2)ncn3C)c(C)n1-c1ccc(Br)cn1 1455853989 YBKPGSQIPAWWOQ-UHFFFAOYSA-N 438.329 4.068 10 10 IICE CCc1cc(OCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1Cl 1458019306 MQFITLSZPBQKJC-UHFFFAOYSA-N 442.003 4.130 10 10 IICE Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460738335 ACTKOKFOKZKONL-KRWDZBQOSA-N 432.511 4.317 10 10 IICE CCc1nc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)nn1-c1ccccc1Cl 1460980224 FEFLGIJMZZJSPI-MRXNPFEDSA-N 425.964 4.219 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1461076834 KZAIEKYIQOGLFS-IBGZPJMESA-N 444.531 4.405 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3OCc3cccs3)CC2)c(OC)c1 1461981473 LGKWZBDEBOAJCO-UHFFFAOYSA-N 438.549 4.307 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2Cc3c(F)cc(C)cc3N2C(=O)OC(C)(C)C)c1 1465991297 AGMJUJUUCKIPPG-JLTOFOAXSA-N 444.503 4.392 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)O 1515681827 QPNPKCICGFUNCF-OAQYLSRUSA-N 437.588 4.129 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)s2)o1 1524851008 BXQXYKOTEQPDSB-UHFFFAOYSA-N 433.480 4.065 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3sc(-c4ccc(F)c(F)c4)nc3C)C2)cc1 1531730526 ZTSVTCKAQHFVAA-HNNXBMFYSA-N 429.492 4.414 10 10 IICE C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N[C@@H]4CCCC[C@@H]43)c2C(=O)OC(C)(C)C)C1 1539725178 QIXLXCLMCHHDMI-MUIFIZLQSA-N 446.613 4.462 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCc3c(OC)cc(OC)cc3OC)c2C)cc1 1543253342 JAQOKFZSHDSQOP-UHFFFAOYSA-N 438.524 4.101 10 10 IICE CC/C=C/Cn1c(-c2cc(Br)cn2C)nnc1N(C)Cc1ccccc1O 1546781161 WHRXTNPPZQQGTJ-VMPITWQZSA-N 430.350 4.354 10 10 IICE CC1CCN(c2ccc(NC(=O)CCC(=O)NCc3cc(Cl)ccc3O)cc2)CC1 1557385777 JMOMZYLKVQEABI-UHFFFAOYSA-N 429.948 4.317 10 10 IICE CCCO[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1559533497 MZSXRAFLMUJZHK-PKOBYXMFSA-N 434.536 4.070 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H](N(C)c4ccc(C)cc4)C3)C2)cc1 1564962044 CVTMTMGVSMJXSY-XUZZJYLKSA-N 436.600 4.140 10 10 IICE COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1565453006 PZXFSKCZAAMDON-VXKWHMMOSA-N 432.996 4.038 10 10 IICE O=C(CCCc1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1566023307 RANXGZGTUAISIS-UHFFFAOYSA-N 449.364 4.188 10 10 IICE Cc1cc(C(=O)NCC(=O)N(C)C2CCCCC2)c(C)n1-c1ccc(Br)cc1 1566412887 HSQBETDXPDJJDF-UHFFFAOYSA-N 446.389 4.378 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccnc(Oc3ccc(F)cc3F)c2)cc1 1585448805 AOCYJGDARIDCJL-UHFFFAOYSA-N 427.451 4.369 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CCCN2c2ncnc3sc(C)cc23)cc1 1587459858 KBTKARAJQXEFMR-OAQYLSRUSA-N 437.613 4.473 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](C3(C)OCCO3)C2)c(C)n1-c1cccc(Br)c1 1597233178 YGSNRJCYAGYWMR-KRWDZBQOSA-N 447.373 4.472 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(C)(C)c3ccccc3Br)C2)cc1 1598363158 FJMDYCCBMSKSIX-INIZCTEOSA-N 431.374 4.378 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1614116432 IUSLADGXWHQTSO-ICSRJNTNSA-N 429.584 4.125 10 10 IICE COC(=O)c1cc(C(=O)CN(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)c(C)[nH]1 1615886973 KLDBEUOEKCYYQW-TWGQIWQCSA-N 446.503 4.284 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc2c(c1)CCN(C(=O)OC(C)(C)C)CC2 1617046906 HWJCMNPCYJSTTC-UHFFFAOYSA-N 437.584 4.327 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN[C@@H](c3ccccc3Cl)C2)cc1 1617568212 NOGFGCIIUJCSEC-XMMPIXPASA-N 435.955 4.276 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@](C)(OC)C3CC3)CC2)cc1 1619301701 VIEOVAGQKVEILY-VWLOTQADSA-N 441.620 4.116 10 10 IICE Cc1nc(Br)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1631612342 MMFCIZHMRCLXLJ-MRXNPFEDSA-N 438.391 4.101 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 1632701572 IQEFERDCMJKWMK-OAHLLOKOSA-N 433.932 4.312 10 10 IICE COC(=O)c1cc(OCC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)ccc1N(C)C 1641368814 XJYLVZBPAARHDF-DEOSSOPVSA-N 444.531 4.092 10 10 IICE Cc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1OCCN(C)C 1642374387 VFYAETUOYJQFGC-UHFFFAOYSA-N 433.552 4.337 10 10 IICE Cc1c([C@@H](C)NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)sc2ccccc12 1642642261 DMQHQUHQKPFMFJ-QGZVFWFLSA-N 441.572 4.152 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCc4cc(Cl)ccc43)cc2F)C[C@@H](C)O1 1642843208 UHJHPJVZAOEVBD-CALCHBBNSA-N 445.966 4.162 10 10 IICE COc1ccc(-n2nnnc2SCC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1651720673 MKXINVBGIPCARL-UHFFFAOYSA-N 433.537 4.362 10 10 IICE COC(=O)/C=C/c1ccc(N2CC(Cc3cccc(OC(F)(F)F)c3)C2)c([N+](=O)[O-])c1 1655235917 KXEGCYOGXGQERX-SOFGYWHQSA-N 436.386 4.359 10 10 IICE C[C@H](Sc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1656544186 LFTPGIFPKBMUTO-ZDUSSCGKSA-N 432.457 4.490 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C12CCC2 1683862687 TXWYIMNODAMXFN-OAHLLOKOSA-N 444.359 4.430 10 10 IICE CN(CCc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684607515 RFMQCNPXAWUZQI-NRFANRHFSA-N 447.421 4.002 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NCCc1ccc(I)cc1 1687160261 WMGOTPISAPEOCN-UHFFFAOYSA-N 438.309 4.161 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1cccnc1 1694110060 VAFVZEFBHGECRK-HXUWFJFHSA-N 434.588 4.155 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)C[C@@H]2CCOC2)cc1 1695624838 MTHMXBYVHGUPOM-QFIPXVFZSA-N 425.621 4.378 10 10 IICE CN(Cc1ccco1)c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1696705473 OKRCPKQJOHYCIT-UHFFFAOYSA-N 426.571 4.132 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1CCC1=CCCCC1 1708706788 NWJJLCKRIYFWSK-UHFFFAOYSA-N 425.577 4.429 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCN1CCC[C@H](C)C1 1723270484 MKYKGUKCAYDGKA-QFIPXVFZSA-N 438.664 4.445 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1728239923 QCWZDEZQFKWPGS-HXUWFJFHSA-N 429.584 4.270 10 10 IICE CO[C@@H](Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1729882883 KXVDNNXULKSNHL-IRLDBZIGSA-N 441.620 4.080 10 10 IICE CC(C)(C)[C@H]1CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1741177718 CJWASNJFGSIAQN-HNNXBMFYSA-N 429.619 4.246 10 10 IICE COC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C[C@H](C)O1 1749544567 UYAFDQWOFJMGJL-SIKLNZKXSA-N 437.588 4.249 10 10 IICE CCC1(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCOCC1 1762542030 HHHXBHFKDCQPTH-UHFFFAOYSA-N 426.586 4.479 10 10 IICE C[C@@H]1C[C@@H](C)CN(C(C)(C)Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1762701635 DGUGELJVWQLTAF-WOJBJXKFSA-N 448.615 4.439 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CCCS3)CC2)cc1F 1768705076 UOENXBZNTGZCFD-SFHVURJKSA-N 447.624 4.237 10 10 IICE CN1CCCc2cc([C@@H](O)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999524185 WJEMGBBYPICRJE-FYYLOGMGSA-N 426.557 4.213 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)[C@H]2C[C@@H]21 2057596843 YMZBWWSVDWVNGH-SNPRPXQTSA-N 431.758 4.296 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(CCNCc2cc(Br)cc(F)c2O)C1 2205241131 LWFDDKJSSLFSNH-XOBRGWDASA-N 443.357 4.421 10 10 IICE COc1ccc(Br)c(CNC[C@]2(C)CCCN2C(=O)OC(C)(C)C)c1O 2227750190 XMKHKGYEIGUCNM-IBGZPJMESA-N 429.355 4.043 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCCC[C@@H]2NC(=O)OC(C)(C)C)c1O 2236054300 HBRLNUGTQHDNQQ-CVEARBPZSA-N 443.382 4.479 10 10 IICE CC[C@@H]1CC[C@H](NCc2c(Br)ccc(OC)c2O)CN1C(=O)OC(C)(C)C 2236056602 XBDSVNKDRBVZMT-UONOGXRCSA-N 443.382 4.431 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3cccc(C(=O)O)c3)C2=O)cc1 2293039471 APGBVWZEIHDYNV-UHFFFAOYSA-N 440.546 4.177 10 10 IICE COc1ccc2c(C=C3SC(=S)N(CCc4ccccc4)C3=O)c(C(=O)O)[nH]c2c1 2297580151 ULRBMRHFKZBBPT-UHFFFAOYSA-N 438.530 4.319 10 10 IICE O=C(O)c1ccc(N2C(=O)C(=Cc3ccc(O)c(Br)c3)SC2=S)cc1 2314732742 VUHCRRBLOGHKEP-UHFFFAOYSA-N 436.308 4.259 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1ccc(Br)cc1O)[C@H]2F 2333278283 ZAPHLZQKQDAQHM-WBTNSWJXSA-N 429.330 4.123 10 10 IICE CC(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)NC(=O)[C@@H](C)O4)cs2)cc1 11857569 JQIIJOIMPJBMCX-CYBMUJFWSA-N 443.550 4.454 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccccc3)C2=O)ccc1O 15045335 KPEQJKPFYQBLRI-FDIDITGRSA-N 428.535 4.019 10 10 IICE COc1cc(/C=C2\C(=O)NN(c3ccc(Cl)c(Cl)c3)C2=O)cc(Cl)c1OC 98064438 ATYPXBXHSKMKIC-VZUCSPMQSA-N 427.671 4.125 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C\c3ccc(OC(F)F)c(OC)c3)CC2)cc1 209669991 AQUNUNIVWHIPAI-WZUFQYTHSA-N 432.467 4.057 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(OC)c1O)N2 226709135 UVOPBZDOGNPAGL-YVHKJVDXSA-N 428.554 4.258 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc3c(c2)NC(=O)CS3)C1 435655339 NDQMUDJMACJVTQ-UHFFFAOYSA-N 434.565 4.091 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCc2cc(Br)cc(F)c2O)CC1 715760924 SFMGNQURMYTHDY-NNUKFRKNSA-N 431.346 4.467 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccccc3OC(F)F)n2)cc1OC 727241705 AXXDZRXYCLRGRV-UHFFFAOYSA-N 442.465 4.230 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCc3ccccc3OC3CCC3)cc2F)C[C@@H](C)O1 735680827 IVHMSNPOXKHZFB-HDICACEKSA-N 441.547 4.370 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(Cc1ccc(F)cc1)C1CC1 769047296 DPGVDNSTJCWOAC-UHFFFAOYSA-N 436.575 4.232 10 10 IICE C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 776417904 QTYJZDJNQSLRQT-BDJLRTHQSA-N 446.381 4.173 10 10 IICE CCc1ccc(-c2csc(NS(=O)(=O)c3c(OC)cc(OC)cc3OC)n2)s1 777665966 CHGGIAGARXAOCY-UHFFFAOYSA-N 440.568 4.261 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCCN2Cc2ccc(N3CCOCC3)cc2)C1 816658546 OOFLJVKVBUJMIK-JTHBVZDNSA-N 429.605 4.135 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CCCN(C(=O)Cc3ccc(F)cc3)C2)cc1 916732264 BRIHAJHQRAXZBB-QFIPXVFZSA-N 439.575 4.112 10 10 IICE Cc1sc(=O)n(CC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1-c1ccc(F)cc1 1124549585 NKVYEMADJMQGDB-UHFFFAOYSA-N 439.556 4.283 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](OC(C)(C)C)c3ccccc3)cc2F)CC1 1125975746 ACOPGUZGRGVMSV-HSZRJFAPSA-N 427.564 4.140 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCCC23OCCO3)c(C)n1-c1ccc(Br)cc1 1137748365 YHCXWJMVZWLCOB-LJQANCHMSA-N 433.346 4.272 10 10 IICE COc1ccc(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)no2)cc1 1142713211 ROBBCEFNTPSUDA-JOCHJYFZSA-N 435.524 4.238 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)c2ccc(N(C)C)cc2)sc2c1CC[C@H](C)C2 1193574156 DQJKHNMXPCCMDC-JKSUJKDBSA-N 443.613 4.405 10 10 IICE CN(c1ccc(CNC(=O)NCCNC(=O)OCc2ccccc2)cc1)C1CCCCC1 1256464040 IBQKXXWOEFSDSE-UHFFFAOYSA-N 438.572 4.181 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnn(-c2ccccc2)c1Br 1276283678 KUMAWLWJDLRXHW-MRXNPFEDSA-N 441.373 4.370 10 10 IICE CC[C@@H](C)c1nnc(N2CCSC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1291682213 PCKHPMLVWHVDPK-MSOLQXFVSA-N 431.675 4.335 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cccnc3)CC2)c(C)n1-c1cccc(C(C)C)c1 1295405157 FSGNZKBFLJOCAY-UHFFFAOYSA-N 430.552 4.211 10 10 IICE CC[C@](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)(C(=O)OC)c1ccccc1 1299266081 IUYXJPCOYZXVDB-AREMUKBSSA-N 432.520 4.157 10 10 IICE COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)NCc2ccc(O)cc2O)c1 1299570448 JAWCIBOYNOCNJF-UHFFFAOYSA-N 429.476 4.198 10 10 IICE CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCc1c(O)cccc1F 1303879296 WQGRXGSTZFADKV-INIZCTEOSA-N 445.343 4.006 10 10 IICE C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1312363173 CRDKCQNLRVCHKA-IIBYNOLFSA-N 436.522 4.305 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2c2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1314380263 YIAXEBGSAMAGFJ-LJQANCHMSA-N 429.565 4.471 10 10 IICE Cc1cncc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1Cl 1337101642 WVYWTUXALTWRKT-ZDUSSCGKSA-N 448.862 4.003 10 10 IICE COc1ccc2c(c1)[C@H](C(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CCC2 1357836117 NNZXBOXSYQGDHL-LLGFUMIMSA-N 426.532 4.184 10 10 IICE Cc1ccc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)nc1C 1436631195 KWBPJONOHRSFSA-GZTJUZNOSA-N 431.608 4.058 10 10 IICE CNC(=O)Nc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 1443636639 XBDPBQYQXVUCIZ-UHFFFAOYSA-N 432.524 4.360 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H]3CCCCC34CCCC4)cc2F)C[C@@H](C)O1 1460137819 OGZWMZRTHBSGMM-PWHSHALESA-N 431.596 4.148 10 10 IICE CN1CC[C@](Cc2ccccc2)(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1=O 1464543084 VVLYRQSSHWXSLI-MHZLTWQESA-N 433.596 4.163 10 10 IICE COc1ccccc1N1CC[C@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)C1 1464703414 CDVAEHLOJSNQHV-HXUWFJFHSA-N 431.536 4.172 10 10 IICE CN(C)c1ccc(CNC(=O)CN(Cc2cccc(Br)c2)CC2CC2)cc1 1473448847 MTAGECVPONCFRB-UHFFFAOYSA-N 430.390 4.044 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H](C)c3ccc(Br)cc3)C2)cc1 1478861379 ZRYLMPUSCAEPFM-DLBZAZTESA-N 446.389 4.387 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCOC1CCCCCC1 1499100747 ZMJHXELMROLVKP-UHFFFAOYSA-N 441.620 4.305 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCO[C@H]1C 1500735331 WQGINVVKYVNNSF-NBGIEHNGSA-N 437.588 4.129 10 10 IICE CCN(c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1501607727 RITQRGASHGWJAH-NRFANRHFSA-N 429.634 4.356 10 10 IICE COc1ccccc1-c1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)s1 1526002398 CAHBGMFQGYUPBJ-UHFFFAOYSA-N 426.513 4.329 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cccc(Cl)n1 1527851627 SBWPANVMLONXBF-SDNWHVSQSA-N 435.933 4.128 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(Cl)c(-n4cccc4)cc3OC)C2)cc1 1529404757 ZCFFYDSXZCPREV-QGZVFWFLSA-N 439.943 4.404 10 10 IICE Cc1cc(Br)ccc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1535561326 MKXBJDXGYMPUBM-UHFFFAOYSA-N 442.401 4.220 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)n3nnc(-c4ccccc4)n3)cc2Cl)C1 1538422123 UKLQZDQVPZPNKS-DLBZAZTESA-N 438.963 4.107 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC=C(Br)C2)nnc1C(C)(C)C 1542228518 MJOGKSWRWFHNPY-UHFFFAOYSA-N 432.410 4.487 10 10 IICE CC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1Cl 1544529645 HVRWXDSRNITVDT-FQEVSTJZSA-N 429.948 4.186 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC(OC[C@@H]3CCCCO3)CC2)cc1 1547442306 NWVRWNOKNLNZAT-DEOSSOPVSA-N 441.620 4.036 10 10 IICE CCS[C@@H]1CCCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1552571519 ONXJMULBSUSJOV-WIYYLYMNSA-N 447.624 4.495 10 10 IICE CN(Cc1cscn1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1554195986 GABIYQPYNQCCNF-OAHLLOKOSA-N 436.632 4.252 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1556539971 MSURPOQEKIDUBJ-OFNKIYASSA-N 445.629 4.055 10 10 IICE Cc1ccc(O)c(CNC(=O)NCc2cccc3c2CCCN3C(=O)OC(C)(C)C)c1 1564866530 RDXJTSZUDOLKBT-UHFFFAOYSA-N 425.529 4.388 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Br)cc4cccnc34)C2)cc1 1587112133 BIEIWXZFGXVOSW-MRXNPFEDSA-N 426.314 4.015 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H](O)Cc2cccc(C(F)(F)F)c2)cc1 1595385436 PFYKFKPCOHMHIA-QFIPXVFZSA-N 446.469 4.497 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1nc(C)cs1 1613295572 KGWPCXQDBJBLCX-KRWDZBQOSA-N 440.617 4.330 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1CC 1613370496 GQZZOYGTFSGYQD-GOSISDBHSA-N 446.603 4.495 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@H](C)N(CC)C[C@@H]3C)nnc2C(C)(C)C)cc1 1615382534 ZTOMEPKFMZSOIM-PMACEKPBSA-N 426.653 4.389 10 10 IICE CCOC(=O)CN(Cc1nc(O)c2c(-c3ccccc3)csc2n1)Cc1ccccc1O 1618721137 VSMOFHOPSHCXOL-UHFFFAOYSA-N 449.532 4.335 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C 1625794510 KSKOVTABIYPAKL-JOCHJYFZSA-N 425.573 4.442 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1csc(-c2ccc(Cl)cc2)n1 1627013643 ICXUPTABBJLCKP-UHFFFAOYSA-N 430.913 4.375 10 10 IICE CCN(CCCNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)C(=O)OC(C)(C)C 1628254249 YHHPEWGYHPMAMZ-UHFFFAOYSA-N 443.588 4.292 10 10 IICE CC[C@H](CO)NC(=O)Cc1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1 1631430029 MGVGYUDXZXTBKO-JOCHJYFZSA-N 447.579 4.393 10 10 IICE CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@@H](C)c1ccccc1O 1632250032 INVKSLZVFOCVGU-YVEFUNNKSA-N 441.380 4.428 10 10 IICE CNC(=O)CC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1636028003 SMFYDJQSQCDTIX-QGZVFWFLSA-N 446.389 4.378 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C[C@H]2c3ccccc3CN2C(=O)OC(C)(C)C)c1 1636061838 YVFVFMYWNSUMCE-QRWLVFNGSA-N 426.513 4.460 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3C2=O)c(C)n1-c1cccc(Br)c1 1636365761 UKTAOZKILJECFD-IBGZPJMESA-N 439.309 4.230 10 10 IICE COC(=O)[C@H]1CCc2sc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)nc2C1 1643164507 NTSDZOSUQYMHAS-HNNXBMFYSA-N 439.537 4.089 10 10 IICE CON(C[C@@H]1CCC[C@H](C)C1)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1643308422 KGZILGHARFIPHL-OKZBNKHCSA-N 434.536 4.479 10 10 IICE CCCCN(C)C(=O)CSCC(=O)c1cc(C)n(-c2ccc(C(=O)OC)cc2)c1C 1652762698 QRKCJIXVXPBKHX-UHFFFAOYSA-N 430.570 4.055 10 10 IICE COC1CCN(c2ccc(CN3CCCC[C@@H]3COC(=O)N3CCCCC3)cc2)CC1 1658547363 LMGXOANKXRHVQG-HSZRJFAPSA-N 429.605 4.279 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(c2cccc3cnccc23)C[C@H]1C 1673743376 CYFOOAPAAJBPBR-NHCUHLMSSA-N 445.611 4.461 10 10 IICE C[C@@H](NC(=O)NCc1cccc(Br)c1O)c1ccc(-n2cccn2)c(F)c1 1682586719 WWSANVYGPSQTRB-GFCCVEGCSA-N 433.281 4.040 10 10 IICE CC[C@@H](NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)C(=O)NCc1cccs1 1683149126 KPORVYVRBTWJDK-JOCHJYFZSA-N 438.597 4.092 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c(C)n1-c1ccccc1 1683149630 SKEKGFTZPXNZBT-HSZRJFAPSA-N 425.960 4.193 10 10 IICE Cc1cc(CNC(=O)N(C)[C@@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccccc1 1683308361 ZEGVJGXIUWPRRM-HSZRJFAPSA-N 434.515 4.180 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H](c1cccnc1)C(C)C 1694635494 XZSMECKQOIRCRO-XMMPIXPASA-N 448.615 4.148 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C[C@H]2CCOC2)C2CC2)cc1F 1711006540 LMRSZKMUQZWUON-GOSISDBHSA-N 429.584 4.125 10 10 IICE CO[C@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC[C@@H]1C 1712070153 BWKBOQYSHLEXKM-YOEHRIQHSA-N 433.603 4.347 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1743287373 UCKDGIOUXDAASJ-LSDHHAIUSA-N 425.649 4.100 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)CCc2nccs2)cc1 1746090396 XBPNQRVZULASDR-UHFFFAOYSA-N 447.612 4.370 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1750303496 JMDRLJLWQLFCGV-FUHWJXTLSA-N 435.613 4.003 10 10 IICE CC(C)CCN(c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1)C1CC1 1750791706 ZHESFLBNEMQTLA-LJQANCHMSA-N 429.584 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1766613613 HYTIWIBWFQWSCE-RDPSFJRHSA-N 448.615 4.020 10 10 IICE COc1cn(CCCn2ccnc2)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1870999800 NZGSNCMTAZXCGD-UHFFFAOYSA-N 429.524 4.499 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](NCc1c(O)cccc1Br)C2 1878874447 IVIAUTWDKGZDHT-JIRONKKISA-N 429.330 4.123 10 10 IICE CC(C)(O)CN(Cc1ccccc1)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 1915403964 IDJSAIICZAHEHS-UHFFFAOYSA-N 425.573 4.340 10 10 IICE CSCC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(F)cc3)o2)SC1=S 2040479858 BKNASTUNAFRRDY-CQSZACIVSA-N 437.539 4.493 10 10 IICE Cc1ccc([C@H](n2nc(C)c(C(=O)O)c2I)C(C)(C)C)c(O)c1 2079107597 BGTXNTWYQJTIIW-AWEZNQCLSA-N 428.270 4.144 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)NN(c4ccc(C)c(C)c4)C3=O)o2)cc1 2297297831 VYBUDHXLMRRNHR-UHFFFAOYSA-N 430.460 4.202 10 10 IICE O=C(O)CCN1C(=O)C(=Cc2ccc(-c3ccc(Br)cc3)o2)SC1=S 2297311839 YQGDLHYELOLTHU-UHFFFAOYSA-N 438.324 4.385 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(C3CCCCC3)C2=O)cc1OC)C(=O)O 2314931318 FAGQIWNALZJKMA-OAHLLOKOSA-N 435.567 4.471 10 10 IICE Cc1ccc(CN[C@]23CCCN(C(=O)OC(C)(C)C)C[C@@H]2C3)c(O)c1Br 2352945055 QADNWEZJNKWNGZ-YWZLYKJASA-N 425.367 4.342 10 10 IICE COc1cccc([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1O 2505596 JMERTOAGXLOQGP-OAQYLSRUSA-N 433.460 4.455 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1)N2)N1CCOCC1 14465007 UVHIHJSTROXJTD-JQVVWYNYSA-N 430.957 4.187 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)ccc1OCC(=O)O 16914952 PLSUCPCEUBWEPB-VCHYOVAHSA-N 429.519 4.181 10 10 IICE C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S 47152312 FPIQREHFMBXADA-OKHBPPCESA-N 447.925 4.477 10 10 IICE CN(C)c1ccc(/C=C\C(=O)N2CCN(Cc3csc(-c4ccccc4)n3)CC2)cc1 98004140 OOPVSHBTSVFHKX-RAXLEYEMSA-N 432.593 4.234 10 10 IICE Cc1cccc(NC(=O)CCN2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)c1 205691348 SRIOZZNHZACIQA-SFQUDFHCSA-N 427.507 4.133 10 10 IICE CCOc1c(/C=C2/SC(=S)N(CC(=O)OC3CCCCC3)C2=O)cccc1OC 206473850 PIOZCXHLUXPVGK-SFQUDFHCSA-N 435.567 4.171 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccccc4)nc4onc(C)c34)CC2)cc1F 753729696 FHXDSEWOEDNXHK-UHFFFAOYSA-N 446.482 4.308 10 10 IICE C[C@H]1CN(c2ccc(CN[C@H](C)c3cc(Br)cc(F)c3O)cn2)C[C@@H](C)O1 756418309 SIPSRCXIZALDTM-HZSPNIEDSA-N 438.341 4.153 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(C(F)(F)F)nc3)n2)cc1OC 782263226 WDVWHHGZRAYDHS-UHFFFAOYSA-N 445.444 4.042 10 10 IICE Cc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(-c2cnn(C)c2)c1 801726783 KOZRBJGZQCOIMH-UHFFFAOYSA-N 429.612 4.217 10 10 IICE C[C@H](Oc1ccccc1Br)C(=O)NCc1cc(Br)ccc1O 804734805 ZUSMBBHQOVAZRA-JTQLQIEISA-N 429.108 4.001 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CCc2ccccc2C1 914439557 KXGGBKPWFBSCSH-GMYFBSLISA-N 442.631 4.403 10 10 IICE COc1ccc(CN2CC[C@H]2C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1139138611 KODKOLMCIZJOPF-KOSHJBKYSA-N 442.003 4.476 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(CC(=O)NCc3ccc(N4CCCC4)cc3)cccc2C1 1141538043 HTOQZOMQXKCDHK-UHFFFAOYSA-N 449.595 4.439 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2 1142418460 FCTJVIYYZKHXIU-DHTSOJEISA-N 429.605 4.288 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1nnn(-c2cccc(Br)c2)c1C 1155705065 WFIVZYONHFAZGH-UHFFFAOYSA-N 443.345 4.486 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)C2)cc1 1162718703 OSZRWHLVGKGZDV-FQEVSTJZSA-N 433.552 4.368 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1cc(F)cc(F)c1 1194090480 IOANCHPXRSAEDZ-CQSZACIVSA-N 434.442 4.199 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCCc2cc(Cl)ccc2Br)c1 1224453080 NNTCGONZOHGSDB-LLVKDONJSA-N 427.726 4.420 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@]2(C)Cc2ccc(F)cc2)N(C)C)cc1 1256236652 JHTJNDVBVCCJHK-ZCYQVOJMSA-N 426.580 4.301 10 10 IICE Cc1cc(CCNC(=O)NC[C@@](C)(O)c2cccc(Cl)c2)c(C)n1-c1ccccc1 1313100940 PEHAZSQANYHVRZ-XMMPIXPASA-N 425.960 4.497 10 10 IICE Cc1cc(-c2nc(C)c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)s2)ccc1F 1354656867 HZYMJAKNDWTUPH-UHFFFAOYSA-N 443.519 4.472 10 10 IICE COc1ccccc1Oc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nc1 1357129560 SXLGEZLWEFLOQJ-GOSISDBHSA-N 433.508 4.210 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCCCCNC(=O)NC1CCCCC1 1440716717 ZBZYZWYJPIZKNZ-UHFFFAOYSA-N 428.621 4.438 10 10 IICE COc1ccccc1Nc1ncccc1C(=O)NCc1ccc(N2CCSCC2)cc1 1441627147 AHBKEOSTAZMUCJ-UHFFFAOYSA-N 434.565 4.317 10 10 IICE CCOC(=O)c1cc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc([N+](=O)[O-])c1 1462078450 DMCCCIHDBMPXBT-UHFFFAOYSA-N 435.480 4.417 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1C[C@@H](NC(=O)OC(C)(C)C)[C@@H]2C[C@H]12 1463783187 GTHPJUBDSDOZIU-LNRXMEIDSA-N 427.589 4.185 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)nn2C)cc1OC 1464983668 NMJKATVYQQVVDW-UHFFFAOYSA-N 448.567 4.271 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 1472766353 BNWKTWPLQCETQF-OAQYLSRUSA-N 443.503 4.471 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@H](c3ccccc3)C3CCCCC3)CC2)cc1 1473284857 ZYMCQSOPFGNNPX-XNMGPUDCSA-N 437.628 4.089 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3cc(-c4ccccc4)oc3C2)N(C)C)cc1 1479535277 RLVPLHUUJAEUOL-QHCPKHFHSA-N 432.568 4.383 10 10 IICE C[C@@H]1CSCCN1c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1494614501 YQTNRUMHYPKDGC-HUUCEWRRSA-N 425.649 4.100 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1F 1518068582 JUADPSKLDPMTQO-CXUHLZMHSA-N 449.460 4.103 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CCCC2 1525377897 GMMJYQKRFLFDQQ-QGZVFWFLSA-N 440.565 4.179 10 10 IICE CCOC(=O)C[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1cccc(OC)c1 1526020874 AAUOHGRBYDWJPT-DEOSSOPVSA-N 434.536 4.456 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 1526967564 HNRQYRIPEIIUIO-HNNXBMFYSA-N 431.920 4.236 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2ccccc2)c(C)n1-c1cccc(Br)c1 1544531859 PPWHUZWGISILRT-LJQANCHMSA-N 441.369 4.438 10 10 IICE CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)c1cc2cc(O)c(O)cc2s1 1545993848 GURAAGPECHUYRQ-HNAYVOBHSA-N 439.581 4.389 10 10 IICE C[C@@]1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCCc2ccccc21 1546089985 ASXOABOFUBOAMN-JOCHJYFZSA-N 442.562 4.236 10 10 IICE CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1583919366 PWSNLYWZXKTIOW-URXFXBBRSA-N 439.556 4.437 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(Br)c2nccnc2c1 1584094707 HLGQLOREXRSENL-CQSZACIVSA-N 427.346 4.128 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccn(-c4ccc(Cl)cc4Cl)n3)C2)cc1 1585987706 GUIYDNHMMDIXDX-OAHLLOKOSA-N 431.323 4.196 10 10 IICE C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1586054829 OTRDSFGVOZHPHA-KBMIEXCESA-N 446.595 4.330 10 10 IICE COc1ccc(N2CCN(C(=O)c3oc4ccccc4c3Br)CC2)c(OC)c1 1587490081 DKJGZAOUOQFJOX-UHFFFAOYSA-N 445.313 4.175 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCCC(=O)c3ccc(Cl)c(Cl)c3)cc2)CC1 1589179386 NQNYZBILJYLGKR-UHFFFAOYSA-N 448.394 4.415 10 10 IICE CCOC(=O)c1ccc(NCCNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)nc1 1607343954 YTBKTOUSPPBRDD-UHFFFAOYSA-N 440.931 4.161 10 10 IICE CN(C)c1ccc([C@@H](CNc2c(F)c(F)nc(F)c2F)NC(=O)OC(C)(C)C)cc1 1612344783 AYXCWCSAWGQLOD-CYBMUJFWSA-N 428.430 4.382 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccoc3C)n2Cc2ccc(N(C)C)cc2C)n1 1612480681 NAHZCNYTXDJGHA-UHFFFAOYSA-N 447.587 4.100 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(OCCN4CCCC4)cc3)ccc21 1617165770 VCEQAKNVZFNBBO-UHFFFAOYSA-N 449.595 4.309 10 10 IICE Cc1ccc(C(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1628880187 GFIIEBOGTJJWKB-FDDCHVKYSA-N 429.520 4.139 10 10 IICE O=C(COc1ccc(C(F)(F)F)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257204 QUQCNALJPJORNG-KRWDZBQOSA-N 442.865 4.224 10 10 IICE COc1ccc(N2CCN(C(=O)/C(F)=C\c3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1631372785 YUEYVSZIHKJSNO-QGOAFFKASA-N 438.421 4.382 10 10 IICE C/C=C/C[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C(=O)OCC 1633749484 NZZXSLAKUVEKNK-XZXOBPBMSA-N 433.346 4.484 10 10 IICE Cc1cc(C(=O)NCCCN2CCCO[C@@H](C)C2)c(C)n1-c1cccc(Br)c1 1633950749 WHIFBGGQFJHSLH-KRWDZBQOSA-N 448.405 4.087 10 10 IICE CC(C)(C)[C@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1634338560 GTHLGDZDYQZTCS-SFTDATJTSA-N 428.621 4.183 10 10 IICE COc1cc(OC)c2c(c1)N(C(=O)/C=C\[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CCC2 1641445791 DKSKGQSDGQASEG-QXPKXGMISA-N 430.545 4.186 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(Cl)c(Cl)c3)C(C)C)nc12 1641543106 GJPHTCLTWOBKCM-UHFFFAOYSA-N 437.327 4.329 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C4CCCCC4)C3)cc2F)C[C@@H](C)O1 1647853271 BUPQKNNGJJULLB-MZKRTTBSSA-N 445.623 4.348 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC(Cc3nc(-c4ccc(F)cn4)no3)CC2)c1O 1648274322 NXRDBKGWXYZSJF-UHFFFAOYSA-N 444.894 4.287 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)cc1F 1657763981 ZCXMLTGQQITABT-OALUTQOASA-N 439.575 4.101 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)N[C@@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1657875749 GSBWUGWVPQGDRQ-LEWJYISDSA-N 435.612 4.352 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(Cc2nc([C@@H]3C[C@H]3C)no2)CC1 1673743164 AYSLYNQJCJOKJU-KGVIQGDOSA-N 439.604 4.163 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC[C@@H](C(F)(F)F)O3)cc2Cl)C1 1680562819 NGIQWYCJRRUYTR-SIIHOXLZSA-N 433.902 4.485 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1680702689 AYCSEWWCDMHVCK-QGZVFWFLSA-N 446.954 4.271 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H](Cn1ccccc1=O)c1ccccc1 1681822629 MMBCVNQMYBNNLB-DEOSSOPVSA-N 430.552 4.031 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1C[C@@H](C)[C@@H](F)C1 1693008509 LBKYZQNTJHBGNI-HLRQEUIKSA-N 443.611 4.414 10 10 IICE CCOCc1nnc(N2CCCC[C@@H](SCC)C2)n1Cc1ccc2c(c1)CCCN2C 1729051413 CVQFPRJCAARTKV-OAQYLSRUSA-N 443.661 4.357 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1749981396 GWEWDUCSLSSHPN-SIKLNZKXSA-N 429.609 4.050 10 10 IICE FC1(F)CCN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)CC1 1770713128 WKHRKNOWUJECLJ-CQSZACIVSA-N 429.562 4.047 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2nc(C)cs2)sc(C)c1-c1ccc(C)cc1 1860764634 BLJLBBJYWBDRFS-UHFFFAOYSA-N 429.523 4.161 10 10 IICE COC(=O)c1c(NC(=O)[C@@H](N)Cc2ccc(O)cc2)sc(C)c1-c1ccc(C)c(C)c1 1866018353 VDBSJLHIPULHTG-IBGZPJMESA-N 438.549 4.341 10 10 IICE COCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2cccs2)C1=O 1873165342 IXWDREOIZUVXRL-UHFFFAOYSA-N 449.576 4.062 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(NCc2cc(Cl)cc(Br)c2O)C1 2033965973 DJPZQJXKATZNSV-KZULUSFZSA-N 431.758 4.297 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cccc(Br)c2O)[C@H]2CCCC[C@H]21 2122806082 WWTZAYWLLNPKIZ-HYVNUMGLSA-N 425.367 4.422 10 10 IICE O=C1C(=Cc2ccccc2)SC(=S)N1CCCCCC(=O)N1CCCC[C@@H]1CCO 2296567510 DNOHGBBVRNMVBK-LJQANCHMSA-N 446.638 4.212 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N([C@H](C(=O)O)[C@@H](C)CC)C1=O)C(C)=O 2314927362 DNRRYXQCQNBQPB-QITLCBANSA-N 435.567 4.134 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380760626 ZBHKSSWNEASSLA-CQSZACIVSA-N 441.366 4.069 10 10 IICE CC1(C)OC(=O)C(=CNc2ccc(C(=O)Nc3cccc(C(F)(F)F)c3)cc2)C(=O)O1 20116399 REXZRNKBASEMDM-UHFFFAOYSA-N 434.370 4.090 10 10 IICE COC(=O)c1ccc(N2C(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)cc1 33305450 MJFAILXRFZNXAG-OQLLNIDSSA-N 434.882 4.441 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@@H](C(=O)NCc4cccc(F)c4)[C@@H]3C2)cc1 104914870 IVXDRHJUAOJLMH-RSXGOPAZSA-N 445.538 4.018 10 10 IICE COc1ccc(O)c(C2=NN3[C@@H](C2)c2cccc(OC)c2O[C@H]3c2ccc(O)c(OC)c2)c1 245297718 WPFQZSRAWPPQMV-DFBJGRDBSA-N 448.475 4.366 10 10 IICE Cc1ccc(N=Nc2cc(C)ccc2NC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1 255379764 FJWWOGGCKSBMAG-DODAUVCRSA-N 428.492 4.464 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)c1cn(-c2ccccc2)nn1 761786792 OYZCJRTVEMRNAG-AWEZNQCLSA-N 444.333 4.028 10 10 IICE COC(=O)Nc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1F 766876201 MOTKOXKYXPQMOK-UHFFFAOYSA-N 438.503 4.364 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 772558067 NFHHLOJBPZCMFS-OXJNMPFZSA-N 433.346 4.464 10 10 IICE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 779706669 VWWDNPVAZLFRSY-YLJYHZDGSA-N 443.544 4.343 10 10 IICE O=S(=O)(/C=C/c1ccc(Br)cc1)NCc1cc(Br)ccc1O 796191274 IOLQWHWKZLWKRA-BQYQJAHWSA-N 447.148 4.008 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)/C=C/c3ccccc3F)cc2)cc1 799913606 VQTNJWYFCZDHKR-CCEZHUSRSA-N 446.525 4.348 10 10 IICE O=C(NCc1cc(F)cc(Br)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 918131451 ZLIZJCPXTUCSQW-GOSISDBHSA-N 437.309 4.185 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)nc3)c2C)c1 918576163 QAKGGFDTZPZIEY-WOJBJXKFSA-N 432.568 4.341 10 10 IICE CSc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 919924849 YKLWVKPMXCCAQW-UHFFFAOYSA-N 439.503 4.263 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCN2C(=O)c3ccccc3C2=O)cc1 1125466123 OUDQPMQIQGPRBQ-UHFFFAOYSA-N 441.491 4.194 10 10 IICE Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)c(F)c2)cc1 1133847030 CLSFJTQGLKBRBT-UHFFFAOYSA-N 445.538 4.433 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(Br)cccc3cn2)N(C)C)cc1 1134686649 QWGVYHISEIVJQJ-OAQYLSRUSA-N 441.373 4.096 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1142370529 CSMPMQBQWOWSNF-GLDPYIMESA-N 444.019 4.390 10 10 IICE CC(C)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)Cc1ccccc1 1146669729 ZFUMMKIUJAUAKF-UHFFFAOYSA-N 444.578 4.253 10 10 IICE O=C(Cc1scnc1-c1ccccc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150346861 CETZTGCRMAOLDZ-LJQANCHMSA-N 441.984 4.492 10 10 IICE CC(C)[C@H]1CN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c2ccccc21 1194000877 ZFWOPFYCUZRRRA-WOIUINJBSA-N 439.575 4.315 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCOCC(F)(F)C(F)F)cc2Cl)C1 1227208695 PVHJIMMBKYIUDX-CYBMUJFWSA-N 439.881 4.293 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3csc(C4CCCCC4)c3)cc2)C1 1264737774 HIJNPZBXTPEXEB-IBGZPJMESA-N 425.598 4.428 10 10 IICE C/C(=C/C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1OC(F)F 1275224266 AHDHSEDNABVBFZ-UVTDQMKNSA-N 438.421 4.123 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cc2ccn(CC(F)(F)F)n2)cc1 1293123306 QJKWTRMRZIUEMQ-UHFFFAOYSA-N 446.473 4.296 10 10 IICE O=C(COc1cccc(C(F)(F)F)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860435 SLQSIFIHWYUCKU-KRWDZBQOSA-N 442.865 4.224 10 10 IICE CC(=O)N1C[C@@H]2CCC[C@H](NCc3ccc(N4CCCCC4)c(Br)c3)[C@H]2C1 1308424371 SOMAPAIHWXZFDF-ZJOUEHCJSA-N 434.422 4.176 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(OC(F)(F)F)c3)cc2F)C[C@H](C)O1 1354657137 JWMOPBONJNEPLD-KBPBESRZSA-N 426.410 4.268 10 10 IICE CCC1(CC)[C@@H](OC)C[C@H]1N(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357356066 LCVFGMDEVDWHBD-RPWUZVMVSA-N 425.617 4.460 10 10 IICE Cc1cc(-c2nnc(N3CC=CCC3)n2CCCNC(=O)C(C)C)c(C)n1-c1ccccc1 1361048937 NPOVLIYFOZBRDZ-UHFFFAOYSA-N 446.599 4.281 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(F)c(Br)c1 1438885678 GBQNBOVKZVDPSL-MRXNPFEDSA-N 448.380 4.150 10 10 IICE Cc1cc(C(=O)NCCOCc2ccccc2)c(C)n1-c1ccc(Br)cn1 1445122087 DDZHFLDTWWWBHM-UHFFFAOYSA-N 428.330 4.198 10 10 IICE COc1cc2c(cc1CNC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)O[C@@H](C)C2 1446384071 UQBQEMVTPNRCOC-KRWDZBQOSA-N 432.520 4.098 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1450720833 DKGUTKFOCQCNKL-YGRLFVJLSA-N 433.332 4.076 10 10 IICE Cc1cc(CC(=O)Nc2cccc(N3C(=O)NC(C)(C)C3=O)c2)c(C)n1-c1ccccc1 1459621170 XUZMZPIMJOZOLW-UHFFFAOYSA-N 430.508 4.110 10 10 IICE COC[C@@H](Cc1ccccc1)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1465654141 BPGODCLSKLKRLI-LJQANCHMSA-N 442.357 4.239 10 10 IICE Cc1nc(C(=O)NCc2cccc(Br)c2O)nn1-c1ccccc1C(C)C 1467763214 FULGKTKGHGCOON-UHFFFAOYSA-N 429.318 4.097 10 10 IICE CC[C@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cccc(OC)c1OC 1471136731 YKERISUVUSMXSV-ICSRJNTNSA-N 428.529 4.251 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2c(O)ccc3ccccc23)c1 1472085458 TWWOXQBCQHQIEO-UHFFFAOYSA-N 446.956 4.206 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1C[C@@H]1CCCN1C(=O)OC(C)(C)C 1517148690 QTAJWHSGCWEBSF-IBGZPJMESA-N 441.576 4.287 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C)CCC1 1517571079 QPFAZEVZPQXKLV-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]3CCC[C@H]32)n1Cc1ccc(N(C)C)c(F)c1 1519302280 GDJLPZULUPCJEP-YFVAEKQCSA-N 445.583 4.024 10 10 IICE CCN(c1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1)C(C)C 1526015254 KIEUAUDKXWOPSZ-UHFFFAOYSA-N 434.628 4.383 10 10 IICE CCOC(=O)C[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1cccc(OC)c1 1526020878 AAUOHGRBYDWJPT-XMMPIXPASA-N 434.536 4.456 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](F)c3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1530968249 MOJHDYBCIKEXAK-IBGZPJMESA-N 426.410 4.082 10 10 IICE Cc1cc(CC(=O)NCCNC(=O)c2ccccc2C(F)(F)F)c(C)n1-c1ccccc1 1533900688 UNUWYPOIOJFSLL-UHFFFAOYSA-N 443.469 4.202 10 10 IICE CCCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cc1OCCC 1534277961 HXGNGXFBKWQJGB-UHFFFAOYSA-N 442.556 4.244 10 10 IICE CC(=O)N[C@@H]1Cc2ccccc2N(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1536311949 JFFRQRDTPWBPTQ-JOCHJYFZSA-N 435.955 4.384 10 10 IICE COc1cc(Cl)ccc1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1538376889 ROAZONJEOUGDON-UHFFFAOYSA-N 425.960 4.386 10 10 IICE C[C@@H](c1cccs1)N(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1541795682 GQLKAVYYJVZTNO-HNNXBMFYSA-N 439.564 4.191 10 10 IICE CCO[C@]1(c2nnc(N3CCC(C)=C(C)C3)n2CCCSc2nccs2)CCOC1 1547889021 OPCLGUQBLNBQAZ-OAQYLSRUSA-N 449.646 4.116 10 10 IICE C[C@@H](Nc1ccccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 1556582132 IERXYYGOQPYYPT-OAHLLOKOSA-N 425.510 4.189 10 10 IICE CC[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)NC(=O)OC(C)(C)C 1556692412 LWISXWUPRJYKLB-HXUWFJFHSA-N 427.545 4.248 10 10 IICE Cc1ccc(CN2CCCN(C(=O)CN3CCCc4cc(OC(F)F)ccc43)CC2)cc1 1559605101 DNECEWINLVNMAV-UHFFFAOYSA-N 443.538 4.084 10 10 IICE C[C@@]1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CC1(Br)Br 1570027793 XKRNDCZNSNXYIG-NSHDSACASA-N 431.939 4.211 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(-n2cc(Br)cn2)cc1 1584090203 XQWABJCVOLICBH-MRXNPFEDSA-N 441.373 4.370 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC(NC(C)C)CC1 1611963373 ODXRUXFXUCRWSD-UHFFFAOYSA-N 426.653 4.256 10 10 IICE CCC(CC)NC(=O)c1nnc(N(CC)CC)n1Cc1ccc(N2CCC(C)CC2)cc1 1613536044 OONNCLGFUMTNFF-UHFFFAOYSA-N 440.636 4.327 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](CC(N)=O)C1 1614272846 QWNNBSMWRFDDII-AEVNEEFTSA-N 446.599 4.411 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC[C@H]2CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1618252209 BCXQJONKUJHWCG-DOTOQJQBSA-N 444.403 4.409 10 10 IICE CC(=O)Nc1ccccc1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1620576025 DUHOSLPMOIOIIN-UHFFFAOYSA-N 441.329 4.140 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@H](CC(=O)OC(C)(C)C)C2)CCCC1 1621984442 AROFSXZUMROLNY-SFHVURJKSA-N 440.584 4.499 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(Oc2ccncc2)c1 1623928071 DHQAIKPRPBBHSG-UHFFFAOYSA-N 426.856 4.048 10 10 IICE Cc1cc(C(=O)NCC(=O)Nc2ccc(-n3cccn3)cc2)c(C)n1-c1ccc(Cl)cc1 1626337685 CGVSKEIIYHYRFY-UHFFFAOYSA-N 447.926 4.302 10 10 IICE Cc1cc(N(C)C)cc(C)c1CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1630275309 PVCFWEBVQMFJQR-SFHVURJKSA-N 431.527 4.299 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1ccc(Cl)c(Cl)c1 1630280635 OTJJDQXOZMPNSV-SCLBCKFNSA-N 445.293 4.413 10 10 IICE CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(Cl)ccc1O 1632228507 OONLWTKIOPKWBC-LJQANCHMSA-N 443.931 4.279 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(O[C@H](C)c4ccccc4)nc3)C2)cc1 1643351370 SEINMPSYGVSLHY-WOJBJXKFSA-N 431.536 4.487 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3CCC3CCCC3)cc2F)C[C@@H](C)O1 1644947623 XSSUUGQFKZBHPZ-MZKRTTBSSA-N 445.623 4.490 10 10 IICE COc1ccc(Cn2nnnc2SCC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1 1652560032 YLYMTERQAYCMAH-UHFFFAOYSA-N 433.537 4.113 10 10 IICE COc1ccc(CN(CC(=O)NCc2ccc(N(C)C)cc2)C2CCCCC2)cc1OC 1652934230 JDWQSHPIPNXFBP-UHFFFAOYSA-N 439.600 4.221 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@H](C)C(=O)OC(C)C)sc(C)c1-c1ccccc1 1653774485 IBDCMRTVLBADGE-OAHLLOKOSA-N 446.569 4.111 10 10 IICE CC[C@@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1655293722 XGYFLSAKZPJCJV-FUMQJTLXSA-N 445.554 4.110 10 10 IICE CCOc1ccccc1CN1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)[C@H](C)C1 1658397926 YPEBCLVNFXOYOB-JOCHJYFZSA-N 437.628 4.407 10 10 IICE Cc1ccc(-n2cnc3c2CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C3)cc1 1682100886 GWJBUNZBCITVQQ-HXUWFJFHSA-N 431.584 4.254 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCSC[C@@H]3c3ccc(Cl)cc3)C2)cc1 1683945821 WVBUMFDDTWZLBQ-GHTZIAJQSA-N 431.989 4.427 10 10 IICE C[C@@H]1CCCN(CCCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1693682151 JUZVLJDVWXKDAK-HXUWFJFHSA-N 434.588 4.194 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCOC 1708339076 FNMDNPHNGHKYSF-CJAUYULYSA-N 439.604 4.232 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(C)CC1 1711384897 XQNRDLXXFKSIAC-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CCO1 1727981932 DFHSRZJHJVPBOM-MRXNPFEDSA-N 433.603 4.491 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C(C)C)N1CCCC1 1730964726 MJRKWRXOJHALOL-QHCPKHFHSA-N 436.604 4.471 10 10 IICE Cc1ccc(-c2nnc(N(C)C[C@H]3CCCCO3)n2CCCSc2nccs2)o1 1742184073 QXUGPDOLCYUHRG-MRXNPFEDSA-N 433.603 4.491 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCCC[C@@H](COC)C2)cc1 1746089288 KLAMYAVNHQQBLH-JOCHJYFZSA-N 448.615 4.488 10 10 IICE C[C@H]1C[C@@H](C)CN(C(C)(C)Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1762701633 DGUGELJVWQLTAF-BGYRXZFFSA-N 448.615 4.439 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCOC1CCCCC1 1764913808 JGMCLRIBUDPIEZ-UHFFFAOYSA-N 445.583 4.054 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1765523428 MMVPSCZRUVCWNI-SIKLNZKXSA-N 427.593 4.029 10 10 IICE COc1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)[C@@H](C)C(=O)N3)cs1 1859573394 JFPPGISPLYUEHD-SNVBAGLBSA-N 449.941 4.329 10 10 IICE COc1cccc(OCC(=O)N(c2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)c1 1859888984 AZXKVTRQGSFCRS-UHFFFAOYSA-N 429.472 4.291 10 10 IICE CCn1cc(OCc2n[nH]c(=N)s2)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1871025553 PEQRWBVMKLENKZ-UHFFFAOYSA-N 448.552 4.067 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1O 2227747786 FUNWFXKSQLPNNL-ZDUSSCGKSA-N 429.355 4.043 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Sc4ccc(C)cc4)o3)C2=O)cc1 2293308737 IWEGADIICZFASP-UHFFFAOYSA-N 434.473 4.414 10 10 IICE COc1cc(C=C2SC(=S)N(CNc3cccc(C)c3)C2=O)cc(OC)c1OC 2313503159 VQMVTWKPLXQRLF-UHFFFAOYSA-N 430.551 4.292 10 10 IICE CC(C)c1ccc(C=C2C(=O)NC(=S)N(c3ccc(Br)cc3)C2=O)cc1 2313561238 ZXAOLJAZJMXUTK-UHFFFAOYSA-N 429.339 4.404 10 10 IICE CCCCCCN1C(=O)C(=Cc2c(NCCC)nc3ccccn3c2=O)SC1=S 2314414769 LRVBIEOTDURATN-UHFFFAOYSA-N 430.599 4.298 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2314831642 PBCXQVCLTJEEAA-UHFFFAOYSA-N 427.507 4.215 10 10 IICE COc1ccc2c(c1)c(C=C1SC(=S)N([C@@H](C(=O)O)c3ccccc3)C1=O)cn2C 2323865427 AJXGYZVXGAWROS-LJQANCHMSA-N 438.530 4.214 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)c(O)c1Br 2352947305 RFELEVNRMAJEKF-XHSDSOJGSA-N 425.367 4.198 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](C)C(C)(C)NC(=O)OC(C)(C)C)c(O)c1Br 2381138632 XELMBPFLFDGQIN-CYBMUJFWSA-N 443.382 4.409 10 10 IICE COc1ccc([C@H](CC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)NC(C)=O)cc1 109295348 VKARUDICWIEPQJ-VWLOTQADSA-N 437.584 4.348 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 226697156 NTABJDONIMPISH-PQNGQFLHSA-N 434.540 4.493 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cn(C)nc2-c2ccccc2)C1 436028228 NYXDWERIQYUBCW-UHFFFAOYSA-N 427.552 4.447 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C(=O)c2ccc(Br)cc2)cc1 733931351 TXURDRCXEKZPHF-UHFFFAOYSA-N 443.263 4.289 10 10 IICE COc1ccccc1C(=O)N1[C@H](C(=O)NCc2ccc(N(C)C)cc2C)C[C@@H]2CCCC[C@@H]21 734401916 GKTLDGZUXFJUFH-IGKWTDBASA-N 449.595 4.159 10 10 IICE C[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1ccc(N2CCOCC2)cc1 741182963 MEVDGCIIRNMSSI-YSSFQJQWSA-N 434.458 4.403 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 745808318 DIFPKFMOBWQOHF-HXUWFJFHSA-N 432.609 4.320 10 10 IICE COc1c(C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)cnc2c1cnn2C 752372077 OFSNWZDOSQBIEO-UHFFFAOYSA-N 444.451 4.188 10 10 IICE C[C@@H](NCc1ccc(Cn2ccccc2=O)cc1)c1cc(Br)cc(F)c1O 756480438 WPVZRCIRAJUGOU-CQSZACIVSA-N 431.305 4.355 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H](C)c3ccc(Cl)s3)CC2)cc(OC)c1OC 759217881 ZBHPXPQPCLRWQY-ZDUSSCGKSA-N 439.965 4.020 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 778992019 PRMWKRROWMLETN-CQSZACIVSA-N 441.366 4.150 10 10 IICE CCOc1ccc(O)c(CN(C)Cc2cccc(Br)c2OCC(C)(C)O)c1 786578224 DUIFOYWRYVBFKS-UHFFFAOYSA-N 438.362 4.335 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cnn(-c4ccccc4C)c3C(F)F)CC2)cc1 1125323220 XKEUVYDFRZUQQA-UHFFFAOYSA-N 440.494 4.479 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@H]3c3ccccc3OC(F)(F)F)C2)cc1 1129993182 KIWQYOGHZOZBRZ-UIAACRFSSA-N 434.458 4.340 10 10 IICE COc1ccc(-n2ccc(CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)n2)cc1 1142263643 PHNWQAWYWBBQOQ-UHFFFAOYSA-N 428.492 4.031 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1)N(C(=O)c1cc2cc(O)c(O)cc2s1)C1CC1 1144002974 DZTAGDMQVGFIFT-KRWDZBQOSA-N 425.506 4.092 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(C)c4ncccc4C3)cc2Cl)C1 1235832720 GJWPQPHEJIENJR-QGZVFWFLSA-N 427.980 4.133 10 10 IICE C[C@@H](NC(=O)[C@H]1CCOc2ccc(Br)cc21)c1ccc(N2CCOCC2)cc1 1264822322 NJLVDXAQMCUTMJ-BEFAXECRSA-N 445.357 4.029 10 10 IICE C[C@H](NC(=O)[C@@H]1CCOc2ccc(Br)cc21)c1ccc(N2CCOCC2)cc1 1264822324 NJLVDXAQMCUTMJ-HNAYVOBHSA-N 445.357 4.029 10 10 IICE CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1292581789 GIMJYSMNBUNUPW-JOCHJYFZSA-N 431.024 4.236 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccccn4)n3CCCC(C)C)CC2)cc1F 1300247317 LQMVYAXPDFKFTJ-UHFFFAOYSA-N 438.551 4.251 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(C)CCOCCNC(=O)OC(C)(C)C)c1C 1302236843 OZNXEIGLJWMCDK-UHFFFAOYSA-N 429.561 4.016 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC2CC2)c2ccc(OC)cc2)sc2c1CCC2 1307781070 VKLLZFJLEKOYNR-UHFFFAOYSA-N 428.554 4.277 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1(c2ccccc2)CC1 1352259935 YMOTWCKRNOOPFC-JXAWBTAJSA-N 426.538 4.223 10 10 IICE Cc1cccc(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1Br 1356036369 FRDSSALDLKZNBU-HZPDHXFCSA-N 449.364 4.369 10 10 IICE CSc1cc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1Br 1356167015 XZXAFGWIPUFMOB-AWEZNQCLSA-N 435.387 4.499 10 10 IICE COCCOc1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1F 1357433428 XCVHCOKPVBIRSZ-UHFFFAOYSA-N 426.488 4.332 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)NCc2ccc3c(c2)CCCN3C)cc1 1442399175 AXSLYRIAYQKIQV-UHFFFAOYSA-N 439.357 4.256 10 10 IICE Cc1cc(C(=O)NC2(C(N)=O)CCC(C)(C)CC2)c(C)n1-c1ccc(Br)cc1 1446293942 MAVBGFNWRBLCRY-UHFFFAOYSA-N 446.389 4.411 10 10 IICE COc1cc(Br)ccc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 1466650572 ZSPNAWNDKGUSGX-UHFFFAOYSA-N 432.362 4.240 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)C[C@@H]3CCCO[C@@H]3c3ccccc3)C2)cc1 1478860714 RAUYOQXATQSEBR-JLRUASKGSA-N 437.584 4.331 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)O[C@@H]1COc2ccccc21 1520031441 NGMPMIAWTYSMOJ-LVSMMTLPSA-N 429.494 4.094 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 1525106811 MPZQHGOKXTVLSU-WMZHIEFXSA-N 443.950 4.257 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@H](C)C2 1525452648 DENUVMRZYMAFIU-JKSUJKDBSA-N 440.565 4.430 10 10 IICE CC(C)Oc1cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccc1[N+](=O)[O-] 1525592869 AEUWBLNMOWEWOY-UHFFFAOYSA-N 430.416 4.410 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc1 1528643919 RGAFUAONTYSHSI-UHFFFAOYSA-N 448.411 4.048 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3cccc(C(C)C)c3)cc2F)CC1 1528701596 MKTAZHDXEXTTCD-LJQANCHMSA-N 427.564 4.175 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1=Cc2cc(Br)ccc2OC1 1528924617 PVOHIXUSIJFNCJ-OAHLLOKOSA-N 429.358 4.347 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)COc3c(Cl)cc(Cl)cc3Cl)C2)cc1 1532104433 BSIUTHGAEXVIKD-CYBMUJFWSA-N 429.731 4.429 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3c(Cl)ccc(Cl)c3Cl)cc2)CC1 1537840233 WJICKGBGFVYFNU-UHFFFAOYSA-N 440.758 4.279 10 10 IICE CN(C)c1ccc([C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 1559184053 SPAUIMPTKOTIBF-MRXNPFEDSA-N 435.912 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@@H]1c1nnc([C@H]2CCCO2)o1 1564946470 PZZYJAZSVDZYFP-IOMROCGXSA-N 441.576 4.163 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3ccc(Cl)c(Cl)c3)CC2)cc1F 1566346819 NEHXVVTVBPEFME-UHFFFAOYSA-N 427.303 4.259 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1nn(-c2ccc(F)cc2)ccc1=O 1597566968 DJRXDBIULYLJRK-SFHVURJKSA-N 443.478 4.481 10 10 IICE COc1ccc(OCCSCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1613514905 DZCNKNQMRNDRFE-UHFFFAOYSA-N 447.512 4.221 10 10 IICE CCN(CC)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)cc1C 1615386389 MFRDJGCQTXRXTP-UHFFFAOYSA-N 431.382 4.305 10 10 IICE Cc1csc(CNc2cccc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)n1 1624537557 MPPAFPYGDUQSGG-UHFFFAOYSA-N 436.581 4.172 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2cccc(Br)c2O)cc1)[C@H]1C[C@H]1C 1625066571 LCUIBYYSLKUDQB-XIKOKIGWSA-N 432.318 4.238 10 10 IICE CC(C)(C)OC(=O)N1CCC(OC(=O)c2ccccc2NC(=O)c2cc(O)cs2)CC1 1626466668 KYSLBVNJJUKHJK-UHFFFAOYSA-N 446.525 4.262 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1C[C@H]1C1CCCC1 1627953420 JRBUQPHEAUXTIH-FUKXBTRTSA-N 432.586 4.360 10 10 IICE CCO[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccc1 1629678640 FGOVHGBROGAHRB-FGZHOGPDSA-N 441.572 4.212 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cc(S(=O)(=O)Nc3ccccc3)ccc2Cl)c1 1629740653 LXXFGIOFMORJDR-UHFFFAOYSA-N 430.913 4.085 10 10 IICE COc1cccc(CNC(=O)NCC2(c3cccc(Br)c3)CCCC2)c1O 1633364533 SMBBEXPPPVHGLB-UHFFFAOYSA-N 433.346 4.475 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)c1 1635893547 JKDXOALJFBEJNY-UHFFFAOYSA-N 434.540 4.253 10 10 IICE O=C(CCOc1ccc(F)cc1Cl)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941770 VOLZROCCJBHPPX-KRWDZBQOSA-N 441.330 4.388 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NCc3ccc(-c4cccs4)cc3)cc2)CC1 1636758576 QAJLEKGCYKOROK-UHFFFAOYSA-N 448.592 4.116 10 10 IICE CCS[C@H]1CCCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 1644583994 JPCPJYOQXLMBHN-WMZOPIPTSA-N 436.577 4.397 10 10 IICE COC(=O)CN(CC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)Cc1cc(Cl)ccc1O 1652735254 VNNJVKSFMZRMGT-MRXNPFEDSA-N 440.968 4.058 10 10 IICE COc1ccc(C[C@H](C)CNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1OC 1679664964 KOWMGJIFWFWCPN-IBGZPJMESA-N 425.573 4.324 10 10 IICE Cc1cccc([C@H](NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccn2)c1 1679703668 UFAVQRSAJKJVJK-DQEYMECFSA-N 431.584 4.148 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@H](C)C1)OC 1694370418 SOBDPFFSXUYEGW-WOIUINJBSA-N 437.588 4.391 10 10 IICE C[C@@H]1CCCCN1CCCCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O 1726552953 XNCAYCMERJXSGU-DENIHFKCSA-N 427.593 4.126 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1726843000 JIYSARJTAXNEHM-KBMIEXCESA-N 443.636 4.098 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H](OC)C(C)(C)C)CC2)cc1 1730180451 QHCNITYZIFUKMN-JOCHJYFZSA-N 443.636 4.263 10 10 IICE COCCC(C)(C)Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1730621823 MJBSLYCFKWCDSZ-UHFFFAOYSA-N 441.620 4.081 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@@H](C)C3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1742120214 WOBDCVABUSYTKY-KDURUIRLSA-N 448.615 4.313 10 10 IICE Cc1ncsc1CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1761612468 WKTLCOJGFZQEHE-UHFFFAOYSA-N 440.960 4.343 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@H]1OC 1771066135 MLRNFSVFLRCHPJ-NFBKMPQASA-N 437.588 4.250 10 10 IICE COc1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CC(=O)N3)c(C)s1 1859573927 WISHAZUACKWDPL-UHFFFAOYSA-N 449.941 4.076 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H](NCc3cc(Cl)cc(Br)c3O)[C@@H]21 1965929876 QAPQKGRPJWILQN-BPLDGKMQSA-N 431.758 4.296 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@H]1NCc1cccc(Br)c1O 2144144699 LKDXLQQDKRJCFM-MSOLQXFVSA-N 433.346 4.435 10 10 IICE CCCOc1cccc(C=C2SC(=S)N(C3CCN(C(=O)OCC)CC3)C2=O)c1 2323858263 ZOMXHVSRRNPOTC-UHFFFAOYSA-N 434.583 4.298 10 10 IICE Cc1ccc(CN[C@@H]2CN(Cc3ccccc3)CC(F)(F)C2)c(O)c1Br 2352680651 OSQALAPQKZEPOQ-KRWDZBQOSA-N 425.317 4.463 10 10 IICE Cc1ccc(CNC[C@H]2[C@H]3CN(C(=O)OC(C)(C)C)CC[C@@H]32)c(O)c1Br 2352944278 FXUZSQWHUKZVRG-OAGGEKHMSA-N 425.367 4.056 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccc(C)c(C)c3)=NC2=O)ccc1OCC(=O)O 16916132 IEFSLSAEFPEBPX-YBFXNURJSA-N 426.494 4.248 10 10 IICE O=C(O)[C@H](c1ccccc1)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 16930141 UWGHIIVMJODBSH-LTBFUDJGSA-N 434.336 4.476 10 10 IICE CCCCOc1ccc(/C=C2\SC(Nc3ccccc3C(N)=O)=NC2=O)cc1OC 39869826 UARLNLSVVMYIPU-UYRXBGFRSA-N 425.510 4.055 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(OC)c1OC 59397805 OLVQQYVIZDGFGT-YBEGLDIGSA-N 432.479 4.026 10 10 IICE CCOc1cccc(CN2CCC[C@H](COc3ccccc3C(=O)NC(C)C)C2)c1O 169765053 QSHQUINBTGOGRZ-IBGZPJMESA-N 426.557 4.220 10 10 IICE Cc1cccc(Oc2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(C)C2=O)c1C 213198959 WNOVNUSFVXZNHX-BOPFTXTBSA-N 437.546 4.243 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2ccccc2-n2cccn2)C1 435815521 DKICKTFZEJRBJS-HXUWFJFHSA-N 441.579 4.471 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)cc1OC 526382989 VMVIRCBOGFWLHQ-HSZRJFAPSA-N 433.460 4.481 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(NC(=O)N2CCCC2)cc1 586663468 NBIINPIJPAMIFH-UHFFFAOYSA-N 439.471 4.342 10 10 IICE CC(C)[C@H](NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2)C(N)=O 730509226 RNEQTYXSCBKGFP-BAJVAIGLSA-N 442.563 4.027 10 10 IICE COC(=O)/C=C\c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1 747857317 MQYUUKLOLHEDJQ-WTKPLQERSA-N 436.461 4.075 10 10 IICE FC(F)(F)c1cc(N2CCOCC2)ccc1CNCc1cnc(-c2ccccn2)s1 753365641 HIXAQHCRCIMUMT-UHFFFAOYSA-N 434.487 4.350 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(-c4csc(C)n4)s3)CC2)cc1F 753930631 HNZBMCVQHLRKFW-UHFFFAOYSA-N 446.573 4.360 10 10 IICE C[C@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)c(F)cc1O 757637616 LIQBDZCMNZGCAU-FZMZJTMJSA-N 449.299 4.357 10 10 IICE C[C@@H](Nc1cccc2c1CCN2S(C)(=O)=O)c1cc(Br)cc(Cl)c1O 757695316 DEOXRUOLRKOFRJ-SNVBAGLBSA-N 445.766 4.303 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)c(C)n1-c1ccccn1 769377062 JYDPFYFTCOCKRE-SFHVURJKSA-N 431.458 4.089 10 10 IICE CN1CCC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1c1ccc(C(F)(F)F)cc1 779518655 LLMSEOAYRDHLTM-WKUSZTRCSA-N 434.458 4.329 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cnc(-c4cnn(C)c4)s3)cc2Cl)C1 800048769 BXFZVYJITHJTJD-AWEZNQCLSA-N 429.977 4.363 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)[C@](C)(CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 811605552 ZESVNBFCPHTCOW-VOIUYBSRSA-N 426.561 4.112 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1c1ccc(F)cc1 917642426 NIHONRYQPCRNBQ-XFFZJAGNSA-N 431.251 4.429 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)cc1 1136643830 YMJWKHNZDZVEGU-VWLOTQADSA-N 443.591 4.130 10 10 IICE Cc1ccc(CNC(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1139137374 BOPBTGCCDOBAMJ-SFHVURJKSA-N 442.991 4.000 10 10 IICE COc1cc(Cl)ccc1OC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1142464080 DYSNUWODKVQEQZ-UHFFFAOYSA-N 439.898 4.136 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2c(F)c(F)c(Br)c(F)c2F)cc1 1142805168 PSWPNPAUADXXAQ-UHFFFAOYSA-N 433.159 4.098 10 10 IICE COc1cccc(CNC(=O)c2ccc3c(c2)[C@@H](CNC(=O)OC(C)(C)C)CCC3)c1O 1150543353 MKHVVNKUWCCIFC-GOSISDBHSA-N 440.540 4.275 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(Cc4cccc(C(F)(F)F)c4)C3)C2)cc1 1252115171 INOJVYZAWLFWFV-SFHVURJKSA-N 447.501 4.424 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H](c2ccc(F)cc2F)c2nccn2C)cc1 1256214791 AFLVQHUNABLREI-QFIPXVFZSA-N 441.526 4.476 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@@H](C(F)F)C1CCCCC1)c2[N+](=O)[O-] 1279943704 XXBQRHUTCRDNDX-GOSISDBHSA-N 442.418 4.314 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccsc1 1289423598 MFBXTQGANLILIE-UHFFFAOYSA-N 432.597 4.385 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ncc(Br)cc3O)cc2Cl)C1 1297010059 LSDQRCQOMSBOOA-GFCCVEGCSA-N 438.753 4.369 10 10 IICE CCCCN(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCC[C@H](C)C1 1298617596 NGBOJIJEPAHIJZ-UTEMQFSSSA-N 441.616 4.107 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C)C3)n2CCOC(C)(C)C)c(C)n1-c1ccccc1 1304197256 RZTQQRRRSZHKKF-IBGZPJMESA-N 437.588 4.393 10 10 IICE CCN(c1nnc([C@@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C)C1CCCC1 1313579599 MVCLEVMXZZTLRH-LJQANCHMSA-N 441.620 4.202 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)C1(C)C 1314257655 RYXQBHVHAOVINU-NHCUHLMSSA-N 443.661 4.082 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(C)(C)C)C1 1315042109 FBDIAWUPCYTOAV-FQEVSTJZSA-N 448.615 4.361 10 10 IICE Cc1nc(O[C@H](C)C(F)(F)F)ccc1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1356167229 ZOYYAIKGTBYMPK-GDBMZVCRSA-N 437.462 4.047 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnc2c(cnn2Cc2ccccc2)c1 1436851275 HSLFSRFJXMTZJP-LJQANCHMSA-N 427.552 4.215 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1451641708 BAPDFNZHSVCESO-CVDCTZTESA-N 439.600 4.244 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3cccc(C(F)(F)F)c3nc2O)N(C)C)cc1 1456929087 GHUPWYZGLBIVFJ-IBGZPJMESA-N 446.473 4.058 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1 1463815359 ZEDIKGRNEXQTGF-UHFFFAOYSA-N 449.576 4.360 10 10 IICE COc1ccc([C@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccco2)cc1 1470541333 NCJTUHRPVQXDJC-DEOSSOPVSA-N 435.524 4.056 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccccc3)[C@H]3COC(C)(C)C3)C2)cc1 1470594024 QLIHDAPXFYGGDD-FYYLOGMGSA-N 437.584 4.301 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1cnc(C)s1 1495112319 VKJBZAZQCOKVBV-QGZVFWFLSA-N 440.617 4.078 10 10 IICE CC(C)Cc1nnc(N(C)[C@H]2CCCc3c2cnn3C)n1CCCSc1nccs1 1509127390 KSWIBNLGNNDJPX-KRWDZBQOSA-N 445.662 4.363 10 10 IICE C[C@H]1CN(C(C)(C)Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)C[C@H](C)O1 1512365915 RAYMIBZXCVBYGA-OALUTQOASA-N 443.636 4.097 10 10 IICE CCNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1 1515952761 HHQBCNOIWADIBF-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CC[C@H](C)C2 1529700774 HNFRANQGGQSXCD-UONOGXRCSA-N 444.528 4.180 10 10 IICE CC(C)(CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)CC(F)F 1536705322 HIXNHZJXWROBCE-NTEUORMPSA-N 430.517 4.215 10 10 IICE COC(=O)c1cc(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)oc1C 1540847704 LGPMFDAVTDUOCR-UHFFFAOYSA-N 445.313 4.475 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCCN(C(C)(C)C)CC1 1542227283 XWGCFTIHKMHERN-UHFFFAOYSA-N 426.653 4.210 10 10 IICE Cc1cc(C(=O)Nc2ccc(C3(O)COC3)cc2)c(C)n1-c1cccc(Br)c1 1570065474 QCIPOILITYRWAI-UHFFFAOYSA-N 441.325 4.327 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C)cc1 1585445272 YZARTSQASDXNRE-UHFFFAOYSA-N 446.473 4.417 10 10 IICE CCOc1ccc(CN2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1587629009 JSHBVZMHBQAWIQ-UHFFFAOYSA-N 445.563 4.263 10 10 IICE CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1595997582 XQXOABWFJFAROK-UHFFFAOYSA-N 445.541 4.077 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(Oc4ccccc4)cc3)CC2)cc1F 1611026008 HLDHKFMFCUPHQC-UHFFFAOYSA-N 436.483 4.354 10 10 IICE C[C@H]1C[C@H](C)CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C1 1612673086 XHIDCYWOKDCXAF-IRXDYDNUSA-N 428.631 4.385 10 10 IICE COC(=O)c1ccccc1OCCN(Cc1cccs1)c1ccc2c(c1)OCCO2 1615887244 QJTWQHVPVCMNHM-UHFFFAOYSA-N 425.506 4.392 10 10 IICE Cn1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1C(F)F 1627272226 XOIYDGQHUTVZCX-UHFFFAOYSA-N 447.243 4.082 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)c1 1629191556 YLMVTAQJQQWPSE-UHFFFAOYSA-N 431.580 4.289 10 10 IICE CC(C)(C)OC(=O)CC[C@@H]1C[C@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)CO1 1629944021 ZCXBYKFFSSHHNV-RBUKOAKNSA-N 429.513 4.041 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1oc2ccccc2c1Br 1634346936 AXONWALCHVVEND-UHFFFAOYSA-N 443.341 4.334 10 10 IICE Cc1cc(C(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)c(C)n1-c1ccc(C(C)C)cc1 1634904739 HQBOSMLZZAKXBP-OAQYLSRUSA-N 437.506 4.210 10 10 IICE Nc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cccc1C(F)(F)F 1635946989 ORRYGNFMBZVQOH-AWEZNQCLSA-N 427.854 4.041 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1CO 1636046942 MIKULGHWCTWOJF-UHFFFAOYSA-N 430.302 4.005 10 10 IICE COc1ccc([C@H](CNC(=O)OC(C)(C)C)CN2CCOc3cc(N(C)C)ccc32)cc1 1642567207 KMCHSVLZGPMEBQ-LJQANCHMSA-N 441.572 4.269 10 10 IICE Cc1cc(CNC(=O)CO[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1643366672 REGSGZVGJLNNKS-JOCHJYFZSA-N 441.572 4.126 10 10 IICE C[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)[C@H]1c1ccccc1 1644453081 RTQHQJSHCLZDJQ-FDDOMMOESA-N 439.575 4.139 10 10 IICE Cc1cccnc1[C@@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 1644901140 NZCUYYPSHZYEGN-HXOBKFHXSA-N 441.531 4.479 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C)c2C)cc1 1644916102 RSBILYBFDNAVLL-QVKFZJNVSA-N 427.545 4.088 10 10 IICE CNC(=O)c1cccc(N(C)C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1 1645925586 JDNCLVPEVPQGAU-UHFFFAOYSA-N 440.341 4.493 10 10 IICE COc1ccc(N2CCN(c3ccc(C(=O)Nc4ccc(C)cc4)cc3[N+](=O)[O-])CC2)cc1 1650856385 IKTWNZGAJSBDFP-UHFFFAOYSA-N 446.507 4.491 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@@H](CO)Cc1ccc(F)c(F)c1 1651027372 ORKCGCXMKFYYCU-INIZCTEOSA-N 426.419 4.367 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1651627742 SPZAJFGEBVURSK-UITAMQMPSA-N 435.274 4.276 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(=Cc4ccc(F)c(F)c4)CC3)cc2)CC1 1683701878 OETDFQUWQIOQOA-UHFFFAOYSA-N 440.538 4.106 10 10 IICE C=CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(=O)C1CCC1 1705835427 KIHDKTGUOQYXSE-UHFFFAOYSA-N 446.599 4.281 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOCCOC)C1 1727756942 PGNNFUJGNUZLNU-NRFANRHFSA-N 437.588 4.252 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)OC 1728448494 SVDWMSQNGHLNRU-LJQANCHMSA-N 447.587 4.148 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](C)c1ncc(C)s1 1763071000 SHJCPRZWHQFZGD-KRWDZBQOSA-N 440.617 4.134 10 10 IICE CC[C@@H](C)NC(=O)CCn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1763933778 RRQPHRYWWGCMEK-LJQANCHMSA-N 438.620 4.087 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OCCOCC)C1 1766041673 XDNCXWRRHVNVCO-QFIPXVFZSA-N 437.588 4.394 10 10 IICE O=C1/C(=C\c2ccccc2[N+](=O)[O-])SC(=S)N1C1CCN(Cc2ccccc2)CC1 1858594310 UCWHDOWJBRCTFQ-XSFVSMFZSA-N 439.562 4.461 10 10 IICE COc1ccc(Cc2nc3ccc(C(=O)Nc4cccc(N(C)C)c4)cc3[nH]2)cc1OC 1859438328 JIBTYRXATIDKIK-UHFFFAOYSA-N 430.508 4.489 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(COc4cccc(OC)c4)c3)CC2)cc1 1872846899 AWQFVMPQDULFFQ-UHFFFAOYSA-N 432.520 4.245 10 10 IICE CCN[C@H](c1ccccc1O)c1cc(I)ccc1Br 2090034425 HQJQDIBKKDNBQZ-OAHLLOKOSA-N 432.099 4.458 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)C3(CC3)C2)c1O 2236056330 UZVSPTFZNIIBHO-ZDUSSCGKSA-N 441.366 4.185 10 10 IICE CCN1C(=O)C(=Cc2ccc(OCCOc3ccccc3OC)c(OC)c2)SC1=S 2293394398 NHSALDQBAYKGHU-UHFFFAOYSA-N 445.562 4.383 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=CNCc2cccs2)cc1 2297349229 FWUMVKHGLJBFGE-UHFFFAOYSA-N 434.477 4.090 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314767066 DDYMIEIDWKIVDS-QGZVFWFLSA-N 428.491 4.100 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1ccc(Br)cc1O)[C@@H]2F 2333286526 ZAPHLZQKQDAQHM-AIANPOQGSA-N 429.330 4.123 10 10 IICE COC(=O)c1c(NC(=O)CCC(=O)OCCCc2ccccc2)sc2c1CCCC2 13998358 CZKYDICTURSOSH-UHFFFAOYSA-N 429.538 4.308 10 10 IICE COCCN1C(=O)/C(=C/c2cc3cccc(C)c3nc2N2CCCCC2)SC1=S 38732129 NBSDIZJNDMZFFS-JXAWBTAJSA-N 427.595 4.381 10 10 IICE CC(=O)N(C1CC1)[C@H]1CCOC2(CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)C1 169770217 ZPFHKXRPINGOHP-VWLOTQADSA-N 449.595 4.259 10 10 IICE COc1ccccc1N1C(=O)C(O)=C(c2cccc(OC)c2OC)[C@H]1c1ccc(O)c(O)c1 526405613 AMYFAJAIQAOOOQ-JOCHJYFZSA-N 449.459 4.181 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)c2n[nH]c(C)c2C)sc(C)c1-c1ccccc1 734619865 PWDIEESAJCHYLY-UHFFFAOYSA-N 441.509 4.036 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1Cl 749737354 FXPHUMWDIUPIND-UHFFFAOYSA-N 426.878 4.190 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(c2ccccn2)CC1 754663163 PEXYIACIKKWDEN-SFHVURJKSA-N 430.499 4.241 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H](c1cccnc1)C1CC1 760012061 PHIDSDBOKZQBQP-LYPXWFNGSA-N 443.619 4.392 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)n1Cc1ccncc1 762589399 JULYTMAHLPGNOE-VWLOTQADSA-N 446.595 4.436 10 10 IICE CN(Cc1c(F)cccc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769044938 XLDYSLFFEBPVDS-UHFFFAOYSA-N 444.982 4.353 10 10 IICE CCN1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 782518771 AUUUUTQPJBOTOX-GGAORHGYSA-N 444.501 4.115 10 10 IICE Cc1cc(C(=O)COC(=O)c2nc(Cl)cs2)c(C)n1-c1ccc2c(c1)OCCO2 789209657 ACZNIEFYHMSZMA-UHFFFAOYSA-N 432.885 4.015 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)/C=C/c2ccc(Cl)cc2)cc1F 1125465345 VIRYVWUHGYANMF-XAYKGCCJSA-N 443.950 4.256 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccncc1 1126373561 FJTVEQBRGPPXRB-CLEQQJOVSA-N 429.542 4.080 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2C[C@]2(C)c2cccc(Br)c2)cc1 1130547524 KZCSMYDVFMOLGK-RBBKRZOGSA-N 431.374 4.330 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1([C@H]2CCCCO2)CCC1 1132710815 JTJPZUIXVZOWRQ-HGLWPWQMSA-N 448.585 4.025 10 10 IICE Cc1cc(C(=O)CSCCN2CCOCC2)c(C)n1-c1ccc(OC(F)(F)F)cc1 1165462887 DXUWUIUXWUCULI-UHFFFAOYSA-N 442.503 4.241 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](C)c3ccc(-c4ccccc4)cc3)CC2)cc1 1168633010 JECDXEAVIXMJID-CUNXSJBXSA-N 445.607 4.196 10 10 IICE C[C@@H](NC(=O)c1cccc(S(=O)(=O)N(C)c2cccc(Cl)c2)c1)c1ccccc1O 1171717470 SWZLRQYPMLCVOY-OAHLLOKOSA-N 444.940 4.362 10 10 IICE COC(=O)c1cnc(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)s1 1178002590 RIYBSZUNNKVGPE-UHFFFAOYSA-N 448.342 4.030 10 10 IICE CN(c1ccc(CNC(=O)c2cc3nccc(C(F)(F)F)n3n2)cc1)C1CCCCC1 1292256647 GRYKZETZBKPBPT-UHFFFAOYSA-N 431.462 4.447 10 10 IICE C[C@@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1O 1302530346 MCKCSUZQXYCACU-CQSZACIVSA-N 430.913 4.337 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@H]1CCCO[C@@H]1C(C)(C)C 1314753218 MTNLFPNAAHEYDB-QPPBQGQZSA-N 449.599 4.447 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@@H]2C(=O)Nc3c(F)cccc32)sc2c1CC[C@@H](C)C2 1348718350 FYIORFPMSUXFKJ-RISCZKNCSA-N 430.501 4.253 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@H]2CCCS(=O)(=O)C2)sc(C)c1-c1ccc(C)cc1 1348914728 OBLUFARBZMULGV-MRXNPFEDSA-N 449.594 4.362 10 10 IICE CCOc1ccccc1CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1351233096 SDTUMCYSAJMOEB-CPNJWEJPSA-N 444.553 4.132 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2cccc(S(=O)(=O)NC(C)(C)C)c2)cc1 1351429743 ALMGLLYUBJOZMK-UHFFFAOYSA-N 425.554 4.423 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N(Cc1ccncc1)C1CC1 1353973729 JZZJYAVBAPSZSO-CPNJWEJPSA-N 441.553 4.003 10 10 IICE CC[C@H](c1ccc(F)cc1F)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1444104281 YMHWWBMWYBZWDO-QGZVFWFLSA-N 432.492 4.500 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@](C)(CNC(=O)OC(C)(C)C)C1 1467426402 BMHOBMYZIBTPJE-VWLOTQADSA-N 439.556 4.284 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1469683749 IMZJXPXDCYGZFK-OAHLLOKOSA-N 446.693 4.096 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCN3CC(F)(F)F)cc2Cl)C1 1469959671 LXCOPJSMGGWZLK-RDJZCZTQSA-N 446.945 4.402 10 10 IICE CCN(Cc1nc2c(s1)C[C@@H](C)CC2)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1470772332 JRMSQPLPQWZWNR-DLBZAZTESA-N 428.602 4.087 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@]2(C)CCO[C@H]2C2CC2)sc(C)c1-c1ccccc1 1473373263 RSGNYJXTRXKBFJ-XUZZJYLKSA-N 442.581 4.386 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1c2ccccc2C(=O)N1Cc1ccccc1 1478969228 ADKZLLPYNGANKB-VWLOTQADSA-N 442.563 4.291 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)CCc4cnccn4)nnc3C(C)(C)C)cc2)CC1 1493873602 NSXXEPYADJBVHL-UHFFFAOYSA-N 447.631 4.329 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1500735153 RARRGIKYNGTRLF-RUZDIDTESA-N 434.588 4.067 10 10 IICE CCc1csc([C@H]2CCCN(c3nnc(C)n3Cc3ccc(N(C)C)c(F)c3)C2)n1 1513720634 NUGHUDAUSRSPKA-KRWDZBQOSA-N 428.581 4.243 10 10 IICE CC[C@@H](Cc1ccccc1Br)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1518368541 IARQSMNOFFMEGP-KRWDZBQOSA-N 431.374 4.375 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2c(F)c(F)cc(F)c2F)C1 1524842166 VNNRWBSLQGOQSJ-UHFFFAOYSA-N 433.449 4.281 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nn(-c3ccccc3)cc2Br)cc1 1527395208 QZXRXPKXOHEFSH-UHFFFAOYSA-N 427.346 4.411 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCC1CC(F)(F)C1 1527705731 XBYFMZHQXDELSV-NTEUORMPSA-N 430.567 4.281 10 10 IICE CSc1cncc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1529417193 APRZKVKNYXNTRM-LZYBPNLTSA-N 433.555 4.173 10 10 IICE CCCCNC(=O)OC[C@H]1CCCCN1C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1544478687 ZMBPLNMCQMXSBE-OAQYLSRUSA-N 443.588 4.426 10 10 IICE CN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H]1CCC[C@@H]1c1ccccc1 1564895268 CFJYGAXEUJMWKJ-DENIHFKCSA-N 429.511 4.279 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1ccccc1C(F)(F)F 1566155135 NZRDPWFEHIYUAJ-UGSOOPFHSA-N 444.400 4.125 10 10 IICE Cc1ccc2nc(CNC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)[nH]c2c1 1566167729 KGEHEAXBSOKJMX-UHFFFAOYSA-N 438.329 4.366 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)COc1cccc(NC(=O)c2ccco2)c1 1584088755 FVEVXELGKVJNMI-GOSISDBHSA-N 435.524 4.033 10 10 IICE CCc1cc(N2CCC[C@H](NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)C2)ncn1 1585441821 XMABFILEYZRDPI-FQEVSTJZSA-N 437.975 4.499 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)C2)cc1 1585665969 XXZIOLLFHCJZCG-RXVVDRJESA-N 445.604 4.063 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](Cn2cccn2)c2ccccc2)cc1 1586609524 RQHLBWMKTJOJDX-VWLOTQADSA-N 426.520 4.203 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2cc(C)on2)cc1 1615381995 JTCVXFWERWFUQH-UHFFFAOYSA-N 445.571 4.091 10 10 IICE Cc1cc(CCNC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)c(C)n1-c1ccccc1 1623733432 IAHPHCTZWWFVHV-DEOSSOPVSA-N 443.547 4.074 10 10 IICE CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1624626117 MCDPIJHABBXARO-HSZRJFAPSA-N 439.625 4.105 10 10 IICE Cc1cc(C(=O)Nc2ccc(-c3nn[nH]n3)cc2)c(C)n1-c1ccc(Br)cc1 1626198166 JDIPANHEGNZLGQ-UHFFFAOYSA-N 437.301 4.289 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@H](O)c3ccc(OCc4ccccc4)cc3)C2)cc1 1629083179 HOGPGTMLLQKWLI-GJZUVCINSA-N 446.547 4.093 10 10 IICE O=C(Cc1ccc(OCc2ccccc2)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1634423604 GWYVVTHMVXADGR-UHFFFAOYSA-N 448.538 4.225 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2c(OC(F)(F)F)cccc2[nH]1 1634725402 WSLPGZCRRJLKKN-UHFFFAOYSA-N 429.192 4.465 10 10 IICE O=C(COCCc1ccc(Br)cc1)NCc1cc(Cl)cc(Cl)c1O 1638305895 PSJXQXXBHPKWKY-UHFFFAOYSA-N 433.129 4.337 10 10 IICE CCCCO[C@@H]1C[C@@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(C)C 1644890697 MGJCBGAVEFQXIX-FGZHOGPDSA-N 448.563 4.316 10 10 IICE CN(CCOCCN1C(=O)c2ccccc2C1=O)c1ccc(OCc2ccccc2)cc1 1645306123 DWSDZQUFPFLVCH-UHFFFAOYSA-N 430.504 4.015 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3n[nH]c4nc(C(F)(F)F)ccc34)ccc21 1653811569 ICUYNXNCFGAMMC-UHFFFAOYSA-N 431.418 4.447 10 10 IICE CCOC(=O)CN(Cc1ncc(-c2cccc(Br)c2)o1)Cc1ccccc1O 1654806257 SNIFJBODMYPRFV-UHFFFAOYSA-N 445.313 4.375 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3ccc(Br)cc3)CC2)cc1F 1675171007 RPKYQWXFTRWYLS-CQSZACIVSA-N 436.325 4.190 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc(F)c(Br)cc2F)cc1 1684371750 JORVRVZBQWQEAK-UHFFFAOYSA-N 442.304 4.014 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1696558186 LGHXBTYUPUWMNZ-FUHWJXTLSA-N 435.613 4.003 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](C)C1 1709839282 BERIFMFOQKBBDK-MOPGFXCFSA-N 448.615 4.361 10 10 IICE Cc1ccc(CN(C)c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)o1 1742217350 QTDQSXPCPXBICE-UHFFFAOYSA-N 437.588 4.289 10 10 IICE CCN(c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCCSc1nccs1)C1CC1 1745943699 FRYMQICHNFPCFL-UHFFFAOYSA-N 430.559 4.481 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCCC[C@H](C)C2)cc1 1746085332 BSHAUSLOMODYSH-FQEVSTJZSA-N 438.620 4.035 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)OC(C)(C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1751408347 GDCFNJZDRSZSFJ-GOSISDBHSA-N 437.588 4.127 10 10 IICE CC(C)[C@@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1760950013 IIHZSDMBGJDPKR-QFIPXVFZSA-N 425.621 4.376 10 10 IICE CC1CCN(CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CC1 1763023753 JQJMOBMQYZLWLI-UHFFFAOYSA-N 425.602 4.004 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)Cc2c(C)noc2C)cc1 1766611612 LZCRPRGGTBGNLS-UHFFFAOYSA-N 445.571 4.476 10 10 IICE CCCN1C(=O)C(NCCc2ccccc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873162192 JUBOVQWETJHIAY-UHFFFAOYSA-N 427.548 4.416 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc(O)c1O 1951866839 HQXBWQWHAJGBJR-RUZDIDTESA-N 433.460 4.326 10 10 IICE CC[C@H](N[C@@H]1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)c1cc(Br)ccc1O 2095041821 PPIHGAKPYUAFLV-ISWURRPUSA-N 425.367 4.451 10 10 IICE CC(C)(C)OC(=O)N1C[C@]2(F)CCC[C@@]2(NCc2ccc(Br)cc2O)C1 2126045740 GJMOXUNVQAAFTO-RTBURBONSA-N 429.330 4.126 10 10 IICE CCOC(=O)[C@@H](C(C)C)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2297580067 KWMCGNCXTRKJAY-CQSZACIVSA-N 428.373 4.238 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H]2CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2381134739 HHAZJVFVCXDWLJ-OAHLLOKOSA-N 441.366 4.211 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3C)C2)sc2c1CCCC2 15466104 ISAJAZGLEPZARZ-MRXNPFEDSA-N 440.565 4.412 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1)N2)N1CCOCC1 20695018 RUTXHTQTSSBPOE-WOIUINJBSA-N 430.957 4.187 10 10 IICE CCOc1ncnc2sc(C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)c(C)c12 71565491 DXAFGFPXKIUSHG-UHFFFAOYSA-N 443.484 4.426 10 10 IICE CCOC(=O)c1ccc(NC(=O)CCN2C(=O)/C(=C\c3cccs3)SC2=S)cc1 210698273 JDTYOMYMWPPZNV-FOWTUZBSSA-N 446.575 4.155 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(CCCCCC(=O)N2CCOCC2)C1=O 211906623 OGRWYVPGNJOZLY-OPMCAQPSSA-N 444.622 4.253 10 10 IICE CCOc1ccc(CN[C@H](c2cccc(S(C)(=O)=O)c2)c2cc(F)ccc2F)c(O)c1 742385266 VOGRTVRMALBZAZ-HSZRJFAPSA-N 447.503 4.352 10 10 IICE C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754660439 GPRHVNXDRUPSCD-AEFFLSMTSA-N 433.499 4.235 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 779506364 PZJGBLMKQLXFRD-XVNBXDOJSA-N 431.275 4.267 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@]2(CCO[C@H](C)C2)O1 797440065 LVEQXRLWKVDEBX-OHUGHZGNSA-N 429.605 4.324 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802680076 SMIOTHGESRNSQP-YADHBBJMSA-N 435.572 4.147 10 10 IICE C[C@H](N[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2)c1ccc(N2CCOCC2)c(F)c1 813878122 CAAAUZSXLZEDON-LAUBAEHRSA-N 433.568 4.103 10 10 IICE CCN(CC)C(=O)C1(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CCCCC1 1142082522 GYGCKVGXBSAUGC-UHFFFAOYSA-N 425.573 4.404 10 10 IICE CCOC(=O)c1nc(NCc2cccc(Br)c2O)ccc1Br 1163217475 NRXFSZCJIGNEKZ-UHFFFAOYSA-N 430.096 4.101 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@H](O)c1ccccc1Br 1167512425 MTYJTDYNDUOLDS-KRWDZBQOSA-N 429.152 4.473 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)c4ccc(Cl)cc4F)CC3)cc2)CC1 1190810631 RDZZAIBLPLSQLL-UHFFFAOYSA-N 445.966 4.052 10 10 IICE COc1ccc2c(c1)OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)C2 1225636825 MNYKMIYJJXNSBV-LPHOPBHVSA-N 443.975 4.388 10 10 IICE CCC(C)(C)c1ccc(CNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1230658057 YSNVXALZNRSTDO-UHFFFAOYSA-N 436.600 4.075 10 10 IICE Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1296647818 DGINQBROHPEPPX-DNVCBOLYSA-N 429.362 4.226 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C(C)C)c(C)n1-c1ccccn1 1301111500 RJNYDEBSDYJSAX-HXUWFJFHSA-N 426.561 4.207 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CCCOc3ccc4c(c3)CCC4)cc2F)C[C@@H](C)O1 1354656779 FWJVGPYOEAENCX-RTBURBONSA-N 440.559 4.403 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n(C(C)(C)C)n1 1357128004 COROVYZIGCEALC-VBKFSLOCSA-N 446.573 4.316 10 10 IICE C[C@@H](NC(=O)c1cc(-c2cccc(Cl)c2F)no1)c1ccc(N2CCOCC2)cc1 1357129416 RNAXVVLDGCFXCP-CQSZACIVSA-N 429.879 4.462 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)cc2)c1C 1436846556 IUSCEGBNWGQDKH-GOSISDBHSA-N 448.567 4.093 10 10 IICE CCN(CC)[C@@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)CC(C)C 1443419840 COWJHKZCRYFRSQ-OAQYLSRUSA-N 426.649 4.281 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1cc(-c2ccccc2)on1 1448687049 RFVPJPKSNUVSLV-UHFFFAOYSA-N 435.524 4.273 10 10 IICE CSc1cc(O)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1449033789 WZKUHYNYFCOZHH-LICLKQGHSA-N 448.566 4.483 10 10 IICE O=[N+]([O-])c1cc(Br)ccc1NCc1cc(F)c(N2CCOCC2)c(F)c1 1458427231 GKOHRFCEFRWTET-UHFFFAOYSA-N 428.233 4.084 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C3(c4cccc(OC(F)(F)F)c4)CCC3)C2)cc1 1461496177 OSCBTZGVJNBJGM-QGZVFWFLSA-N 434.458 4.411 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@@H](CNC(=O)OC(C)(C)C)C3CC3)c2C)cc1 1467312543 DMAGFNXMEJYCLH-QFIPXVFZSA-N 441.572 4.478 10 10 IICE Cc1cc(C(=O)NC[C@@](C)(O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cn1 1471949344 ZSWMHBDPCKQBEL-OAQYLSRUSA-N 446.320 4.028 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccccc3Cn3cncn3)c2C)c1 1478528519 PAOLOCZSHXMGCB-UHFFFAOYSA-N 428.540 4.042 10 10 IICE COC(=O)c1ccc2c(c1)CCN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)C2 1479064518 RCJFXRQLKHTREI-UHFFFAOYSA-N 431.536 4.191 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N(C)CC(=O)NC(C)(C)C)cc1 1515532480 QUJZBRRQARTRSB-UHFFFAOYSA-N 440.636 4.181 10 10 IICE CNc1ccc(C(F)(F)F)cc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1533991802 FIQPJRPGGWJDNG-UHFFFAOYSA-N 446.517 4.209 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cnn1-c1ccccc1C 1543633313 YKOJSZONARGFLK-UHFFFAOYSA-N 448.567 4.113 10 10 IICE CC(=O)N1CCCc2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)ccc21 1546188426 ZTYSGMFGJCAKBV-UHFFFAOYSA-N 429.520 4.387 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CO[C@H](CN3CCCc4cc(OC(F)F)ccc43)C2)C1 1559605356 OSEDKYRYJZPGGA-MBSDFSHPSA-N 438.515 4.457 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)Nc1cnn(Cc2ccc(Br)cc2Cl)c1 1570158743 IRNOZQNYTXTEMA-QHHAFSJGSA-N 448.704 4.410 10 10 IICE CCc1ccccc1-n1cc(O)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)n1 1583919981 UZLMNJKXDCZLGF-JOCHJYFZSA-N 448.567 4.028 10 10 IICE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1596359446 SKBHZMFWDKMCOL-HXUWFJFHSA-N 447.645 4.282 10 10 IICE CC1(C)CC[C@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)OC1 1596542119 DKFICMSPSSRPSF-DSQDWWTGSA-N 438.640 4.051 10 10 IICE CCOC(=O)c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)nc1 1633066962 XCXLIXLZDRRYCG-UHFFFAOYSA-N 433.508 4.180 10 10 IICE C[C@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1O 1635799011 MCKCSUZQXYCACU-AWEZNQCLSA-N 430.913 4.337 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCOc1ccc(C(C)(C)C)cc1 1638529449 PDDRWJRQWYKYIH-UHFFFAOYSA-N 427.541 4.441 10 10 IICE CCCC[C@@H]1NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1=O 1641155685 NOEOGQTXZQLZJQ-SFHVURJKSA-N 446.345 4.150 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(F)cc3NC(=O)OC(C)(C)C)C2)cc1 1643347154 UMECOEXCYQKSDF-MRXNPFEDSA-N 443.519 4.438 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3cc(F)ccc3F)CC2)N(C)C)cc1 1676653701 VIQCRARFUALLQY-XMMPIXPASA-N 444.570 4.298 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1 1686826575 KWBRSUXCPOPZQB-GOSISDBHSA-N 432.609 4.033 10 10 IICE CC[C@@]1(C)CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1727323516 ZBMZQZOFXNVTEA-QHCPKHFHSA-N 429.634 4.008 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC3C[C@@H](C)O[C@H](C)C3)CC2)cc1F 1730179701 BZOLRZLVMCCSIB-QZTJIDSGSA-N 445.583 4.079 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746931083 UMNJAZYKBWEBJB-NHCUHLMSSA-N 440.567 4.166 10 10 IICE CCCC(=O)NC1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)cc2C)CC1 1763683470 YRLSGSMPKDFPSY-GOSISDBHSA-N 440.636 4.099 10 10 IICE COCCN(Cc1ccco1)c1nnc(C(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1771103881 FVQBTMRUNXJHAD-UHFFFAOYSA-N 437.588 4.252 10 10 IICE COCCN(Cc1ccco1)c1nnc(C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1771105166 ZUIXARQHGUESCA-UHFFFAOYSA-N 429.540 4.075 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C(C)C)c(CN)c2I)c(O)c1 2078984793 ZNCKPADORPUQCM-QGZVFWFLSA-N 427.330 4.329 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccc(NC(C)=O)cc3)C2=O)cc1OC 2296882914 CUFBKZRWYROHKT-UHFFFAOYSA-N 428.535 4.458 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)[C@@H]2CC[C@@H]21 2330841168 LULCLHIYIOIMOP-IMJJTQAJSA-N 429.330 4.171 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)C2=Cc2ccccc2C(=O)O)cc1 2332131786 FMJOQMRXGWOLOD-UHFFFAOYSA-N 430.435 4.363 10 10 IICE CC[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380759541 OZRRARSSRVZEJM-FQEVSTJZSA-N 443.382 4.363 10 10 IICE COC[C@H](C)NC(=O)CSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 11215067 GPEWISDDGLERNJ-INIZCTEOSA-N 429.973 4.495 10 10 IICE O=[N+]([O-])c1c(NCCN2CCOCC2)ncnc1Nc1ccc(/N=N/c2ccccc2)cc1 40646004 WRNQXDNKNLETRE-BYYHNAKLSA-N 448.487 4.288 10 10 IICE CC(C)Cc1ccc(C(=O)C2CCN(c3cc4c(cc3[N+](=O)[O-])OCC(=O)N4)CC2)cc1 301670951 FHCJREYXPRHJEV-UHFFFAOYSA-N 437.496 4.224 10 10 IICE O=C1/C(=C\c2cnn3ccccc23)SC(=S)N1Cc1ccc(Br)cc1 746814641 ARAAYFWLHRROMT-CXUHLZMHSA-N 430.352 4.498 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1[C@H]2CC[C@H]1c1ccccc12 751068646 XPOFOUGIPZBEOB-ROUUACIJSA-N 426.519 4.287 10 10 IICE O=C(Cc1ccccc1C(F)(F)F)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768542000 BVBYHMLJXIVHDJ-UHFFFAOYSA-N 431.502 4.096 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3cc(-c4ccsc4)nn3C)cc2F)C[C@@H](C)O1 786189222 FDVNVRLASGFVMD-GASCZTMLSA-N 443.548 4.223 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(F)cc(Br)c3F)CC2)cc1F 786484377 HMLAKWUJSFYOTC-UHFFFAOYSA-N 444.251 4.229 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2cscc2Br)cc1 814679910 RHTJPCIFTRTEQG-GOSISDBHSA-N 437.403 4.327 10 10 IICE Cc1cc(C)c(CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(C)c1Br 1134882234 NFXOIKLVPRSICB-NRFANRHFSA-N 446.433 4.402 10 10 IICE Cc1cc(N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)nc(C(C)C)n1 1135729946 XXOBDDKNVTZRQE-UHFFFAOYSA-N 445.567 4.091 10 10 IICE CC(C)(C)OC(=O)Nc1ncc(CCC(=O)NCc2c(O)ccc3c2CCCC3)s1 1137443548 TXSYNXLQJLXUPD-UHFFFAOYSA-N 431.558 4.324 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1ccc(OC)c(F)c1 1154565669 HQMNDIAMACBCJG-JOCHJYFZSA-N 442.462 4.415 10 10 IICE C[C@]1(C(=O)NCc2ccc(N3CCCCC3)cc2)CC1(Br)Br 1162800861 PHEZKALTMGGFJP-MRXNPFEDSA-N 430.184 4.189 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](c3cccc(C)c3)c3ccccn3)C2)cc1 1225430773 QOIGTKJSILDXHJ-CPJSRVTESA-N 430.552 4.314 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1230301353 XRRIKCHNPYYORK-QZTJIDSGSA-N 443.975 4.388 10 10 IICE Cc1cc(CNC(=O)N2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1234325399 DHEUFJCWKYBHED-OAQYLSRUSA-N 426.561 4.245 10 10 IICE COc1ccc(Cl)cc1[C@H](O)CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1253807633 HIWUQSYPODWDNV-JOCHJYFZSA-N 441.959 4.331 10 10 IICE C[C@H](Sc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1264640968 RBPUIVFKTCCHGM-AWEZNQCLSA-N 442.478 4.478 10 10 IICE CC1(C)OC(=O)c2c(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cccc21 1265564765 UPRVHLFHNCUIRS-AWEZNQCLSA-N 430.451 4.092 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)cc1 1290324922 KYJYTHVZAXFSTK-UHFFFAOYSA-N 438.572 4.498 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1OC(F)(F)F 1294859818 PGHXCINEBKJQFA-HNNXBMFYSA-N 428.838 4.339 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccon2)cc1 1295413584 APQLMUNNSDKPGU-UHFFFAOYSA-N 431.544 4.167 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCN1C[C@@H](C)C[C@H](C)C1 1306078112 IINIWKHLMFTQOE-VXKWHMMOSA-N 438.664 4.445 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cc(C)cc(C)c1 1307535174 LKVYDAZOGLWKBO-PMACEKPBSA-N 427.564 4.199 10 10 IICE COC[C@@]1(CNC(=O)NCc2cc(C)n(-c3ccccc3)c2C)OCCc2ccccc21 1312799370 YKSPCIJEVCZPMT-AREMUKBSSA-N 433.552 4.008 10 10 IICE CN(CCCn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1314851563 WMGDODLBMOHCMZ-UHFFFAOYSA-N 445.608 4.466 10 10 IICE CCC(CC)(C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)c1ccc(OC)c(OC)c1 1436972540 RZFJMSCTHTYRFD-IBGZPJMESA-N 440.584 4.413 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1Cc2ccc(O)cc2N1C(=O)OC(C)(C)C 1442339921 CMJPBRBKODVKCO-JOCHJYFZSA-N 439.556 4.173 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3sc(Cc4ccc(F)cc4)nc3C)C2)cc1 1461077745 OZUGYQXAXMGYHW-GOSISDBHSA-N 439.556 4.446 10 10 IICE CCOc1ccccc1[C@](N)(C(=O)NCc1ccc(N2CCC(C)CC2)cc1)C(F)(F)F 1472508293 OFTZGJKMALGUNF-QHCPKHFHSA-N 449.517 4.354 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)C1 1505221474 YSGUSBJVNQIATK-CVEARBPZSA-N 439.676 4.143 10 10 IICE COc1ccc(N2CCN(C(=O)C[C@@H](C)c3ccc(F)c(Br)c3)CC2)cc1 1518369297 LJCBUPBLPGXXIE-OAHLLOKOSA-N 435.337 4.439 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1oc(C2CC2)nc1C(F)F 1520922381 LXEVIRQWRMHJFR-UHFFFAOYSA-N 427.398 4.490 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(CN3C(=O)c4ccccc4C3=O)c2)cc1 1525918574 NHCBTWMUCMMJDY-UHFFFAOYSA-N 441.531 4.259 10 10 IICE COc1ccc2c(c1)OC[C@H](C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)C2 1530426872 WQHXDXXGTIBGRP-QFBILLFUSA-N 428.960 4.452 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1(C(F)(F)F)CCC1 1532982054 PJNICBGLUWTEDZ-RAXLEYEMSA-N 432.464 4.018 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2csc(COc3ccc(C)cc3)n2)cc1 1538160288 MNTJUEAKYNIIJH-UHFFFAOYSA-N 439.581 4.176 10 10 IICE Cc1cccc([C@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCOCC2)c1 1540945064 KJAYULQEAAKGAN-SANMLTNESA-N 445.563 4.018 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3cccc(Cl)c3)cc2F)C[C@H](C)O1 1542112801 FJNWOLXJVHDWAB-GJZGRUSLSA-N 442.922 4.413 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CO)c3cccc(Br)c3)c2C)cc1 1546099206 ZIDPBRWQHPYZFJ-OAQYLSRUSA-N 443.341 4.329 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(=O)cc[nH]c4c3)cc2Cl)C1 1564649317 AQOGQVBEQYWTCH-INIZCTEOSA-N 438.959 4.417 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cncc(N3CCCC3=O)c2)cc1 1565656367 ZALKCLNAHOSQKV-UHFFFAOYSA-N 444.535 4.130 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC[C@H](C3CC3)N2C(=O)OC(C)(C)C)cc1F 1565688489 ZEFRDFIWZSNEMB-CTNGQTDRSA-N 433.568 4.466 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cnc(OC4CCCCC4)c(Cl)c3)cc2)CC1 1583475847 NEUBQSZIYSRWNE-UHFFFAOYSA-N 442.991 4.128 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCN(C(=O)OC(C)(C)C)C1CC1 1611396456 KBLLOVGNAZPJAV-UHFFFAOYSA-N 425.529 4.036 10 10 IICE O=C(NCCCSc1nccs1)c1cn(Cc2ccc(Cl)cc2Cl)nn1 1616241472 NETVOVAPOBPCFF-UHFFFAOYSA-N 428.370 4.002 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2cccc(F)c2)c(C)n1-c1ccccc1Br 1623814948 WCDBZJARWFQWAR-LJQANCHMSA-N 431.305 4.459 10 10 IICE Cc1cc(CNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C)n1-c1ccccc1 1624075675 XZZVHHBIAZQTIY-UHFFFAOYSA-N 448.479 4.007 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cnc(OC2CCCCC2)c(Cl)c1 1630287434 ANZVDJGUBQPMQC-UHFFFAOYSA-N 443.975 4.338 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)cc1 1631675515 OYHDVGAEDCOPHW-BWKNWUBXSA-N 443.591 4.476 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCC2(NC(=O)OC(C)(C)C)CCOCC2)c1 1633005641 DGGRJZJQWURQML-UHFFFAOYSA-N 441.572 4.206 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(c4nnc(C(F)(F)F)s4)CC3)c2C)c1 1634362054 IRHHWCCSBRAXJE-UHFFFAOYSA-N 449.502 4.235 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F 1639254532 TWXCCWJBFAFSBT-CQSZACIVSA-N 431.480 4.341 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCN(CC(F)F)C2)c(C)n1-c1ccccc1Br 1644353030 MCYOZQUBSVUTKY-OAHLLOKOSA-N 440.332 4.173 10 10 IICE COC(=O)c1cc(NC(=O)[C@H](C)Sc2ncc(C(C)(C)C)s2)cc(C(=O)OC)c1 1651864049 BVLVNAKFQLNKRI-NSHDSACASA-N 436.555 4.133 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC)cc2OC)sc2c1CC[C@H](C)C2 1652958583 YICLWEPPCXXYOT-AWEZNQCLSA-N 446.569 4.142 10 10 IICE COC(=O)[C@@H]1c2ccccc2OCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1653130157 HSSHEDMRBLQQOV-QFIPXVFZSA-N 438.911 4.496 10 10 IICE C[C@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)C(=O)N1c2ccccc2C[C@@H]1C 1672776728 JHPUVMRBNPGXPA-ROUUACIJSA-N 433.508 4.063 10 10 IICE CCOC(=O)c1csc(CC2CCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)n1 1681551249 DFOZUVLQYPDKRE-MRXNPFEDSA-N 444.601 4.111 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H]3CC[C@H](c4ccc(Cl)cc4)C3)cc2)CC1 1683345098 XTUPHXAREKWDLQ-RBBKRZOGSA-N 426.992 4.227 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](c2ccncc2)C2(CO)CCC2)c(C)n1-c1ccccc1 1684444150 JHSTVBVGCUCYBU-DEOSSOPVSA-N 432.568 4.235 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC1CN(c2ccc(C(F)(F)F)cc2)C1 1685313443 URPCWSONCMMJHR-UHFFFAOYSA-N 434.245 4.406 10 10 IICE Cc1cc(CCNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(C)n1-c1ccccc1 1687155847 YFYAXJVDEYYOMY-UHFFFAOYSA-N 446.595 4.097 10 10 IICE COCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1697922561 BVVJCZIADTTYDT-SANMLTNESA-N 449.599 4.297 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCC2(C)C)CCOC1 1723665656 DMDFSSQIZQEBRG-CJFMBICVSA-N 442.604 4.487 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CC(C)(C)OC(C)(C)C1 1724235525 LQQOOUCUKGKSKI-UHFFFAOYSA-N 436.604 4.100 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccco2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726880981 NIPOIEGILMYAPX-IBGZPJMESA-N 437.588 4.278 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCC(=O)N3)nnc2N(C)CC2CCCCC2)cc1 1764935653 TVWIBKCSLDUANR-JOCHJYFZSA-N 438.620 4.140 10 10 IICE CCc1c(OCCCOc2ccc(N)cc2)c(=O)ccn1C1CC(C)(C)NC(C)(C)C1 1857913360 FSGAHHLUJPKIQC-UHFFFAOYSA-N 427.589 4.323 10 10 IICE COCC[C@@]1(NCc2cc(Br)ccc2O)CCCN(C(=O)OC(C)(C)C)C1 2157553991 PZYRDVIZIOSBDV-FQEVSTJZSA-N 443.382 4.051 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S)Nc1cccc(Cl)c1 2296880010 PVURYIVWGSOHIN-UHFFFAOYSA-N 446.937 4.299 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCO3)C(=O)N(c2ccccc2)C(=S)N1Cc1ccccc1 2313504702 XAZUEISFNBBVOZ-UHFFFAOYSA-N 442.496 4.159 10 10 IICE CCN1CCN(C=C2SC(=S)N(c3cc(C(F)(F)F)ccc3Cl)C2=O)CC1 2313608941 AYWOFJPWEQCYCJ-UHFFFAOYSA-N 435.924 4.202 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3cc(F)ccc3F)C2=O)c(C)n1-c1ccccc1 22224360 KBZKDPOYNLBPMW-DEOSSOPVSA-N 437.446 4.022 10 10 IICE Cc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1 33318287 XICGRPCMEFKSKV-XDHOZWIPSA-N 440.546 4.344 10 10 IICE O=C1[C@@H]2ON(Cc3ccccc3)[C@H](c3cc(Cl)ccc3O)[C@H]2C(=O)N1Cc1ccccc1 43254213 SOATWEQQEKPCOY-DNVJHFABSA-N 448.906 4.088 10 10 IICE COc1cc2c(cc1OC)CN(C(=O)Cn1c3c(c4ccccc41)CN(C(C)C)CC3)CC2 435617009 NQIBCLUJRIWQQO-UHFFFAOYSA-N 447.579 4.010 10 10 IICE COC(=O)c1ccc(-c2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)cc1 436108841 PVPHFOVRPFQPOF-UHFFFAOYSA-N 430.508 4.293 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCN(c3ccccc3F)C2)C1 462373830 YGOMZWNSNSPVKM-FQEVSTJZSA-N 448.586 4.190 10 10 IICE COc1cc(CN(C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc(OC)c1 726718564 GZYUZKLFZBRHAH-UHFFFAOYSA-N 449.498 4.116 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccccc1 733974875 NRYNLONQQRTPFD-QRVBRYPASA-N 429.611 4.215 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCC[C@H]2c2ccc(F)cc2)c1 751950377 PFUYTYUOWUSNRL-DEOSSOPVSA-N 426.532 4.293 10 10 IICE O=C(NCc1ccc(O)c(O)c1)c1c(C(F)(F)F)nn(-c2ccccc2)c1C(F)(F)F 778918222 OWSZBTYZIINUQX-UHFFFAOYSA-N 445.319 4.251 10 10 IICE C[C@@H]1CN(c2ccc(NC(=O)/C=C\c3ccc(O)c(O)c3)cc2C(F)(F)F)C[C@@H](C)O1 779515413 WBJSRKZMGCXADS-CWIKABRRSA-N 436.430 4.382 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCO[C@@H](c3nccn3C)C2)c(C)n1-c1ccc(Cl)cc1 1129764488 MXUCSGRAEFRCLO-TZIWHRDSSA-N 426.948 4.060 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C)n1-c1ccc(Br)cn1 1141478375 XNCBCADZHQXIQF-UHFFFAOYSA-N 443.301 4.432 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC(C)(C)N2C[C@@H](C)C[C@H](C)C2)C1 1142282326 XTCRZVLDBQGFPD-SFTDATJTSA-N 438.660 4.281 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 1142534013 WLUAPJCJLTZZPK-UHFFFAOYSA-N 441.281 4.043 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cnc3ccccc3c2)NC(=O)OC(C)(C)C)cc1 1147508151 UQYUOEBKBUIQLA-QFIPXVFZSA-N 434.540 4.297 10 10 IICE Cc1cc(C(=O)COc2ccc(F)cc2C(N)=O)c(C)n1-c1cccc(Br)c1 1166509037 OJAYKGLWWPYVNS-UHFFFAOYSA-N 445.288 4.356 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2ccc(Br)cc2)c(C)n1-c1ccc(F)cc1 1176096064 YWPOFKLWTUGAFG-HXUWFJFHSA-N 431.305 4.459 10 10 IICE O=C(CN(Cc1ccccc1O)C1CCCC1)NCCOc1ccc(C(F)(F)F)cc1 1190904150 JOSYTIRHJQAWCZ-UHFFFAOYSA-N 436.474 4.351 10 10 IICE O=C(NCc1cccc(Br)c1O)NC[C@@H](Cc1ccccc1)c1ccccn1 1251639538 DUDWKPYOQASANL-GOSISDBHSA-N 440.341 4.375 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CC(C)(C)Oc4ccc(F)cc43)CC2)cc1 1252661813 FXKUWJJSXWGKAW-OAQYLSRUSA-N 427.520 4.358 10 10 IICE CC[C@H](C)CN(CC)c1nnc([C@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1291755508 YYYQVYZSWKHKAI-UGKGYDQZSA-N 425.621 4.475 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CC[C@H](Cc3cnn(C)c3)C2)cc1 1295411764 WCZVRTPUTPKMJH-OAQYLSRUSA-N 435.620 4.099 10 10 IICE CN(c1nnc(-c2ccc(Cl)cc2)n1CCCSc1nccs1)[C@@H]1CCOC1 1298130660 LXJNUFVAOVYEFB-MRXNPFEDSA-N 436.006 4.463 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H](C[C@H]2CCCO2)C(F)(F)F)cc1 1352929396 PQHIONUTXRRYPN-HZPDHXFCSA-N 426.401 4.391 10 10 IICE Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1355131589 XPLNBRAVGZOJFH-IXDOHACOSA-N 434.939 4.485 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCCC[C@@H]2N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1355606066 UAHQDIDJVCOKBK-GOTSBHOMSA-N 429.992 4.050 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1360063396 OZLJXXADRUYZHV-IBGZPJMESA-N 431.600 4.371 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cc(C(F)F)ncn1 1439875330 RRNYQDRRYRPDJF-UHFFFAOYSA-N 445.227 4.139 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(OCC(F)(F)F)nc2)cc1 1441425349 YGNMEXHMPMIKHB-UHFFFAOYSA-N 445.441 4.102 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H](O)c2ccc(Cl)c(Cl)c2)cc1 1442617179 PGVFHRWHJSQSFZ-NQIIRXRSSA-N 437.367 4.301 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC[C@@H](C)N(C)Cc2ccccc2)cc1 1445358665 NJQLPQFXWGNLHH-HXUWFJFHSA-N 431.580 4.476 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](C[C@H]1COCCO1)C(F)(F)F 1446799420 FHMVEUOKRQEDEG-LSTHTHJFSA-N 437.458 4.466 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(COc2ccc(C)cc2C)o1 1451908066 DCHURLMMGSUPCG-UHFFFAOYSA-N 437.492 4.387 10 10 IICE CCS(=O)(=O)Nc1cccc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1 1454625962 RAZHPBHDAZFLII-UHFFFAOYSA-N 425.554 4.094 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC12CCC(C(C)(C)CC)CC2 1466674549 ZPXDXWGAHMXAOG-XEXBDKKRSA-N 431.573 4.321 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@](C)(Cc2ccccc2)[C@H](C)O)cc1 1467801827 AXYNWIXEVTYTLI-KDYSTLNUSA-N 432.564 4.195 10 10 IICE CC(C)(C)OC(=O)NCC1(CCNC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 1470709264 ZASFKWVFGMAFMR-UHFFFAOYSA-N 443.544 4.392 10 10 IICE C[C@H]1CN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)C[C@@H](C)C1(F)F 1505287603 OCTLPQPVENSWDB-QLFBSQMISA-N 443.589 4.148 10 10 IICE COc1ccccc1[C@@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1535509738 KIGCTXRHJDPCMD-RMENWYJGSA-N 444.553 4.303 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)C[C@H](C)C1 1541084390 BZVPFUVRPJIVSZ-OALUTQOASA-N 448.615 4.361 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc4c(s3)CCN(C(=O)OC(C)(C)C)C4)ccc21 1544164517 LAJSGCSNCRQFJY-UHFFFAOYSA-N 441.597 4.354 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1546590177 DBTBIIGXPSDPQD-NNMXDRDESA-N 441.620 4.058 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(CCCCO)C3CC3)ccc21 1554359406 ACKDFDRDPCHWQG-UHFFFAOYSA-N 425.621 4.039 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(CCNC(=O)OC(C)(C)C)cc1 1557063724 XNFYGIDPNZNLLF-LJQANCHMSA-N 439.600 4.489 10 10 IICE COc1ccc(CNC(=O)NCc2cc(C(F)(F)F)ccc2Br)c(O)c1 1565343547 LJKQDNKGJDQFOK-UHFFFAOYSA-N 433.224 4.182 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](C)SCc2nc(O)c3ccccc3n2)cc1F 1585698518 PJZSQENIRVCWCY-HNNXBMFYSA-N 442.560 4.259 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(C(=O)OC(C)(C)C)cn1 1588193119 LMRZRBBMKSXXFK-UHFFFAOYSA-N 435.318 4.167 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)CNC(=O)N1CCCC1 1610124618 ZLXGEQZZURMYMR-LJQANCHMSA-N 448.489 4.104 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1F 1616924283 IEZARHCTCBDOMN-OPAMFIHVSA-N 449.929 4.300 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)C2CCC(C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1619965824 LZMGRZXTCSGMKR-FDYSRKEFSA-N 447.599 4.270 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cccc(Cl)c1 1620449722 ZDORSSHKMXUMQM-UHFFFAOYSA-N 447.982 4.090 10 10 IICE COc1ccc(C)cc1CN1CCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1624431006 BTPSNDNZXVDSJS-UHFFFAOYSA-N 431.580 4.298 10 10 IICE CSCC[C@@H](CC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)NC(=O)OC(C)(C)C 1629697533 KIVKAVILNCJPQJ-SFHVURJKSA-N 435.634 4.280 10 10 IICE O=C(COc1c(Cl)cc(Cl)cc1Cl)NCc1ccc(N2CCOCC2)cc1 1631070143 UFJOXBSEQDRSOU-UHFFFAOYSA-N 429.731 4.179 10 10 IICE CN(c1ccc(CNC(=O)c2cncc(I)c2)cc1)C1CCCCC1 1631386213 MYOQEHRPRNADBA-UHFFFAOYSA-N 449.336 4.385 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(OC)cc(Cl)c1F 1634384439 BSLBLYIUINNPGF-UHFFFAOYSA-N 436.911 4.490 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4ccc(Br)cc43)C2)cc1 1636354067 PRDKSQAYSWAVFP-HNNXBMFYSA-N 430.346 4.056 10 10 IICE CC[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccn1 1638409479 BLZOFVAFZQCTFD-WIZMWCRPSA-N 431.608 4.392 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)COc1ccc2ccccc2c1Br 1640256872 HQHGDAQAFDMWCO-UHFFFAOYSA-N 435.314 4.489 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C3)ccc21 1643590034 PDMGPXBGQBIZDD-IERDGZPVSA-N 428.573 4.344 10 10 IICE COC(=O)CC[C@@H](SC1=NC(=O)/C(=C\c2csc3ccccc23)S1)C(=O)OC 1652013954 NXOBHBNFCHUHNX-UWZYDCLUSA-N 435.548 4.100 10 10 IICE COc1cc(N(C)CC(=O)NCC2(c3ccccc3)CCCCC2)cc(OC)c1OC 1653378692 NGBFFZMULZXNKT-UHFFFAOYSA-N 426.557 4.167 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2ccc(C(F)(F)F)cc2)CC1 1674713381 WWHCMGDCQWSIGL-UHFFFAOYSA-N 433.474 4.155 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC(c1ccccc1)c1ccccc1 1681846367 HLHOGUFZHXCJGR-UHFFFAOYSA-N 437.490 4.390 10 10 IICE COCCN(CC(C)C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N(C)C)c(F)c1 1698045891 XOKWCDYWBKYXFL-UHFFFAOYSA-N 429.540 4.209 10 10 IICE CC(C)C1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1741392636 WXGKINDQQMDGAO-UHFFFAOYSA-N 443.611 4.472 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)cc1C 1750129308 BYKAJBBQFKOJHY-YZBYQZESSA-N 441.620 4.050 10 10 IICE CCCC(O)(CCC)Cn1c(C2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1765589408 ZHCYQWOULMLPQQ-UHFFFAOYSA-N 441.620 4.212 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](COC)C1 1765769456 IMGTYLDVSAVJBG-SIKLNZKXSA-N 437.588 4.393 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)c1 1860085774 ZIKXVSUKBOHMOW-OVCLIPMQSA-N 434.882 4.441 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(-c4cc5ccccc5oc4=O)c3)CC2)cc1 1860300197 RGOZIOXQWNTNQU-UHFFFAOYSA-N 440.499 4.431 10 10 IICE C[C@@H](C(=O)NC(C)(C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CCCC1 1867018132 WSACUZWRDCGCQG-OAHLLOKOSA-N 432.520 4.122 10 10 IICE C[C@@](CC(=O)O)(Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951860094 MWGBGROWGMWZDJ-SANMLTNESA-N 447.487 4.412 10 10 IICE CSCC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(F)cc3)o2)SC1=S 2040479857 BKNASTUNAFRRDY-AWEZNQCLSA-N 437.539 4.493 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@](F)(CNCc2cc(Cl)cc(Br)c2O)C1 2046407583 GVVZCHMYYGMYOG-QASKLWRZSA-N 437.737 4.293 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CNCc3cc(Cl)cc(Br)c3O)[C@@H]2C1 2138818913 RVNRBXLHYHGIGT-RBSFLKMASA-N 445.785 4.401 10 10 IICE Cc1ccc(NC(=O)CN2C(=O)NC(=Cc3cc(C)n(-c4ccccc4F)c3C)C2=O)cc1 2294143445 BAXRLUHLDCRVCH-UHFFFAOYSA-N 446.482 4.073 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc(OC)c1O 2313609729 MEFOIUOTWIYHOH-UHFFFAOYSA-N 432.479 4.032 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccc(F)cc3)C2=O)ccc1O 2314837957 YYNJLZVFUYDSCO-LBPRGKRZSA-N 446.525 4.158 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2381135465 QSJCSSAULOIMAV-LSDHHAIUSA-N 441.366 4.115 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(OCC)cc2)C(=O)/C1=C/c1ccc(C(=O)OC)cc1 33342685 TZOPYLFGTGECQN-RCCKNPSSSA-N 435.476 4.139 10 10 IICE CCn1c(/C=C\c2ccccc2[N+](=O)[O-])nc2cc(S(=O)(=O)C(F)(F)F)ccc21 97992848 CGIVDKGKGMNXJC-YFHOEESVSA-N 425.388 4.428 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(OC)c1O)N2 226721270 PJQPMXCRGSUPTR-IMWIBFENSA-N 435.568 4.299 10 10 IICE CCOc1ccc(Nc2ncccc2C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 248156965 ZUNWOMWXDPFZGF-UHFFFAOYSA-N 432.524 4.195 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)NC34CC5CC(CC(C5)C3)C4)ccc21 728637638 OHERKWLHEFCNIN-UHFFFAOYSA-N 438.568 4.146 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3OC)cs2)cc1Cl 749736882 BXPXQVBSCIKJDV-UHFFFAOYSA-N 438.914 4.060 10 10 IICE CC(C)N(CCc1nccs1)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 754569806 MANHCMYSBQZQQI-IAGOWNOFSA-N 434.581 4.059 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H](C)CC(O)C[C@H]2C)sc(C)c1-c1ccccc1 759478543 BEMWWFMCTSQPLO-HUUCEWRRSA-N 430.570 4.072 10 10 IICE O=C(O)CCCN1C(=O)/C(=C\c2nc3ccc(Br)cc3s2)SC1=S 772177390 TTYQJEBGQZXIAD-YRNVUSSQSA-N 443.369 4.125 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F 782084316 XYEMMRQMMKKNRF-UHFFFAOYSA-N 446.473 4.450 10 10 IICE COc1ccccc1OCc1ccc(C(=O)NCc2cc(Br)ccc2O)o1 804735116 LROBXVQRJCPLFD-UHFFFAOYSA-N 432.270 4.265 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(Br)c2)n1C[C@@H]1CCCO1 812307415 RQLAAGRTNZRBQW-SFHVURJKSA-N 443.345 4.229 10 10 IICE COCCn1c(SCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)nc(C)c1C 817746428 OSVGRPJUTMXOQH-UHFFFAOYSA-N 441.553 4.258 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@]1(C)CCN(C(=O)OCc2ccccc2)C1 1136025395 ISBVNJJOOKSBLJ-AREMUKBSSA-N 435.568 4.294 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](CC(=O)OC(C)(C)C)C2)cc1 1137255610 JYOQJAOANKWQJH-NRFANRHFSA-N 438.568 4.420 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 1139589147 ARWQRPLYIAJMRF-UHFFFAOYSA-N 447.919 4.179 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1142847576 TZSVKRUXHMQCHM-QGFLDLQWSA-N 427.589 4.496 10 10 IICE O=C(CCOc1ccc(F)cc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1151082791 RHCSBAYABJOGRO-UHFFFAOYSA-N 445.966 4.096 10 10 IICE COc1ccc(CNC(=O)c2cc(Br)c(C)cc2Br)c(O)c1 1155575467 WMXXIOKZBXQQEJ-UHFFFAOYSA-N 429.108 4.164 10 10 IICE CCOC(=O)C[C@@H](O)CSc1ncc(-c2ccc(Br)cc2)n1CC(C)C 1188364329 ASLILGMOGIEPDW-MRXNPFEDSA-N 441.391 4.375 10 10 IICE COc1ccc(N(C)CC(=O)N(C)[C@@]2(c3ccccc3Cl)CCCCC2=O)cc1F 1191890760 BKPFJODDGIROJV-HSZRJFAPSA-N 432.923 4.421 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C)C[C@H]2Cc2ccccc2)c(C)n1-c1ccccc1 1253808624 VYKKHFMDAIFURP-AREMUKBSSA-N 430.596 4.205 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cc(Br)cc([N+](=O)[O-])c3N)c2)CC1 1293767423 CPRCYJRHPPFSPC-UHFFFAOYSA-N 433.306 4.428 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C 1294683918 ACXYOCUMSSJGIK-INIZCTEOSA-N 441.366 4.293 10 10 IICE O=C(Nc1ccc(O)c(C(=O)NCc2c(O)ccc3c2CCCC3)c1)OCC(F)(F)F 1294869880 PACVOFPAWXXLLO-UHFFFAOYSA-N 438.402 4.017 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)OC 1313772416 RAZKMUKTESGAPQ-DENIHFKCSA-N 437.588 4.393 10 10 IICE Cc1ccc(Cn2ncc3c(C(=O)NCc4ccc(N(C)C)cc4C)cc(C)nc32)cc1 1353247534 ZHGSFHJGDNJTNK-UHFFFAOYSA-N 427.552 4.401 10 10 IICE CC(C)c1nnc(N2CCS[C@@H](C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1359726478 MYMWGOZVMDTGRE-ROUUACIJSA-N 431.675 4.333 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CC[C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1436972472 QVMZPWOJEWJPBI-UXHICEINSA-N 445.604 4.065 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccccc2F)on1 1445884761 QICUPCLOQQQNRM-INIZCTEOSA-N 429.879 4.234 10 10 IICE CCOC(=O)C[C@@H](SCC(=O)c1cc(C)n(-c2cccc(F)c2)c1C)C(=O)OCC 1473026089 OXDKBPLJJVEAOE-HXUWFJFHSA-N 435.517 4.034 10 10 IICE CS[C@H](C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1505164568 ICQFBHFOHOCRLB-GOSISDBHSA-N 429.634 4.160 10 10 IICE CCN(CC)[C@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O)c1ccco1 1515521788 GKXMOVCEPDBEHA-DENIHFKCSA-N 439.560 4.148 10 10 IICE COc1cc(N2CCN(C(=O)CSc3ccc(C(C)C)cc3)CC2)cc(OC)c1OC 1521837010 NGHMHVUAMNYWHA-UHFFFAOYSA-N 444.597 4.277 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(I)c(F)c1 1525761905 IFUAEOCXNFGDOQ-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(C)c1 1526898388 QWTXNMRUGRKMNP-XSFVSMFZSA-N 442.581 4.393 10 10 IICE CC(C)CCc1nnc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)s1 1531956561 XXNNAESSBLBKQC-UHFFFAOYSA-N 425.602 4.487 10 10 IICE CCN(CC)c1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1540626165 YETNKUTURUUURD-UHFFFAOYSA-N 445.566 4.353 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1[C@@H]1CCC[C@@H](C(F)(F)F)C1 1541639195 ZANWSWYRTNEJAZ-HZPDHXFCSA-N 439.482 4.052 10 10 IICE Cc1cc(CNC(=O)CS(=O)(=O)Cc2ccc(Cl)s2)c(C)n1-c1ccccc1 1544081114 RKVUTOGCKZCHCQ-UHFFFAOYSA-N 436.986 4.040 10 10 IICE Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2ccc(C)c(O)c2O)cc1 1544259872 BJBFLNRUSPJNBE-UHFFFAOYSA-N 448.519 4.442 10 10 IICE CC[C@@H](C)c1nnc(N2CCCO[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1545509612 LBTMJTKQVGVRLR-MOPGFXCFSA-N 429.634 4.008 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cc(F)c(F)cc2N2CCOCC2)c1 1556519872 WYTQTBONKCUKPW-UHFFFAOYSA-N 439.462 4.274 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCOC(C)(C)C2)sc(C)c1-c1ccccc1 1559544755 GMOABNVXUITJCL-UHFFFAOYSA-N 430.570 4.340 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C(=O)OC)[C@H]4CCCC[C@H]43)ccc21 1585636324 JJZZFOATPMAZIU-RZUBCFFCSA-N 426.557 4.098 10 10 IICE CCc1nc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c(C)o1 1585834474 DPZSUGVFYKGTDS-UHFFFAOYSA-N 426.274 4.270 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCCC[C@H]3NC(=O)c3ccccc3)ccc21 1587720456 DOEYCAAQQNQXNX-DNQXCXABSA-N 447.579 4.376 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CSC(c3ccccc3O)=N2)cc1 1595385665 SGBRXUVEQOEBCN-OAQYLSRUSA-N 435.549 4.142 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1596787701 IGRHWMVOAZIVEA-UHFFFAOYSA-N 435.499 4.328 10 10 IICE COc1c(C)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1C 1618253404 NJAVXINLMHYQPL-OAQYLSRUSA-N 441.572 4.374 10 10 IICE Cc1cc(NC(=O)c2ccco2)sc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1627463692 CBVCGWSOHGPGJL-SFHVURJKSA-N 440.569 4.001 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2cc(Cl)ccc2OC)CCCC1 1627484218 XBNWSCBVYGBSJK-JOCHJYFZSA-N 442.943 4.041 10 10 IICE CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1628079596 FSCAXFQUJIWCEV-UHFFFAOYSA-N 431.536 4.271 10 10 IICE Cc1nc(N)c2c(C)c(C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)sc2n1 1631513536 SQWZPOURURAVBJ-UHFFFAOYSA-N 437.491 4.161 10 10 IICE O=C(c1cc(S(=O)(=O)Nc2ccccc2)ccc1Cl)N1Cc2cccc(O)c2C1 1632708740 DYTIDBNJRCMSGU-UHFFFAOYSA-N 428.897 4.002 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2C[C@@]3(C)CS(=O)(=O)C[C@@]3(C)C2)cc1 1637486952 RYPVFIZMCRPRGC-ZRZAMGCNSA-N 440.569 4.065 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(OCc3ccccc3)ccc2O)N(C)C)cc1 1647080428 DUTZWYOMWGZUJY-DEOSSOPVSA-N 433.552 4.070 10 10 IICE Cc1cc(C(=O)COc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c(C)n1-c1ccc(Cl)cn1 1656721332 KONUZBWWIHAZAF-UHFFFAOYSA-N 430.804 4.221 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCc1cnc(SC2CCCC2)nc1 1673149532 JLEIYQCSWKLPMF-SFHVURJKSA-N 441.645 4.359 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](Cc3ccccc3)c3ccccn3)C2)cc1 1673825400 AUYDETUOHUODFR-BWKNWUBXSA-N 430.552 4.200 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@H](Oc3ncccc3F)C2)c(C)n1-c1ccccc1 1684322507 PZSUPPZQPRTHCJ-QFIPXVFZSA-N 436.531 4.424 10 10 IICE C[C@@H](NC(=O)NC[C@@](O)(c1ccc(Cl)cc1)C(F)(F)F)c1ccc(N(C)C)cc1 1686174083 WSKOTEHTRABRQO-BFUOFWGJSA-N 429.870 4.216 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCCC[C@H]3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1694712262 XCXKBLJKYGLODW-TZIWHRDSSA-N 442.627 4.185 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1696425043 YERBWXFIBFZTPD-SFHVURJKSA-N 425.602 4.331 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCN(c3cccs3)CC2)nnc1C(C)(C)C 1707305802 MGFGAQZODSVZKQ-UHFFFAOYSA-N 438.645 4.386 10 10 IICE CSC[C@@H]1CCCN1c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1731098604 JHKSNERWMMKQKG-KRWDZBQOSA-N 446.671 4.235 10 10 IICE CSCCCN(C)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N(C)C)c(F)c1 1750323889 YREQFKFCDPZRBM-UHFFFAOYSA-N 448.999 4.436 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@@](C)=O)CC1 1764944616 HJLQGJSXPGQWDS-SSEXGKCCSA-N 425.602 4.110 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N2CCC(CCCO)CC2)cc1F 1766912243 RUVURZAJIRFDEY-UHFFFAOYSA-N 443.611 4.253 10 10 IICE COc1ccc(CCNC(=O)[C@@H]2CCc3c(c4cc(Cl)ccc4n3C)C2)cc1OC 1858153490 IUJPSNLUEHDASV-MRXNPFEDSA-N 426.944 4.313 10 10 IICE C[C@](Cc1cccc(O)c1O)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1951724415 OGVXQNFROLBEAT-RUZDIDTESA-N 433.460 4.022 10 10 IICE CCN[C@H](c1ccc(N(C)C)cc1)[C@@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 2044747902 JXLVWOHESYVLBL-DNQXCXABSA-N 440.632 4.429 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)CC23CC3)c1O 2236055253 OVWQBTJKRVIIDI-MRXNPFEDSA-N 441.366 4.043 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3ccc(-c4csc(C)n4)cc3)CC2)cc1 32843833 KXQXYAGFCJBPGE-UHFFFAOYSA-N 436.581 4.201 10 10 IICE COC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N(Cc4ccccc4)C(=O)N=C3O)o2)cc1 33447348 XGNVNSLQWQABCB-UYRXBGFRSA-N 430.416 4.236 10 10 IICE CC(C)CN1C(=O)/C(=C\c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33490827 HCYUTKNMVUCFOR-SFQUDFHCSA-N 442.610 4.296 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(-c4ccc(Cl)cc4)c3O)C2=O)cc1 33907756 COKWZCMENAIKHX-WQRHYEAKSA-N 436.855 4.355 10 10 IICE FC(F)(F)c1cc(N2CCOCC2)ccc1CNCc1nccn1Cc1ccccc1 734158960 XXIZXKLZDVLXNC-UHFFFAOYSA-N 430.474 4.077 10 10 IICE C[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N[C@H](C)c1cc2ccccc2o1 751930723 IALGOKHDTSXFNP-HUUCEWRRSA-N 449.532 4.485 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3cccc(Cl)c3)cc2F)C[C@@H](C)O1 753779118 LEOKRAIAOBXCLM-IXDOHACOSA-N 433.955 4.060 10 10 IICE O=[N+]([O-])c1ccc(Br)c(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)c1 775467697 QEHQFSUYISBKEY-UHFFFAOYSA-N 442.074 4.171 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCOc2c(Cl)cccc21 775777211 MVYJNOPJXZMNQY-HXUWFJFHSA-N 447.938 4.153 10 10 IICE C[C@H](NC(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1)c1ccc(N(C)C)cc1 787535363 VQKDCSKJRBTRST-HNNXBMFYSA-N 429.590 4.248 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nc(Br)ccc1F 788694031 UDRZBNFXLIEWTM-MRXNPFEDSA-N 447.396 4.366 10 10 IICE C[C@H](c1ccccc1)N(C(=O)C(=O)Nc1nc(C(F)(F)F)cs1)c1ccc(N)cc1 793044033 YGUDZBVXESUPTI-GFCCVEGCSA-N 434.443 4.477 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc(Cl)c1 1125325888 RTUXSHNCIQPFEU-KNQAVFIVSA-N 427.976 4.242 10 10 IICE O=C(CSc1ccc(Cl)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127181096 CDICPEZEKBLVOR-UHFFFAOYSA-N 430.017 4.281 10 10 IICE C[C@H](CC(=O)c1ccc(F)cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1142713319 SWZXOFLRPWRZHF-WZONZLPQSA-N 426.532 4.308 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccccc1OC 1159033393 HQUIYPYWVPURHJ-XMSQKQJNSA-N 444.959 4.450 10 10 IICE CCOc1ccc(N2CCN(CC(=O)NCC3(c4ccccc4)CCCCC3)CC2)cc1 1168331588 KZSXEZOWARXDHE-UHFFFAOYSA-N 435.612 4.226 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NCC1(c2ccc(F)cc2)CCCC1 1192012693 JDMQCXARUHVMCW-HSZRJFAPSA-N 440.559 4.141 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1230702709 KNTMSPIPZFEXTN-KRWDZBQOSA-N 428.577 4.097 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCc2nc(-c3ccccc3F)cs2)N(C)C)cc1 1248169253 SNJWMLNJWAWVKA-NRFANRHFSA-N 441.576 4.117 10 10 IICE O=C(NCCc1c[nH]c2cc(F)c(Cl)cc12)NCc1cccc(Br)c1O 1253829293 ZPEBHZRPHFWDRB-UHFFFAOYSA-N 440.700 4.470 10 10 IICE CC(C)[C@H]1OCC[C@H]1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1287304817 DMBYUZUHMKOHNH-SIKLNZKXSA-N 426.586 4.334 10 10 IICE CC(C)N(Cc1ccco1)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1287946258 DASYAPZIILDVFC-GOSISDBHSA-N 427.524 4.043 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@H](C1CCCCC1)N(C)C 1298363596 HNONFRLYUYIPDS-GGAORHGYSA-N 441.620 4.372 10 10 IICE CCOC(=O)C[C@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccc(F)cc1F 1303716563 IQLFKWIAPISDDT-FQEVSTJZSA-N 427.451 4.192 10 10 IICE Cc1cccc([C@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1C 1312833215 GQLYVIZZXZHIGU-JOCHJYFZSA-N 429.511 4.465 10 10 IICE CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1438307600 YVIQWPNEGZPOHP-VWLOTQADSA-N 446.526 4.078 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3cn(C)nn3)C2)c(C)n1-c1ccc(Br)cc1 1457174848 IPTSRSSTPNKPNW-MRXNPFEDSA-N 442.361 4.005 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCOc2ccccc21 1458517380 HQVBPROLNGFZJY-XMHGGMMESA-N 442.537 4.233 10 10 IICE CC[C@H](C)CCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1461441641 XDLKZMKDBJZKCN-XBUHWIKASA-N 441.416 4.203 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCSC1 1495753013 OPXGOOSPPSWKPR-IRXDYDNUSA-N 433.597 4.019 10 10 IICE CCC(CC)N1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@H](C)C3)CC1=O 1515517926 DAPOLPNJUDKJLS-GJZGRUSLSA-N 434.602 4.414 10 10 IICE C[C@H]1CC[C@@](C)(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1(C)C 1517866883 XUPJCTMFZQKSIF-BVZFJXPGSA-N 439.579 4.021 10 10 IICE COc1ccccc1C[C@H](C)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1519556124 MERXLYKIWBBTLW-NRFANRHFSA-N 435.612 4.112 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4cccc(Br)c4)no3)CC2)cc1 1519586182 NPMPDIOCEGZUJO-UHFFFAOYSA-N 442.313 4.075 10 10 IICE Cc1cc(CC(=O)NC2(c3ncc(Br)cn3)CCC2)c(C)n1-c1ccccc1 1538277653 YGMKNOAKRRIHQG-UHFFFAOYSA-N 439.357 4.385 10 10 IICE CO[C@H](C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccccc1 1538920171 QCPDMWIUFPKEIV-IBGZPJMESA-N 437.297 4.485 10 10 IICE COc1ccc(-c2cc(C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)nn2C)cc1OC 1539336396 HMEMAZPIHMAZDN-UHFFFAOYSA-N 448.567 4.367 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1(C)C 1541085342 ZDSXAWGYBBHUBW-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)O[C@@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1541437503 LUNVENXHJWSFBF-SFTDATJTSA-N 425.621 4.375 10 10 IICE Cc1ncc(CN(C)c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)s1 1542957077 OVHWPAJRJDKNFI-OAQYLSRUSA-N 440.617 4.344 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3cccs3)n2Cc2ccc(N(C)C)cc2C)n1 1543018699 BDVJRTSXKQOAIU-UHFFFAOYSA-N 449.628 4.260 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H]1CC(=O)c2ccccc21 1546230043 HPHJIXDGXLMJQR-GYKGCMEESA-N 442.587 4.173 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(NS(=O)(=O)C(F)(F)F)c(C)c2)cc1 1596578468 JYXACRMRFUKPET-UHFFFAOYSA-N 443.491 4.033 10 10 IICE Cc1cc(C(=O)NCc2cc(=O)n(-c3ccccc3)n2C)c(C)n1-c1ccc(Cl)cc1 1596949287 UXHACWGRKWVQHM-UHFFFAOYSA-N 434.927 4.167 10 10 IICE CC(C)[C@H]1OCCC[C@@H]1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1603172450 WBDWWNGZAZJDIF-HYBUGGRVSA-N 435.572 4.057 10 10 IICE Cc1ccc(C(=O)N[C@H](Cc2nc[nH]n2)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1616723637 KECRHFYYKYEROT-JOCHJYFZSA-N 427.508 4.047 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@](O)(CC)c1cccc(Cl)c1 1622327866 DACDLHGZTDUEKK-IBGZPJMESA-N 426.738 4.454 10 10 IICE Cc1cc(C(=O)NCCCN2C(=O)COc3ccccc32)c(C)n1-c1cccc(Cl)c1 1629142699 KWGPZFDMSGXBGQ-UHFFFAOYSA-N 437.927 4.293 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccccc4Cl)[nH]n3)cc2F)C[C@H](C)O1 1630549975 FJBHZZRVCLBVOZ-GJZGRUSLSA-N 442.922 4.413 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(OCC(F)(F)C(F)F)nc2)cc1F 1633259675 VHVGECDGLMVXCH-UHFFFAOYSA-N 431.405 4.276 10 10 IICE O=C(C[C@@H]1CCc2sccc2C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635945741 AQWGNOCUXBVNBY-WMLDXEAASA-N 432.973 4.023 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1nn(-c2ccccc2)cc1Br 1635964415 OTSKATCKHIVKCO-UHFFFAOYSA-N 426.314 4.149 10 10 IICE COc1cc(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1OCCN(C)C 1638243182 BPHWMOCSOMNCSL-UHFFFAOYSA-N 425.504 4.435 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)C(=O)N([C@H](C)c3ccccc3)C2=O)c1C 1656211817 LLIBRTFFNARBMH-GOSISDBHSA-N 443.503 4.137 10 10 IICE CCCN(CCc1cccs1)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1658159041 XZUOTJZXXOMDMU-UHFFFAOYSA-N 432.545 4.417 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C 1683254392 PTBDHEBALNKWKD-SVFBPWRDSA-N 446.636 4.184 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2COc3cccc(Br)c3C2)C2CC2)cc1 1684911587 RRVMLEOHDOUEOA-MRXNPFEDSA-N 444.373 4.193 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC=C(c2cccc(Cl)c2)CC1 1687155910 ZSWIWVMOLUMCIV-UHFFFAOYSA-N 425.960 4.300 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCCC(F)(F)F 1691663494 ZIEDYAJRWQDMGE-UHFFFAOYSA-N 425.499 4.217 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cc(C)on1 1697110331 KPMPGBAZKRZYFT-GOSISDBHSA-N 434.544 4.320 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C2CC2)O1 1726704934 RSAHTCRNPACPKX-IERDGZPVSA-N 429.584 4.124 10 10 IICE Cc1nc(Cc2nnc(N(C)CCC3CC3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1751767238 ADXANVITXXFAQR-UHFFFAOYSA-N 428.581 4.124 10 10 IICE CCOCc1nnc(N2CCSC(CC)(CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1766446695 RKMLYLQCHZWFHK-UHFFFAOYSA-N 435.613 4.180 10 10 IICE CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1sc2c(c1C(=O)OC)CC[C@@H](C(C)(C)C)C2 1866192037 FAMLBHZRVKNFDE-KFWWJZLASA-N 434.602 4.177 10 10 IICE CC[C@H](NC(=O)[C@@H](C)C1CCCC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1867020660 DUVHNZWIIHUSIW-YWZLYKJASA-N 432.520 4.122 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2CC2)c(C(=O)OC)c1I 2078992379 NRELWNCXZNLEAD-ZDUSSCGKSA-N 440.281 4.165 10 10 IICE Cc1ccc(C2=NN3C(=N)C(=Cc4cc(Br)ccc4O)C(=O)N=C3S2)cc1 2293497270 HNYUUPHVMMZQHE-UHFFFAOYSA-N 441.310 4.131 10 10 IICE COc1ccc2cc(C=C3SC(=S)N(c4ccc5c(c4)OCO5)C3=O)c(O)nc2c1 2296625819 QXIASKLOQXHIEW-UHFFFAOYSA-N 438.486 4.084 10 10 IICE Cc1cccn2c(=O)c(C=C3SC(=S)N(C)C3=O)c(Oc3ccccc3Cl)nc12 2314509706 XEIZANJZXBPISK-UHFFFAOYSA-N 443.937 4.280 10 10 IICE CC[C@H](CO)N1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)SC1=S 2323807812 CQOGKOMEWLHNSJ-QGZVFWFLSA-N 429.563 4.246 10 10 IICE Cc1ccc(CNC2CC3(CCN(C(=O)OC(C)(C)C)C3)C2)c(O)c1Br 2352931683 BVZILEVKGINGHX-UHFFFAOYSA-N 425.367 4.342 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N(NC(=O)c2cccc([N+](=O)[O-])c2)C1=O 1452251 BBFSIEPNQMJCNX-VHDJGTGISA-N 425.491 4.087 10 10 IICE COc1cc([N+](=O)[O-])ccc1-n1cccc1/C=C1\C(=O)N(c2ccc(C)cc2)C(=O)N=C1O 20210157 JVEKMFMGFXRGAA-PDGQHHTCSA-N 446.419 4.209 10 10 IICE Cc1ccc(-n2c(C)cc(CC(=O)Nc3ccc(C(=O)N4CCOCC4)cc3)c2C)cc1 97427133 UEUJWASFCWLWFL-UHFFFAOYSA-N 431.536 4.056 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)/C2=C(\C)NC[C@@H]2CCCO2)cc1 205962557 YWYVEMBZYCRXLA-CQHJRZBDSA-N 448.548 4.098 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cc(OC)ccc3OC)[C@H]2c2ccc(O)c(O)c2)c1 526226036 BXELESJLCYQYSS-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CC[C@H](C)C[C@H]3c3ccco3)cc2F)CC1 745808027 JNEKJFPLUHHCRG-AVRDEDQJSA-N 428.552 4.243 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCC(=O)c2ccc(F)c(F)c2)cc1 755262196 ODBLAJPHZQKHIW-FQEVSTJZSA-N 430.495 4.202 10 10 IICE COCCc1cc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n(C)n1 768344759 VYNRITUQTIZZBX-UHFFFAOYSA-N 431.334 4.031 10 10 IICE C[C@@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)c1ccc(N2CCOCC2)cc1 770278649 JMLSQFZZXVHTBU-QGZVFWFLSA-N 427.504 4.009 10 10 IICE CCN1CC[C@@H](NC(=O)NCCCSc2nccs2)[C@@H]1c1cc(F)c(F)c(F)c1 782732852 NMUMRXROTOXIDK-WBVHZDCISA-N 444.548 4.177 10 10 IICE COc1cc(Br)cc(CN2CCOC[C@H]2Cc2c[nH]c3ccccc23)c1O 799737612 JJUUHFKIAALWRP-QGZVFWFLSA-N 431.330 4.088 10 10 IICE CNC(=O)C[C@@H](NC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)c1ccccc1 800717782 RNHUSYMETNFQJQ-LAUBAEHRSA-N 442.991 4.253 10 10 IICE O=C(NCc1cc(F)cc(Br)c1)NCc1cc(Br)ccc1O 804940834 ZIVULTJBTTZFML-UHFFFAOYSA-N 432.087 4.056 10 10 IICE COc1ccc(N2CCN(C(=O)CSCc3csc(Br)c3)CC2)cc1 917953712 DHNQSEUEXXXWCS-UHFFFAOYSA-N 441.416 4.101 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccccc3[N+](=O)[O-])C2=O)cc(OC)c1OC 1084075089 CNLQOVXTEGYDDT-MHWRWJLKSA-N 432.479 4.026 10 10 IICE CC[C@H]1N[C@@](N=Nc2ccc([N+](=O)[O-])cc2)(P(=O)(OC(C)C)OC(C)C)OC1=O 1088716041 OBJIVGDTIWTEFE-WBVHZDCISA-N 428.382 4.258 10 10 IICE O=C(CCC[C@H](O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1136285111 QCZBAUWWZHTROR-NRFANRHFSA-N 436.474 4.062 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(-n4ccc(C(N)=O)n4)cc3)c2C)c1 1136531190 YBFXPWMFECRDDH-UHFFFAOYSA-N 427.508 4.248 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)CC2CCCC2)c(C)n1-c1ccc(Br)cn1 1139357073 SCOMOFSLOQEFHT-QGZVFWFLSA-N 434.378 4.170 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1NC(=O)OC(C)(C)C 1167762379 LQDRUKPVZPKROW-UHFFFAOYSA-N 439.556 4.233 10 10 IICE O=C(c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F)N1Cc2cccc(O)c2C1 1175029362 CHTGISCWYBYVSB-UHFFFAOYSA-N 435.320 4.430 10 10 IICE C[C@@H](N[C@H](C)c1cccc(F)c1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1192803165 PEUNRARMVMHOAF-ZIAGYGMSSA-N 434.442 4.418 10 10 IICE CCCCOc1c(Cl)cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OC 1266269442 YYYNVSQLJYMLDT-UHFFFAOYSA-N 432.948 4.499 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@](C)(O)c1ccc(F)c(Br)c1 1290334817 PNHXLFQJRWECMG-JOCHJYFZSA-N 449.364 4.445 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1293606576 FMKNBPDTLBLQGF-SIKLNZKXSA-N 443.661 4.082 10 10 IICE CCC(C)(C)Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1305285090 IBJCYHOXZBXKNB-OAQYLSRUSA-N 441.620 4.081 10 10 IICE Cc1oc(Br)cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1354783868 FVDPSYXFUNSVFB-UHFFFAOYSA-N 447.251 4.136 10 10 IICE Cc1cc(CC(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2F)c(C)n1-c1ccccc1 1359824303 KJMAUAIUUSHCGK-JOCHJYFZSA-N 437.540 4.316 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)N(C)C)cc1 1439959396 FBIOOVQAROEMJU-HBMCJLEFSA-N 435.490 4.174 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)O[C@H](C3CC3)C2)sc(C)c1-c1ccccc1 1460038604 LOUFKRMHRNWFGO-KXBFYZLASA-N 442.581 4.338 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCCC3=O)c(F)c2)cc1 1465035556 UQTMLBQJPXMSTQ-UHFFFAOYSA-N 433.483 4.354 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc2c(Cl)nccc2o1 1467631771 QIKKXEFAZNMLNT-UHFFFAOYSA-N 429.904 4.483 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1 1469104249 OPULWNUXCUYDLU-QUCCMNQESA-N 440.563 4.191 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(C(=O)OCc2ccccc2)cc1 1470392742 HTOFEXYNIOVYBV-UHFFFAOYSA-N 431.536 4.451 10 10 IICE Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2O)ccc1F 1471195314 WAZJGNPFLBHCHB-HNNXBMFYSA-N 428.485 4.132 10 10 IICE COc1ccc(N2CCCN([C@@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC2)cc1 1473114490 DHKITFUNSFVSKF-OAQYLSRUSA-N 433.474 4.032 10 10 IICE Cc1cnn([C@@H]2CCCN(c3nnc(CC(C)C)n3Cc3ccc(N(C)C)cc3C)C2)c1 1511404462 IRLNLBLIUIUYEF-HSZRJFAPSA-N 435.620 4.246 10 10 IICE Cc1cc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1F 1523934932 PLZDIVXVQZLHFQ-WQRHYEAKSA-N 432.517 4.181 10 10 IICE Cc1cc(Cl)c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 1527480810 ARABBZXAYOOITM-ZIAGYGMSSA-N 435.883 4.239 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4cccc(Cl)c4)CCOCC3)C2)cc1 1537109005 ILDYEKQIPJHIKW-SFHVURJKSA-N 428.960 4.040 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]1C 1564946000 WOEXRKYIOFVHOQ-OTWHNJEPSA-N 432.609 4.031 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2C)c1C 1570303604 BEERDZCWKXSIRV-UHFFFAOYSA-N 425.554 4.214 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c1C 1585112686 YOMYZQFKNYTJHV-QHCPKHFHSA-N 436.625 4.183 10 10 IICE Cc1cc(C(=O)NCCCSc2nccs2)nn1-c1ccc(Br)cc1 1585222175 HULAOPMXOIRFJS-UHFFFAOYSA-N 437.388 4.312 10 10 IICE O=C(CCCc1ccc(Br)s1)NCc1ccc(N2CCC(O)CC2)cc1 1585536244 WPOOCEUOTCDIKO-UHFFFAOYSA-N 437.403 4.111 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1c(Cl)cccc1C(F)(F)F 1586864985 WSRSPPMYOMCJJF-UHFFFAOYSA-N 430.829 4.389 10 10 IICE Cc1cc(CCNC(=O)c2ccccc2S(=O)(=O)C(F)F)c(C)n1-c1ccccc1 1595949745 FPMNTEANLYZAKP-UHFFFAOYSA-N 432.492 4.063 10 10 IICE CCc1c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnn1CCC(C)C 1596695346 QZAFGTXVHSXAMU-HDICACEKSA-N 430.568 4.174 10 10 IICE CC(=O)N1CC[C@@H](C)c2ccc(S(=O)(=O)N(Cc3ccccc3O)C3CCCC3)cc21 1621833433 PAHNQYVYQFHEBV-QGZVFWFLSA-N 442.581 4.386 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCC[C@@H]2COC(=O)NC(C)C)c1 1627003149 WRIUZDZSTYJJEZ-JOCHJYFZSA-N 425.529 4.036 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc2cc(O)c(O)cc2s1 1634385340 YQYQXLUXZOEFBP-UHFFFAOYSA-N 442.537 4.315 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCSc1nc2ccccc2s1 1638529719 UAXLMUPAODYEJO-UHFFFAOYSA-N 430.551 4.076 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H]1CN(c2ccc(Cl)cc2)CCO1 1640552399 CFNRZURZCLZPIQ-IBGZPJMESA-N 429.973 4.444 10 10 IICE COC(=O)[C@@H]1CCc2sc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)nc2C1 1643164508 NTSDZOSUQYMHAS-OAHLLOKOSA-N 439.537 4.089 10 10 IICE Cn1cc(C(=O)N2C[C@@H](CCNC(=O)OC(C)(C)C)c3ccccc32)c(-c2cccnc2)n1 1645385696 XKRSLUAHLPXQLX-GOSISDBHSA-N 447.539 4.141 10 10 IICE CN(C)c1ccc([C@@H](CNc2ncnc3cc(F)c(Br)cc23)N(C)C)cc1 1651498003 BQMRYBBIXPYJDE-LJQANCHMSA-N 432.341 4.312 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c(O)cc(Cl)cc1Cl 1654410219 VGZIZHZFASQEGQ-AWEZNQCLSA-N 429.731 4.452 10 10 IICE CC[C@](C)(NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1655293723 XGYFLSAKZPJCJV-GAKIBJFNSA-N 445.554 4.110 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCc1cc(Cl)cc(S(=O)(=O)CC)c1 1683206653 KMQFZXCZDNQWIX-UHFFFAOYSA-N 438.977 4.351 10 10 IICE C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1683701685 HZUSFBLCWHWUOJ-GOSISDBHSA-N 448.533 4.230 10 10 IICE CC(C)c1nnc(N2CCO[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1706320210 RASXMWYOTURWDA-NRFANRHFSA-N 443.661 4.254 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1C[C@H](C)C(F)(F)[C@H](C)C1 1707305710 JPBSLZQAGNQGLB-FUHIMQAGSA-N 433.547 4.280 10 10 IICE C[C@@H](Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)N(C)C1CC1 1741866225 CAURXMGPXYCKEL-UCNVEGJOSA-N 441.620 4.021 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)C[C@@H]1CCCOC1 1742141500 ILAXCVBZXJAMIX-FQEVSTJZSA-N 439.629 4.216 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@@H]1CCO[C@@H](C)C1 1742940754 GVULNBWHYYLLDW-LEWJYISDSA-N 441.620 4.080 10 10 IICE CC(C)NC(=O)c1nnc(N(C)[C@@H]2CCC[C@H](C)C2)n1CCCSc1nccs1 1743021879 MGVAVKFOEYITFQ-JKSUJKDBSA-N 436.651 4.070 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1746090452 ZAQWUIJIOWCHTJ-NTKDMRAZSA-N 448.615 4.404 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1750859922 UAKZITQRPPEEEN-SFHVURJKSA-N 444.630 4.230 10 10 IICE CCc1nnc(Cn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1762832261 TVNGCHFIOPMUHJ-UHFFFAOYSA-N 439.633 4.175 10 10 IICE C[C@H]1SCCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)[C@@H]1C 1763290151 JOQPCWTUHMOWMT-HZPDHXFCSA-N 446.671 4.233 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1766822933 LXDGZMXZFQGRJU-IRXDYDNUSA-N 437.635 4.164 10 10 IICE COc1cc(OC)c2cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)n(C)c2c1 1874179412 CIUIOKVHAJHFLV-UHFFFAOYSA-N 440.455 4.223 10 10 IICE Cc1ccccc1COc1ccc(C=C2C(=N)N3N=C(N4CCCC4)SC3=NC2=O)cc1 2297352622 HGKWEXHGXYANAV-UHFFFAOYSA-N 445.548 4.246 10 10 IICE Cc1nn(-c2ccccc2)c(Cl)c1/C=C1\SC(=S)N(NC(=O)CC(C)C)C1=O 3079126 BMIQQMLMTFFAAR-GDNBJRDFSA-N 434.974 4.113 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(F)cc3)C2=O)ccc1OCCC(=O)O 16919551 FHCYSJFLJWXLRI-LDADJPATSA-N 447.509 4.484 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccccc3[N+](=O)[O-])C2=O)cc(OC)c1OC 59396937 CNLQOVXTEGYDDT-YBEGLDIGSA-N 432.479 4.026 10 10 IICE CCN(C(=O)c1ccccc1-c1ocnc1C(=O)NCc1ccccn1)c1ccccc1 65305659 VEVYQDMVFSRVOX-UHFFFAOYSA-N 426.476 4.333 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3OC)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526405451 DBVMFSRIZWGPHO-HSZRJFAPSA-N 449.459 4.181 10 10 IICE O=C1/C(=C/c2ccc(-c3cccc(F)c3)s2)SC(=S)N1CCN1CCOCC1 725903779 ACJMGVVMIZXRSW-AQTBWJFISA-N 434.583 4.088 10 10 IICE CN(C(=O)OC(C)(C)C)C1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 730565677 SHUGTGRQRWZSSX-UHFFFAOYSA-N 440.540 4.160 10 10 IICE Cc1cc(CCNC(=O)c2cc(O)nc3ccc([N+](=O)[O-])cc23)c(C)n1-c1ccccc1 735270198 OLZKQLIBGAAMSQ-UHFFFAOYSA-N 430.464 4.229 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1 751302706 PUXUKNAJIJGILG-IAGOWNOFSA-N 435.528 4.418 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)C1 768129704 ANRRSKWOMWKIHA-QHCPKHFHSA-N 443.950 4.050 10 10 IICE COc1ccc(N2CCC(N[C@@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(F)c3)CC2)cc1 773102057 FFVFCRSWMKOCCG-GGAORHGYSA-N 431.939 4.018 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3nnc(-c4cc5ccccc5o4)s3)CC2)cc1 787461404 GBIQZQCMKJSDQW-UHFFFAOYSA-N 435.509 4.314 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCC[C@H](CNC(=O)CC(F)(F)F)C3)c2C)c1 804200741 CQTAFKOWYYKEAH-GOSISDBHSA-N 435.490 4.323 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCO2)c2ccccc2n1 812292913 NBOWOPFKXMHHCD-LJQANCHMSA-N 429.524 4.323 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(-c4cccc(Br)c4)no3)C2)cc1 1130826904 MPIBCQHHEORQIB-INIZCTEOSA-N 442.313 4.121 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)ccc21 1131535911 KUXFLUVSVUUJFC-PMACEKPBSA-N 441.572 4.128 10 10 IICE CN1CCN(c2ccc(CNC(=O)Cc3coc4c(Cl)c(Cl)ccc34)cc2)CC1 1132902994 QVQLVRYTGPRARM-UHFFFAOYSA-N 432.351 4.350 10 10 IICE Cc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(N)c1Cl 1147506378 NXMIDXZXQXBQSC-SFHVURJKSA-N 446.979 4.292 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@@]3(C2)CN(Cc2ccccc2)C[C@H](C)O3)c1O 1197272707 DGMZCLKPJORRTA-BXKMTCNYSA-N 428.960 4.114 10 10 IICE Cc1nc(Br)sc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1265564090 BLMPIFGSRBREDJ-LLVKDONJSA-N 446.317 4.214 10 10 IICE Cc1cc(CC(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c(C)n1-c1ccccc1 1265632807 XHCYYKDTCDXHOZ-RUZDIDTESA-N 429.564 4.448 10 10 IICE CCOCc1nnc(N2CCCCCCC2)n1Cc1ccc(N2CCSCC2)cc1 1297243644 GINUXGKLKZTSSB-UHFFFAOYSA-N 429.634 4.187 10 10 IICE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccc(O)cc1O 1299574568 RZOOQGSQIOHHBJ-UHFFFAOYSA-N 446.503 4.031 10 10 IICE CCN(c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1313586791 UGGVSAKVPMXMNL-UHFFFAOYSA-N 427.524 4.105 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CSc2ccccc21 1360898194 WMFORTDBMABYEU-CJMVGXJBSA-N 444.578 4.380 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCOC[C@@H](C2CCC2)C1 1361097576 DHXYPADMRFJSBE-QFIPXVFZSA-N 425.621 4.152 10 10 IICE O=C(Cc1noc2ccc(Br)cc12)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446570289 VMMZBSYZJOCHKK-INIZCTEOSA-N 445.313 4.046 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cc(C(F)(F)F)ccc1=O 1446801200 HAVYZHNWNQNWRR-INIZCTEOSA-N 430.426 4.363 10 10 IICE COc1ccccc1N1CC[C@@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)C1 1464703402 CDVAEHLOJSNQHV-FQEVSTJZSA-N 431.536 4.172 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccccc3)[C@@H]3COC(C)(C)C3)C2)cc1 1470594030 QLIHDAPXFYGGDD-GMAHTHKFSA-N 437.584 4.301 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3)Cc3ccccc3)cc2)CC1 1471192055 VJGYZCSFYNAJQT-UHFFFAOYSA-N 428.580 4.350 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 1471211870 QZWBCTUXRHGCTG-FCHUYYIVSA-N 447.501 4.269 10 10 IICE O=C(NCC[C@@H]1CCC2(CCOCC2)CO1)N(Cc1ccco1)Cc1ccccc1O 1471328044 MFARYWVQDJLLBP-FQEVSTJZSA-N 428.529 4.063 10 10 IICE COc1ccc(N(CCc2ccccc2)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1 1473251883 YCFVCZUXBNOSDT-HSZRJFAPSA-N 426.557 4.380 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1514324378 YCPHXDZWFWEJGR-TZIWHRDSSA-N 443.661 4.398 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C1 1518588283 ZUMGTORYRQGNSV-OAHLLOKOSA-N 433.578 4.338 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cccc(NC(=O)[C@H]4CCCO4)c3)c2C)c1 1531611706 FCEPVUJQRPNMLJ-XMMPIXPASA-N 431.536 4.450 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)CC(C)C)CC2)c(C)n1-c1ccc(Br)cc1 1544469543 JGMPITLVISSHFM-UHFFFAOYSA-N 446.389 4.187 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2ccccc2)c(C)n1-c1cccc(Br)c1 1544531855 PPWHUZWGISILRT-IBGZPJMESA-N 441.369 4.438 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2c(F)cccc2C1 1544801646 XZASLZGNGIJIJK-UNOMPAQXSA-N 444.528 4.141 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)cc1 1545795824 PDADYSZYXDHTDH-GOSISDBHSA-N 432.520 4.087 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@H]1c1ncc(Br)cn1)c1ccc(N(C)C)cc1 1564596672 FDAMKCIUXLZSRZ-KDOFPFPSSA-N 432.366 4.303 10 10 IICE CCOC(=O)C1(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCC1 1565809550 OIOMLLPLVLHYJC-UHFFFAOYSA-N 433.346 4.320 10 10 IICE Cc1cc(C(=O)N2C[C@@H](O)C[C@H]2c2ccccc2)c(C)n1-c1ccc(Br)cn1 1570266378 NJLVSFYAPQQZCP-ICSRJNTNSA-N 440.341 4.200 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CNC(=O)Nc2cccc(Cl)c2)cc1 1595385481 PZHIKIVFPXBZLY-UHFFFAOYSA-N 440.931 4.350 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCNc2ncccc2C(F)(F)F)cc1 1596519884 XBYZJVBRUNLQET-UHFFFAOYSA-N 444.457 4.091 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)nc1C 1618665050 VCQBXYNEUVBEIA-SFQUDFHCSA-N 445.541 4.158 10 10 IICE CSCCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1620294672 DQRQJHQRPOEPFX-UHFFFAOYSA-N 436.629 4.254 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2ccc(Cl)nc2)C1 1624671161 SYOJLLIKTFIXOL-KAMXEHQASA-N 427.932 4.478 10 10 IICE C[C@H](NC(=O)[C@@]1(C)CC(c2cccc(Cl)c2F)=NO1)c1ccc(N2CCOCC2)cc1 1625882091 CPLXWZPHQKQBEW-NPMXOYFQSA-N 445.922 4.076 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)CCCC1 1626133613 VJSFPNBKINWRMM-KRWDZBQOSA-N 441.572 4.044 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc([C@@H](C)CC(N)=O)cc2)C1 1626881904 PYVCMOVLMKNACC-SFHVURJKSA-N 432.568 4.025 10 10 IICE CCc1ccc2c(c1)[C@H](CCNC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)C(=O)N2 1628128515 XNENDIKEECGYOC-QHCPKHFHSA-N 443.547 4.254 10 10 IICE Cc1cc(C)cc(OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1629678450 AGZWSASYTMRBPS-QFIPXVFZSA-N 441.572 4.130 10 10 IICE CCO[C@@H]1CN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C[C@H]1CNC(=O)OC(C)(C)C 1632095313 WYWABQGARFMIIH-IFMALSPDSA-N 441.572 4.096 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cnn(C(C)C)c1I 1635114186 OMMAGZCVCPOXCC-UHFFFAOYSA-N 441.313 4.217 10 10 IICE Nc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cccc1C(F)(F)F 1635946991 ORRYGNFMBZVQOH-CQSZACIVSA-N 427.854 4.041 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccccc1 1637410252 JXOSPVDKURRMMH-DEOSSOPVSA-N 448.542 4.223 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@H](O)Cc3cccc(Cl)c3)c2C)c1 1637577992 MEBUGFDIHZSOBC-HSZRJFAPSA-N 425.960 4.459 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC2CCN(Cc3cccc(Br)c3)CC2)cc1 1639083611 LNBQDNBJJUNEKS-UHFFFAOYSA-N 444.333 4.006 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc(-c2ccc(F)c(C)c2)nc1C 1639587990 NOLSKDGESDYGCE-UHFFFAOYSA-N 442.512 4.477 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3cccc(F)c3F)CC2)cc1 1639974090 VSRMJCUYCQMYBK-UHFFFAOYSA-N 437.490 4.076 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1640257647 YGAJUPBSSSNGQQ-QHSLDKKCSA-N 447.959 4.242 10 10 IICE COc1cc([C@H](C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)ccc1S(C)(=O)=O 1640751736 SMRIZSIFRUTUDG-KRWDZBQOSA-N 440.565 4.306 10 10 IICE CCCN(CCc1cccs1)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1654070497 RGBMIANWYMNWLA-UHFFFAOYSA-N 432.545 4.417 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCCNC(=O)c3cccs3)cc2Cl)C1 1682023629 HTSYKTDSABYUGV-MRXNPFEDSA-N 449.020 4.257 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(Cc4c(F)cccc4F)CC3)C2)cc1 1683944429 DWHFABLTIHHBPV-SFHVURJKSA-N 429.511 4.216 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H]3c3ccc(Br)cc3)C2)cc1 1687022753 GUHMMCJBPPEDBK-PXNSSMCTSA-N 430.346 4.193 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC[C@@H](c2ccnn2C)C1 1707304651 BLCHWIHNKZPNFK-OAQYLSRUSA-N 435.620 4.017 10 10 IICE Cc1cc(-c2nnc(N3CC=CCC3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1751409290 XLQBLRJDEOPAKJ-UHFFFAOYSA-N 432.572 4.034 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@H]2CCC[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1769957223 WYPQZRKUYLCFFA-NSHGMRRFSA-N 447.599 4.270 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCSC(C)C)CC2)cc1 1770257662 DRWHVEIICSGCNP-UHFFFAOYSA-N 431.650 4.344 10 10 IICE CC(C)Oc1ccc(S(=O)(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1858074647 PRLSFGGUYSDYAG-DEOSSOPVSA-N 445.629 4.045 10 10 IICE CC[C@H](C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2c(Cl)nc3scc(C)n23)SC1=S 1858595604 DUGHPUQGNHMQQQ-LKLVHFPJSA-N 429.976 4.058 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)cc1 1860087683 NTBJGTXYUVTAOW-HMMYKYKNSA-N 426.563 4.328 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3c(C)cccc3CC)C2)sc2c1CCC2 1865921280 AKILWVAFMSHVQN-INIZCTEOSA-N 440.565 4.276 10 10 IICE COCCN1C(=O)C(Nc2cccc(C)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420149 HORCOEIPOQRHBY-UHFFFAOYSA-N 429.520 4.241 10 10 IICE Cc1ccc(NC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(CCN(C)C)C2=O)cc1 1873421461 ZGPXYSKSJBHAMH-UHFFFAOYSA-N 442.563 4.156 10 10 IICE Cc1ccc(O)c([C@@H](C)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c1 2084723463 YPVVYFNTRFYGTN-IFMALSPDSA-N 439.600 4.473 10 10 IICE CCN[C@H](c1ccccc1O)c1cc(Br)ccc1I 2090035543 SGWHGCBDUIMCMR-OAHLLOKOSA-N 432.099 4.458 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1ccc2nccnc2c1 2296608239 CTZQKGNOLMNIES-UHFFFAOYSA-N 434.546 4.250 10 10 IICE COc1ccccc1OCCCOc1ccc(C=C2SC(=S)NC2=O)cc1OC 2297347196 JXQZLVLDUDNPDJ-UHFFFAOYSA-N 431.535 4.041 10 10 IICE COc1ccc(NC=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccc(OC)cc2)cc1 2297460040 QTVUCMDYVXADOR-UHFFFAOYSA-N 444.447 4.359 10 10 IICE CCOc1ccc(C=C2C(=O)NC(=O)N(c3cc(C)c(C)cc3Br)C2=O)cc1 2313549319 STNMRNKUTQQRDZ-UHFFFAOYSA-N 443.297 4.131 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457541 DCTOPAUENYQMDX-RLSLOFABSA-N 435.568 4.299 10 10 IICE COc1ccccc1/C=C1/SC(=S)N(CCCC(=O)Nc2ccc(F)cc2)C1=O 210715271 UESQGVCHVVRXJD-QGOAFFKASA-N 430.526 4.454 10 10 IICE O=C1N=C(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)S/C1=C\c1ccc(Cl)cc1 606618912 PMCAZKFEXLSJRC-AQTBWJFISA-N 446.359 4.422 10 10 IICE Cc1c(S(=O)(=O)Nc2nc(-c3ccccn3)cs2)cnn1-c1ccc(Cl)cc1 743045967 IKWPDRFSISUQTH-UHFFFAOYSA-N 431.930 4.153 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1 743337069 PBHRGOYIBSJFEB-WMZOPIPTSA-N 428.529 4.104 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 779533976 LRUAYFDXPUBOPH-ANGAQGJPSA-N 425.529 4.413 10 10 IICE CC[C@@H](C)n1ncc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 790676574 KONFNNCYYIDJON-IIBYNOLFSA-N 443.592 4.224 10 10 IICE CC(C)C(=O)c1ccc([C@@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 801687781 JZPWRVFORMMEIG-OAQYLSRUSA-N 447.623 4.477 10 10 IICE CCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2cc(C)c(C)cc2Br)C1=O 1083973904 DWBICSPVRUUHRT-RVDMUPIBSA-N 443.297 4.131 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C\c3ccccc3C(F)(F)F)CC2)cc1 1124515463 GAOBVKIITVESTR-GHXNOFRVSA-N 447.501 4.056 10 10 IICE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1125519528 XMWNNLZHHYSYST-DFBJGRDBSA-N 447.620 4.278 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccnn1CC1CCC1 1132811029 PERCTPCKHIFJFT-ATVHPVEESA-N 444.557 4.052 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(CNC(=O)OC(C)(C)C)n(C)c2C)cc1F 1136730445 PJGPCLQDMDIHIH-UHFFFAOYSA-N 446.567 4.274 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)CC2)cc1 1151503438 VENFWMGHRWBKHI-NRFANRHFSA-N 445.604 4.160 10 10 IICE CC(C)Oc1ccc(N(C)C[C@@H](O)c2ccc3c(c2)CN(C(=O)C(F)(F)F)CC3)cc1 1169252914 NWMBYMMEALJPMV-OAQYLSRUSA-N 436.474 4.091 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H](C)[C@H]2CCO)sc(C)c1-c1ccccc1 1171833899 KYKRRFKKBFENFF-VQIMIIECSA-N 444.597 4.322 10 10 IICE Cc1ccc(N(Cc2cnn(C)c2)C(=O)/C=C/[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1177596128 LBRBESTXWBBZII-YPNIWSFNSA-N 438.572 4.465 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC(NCc3ccc(Br)cc3O)C[C@H](C2)C1 1257842417 GCTVTXMRHQPGKZ-KBPBESRZSA-N 425.367 4.280 10 10 IICE COC(=O)c1ccc(Cl)c(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)c1 1265002138 UUQRHCWGTZFQHA-UHFFFAOYSA-N 428.838 4.397 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(NC(=O)c4ccc(F)cc4)c3)C2)cc1 1276832172 PBNLYQAMBIACAJ-SFHVURJKSA-N 447.510 4.343 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@]34CC[C@H]3CN(C(=O)OC(C)(C)C)C4)cc2)CC1 1293146045 SVTLMCOKKZYCNR-CPJSRVTESA-N 427.589 4.186 10 10 IICE COc1cccc(-n2nc(C)c([C@@H]3COCCN3Cc3ccc(N(C)C)c(C)c3)c2C)c1 1307681350 YNOGGRVNLKEQOP-VWLOTQADSA-N 434.584 4.446 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)c2ccc(Br)cc2F)cc1 1312798537 UNKZVVLJHPWAQG-AWEZNQCLSA-N 438.341 4.436 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCSC[C@@H]2C)cc1 1313678186 BSXOEHGWIGNKDX-ICSRJNTNSA-N 429.634 4.008 10 10 IICE CCOCc1nnc(N(C)CCOC(C)(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1314310992 YRGGKWNYRVXNKH-UHFFFAOYSA-N 443.636 4.351 10 10 IICE CO[C@H]1CCC[C@@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1315690045 FWOFSJCBIXKPNP-KRXUUXHPSA-N 442.604 4.354 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ccc(OC(F)(F)C(F)(F)F)cc1 1319287309 ZIJUMCJROQVBQM-UHFFFAOYSA-N 445.388 4.379 10 10 IICE Cc1cc(Br)ccc1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1355130767 NNHSNTIEOCTZEU-HZPDHXFCSA-N 449.364 4.369 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(c4ccc(F)cc4F)CCC3)cc2F)C[C@H](C)O1 1357834709 AIPSURXRAVQYGK-HOTGVXAUSA-N 432.486 4.456 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnn(-c2ccc(F)cc2)c1 1361064280 ZJMKPHNXCBNLPR-QGZVFWFLSA-N 430.430 4.012 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C[C@@H](O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1465805637 OTDHYUKKAGGQHS-VBKZILBWSA-N 442.357 4.494 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3ccc(Cl)c(Cl)c3)CC2)cc1F 1471321502 XOHNVOCKTIIDCP-UHFFFAOYSA-N 426.319 4.215 10 10 IICE CC(C)CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CCCC1 1473127277 CVGIIHHFWDBKDX-PMACEKPBSA-N 433.612 4.346 10 10 IICE CC(C)CN(CC(F)(F)F)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1515065230 BFUOLHAONVWXMU-DHDCSXOGSA-N 448.507 4.464 10 10 IICE CCn1cc(CN(C)c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)cn1 1515772463 IRMGGFFSMJKBAZ-UHFFFAOYSA-N 449.628 4.206 10 10 IICE COCCC(C)(C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1518954395 GTUZIDBQFFMTNH-JOCHJYFZSA-N 441.620 4.429 10 10 IICE Cc1ccc([C@H](NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)[C@@H](C)S(C)(=O)=O)cc1 1519787722 UKAZJXGKZRKGDF-CJFMBICVSA-N 438.593 4.236 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(Cn2ccc(C(F)(F)F)n2)cc1 1528229897 IXBIVQKJFUNWPG-UHFFFAOYSA-N 430.430 4.039 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(-c4cc(OC)ccc4Cl)no3)C2)cc1 1529412174 WXBQDODAIPDYHD-HNNXBMFYSA-N 441.915 4.269 10 10 IICE CC1(C)[C@@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1(F)F 1533331763 CYCCXGPIPIAKEB-KIWPFMIBSA-N 430.567 4.137 10 10 IICE CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1542410720 ORXIEJIKQBGGBN-TWHMRZPUSA-N 429.630 4.330 10 10 IICE CCN(CC)[C@@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccco1 1542433455 GARMAYUSMZRNKF-DEOSSOPVSA-N 436.600 4.200 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(CN3CCCC3=O)cc2)cc1 1544274265 GMCUXJCIMLIVHV-UHFFFAOYSA-N 429.520 4.210 10 10 IICE COCCN(c1nnc(-c2ccccn2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@@H](C)C1 1555537007 WWBHATSPRIHELP-AUSIDOKSSA-N 448.615 4.404 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(-c2ccc(OC(F)(F)F)cc2)[nH]n1 1557124110 VXNINDCKGVURJH-UHFFFAOYSA-N 428.370 4.159 10 10 IICE COC(=O)c1cc(OCC(=O)N(C)C(c2ccccc2)c2ccccc2)ccc1N(C)C 1559457091 ZWEQDOIHIJWLRO-UHFFFAOYSA-N 432.520 4.166 10 10 IICE C[C@@H](NC(=O)N1CCN(Cc2ccc(Br)cc2)CC1)c1ccc(N(C)C)cc1 1564597415 MOHUOUYGVFULQX-QGZVFWFLSA-N 445.405 4.104 10 10 IICE COCCCOc1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cn1 1586081985 LGKYOGMHJVZJNY-QGZVFWFLSA-N 431.964 4.317 10 10 IICE Cc1c(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)nnn1-c1ccc(F)c(F)c1 1587475609 GMMHMSCFPZTFIG-UHFFFAOYSA-N 425.483 4.116 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3C[C@H](S(=O)(=O)c4ccccc4)C3)c2C)c1 1587630452 JXDKOGBSFQQSCD-JKIUYZKVSA-N 436.577 4.446 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CS[C@H](C)C(=O)Nc3cc(C)on3)c2C)c1 1596471072 ATDQTKSWFNQWNB-GOSISDBHSA-N 440.569 4.076 10 10 IICE C[C@@H](CN(C)C(=O)OC(C)(C)C)Cn1c(CC2CC2)nnc1N(C)Cc1ccccc1O 1611438972 VNBUXFZEYBSBKO-KRWDZBQOSA-N 443.592 4.076 10 10 IICE COc1cc(N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c([N+](=O)[O-])cc1OC 1611933149 XBERNPWFADHWHQ-FQEVSTJZSA-N 431.876 4.218 10 10 IICE C[C@@H]1CCC[C@]1(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1612751325 JYOUEHZEILKANV-LCXONAHVSA-N 442.604 4.090 10 10 IICE CCOC(=O)C[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1616746307 XLXWRMCPMHYCIZ-QGZVFWFLSA-N 430.854 4.290 10 10 IICE C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623546464 LKBWRCSZFVZGEP-QGZVFWFLSA-N 429.561 4.145 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1ccc(Cl)cc1 1627092124 VSFDEYYFJZXXKR-HUUCEWRRSA-N 440.931 4.241 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(CN4CCN(C)CC4)s3)c2C)c1 1635326960 MWYAPVZLHCWRDC-UHFFFAOYSA-N 436.625 4.141 10 10 IICE O=C(NCc1cccc(Br)c1O)c1ccccc1C(=O)c1ccc(F)cc1 1640084450 WPHLPCCKACCUBA-UHFFFAOYSA-N 428.257 4.455 10 10 IICE Cc1cc(C(=O)NC2(CC(N)=O)CCCCC2)c(C)n1-c1ccc(Br)cc1 1640290921 AVSJGZRAEYMIDX-UHFFFAOYSA-N 432.362 4.165 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC[C@H](O)c2ccc(C(C)(C)C)cc2)N(C)C)cc1 1648477806 FEOVLHJBHIFGKY-RPWUZVMVSA-N 425.617 4.283 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCN([C@@H](C)CC)CC2)sc(C)c1-c1ccccc1 1654461744 XDBSYKKOABLDEP-KRWDZBQOSA-N 443.613 4.255 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1680563094 PAJDIAAUVXHTBP-OXQOHEQNSA-N 433.955 4.118 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3c(C)nn(-c4ccccc4C)c3C)C2)cc1 1683781554 CJSPXOPRNZCHBS-OAQYLSRUSA-N 447.583 4.226 10 10 IICE Cc1ccccc1CN1CCO[C@H](CNC(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1687286261 AVWDHTGEPNLYOU-AREMUKBSSA-N 446.595 4.103 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2C[C@@H](C)N(CC)C[C@@H]2C)cc1 1695618627 BHDMSTGPBNXPBJ-UXHICEINSA-N 435.620 4.087 10 10 IICE CC[C@@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1709258704 NAPUSUNIHIMIDY-RTBURBONSA-N 429.584 4.442 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC[C@H]1C 1743166577 NPFVLHBSJGWWBL-WOJBJXKFSA-N 425.621 4.234 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)CC[C@@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1751843724 RRLCDSWSOMLNAA-XLIONFOSSA-N 435.620 4.187 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1nc(C)cs1 1763500925 VCFPWZSIGQIPCY-QGZVFWFLSA-N 440.617 4.078 10 10 IICE CCN(CC)CCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1766688491 QALZDDJLQJPCDG-IFMALSPDSA-N 443.636 4.271 10 10 IICE CN(C)c1ccc([C@H](CNS(=O)(=O)Cc2ccccc2Cl)N2CCCCC2)cc1 1858074616 ODTWAMRDSQPYEE-QFIPXVFZSA-N 436.021 4.053 10 10 IICE COc1ccc([C@@H](Cc2cccs2)C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1858086383 HRHLSEWMGQOQQA-XMMPIXPASA-N 436.577 4.440 10 10 IICE COc1ccc(CCNC(=O)[C@H]2CCc3c(c4cc(Cl)ccc4n3C)C2)cc1OC 1858153489 IUJPSNLUEHDASV-INIZCTEOSA-N 426.944 4.313 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(c3ccc(N4CCN(C)CC4)cc3)C2=O)c1 1860085767 YZCGWMHOAODZDJ-LTGZKZEYSA-N 439.606 4.243 10 10 IICE O=c1cc(CNc2ccc(Nc3ccccc3)cc2)n(C[C@H]2CCCO2)cc1OCCCO 1871263489 DHJIHCZYBABJAS-XMMPIXPASA-N 449.551 4.144 10 10 IICE COc1ccc(Br)c(CNCCCC2(NC(=O)OC(C)(C)C)CC2)c1O 2227750624 KOUHEAYKTMFXDS-UHFFFAOYSA-N 429.355 4.090 10 10 IICE Cc1cc(C=C2SC(=O)N(C)C2=O)c(C)n1-c1ccc(I)cc1 2294028507 OYDIRZQYCWCLSD-UHFFFAOYSA-N 438.290 4.365 10 10 IICE N=C1SC(=Cc2ccc(N3CCOCC3)cc2)C(=O)N1c1ccc(Br)cc1 2296463327 UBXPYGNONZIEIP-UHFFFAOYSA-N 444.354 4.341 10 10 IICE CCC[C@H](NC(=O)c1cccc(N2C(=O)C(=Cc3ccccc3)SC2=S)c1)C(=O)O 2297580233 HPUAGKJYLMMMQK-KRWDZBQOSA-N 440.546 4.076 10 10 IICE O=C(CCCN1C(=O)C(=Cc2c[nH]c3ccccc23)SC1=S)Nc1nccs1 2314831911 VOOOLFHHUDHORD-UHFFFAOYSA-N 428.564 4.245 10 10 IICE CCCOc1ccccc1C=C1SC(=S)N([C@H](Cc2ccccc2)C(=O)O)C1=O 2314926591 MRTSSIFVOOMTKV-QGZVFWFLSA-N 427.547 4.373 10 10 IICE Cc1ccc(CNC(=O)CC(C)(C)CNC(=O)OC(C)(C)C)c(O)c1Br 2352645726 MHUBSSOZPCMIGU-UHFFFAOYSA-N 429.355 4.020 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(O)c1Br 2380759046 LCPKHIGHZSQHTC-UKRRQHHQSA-N 441.366 4.067 10 10 IICE Cc1ccc(N2C(=O)/C(=C3\C(=O)Nc4ccc(Br)cc43)SC2=S)cc1 1243533 YRNPSHRXTHDICY-CCEZHUSRSA-N 431.336 4.486 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1)N2)N1CCOCC1 14465005 UVHIHJSTROXJTD-NNMXDRDESA-N 430.957 4.187 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(O)cc3)C2=O)ccc1OCCC(=O)O 16919527 HIDFYSQNWFWCOE-LDADJPATSA-N 445.518 4.050 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@@H](C(=O)NCc4cccc(F)c4)[C@H]3C2)cc1 245279577 IVXDRHJUAOJLMH-AOYPEHQESA-N 445.538 4.018 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(NC(C)=O)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526332995 LLELNFMDZPCTFE-QHCPKHFHSA-N 446.459 4.122 10 10 IICE COc1ccc(-c2nc(CN(C)c3cc(OC)c(OC)c(OC)c3)cs2)c(OC)c1 741794862 CSQAWYXLHAIJHL-UHFFFAOYSA-N 430.526 4.490 10 10 IICE Cc1n[nH]c(C)c1[C@@H](C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 772033053 QAKDQADUJZFOQX-ZDUSSCGKSA-N 437.496 4.082 10 10 IICE COc1cc(S(=O)(=O)Nc2nc(-c3ccc(OC(F)F)cc3)cs2)ccc1F 786874228 KEWDZDNFLQRREA-UHFFFAOYSA-N 430.429 4.360 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@@H]([C@H]2CCCOC2)C(F)(F)F)C1 789646423 OVJQMBIBBLHRRY-AOMKIAJQSA-N 438.490 4.309 10 10 IICE Cc1cnn(Cc2cc(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)no2)c1 800048621 GVVVOJVZCQEMDP-OAHLLOKOSA-N 427.936 4.048 10 10 IICE COc1ncccc1CCN[C@H](C)c1cc(Br)cc(Br)c1O 810260822 QQBPVVWSMYEMGS-SNVBAGLBSA-N 430.140 4.214 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(N2CCCCC2)cc1 857473272 VVPNSDUCXXVUCE-NRFANRHFSA-N 427.976 4.430 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1Br 1125257115 TUEHHXPFSBLSGM-GASCZTMLSA-N 435.337 4.440 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C[C@H](C)c2ccccc2)[C@@H](C)CO)cc1 1141612820 MRJGZRGBHROVQI-FPOVZHCZSA-N 432.564 4.462 10 10 IICE CC[C@](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)(C(=O)OC)c1ccccc1 1142080237 CZLCJLQVYAOZCS-AREMUKBSSA-N 432.520 4.157 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OC(F)(F)F)cc1 1150346776 ADSHASLXPWIQBX-MRXNPFEDSA-N 428.838 4.339 10 10 IICE COc1ccc(C[C@H]2CCCN(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)C2)cc1 1252117953 ZMIIDBQLJRWVKM-YADHBBJMSA-N 437.584 4.194 10 10 IICE Cc1cc(CCNC(=O)NC[C@@](C)(O)c2ccc(F)cc2F)c(C)n1-c1ccccc1 1253807826 IOZPROKTQNROOI-XMMPIXPASA-N 427.495 4.122 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1OC 1264455352 FJFDHQDWIFUIPB-RGEXLXHISA-N 444.553 4.479 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(S(=O)(=O)N3CCCC[C@@H]3C)c2)cc1 1264668548 PGJHBFBQJNYHNF-IBGZPJMESA-N 443.613 4.026 10 10 IICE CC(=O)c1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1OC(C)C 1264689572 XPZIVWVRBXRBNB-IAGOWNOFSA-N 442.531 4.359 10 10 IICE CN1CCN(Cc2cccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c2)CC1 1292258387 RTVKQXDDSVOISS-UHFFFAOYSA-N 434.628 4.133 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(F)(F)Cc2ccccc2)NC(=O)OC(C)(C)C)cc1 1293793825 TYQZGOAAEIGOOB-HXUWFJFHSA-N 447.526 4.313 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)CCCCc3ccc(Cl)cc3)cc2)CC1 1296399865 NFBZNQNHCVJVSL-UHFFFAOYSA-N 427.976 4.038 10 10 IICE CC1(C)CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1303958726 WLFZPEITQVDRKS-UHFFFAOYSA-N 429.584 4.226 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CCCO1 1305195650 CCRMYJFLPHNTKR-OAHLLOKOSA-N 435.644 4.185 10 10 IICE CC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(F)ccc1F 1307625112 LGPRCHBZMOAIFE-FQEVSTJZSA-N 434.442 4.420 10 10 IICE CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357641662 WEDMBDAVVLFZDY-WXTAPIANSA-N 437.559 4.439 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1 1441248372 UUQHFJJNWVWLCO-HSZRJFAPSA-N 436.625 4.264 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1[C@@H]1CCCOC1 1444988602 QEAYRVACQCUTOH-AZUAARDMSA-N 447.526 4.457 10 10 IICE O=C([C@@H]1CCc2cc(Br)ccc21)N(Cc1ccccc1O)C[C@H]1CCCO1 1446566430 KUIMKUYVBQJMDJ-UYAOXDASSA-N 430.342 4.392 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)Cc4ccccc4C)CC3)c2C)c1 1464716607 BAUVMNRENHBMBU-UHFFFAOYSA-N 429.564 4.238 10 10 IICE Cc1cc(C(=O)N[C@H](CO)Cc2ccc(F)cc2)c(C)n1-c1ccccc1Br 1467689894 LSNOYYLBXGSSCF-SFHVURJKSA-N 445.332 4.329 10 10 IICE Cc1noc([C@@H]2CCCCN2C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1467883915 WICXMVLZNLVWJX-KRWDZBQOSA-N 444.333 4.310 10 10 IICE CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1469852957 CYNLXHJLTDXYMD-HWHXTQLESA-N 437.632 4.459 10 10 IICE O=C(CN(Cc1cccs1)c1ccc2c(c1)OCCO2)NCc1ccc(Cl)cc1 1473224691 FHRHRVKSAHYSCW-UHFFFAOYSA-N 428.941 4.496 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(C)c1C 1473232015 WBSPAUQGKYZQEL-KDURUIRLSA-N 427.564 4.199 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC1CCC(C)(N2CCCC2)CC1 1479356455 YXQOSGUZMDGHIT-UHFFFAOYSA-N 438.410 4.483 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)COCCO1 1514424488 AZRLAQZOALPSPH-VWLOTQADSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(/C)c3ccccc3C(F)(F)F)CC2)c(OC)c1 1530968525 QOVBPIBAMOQDNX-PEZBUJJGSA-N 434.458 4.475 10 10 IICE Cc1cc(CCNC(=O)CSCC(=O)N(C)C2CCCCC2)c(C)n1-c1ccccc1 1534543339 USNLOYRYZFTCEN-UHFFFAOYSA-N 441.641 4.277 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)CCN2C(=O)c3ccccc3C2=O)c1 1535667542 WQOVVZTXZCHGOH-UHFFFAOYSA-N 435.911 4.116 10 10 IICE Cc1c(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n[nH]c1C1CC1 1542846671 JORJQFREMPJROO-UVTDQMKNSA-N 432.596 4.277 10 10 IICE CN(CC(=O)NCc1ccc(N2CCCCC2)cc1)c1ccc(C(F)(F)F)cc1C=O 1557140165 RLEQZKWLDYRKGY-UHFFFAOYSA-N 433.474 4.261 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)c3ccccc3F)CC2)c(C)n1-c1ccccc1 1565193032 MVZVOLMNLNLBIW-UHFFFAOYSA-N 448.542 4.291 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCOCC2)cc1 1583359376 IGYOBGXGSDJFLT-UHFFFAOYSA-N 434.418 4.346 10 10 IICE CC(C)(C)OC(=O)N1CCC(C2(C(=O)NCCCSc3nccs3)CC2)CC1 1585222564 OVOWFHMFMZBKPL-UHFFFAOYSA-N 425.620 4.169 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1 1587460320 VFNWHMWMHPLMMC-PXNSSMCTSA-N 433.593 4.252 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(NC(=O)NCc2ccccc2)CCCC1 1587547624 OSYOIQRADUZLOI-UHFFFAOYSA-N 434.584 4.057 10 10 IICE CCOC(=O)N1[C@H](C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC[C@@H]1c1ccc(C)o1 1597800733 OMYACGGLIWUYOQ-WTOYTKOKSA-N 441.572 4.372 10 10 IICE COC(=O)[C@@](C)(Cn1cnc2ccccc21)NC(=O)c1cc(C)n(-c2ccccc2C)c1C 1597943289 DRKMNXRKOCYFLA-AREMUKBSSA-N 444.535 4.114 10 10 IICE Cc1cc(-c2csc(NC(=O)C(C)(C)N3CCOCC3)n2)c(C)n1-c1ccc(F)cc1 1609793525 VZGUGWYGQJLESL-UHFFFAOYSA-N 442.560 4.406 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1cccs1 1611431261 LQALFRWJQPLLHU-DUXKGJEZSA-N 436.577 4.122 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1CN1CC[C@@H](O)C1 1612241161 OBAUZPRJSLCYBX-JOCHJYFZSA-N 431.492 4.005 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C[C@@H]1C 1612829257 OOIWSFHCLFHDLH-ROUUACIJSA-N 429.584 4.082 10 10 IICE COc1ccc(CN2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1F 1618795011 FRLOHRBBWNQKSH-UHFFFAOYSA-N 449.526 4.012 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)COc2ccccc2C(F)(F)F)cc1 1626106906 RWHZTBVNQDBOBQ-LJQANCHMSA-N 436.474 4.358 10 10 IICE Cc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(F)c1F 1628496340 WNWOFYIUZJFSRK-GOSISDBHSA-N 433.499 4.335 10 10 IICE Cc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1I 1628603754 JCOBJGOHFRUDGV-UHFFFAOYSA-N 425.247 4.478 10 10 IICE O=C([C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N(Cc1ccccc1O)C[C@H]1CCCO1 1631219170 OOCHJTWGKBWZOU-IERDGZPVSA-N 449.334 4.400 10 10 IICE CC[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1)N1CCO[C@H](CC)C1 1633065799 CSDGIXOWIIYJOB-NOZRDPDXSA-N 439.600 4.184 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)c1ccc(Cl)cn1 1634384889 NHFCLVGELOLTGS-UHFFFAOYSA-N 445.947 4.087 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2CCC[C@@]2(NC(=O)OC(C)(C)C)C1 1636262266 DQAVIAPZQBJNLS-DMJCMNNJSA-N 444.620 4.081 10 10 IICE Cc1cc(C(=O)NCC2CCN(C3CC3)CC2)c(C)n1-c1ccc(Br)cc1 1639867360 MYHTWPNJMAXTJU-UHFFFAOYSA-N 430.390 4.461 10 10 IICE CCN(CCOc1ccc2c(C)cc(=O)oc2c1)Cc1cc(Br)ccc1O 1644710248 ISMXKPWCQGAZDW-UHFFFAOYSA-N 432.314 4.470 10 10 IICE Cc1cc(C(=O)N2CC[C@](CO)(C(F)(F)F)C2)c(C)n1-c1ccccc1Br 1645047145 CXOAZRRLRUFUOM-SFHVURJKSA-N 445.279 4.244 10 10 IICE CCOc1ccc(N2CCN(Cc3nnc(-c4ccc(Cl)cc4[N+](=O)[O-])o3)CC2)cc1 1649395111 CPQZEYPYEIQNLE-UHFFFAOYSA-N 443.891 4.019 10 10 IICE CCCC(O)(CCC)Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1649638288 BUROFJGESRAFSZ-UHFFFAOYSA-N 443.636 4.458 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3cccc(C(F)(F)F)c3)C(C)C)nc12 1657123202 VUZCZJLOTXJZCA-UHFFFAOYSA-N 436.434 4.041 10 10 IICE Cc1cc(CCNC(=O)N2CCOC[C@H]2C[C@@H](O)c2ccccc2)c(C)n1-c1ccccc1 1674924260 NNIMZJGLGGYLTM-CLJLJLNGSA-N 447.579 4.171 10 10 IICE C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCN1C(=O)OC(C)(C)C 1686310167 XIWCIRAFOIFTAP-UYAOXDASSA-N 430.593 4.216 10 10 IICE CCC(O)(CC)Cn1c(Nc2cnn(C)c2)nnc1-c1cc(C)n(-c2ccccc2)c1C 1708827749 LMFKGVPHLNWQCC-UHFFFAOYSA-N 433.560 4.381 10 10 IICE CCOCCCn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1710802701 USPVFUXKQZATBO-UHFFFAOYSA-N 434.588 4.312 10 10 IICE C[C@@H]1CCC[C@@H](N(C)c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)C1 1726527733 XPFAZXMZZCWOID-IAGOWNOFSA-N 448.662 4.054 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN(C)[C@@H](C)CC 1726985515 KFALRLJFFLMRLB-SFTDATJTSA-N 442.652 4.247 10 10 IICE COC[C@@H]1CCCCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1730548788 ZCKOLSCLQHZVSV-LJQANCHMSA-N 429.584 4.442 10 10 IICE CC(C)CCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1741506139 YKQKTJZKTPRYPN-HSZRJFAPSA-N 441.620 4.429 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CCOC[C@H]2C)cc1 1746089556 QFXLIVPRZRADGT-QGZVFWFLSA-N 440.979 4.113 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)OC(C)(C)C1 1748379971 HSIMJFJUISXDJF-RTBURBONSA-N 437.588 4.391 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N(C)C)cc1C 1749951843 ZMUTUYCGJJKUBH-IBGZPJMESA-N 429.609 4.051 10 10 IICE CC(C)CN1CCC[C@H](Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1761116835 OQCJRWSUBIBAFF-NZQKXSOJSA-N 441.620 4.230 10 10 IICE CCCN(CCn1c(CC2CC2)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1764362951 FWUKZWPMEVZVBY-UHFFFAOYSA-N 443.592 4.220 10 10 IICE CN(Cc1ccon1)c1nnc(-c2ccccc2F)n1CCCSc1nccs1 1767180538 ISELVRFGDWWTFQ-UHFFFAOYSA-N 430.534 4.348 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Cc3ccccn3)c3ccc(Cl)cc3)CC2)cc1 1858090559 UWVCVGOGOHGSFO-DEOSSOPVSA-N 435.955 4.419 10 10 IICE COc1ccc2c(c1)c(/C=C1/SC(=S)N(Cc3cccc(C(=O)O)c3)C1=O)cn2C 1860825320 ZUTVJYHZCPQILY-DJKKODMXSA-N 438.530 4.287 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)/C=C/c2ccc(-c3cccnc3)cc2)c2nccn2C)cc1 1866181817 WFYYUTARGZZMMR-FICPYRFJSA-N 437.547 4.467 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1ccc(O)cc1O 1952792509 IEFGJZIJCXSPKW-QPPBQGQZSA-N 445.471 4.495 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C(F)F)c(N)c2I)c(O)c1 2079881975 YPVQVUVINJIWRO-CQSZACIVSA-N 449.239 4.111 10 10 IICE COc1cccc(O)c1CNc1cc(I)ccc1Br 2104442345 KEFYYPQFYSOYLF-UHFFFAOYSA-N 434.071 4.380 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)CC23CC3)c1O 2236055252 OVWQBTJKRVIIDI-INIZCTEOSA-N 441.366 4.043 10 10 IICE C[C@H](C(=O)N1CCCC[C@@H]1c1cccnc1)N1C(=O)C(=Cc2ccco2)SC1=S 2296303804 JOYYRXNCKHUNDT-RHSMWYFYSA-N 427.551 4.018 10 10 IICE O=C1C(=Cc2cc([N+](=O)[O-])cc(Br)c2O)SC(=S)N1c1ccccc1 2313510557 QWMRAGMRFCZXDY-UHFFFAOYSA-N 437.296 4.469 10 10 IICE CCOc1cc(C=C2SC(=S)N(NC(=O)c3ccccc3Cl)C2=O)ccc1OC 2314765273 ZDAOXYNKZYBIPX-UHFFFAOYSA-N 448.953 4.294 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3cccc(OCCC(=O)O)c3)SC2=S)cc1 2314930789 JGNXSDKIIOXCMM-UHFFFAOYSA-N 427.503 4.149 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3ccc([N+](=O)[O-])s3)SC2=S)cc1OC 2323790526 OFLTVLHZPKWLDD-UHFFFAOYSA-N 436.536 4.117 10 10 IICE O=C1/C(=C\c2ccccc2Cl)SC(=S)N1NS(=O)(=O)c1ccc(Cl)cc1 3079154 KLBMDJXHIAGFJQ-NTEUORMPSA-N 445.374 4.088 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2cccc(C(F)(F)F)n2)C1 489481741 VOJWLCPUUVOCLI-UHFFFAOYSA-N 444.501 4.181 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(C)c3)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526322169 DHMPMPMJTIFIHU-QHCPKHFHSA-N 433.460 4.481 10 10 IICE COc1ccc(O)c(CNC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)c1 734019069 UEAZYIDHEOQTEI-UHFFFAOYSA-N 431.414 4.413 10 10 IICE Cc1nn(C)c(C)c1[C@H]1COCCN1Cc1c(O)ccc2cc(Br)ccc12 771632089 DXALHAKANPNGKD-LJQANCHMSA-N 430.346 4.232 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)N(C)Cc2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1 783320174 LZICWBOSIRTONL-WIYYLYMNSA-N 433.911 4.077 10 10 IICE O=C1/C(=C\c2ccc(-c3ccccc3F)s2)SC(=S)N1CCN1CCOCC1 913514746 ASAQZGFFLKPAMA-QGOAFFKASA-N 434.583 4.088 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(NC(=O)CC(C)C)c(F)c3)C2)cc1 1130185784 QWERUWTZCORCFP-QGZVFWFLSA-N 427.520 4.075 10 10 IICE CCc1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc(Cl)n1 1136903459 DPZGNBBLHHDMKE-IBGZPJMESA-N 446.979 4.359 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]3C)ccc21 1137902017 SIZRQLYKOXXJMJ-SJORKVTESA-N 443.588 4.374 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)C1 1138498388 VGMLCHRAHBHULM-PKTZIBPZSA-N 443.632 4.382 10 10 IICE Cc1ccc(NC(=O)Nc2cccc3c2CCN(C(=O)c2c(F)ccc(O)c2O)C3)cc1 1160733915 ZEHQQMQKKIMJGU-UHFFFAOYSA-N 435.455 4.388 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@](C)(O)c3cccc(F)c3)cc2Cl)C1 1227207075 CAPHXNXNRKSKTQ-HJPURHCSSA-N 433.955 4.422 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1 1235490349 YMZCIFABJNSMOL-FQEVSTJZSA-N 446.389 4.269 10 10 IICE CN(C)c1cccc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1289508044 GOKMYFQLBAKNJQ-UHFFFAOYSA-N 436.313 4.477 10 10 IICE Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)C2=O 1292256296 DRPJOTCOSSJWIV-SFHVURJKSA-N 433.552 4.065 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(C3CCCCC3)C2=O)cc1-n1c(C)cc(C=O)c1C 1296453771 LZUUPXJFSXRIJF-HSZRJFAPSA-N 435.568 4.269 10 10 IICE C[C@@H](NC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1)c1ccccc1O 1302530299 KCYQZMUGQAREAF-CYBMUJFWSA-N 448.903 4.477 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1OC 1350595405 CKFCBDCYJBAMHZ-WOJGMQOQSA-N 446.525 4.073 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1351697772 YTUXBPORNQYDOS-INIZCTEOSA-N 433.643 4.456 10 10 IICE CC(C)N(Cc1ccco1)c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1360121284 NHZCSLIVPUXEJB-OAQYLSRUSA-N 427.524 4.391 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)CCCc1ccccn1 1361095998 SQQSCPSRVAGMET-UHFFFAOYSA-N 441.583 4.227 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(C)n1-c1ccccc1 1438180104 UZKPOUSFWIGRHE-KNQAVFIVSA-N 425.573 4.398 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(O[C@H]3CC3(F)F)cc2)cc1 1442613887 KKOGMLRUUFAOFQ-VXKWHMMOSA-N 430.495 4.360 10 10 IICE Nc1c(Cl)cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1445887596 VGHSKRNZFMUPDT-AWEZNQCLSA-N 428.747 4.329 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2 1460981555 HMYTYWFTDDZWNF-NPMXOYFQSA-N 444.000 4.391 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)Sc3ccc(Br)cc3)C2)cc1 1461493863 IUDMEAXCXMYECP-GDBMZVCRSA-N 435.387 4.333 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)cc2)CC1 1462809904 SVYABARCZGEYIH-RTWAWAEBSA-N 446.378 4.115 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F 1463814640 QTCIZXOIEILSGW-HSZRJFAPSA-N 427.539 4.403 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3c4ccccc4CCN3C(=O)OC(C)(C)C)ccc21 1464512784 PHFKIDFWOYHZSQ-QHCPKHFHSA-N 435.568 4.220 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc([C@@H](C)OCC)s1 1467631635 OIRGIWMHECPHMZ-OAHLLOKOSA-N 433.574 4.243 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2ccc(C(F)(F)F)cc2nc1O 1467764378 QIGKTEWLQOLUEY-UHFFFAOYSA-N 441.203 4.357 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](C2CCCC2)C1 1472378314 ZONSBDZBDKTGTN-MRXNPFEDSA-N 434.583 4.297 10 10 IICE CC[C@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)CCS1 1499659349 MYZHFYUYBPAKBP-MJGOQNOKSA-N 447.624 4.147 10 10 IICE COC[C@H]1CCN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)C1 1504698077 BOTOMPDSOYSNRB-SFHVURJKSA-N 443.642 4.289 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)c(F)c2)C1 1505209588 LQWFJKKBIFSWIL-SFHVURJKSA-N 442.608 4.259 10 10 IICE Cc1ccc(OCc2nnc(N(C)[C@@H]3CCOC3)n2CCCSc2nccs2)cc1 1510962390 GTAHOWQNGNQDIR-QGZVFWFLSA-N 445.614 4.030 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(Br)cc3SC)C2)cc1 1529411206 BEFGBCAWJWNVIF-CQSZACIVSA-N 435.387 4.436 10 10 IICE COc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)ccc1OCc1ccccc1 1539234388 CQAFLVYCKBQZKL-XMMPIXPASA-N 447.579 4.373 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C=C/[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1540567475 NKPWFIIUPYVZIB-IXDOJHRFSA-N 427.589 4.449 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1C[C@H](C)S[C@H](C)C1 1542227022 QISJRCFLHVBRCB-KDURUIRLSA-N 436.629 4.017 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)Cc3ccccc32)c1 1545684259 QBSZJZHCDXHKNV-FOIQADDNSA-N 426.513 4.113 10 10 IICE COc1ccc(N2CCC(NC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)CC2)cc1 1546188211 QQOLOAMOFKYTHK-HXUWFJFHSA-N 433.593 4.110 10 10 IICE CN(Cc1ccoc1)c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1554191734 JFJSELXQHIQKGX-UHFFFAOYSA-N 426.571 4.132 10 10 IICE CN(Cc1cscn1)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1554196475 VDEKRLPWFUMBNW-UHFFFAOYSA-N 429.600 4.072 10 10 IICE COc1ccc(O)c([C@H](C)Nc2ncnc3c2cnn3-c2cccc(Br)c2)c1 1559098800 CHMWAXQKQCAEBN-LBPRGKRZSA-N 440.301 4.465 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1CC(OCc2ccccc2)C1 1566356272 ARHGBEZRNSOVQO-NFOQDIRWSA-N 428.960 4.122 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccn(-c4ccccc4C(F)(F)F)n3)C2)cc1 1584444479 PHNKSXSIXZHUDH-INIZCTEOSA-N 444.457 4.156 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H]1CCC2(CN(C(=O)OC(C)(C)C)C2)O1 1584914988 COUCBNDJJXEZQY-KRWDZBQOSA-N 445.585 4.054 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](C(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1613267247 GSBSZYJNWVJEGQ-IEBWSBKVSA-N 433.547 4.158 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H](Nc3cccc(Br)c3)C2)cc1 1618831275 SOLOJNFWFCGVSD-KRWDZBQOSA-N 430.306 4.328 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCC4)CC3)cc2F)C[C@H](C)O1 1620413875 JTEAMRYSOOVFQK-PMACEKPBSA-N 431.596 4.102 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c1 1625365588 VUNOKRFCXSURIA-UHFFFAOYSA-N 445.519 4.160 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(c3cccc(Br)c3)CC(=O)C2)cc1 1626085051 AJMGEADYAGIVHJ-UHFFFAOYSA-N 429.358 4.212 10 10 IICE Cc1cc(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1631078857 XMVPVLZGCMYFSR-HNNXBMFYSA-N 447.421 4.492 10 10 IICE Cc1c(F)ccc(N)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1631527673 YFOLCBVCNSAFQK-UHFFFAOYSA-N 432.543 4.333 10 10 IICE Cc1ccc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c(N2CCCC2)n1 1633765239 VQQHUIOZVVXIDZ-UHFFFAOYSA-N 430.552 4.449 10 10 IICE Cc1cc(C(=O)N2CCC(CO)(NCC(C)C)CC2)c(C)n1-c1ccc(C(C)C)cc1 1634084599 AFVIRQHEDUERLS-UHFFFAOYSA-N 425.617 4.430 10 10 IICE Cc1cc(CC(=O)N2CCC([C@@]3(C)COC(=O)N3)CC2)c(C)n1-c1ccc(Cl)cc1 1638481539 UGQZPORKCOJGEC-HSZRJFAPSA-N 429.948 4.027 10 10 IICE CCOC(=O)c1nc(N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1Br 1642154189 PDAGOWUOYZANGS-CQSZACIVSA-N 434.334 4.031 10 10 IICE COc1ccc(C)cc1[C@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1=O 1652723651 NLBXKAIHIAQXIP-SANMLTNESA-N 445.519 4.061 10 10 IICE COc1cc2c(c(OC)c1)N(CC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1)CCC2 1653903754 KQWYVKYGAIIQNA-CQSZACIVSA-N 438.446 4.232 10 10 IICE CCOC(=O)[C@H]1CCCc2sc(=O)n(CC(=O)c3cc(C)n(-c4ccccc4)c3C)c21 1656738351 DXZFAKPQJWOMHY-SFHVURJKSA-N 438.549 4.183 10 10 IICE CC(=O)c1nn(C)cc1OCC(=O)c1cc(C)n(-c2ccc(Br)c(C)c2)c1C 1656954469 HOKLDXGLESRCMP-UHFFFAOYSA-N 444.329 4.363 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCSC[C@H]2c2ccccc2)N(C)C)cc1 1685686379 MCLBECJNIHVFQW-PKTZIBPZSA-N 426.630 4.245 10 10 IICE CC[C@H](C)c1nnc(N(C)CCOC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694010807 VPBXRPNEBSOQSG-SFHVURJKSA-N 447.599 4.067 10 10 IICE C#CCN(CC#C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@H]1OC 1705574474 FAEZOGQBAVBMBU-RCZVLFRGSA-N 441.579 4.241 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1C 1706057313 FFVCKKWUKPKJTK-PKOBYXMFSA-N 434.588 4.114 10 10 IICE CCCCN(C)CC1CCN(c2nnc(CC)n2Cc2ccc(N(C)C)cc2C)CC1 1709601181 DZFMZARRKZCCBX-UHFFFAOYSA-N 426.653 4.212 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1C[C@H](C1CCCCC1)N(C)C 1729419645 XUNRMIQBPPTOLX-JOCHJYFZSA-N 434.588 4.193 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743513371 BUVKWQLSHCCEKZ-SWHJIRTISA-N 441.620 4.163 10 10 IICE Cc1csc(CN(C)c2nnc(-c3cnccn3)n2Cc2ccc(N(C)C)cc2C)c1 1751747531 FERAXHYBJQKUAC-UHFFFAOYSA-N 433.585 4.164 10 10 IICE CC(C)c1nnc(N2CC[C@H](C(C)C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1760908808 XEBDNTWOIMIRAX-QFIPXVFZSA-N 425.621 4.141 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1761010363 UZMPXWQICRHTRP-FQEVSTJZSA-N 425.621 4.234 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1CCc1ccc(Cl)s1 1767111783 FXHAGXMTLHCBOC-MRXNPFEDSA-N 432.977 4.472 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCOC1 1771047115 VJAARBZZWGBVDQ-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1771430737 IYHZIVBNGKFRLA-OAHLLOKOSA-N 447.659 4.096 10 10 IICE Cc1c(OCCOc2cccc3ccccc23)c(=O)ccn1CCOc1ccc(N)cc1 1857919748 VIGUTMTYTXZSAS-UHFFFAOYSA-N 430.504 4.429 10 10 IICE Cc1ccc([C@H](n2nc(C3CC3)c(CO)c2I)C2(C)CC2)c(O)c1 2079002393 ILJSURPPXRRMBU-KRWDZBQOSA-N 438.309 4.261 10 10 IICE CC[C@H](NC[C@H]1C[C@@H](OC)CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2172450423 XBLMRKUICOITMV-INMHGKMJSA-N 443.382 4.220 10 10 IICE C[C@H](NC(=O)C1(COCc2ccccc2)CN(C(=O)OC(C)(C)C)C1)c1ccccc1O 2256684972 LIIHVIIMHIFKKK-SFHVURJKSA-N 440.540 4.023 10 10 IICE CCN(CC)c1ccc(NC=C2C(=O)NC(=O)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 2295927474 SWZWHLBRLNYVTB-UHFFFAOYSA-N 446.429 4.130 10 10 IICE COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)C1=Cc1cccc(Br)c1 2297462828 OTDOCSPQISGAHM-UHFFFAOYSA-N 428.282 4.335 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccccc3F)SC2=S)cc1 2314831071 BTRRDBYQAJEANQ-UHFFFAOYSA-N 430.526 4.454 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC[C@@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381136227 CDBNHENNGOXPKI-IUODEOHRSA-N 441.366 4.115 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc3c(c2)OCO3)N2CCc3ccccc32)cc1 9529643 FYUUKRNKSCBJKE-HSZRJFAPSA-N 429.520 4.015 10 10 IICE O=C(O)Cc1ccc(N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)cc1 16930569 WNWRFVSGUQRGTA-DHDCSXOGSA-N 434.336 4.482 10 10 IICE COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C/c1cc(Br)ccc1OC 33332815 ZPKRNQWNPNYCFY-GZTJUZNOSA-N 446.272 4.474 10 10 IICE CCOC(=O)[C@@H](C)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S 33378448 YZWSXCZHKCEIFU-DQPIFXJKSA-N 427.547 4.418 10 10 IICE CCCN1C(=O)/C(=C\c2c(NC3CCCCC3)nc3ccc(C)cn3c2=O)SC1=S 33459292 XSPVNIUILPEKQV-SFQUDFHCSA-N 442.610 4.359 10 10 IICE Cc1ccc(OCCn2cc(/C=C3/C(=N)N4N=CSC4=NC3=O)c3ccccc32)cc1 89267733 HUWQEEHJMLEYIK-MPZUNYIRSA-N 429.505 4.278 10 10 IICE CCn1cc([C@H]2CSCCN2C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cn1 683362590 VTFFQFSFUDHMBG-JOCHJYFZSA-N 426.586 4.051 10 10 IICE Cc1cc(C(=O)NCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 731020114 KDUQBRKYGAICBE-LJQANCHMSA-N 426.561 4.256 10 10 IICE Cc1sc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 742749425 GYCNRHSNGQZVTB-INIZCTEOSA-N 448.545 4.027 10 10 IICE COc1c(Br)cccc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 775314968 XWCZMWXSONTQBL-UHFFFAOYSA-N 444.417 4.280 10 10 IICE CC[C@@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)ccc1O 797085344 DPXJDCRFPSTSDJ-MRXNPFEDSA-N 440.769 4.482 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)c3ccc4ccccc4c3)CC2)cc1 1124586034 WCLUVAZIXJOIPF-NRFANRHFSA-N 431.580 4.280 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCCOc3cccc(Br)c3)C2)cc1 1130185568 LTKFWYLYOOEYSY-QGZVFWFLSA-N 447.373 4.259 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ncoc3-c3cccc(C(F)(F)F)c3)C2)cc1 1130826812 KFIJHZISGXKMNG-INIZCTEOSA-N 431.414 4.378 10 10 IICE CC1(C)C[C@@H](NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CCS1 1134406226 NWELEKKBVVDKIA-CNYBTUBUSA-N 438.615 4.207 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 1135914800 QMRXUFGZHLJQJK-VEXUSMLFSA-N 433.596 4.495 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC(C)(C)N2C[C@H](C)C[C@@H](C)C2)C1 1142282324 XTCRZVLDBQGFPD-NHCUHLMSSA-N 438.660 4.281 10 10 IICE COC(=O)[C@H](C)[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1149304948 YSIYEYLZVYKZND-CJAUYULYSA-N 432.520 4.116 10 10 IICE CCS[C@@H](C)c1noc(CN(C)C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1150760061 GPHJONNPRZEJQY-INIZCTEOSA-N 426.542 4.376 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@@]2(CCN(C(=O)OC(C)(C)C)C2)CO1 1190436686 HEFSEUQKNACFTL-WIOPSUGQSA-N 431.621 4.379 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3ccc(Br)cc3F)C2)cc1 1229413018 ITRURXDFXPKQSL-ZFWWWQNUSA-N 436.325 4.236 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)C1(c2ccc(C(F)(F)F)cc2)CC1 1255381897 DXFBZAOJSRGYEJ-UHFFFAOYSA-N 434.458 4.005 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@H](C(F)F)C1CCCCC1)c2[N+](=O)[O-] 1279943705 XXBQRHUTCRDNDX-SFHVURJKSA-N 442.418 4.314 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CCCN3C(=O)OCC(F)(F)F)c2C)c1 1287660939 SCFAFXQYZGVFKN-LJQANCHMSA-N 437.462 4.182 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CC[C@H](C2CCOCC2)C1 1289423451 LIQDWAIVVACNPZ-QFIPXVFZSA-N 425.621 4.152 10 10 IICE CCc1ccc([C@H](CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)N(C)C)cc1 1290310762 YPIMFPOZZMEMTF-MHZLTWQESA-N 446.639 4.389 10 10 IICE C[C@H](NC(=O)c1nccnc1SCc1ccccc1)c1ccc(N2CCOCC2)cc1 1292236642 ZBXORJBCIGNOEH-SFHVURJKSA-N 434.565 4.097 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H](Cc4cnn(C)c4)C3)nnc2C(C)(C)C)cc1 1295419861 TWSOBKGNIGJDHH-OAQYLSRUSA-N 449.647 4.273 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H]([C@H]3CCOC3)C2)cc1 1295420557 SIKRKNITZYSAGU-YADHBBJMSA-N 425.621 4.234 10 10 IICE C[C@H](NC(=O)NC[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)c1ccc(N(C)C)cc1 1312534855 HUWBDGUQNGDLJX-RDJZCZTQSA-N 440.535 4.005 10 10 IICE COc1cccc(CN(CC(C)C)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1313065676 URMNDQSQNZBHEF-UHFFFAOYSA-N 425.573 4.024 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Cl)cc(Br)c3F)C2)cc1 1437579711 PERDVBCDXSVUJR-GFCCVEGCSA-N 427.701 4.259 10 10 IICE COCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1446808523 XPHOISWPVPFTIZ-WIYYLYMNSA-N 442.556 4.412 10 10 IICE O=S(=O)(c1ccccc1N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(F)(F)F 1458169218 NMYKBEKVFFGVHK-HNNXBMFYSA-N 448.894 4.416 10 10 IICE Oc1ccccc1CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)C[C@H]1CCCO1 1459739264 IHJNTWHIRROLIW-RBUKOAKNSA-N 426.340 4.120 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(Br)c(Cl)c3F)C2)cc1 1461498208 YGRSJWJZJGOSGZ-NSHDSACASA-N 427.701 4.259 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)CCC(=O)NC(c2ccccc2)c2ccccc2)c1 1465991361 CDXJTKAOVGHLJN-SFHVURJKSA-N 432.520 4.264 10 10 IICE CCCCCn1cc(Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)c(C)n1 1500352863 FCLIAHNNCNNGMG-UHFFFAOYSA-N 445.571 4.426 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1CCCN(C)C1CCCCC1 1517142668 PWULWDCNJPNZSA-UHFFFAOYSA-N 434.588 4.337 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)cc2)C1 1517373867 RYTURRVWMCAGEX-YTQUADARSA-N 446.378 4.115 10 10 IICE Cc1cc2sc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c(C)c2cc1C 1534540850 RPTYOSFKAQOFDZ-IBGZPJMESA-N 435.593 4.458 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(C(=O)C3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1535114158 FADMLJMFZYGZSW-OAQYLSRUSA-N 427.976 4.197 10 10 IICE COC(=O)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1cc(C)cc(C)c1 1539455678 PEWWLPLAVNRIGE-AREMUKBSSA-N 447.579 4.055 10 10 IICE CCN(Cc1ccccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C(C)=O 1540814496 GGPLLYPLBPIHDT-UHFFFAOYSA-N 431.536 4.456 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(F)c1I 1542371056 PGYTZBQAWNYEBW-UHFFFAOYSA-N 426.273 4.159 10 10 IICE Cc1cc(C(=O)N(CC(C)C)C2CCN(C)CC2)c(C)n1-c1ccc(Br)cn1 1542939014 XBBZQYJAGDMORP-UHFFFAOYSA-N 447.421 4.444 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](c3cccc(F)c3)N3CCOCC3)c2C)c1 1544454017 FZMCSHXXSDMVOC-RUZDIDTESA-N 435.543 4.345 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 1564446733 YTEGWBKYPGLFKA-SFHVURJKSA-N 430.955 4.500 10 10 IICE COC(=O)[C@]12CCC[C@H]1CN(C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)C2 1564649578 GXWSXGGCXACINU-QSAZIKIQSA-N 433.980 4.061 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2Cc3cc(F)ccc3NC2=O)cc1 1565656140 PXJATQSIIIPBNL-QHCPKHFHSA-N 447.510 4.245 10 10 IICE COc1ccc(OC)c(CN(CCO)C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c1 1567075288 PRJIBGPHGAKUSY-UHFFFAOYSA-N 436.552 4.363 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 1568137536 WESKICVKZKFIIU-GBXCKJPGSA-N 442.556 4.251 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@H](c2cccc(Br)c2)C1 1584549868 VVYUWDLJLYXRAP-INIZCTEOSA-N 434.311 4.289 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CSCN3C(=O)OC(C)(C)C)c2C)c1 1587020738 DZUFPOFOXFQPLI-FQEVSTJZSA-N 429.586 4.329 10 10 IICE Cc1cc(C(=O)N[C@@H](CCO)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1595971039 APCNBVRDYQGIFJ-IBGZPJMESA-N 434.378 4.313 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(N2CCCCC2)nc1 1603309685 GJNZOASZZFWMLX-UHFFFAOYSA-N 434.588 4.252 10 10 IICE COc1ccc(N2CCN(CCCNc3cccc(C(F)(F)F)c3[N+](=O)[O-])CC2)cc1 1611747494 RNLAAKRRAUPNKF-UHFFFAOYSA-N 438.450 4.246 10 10 IICE Cc1ccc(C(=O)NCc2c(F)cccc2-n2cccn2)cc1-n1c(C)cc(C=O)c1C 1627736089 ZJBOAMLZDGNIFB-UHFFFAOYSA-N 430.483 4.470 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1C 1629640101 UHUHSQIUBCZXEX-GCJKJVERSA-N 441.572 4.157 10 10 IICE CCN1CCN(Cc2ccc(CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)cc2)CC1 1630026507 JYIRZXVNCAGAEO-UHFFFAOYSA-N 448.586 4.301 10 10 IICE CCCCN(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)c1ccccc1 1634241990 MHPHTIDNOGYNKU-BQXQKYNTSA-N 449.595 4.290 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)/C(=C\c3ccccc3)n3nnnc3C)c2C)c1 1635327379 SNUOSJPXTUHQFP-BUVRLJJBSA-N 426.524 4.012 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 1638529242 JGQPQKOMIHVWME-UHFFFAOYSA-N 446.503 4.158 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c1 1639618534 ZNADPWWBXLKDNG-RTWAWAEBSA-N 439.556 4.328 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCCN2C(=O)OC(C)(C)C)C1 1640652790 MIVVSBCWOWQVSD-UHFFFAOYSA-N 440.588 4.182 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2ccccc2NC(=O)OC(C)(C)C)cc1 1640771664 PZAUURPDOJXYCY-UHFFFAOYSA-N 427.545 4.180 10 10 IICE CCOC(=O)c1c[nH]nc1[C@H]1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1 1641510519 HJTLRHVZXGTLEI-INIZCTEOSA-N 440.931 4.277 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(C)Cc3cccc4ccccc34)cc2F)C[C@@H](C)O1 1644342849 UONLFRYJFLBBTR-WOJBJXKFSA-N 449.570 4.341 10 10 IICE Cc1ccc(C(=O)N2CCCSC[C@@H]2c2cnn(C)c2)cc1-n1c(C)cc(C=O)c1C 1647949167 QFWZPNIOBDWUJT-HSZRJFAPSA-N 436.581 4.269 10 10 IICE Cc1cc(C(=O)Cn2cc(N=S(C)(C)=O)cn2)c(C)n1-c1ccc(OC(F)F)cc1 1652978538 CRYPYKODZQTJGT-UHFFFAOYSA-N 436.484 4.134 10 10 IICE CCc1cccc2c1N(CC(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)CCC2 1657668063 FMBUCLUZBPYBBW-RTBURBONSA-N 439.575 4.071 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)N(Cc3ccc(N(C)C)cc3)C3CC3)c2C)C1=O 1672149214 OOVMZEUUFVOKFE-UHFFFAOYSA-N 449.555 4.046 10 10 IICE CCN(C(=O)NCCc1cc(C)n(-c2ccccc2)c1C)[C@@H]1CCN(c2ccccc2)C1=O 1684445351 ZHKJSGVHVUOACD-RUZDIDTESA-N 444.579 4.474 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)cc2C)CCS1 1709365671 JQFHYODRSAXVPU-QFIPXVFZSA-N 436.629 4.018 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC(c3ccnn3C)CC2)cc1 1710024324 RGHFZXQQYDZNCP-UHFFFAOYSA-N 435.620 4.414 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCS[C@H](C)C2)cc1 1710026746 OEHJICUITRUWML-QUCCMNQESA-N 429.634 4.008 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCOCC1 1710822769 LPIIWJVFYIFUPG-UHFFFAOYSA-N 437.588 4.252 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc2c(c1)CCCN2C 1712550438 LWWYMMMVQQIVAZ-VQTJNVASSA-N 441.620 4.059 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ncccc1C 1743563212 HFDAFUDTMQKFNT-IBGZPJMESA-N 434.588 4.016 10 10 IICE COCC1(CCn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CCC1 1749396505 XRPOMTJPLVQUQE-UHFFFAOYSA-N 445.583 4.083 10 10 IICE CCN1C(=O)CCc2cc(-c3nc(NS(=O)(=O)c4cccs4)sc3C)ccc21 1859572868 NGKSFVCCNWZQKQ-UHFFFAOYSA-N 433.580 4.280 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1\C(=O)N(Cc2ccc(C)cc2)N=C1C(F)(F)F 1865678285 CVQJBEXPGWFOBL-SXGWCWSVSA-N 434.414 4.365 10 10 IICE CN(Cc1nn(C)c(Cl)c1Br)c1ccc(CNC(=O)OC(C)(C)C)cc1 2117997467 WDHMDYKXCNXPIC-UHFFFAOYSA-N 443.773 4.497 10 10 IICE CN1CCc2cc([C@@H](N)c3cc(Br)ccc3I)ccc21 2163140637 LPAGABCFLLAYPS-MRXNPFEDSA-N 443.126 4.094 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OC(=O)c1cc(C)cc([N+](=O)[O-])c1 2293561007 BEHHFBDNLNTHSG-UHFFFAOYSA-N 444.490 4.010 10 10 IICE O=C(COc1ccccc1C=C1SC(=S)NC1=O)Nc1ccc(Cl)c(Cl)c1 2314835391 HEHWTDAVOFCQIL-UHFFFAOYSA-N 439.345 4.500 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C/c1ccc(C(=O)OC)cc1 34849405 URRGNTSZOLHAEN-GZTJUZNOSA-N 441.867 4.012 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)sc2c1CCCC2 59239309 CKWRBUMNISMTCY-HNNXBMFYSA-N 426.538 4.104 10 10 IICE O=C(N[C@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@@H]1CCCN(C(=O)C2CC2)C1 109915409 OKNFPPDLNZZEFR-PXDATVDWSA-N 428.532 4.400 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1 566878597 YGNOLYGBHMTQTI-UHFFFAOYSA-N 439.563 4.136 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ncccc3-n3cccn3)no2)C1 583590701 DSCGWXXSSHJYLZ-UHFFFAOYSA-N 439.523 4.087 10 10 IICE CCn1nc(C)cc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 726018984 DBYQGUQOMOCZGV-UHFFFAOYSA-N 431.439 4.260 10 10 IICE C[C@@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc2c(c1)OCO2 726611268 SSRBTRGKRMIFKW-CQSZACIVSA-N 433.455 4.046 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N3CCC(C)CC3)CC2)c(C)n1-c1ccc(F)cc1 734151713 KSOOQGFGUUMWBD-UHFFFAOYSA-N 439.575 4.386 10 10 IICE O=C(O)/C=C\c1ccc(N2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1 743113241 AOYZUEDNKNVGCK-YWEYNIOJSA-N 435.402 4.034 10 10 IICE CCOc1cccc(N2C(=O)/C(=C\c3cc(OC)c4c(c3)OCCO4)SC2=S)c1 743285833 YHEUPTZBOSWCSS-WOJGMQOQSA-N 429.519 4.271 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CC[C@H](c2cccc(F)c2)C1 769049627 ZMDBYKWACXUTIC-QHCPKHFHSA-N 436.575 4.057 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CCC(O)(c4ccc(-c5ccccc5)cc4)CC3)cc2N1 784646019 HXANCYWWKBHNQH-UHFFFAOYSA-N 445.475 4.081 10 10 IICE Cc1cc(-c2nnc(N3CC[C@]4(CCOC4)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802695027 PDUMUQRFGAFBLB-GJZUVCINSA-N 447.583 4.148 10 10 IICE COc1ccc(Br)c(NC(=O)NCc2cc(Br)ccc2O)c1 806247937 RIYHHFKOMNJCGH-UHFFFAOYSA-N 430.096 4.248 10 10 IICE C[C@H]1c2ccsc2CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 824651000 RSERJNYMSUTBQC-LBPRGKRZSA-N 432.457 4.191 10 10 IICE O=C(CSc1cccc(C(F)(F)F)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 919970455 DELGQKKLFTWYIF-UHFFFAOYSA-N 442.478 4.214 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)C2 1125468404 BQLHFPFLJZEFTB-OAQYLSRUSA-N 445.510 4.322 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3csc(-c4ccccc4Cl)n3)C2)cc1 1130826933 NRWSKKJZKLPEBK-HNNXBMFYSA-N 427.957 4.410 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](CN3CCCCC3)C2)c(C)n1-c1ccc(Br)cn1 1136827350 WBLZGAFGXACYEO-SFHVURJKSA-N 445.405 4.200 10 10 IICE Cc1cc(C(=O)Nc2ccc(C3(O)COC3)cc2)c(C)n1-c1ccc(Br)cc1 1141779306 ANZNBQNXSNUYTR-UHFFFAOYSA-N 441.325 4.327 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c(C(F)F)nc2ccccn12 1150355488 WACSFFWYBJRVPO-HNNXBMFYSA-N 434.874 4.025 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](C(=O)NCc2c(O)ccc3c2CCCC3)(C(F)(F)F)C1 1150378642 SRNQSYXKUQDMIO-NRFANRHFSA-N 442.478 4.077 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cnn1-c1cccc(C)c1 1151503458 VYDWDGUGEYUWQG-UHFFFAOYSA-N 432.568 4.494 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)[C@@H]1Oc1ccccc1 1234567684 ZJSLWWBLXKQPJL-SMIHKQSGSA-N 425.573 4.298 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)Nc3sc4c(c3C(=O)OC)CCC4)CC2=O)cc1 1264229540 IVJAUPKAVCIOBN-MRXNPFEDSA-N 440.565 4.358 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1 1292625236 NLHYTKPQABLEKN-UHFFFAOYSA-N 431.370 4.289 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1SC 1297228971 WPUGNWGOABXCGF-UHFFFAOYSA-N 445.541 4.319 10 10 IICE Cc1cc(C(=O)Cn2cnc(C3CC3)cc2=O)c(C)n1-c1ccc(OC(F)(F)F)cc1 1307409605 BCBIRVOCFSTEIG-UHFFFAOYSA-N 431.414 4.310 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(N4CCC[C@@H](C)C4)c3)cc2F)C[C@@H](C)O1 1355130907 PWKNMYJJBGHXGC-QRVBRYPASA-N 440.563 4.001 10 10 IICE CCc1cc(N2CCC(NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2)ncn1 1445441071 NTDJZDCRBGFUAY-UHFFFAOYSA-N 431.584 4.462 10 10 IICE Cc1cc(C(=O)NCc2c(C3CC3)cnn2C)c(C)n1-c1ccccc1Br 1453580053 ZQIUBYIGEXZWFP-UHFFFAOYSA-N 427.346 4.398 10 10 IICE O=S1(=O)N=C(Cl)c2ccc(N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc21 1458222348 VPYGLTSPNXFFOL-ZDUSSCGKSA-N 441.887 4.057 10 10 IICE Cc1cc(C(=O)Cn2cnc3ccccc3c2=O)c(C)n1-c1cccc(Br)c1 1458815626 HBCLUULYOSVBRW-UHFFFAOYSA-N 436.309 4.449 10 10 IICE Cc1ccc(CN2CCO[C@@H](CNC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)cc1 1471223430 SUVWXTFDFGGALR-DEOSSOPVSA-N 431.580 4.342 10 10 IICE Cc1nc(C[C@@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)no1 1492686041 RFYGPAHZWYHWES-INIZCTEOSA-N 447.634 4.191 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](CC)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1499659351 MYZHFYUYBPAKBP-PKOBYXMFSA-N 447.624 4.147 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](CCS(C)(=O)=O)c3ccccc3)c2C)c1 1534760018 PNPRBKUZYPQIPX-XMMPIXPASA-N 438.593 4.237 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1 1536549149 BMEUMNQHBVQDOC-DGDFFNOKSA-N 433.596 4.060 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(C(=O)N3CCCCC3)CC2)c1 1540669678 DFKFNSKFKRXGMC-UHFFFAOYSA-N 428.964 4.111 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3c(C)cc(C)cc3C)C2)cc1F 1543248017 RYNUPTIUMLECJJ-FQEVSTJZSA-N 425.548 4.266 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)cc3c2OCCO3)cc1F 1543251450 OVYVWWJPQIMKCO-UHFFFAOYSA-N 437.309 4.136 10 10 IICE CN1CCCc2cc(CNC(=O)C3(CNC(=O)OCc4ccccc4)CCCC3)ccc21 1544164649 MVGWHXAIKIFGEQ-UHFFFAOYSA-N 435.568 4.172 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@](C)(CC)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1545406211 WYBVJRKGSIDFAE-MHECFPHRSA-N 429.584 4.442 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)cc1 1545795825 PDADYSZYXDHTDH-SFHVURJKSA-N 432.520 4.087 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@]3(Cc4ccc(Cl)cc4)CCCOC3)C2)cc1 1565055829 LQONRJBALYANEJ-YKSBVNFPSA-N 443.975 4.018 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCSC[C@H]1c1ccccc1 1565127360 OEILXYDFTQHTEO-QHCPKHFHSA-N 425.598 4.038 10 10 IICE CC(C)C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)cc1 1584506598 DBZVDMSXPCAGSL-HSZRJFAPSA-N 442.003 4.488 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(Oc2ccccc2)cn1 1595584038 LIUUTMXSOZKWPE-SFHVURJKSA-N 438.915 4.022 10 10 IICE COc1ccc(Br)c2[nH]c(C(=O)NCc3c(O)ccc4c3CCCC4)cc12 1595596065 PLQBXIHCYBCLLG-UHFFFAOYSA-N 429.314 4.453 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)C[C@H]4CCCO4)nnc3C(C)(C)C)cc2)CC1 1612825554 AYUZPEGSOFBODA-JOCHJYFZSA-N 425.621 4.475 10 10 IICE CC[C@@H]1CCCCN1CCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1627626540 DRFVSGKKMWOWGF-GOSISDBHSA-N 433.394 4.246 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cc2c(cc1OC(F)F)OCO2 1631700753 GIGBEVIZLZLACJ-UHFFFAOYSA-N 442.418 4.167 10 10 IICE COC(=O)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1ccccc1OC 1650894068 YJPJODDBXQACLC-LJQANCHMSA-N 448.475 4.278 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC(=O)c3sc(C(C)C)nc3C)ccc21 1651220511 PMVQNVGOROJWFH-UHFFFAOYSA-N 427.570 4.406 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4F)C3=O)c2C)c1 1652632770 IRWNGLNHSXUYNL-VWLOTQADSA-N 433.483 4.192 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@@H](C)NC(=O)OC(C)(C)C)CC1 1683421351 MMBVDVPUOURDRG-RTBURBONSA-N 446.636 4.327 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCC[C@@H]3COC(=O)N(C)C)c2C)c1 1684478773 IFOBYJNJOJGSTA-JOCHJYFZSA-N 426.561 4.165 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3c(F)cccc3F)cc2Cl)C1 1686268966 JBEYGSJAFUSBGE-LIRRHRJNSA-N 437.918 4.387 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)N(C)C(=O)OC(C)(C)C 1693999870 VVGOMWFJKRXKMK-IAGOWNOFSA-N 431.581 4.389 10 10 IICE CCN(CC)[C@@H](C)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1695606580 RCSWWOJTFRCUJR-INIZCTEOSA-N 428.968 4.066 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C1 1696209747 RPMSGCVJVUCCQP-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1710028107 QBFYVQFPKJMBME-AREMUKBSSA-N 448.615 4.164 10 10 IICE CO[C@H](Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)C(C)C 1711583334 MGOSKIOKZQSBCP-HMXCVIKNSA-N 430.593 4.210 10 10 IICE C[C@@H]1CN(C(C)(C)Cn2c(C3CCCC3)nnc2N(C)Cc2ccccc2O)C[C@@H](C)O1 1726646421 WHMIWTPYADYJNY-RTBURBONSA-N 441.620 4.166 10 10 IICE CSC[C@@H]1CCCN1c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)cc1C 1731099533 QURQZDUMBWIFKW-QFIPXVFZSA-N 436.629 4.018 10 10 IICE CC1=C(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)CC1 1742036760 SONAWYHMKYMXNM-UHFFFAOYSA-N 446.599 4.377 10 10 IICE Cc1cnn([C@H]2CCCN(c3nnc(CC(C)C)n3CCCSc3nccs3)C2)c1 1762183768 YXWNMAWUGFELCT-SFHVURJKSA-N 445.662 4.462 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1764337068 BKVHFEBSWDVNRV-UHFFFAOYSA-N 436.604 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2nccs2)cc1 1764938698 PDENENROXAFKPQ-LJQANCHMSA-N 440.617 4.160 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1765062007 AICONCYVHAAZGR-FPOVZHCZSA-N 425.621 4.376 10 10 IICE CSc1ccc(/C=C2/SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 1858592058 HIHLACLDTLMZCW-PCJMVEANSA-N 431.560 4.011 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cccc(O)c3)C2=O)cc(Br)c1O 1860075410 UDZLOBHEZMSXCO-VGOFMYFVSA-N 438.324 4.275 10 10 IICE Cc1ccc(C)c(N2C[C@H](C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2=O)c1 1874179217 UHMGSHGPIRKPPK-QGZVFWFLSA-N 438.483 4.070 10 10 IICE O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)Nc1nc(-c2ccc(F)cc2F)cs1 1891598754 NSNRBJAAWVPOHF-UHFFFAOYSA-N 431.829 4.451 10 10 IICE COc1ccc(Br)c(CN[C@@]23CCCN(C(=O)OC(C)(C)C)C[C@H]2C3)c1O 2236056535 WFZWOFPJXYSIES-ZUOKHONESA-N 441.366 4.043 10 10 IICE O=C1NC(=S)N(c2ccccc2F)C(=O)C1=Cc1cccn1-c1ccc(Cl)cc1 2293168074 TZTYJKGZZICJIV-UHFFFAOYSA-N 425.872 4.101 10 10 IICE O=C(CCCN1C(=O)C(=Cc2c[nH]c3ccccc23)SC1=S)Nc1ccc(O)cc1 2314831977 WUSSABWPYNPHBQ-UHFFFAOYSA-N 437.546 4.494 10 10 IICE Cc1ccc(-c2nn(-c3ccccc3)cc2/C=C2\SC(N3CCOCC3)=NC2=O)c(C)c1 26763750 JTQKMNDHNRDAKO-JCMHNJIXSA-N 444.560 4.459 10 10 IICE CCCCOc1ccc(/C=C2\SC(=S)N(CCC(=O)OCC)C2=O)cc1OCC 40938078 RNZGQHXGZCFOFU-JXAWBTAJSA-N 437.583 4.419 10 10 IICE CCOc1cccn2c(C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)c(C)nc12 71457928 MILDTISCKZHQBB-UHFFFAOYSA-N 425.444 4.069 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)cc1 733730706 DRRPSFLNVGNUEL-UHFFFAOYSA-N 440.905 4.119 10 10 IICE COc1ccc(N2C(=O)/C(=C/c3ccc(Br)c(F)c3)SC2=S)cn1 763105401 COXGCWGNTQQHRP-QPEQYQDCSA-N 425.304 4.398 10 10 IICE C[C@H](NC1CCN(C(=O)c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1Cl 765367264 ABSNVGWWAABONP-SFHVURJKSA-N 427.976 4.132 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 777808850 JZHWKRDWIKJKDP-NRFANRHFSA-N 438.641 4.363 10 10 IICE CNC(=O)C[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)c1ccccc1 800717781 RNHUSYMETNFQJQ-DYESRHJHSA-N 442.991 4.253 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cccc(-c2noc(C(F)(F)F)n2)c1 804735882 HKRYPNVISQLESM-UHFFFAOYSA-N 442.191 4.154 10 10 IICE COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 918567552 CBWAPXZTINQGFN-XMMPIXPASA-N 447.535 4.355 10 10 IICE Cc1cc(CSc2ccccc2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)on1 1148701195 MHQQAUJXHOZXKB-UHFFFAOYSA-N 437.565 4.166 10 10 IICE Cc1cc(CNC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(C)n1-c1ccccc1 1234326790 MJMWGFRZUKLQNC-UHFFFAOYSA-N 433.512 4.034 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cccc(Oc4ccccc4)c3)cc2)CC1 1288912466 HQOMPDMELZQLJP-UHFFFAOYSA-N 429.520 4.111 10 10 IICE COc1cc(OC)cc(N2CC[C@H](CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)c1 1295019361 GQDZJYWGPOKHAY-HXUWFJFHSA-N 433.552 4.368 10 10 IICE Cc1cc(C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)c(C)n1-c1ccc(Br)cc1 1296584217 GDCLKYPFGGMFJX-OAHLLOKOSA-N 434.378 4.232 10 10 IICE COC(=O)[C@H](Cc1ccccc1O)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1301179176 QEQNSPNQWDILJM-QFIPXVFZSA-N 446.507 4.388 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](c1ccc(F)cc1F)c1nccn1C 1312883043 ASNUPBSAGRDWCV-OPAMFIHVSA-N 441.526 4.093 10 10 IICE CN(CCc1cccc(Br)c1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1313419925 VXZHVSSSNJAHJP-OAQYLSRUSA-N 447.421 4.002 10 10 IICE CO[C@@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC[C@@H]1C 1315714924 DJHNTXNHAVOGFO-FUHWJXTLSA-N 429.615 4.445 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(O[C@@H]4CC4(F)F)cc3)cc2F)C[C@@H](C)O1 1350933539 OUYDISXEVUXHNI-LRAJWGHMSA-N 434.458 4.156 10 10 IICE O=C(/C=C/C1CCCCCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1358428737 MOVSSPSOLCWMRZ-PKNBQFBNSA-N 437.563 4.085 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3CO)c2C)c1 1446281707 JHBUXRGPMJQOTM-BVAGGSTKSA-N 431.580 4.015 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C)(NC(=O)OC(C)(C)C)CC1 1447795481 PXYVHNSGBLZVFN-UHFFFAOYSA-N 439.556 4.426 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1 1464443078 STHVYQKQIHSCON-UHFFFAOYSA-N 437.927 4.443 10 10 IICE COc1cc(OC)cc(N2CC[C@H](NC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)c1 1465609456 UKQLGWKGVJJYLQ-FQEVSTJZSA-N 433.552 4.428 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(Br)cnc1Br 1465845613 FJGPXKCUBVARQE-UHFFFAOYSA-N 428.124 4.365 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(C(=O)c4cccc(OC)c4)cc3)CC2)cc1 1466208651 NGVXYFMSHKAXBZ-UHFFFAOYSA-N 444.531 4.287 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)c(C)n1-c1ccccc1 1468114332 PYVMDZUEQSUFIN-HXUWFJFHSA-N 447.526 4.398 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cncc2c1CCCC2 1470093356 KWOPUWCNGZBUMC-ODLFYWEKSA-N 441.553 4.330 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](c1ccc(F)c(F)c1)c1nccn1C 1470556388 TYTCGLMVFBYHGM-AOMKIAJQSA-N 441.526 4.093 10 10 IICE CC1CCC(OC2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CC2)CC1 1479532350 CMWRVIBOWXQWPJ-MXJXRJBTSA-N 430.637 4.125 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](C(F)F)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1508976754 FGKBVIAXMGHIQK-HXUWFJFHSA-N 447.574 4.140 10 10 IICE COC(=O)CC[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1530074742 GZHXQUHPTMMOLT-HSZRJFAPSA-N 447.579 4.219 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(OC(C)(C)C)nc2)C1 1535264259 DDKKTTQXMAAZIF-UHFFFAOYSA-N 434.584 4.297 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(F)cc1I 1536549375 FKDUEEMPNUEBBY-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE O=C(C[C@](O)(c1nc2ccccc2s1)C(F)(F)F)NCc1ccc(N2CCCC2)cc1 1540811858 LFWBJNWXFWYENU-NRFANRHFSA-N 449.498 4.353 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N(C)[C@@H]1CCCc2c1cnn2C 1542226702 GLBMDVTYFUAGHP-JOCHJYFZSA-N 435.620 4.147 10 10 IICE O=C(Cc1c(Cl)cccc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1544720426 DTCCAYNUJQNYHO-UHFFFAOYSA-N 432.395 4.384 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1545257434 MDDUWNRGYPWACN-RXFWQSSRSA-N 448.615 4.374 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CNc1cc(Cl)ccc1OC 1545509086 YTPQLUWCISRKTN-UHFFFAOYSA-N 427.726 4.277 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] 1557122787 JEGYUOSLITYFHA-UHFFFAOYSA-N 429.432 4.358 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2C[C@]3(CCN(C(=O)OC(C)(C)C)C3)CO2)C2CC2)cc1 1559492458 QFQKEJODABXVOO-DHLKQENFSA-N 429.605 4.133 10 10 IICE C[C@H](NC(=O)N(C)C[C@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc(N(C)C)cc1 1564597378 LNPPIXDUVKUWBA-LIRRHRJNSA-N 440.371 4.202 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCC1 1564667898 KNUHRPIVAOUYEO-PGRDOPGGSA-N 446.636 4.375 10 10 IICE CCN(C[C@H]1COc2ccccc2O1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1565585757 UMNSNNSGCSVMJD-QHCPKHFHSA-N 432.520 4.138 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](C2CC2)N(C)Cc2ccccc2)cc1 1567881791 VBNRQRJXDRGZDS-MHZLTWQESA-N 443.591 4.476 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2C1 1611011137 FJIVJQGISYKNIZ-OAHLLOKOSA-N 445.510 4.302 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(OC)CCCC1 1613165046 JNJPZQOQCHAIJW-FQEVSTJZSA-N 441.620 4.224 10 10 IICE CCN(c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)cc1C)C(C)C 1615254266 CQGBEIDSUQBOIK-UHFFFAOYSA-N 431.588 4.174 10 10 IICE C[C@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CC(c2cccc(Cl)c2F)=NO1 1625969790 KXEJCKVLDVVELI-JOCHJYFZSA-N 447.963 4.232 10 10 IICE CCN(C)C(=O)OC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1626997774 BBXIZJFRGAESHR-HXUWFJFHSA-N 427.545 4.186 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1627263819 AWWBLPFRDBORIV-IBGZPJMESA-N 437.500 4.113 10 10 IICE Cc1cccc(NS(=O)(=O)c2cc(NC(=O)c3ccc(C)c(O)c3O)ccc2C)c1 1628558355 NTRONDBZMVBOMX-UHFFFAOYSA-N 426.494 4.076 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)Nc1cccc(CN2CCSCC2)c1 1642061267 NOCZIGAHZMTRIN-UHFFFAOYSA-N 447.551 4.228 10 10 IICE CN1CCN(C2CCN(C(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)CC2)CC1 1648957326 SUFOCLDSBWBSAU-UHFFFAOYSA-N 434.588 4.020 10 10 IICE COC(=O)[C@]12C[C@H]1CCCN2C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1652394515 UYZWFFRDSABHOY-VFNWGFHPSA-N 431.330 4.024 10 10 IICE C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1673472608 SGQQJAIMNNYKHP-VFNWGFHPSA-N 433.474 4.233 10 10 IICE CC[C@H](C)N(CCc1ccccc1F)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675580548 PYOOJCVFPMYIQY-FQEVSTJZSA-N 426.580 4.130 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](NC4CCOCC4)C3)cc2Cl)C1 1682024555 UHTFVIIVACRFOK-RXVVDRJESA-N 449.039 4.019 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC([C@@H](O)c4ccc(Cl)cc4)CC3)C2)cc1 1682646600 UPZHSPFAYAHCRL-REWPJTCUSA-N 443.975 4.083 10 10 IICE CC1CCN(C(=O)OC[C@H]2CCCCN2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 1686173175 DDBLZOGZGBKEPX-DENIHFKCSA-N 430.593 4.246 10 10 IICE CN(C)c1ccc(Cn2c(C3CCC3)nnc2N2CCCN(C(C)(C)C)CC2)cc1F 1711005344 SWZVYPZODAPVDC-UHFFFAOYSA-N 428.600 4.110 10 10 IICE COCCN(c1nnc(CC(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@@H](C)C1 1730742078 NEEKCYROZNKLKV-QUCCMNQESA-N 431.600 4.371 10 10 IICE CC(C)[C@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1741402695 HHDHDVZOPKRKIU-OAQYLSRUSA-N 442.608 4.115 10 10 IICE C[C@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1763151260 DSXIQTUTYXQHMD-GOSISDBHSA-N 436.579 4.390 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCS1 1769752908 BYNCEJYXIBIZFV-FQEVSTJZSA-N 425.602 4.331 10 10 IICE CCN(CC)CCNC(=O)c1ccc(/N=N/N2CCN(c3cccc(C)c3C)CC2)cc1 1860481367 VPDKHDGZSZOARC-BYYHNAKLSA-N 436.604 4.196 10 10 IICE CCOC(=O)C(=Cc1ccc(N(C)C)c([N+](=O)[O-])c1)c1nc(O)c2c(C)c(C)sc2n1 2053509213 PSTMQKFWUUASFI-UHFFFAOYSA-N 442.497 4.092 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(NCc3cc(Cl)cc(Br)c3O)C[C@@H]2C1 2077033885 FOBLQYOWPCCBOA-XIKOKIGWSA-N 431.758 4.297 10 10 IICE C[C@@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccc(F)cc1O 2084723942 CEEYLFWRDCOPOF-WIYYLYMNSA-N 443.563 4.303 10 10 IICE COc1cccc(O)c1CNc1ccc(Br)c(I)c1 2104441917 DHURJHDWNYGPNK-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1c(Br)ccc(OC)c1O 2236056984 YNMYNAPPKSWYPR-BBRMVZONSA-N 443.382 4.289 10 10 IICE COc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3Cl)C2=O)cc1Cl 2294095319 POPBLAVJOKFJIU-UHFFFAOYSA-N 425.655 4.322 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)c(C)n1Cc1ccccc1 2294199379 YRIAWNBIEFFIPL-UHFFFAOYSA-N 433.508 4.124 10 10 IICE COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)Nc1ccc(Br)cc1 2313683181 UACWUOAPMMRWLY-UHFFFAOYSA-N 446.276 4.240 10 10 IICE O=C(O)c1ccc(CN2C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)cc1 2318684218 VEJDCPGFIWKYRZ-UHFFFAOYSA-N 434.882 4.348 10 10 IICE COc1cc(C=C2SC(=S)N(Cc3ccc(Cl)cc3)C2=O)cc([N+](=O)[O-])c1O 2323843107 YGAWAWIZNWBLGQ-UHFFFAOYSA-N 436.898 4.364 10 10 IICE CCC1=NN(Cc2ccccc2Cl)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141106 GZROPWDRAUGCDJ-UHFFFAOYSA-N 427.844 4.211 10 10 IICE Cc1ccc(CNC(=O)C[C@](C)(NC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380756185 JEYKJYARYLQMAV-FQEVSTJZSA-N 441.366 4.163 10 10 IICE Cc1ccc(CNC(=O)c2cncc(NC(=O)OC(C)(C)C)c2)c(O)c1Br 2381141789 FBMYDJHQMAXAPK-UHFFFAOYSA-N 436.306 4.135 10 10 IICE CN1C(=O)/C(=C2\C(=O)N(Cc3ccccc3)c3ccc(Br)cc32)SC1=S 1253810 YPSZUDNHYHUVOF-FOCLMDBBSA-N 445.363 4.197 10 10 IICE O=C(O)CN1C(=O)/C(=C/c2ccc(-c3ccc(OC(F)(F)F)cc3)o2)SC1=S 2994303 WMMSJPXHMCXKHO-QPEQYQDCSA-N 429.397 4.131 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C\c1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 9794005 QBRGKQUDIIQIBO-BKUYFWCQSA-N 425.444 4.474 10 10 IICE CCOC(=O)c1c(NC(=O)CCCCCN2C(=O)[C@@H](C)SC2=S)sc(C)c1C 11636552 ADGQHAPDCMGILW-CYBMUJFWSA-N 442.628 4.289 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@H](c2cccc(Cl)c2)N3)CC1 14460354 OESDAGULAZQRDM-MZKRTTBSSA-N 444.000 4.103 10 10 IICE Cc1cc(NC(=O)CN2C(=O)/C(=C\c3c(Cl)cccc3Cl)SC2=S)no1 33668076 ANVUSERUYASKKP-WUXMJOGZSA-N 428.322 4.130 10 10 IICE CC1=NN(c2ccc(C)cc2)C(=O)/C1=C/c1ccc(-c2cc(C(=O)O)cc(C(=O)O)c2)o1 35668752 RHHQYWKCIKHVDY-UDWIEESQSA-N 430.416 4.458 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)CCCc3ccccc3)c3ccco3)CC2)cc1 38598113 BFWWKLFEDXDDPG-VWLOTQADSA-N 447.579 4.291 10 10 IICE CC[C@H](C)N1C(=O)/C(=C\c2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 39723629 LRCPGRFVERWDAJ-KNGSKEOJSA-N 430.599 4.071 10 10 IICE COc1cc(C)c(/C=C2/C(=O)NC(=S)N(c3cccc(Cl)c3Cl)C2=O)cc1C 208733136 ZSTINZDMOFUOIV-LCYFTJDESA-N 435.332 4.450 10 10 IICE Cc1ccc(C(=O)O)c(NC(=O)CN2C(=O)/C(=C\C=C\c3ccccc3)SC2=S)c1 210493559 QDFVOGKJWJBKSX-HYZSBJHASA-N 438.530 4.089 10 10 IICE Nc1ccc(NC(=O)Nc2cc(I)ccc2Br)cc1 311606171 CMMVYARTLUTIRF-UHFFFAOYSA-N 432.059 4.280 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526400327 HQVZVFZBGBMOHZ-QHCPKHFHSA-N 433.460 4.481 10 10 IICE Cn1ccnc1C[C@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)c1ccccc1 745913443 YRTDMRWOUFJAEU-QFIPXVFZSA-N 430.508 4.415 10 10 IICE CCCN(Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O)[C@H]1CCCc2cccnc21 774607549 SJQLVKJXLYAECD-DEOSSOPVSA-N 437.584 4.112 10 10 IICE CN(c1ccc(CNC(=O)NCc2ccc(N3CCOC3=O)cc2)cc1)C1CCCCC1 782998102 FIXUEHDUZHHRLY-UHFFFAOYSA-N 436.556 4.412 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)c(C)s2)s1 799187429 RVTXTEKTTQLZLN-UHFFFAOYSA-N 433.580 4.428 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 812006370 UFONSBZMGMQAGH-HXUWFJFHSA-N 441.601 4.327 10 10 IICE CN(C)c1ccc(CN(C(=O)CSc2nnc(-c3ccc(F)cc3)o2)C2CC2)cc1 914840484 FQEBAYFVEUPBAY-UHFFFAOYSA-N 426.517 4.225 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NCc1ccc(Cl)cc1Cl 918150846 GLSYXNCIHXUSBA-UHFFFAOYSA-N 426.319 4.093 10 10 IICE CCC[C@@H](NC(=O)c1cccc(N2C(=O)/C(=C\c3ccccc3)SC2=S)c1)C(=O)O 1081156799 HPUAGKJYLMMMQK-YPOUMIDOSA-N 440.546 4.076 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C(C)(C)c3ccc(Cl)cc3F)cc2F)CC1 1125976411 XUQIVKKNJRRYDC-UHFFFAOYSA-N 435.946 4.354 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(Oc4ncccc4C)cc3)c2)CC1 1128039347 GBYPASYDFKXBKP-UHFFFAOYSA-N 430.508 4.103 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1132011369 MLWZKBBCDFOWEN-DEOSSOPVSA-N 445.563 4.412 10 10 IICE CC(C)c1nccnc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1134035029 ZWRIGYMKUKUFCD-SDNWHVSQSA-N 432.596 4.282 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cccc(NC(=O)N3CCCC3)c2)c1 1136337055 RXRLKLFYQKQXGL-UHFFFAOYSA-N 444.535 4.464 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)Cc1ccc(O)cc1 1136657744 BQHRGCMVMDIDST-GOSISDBHSA-N 440.927 4.215 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2ccc(F)cc2)c(C)n1-c1ccccc1Br 1141368076 BREQTPSKTXRACY-LJQANCHMSA-N 431.305 4.459 10 10 IICE Cc1cc(C(=O)NCc2ncc3c(n2)CCC3)c(C)n1-c1cccc(Br)c1 1142021373 GMGQNYNIGFHVNU-UHFFFAOYSA-N 425.330 4.065 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)cc1F 1144978970 XPXSIDWBNZILBK-UHFFFAOYSA-N 435.425 4.201 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(S(N)(=O)=O)c1 1154583907 RCYFKOYSFYTMNU-OAQYLSRUSA-N 445.972 4.276 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@@H]1CCCOC1 1178046935 FGSLALPQSCTQIQ-OXQOHEQNSA-N 435.362 4.028 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC3(Cc4ccccc4Br)CC3)C2)cc1 1252925092 ZDHIURARFDQNJF-QGZVFWFLSA-N 444.373 4.111 10 10 IICE O=C(NCC(F)(F)c1ccc(F)cc1F)N(Cc1ccccc1O)C[C@H]1CCCO1 1255010493 MSDIESCEXWMWGJ-MRXNPFEDSA-N 426.410 4.153 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(Oc4ccccc4OC)cn3)CC2)cc1 1264934149 ZTXSFDDGRFKLSA-UHFFFAOYSA-N 433.508 4.290 10 10 IICE Cc1cc(CCNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c(C)n1-c1ccccc1 1287467302 VORZDVWQALDJTM-UHFFFAOYSA-N 428.536 4.357 10 10 IICE CCOCc1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1297165137 VJPMYATUKQCCKP-UHFFFAOYSA-N 433.547 4.335 10 10 IICE COC1CCN(c2ccc(CN3C[C@H]4CCC[C@@]4(NC(=O)OC(C)(C)C)C3)cc2)CC1 1307960379 LFJBPZIVVKEGLE-CJFMBICVSA-N 429.605 4.181 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CCc1cccs1 1314736088 HCUVTIXVLAUIQW-UHFFFAOYSA-N 439.629 4.353 10 10 IICE Cc1noc(C2CC2)c1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1435667615 VBDKBJGEDBEJND-GDNBJRDFSA-N 431.514 4.230 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(-c4cccc(F)c4)s3)cc2)CC1 1447705379 CZTDVAVGPZCZBQ-UHFFFAOYSA-N 437.540 4.153 10 10 IICE CC[C@H](C)Oc1ccccc1/C=C\C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1466398934 VAEAPKMKGPBYIP-CKDIWJPDSA-N 431.916 4.438 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1cc(F)ccc1OC 1471342717 SNSMCJBOIJQPCT-UHFFFAOYSA-N 425.298 4.077 10 10 IICE Cc1sc2nc(CS[C@H](C)C(=O)NCc3cccc(Cl)c3O)nc(O)c2c1C 1472315847 GNJZUBQJUBPULP-LLVKDONJSA-N 437.974 4.311 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](c3ccccc3)C3CCCCC3)CC2)cc1 1473284855 ZYMCQSOPFGNNPX-BDYUSTAISA-N 437.628 4.089 10 10 IICE COc1ccc([C@@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)C2CCC2)cc1 1479473216 XXDJPTAQEFWVEO-QHCPKHFHSA-N 427.520 4.216 10 10 IICE CCOCCCCn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1516687056 KMRMEJXIQOUQKG-UHFFFAOYSA-N 447.599 4.158 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cccc(-n4nccc4C(F)(F)F)c3)c2)CC1 1523931499 UJXBFKFVBBPTGS-UHFFFAOYSA-N 443.473 4.285 10 10 IICE Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(C)c1 1526898389 QWTXNMRUGRKMNP-ZHZULCJRSA-N 442.581 4.393 10 10 IICE COc1cnc2ccccc2c1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533330522 YUFXGNBWSTYWFR-HNNXBMFYSA-N 427.451 4.244 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3CN(C(=O)C4CCCCC4)C3)cc2Cl)C1 1539911722 CDMUYIGCTFXMBD-KRWDZBQOSA-N 432.008 4.231 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CC[C@@H](OCC(C)C)C1 1542227020 QEZSCLUOTCXTQU-JOCHJYFZSA-N 434.588 4.014 10 10 IICE Cc1nnc(N(C)Cc2ccc(Cl)s2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543144113 XKOOMNHGBOVNPZ-UHFFFAOYSA-N 446.020 4.195 10 10 IICE O=C(c1nc2ccc(Br)cn2c1F)N(Cc1ccco1)Cc1ccccc1O 1545496528 QGQSGHHMQZWVHV-UHFFFAOYSA-N 444.260 4.377 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(CC(=O)NCc3cc(Cl)ccc3O)cccc2C1 1557386298 GEQLACKVXDAKEG-UHFFFAOYSA-N 430.932 4.198 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F 1559607462 MTABIAKNOPCSAH-UHFFFAOYSA-N 432.782 4.148 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3cccc(O)c3C2)c(C)n1-c1cccc(Br)c1 1567587746 SOVBXZGREKUQFQ-QGZVFWFLSA-N 425.326 4.459 10 10 IICE Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1585536008 MVOSJAHBGJTFLF-UHFFFAOYSA-N 439.556 4.073 10 10 IICE COC(=O)c1nc(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1Cl 1587035184 MMIMQCAIDNEEAV-UHFFFAOYSA-N 446.334 4.441 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nn(-c4ccc(F)cc4)ccc3=O)c2C)c1 1587880632 FWDPQBLRDXHRAF-UHFFFAOYSA-N 430.483 4.018 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1613663396 FIXCUSJACPSLEP-IBGZPJMESA-N 437.588 4.129 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@@H](C)O1 1614218462 LLLOQXYRVHGWTP-HZPDHXFCSA-N 433.603 4.489 10 10 IICE Cc1cc(CNC(=O)[C@H]2Cc3cc(Br)ccc3O2)c(C)n1-c1ccccc1 1624075715 ZMFIMTXMTYMKQO-OAQYLSRUSA-N 425.326 4.477 10 10 IICE CN1CCN(c2ccc(CNC(=O)C(C)(C)c3csc(-c4cccs4)n3)cc2)CC1 1625145860 SPSHBDPKUZCYLJ-UHFFFAOYSA-N 440.638 4.217 10 10 IICE COc1ccc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c(OC)c1OC 1625326905 CRDAQKPQGMCXGA-UHFFFAOYSA-N 436.508 4.171 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3CC(=O)N(c4cc(Cl)cc(Cl)c4)C3)ccc21 1625848142 WPKYCBZZADPFJW-MRXNPFEDSA-N 432.351 4.045 10 10 IICE C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)N(C(=O)OC(C)(C)C)C1CC1 1626105477 DHGGPOBOANIWFN-PGRDOPGGSA-N 445.604 4.048 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(F)c(OC)c(F)c2N)cc1 1628565514 QGXKWORSKUNQEO-UHFFFAOYSA-N 441.478 4.477 10 10 IICE Cc1cc(CC(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)c(C)n1-c1ccccc1 1629738977 JWNRQOPBUCOSBK-UHFFFAOYSA-N 449.570 4.435 10 10 IICE Cc1cc(C(=O)N2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2)c(C)n1-c1ccc(F)cc1 1635545353 VCHDLWMHWXDZOG-HDICACEKSA-N 427.520 4.172 10 10 IICE COc1cccc2c1CN(C(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CC2 1635687877 LPKOJIZGTBTPAU-UHFFFAOYSA-N 440.341 4.459 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cccc(Cl)c1O 1637615848 DTZDQTQCZVSOJJ-XNTDXEJSSA-N 436.917 4.415 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccc(N(C)Cc3ccccc3O)c([N+](=O)[O-])c2)c(C)c1 1650881317 OIHQCRCQVYBLBN-UHFFFAOYSA-N 441.509 4.354 10 10 IICE Cc1cc(C(=O)Cn2ccc(C(=O)OC(C)C)cc2=O)c(C)n1-c1ccc2c(c1)CCC2 1652732793 GNJPZRWGDXHMJS-UHFFFAOYSA-N 432.520 4.193 10 10 IICE CC(C)N1C(=O)C[C@@H](NCc2ccc(N3CCOCC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 1654145490 BMXMHIKDHRCTQK-ISKFKSNPSA-N 445.966 4.156 10 10 IICE CN(CCCc1cc(-c2ccccc2)no1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1674711895 CICQOHZYOBXUHZ-UHFFFAOYSA-N 448.567 4.077 10 10 IICE CC1(C)[C@H](c2ccc(F)cc2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1674713008 TUHYUFUQHNVPDZ-QHCPKHFHSA-N 425.548 4.265 10 10 IICE C[C@@H]1CCCN(C(=O)OC[C@H]2CCCCN2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1681552640 QWOGXMPNBNSPSN-WOIUINJBSA-N 430.593 4.246 10 10 IICE CCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 1683944868 LORKDODGZUSYPA-BGWNEDDSSA-N 436.600 4.141 10 10 IICE CC[C@H](C)c1nnc(N2CCCC2(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1694092556 MERDTQOWVYTIMA-IBGZPJMESA-N 425.621 4.427 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCCO3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1761674607 DUSLQPJBDLPCCM-OAQYLSRUSA-N 437.588 4.129 10 10 IICE CC[C@H](C)[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1)OC 1763437417 NFLBJHHHZNDFSF-MBSDFSHPSA-N 437.588 4.250 10 10 IICE CC[C@H](C)c1nnc(N(C)C[C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763515223 BHDSOIOQGMKIPQ-PZJWPPBQSA-N 443.661 4.256 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(CC(=O)O)cc3)C2=O)ccc1OC 1860073457 HLMIPVKZWDEGSZ-WOJGMQOQSA-N 429.519 4.127 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)C1CCN(C(=O)Nc2cccs2)CC1 1891327284 HXDGCMQIMNSJQV-RXVVDRJESA-N 438.597 4.297 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@@H]2NCc2cc(Br)ccc2O)C1 1918889232 VOPKVCAIDNUVIO-FXAWDEMLSA-N 425.367 4.424 10 10 IICE COc1cccc([C@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@@H]2C(=O)O)c1O 1952767961 MCSLIMSLOPECMV-QFQXNSOFSA-N 445.471 4.239 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1O 2236032588 OHOUHNHLJFPXIG-ZDUSSCGKSA-N 443.382 4.289 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(N(C)C)cc3)C2=O)cc(OC)c1OC 2297512943 XSQBPTXPTDEWFW-UHFFFAOYSA-N 430.551 4.184 10 10 IICE CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 2313533012 KOWZPTZMDSFXSU-UHFFFAOYSA-N 444.490 4.044 10 10 IICE O=C(O)CN1C(=O)C(=Cc2ccc(OCc3c(F)cccc3Cl)cc2)SC1=S 2313652990 BJQCMYXPNVXTJI-UHFFFAOYSA-N 437.901 4.344 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)c(O)c1Br 2380747685 WQOVIQMOXOFKFG-AWEZNQCLSA-N 441.366 4.115 10 10 IICE CCN1C(=O)/C(=C\c2c(NC3CCC(C)CC3)nc3c(C)cccn3c2=O)SC1=S 33457679 KNONNKWVNIXDOU-SFQUDFHCSA-N 442.610 4.215 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C/c2ccc(OC)c(OC)c2C(=O)O)SC1=S 210400861 VWQSBXZEQXGTOO-WJDWOHSUSA-N 445.518 4.207 10 10 IICE Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NC(CNC(=O)OC(C)(C)C)CNC(=O)OC(C)(C)C 389237350 WRGNDMBIFXSAOK-DOTOQJQBSA-N 449.592 4.257 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccccc2N2CCCCC2)c1 733219035 NDHNFMZRUJCIBH-UHFFFAOYSA-N 442.563 4.421 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@H]2c2ccccc2I)cc1 733801060 RGFIHUGOOFHYKN-IBGZPJMESA-N 449.336 4.404 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)n1CC(F)(F)F 769123141 WSJJMJZBTZPFPT-UHFFFAOYSA-N 448.533 4.129 10 10 IICE Cc1cncc(/C=C\C(=O)N(C[C@@H](C)NC(=O)/C=C/c2cncc(C)c2)c2ccccc2)c1 772126798 UPFJAMXEESRNNH-OXLGGPPOSA-N 440.547 4.358 10 10 IICE O=C(NCc1ccc(O)c(O)c1)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1 778919141 VLONGOJWYKMEKE-UHFFFAOYSA-N 433.504 4.041 10 10 IICE Cc1cc(CC(=O)NCc2cccc(C(=O)NCc3ccco3)c2)c(C)n1-c1ccccc1 1125390481 UHDUBQRKIAYHOP-UHFFFAOYSA-N 441.531 4.476 10 10 IICE Cc1cc(C(=O)NCCNc2nccc(C(F)(F)F)n2)c(C)n1-c1cccc(Cl)c1 1136865624 SPLIOGPMPZEORP-UHFFFAOYSA-N 437.853 4.398 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCC(=O)Nc1nnc(C2CC2)o1 1152400600 CHMYLIIXPHTOHE-INIZCTEOSA-N 434.496 4.161 10 10 IICE CCOC(=O)c1sc2nc(C)nc(NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2c1C 1164318038 LDIOSYXWBQTHKI-GOSISDBHSA-N 441.601 4.266 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1C[C@H](OCC)C12CCCC2 1233605707 XKIBLWPNHWOZHD-ZEQRLZLVSA-N 443.632 4.307 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3c4ccccc4CC[C@H]3O)cc2Cl)C1 1235833621 LIERWOOCIFWKMS-FNVCAUGXSA-N 427.976 4.424 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3CC(C)(C)c3cccs3)CC2)cc1F 1300245915 AHIMZYBSRCMLHQ-UHFFFAOYSA-N 429.565 4.100 10 10 IICE CCc1nnc(N2CCO[C@@H](CCc3ccccc3)C2)n1CCCSc1nccs1 1306221000 IHUYGKKGAWKUNH-IBGZPJMESA-N 443.642 4.317 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](COC)C1 1315773056 DFJDRLKGDDDLHW-RXVVDRJESA-N 437.588 4.108 10 10 IICE Cc1cc(CN(C)c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)no1 1361060125 KFTPPEPHXWBANV-INIZCTEOSA-N 434.591 4.091 10 10 IICE CC(C)(C)OC(=O)N1CCOc2ccc(NC(=O)c3ccc(N=NC(N)=O)cc3)cc2C1 1450467333 HFZBSIIEAIJTLA-UHFFFAOYSA-N 439.472 4.231 10 10 IICE Cc1cc(C(=O)Nc2cccc3ncnc(O)c23)c(C)n1-c1ccc(Br)cn1 1455613613 VKUWQFJGZVWCTM-UHFFFAOYSA-N 438.285 4.153 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1459836896 CERPKJHKXYHBDA-JKSBSHDWSA-N 447.982 4.450 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C[C@](O)(c1nc2ccccc2s1)C(F)(F)F 1465030970 OZYMFULDMJMEAS-FQEVSTJZSA-N 437.487 4.127 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNCc1cccc(Br)c1O)CC(F)(F)F 1474496041 LYRDOQZXTDMYPX-NSHDSACASA-N 427.261 4.090 10 10 IICE Cc1ccccc1-c1nnc(N(C)C[C@@H]2CCOC2)n1CCCSc1nccs1 1511245657 RFCYNUGNZHGIOZ-KRWDZBQOSA-N 429.615 4.365 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)cc2F)C[C@H](C)O1 1516816974 OXCOSWDCJXKDOC-GJZGRUSLSA-N 449.910 4.250 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CC(=O)N(C)C1CCCCC1 1517149820 VWDIEBJHQOOMFE-UHFFFAOYSA-N 425.577 4.069 10 10 IICE COc1cc(N2CCN(C(=O)[C@@](C)(Cc3ccccc3)C(C)C)CC2)cc(OC)c1OC 1521836441 GNAFDPRSEHZJSJ-SANMLTNESA-N 440.584 4.266 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cccnc1C 1524952300 IDAZFOOVGFTBMS-AQTBWJFISA-N 429.542 4.174 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)[C@@H]1C[C@H]2CC[C@H]1C2 1525904041 RWISMDJZZMQMKD-YCJAGTIPSA-N 432.586 4.358 10 10 IICE CCCCOCCN(C(=O)/C=C/c1cnc(OC)nc1)c1ccc(Br)cc1 1538954792 VWHHKQFWRKRARL-BJMVGYQFSA-N 434.334 4.111 10 10 IICE C/C(=C\C(=O)N(Cc1ncc[nH]1)c1ccc(Br)c(Cl)c1)c1cnccn1 1544408352 CENKBHZSFZYXRM-XYOKQWHBSA-N 432.709 4.252 10 10 IICE CCCN(CC(=O)Nc1sc2c(c1C(=O)OC)CC[C@H](C)C2)Cc1ccccc1O 1559571361 REEVSVCQFZUGHX-HNNXBMFYSA-N 430.570 4.216 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(O)CCc4ccccc43)cc2Cl)C1 1564650255 UUMRDNMIDZXSGN-MZNJEOGPSA-N 427.976 4.210 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 1564946469 PZZYJAZSVDZYFP-DZFGPLHGSA-N 441.576 4.163 10 10 IICE CN(C)C(=O)C[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)c2ccc(Cl)cc21 1565874683 AHKFRAZLMNHYQE-LBPRGKRZSA-N 430.913 4.188 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)c(C)n1-c1ccccc1 1595949672 CEZJHDKAZNHUPI-HXUWFJFHSA-N 435.955 4.459 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(OC)cc1I 1597773959 DGZUAYFTYYOMBR-UHFFFAOYSA-N 438.309 4.028 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(OC2CCCC2)c1 1618649145 XMROMCCIJBBWPR-UHFFFAOYSA-N 442.531 4.047 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H](C)O[C@@H](C)C2)sc(C)c1-c1ccccc1 1620423567 NADOVNBBPOZTNU-CVEARBPZSA-N 430.570 4.338 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc([C@H](C)CC(N)=O)cc2)C1 1626881900 PYVCMOVLMKNACC-GOSISDBHSA-N 432.568 4.025 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C(C)=C\c2cccnc2)cc1 1627166221 ZJBULEAUPCOBGQ-ZPHPHTNESA-N 429.520 4.129 10 10 IICE COCCOc1cc(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)nc2ccccc12 1627467909 SBWHFSRUFOERAZ-UHFFFAOYSA-N 433.552 4.426 10 10 IICE Cc1cc(C(=O)Nc2ccc(-c3nn[nH]n3)cc2)c(C)n1-c1ccccc1Br 1631713837 PSTZKEBNLKXPPL-UHFFFAOYSA-N 437.301 4.289 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c1 1636715113 ALOVHAMJTJGHGM-YADHBBJMSA-N 444.453 4.171 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(F)c(F)c(Br)c(F)c2F)cc1 1640771733 RBTAXDFXCMBWFF-UHFFFAOYSA-N 449.242 4.223 10 10 IICE COC(=O)/C=C\c1ccc(N(C)CC(=O)Nc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 1641958367 SBOJCZFRMRNPGK-YWEYNIOJSA-N 438.267 4.163 10 10 IICE COC(=O)/C=C/c1ccc(N(Cc2ccc(Cl)cc2)Cc2cnn(C)c2)c([N+](=O)[O-])c1 1642648828 LTUAHORIYVGADK-UXBLZVDNSA-N 440.887 4.375 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]([C@@H]3CCCO3)C2)sc(C)c1-c1ccccc1 1648269565 BXTKFVYAZFSNJC-MOPGFXCFSA-N 442.581 4.340 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(C(F)(F)F)CC1 1653472265 FHQGYFMPWQWSEO-ZDUSSCGKSA-N 430.426 4.063 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCCCCN(Cc4ccccc4)C3)C2)cc1 1687025574 RYZRILCRKBKCPP-DHIUTWEWSA-N 436.600 4.018 10 10 IICE CN(CC(C)(C)C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1696660807 GAVPHSJUFNFYMO-UHFFFAOYSA-N 436.629 4.424 10 10 IICE CC(C)NC1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1723658917 RDZMGXVLPXAAQU-UHFFFAOYSA-N 438.664 4.264 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)c3ccco3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1751415174 IAIXRDUENRLSOZ-LJQANCHMSA-N 446.555 4.231 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@](C)(OC)C1 1768137514 CLIPAHXMOSAEHV-RUZDIDTESA-N 437.588 4.394 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3ccc(N4CCN(C)CC4)cc3)C2=O)cc1 1860085271 AIIAXNDXAWHUNH-LTGZKZEYSA-N 439.606 4.243 10 10 IICE CN(CCCN(C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2)C(=O)OC(C)(C)C 2044637999 OTXPXBMREHQYGI-UHFFFAOYSA-N 448.608 4.255 10 10 IICE COc1cc(C=C2SC(N3C[C@H](C)O[C@@H](C)C3)=NC2=O)ccc1OCc1ccccc1 2053496912 PERNXZAKWQXXKK-IRXDYDNUSA-N 438.549 4.354 10 10 IICE Cc1cc(O)c([C@H](n2nc(C(F)F)c(C(N)=O)c2Br)C2(C)CC2)cc1C 2080055681 IWMZXAAOOLGUPV-AWEZNQCLSA-N 428.277 4.394 10 10 IICE CC(C)(C)OC(=O)NCC[C@@H]1CC[C@H](NCc2cc(Br)cc(F)c2O)C1 2098526365 WISGEQKAQXHWGE-WFASDCNBSA-N 431.346 4.467 10 10 IICE CN1CCc2cc([C@H](N)c3cc(Br)ccc3I)ccc21 2163140636 LPAGABCFLLAYPS-INIZCTEOSA-N 443.126 4.094 10 10 IICE N=C1C(=Cc2cccc3ccccc23)C(=O)N=C2SC(c3ccc4c(c3)OCO4)=NN12 2296400338 SVCYJWYDOLKDKJ-UHFFFAOYSA-N 426.457 4.236 10 10 IICE COc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccc(C)cc3)C2=O)cc1OC 2296881549 NVXQORVGPAQSES-UHFFFAOYSA-N 442.562 4.242 10 10 IICE CC[C@H](C)n1cc(C=C2C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c2ccccc21 2296929590 MUWYVJYOMIBAQC-AWEZNQCLSA-N 431.448 4.007 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(\C)Nc1ccccc1OC(F)(F)F 103920281 MXYBFVPYXZTBLO-CPNJWEJPSA-N 433.386 4.237 10 10 IICE CCOC(=O)Cn1cc(/C=C2\C(=O)N(c3ccc(C)c(C)c3)C(=O)N=C2O)c2ccccc21 27571093 ZDALVHGFNWOVAU-NDENLUEZSA-N 445.475 4.328 10 10 IICE CCCOc1ccccc1/C=C1/SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O 210501891 WECFOEFMSZJCKC-GZTJUZNOSA-N 443.502 4.278 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(CC(=O)OC3CCCCC3)C2=O)cc1OC 40888406 JLSJKVOCQWECCL-PDGQHHTCSA-N 435.567 4.171 10 10 IICE COc1cc(Br)cc(CN2CC[C@@]23CCCN(C(=O)OC(C)(C)C)C3)c1O 812761048 CZZQNRGCDPTHNO-HXUWFJFHSA-N 441.366 4.139 10 10 IICE CCCc1sc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc1CC 1351456312 GYZGPIJQKKTVHV-UHFFFAOYSA-N 429.630 4.214 10 10 IICE CN(C)c1ccc(CN(C(=O)c2c(F)cccc2I)C2CC2)cc1 1124836772 ZZPUIOIJCFVSJV-UHFFFAOYSA-N 438.284 4.301 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)/C=C\c2ccc(Cl)cc2)cc1F 1125465342 VIRYVWUHGYANMF-BPRLYGGPSA-N 443.950 4.256 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H](c1ccncc1)C1CC1 1134646183 ICXCPZQWZFBSOM-ITICKHJUSA-N 441.553 4.080 10 10 IICE CCOC(=O)C1(COC)CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 794334835 SSUSCCYPHBTNBU-UHFFFAOYSA-N 432.948 4.179 10 10 IICE CC(C)(CCc1ccccc1)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307454852 CNJNODCLVQGYAC-UHFFFAOYSA-N 426.516 4.402 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4c(F)cc(Br)cc4[nH]3)C2)cc1 1162724717 IFFYTYLQPXYMIO-CYBMUJFWSA-N 446.320 4.334 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(CCc3ccccc3)Cc3ccncc3)C2)cc1 1312995076 RDDCNQJJJFFXPH-HSZRJFAPSA-N 430.552 4.123 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2cnc(NC(=O)/C=C/c3ccc(O)c(O)c3)s2)CC1 1346131869 UMFBZVIUOJFVJW-FNORWQNLSA-N 445.541 4.321 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(Br)c(OC(C)C)c3)C2)cc1 1278861752 NGSZOPCTNLSTQB-INIZCTEOSA-N 433.346 4.254 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC(C(F)(F)F)CC2)cc1F 1503394168 SHRVQTRTXUPDEI-UHFFFAOYSA-N 436.457 4.305 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4c(Cl)cccc4Cl)CC3)CC2)c(OC)c1 1438186107 OVCDWXBMYWWXSL-UHFFFAOYSA-N 435.351 4.391 10 10 IICE Cc1cnc(CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c(C)c1 1437186884 SYFFKXCCQHMVMG-LDADJPATSA-N 445.635 4.100 10 10 IICE COc1ccc(Cn2cc(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)cn2)cc1OC 1287660406 IUYKUMMSHFSBNF-UHFFFAOYSA-N 444.535 4.286 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c(C)n1-c1ccc(Br)cc1 1448920778 JOPOBNSJAUVDNI-JIGPKXGUSA-N 447.373 4.265 10 10 IICE COc1ccc([C@H](CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)N2CCOCC2)cc1 1440722610 MKZJDMWRDBZTSU-SANMLTNESA-N 447.579 4.214 10 10 IICE COc1ccc2c(c1)CC[C@H](C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 1361062928 IJLHOTCGBFUEFH-RBUKOAKNSA-N 430.495 4.187 10 10 IICE Cn1nc(-c2ccccc2)cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1360045817 SNDLNCFYDQPJDK-UHFFFAOYSA-N 426.467 4.087 10 10 IICE CC[C@@](C)(O)CN(Cc1ccccc1)c1ccc(CNCCOC)c(Br)c1 1915216267 HKUGHCXCPFTMQD-JOCHJYFZSA-N 435.406 4.353 10 10 IICE COc1ccc(-c2cncc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)c2)c(C)c1 1519155485 GLSUEOUOSRHSCE-LJQANCHMSA-N 431.536 4.393 10 10 IICE CC[C@H](Oc1ccccc1Cl)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1446812735 AEAZAJCEPWHLQB-KRWDZBQOSA-N 426.296 4.058 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C1 1512003666 XUZOMCHVZCQRPB-IAGOWNOFSA-N 428.631 4.385 10 10 IICE Cc1cc(C(=O)N2CCN(c3ncccc3[N+](=O)[O-])CC2)c(C)n1-c1ccc(Cl)cc1 1298949591 PORJGFHVIIUELX-UHFFFAOYSA-N 439.903 4.013 10 10 IICE CCCCOc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1OCC 1294824110 PWPSZNIBWPFIMQ-UHFFFAOYSA-N 430.520 4.374 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cccn(CC(F)(F)F)c3=O)cc2Cl)C1 1459574738 HPSDMLXGYDOYGP-AWEZNQCLSA-N 441.881 4.230 10 10 IICE C[C@@]1(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC1(Cl)Cl 1525997219 HSRGGIYSNYLQPU-YJJOXIQCSA-N 447.384 4.117 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cc(F)cc(C(F)(F)F)c4)CC3)CC2)cc1F 1294822943 BYNAIAVMIQMOOU-UHFFFAOYSA-N 440.412 4.373 10 10 IICE CC[C@H](C)c1nnc(N2CCSC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1291682215 PCKHPMLVWHVDPK-ROUUACIJSA-N 431.675 4.335 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1529276855 BBGVLWFFMDPTTF-QGZVFWFLSA-N 448.533 4.439 10 10 IICE Cc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1N1CCCS1(=O)=O 1530195677 BAVIWUVVMJNFKC-UHFFFAOYSA-N 437.565 4.124 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCN(C)C)c3cccnc3)cc2Cl)C1 1469960609 QMZPVOLRUYKXFT-XMSQKQJNSA-N 444.023 4.464 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCN(C)C)c3cccnc3)cc2Cl)C1 1469960608 QMZPVOLRUYKXFT-PGRDOPGGSA-N 444.023 4.464 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1 1470555830 ITYVENRMUYUUOT-IBGZPJMESA-N 446.636 4.328 10 10 IICE CCCN1CC[C@@H](Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1709770614 IHMVSUHURGFOAB-LJQANCHMSA-N 425.602 4.004 10 10 IICE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1612821175 NLEXGXBBYLUBEP-VQIMIIECSA-N 441.576 4.143 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1544740692 UWHZSBSEQUMZOX-GASCZTMLSA-N 428.943 4.339 10 10 IICE Cc1cccc2sc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)nc12 1624466207 IZCMJSJZVFTUJH-UHFFFAOYSA-N 445.547 4.425 10 10 IICE COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)c1 1559359630 NJLODGBSJVPRPD-UHFFFAOYSA-N 426.400 4.190 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)c2C)c1 1624069988 NHPLTTWQUCNVHU-UHFFFAOYSA-N 429.480 4.426 10 10 IICE C[C@H](NC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1)c1ccc(N(C)C)cc1 1638950290 LROIOEDKJXAURM-HNNXBMFYSA-N 429.567 4.106 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2cccc(F)c2)c(C)n1-c1ccc(Br)cc1 1566784225 DDAZVMYWEFTTAP-HXUWFJFHSA-N 431.305 4.459 10 10 IICE CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1cccc(O)c1O 1633021776 SBNNDJXOXZUWTN-UHFFFAOYSA-N 430.810 4.259 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1496021354 ARGGEXPAECDPSM-TZIWHRDSSA-N 443.661 4.256 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@]3(N(C)C)COc4ccccc4C3)cc2Cl)C1 1568142218 PKSHAXZWXKTXKB-IQGLISFBSA-N 442.003 4.128 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)N(Cc2ccco2)Cc2ccccc2O)c1 1566302988 STCGFOBHAAORDV-UHFFFAOYSA-N 446.463 4.289 10 10 IICE CCOCCOC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 1564649449 DCMWGSGQIXVPSZ-SFHVURJKSA-N 438.012 4.303 10 10 IICE Cc1cc(C(=O)N2CCC([C@@H]3CCOC3)CC2)c(C)n1-c1ccc(Br)cn1 1631396841 BJGKFNLIMXDNTG-QGZVFWFLSA-N 432.362 4.140 10 10 IICE C[C@@H](NC(=O)c1cccc(OCCN(C)C(=O)OC(C)(C)C)c1)c1ccc(N(C)C)cc1 1638957498 PQJQICGGWUMRQC-GOSISDBHSA-N 441.572 4.489 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cc1cccc(NS(C)(=O)=O)c1 1632696892 AEWRHBLIHNUIIP-SFHVURJKSA-N 438.549 4.096 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCCNc2ccc([N+](=O)[O-])cc2)cc1 1640367571 GGJULKHLRHUBDG-UHFFFAOYSA-N 438.450 4.444 10 10 IICE CCCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccccc1O 1658432742 FBQSPGBLLXYONW-UHFFFAOYSA-N 442.515 4.408 10 10 IICE CCOC1CC(CCn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)C1 1746912177 FFCBVXPADLDOKY-UHFFFAOYSA-N 441.620 4.080 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2cnn(C)c2)n1Cc1ccc(N2CCC(C)CC2)cc1 1743570568 NAJDRQQBMADOJH-FQEVSTJZSA-N 435.620 4.446 10 10 IICE C[C@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc2c(c1)CCCC2 1671457979 GQKYXHLZLJIMFI-INIZCTEOSA-N 429.511 4.241 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1766822931 LXDGZMXZFQGRJU-DLBZAZTESA-N 437.635 4.164 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](c3cnn(C)c3)C2)n1CCCSc1nccs1 1763598534 OVFXRIFWYBULSF-CVEARBPZSA-N 431.635 4.158 10 10 IICE CSC[C@@H]1CCCN1c1nnc(C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1698391723 MRTBLZVMRHQPGN-FQEVSTJZSA-N 431.675 4.335 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)ccc1O 15039026 TXRHMLHAZWZPRR-RGEXLXHISA-N 442.562 4.411 10 10 IICE O=C(O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cccc1[N+](=O)[O-] 1951946891 DIZPAKVCBNXTMI-IBGZPJMESA-N 448.431 4.355 10 10 IICE CCc1nn([C@@H](c2ccc(OC)cc2O)C(C)(C)C)c(I)c1C=O 2079978735 GELHHWLZSWCVQI-INIZCTEOSA-N 442.297 4.212 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N2CCC[C@@H](N=[N+]=[N-])C2)C1 2060638822 BFPASTKVMLJIHM-XXBNENTESA-N 443.548 4.132 10 10 IICE C[C@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccc(F)cc1O 2084723941 CEEYLFWRDCOPOF-RXVVDRJESA-N 443.563 4.303 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(CCCCCC(=O)N2CCOCC2)C1=O 2314489126 OGRWYVPGNJOZLY-UHFFFAOYSA-N 444.622 4.253 10 10 IICE CCOc1cc(C=C2C(=O)N(c3ccc(OC)cc3)N=C2C)cc(Br)c1O 2332110762 KVYUIFSFUBLLDK-UHFFFAOYSA-N 431.286 4.368 10 10 IICE Cc1cc(C)c(/N=N/c2cc(S(=O)(=O)O)c3ccccc3c2O)c(S(=O)(=O)O)c1 20232601 LZHNQLKWDOQXRT-FMQUCBEESA-N 436.467 4.071 10 10 IICE CCc1ccccc1Nc1ncnc(N2CCN(c3ccc(OC)cc3)CC2)c1[N+](=O)[O-] 40587008 ZRZFZEBOKAXXCR-UHFFFAOYSA-N 434.500 4.026 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cnc3c(cnn3C(C)C)c2)C1 563850958 RHTYCAHXUIDUKW-UHFFFAOYSA-N 430.556 4.372 10 10 IICE COc1ccc(O)c(CN2CCC(N(CC(F)(F)F)C(=O)c3ccccc3F)CC2)c1 775713060 TXYSTJUZQQLMMT-UHFFFAOYSA-N 440.437 4.209 10 10 IICE C[C@H](N[C@@H](C)[C@H](O)c1ccc2c(c1)OCO2)c1cc(Br)cc(Cl)c1O 787010738 RGTVNJJGESUFFJ-YMNVWFMLSA-N 428.710 4.310 10 10 IICE COc1ccc(CNC(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c(O)c1 793042821 UNHFWWXZRPHROD-TZIWHRDSSA-N 435.927 4.217 10 10 IICE C[C@@H](Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1cc(Br)cc(F)c1O 797146466 WNHSDPBJPJOTNY-SECBINFHSA-N 425.229 4.259 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@](F)(c4cccc(C(F)(F)F)c4)C3)cc2N1 800884421 GBIBSWYJOKAUQT-GOSISDBHSA-N 425.338 4.020 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/C(=O)NC(=O)N(c3cccc(C)c3)C2=O)o1 1083994930 ZFUQJACUUMKMRK-MOSHPQCFSA-N 445.431 4.392 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nn(-c2ccccc2)cc1Br 1129974088 MSKRCMUSKUGNLV-MRXNPFEDSA-N 441.373 4.370 10 10 IICE COc1ccc(C(=O)C[C@@H](C)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1137081310 CZWUYJATMSHKOZ-AEFFLSMTSA-N 446.494 4.291 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(Br)cc1O 1137082129 PQTLDBNZLPNNFU-CYBMUJFWSA-N 441.272 4.155 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)c1 1137926361 PARJJZQJJRDQBL-MRXNPFEDSA-N 428.492 4.490 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@](C)(Cc2ccccc2)[C@H](C)O)C1 1140089251 LOIVFHOELDKYJM-KMRXNPHXSA-N 447.623 4.154 10 10 IICE CC(C)C[C@H](CC(=O)NCc1ccc(N2CCSCC2)cc1)NC(=O)OC(C)(C)C 1141804359 XJZHCDNOWWOAHO-LJQANCHMSA-N 435.634 4.186 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(OC)c(O)c(OC)c2)cc1 1144704627 ROFISSAGKNZVDI-UHFFFAOYSA-N 436.508 4.331 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1COCc1ccccc1 1148705307 HDPLIQNOAIMCKZ-UHFFFAOYSA-N 430.548 4.295 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](c3ccccc3)[C@@H](O)c3ccccc3)C2)cc1 1230858821 NSKIGOZBKYKNIK-GPUOULLFSA-N 431.536 4.048 10 10 IICE Cc1ccc(NC(=O)C2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)nc1 1264670282 XRKNFSZRLDFNEW-UHFFFAOYSA-N 430.552 4.217 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3cc(C(F)(F)F)cnc3C(=O)OC)ccc21 1288218729 BUWKCILEFJTURE-UHFFFAOYSA-N 449.429 4.357 10 10 IICE CC(C)Oc1cc(Br)cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1289600583 UDOQBUSCTZOFNJ-NRFANRHFSA-N 448.405 4.335 10 10 IICE C[C@H]1CCC[C@@](Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1291066149 KBYZLXQFBIEWSK-UQBPGWFLSA-N 434.588 4.193 10 10 IICE CCc1nnc(N(C)C[C@@H](C)c2nccs2)n1Cc1ccc(N2CCSCC2)cc1 1292819299 HCVCVEPKYXXZME-QGZVFWFLSA-N 442.658 4.138 10 10 IICE COc1cc(C)c(CN(C)c2nnc(C)n2CCCSc2nccs2)cc1OC 1299823880 AZHCPZMQRNOKHT-UHFFFAOYSA-N 433.603 4.187 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCCCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1304698159 XQGFVUJVFXLIKM-IBGZPJMESA-N 426.561 4.399 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccccc3OC(F)(F)F)C2)cc1 1312900932 AUFLMHPVSKDJGU-INIZCTEOSA-N 437.462 4.262 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC[C@@H]3C)nnc2[C@]2(OC(C)C)CCOC2)cc1 1313678260 GFBHPBKHVMIVCQ-CPJSRVTESA-N 441.620 4.202 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)CCCOc2ccc(F)cc2)C1 1352012196 XRHFQCWMRMQKGG-UHFFFAOYSA-N 437.559 4.474 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(OC(F)(F)F)cc2Br)cc1F 1356250679 LAHGUGXANCHAQC-UHFFFAOYSA-N 435.215 4.483 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1(C(F)(F)F)CCC1 1360954812 AYKLMVAJVKNFRZ-BENRWUELSA-N 434.530 4.331 10 10 IICE CCN(CC)c1nc2sc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cc2s1 1439959641 GAKRPTIXBJGHMB-QGZVFWFLSA-N 445.658 4.303 10 10 IICE CC(C)(C)OC(=O)N1CCC(N(C(=O)c2cc3cc(O)c(O)cc3s2)C2CC2)CC1 1443045804 LARXDHFHOBEGHD-UHFFFAOYSA-N 432.542 4.317 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)cc1 1447173054 NUTLNDZVIYOPQR-QFIPXVFZSA-N 428.891 4.091 10 10 IICE Cc1cc(C)c2c(c1)N(CC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CCC2 1459723528 SWJPHGFINZEOSC-BGYRXZFFSA-N 439.575 4.125 10 10 IICE CCN(CCOc1ccc(Br)cc1)c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 1472723995 QTSLGOXBVDXCEY-VZUCSPMQSA-N 449.301 4.449 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCO[C@@H]1C 1500735332 WQGINVVKYVNNSF-NLFFAJNJSA-N 437.588 4.129 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(Br)cc3SC)C2)cc1 1529411205 BEFGBCAWJWNVIF-AWEZNQCLSA-N 435.387 4.436 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)c(Cl)cc3OC)cc2F)CC1 1530366482 DRWIYFPAAQIRBW-UHFFFAOYSA-N 440.346 4.213 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CN(C(=O)OC(C)(C)C)CC34CC4)ccc21 1539827985 ZTNXTUFYKUOIKR-OAQYLSRUSA-N 441.572 4.034 10 10 IICE C[C@H](c1cccs1)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541795937 LGSYEGVIWSJKFH-WBVHZDCISA-N 429.565 4.294 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CC[C@@H](C(C)(C)C)C1 1542226972 OMTDHNOOMSJGFG-LEWJYISDSA-N 425.621 4.467 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@]1(O)CCC[C@H]1C 1545503942 LHAWXDQNXWQNRJ-DFIYOIEZSA-N 441.620 4.068 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(NC(=O)OCC)cc1 1556426453 NLWMFJKOAHIFGO-UHFFFAOYSA-N 441.528 4.257 10 10 IICE Cc1cccc2c1C[C@H](C(=O)NCCCSc1nccs1)N2C(=O)OC(C)(C)C 1565620552 VTFCEGSNTZRONT-QGZVFWFLSA-N 433.599 4.416 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@@H](c1ccsc1)N(C)C 1617940859 SFNMABKPWOKCHT-PZJWPPBQSA-N 441.601 4.226 10 10 IICE CCCOc1ccc(CC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1OCCC 1622564352 YWGXXCZTCUGWNL-UHFFFAOYSA-N 444.547 4.303 10 10 IICE C[C@@H](NC(=O)Cc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 1625543605 IXZQGFPXJQKLOX-GOSISDBHSA-N 437.584 4.466 10 10 IICE O=C(C[C@@H]1C(=O)Nc2c(Br)cccc21)NCc1cc(Cl)cc(Cl)c1O 1625688717 IACSLOVQGQYGBR-NSHDSACASA-N 444.112 4.204 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2CCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1628495392 KYROVLGREYBJFO-SJLPKXTDSA-N 425.520 4.260 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3=Cc4ccccc4O[C@@H]3C(F)(F)F)C2)cc1 1630618748 GLJAYCABHMTJQD-VFNWGFHPSA-N 432.442 4.045 10 10 IICE COc1ccc(C)cc1[C@@H](C)N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1643356158 RVIZLUQDXUDGRU-SJORKVTESA-N 442.515 4.457 10 10 IICE CCN(C)c1ccc(CN2CCC[C@H]([C@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)C2)cc1 1659302693 ACYYTNDEBNPPOF-QZNHQXDQSA-N 431.621 4.427 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CC[C@H](c2ccc(Cl)cc2)C1 1683165999 INFKWVCVYFMSOS-FPOVZHCZSA-N 427.976 4.437 10 10 IICE COc1ccc([C@H](O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1686827111 WGMDTXYAGWXPFW-DFBJGRDBSA-N 439.600 4.156 10 10 IICE CC(C)CN(C)c1nnc(-c2ccc3c(c2)OCCO3)n1CCCSc1nccs1 1692402130 XXKXPHLZXWNCRR-UHFFFAOYSA-N 445.614 4.447 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1692987685 KVHOXOAXIWXPQD-UHFFFAOYSA-N 436.604 4.313 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1709197161 APVNYQYLUPXVCP-MBSDFSHPSA-N 448.615 4.456 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@H]1CC1(C)C 1711095748 XEQJFCCLZGOTDB-CQSZACIVSA-N 430.350 4.424 10 10 IICE C[C@H]1N(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCOC1(C)C 1726759638 BAYRWQDJVFKTTN-HZPDHXFCSA-N 437.635 4.162 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@H](C)C1 1749662017 BDEYTCHRLRETQW-HXUWFJFHSA-N 437.588 4.394 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C)C3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1751410778 VVHXSFUQHQYXID-LJQANCHMSA-N 448.615 4.457 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1C[C@@H](C)[C@H](C(F)(F)F)C1 1761697406 FCFQDLGFSKZWSI-VQIMIIECSA-N 446.521 4.341 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(-c5ccccc5F)[nH]c4c3)CC2)cc1 1861869762 WNGBUMATTRDLAI-UHFFFAOYSA-N 430.483 4.340 10 10 IICE CC[C@@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCCOC(C)C)C1=O 1873167912 CKWBYNDRFGOFOK-GOSISDBHSA-N 437.584 4.377 10 10 IICE O=C(CCCc1nc(-c2ccco2)no1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874180085 ZFOOJZBZRGWWCF-UHFFFAOYSA-N 427.416 4.066 10 10 IICE CCc1cccc(CNC[C@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c1O 2084739946 XKCMFNRTRMZDNA-QHCPKHFHSA-N 439.600 4.166 10 10 IICE CC[C@H](NC[C@H]1C[C@H](OC)CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2172450425 XBLMRKUICOITMV-VYDXJSESSA-N 443.382 4.220 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccco2)SC1=S)NC12CC3CC(CC(C3)C1)C2 2297554511 BNARYTXZHQIGRA-UHFFFAOYSA-N 430.595 4.346 10 10 IICE CCOC(=O)c1ccc(NCN2C(=O)S/C(=C/c3ccc(N(C)C)cc3)C2=O)cc1 59377435 QJKMDZADAPRNMN-CPNJWEJPSA-N 425.510 4.035 10 10 IICE Cc1oc2c(CN3CCO[C@]4(CCOC4)C3)c(O)ccc2c(=O)c1-c1ccccc1Cl 768905063 GYFMFTVVGKNPRA-XMMPIXPASA-N 441.911 4.119 10 10 IICE C[C@@H](c1cc(F)ccc1F)N(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769040500 FVOHMOMXTKSFNV-SFHVURJKSA-N 442.554 4.399 10 10 IICE Cc1cc(Br)cc(/C=C2/SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)c1 772178601 IGMPDZQGCTUUMB-OQLLNIDSSA-N 433.352 4.262 10 10 IICE CC(C)Oc1ccc(N2C(=O)/C(=C\c3c(Br)cnn3C)SC2=S)cc1 779203856 LQAONKMMLPJVRA-OVCLIPMQSA-N 438.372 4.376 10 10 IICE Cc1cc(Br)c(O)c(CN2CCCN(C(=O)c3ccc(Cl)cc3)CC2)c1 781903334 ZBNDTVIIJPHSEZ-UHFFFAOYSA-N 437.765 4.465 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OC[C@@H](F)C(F)(F)F 800126258 CAYVYDHCZARHDE-PFEDMVJOSA-N 427.466 4.173 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802695088 QNIUWUKBLRHXNL-JTHBVZDNSA-N 449.599 4.394 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)c(C)n1-c1ccc(F)cc1 918133658 FTEMWRGKJDKUHY-HNNXBMFYSA-N 429.517 4.096 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)cn(C2CC2)c1=O 1124940235 XZUASMJOZPOYLC-UHFFFAOYSA-N 432.362 4.063 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4c(F)c(Br)ccc4[nH]3)CC2)cc1 1151503421 UKHAYYJPBFBXCN-UHFFFAOYSA-N 446.320 4.431 10 10 IICE Cc1cc(S(N)(=O)=O)ccc1CNC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1155797413 ANTIZBALCQNHCN-UHFFFAOYSA-N 439.581 4.103 10 10 IICE O=C(N[C@@H]1CCC[C@@H]1c1ccccc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1171364348 FTDOOBZGVXSNOO-IEBWSBKVSA-N 442.562 4.321 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCCN(C(=O)c3cc(C)cc(C)c3)C2)cc1F 1293224761 GNMNMYDUWAJYQO-NRFANRHFSA-N 439.575 4.457 10 10 IICE COc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1N1CCOC1=O 1293953649 MGDWCPHUTSFCSF-UHFFFAOYSA-N 447.491 4.433 10 10 IICE Cc1cc(C(=O)N(CCN2CCOCC2)Cc2ccco2)c(C)n1-c1ccc(Cl)cc1 1299379914 MLWCIFUYYBIVCC-UHFFFAOYSA-N 441.959 4.315 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCC[C@@]2(C)NC(=O)OC(C)(C)C)cc1 1300282623 WRITUBYKKMSIDM-HYBUGGRVSA-N 433.593 4.063 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)C1 1302669497 RKFWQSNDPSBANY-OAQYLSRUSA-N 438.645 4.428 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1303697768 SYFZLZGDWKSJTF-FQEVSTJZSA-N 445.332 4.329 10 10 IICE Cc1cc(C(=O)N2NC(=O)C[C@@H]2c2ccccc2)c(C)n1-c1ccccc1Br 1306124907 XZDZKGLTGWERJA-HXUWFJFHSA-N 438.325 4.475 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(CC3CCCCC3)C3CC3)cc2F)C[C@@H](C)O1 1307423037 WTXKJQKIWYOZLJ-RTBURBONSA-N 431.596 4.100 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@H](CO)C2CC2)c(C)n1-c1ccccc1Br 1450039827 UMIVBJODPPRBKL-NQIIRXRSSA-N 431.374 4.384 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3oc(COc4ccc(C=O)cc4)cc3C)C2)cc1 1452026490 JRXYRBDQFBUHMX-FQEVSTJZSA-N 448.519 4.244 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3ccc(Br)cc3)n2)c(C)n1-c1ccccc1 1458842109 DQRLEFBLCNKDGB-UHFFFAOYSA-N 436.313 4.393 10 10 IICE CCOC(=O)CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)Cc1ccccc1O 1460280276 PJGOXTLLHJGNOE-UHFFFAOYSA-N 444.837 4.068 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCO[C@H]1c1cncc(Br)c1 1460980978 FQGGWNJMHGSVTB-RVHYNSKXSA-N 446.389 4.044 10 10 IICE CN(C)[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Cl)cc1 1465952250 YVCVCTVBZPPQRF-FPOVZHCZSA-N 436.383 4.083 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2 1470555107 BBAMBRCAEMBPKG-HMHJJOSWSA-N 444.620 4.223 10 10 IICE CCN(Cc1cccc(Br)c1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1471543387 HXIOREVUYIRRRR-NRFANRHFSA-N 447.421 4.350 10 10 IICE COc1ccc([C@@H](NC(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C2CCC2)cc1 1479470769 ALLXQBLLISIZBV-DEOSSOPVSA-N 439.556 4.085 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@H]2CCSC2)n1Cc1ccc(N2CCSCC2)cc1 1495071636 ILJWAVSEDHYNSI-PXNSSMCTSA-N 431.675 4.335 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@@](=O)CC 1500735418 ZIUFHEDJPOEADO-PMERELPUSA-N 427.618 4.358 10 10 IICE CCc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1525308373 ACRZPHIGEWTYJO-BOPFTXTBSA-N 434.583 4.357 10 10 IICE Cc1cc(CC(=O)N2CCC(N3CCCOC3=O)CC2)c(C)n1-c1ccc(Cl)cc1 1538854275 DOSHZESZHOQMIL-UHFFFAOYSA-N 429.948 4.123 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@H]3C)ccc21 1539334364 LQHJTNZHQQNCTF-CALCHBBNSA-N 443.588 4.374 10 10 IICE COc1cccc2c1CN(C(=O)CCCN1C(=O)/C(=C\c3cccs3)SC1=S)C2 1544482128 VNFPGDSXKRPUPW-WOJGMQOQSA-N 444.603 4.281 10 10 IICE COc1ccc(N2CCN(C(=O)C3(Cc4ccccc4Br)CC3)CC2)cc1 1544744834 LVTIXMASZHPNHM-UHFFFAOYSA-N 429.358 4.129 10 10 IICE COc1ccc(CNC(=O)CCc2cc(Br)c(Br)s2)c(O)c1 1556354890 YBWAGZRIUCSSES-UHFFFAOYSA-N 449.164 4.236 10 10 IICE CCc1ccccc1-n1cnnc1SCC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1557063452 OUKRKKRZNVGBBY-GOSISDBHSA-N 437.613 4.044 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@@H](C(=O)NCc4ccccc4)C3)c2C)c1 1557161233 KRONWBUKZYZCPF-HSZRJFAPSA-N 429.564 4.489 10 10 IICE COc1ccc(-n2cc(CNC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)nn2)cc1 1566293248 XQFXWFKEQJOWCV-UHFFFAOYSA-N 435.915 4.267 10 10 IICE COc1ccc(N2CCN(C(=O)c3cn(-c4ccccc4)nc3C(C)(C)C)CC2)cc1F 1566346477 ACVDWIMKGUHGOX-UHFFFAOYSA-N 436.531 4.280 10 10 IICE COc1cc(Br)ccc1CCCNC(=O)c1cc2cc(O)c(O)cc2s1 1566773118 YXHDMHJSFAPRGY-UHFFFAOYSA-N 436.327 4.446 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(CCNC(C)=O)Cc3ccc(C)s3)c2C)cc1 1567960754 QCYXXALMXZKRTH-UHFFFAOYSA-N 439.581 4.251 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c([N+](=O)[O-])c1 1613370830 XOVHHKGRJKEIOO-UHFFFAOYSA-N 426.400 4.190 10 10 IICE Cc1ccc(/C=C\C(=O)N2C[C@@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)cn1 1617132964 MAPBRNPZTPIXEV-IEODJVTJSA-N 425.504 4.273 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 1618427322 JUKFGYNTMDBTGT-LEWJYISDSA-N 439.512 4.087 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@]3(O)CCN(Cc4ccccc4)C3)c2C)c1 1618657031 BFJJFMODBDWNQX-HHHXNRCGSA-N 431.580 4.078 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1623452454 WFGFANBQRORVNI-AOYPEHQESA-N 435.612 4.030 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1sc2ccc(OC)cc2c1C 1623927999 ADCRQBVQBPODBG-UHFFFAOYSA-N 433.913 4.393 10 10 IICE Cc1cc(C(=O)N2CCn3ncc(Br)c3C2)c(C)n1-c1ccc(Cl)cc1 1632944309 VPMXSVKBEQFCLI-UHFFFAOYSA-N 433.737 4.363 10 10 IICE Cc1cc(S(N)(=O)=O)c(C)cc1NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1634184254 CBQYQPLIHSUJJT-UHFFFAOYSA-N 445.972 4.193 10 10 IICE COC(=O)c1cccc2c1CN(C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)CC2 1637578146 QLIWUFUBONMPND-UHFFFAOYSA-N 431.536 4.457 10 10 IICE CC(C)Oc1cc(Cl)ccc1CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1638087413 HEBCYTHVIJZDSM-UHFFFAOYSA-N 431.964 4.305 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)/C=C\c1ccc(O)c(OCC)c1 1639827475 VSFYPQOJJZYELE-POHAHGRESA-N 440.540 4.193 10 10 IICE CCCO[C@@H]1CCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1644583055 AHTZPFHPEAGZTK-QZTJIDSGSA-N 434.536 4.070 10 10 IICE COc1ccc(N2CCN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])CC2)c(OC)c1 1655779584 IUGRFRYDHLWNRE-UHFFFAOYSA-N 447.491 4.170 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(Cl)cc1 1660293547 BLEONXXNGRXMNS-CALCHBBNSA-N 433.955 4.235 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCCSC[C@@H]3c3ccccc3OC)C2)cc1 1683945387 RUNLQQATAPNKJY-XMSQKQJNSA-N 441.597 4.172 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@]2(C)Cc2ccccc2F)N(C)C)cc1 1684607965 XYPLCQNPLQVWKT-ZCYQVOJMSA-N 426.580 4.301 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCSC1 1726877439 MXBKTLDHZHZEPW-UYAOXDASSA-N 429.634 4.018 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1727986787 KVDJLJUOJWOZJX-QHCPKHFHSA-N 434.588 4.240 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCO[C@@H](C(F)(F)F)C2)cc1 1728380482 BXDISVAUWQXEPY-LJQANCHMSA-N 439.526 4.139 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CCCN(C)C(=O)OC(C)(C)C 1741433713 GAOQZHSKLCBPBV-UHFFFAOYSA-N 431.581 4.076 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cc(C)no1 1747336711 QCZKVOHSYBFENV-UHFFFAOYSA-N 434.544 4.170 10 10 IICE C[C@@H]1CN(c2nnc(-c3cccc(Cl)c3)n2CCCSc2nccs2)CCO1 1763073239 CGDLZWQETZHQMO-CQSZACIVSA-N 436.006 4.463 10 10 IICE CN(C[C@H](O)COCc1ccccc1)c1ccc(CNC(C)(C)C)c(Br)c1 1916344780 OTLIPYGWVXMAJG-FQEVSTJZSA-N 435.406 4.351 10 10 IICE O=C(O)c1nn(Cc2cc(C(F)(F)F)ccc2O)c(C(F)(F)F)c1Br 2079143854 OGHLIDMJMKHIRK-UHFFFAOYSA-N 433.102 4.135 10 10 IICE CC(C)(C)OC(=O)N1CC2(CC(CNCc3cc(Br)cc(F)c3O)C2)C1 2121063247 YXIYPKGISQCPHI-UHFFFAOYSA-N 429.330 4.031 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(Br)cc2I)c1 2207269808 WSCYFYQKUBZLRK-UHFFFAOYSA-N 445.098 4.372 10 10 IICE CCOC(=O)CN1C(=O)SC(=Cc2cc(C)n(-c3cc(Cl)ccc3OC)c2C)C1=O 2297349580 IMJJYDSLCLYZDR-UHFFFAOYSA-N 448.928 4.356 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N([C@@H]2CC(=O)N(c3ccc(C)cc3)C2=O)C1=O 2314832721 MHYXYOUEGHKRLY-LJQANCHMSA-N 448.569 4.475 10 10 IICE CC[C@@H](NC[C@]12C[C@H]1CN(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2332876659 SLQYMFKAPQZWLO-OWZDWXTDSA-N 425.367 4.452 10 10 IICE COc1ccc(/C=C2\C(=O)N(c3ccc(C)cc3)C(=S)N=C2O)cc1Br 33319782 LMHISXYJLXNZJA-ZROIWOOFSA-N 431.311 4.438 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)CC2)cc1 104879962 REUXKQGRMAKBGC-UHFFFAOYSA-N 432.480 4.309 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccc(SC)cc2)cs1 727247426 VHKKRQOXHHCLAH-UHFFFAOYSA-N 438.552 4.329 10 10 IICE CCOC(=O)CCc1ccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 740455960 VERCTDZSJLSZDV-NRFANRHFSA-N 426.513 4.101 10 10 IICE CNC(=O)Cc1nc(COC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)cs1 748491592 KXYVLLIHNMKZGL-UHFFFAOYSA-N 437.525 4.270 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Oc2cccc(N3CCCC3=O)c2)C1 766375304 RXQFBCMKKYTKCR-UHFFFAOYSA-N 431.536 4.140 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1 769279876 FXONQHGUALTPTH-QMMLZNLJSA-N 426.944 4.478 10 10 IICE CCC1(CC)CN(C(=O)c2ccccc2SCc2c(C)noc2C)CCS1(=O)=O 779359583 SKXRYPWUFMRLLL-UHFFFAOYSA-N 436.599 4.013 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 779401778 YCEDBJBLGNKGBT-DQEYMECFSA-N 436.600 4.271 10 10 IICE C[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1cncc(F)c1 782067146 JJPUGBJEPHSMJN-RGZVIEDOSA-N 435.571 4.141 10 10 IICE Cc1ccc(C2CCN(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)CC2)cn1 782999195 KZSLAOVBRZOVKK-OALUTQOASA-N 440.563 4.232 10 10 IICE COc1cc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc(OC)c1O 800702066 IBCNSMOCSFBLJM-OAHLLOKOSA-N 447.963 4.299 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1ccc(Cl)o1 914439098 ABKGNOQZJGMMPP-UKTHLTGXSA-N 426.972 4.292 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3cccc4ccccc34)C2)cc1F 1136729689 LQHGTROFNWFTIO-FQEVSTJZSA-N 433.527 4.494 10 10 IICE Cc1ccc(NC(=O)N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1146576620 QQBBVSZYVJWSMZ-UHFFFAOYSA-N 430.552 4.321 10 10 IICE COc1cc(N2CCN(c3cc(-c4cccc(Cl)c4)ncn3)CC2)cc(OC)c1OC 1163012543 GKKKVTYVWGLHSC-UHFFFAOYSA-N 440.931 4.149 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)Cc3ccccc3C)nc12 1167237407 DSYVKLDLYDWOMJ-UHFFFAOYSA-N 430.508 4.122 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1)[C@@H]1C[C@@H]1C 1218450894 XDUJHHUVXLKCQB-GAJHUEQPSA-N 438.597 4.323 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)[C@@H](O)c3c(Cl)cccc3Cl)C2)cc1 1230857417 AMKABXLYAHJALN-PJSUUKDQSA-N 438.355 4.002 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCC[C@H](C(F)F)C1 1289423504 MDYLTEUJFLXRCR-SFHVURJKSA-N 428.531 4.188 10 10 IICE O=C(CCc1c(Cl)cccc1Cl)NCc1ccc(N2CCC(O)CC2)c(F)c1 1293977124 RIOAFSVMFQRJPO-UHFFFAOYSA-N 425.331 4.343 10 10 IICE CCCN(CCn1c(C2CC2)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1294585180 OWSNSVZRNUJMJV-UHFFFAOYSA-N 429.565 4.145 10 10 IICE CC[C@H](C)c1nc(C)c(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1 1294859487 MRYDWCDCKLOGCS-YWZLYKJASA-N 445.007 4.289 10 10 IICE Cc1cc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)c(C)n1-c1ccccc1Br 1298102550 MDQTUOTUEQFNTC-JOCHJYFZSA-N 430.390 4.415 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)cc1 1300454664 AYDIPGYOQDJEIO-LJQANCHMSA-N 441.453 4.344 10 10 IICE CC(C)(Oc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1301349456 GWCDLXPCCRSYIN-UHFFFAOYSA-N 436.474 4.140 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC([C@H](C)CO)CC2)sc(C)c1-c1ccccc1 1460357850 URLMATFSLTWIIF-MRXNPFEDSA-N 444.597 4.179 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(Nc2nccs2)cc1F 1463780744 YOGLIRIZGYJPOU-UHFFFAOYSA-N 426.517 4.135 10 10 IICE CCCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1469961889 YFIVCBDLHKCMBR-ICSRJNTNSA-N 449.039 4.414 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2c2cccs2)n1Cc1ccc(N(C)C)c(F)c1 1503090874 DLCLHUCBLODIJC-LJQANCHMSA-N 429.565 4.471 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C(F)(F)c2cccc(Br)c2)cc1 1527595907 PNMCJNFRUXNORR-UHFFFAOYSA-N 427.289 4.144 10 10 IICE O=C(CCc1c(Cl)cccc1Cl)NCc1cc(F)c(N2CCOCC2)c(F)c1 1527864447 PCKAFKHBXGRSNH-UHFFFAOYSA-N 429.294 4.357 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Oc3cc([S@@](C)=O)c(C)cc3OC)ccc21 1529581348 LDLHTONVYBDPOU-SSEXGKCCSA-N 429.538 4.178 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1c(F)cccc1F 1534810771 WMCIPLNYUCTUTE-LFIBNONCSA-N 436.480 4.358 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3sc4cccc(F)c4c3Cl)cc2)CC1 1538138482 RVIGTSLYQCYALI-UHFFFAOYSA-N 445.947 4.326 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(/C)c3ccccc3OC(F)F)CC2)c(OC)c1 1543632938 SKUADFRNBWGGCU-PEZBUJJGSA-N 432.467 4.057 10 10 IICE COc1ccc([C@@H]2[C@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC(=O)N2C)cc1 1544246077 HJEHZQBWCANWIC-AOYPEHQESA-N 449.595 4.300 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)N[C@H](C)c2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1564427629 JRPAZZGNZBBDNG-GIWSNZPPSA-N 433.911 4.296 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CO[C@H](CCC(=O)OC(C)(C)C)C3)cc2)CC1 1565663587 IKDNHNFNRUCBAU-RBBKRZOGSA-N 430.589 4.066 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@@H](O)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1566636712 LPKHSIUYVNSAEF-DLBZAZTESA-N 445.279 4.384 10 10 IICE O=C(Cc1csc(COc2ccccc2)n1)N(Cc1ccccc1O)C[C@H]1CCCO1 1566687197 WEVTZPPVIXHVEF-OAQYLSRUSA-N 438.549 4.178 10 10 IICE Cn1nc(C(=O)NCc2ccc(N3CCCCC3)cc2)c(Br)c1C(F)(F)F 1570583169 MCISABIZKRYHEE-UHFFFAOYSA-N 445.283 4.122 10 10 IICE Cc1cc(C(=O)NC[C@@](C)(O)c2ccccc2)c(C)n1-c1ccccc1Br 1586369289 WUHBDZYFYIPELG-JOCHJYFZSA-N 427.342 4.494 10 10 IICE CCN(C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)[C@@H]1CCN(c2ccccc2)C1=O 1616527492 XTRRPELQLSJWGQ-RUZDIDTESA-N 443.547 4.103 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(c4ccccc4Cl)C3=O)c2C)cc1 1617592581 XKIBGLXGZZLHHV-NRFANRHFSA-N 437.927 4.291 10 10 IICE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1630351475 RKLPZYJDAXQSHL-XMMPIXPASA-N 449.661 4.433 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)c1 1631033208 BOQXRKYZNMMHPT-DEOSSOPVSA-N 430.504 4.021 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCc3nc4ccccc4[nH]3)cc2Cl)C1 1634719858 IHXCHKHBOCMBDG-INIZCTEOSA-N 425.964 4.495 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCCSC[C@@H]1c1ccccc1 1635996700 JOWPEFWYPPABNK-OAQYLSRUSA-N 447.551 4.191 10 10 IICE Cc1cc(C(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccn1 1639802356 KNQZQVPXESRMOM-VQIMIIECSA-N 426.561 4.112 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)c(C)n1-c1ccc(Br)cc1 1641855309 WPVIXAQNOUHHRO-INIZCTEOSA-N 446.389 4.233 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NC(=O)CSc2ncc(C(C)(C)C)s2)cc1 1643770680 MUKCKPAGYZKQLB-UHFFFAOYSA-N 441.644 4.202 10 10 IICE C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1655549403 ZBLNXCLJEOHITC-CABCVRRESA-N 443.459 4.048 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H](CCN2CCCC2=O)c2ccccc21 1682097284 PBZFJJAOVWIPFD-IRLDBZIGSA-N 448.611 4.318 10 10 IICE CC(C)(C)O[C@@H]1C[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@@H]1n1cccn1 1682610125 ZWIPZLFKUHRBMJ-NNWRFLSQSA-N 438.528 4.091 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCSC1 1695187042 ANVQMNZMXRJNTB-XMMPIXPASA-N 439.629 4.457 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCCC(C)(C)C 1710647146 OZFKCXVNPATJDE-UHFFFAOYSA-N 429.609 4.114 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728921001 DWEXEZDGXHCENO-PKTZIBPZSA-N 448.615 4.403 10 10 IICE CCOC(=O)N[C@H](CC(C)C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccccc1O 1746565422 BWGVOVFWHVJBAK-HXUWFJFHSA-N 443.592 4.439 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1CC1CCN(CC(F)(F)F)CC1 1747750649 VWWVABILWTVYGN-UHFFFAOYSA-N 437.510 4.162 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3Cc3ccc(C)s3)CC2)cc1F 1748849049 CJOWPHQYJUZGIR-UHFFFAOYSA-N 429.565 4.294 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1749940017 QATPTGOPHSJLDS-AZUAARDMSA-N 443.636 4.297 10 10 IICE CC(C)Cc1nnc(Nc2cnn([C@@H]3CC3(F)F)c2)n1Cc1ccc(N(C)C)c(F)c1 1750764877 WSNFVFHCGJMEKF-GOSISDBHSA-N 433.482 4.250 10 10 IICE C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1(C)C 1752209546 YULMWXMYTDGYPI-LJQANCHMSA-N 425.621 4.333 10 10 IICE CC[C@@H](C)NC(=O)CCn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1762052780 WMUYPAQZLQVTQV-LJQANCHMSA-N 440.636 4.117 10 10 IICE CC(C)c1nnc(N2C[C@@H](C(F)(F)F)O[C@H](C)C2)n1CCCSc1nccs1 1763061326 ZCWZWMHYMPPASZ-OLZOCXBDSA-N 435.541 4.196 10 10 IICE CCN(CC)C1CCN(c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1766643823 FEJVCGCZEQZMRB-UHFFFAOYSA-N 430.616 4.041 10 10 IICE COc1ccc(C(=O)c2ccccc2NS(=O)(=O)c2cc(C)c(OC)cc2C)cc1 1858034817 BLBCPRRTCLDURB-UHFFFAOYSA-N 425.506 4.352 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc4c(c3)c(C)nn4-c3ccc(C)cc3)CC2)cc1 1866396548 IWEMGDOVMKIQQY-UHFFFAOYSA-N 441.535 4.008 10 10 IICE COc1cccc(Cn2nc(C3CC3)c(C(F)(F)F)c2I)c1O 2079834439 JIKRYXKTRYORIG-UHFFFAOYSA-N 438.187 4.146 10 10 IICE O=S(=O)(Nc1ccc(O)cc1Cl)c1cc(Br)ccc1Br 70334312 AEJHHFKERKEBJK-UHFFFAOYSA-N 441.528 4.371 10 10 IICE COc1ccc(-c2nn(CN3CCCN(c4ccc(OC)cc4)CC3)c(=S)o2)cc1 108226020 AQDJKPKQRABPFL-UHFFFAOYSA-N 426.542 4.060 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C(\C)NCCCOC(C)C)cc1 205960968 ZSIFBKCFEJHRML-PTGBLXJZSA-N 437.540 4.133 10 10 IICE CC(C)c1ccc(OC[C@@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 256038578 PXFXXUAWMHLLQR-AZGAKELHSA-N 426.601 4.297 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3cccc(F)c3)[C@H]2c2ccc(O)c(O)c2)c1 526151241 NYDJXVZYLDGJMQ-QFIPXVFZSA-N 437.423 4.311 10 10 IICE CO[C@@H](C)c1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 726932473 QACUTPRZXZGEDY-ZDUSSCGKSA-N 430.416 4.330 10 10 IICE C[C@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1cccnc1 742754945 SETJLVSRAOBJON-UTKZUKDTSA-N 426.561 4.023 10 10 IICE COC(=O)N(C)c1ccccc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 746583906 HSZJZPCUFXDSRX-UHFFFAOYSA-N 438.455 4.476 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](CN[C@H](C)c3cc(Br)ccc3O)C2)c1 756649403 GTXYULLVHFUISI-CABCVRRESA-N 435.362 4.349 10 10 IICE Cc1cc(C(=O)CS(=O)(=O)Cc2cncn2Cc2ccccc2)c(C)n1-c1ccccc1 782219563 SGXGJKREDHRLJG-UHFFFAOYSA-N 447.560 4.137 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(CCc2ccco2)n1C[C@@H]1CCCO1 802681784 OZLCGZBENNJZHE-DEOSSOPVSA-N 449.599 4.462 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)Nc1ccnn1C1CCCCC1)c2[N+](=O)[O-] 822031600 VIBDRHXMNXYKIF-UHFFFAOYSA-N 444.447 4.324 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(c2ccc(Br)cn2)CC1 917514398 HTGNLVYKUCXPJT-UHFFFAOYSA-N 445.386 4.276 10 10 IICE O=C(N[C@H](c1ccccc1)c1c(O)ccc2ccccc12)c1cnc2sccn2c1=O 1087443205 NIDHHATVVLDPCD-OAQYLSRUSA-N 427.485 4.134 10 10 IICE CC[C@@H](C)c1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 1125313578 WIZDVDVGLWGVJK-LJQANCHMSA-N 447.558 4.386 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)N(C)CCN(C)c1ccc(OC)cc1 1130745504 YWZUBOQDTZXHSI-UHFFFAOYSA-N 432.520 4.357 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](COC(C)C)C2)c(C)n1-c1ccc(Br)cc1 1138367753 AKTRNOLZCULHLJ-LJQANCHMSA-N 435.362 4.123 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])cc1 1142712427 AETCKKKEMGYFCP-IBGZPJMESA-N 445.947 4.455 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C/C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1142847575 TZSVKRUXHMQCHM-KVDXNUTJSA-N 427.589 4.496 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c2C)cc1 1166576132 DPSRRDGZNYLLDS-UHFFFAOYSA-N 429.561 4.478 10 10 IICE CN1CCC[C@H](c2cccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)c2)C1 1182262153 SAJNCAXWZNYBBO-AZGAKELHSA-N 435.612 4.383 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ncn(-c4ccccc4)n3)cc2Cl)C1 1227208961 RAYAQAVWGVBSOD-KRWDZBQOSA-N 438.963 4.156 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCC[C@H](N(C)C)C(F)(F)F)cc2Cl)C1 1227209814 WRODJFQCWUNMFR-KSSFIOAISA-N 434.934 4.258 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1251685758 JCYFLCRRMUVNAF-BWKNWUBXSA-N 442.604 4.360 10 10 IICE COc1ccc(CN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(OC)c1 1264192416 WQOMRVOJNRRWPF-UHFFFAOYSA-N 435.568 4.084 10 10 IICE COc1ccc(N2CCC(NC(=O)C(F)(F)c3ccc(Br)cc3)CC2)cc1 1264933592 AQTDITCEJQLGND-UHFFFAOYSA-N 439.300 4.335 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N[C@H](c1cccc(F)c1)c1cccc(Br)c1 1294755110 BIMZMMWWCSJUHI-NRFANRHFSA-N 430.273 4.448 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H]2CCOC2)c(C)n1-c1ccccc1Br 1304201350 ZWESKFUFJGDGTP-MSOLQXFVSA-N 447.373 4.124 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)sc(C)c1-c1ccccc1 1307996545 JYBPRDZIGLUMBT-ZYKFEASCSA-N 430.570 4.240 10 10 IICE O=C(C[C@H]1CSc2ccccc2O1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354767415 NZAYCRVZHRVRIY-YJBOKZPZSA-N 434.508 4.316 10 10 IICE Cc1cc(C)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(C)n1 1356366732 XENAWZXLTNMEMC-BOPFTXTBSA-N 429.542 4.376 10 10 IICE O=C(CSCc1cccc(Cl)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1356421310 NAQZQALCIYBWDZ-UHFFFAOYSA-N 444.044 4.422 10 10 IICE COc1ccc(C[C@@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1444908009 OMGWGXCOXCYSSP-QGZVFWFLSA-N 434.536 4.214 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4c(OC(F)(F)F)cccc4[nH]3)C2)cc1 1452028796 NGMPBXZHPOWMIP-CQSZACIVSA-N 433.430 4.331 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1452525157 SVAUEFQCDRNHFV-ZACQAIPSSA-N 448.405 4.084 10 10 IICE O=C(COC(c1ccccc1)c1ccccc1)NCc1ccc(N2CCC(O)CC2)cc1 1453983889 OBQIFNQFIRHMFR-UHFFFAOYSA-N 430.548 4.070 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCOc1ccccc1C(=O)OC 1458856032 JQCKGAXHPRWYIC-UHFFFAOYSA-N 440.521 4.299 10 10 IICE Cc1cccc([C@@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1C 1459860226 MFDFXBSRKWNFOQ-WSTZPKSXSA-N 427.564 4.023 10 10 IICE CC(C)(C)c1ccc2[nH]c(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)cc2c1 1471911991 IVMIWQVZSGKIJV-UHFFFAOYSA-N 432.568 4.097 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]3CCC[C@@H]32)n1Cc1ccc(N(C)C)c(F)c1 1519302273 GDJLPZULUPCJEP-LMNJBCLMSA-N 445.583 4.024 10 10 IICE COc1ncc(/C=C\C(=O)N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)cn1 1530686292 KEVORWGJBXZTKH-VQDMZCOGSA-N 429.476 4.016 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c(C)n1-c1ccccc1 1534543301 SBKJCGJHKCQTBR-QFIPXVFZSA-N 449.982 4.455 10 10 IICE CC(=O)c1ccc(F)cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1536675748 YUVPENDSAWKBHR-ZDLGFXPLSA-N 446.500 4.397 10 10 IICE CCOC(=O)CN(CCc1ccccc1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1542899332 YUPSZRPPVYJRCI-UHFFFAOYSA-N 446.547 4.463 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)c1 1542917243 CLADVOOXWRWBLH-QHCPKHFHSA-N 429.564 4.201 10 10 IICE Cc1cccc(C(=O)N2CCCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c1 1543269432 ASLRIEDBTFNORQ-UHFFFAOYSA-N 443.547 4.203 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1C 1543448681 UEYNWGZPOODLDP-UHFFFAOYSA-N 437.565 4.343 10 10 IICE COc1ccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c(S(C)(=O)=O)c1 1543605065 HTUWFQBJXRQFOP-UHFFFAOYSA-N 446.956 4.341 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](C)N3C(=O)c4ccc(C)cc4C3=O)c2C)c1 1544080077 JWPSAWWODWREID-LJQANCHMSA-N 429.520 4.012 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCO[C@H](C)C1 1555510247 FXQRIOIPBPETJO-TZIWHRDSSA-N 437.588 4.250 10 10 IICE COc1cc(OC)cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 1566842993 GRGPCFQWROXKDW-UHFFFAOYSA-N 445.563 4.321 10 10 IICE CCn1c(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cnc1Br 1568142199 OYDBLMNOBYUBMB-ZDUSSCGKSA-N 439.785 4.485 10 10 IICE Cc1cccc(CNC(=O)c2ccc(C(=O)NCCCSc3nccs3)cc2)c1 1585222752 QEFRSTTVRYKRDW-UHFFFAOYSA-N 425.579 4.294 10 10 IICE C[C@@H]1CCC[C@H](C2CN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)C1 1587787120 FFHXBCHNMIABDW-CABCVRRESA-N 434.583 4.153 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cc(Br)nc(Br)c1 1595436027 PYBZPOOQTNUKTO-UHFFFAOYSA-N 439.151 4.137 10 10 IICE Cc1ccc(C(=O)c2ccccc2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1603554540 GCBHOFRSYDEMJS-VWLOTQADSA-N 429.564 4.325 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3c(C)[nH]c4ccc(Cl)cc34)cc2F)CC1 1627360633 NGBSTVUTKCDKMV-UHFFFAOYSA-N 428.939 4.341 10 10 IICE Cc1cc(C(=O)NC[C@H]2CS(=O)(=O)c3ccccc32)c(C)n1-c1ccc(Cl)cc1 1628284655 MWAAVHLYDOASBL-INIZCTEOSA-N 428.941 4.048 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1csc(CNC(=O)OC(C)(C)C)n1 1630710194 VYOUXQWHBQHGDN-UHFFFAOYSA-N 446.617 4.214 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccn(-c4ccccc4C(F)(F)F)n3)CC2)cc1 1630992733 UUKQKPRXCKJLMK-UHFFFAOYSA-N 444.457 4.252 10 10 IICE Cc1cc(C(=O)N(C)CCN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1634673112 AQULNKLRMNDRNW-CALCHBBNSA-N 448.405 4.038 10 10 IICE Cc1cc(C(=O)N2CCC(c3ncon3)CC2)c(C)n1-c1ccccc1Br 1635311812 LPIIUAZXLXPLFS-UHFFFAOYSA-N 429.318 4.259 10 10 IICE CCN(C(=O)NCc1cc(C)n(-c2ccccc2)c1C)[C@H]1CCN(c2ccccc2)C1=O 1637581287 IXIUXSDJCNCOLP-DEOSSOPVSA-N 430.552 4.431 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)[C@@H]1Oc1ccccc1 1639222164 PAKJWKITAXKOBE-GVAUOCQISA-N 434.536 4.458 10 10 IICE Cc1ccc(CN2CCCN(C(=O)CN(Cc3ccc(N(C)C)cc3)C(C)C)CC2)cc1 1641554067 BWFPFTKJGAXGPS-UHFFFAOYSA-N 436.644 4.006 10 10 IICE COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N[C@@H](C)c2ccccc2O)cc1 1644182898 AFDHRCQRYDWBHO-IRXDYDNUSA-N 433.508 4.331 10 10 IICE C[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)c1ccccc1O 1648889555 BCTJGOJKFOQWJU-GFCCVEGCSA-N 436.942 4.399 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@@H](C)C(=O)OCC)sc(C)c1-c1ccccc1 1653194181 HWHXQTYITVHXMG-HUUCEWRRSA-N 446.569 4.016 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CS[C@@H](C)C(=O)NCC(=O)OC(C)C)c2C)c1 1656632195 FRYVULRMNFPBFI-IBGZPJMESA-N 444.597 4.083 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H]2[C@H](CCN2C(=O)OC(C)(C)C)C1 1683424804 JATPSODJXDOUTC-CZTZKLFOSA-N 444.620 4.033 10 10 IICE COCC[C@H]1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C1 1697954791 NBVJGRZOTQJHSC-QGZVFWFLSA-N 429.615 4.447 10 10 IICE CCC(CC)(Cn1c(Cc2cn3ccccc3n2)nnc1N(C)Cc1ccccc1O)OC 1708680298 IUZCQFLSGGDROU-UHFFFAOYSA-N 448.571 4.064 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CCO1 1709553983 IYIGNZQSKOFSIB-JOCHJYFZSA-N 434.588 4.077 10 10 IICE CCN1CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C[C@H]1C 1710281850 FMFJLFVADSYOPI-JOCHJYFZSA-N 438.664 4.292 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC[C@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742706027 RSRVXASPILIGBU-SFHVURJKSA-N 435.620 4.189 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC1(OC)CCC1 1743724601 IRTWLVHAEHENPM-HXUWFJFHSA-N 441.620 4.476 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1747750180 NSLOEGHMDPKLHU-KRWDZBQOSA-N 441.576 4.145 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1conc1COC 1763499187 LYZUSLKZNMGFGD-SFHVURJKSA-N 438.576 4.211 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)CS(C)(=O)=O 1764107772 RUZKYJVJMDAJLA-GOSISDBHSA-N 443.617 4.022 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2ccc(C(C)(C)C)cc2)N2CCOCC2)cc1 1858074604 NRJYXAPVNBWBTI-VWLOTQADSA-N 437.628 4.172 10 10 IICE O=C1C(=Cc2ccc(Cl)cc2Cl)SC(=S)N1N1C(=O)[C@H]2CCCC[C@@H]2C1=O 2040742036 FBHINWQNCQTZNB-RYUDHWBXSA-N 441.361 4.285 10 10 IICE C[C@H]1C[C@@](CN)(N(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)CN1Cc1ccccc1 2074363417 DLOOKSOZJSCXIK-FNZWTVRRSA-N 438.616 4.139 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C(F)F)c(C(=O)O)c2I)cc1C 2080047518 GBZHORQOLSXKKT-MRVPVSSYSA-N 436.196 4.055 10 10 IICE CCc1nn(C)c(CN(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)c1Br 2174629826 QJIZRZMEKLPGOQ-UHFFFAOYSA-N 437.382 4.406 10 10 IICE NCc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(F)c1Br 2186715614 NTZMFLDUPRQTTA-MRXNPFEDSA-N 446.286 4.300 10 10 IICE CCCn1cc(C=C2C(=O)NC(=S)N(c3ccc(OCC)cc3)C2=O)c2ccccc21 2296930504 KNEYOYRNLNUWIF-UHFFFAOYSA-N 433.533 4.281 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(OCc3ccccc3)cc2)SC1=S)c1ccncc1 2314735961 LVVXSUDJCQGHQR-UHFFFAOYSA-N 447.541 4.207 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2ccc(OCc3ccccc3C)cc2)SC1=S 2314769656 TYASPIUKMDPMBK-UHFFFAOYSA-N 427.547 4.338 10 10 IICE COc1cc(N2C(=O)C(=Cc3cc(Cl)ccc3O)SC2=S)cc(OC)c1OC 2321740053 GIGWHYYACPKGDX-UHFFFAOYSA-N 437.926 4.477 10 10 IICE Cc1ccc(CN[C@@]23CCC[C@@]2(F)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2380791533 AFAZWLZRUBPCGW-WOJBJXKFSA-N 443.357 4.434 10 10 IICE CC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)SC1=S 2701010 BSNTVMXKBADNQE-LWLPBDFMSA-N 432.479 4.228 10 10 IICE CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C\NC(=O)Nc1cccc(C)c1C 13633588 HMDNLXOXDYFDMN-BOPFTXTBSA-N 427.302 4.494 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(Br)cc3C)C(=S)N=C2O)ccc1O 38173665 WYYUODPEGJJXHP-JYRVWZFOSA-N 447.310 4.143 10 10 IICE COc1ccccc1-n1c(C)cc(/C=C2\C(=N)N3C(SC)=NSC3=NC2=O)c1C 96450555 GMFFWAORMYPEQR-VRENQZFPSA-N 425.539 4.042 10 10 IICE NC(=O)c1ccccc1NC1=NC(=O)/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)S1 208335230 HFNDJFHIGAHMHW-WQRHYEAKSA-N 434.433 4.036 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 759658113 DMZACCPKZFKGLB-AZUAARDMSA-N 432.362 4.132 10 10 IICE COc1cc(Cl)cc(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1O 761216921 ZQUOXFQVUWUQCE-ZDUSSCGKSA-N 436.261 4.490 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)C1 767563299 UBTTULIADSJMRG-MUUNZHRXSA-N 445.607 4.380 10 10 IICE COc1cc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc(OC)c1C(C)C 779142985 BKDKLDAYUPBFQY-UHFFFAOYSA-N 441.572 4.358 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1F 799926152 XREMZLCTAWMMKC-LJQANCHMSA-N 427.568 4.294 10 10 IICE COCCOc1c(Cl)cccc1NC(=O)NCc1cc(Br)ccc1O 806233000 KPUCPVJUZHTFDX-UHFFFAOYSA-N 429.698 4.155 10 10 IICE Cc1nc([C@H]2CCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1124951519 IAFKZTQPGJESHU-SFHVURJKSA-N 425.554 4.457 10 10 IICE O=C(NCc1cc(Cl)ccc1O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1 1146232926 NSBCIFVLDPEPFM-UHFFFAOYSA-N 428.337 4.102 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@H](C)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1146950107 JEBFHZMODZDMCQ-UFYCRDLUSA-N 445.604 4.063 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3cc(Br)cnc3OC)ccc21 1147676089 IZNJPLRGTRVPRT-UHFFFAOYSA-N 446.345 4.001 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCCC23OCCO3)c(C)n1-c1cccc(Br)c1 1152019969 AVUADXHYUCOBCW-LJQANCHMSA-N 433.346 4.272 10 10 IICE Cc1cc(C(=O)N2[C@H](C)CN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]2C)c(C)n1-c1ccccn1 1162925906 LEMPEQLNYRUVSW-FGTMMUONSA-N 426.561 4.348 10 10 IICE COC(=O)c1cccc2c1CN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)CC2 1233973632 JBMWOQWBNSPQJI-UHFFFAOYSA-N 431.536 4.191 10 10 IICE CCc1cc2c(CC(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)csc2s1 1264737250 VERDAILFSPFLGA-MRXNPFEDSA-N 441.622 4.086 10 10 IICE Cc1csc(CN(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)c1 1290337128 QVBNUJQDALLYQM-LJQANCHMSA-N 425.602 4.211 10 10 IICE CCC1CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1293488630 SJWJTVZKWJWHJI-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1294457528 NGEDNRLDWXPLPZ-PZJWPPBQSA-N 426.653 4.382 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)cc1 1294465227 XKTFUKWONNMFJI-GOSISDBHSA-N 442.519 4.300 10 10 IICE Cc1cc(C(=O)NCC(C)(C)c2ccncc2)c(C)n1-c1ccc(Br)cn1 1295214456 PLZYCNHQSWHGPR-UHFFFAOYSA-N 427.346 4.354 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1297371877 OSHQDUNLRFYNDD-KRWDZBQOSA-N 444.630 4.232 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c1 1299697615 HDKRTNRPXWYFAT-FGZHOGPDSA-N 439.556 4.472 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CC[C@@H](F)C3)CC2)cc1 1300247254 KHTIVYBTSMOZHT-VQTJNVASSA-N 429.584 4.340 10 10 IICE COCC1(CCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCCC1 1301116514 OFSAQOLVUWWARB-NRFANRHFSA-N 428.577 4.459 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2CC(C)(C)C(F)(F)F)n1 1304741247 FQAOHYKDMOTEFL-UHFFFAOYSA-N 436.482 4.070 10 10 IICE CCCCCc1nnc(NC(=O)CN(CC)Cc2cc(Br)ccc2O)s1 1307498913 JMYALFUVLPUVFQ-UHFFFAOYSA-N 441.395 4.200 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(NC(=O)OC(C)(C)C)Cc2ccccc2C1 1352615324 MRCNJOPFOUQOMK-UHFFFAOYSA-N 449.595 4.308 10 10 IICE CCC1(CC)[C@@H](OC)C[C@@H]1N(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357356068 LCVFGMDEVDWHBD-ZEQRLZLVSA-N 425.617 4.460 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)N2CC3(CCCC3)c3cc(Br)ccc32)c1 1435512509 DNCUUBRZPWMKID-DAXSKMNVSA-N 440.341 4.076 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(C(=O)N4CCCC4)C3)cc2Cl)C1 1436047043 JBDWSARENLJMJQ-AZUAARDMSA-N 447.023 4.120 10 10 IICE Cc1cccc2c1C[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N2C(=O)OC(C)(C)C 1442473164 JHJHSGPUYBZFTK-OAQYLSRUSA-N 427.520 4.183 10 10 IICE O=C(CCC(=O)c1ccc2c(c1)CCC2)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1465951558 NLFGDBNKZBAEAK-JOCHJYFZSA-N 440.971 4.278 10 10 IICE CCCN(C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)[C@H](C)C(=O)OCC 1467578092 KPMSEKMVHYDKMS-OAHLLOKOSA-N 436.350 4.055 10 10 IICE COC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1469958826 HOOYWBLMZJOVBB-MRXNPFEDSA-N 429.948 4.362 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCc2c(Cl)cccc2OC(F)F)N(C)C)cc1 1471091897 QQDIPTQZXHQOBX-SFHVURJKSA-N 440.922 4.110 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](CCO)c1cccc(C(F)(F)F)c1 1478840352 AMAPQWMRUYPIMS-KKSFZXQISA-N 437.506 4.434 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC[C@H](OCC4CC4)C3)nnc2C(C)(C)C)cc1F 1503394242 QFDCGRJSZOTQNU-IBGZPJMESA-N 429.584 4.224 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCCC2(C)C)nnc1[C@@]1(OC(C)C)CCOC1 1510679749 FJEGIRMTCPTMLX-RUZDIDTESA-N 441.620 4.120 10 10 IICE COCCN(C)c1nnc(-c2ccc3ccccc3n2)n1CCCSc1nccs1 1519100511 XCIKWXRDYZCBLP-UHFFFAOYSA-N 440.598 4.215 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc34)cc2Cl)C1 1519550131 GPDCERVHHHHMFX-CYBMUJFWSA-N 427.892 4.291 10 10 IICE CC1(C)COc2ccc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cc21 1525805588 HHRXQFYWHWCXJD-UHFFFAOYSA-N 434.458 4.142 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(-c4cccc(Cl)c4F)no3)C2)cc1 1526246560 OGUCGONUNRFRPJ-CQSZACIVSA-N 429.879 4.399 10 10 IICE C[C@@H](Cc1cnc2ccccc2n1)C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1530325016 LBFPEKIAFSNKHZ-INIZCTEOSA-N 430.474 4.466 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCCC(F)(F)CC1 1532338063 PXXKXTHBVZSTAN-NTCAYCPXSA-N 428.501 4.065 10 10 IICE Cc1ccc(Cl)c(O[C@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1533992065 JNKVZGFJNZUAGH-LJQANCHMSA-N 442.003 4.264 10 10 IICE Cc1cccc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1C 1543316525 FOMZPOFCOGGFHL-HNNXBMFYSA-N 430.551 4.362 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@H](O)C(F)(F)F)c(C)n1-c1ccccc1Br 1545995923 BOICIJVYMSLROW-IRXDYDNUSA-N 445.279 4.384 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)COc1ccccc1-c1ccccc1 1546152156 VHOFONVOAGXPFP-UHFFFAOYSA-N 439.895 4.293 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(=O)(=O)C(C)(C)C 1547324084 HHZUTIPDBSRPLI-UHFFFAOYSA-N 443.617 4.022 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1O 1557063671 VRTJEPFHFXKSBQ-INIZCTEOSA-N 427.545 4.475 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C2CC2)cc1 1564378596 QMVIYHREQLGPAW-MRXNPFEDSA-N 444.938 4.025 10 10 IICE CCOc1ccc(Cl)cc1CCNC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1564381384 RBWSPLWOKIILOX-QGZVFWFLSA-N 431.964 4.116 10 10 IICE CC[C@@H]1[C@@H](NC(=O)N(C)Cc2ccc(N(CC)CC)cc2)CCN1C(=O)OC(C)(C)C 1565092039 HARZFOVBYJOEKL-LEWJYISDSA-N 432.609 4.462 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)cc1 1583919900 TYDLZCCAQBARIN-FQEVSTJZSA-N 448.523 4.218 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1 1585585358 QYWDLTWNGDAXSS-IBGZPJMESA-N 439.556 4.284 10 10 IICE CCOC(=O)N[C@H]1CCCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1596063226 OVLOJUXAULMOMH-KRWDZBQOSA-N 448.361 4.207 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1598121717 WLDQBBJXRDCRRN-ROUUACIJSA-N 429.521 4.243 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CC1CCN(CC(F)(F)F)CC1 1603309726 HAOSNVBWNPEFGM-UHFFFAOYSA-N 439.526 4.093 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC(=O)NC(C)(C)C)n1Cc1ccc(N(CC)CC)cc1 1613158986 HFXWRLVHBKXRBL-GOSISDBHSA-N 428.625 4.037 10 10 IICE COc1cc(C)c([C@H](C)NC(=O)CN(C)c2ccc(-c3nccs3)cc2)cc1OC 1618415151 FZGPVVZZWITPLN-INIZCTEOSA-N 425.554 4.449 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CCc3cccs3)CC2)cc1F 1619302695 YNCRXUSNCSTJHN-UHFFFAOYSA-N 443.592 4.255 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c(C)n1-c1cccc(Br)c1 1634690515 ZPHOLRTZUPCQRB-LBUQITIBSA-N 447.373 4.265 10 10 IICE COc1ccc(N2CCN([C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)CC2)cc1F 1657763508 JHDOSGRIJBOZOV-LJQANCHMSA-N 438.330 4.069 10 10 IICE CCc1ccccc1[C@H](CNC(=O)NCc1ccc(OC)cc1O)NC(=O)OC(C)(C)C 1683069278 VJYHLIBIKSRCSV-FQEVSTJZSA-N 443.544 4.028 10 10 IICE COc1ccc(C)cc1CN1CCN(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1 1683307412 FXKBXKRHKLDTDW-UHFFFAOYSA-N 446.595 4.439 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@@H](c4ccc(F)cc4Cl)C3)C2)cc1 1683339856 IATWEZAYSQLTSM-KSFYIVLOSA-N 447.938 4.097 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@@H](O)c3ccc(Cl)c(Cl)c3)C2)cc1 1683944842 LJDVXOWCFWZJMN-FOIQADDNSA-N 438.355 4.004 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)CCCNC(=O)OC(C)(C)C)c2C)c1 1687286442 IGYSUBYLVGEDRY-UHFFFAOYSA-N 428.577 4.459 10 10 IICE CC[C@]1(C)CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1694447991 RMKYHKPTGRHDAV-AREMUKBSSA-N 439.648 4.360 10 10 IICE CCCCCN(c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)c(F)c1)C(C)C 1695168711 CGGRLPWHTKIWRX-UHFFFAOYSA-N 425.556 4.394 10 10 IICE C[C@H](CC#N)N(C)c1nnc(-c2ccc(Cl)nc2)n1CCCSc1nccs1 1706744056 OMTFCJIZLDJGRD-CYBMUJFWSA-N 433.994 4.371 10 10 IICE CC/C=C\Cn1c([C@H]2OCC[C@H]2COC)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709407117 OBHOOYJFQWVUID-YACUODEUSA-N 439.604 4.205 10 10 IICE CCOCc1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1710678101 ZVLMKTVUMOHILY-IBGZPJMESA-N 443.661 4.289 10 10 IICE CN(CC1CCCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1711145888 ITMORCRGWPJNAP-UHFFFAOYSA-N 439.648 4.459 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCO[C@](C)(C(C)(C)C)C1 1761698349 VSQWACYEVXKQGL-SANMLTNESA-N 448.615 4.404 10 10 IICE CCCC(=O)NC1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)cc2C)CC1 1763683475 YRLSGSMPKDFPSY-SFHVURJKSA-N 440.636 4.099 10 10 IICE Cc1c(CC(=O)NCCc2ccc(O)c(O)c2)c(=O)oc2cc3occ(C(C)(C)C)c3cc12 1860272324 CHPLTUXDLSLWGM-UHFFFAOYSA-N 449.503 4.458 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCCCNC(=O)C(C)(C)C)N2CCCCC2)cc1 1866168529 GTTLHAMCHUFVIL-QHCPKHFHSA-N 444.664 4.119 10 10 IICE O=C(Cc1ccc(Br)cc1[N+](=O)[O-])NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1890551812 DHPHBCWLFWBUHE-KXBFYZLASA-N 444.329 4.205 10 10 IICE CSc1ccc(C=C2SC(=O)N(CCNC(=O)[C@H](C)Oc3ccccc3)C2=O)cc1 2042444237 LAIZZRNTNNHQCR-HNNXBMFYSA-N 442.562 4.029 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@H](C)C(C)(C)O)c(Br)c1 2169925545 SXWWXOWOHOUPRN-QGZVFWFLSA-N 435.406 4.351 10 10 IICE CCOc1ccccc1C=C1C(=O)NC(=O)N(c2cc(C(F)(F)F)ccc2Cl)C1=O 2297335140 AQWAYIOQTWSKJM-UHFFFAOYSA-N 438.789 4.424 10 10 IICE Cc1cccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc(O)cc3O)SC2=S)c1 15039288 YENCVQKQAZVRJH-WQRHYEAKSA-N 428.535 4.026 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc(C(F)(F)F)nc2)c(C)n1-c1ccc2c(c1)OCO2 26435594 FQZOVXHPGXAGIH-UHFFFAOYSA-N 446.381 4.276 10 10 IICE CCOc1cc(/C=C2\C(=O)N(C)C(=S)N=C2O)ccc1OCc1ccccc1Cl 33656572 WBPOVCBKHUNFIL-GDNBJRDFSA-N 430.913 4.415 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1nc2ccc(F)cc2s1 39874952 NFQAWZITZKRGOJ-CHHVJCJISA-N 447.513 4.414 10 10 IICE COc1cc(/C=C2/C(=O)N(c3cccc(C(=O)O)c3)N=C2C)ccc1OC(=O)c1ccco1 103783705 LRORSTFUAHXCFD-WOJGMQOQSA-N 446.415 4.012 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccccc1 210710961 CQIMTRHNBFSVSO-GHRIWEEISA-N 427.507 4.215 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(OC)c4cc(Br)oc4c3)CC2)cc1 223643565 QDKFHJLZWRCZJY-UHFFFAOYSA-N 445.313 4.175 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3cccc(C)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526324284 YFLPRZMBEQAXBM-HSZRJFAPSA-N 433.460 4.481 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(OC)cc3OC)[C@H]2c2ccc(O)c(O)c2)c1 526329231 VNVDBTHWVGAKKW-QHCPKHFHSA-N 449.459 4.181 10 10 IICE Oc1c(F)cc(Br)cc1[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCNCC1 575283680 HHRWMFHNBQWTIJ-MRXNPFEDSA-N 449.242 4.187 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)NCc1ccc(N2CCOCC2)cc1 727756154 RUUGYDOJKRHDGS-XFXZXTDPSA-N 431.536 4.190 10 10 IICE Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 745647075 IMFLQMZZRZHJBP-ZHRRBRCNSA-N 429.536 4.371 10 10 IICE COc1cc(C)c(Br)cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 747857289 LSKZHYOGVARWHF-UHFFFAOYSA-N 440.344 4.085 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3F)cs2)cc1Cl 749747588 VVIKAYRBFSRFCO-UHFFFAOYSA-N 426.878 4.190 10 10 IICE CN1CC[C@@H](NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H]1c1ccccc1 758968977 ZOMGWGJPWRMRFS-YADHBBJMSA-N 444.526 4.001 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc2c(ccn2Cc2ccccc2)c1 761600883 VWPZVAQLNFPHKD-UHFFFAOYSA-N 425.532 4.456 10 10 IICE O=C1/C(=C/c2nc3ccc(Br)cc3s2)SC(=S)N1Cc1ccon1 772180535 ZFGOMLHDMWVAOY-SDQBBNPISA-N 438.353 4.448 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 781680486 RHJUWNMIABTUIF-QRBZPYHOSA-N 436.386 4.378 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1nc2ccc(F)cc2[nH]1 785875908 JLBNIGZQSOZLKW-GDNBJRDFSA-N 446.554 4.384 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2c2nnc(CC(F)(F)F)o2)c(C)n1-c1ccccn1 811558721 QCGGBNCTDVQINZ-MRXNPFEDSA-N 433.434 4.344 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCc2cc(F)c(F)cc21 916631064 BBNSIAXVXAUIBB-UHFFFAOYSA-N 441.400 4.093 10 10 IICE Cc1cc(-c2csc(NC(=O)Cc3ccc(C(N)=O)nc3)n2)c(C)n1-c1ccc(F)cc1 1124853602 VKLHKPVVZQDPSG-UHFFFAOYSA-N 449.511 4.032 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)c(Br)cc3C)CC2)c(OC)c1 1132032332 SFTQKFWHKCZGTO-UHFFFAOYSA-N 433.346 4.046 10 10 IICE CCCN(CCNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)C(=O)OC(C)(C)C 1137927531 FFRAXNWUTQJSDS-UHFFFAOYSA-N 431.577 4.281 10 10 IICE CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1142782646 MRTXMZVZPZYUNO-RBUKOAKNSA-N 439.600 4.072 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(-c3cccnc3)nn2C)cc1 1144711146 IGZDWRVQPWWSNL-UHFFFAOYSA-N 441.535 4.404 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1147366505 CLXFBRLDCOSZKQ-JOCHJYFZSA-N 449.938 4.404 10 10 IICE C[C@H](Oc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cn1)c1ccccc1 1148701251 PSYAQVRTNXSTRX-IBGZPJMESA-N 431.536 4.113 10 10 IICE Cc1ccc(C(=O)N2C[C@H](C)N(CC(F)(F)F)[C@H](C)C2)cc1-n1c(C)cc(C=O)c1C 1158452467 HLTIEQAMVLGBHX-CALCHBBNSA-N 435.490 4.312 10 10 IICE CC[C@](CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)(C(=O)OC)c1ccccc1 1161599739 CIGKMQPMTAXHQR-HHHXNRCGSA-N 446.547 4.086 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)C[C@@H]1CCCC(=O)N1 1182481671 KAKPREPRZZEFGD-QFBILLFUSA-N 433.474 4.357 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccnc(Oc4ccccc4F)c3)C2)cc1 1227677108 QSQJUMVZTPKJJA-SFHVURJKSA-N 436.487 4.100 10 10 IICE Cc1cc(CCNC(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1233973686 JYMFGICQGXGRCA-KRWDZBQOSA-N 428.577 4.191 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCCO1 1305185660 NFGXMDRZTSUOII-IBGZPJMESA-N 443.661 4.083 10 10 IICE CCOc1ccc(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1347710630 RIVNAWVRRBHCGF-AQTBWJFISA-N 431.510 4.421 10 10 IICE COc1cccc(OCCCNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1360515229 AQOCGLTUQYGMSC-UHFFFAOYSA-N 435.568 4.002 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3[C@H](C)OC(C)(C)N3C(=O)OC(C)(C)C)cc2)CC1 1443669953 ZONFIYDEQDSDAA-RXVVDRJESA-N 445.604 4.300 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CC[C@@H](Nc2ccccn2)CC1 1444993311 ZPMQJLDYHZSVQM-CEXWTWQISA-N 444.526 4.439 10 10 IICE COc1ccc([C@@H](CN(C)C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1449330375 HIAGARLYOPJCLC-XMMPIXPASA-N 433.552 4.256 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C[C@@H]2NC(=O)c3ccccc32)cc1 1465014035 XAMOMBJRNUFQFL-DEOSSOPVSA-N 429.520 4.169 10 10 IICE COc1cc(NC(=O)CNC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc(OC)c1 1465657177 WRDCJRFHKNFYCH-UHFFFAOYSA-N 435.524 4.097 10 10 IICE Cc1cc(C(=O)N[C@H](C)C[C@@H](O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1465805636 OTDHYUKKAGGQHS-JLTOFOAXSA-N 442.357 4.494 10 10 IICE CC[C@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@@H](O)c1c(F)cccc1F 1465917564 DLEQFGKNLMVNLK-NZQKXSOJSA-N 430.495 4.425 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1 1469104251 OPULWNUXCUYDLU-UYAOXDASSA-N 440.563 4.191 10 10 IICE CCOc1ccc(CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C(C)C)cc1 1470449061 GUGVZWNYMMXJLE-UHFFFAOYSA-N 447.526 4.320 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccc(F)cc3)C3CCOCC3)C2)cc1 1470593381 LPVQZCFPFNORPQ-FQEVSTJZSA-N 441.547 4.051 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN([C@@H](C)C(F)(F)F)CC3)cc2Cl)C1 1478527431 CBDWORVLCFXHRV-HOTGVXAUSA-N 446.945 4.354 10 10 IICE Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1479030278 GCNDAZZDPLFSQT-QGZVFWFLSA-N 430.618 4.439 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1505229832 FXOCJKBISQSQCL-IBGZPJMESA-N 443.661 4.398 10 10 IICE CC[C@H](Cc1ccccc1Br)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1518368542 IARQSMNOFFMEGP-QGZVFWFLSA-N 431.374 4.375 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2sc(NC(=O)c3ccco3)cc2C)cc1 1527595933 QGFKYLYDLXWNTO-UHFFFAOYSA-N 427.526 4.119 10 10 IICE COc1ccc(N2CCCN(C(=O)CC[C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1527714538 AXZHVDVODUHMLM-HXUWFJFHSA-N 445.604 4.161 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](C)SCc1nc(O)c2ccccc2n1 1529277961 LGRQVXYVLLYQTA-IAGOWNOFSA-N 438.597 4.079 10 10 IICE CCC[C@H](C)CN(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1546872410 QOGZMGFPCAFZPT-SFHVURJKSA-N 429.584 4.442 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccn(CCc2ccccc2)n1 1556426711 YJDGOUZDMLYNSG-UHFFFAOYSA-N 448.567 4.128 10 10 IICE COC(=O)COc1ccc(CN(C)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1565162205 OWZVNCHZPZSXJN-UHFFFAOYSA-N 449.551 4.030 10 10 IICE Cc1cc(C(=O)Nc2ccc(COCCO)cc2)c(C)n1-c1ccc(Br)cn1 1570519972 JBKOVDAZSFGMQS-UHFFFAOYSA-N 444.329 4.013 10 10 IICE Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1618022235 QSZKEWWNIRZDEU-DEOSSOPVSA-N 445.519 4.077 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](c3ccco3)C2)c(C)n1-c1ccc(Br)cn1 1629619798 CNWWDRAFUOFNLT-GOSISDBHSA-N 430.302 4.058 10 10 IICE Cc1cc(C(=O)N[C@H]2CC[C@@H](N3CCN(C)CC3)CC2)c(C)n1-c1ccc(Cl)cc1 1633561781 FLGNDSNFNJXEKN-OYRHEFFESA-N 429.008 4.036 10 10 IICE COC(=O)/C=C/c1ccc(N2Cc3cc(Br)ccc3C[C@@H]2C)c([N+](=O)[O-])c1 1642548716 WRTPUJCCOONCPB-GBVBUYCNSA-N 431.286 4.495 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCC[C@@H]2CNC(=O)OC(C)(C)C)c1 1643346013 DUUKSFQYVOMEOJ-JOCHJYFZSA-N 439.556 4.426 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)c(C)n1-c1ccccc1 1681187670 DUJOGWWRAXYCPP-SMIHKQSGSA-N 449.599 4.330 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCn4c(nnc4C(C)(C)C)C3)cc2Cl)C1 1681828328 SGLMYARXOAIADO-INIZCTEOSA-N 445.011 4.191 10 10 IICE COc1cc(N2CCN(C(=O)NCC[C@H]3C[C@H](C)CC(C)(C)C3)CC2)cc(OC)c1OC 1681970762 QDEAYDVLSIDQMI-OALUTQOASA-N 447.620 4.397 10 10 IICE CCOCc1nnc(N(C)[C@H]2CC[C@@H](SCC)C2)n1Cc1ccc(N(C)C)cc1C 1696241871 MUGHMXDHXRDIHE-LEWJYISDSA-N 431.650 4.348 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@H](CC)C1 1696424841 TUXNCEUWRHHKGR-DENIHFKCSA-N 437.588 4.393 10 10 IICE CC[C@]1(C)CC[C@H](Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)O1 1708829372 MMZCWANFULJXCU-RCZVLFRGSA-N 441.620 4.222 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CC[C@@H](C(C)(C)C)C2)cc1 1710025768 MLYWHRPDRDTFOS-OAQYLSRUSA-N 435.620 4.446 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCC3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1724198864 RVAYJRZUCVSJRU-UHFFFAOYSA-N 434.588 4.114 10 10 IICE CC(C)CN1CCC[C@@H](Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1741556781 SNWKUCDGWFZJFZ-HXUWFJFHSA-N 434.588 4.050 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@H](C)O1 1745029930 GSVNYSJSFPDSDG-RXVVDRJESA-N 425.621 4.301 10 10 IICE CCO[C@]1(c2nnc(N3CCCC3(C)C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1746718855 JSITXTJKJSGLRT-RUZDIDTESA-N 441.620 4.204 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@@H](N3CCCC3)C2)cc1F 1747571058 AZVPQCOTEMUQNS-HXUWFJFHSA-N 442.627 4.185 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)CC(C)(C)C)nnc1[C@@]1(OC(C)C)CCOC1 1751432855 OHHWDXJSYVZIQI-RUZDIDTESA-N 443.636 4.224 10 10 IICE CC(C)NC(=O)c1nnc(N2Cc3ccccc3[C@H]2C)n1CCCSc1nccs1 1761210353 VLJLLOUKJDPMOV-OAHLLOKOSA-N 442.614 4.136 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1CC1CCC(F)(F)CC1 1764083289 BIUSHEUJRHDQOB-UHFFFAOYSA-N 449.546 4.364 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2ccc[nH]2)n1CCCC(F)(F)F 1768651547 SECBYFPXCYMJPE-UHFFFAOYSA-N 448.493 4.089 10 10 IICE CN[C@@H](c1ccc2c(c1)CCN2C)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 1999536558 LRRFWMDPESTKLS-GGAORHGYSA-N 425.573 4.050 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NCc2cc(Br)ccc2O)C1 2092949353 WGZDZHFYNYFOKH-IAOVAPTHSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@H]1NCc1ccc(Br)cc1O 2144131261 XKFICJIMDXIZEC-MJGOQNOKSA-N 433.346 4.435 10 10 IICE COc1ccc(Br)c(CNC2[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@@H]2C)c1O 2236055955 SVFCXJGXMLSQSO-STQMWFEESA-N 443.382 4.144 10 10 IICE COc1ccc(C)cc1-n1c(C)cc(C=C2C(=N)N3N=C(SC)SC3=NC2=O)c1C 2297469747 NTFYWOZXVFZYAR-UHFFFAOYSA-N 439.566 4.351 10 10 IICE COc1ccc(CNC(C)=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)cc1 2313683223 UWYBEEDJMPQAOB-UHFFFAOYSA-N 442.475 4.418 10 10 IICE Cc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)cc1 2314836670 IJOZVZUTRBGXRC-CYBMUJFWSA-N 427.507 4.132 10 10 IICE CCC1=NN(c2ccc(OC)cc2)C(=O)C1=Cc1cc(Br)cc(OC)c1O 2332124867 YUMVQNKKSZKZGU-UHFFFAOYSA-N 431.286 4.368 10 10 IICE Cc1ccc(CNC[C@@H]2COC(C)(C)CN2Cc2ccccc2)c(O)c1Br 2381148234 XRCRXBOZCGKEHL-LJQANCHMSA-N 433.390 4.232 10 10 IICE CC[C@H](C)c1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(O)c(Br)c3)C2=O)cc1 2220979 QHTIXXPZKASWSP-SEJMYLSOSA-N 443.297 4.335 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@@H](CC(=O)O)c3ccccc3)C2=O)cc1OC 8765563 XEPSCNHVKJUICU-GZQZNAIASA-N 429.519 4.121 10 10 IICE Cc1ccc2c(c1)S/C(=C\c1sc3ccccc3[n+]1C)N2CCCS(=O)(=O)O 20060121 MMOMHAFTUBHGOU-UHFFFAOYSA-O 433.600 4.223 10 10 IICE CCCN(CCC)c1nc2ccccn2c(=O)c1/C=C1/SC(=S)N([C@@H](C)CC)C1=O 33919993 VJPJIKOJOFDNSY-JEFCNZTNSA-N 444.626 4.321 10 10 IICE COc1cc(/C=C/C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1OCC(C)C 109179317 MOTZNVAEJODVPC-YLZBSDIZSA-N 438.568 4.457 10 10 IICE CCN1C(=O)/C(=C/c2c(Oc3ccccc3C)nc3c(C)cccn3c2=O)SC1=S 213209938 OHSFEYAQIPITOD-ATVHPVEESA-N 437.546 4.325 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2nccn2CC(F)(F)F)c(C)n1-c1ccccc1 729586733 HWLHPXCVDSJHNW-UHFFFAOYSA-N 433.478 4.237 10 10 IICE CCOc1ccc(O)c(CN[C@@H](c2ccc(F)cc2)c2cccc(S(C)(=O)=O)c2)c1 742382495 ANLWHOGHLDWMQC-QHCPKHFHSA-N 429.513 4.213 10 10 IICE O=C(/C=C/c1ccc(Br)o1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742807304 ZKYRHGMIFTVICS-AORWBKJGSA-N 441.272 4.442 10 10 IICE Cc1cc(C(=O)CSc2nnc(CO)n2-c2ccccc2)c(C)n1-c1ccc(F)cc1 758039002 DCCRTXRHGXYQHI-UHFFFAOYSA-N 436.512 4.281 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc([C@@H]2CCCOC2)c1 767087684 KQUFKWQQGDDPBN-DENIHFKCSA-N 428.960 4.334 10 10 IICE CCc1noc(C)c1-c1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 771727464 ZAUOTEQRSIEYQC-UVTDQMKNSA-N 446.579 4.491 10 10 IICE COc1ccc(N2CCC(N[C@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(F)c3)CC2)cc1 773102062 FFVFCRSWMKOCCG-JTHBVZDNSA-N 431.939 4.018 10 10 IICE Cc1ccc(C2CCN(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)CC2)cn1 782999178 KZSLAOVBRZOVKK-KDURUIRLSA-N 440.563 4.232 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCc1cc(Cl)ccc1N1CCOCC1 798490720 XNTREXPJXCXJMM-UHFFFAOYSA-N 445.007 4.363 10 10 IICE COC(=O)Nc1cc(C(=O)NCc2cc(Br)ccc2O)cc(C(F)(F)F)c1 804734674 WAAWDTFIAQRMTA-UHFFFAOYSA-N 447.207 4.282 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1sc([C@H]2CCCOC2)nc1C 815797224 HDAWHVSPPKMKSZ-ZDUSSCGKSA-N 439.375 4.476 10 10 IICE Cc1c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cnn1-c1ccccn1 914947684 HFXLZKICGQOREB-UHFFFAOYSA-N 432.455 4.162 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 915619329 LENGCTKKNPVFDS-GOSISDBHSA-N 434.506 4.432 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2ccc(F)cc21 1125965787 QPVWEYYYLTYNSD-HDAJJNEKSA-N 444.528 4.360 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3ncc(-c4ccc(F)cc4F)o3)C2)cc1 1129991699 VFEPIOFKNZWVMI-MRXNPFEDSA-N 441.478 4.204 10 10 IICE CCOC(=O)Cc1cc(Cl)c(=O)n(CC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)c1 1166198639 WMQZCUDKVKKNKK-UHFFFAOYSA-N 440.927 4.206 10 10 IICE CCc1ccc([C@H]2CCCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1229780671 IFSITHFRZSZAJV-NRFANRHFSA-N 443.538 4.453 10 10 IICE CN(C)[C@H]1CCc2cc(Br)ccc2N(C(=O)/C=C\c2ccc(Cl)nc2)C1 1280507425 KEGFEVQSUVOAKE-JDZBVEAQSA-N 434.765 4.420 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3c(F)cccc3F)cc2F)C[C@H](C)O1 1291756312 OMLJJGMHWBWGDN-KBPBESRZSA-N 444.457 4.038 10 10 IICE COc1cc(CN2CC[C@H](NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)cc(OC)c1 1294644651 CQBGKBLNAFMKJM-QHCPKHFHSA-N 447.579 4.045 10 10 IICE O=C(CCCCC(=O)c1ccc(F)cc1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1299098637 DBUIMYXPGXYMHH-UHFFFAOYSA-N 434.458 4.000 10 10 IICE CC(C)NC(=O)c1nnc(N2CC[C@@H](C)C3(CCC3)C2)n1CCCSc1nccs1 1303359857 FRYDWSMSQPVEDC-MRXNPFEDSA-N 448.662 4.072 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1[C@H]1CCC[C@H](C(F)(F)F)C1 1314750901 MTYQFLKEXALDKQ-HOTGVXAUSA-N 432.450 4.371 10 10 IICE Cc1cc(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)ncc1C(N)=O 1349833037 CLZLYXKRYAQZSH-UHFFFAOYSA-N 437.521 4.343 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(OCc4ccccc4)ccn3)cc2F)C[C@@H](C)O1 1354658482 PCHHKCDEUHTTCE-KDURUIRLSA-N 449.526 4.343 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@@]3(C)CCCS3(=O)=O)n2)c(C)n1-c1ccc(F)cc1 1357975635 PFVGSVAPEQUNBE-OAQYLSRUSA-N 447.557 4.263 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)cc(C(=O)OC)c1 1458726363 PYHJGFDDBABAKN-UHFFFAOYSA-N 435.476 4.237 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](Cc1ccncc1)NC(=O)OC(C)(C)C 1464348617 SXYJGWWQLUTIAH-QFIPXVFZSA-N 440.588 4.021 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3cccc(Cl)c3)cc2Cl)C1 1467502602 PBSWGLYBAHAEHH-HNNXBMFYSA-N 434.367 4.276 10 10 IICE Cc1cc2c(Br)ccc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)c2o1 1470447750 MFQGRBTWVDWQNY-UHFFFAOYSA-N 443.341 4.395 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@@H](O)c2cc(F)ccc2F)CC1 1478840792 HRMZTFNKQHDNJA-BXKMTCNYSA-N 445.554 4.425 10 10 IICE CC[C@]1(C)CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1497630407 AVSJFHMPBLNCTE-OXQOHEQNSA-N 437.635 4.164 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)Cc2ccsc2)cc1 1501837189 CBWHHZPPMNWJOV-UHFFFAOYSA-N 435.601 4.271 10 10 IICE CC(C)(C)c1ccc(OCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1518308897 SSNPVKVVFKZTGC-UHFFFAOYSA-N 435.612 4.211 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C(C)(C)N3C(=O)c4ccccc4C3=O)c2C)c1 1531612772 VSIPAMZHCXGHPF-UHFFFAOYSA-N 429.520 4.094 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C(=C\c3ccc(F)cc3)c3cccs3)cc2)CC1 1536924336 GAYNIDHDDMESQB-QJOMJCCJSA-N 435.568 4.496 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccccc2N2CCN(C)CC2)c1 1537660828 PFZYFGBYHVOCHK-UHFFFAOYSA-N 436.987 4.429 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)n1 1542117337 MWUJTBQEUZHOHJ-HXUWFJFHSA-N 444.535 4.101 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCO[C@](C)(C(C)(C)C)C1 1542227056 RIZCLNPCVIQSHS-VWLOTQADSA-N 436.604 4.337 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC(C(C)(C)CN(C)C)CC2)CCCC1 1556670319 OMCNFXVBKZGWMW-UHFFFAOYSA-N 425.617 4.355 10 10 IICE CC(C)CN(CCc1ccc(F)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1564895779 UNXAAFYEXJAIKO-UHFFFAOYSA-N 449.517 4.351 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@@H](O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cn1 1566326066 YFJHRHYEFCKPPY-RNODOKPDSA-N 446.320 4.243 10 10 IICE COc1cc(/C=C\C(=O)NCc2c(O)ccc3c2CCCC3)cc(Br)c1O 1566359905 RFTHCNXCTFBPDH-TWGQIWQCSA-N 432.314 4.077 10 10 IICE CC(C)[C@H]1OCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1603137088 MMKDNTIZPJEMNV-GHTZIAJQSA-N 441.963 4.397 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@@H]2c2cncc(Br)c2)c([N+](=O)[O-])c1 1612954884 HKIGVWZOSLOMPN-GMNBZTITSA-N 432.274 4.280 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(O[C@@H]2CC2(F)F)cc1 1626511024 DRYVTCMTDYKDSK-JOCHJYFZSA-N 446.494 4.475 10 10 IICE CCc1ccc(N2C[C@@H](C(=O)N(CC)Cc3cc(Br)ccc3O)CC2=O)cc1 1631167299 PAKNPISQTQSOES-KRWDZBQOSA-N 445.357 4.119 10 10 IICE O=C(Cc1nc(C(F)(F)F)cs1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1634752910 ALPXHSVQUIRTIO-NSHDSACASA-N 435.418 4.091 10 10 IICE O=C(NC[C@@](O)(c1ccc(Cl)cc1)C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1635177360 GOMZLNBQHLEWND-QGZVFWFLSA-N 431.819 4.146 10 10 IICE COC(=O)[C@]1(c2ccccc2)CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1637577828 IYNNZYGOISLQHG-HHHXNRCGSA-N 445.563 4.429 10 10 IICE Cc1ccc(Cn2nc(C)c(CCC(=O)NCc3ccc4cccnc4c3O)c2C)cc1 1638573467 YWEDLGWJBNTTOA-UHFFFAOYSA-N 428.536 4.359 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3ccccc3[C@H]2O)c(C)n1-c1cccc(Br)c1 1640362668 VIEPNZSCDXFYGR-NHCUHLMSSA-N 425.326 4.245 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@H]1CCCC(=O)N1C 1641202394 FGMJBGHTYXRGQF-AZUAARDMSA-N 433.474 4.309 10 10 IICE CCc1nc(N)nc(S[C@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 1651909661 FZECXRHCNBUSSO-CYBMUJFWSA-N 447.511 4.389 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H]3CSC[C@H]3C2)sc(C)c1-c1ccccc1 1660130505 SHMPUQYDQMHSCG-CALCHBBNSA-N 430.595 4.134 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3cc(F)ccc3F)CC2)N(C)C)cc1 1676653700 VIQCRARFUALLQY-DEOSSOPVSA-N 444.570 4.298 10 10 IICE Cn1ccnc1[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)c1ccc(F)c(F)c1 1685617034 ZHFRRWXQTDDKKW-INIZCTEOSA-N 441.265 4.300 10 10 IICE C[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1693670932 FCNQKMMDACZBHK-SFHVURJKSA-N 429.584 4.226 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CCC[C@H]3OC)CC2)cc1 1697470142 CTFWZIQNEWWBFM-DENIHFKCSA-N 441.620 4.116 10 10 IICE CC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)NC)C1 1709259724 CVWKGZWIKRFIBA-HXUWFJFHSA-N 434.588 4.115 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1712356660 GGXQXYLCJJQVDX-UHFFFAOYSA-N 437.588 4.396 10 10 IICE Cc1cc(-c2nnc(Nc3cnn(C)c3)n2CCN(C)C(C)C)c(C)n1-c1ccccc1 1751412562 VMSUBTBAQTUTCL-UHFFFAOYSA-N 432.576 4.170 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cc(OC)c(Cl)cc3OC)C2=O)ccc1O 1860084258 HESKGBJZMNTUFP-REZTVBANSA-N 437.926 4.477 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1C(=O)O 2079945795 MBSOHJXLBFHIKE-INIZCTEOSA-N 442.297 4.316 10 10 IICE CCc1nn([C@H](CC)c2cc(C)c(C)cc2O)c(I)c1C(=O)OC 2079955210 XLFWGHCJSSHRJI-CQSZACIVSA-N 442.297 4.159 10 10 IICE COCC[C@@]1(NCc2c(O)cccc2Br)CCCN(C(=O)OC(C)(C)C)C1 2157552029 DWJJNTHJSNYKRA-FQEVSTJZSA-N 443.382 4.051 10 10 IICE COc1ccc(N2C(=O)C(=Cc3ccc(I)o3)SC2=S)cc1 2297297212 NGKULIIBGXIOEZ-UHFFFAOYSA-N 443.287 4.299 10 10 IICE CCN1C(=O)C(=Cc2cc(Br)ccc2OCc2ccc(C)cc2)NC1=S 2297316442 XDZPNIHNAJGCBB-UHFFFAOYSA-N 431.355 4.414 10 10 IICE O=C1NN(c2cc(Cl)cc(Cl)c2)C(=O)C1=Cc1cccn1-c1cccc([N+](=O)[O-])c1 2297365497 VVLKQUKOAQFNMK-UHFFFAOYSA-N 443.246 4.154 10 10 IICE CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)NCCOc1ccccc1OC 2313681690 KYSDOQWDAVSGMI-UHFFFAOYSA-N 438.484 4.049 10 10 IICE C[C@@H]1CN(C2=NC(=O)C(=Cc3cn(-c4ccccc4)nc3-c3ccncc3)S2)C[C@@H](C)O1 2314457982 ZMSDAPPANQSZRZ-IAGOWNOFSA-N 445.548 4.014 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2314717640 IQOODZMLCVDRDE-UHFFFAOYSA-N 433.352 4.304 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccc(O)cc3)SC2=S)cc1 2314832061 YVIKFUMCWYNAFD-UHFFFAOYSA-N 442.562 4.411 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)cc1OC 2321630773 NMXZVMSGWMLXPN-UHFFFAOYSA-N 446.506 4.417 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@@H](NCc1cc(Br)ccc1O)C2 2333628608 BYPHLRYZZDBAPD-CPUCHLNUSA-N 425.367 4.280 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380793181 PFZDPZFPWVWFQE-HNNXBMFYSA-N 441.366 4.211 10 10 IICE CCN1C(=O)/C(=C\c2ccc(OCCOc3ccc(OC)cc3)c(OC)c2)SC1=S 6470516 GXKTYCOXXIZACM-XSFVSMFZSA-N 445.562 4.383 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCCC1 13639851 JKOMCCPTKZDSGT-JXQFQVJHSA-N 440.565 4.489 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccc(OC)cc3)SC2=S)cc1 15047389 JLQXZZVZEAANIF-QIQQCEGHSA-N 442.562 4.322 10 10 IICE O=C(O)/C=C/c1ccc(N2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1Br 687211336 CDAQYUKLNGAJNF-ZDMAARRPSA-N 427.342 4.400 10 10 IICE O=[N+]([O-])c1cc(I)ccc1NCc1ccc(Br)cc1O 692078678 QGNVPHYHXGWEDH-UHFFFAOYSA-N 449.042 4.280 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)c(Br)c1 705882454 JDAPJTRHTHXLKY-VMBXEPDQSA-N 426.402 4.255 10 10 IICE CCOC(=O)c1c(NC(=O)CCN(C)Cc2cc[nH]n2)sc(C)c1-c1ccccc1 733997570 RDJSMROAKLPOCQ-UHFFFAOYSA-N 426.542 4.084 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCCc3c[nH]c4ccc(F)cc34)cc2F)C[C@H](C)O1 735096811 ZCUADSBKKRAIEW-HOTGVXAUSA-N 442.510 4.102 10 10 IICE COc1cc(OC)cc(N2CC[C@H](CN[C@H](C)c3cc(Br)ccc3O)C2)c1 756649405 GTXYULLVHFUISI-HUUCEWRRSA-N 435.362 4.349 10 10 IICE Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 775593169 OGGIAZDHGNATTC-UHFFFAOYSA-N 437.949 4.368 10 10 IICE COC(=O)c1nc([C@@H]2CCCN2Cc2cc(C)cc(Br)c2O)sc1C 793234979 MMLKOZCPVQLNDM-AWEZNQCLSA-N 425.348 4.352 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)NCc1cc(Cl)cc(Cl)c1O 805365607 UYTRVPMXONTUCT-ABAIWWIYSA-N 432.348 4.144 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnn(-c4cccc(Cl)c4)c3)cc2F)C[C@H](C)O1 917707824 BTGCLGFPPRCLHJ-HOTGVXAUSA-N 442.922 4.208 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)[C@@H](C)C2)cc1 1136571708 BBWQJPGLHZYIGS-SFHVURJKSA-N 449.526 4.371 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@@]2(C)CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1136903512 FRSLBFJJURMOMH-UZLBHIALSA-N 444.403 4.409 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082121 PLEAUEYTXOQFDG-YOEHRIQHSA-N 438.906 4.312 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F 1142418316 CRCCAEHZFZBVKL-AWEZNQCLSA-N 434.462 4.040 10 10 IICE Cc1cc(C(=O)Nc2cc(Br)c(=O)n(C)c2)c(C)n1-c1ccc(Cl)cc1 1149643001 WNDZBIMDLYYKRJ-UHFFFAOYSA-N 434.721 4.461 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 1154026588 NPQUJMXLVJLKHN-LULLPPNCSA-N 432.561 4.103 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2cccc3ccccc23)cc1 1166169925 HJQLTGPNSMFGHO-SANMLTNESA-N 426.516 4.452 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@@H]3c3cccc(C)c3C)CC2)cc1 1191212602 BWJHMZQXRVUYDK-SHQCIBLASA-N 437.628 4.022 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@@H]1COC(=O)NC1CCCCC1)c1ccc(N(C)C)cc1 1226647201 RCNKNPFGKQYDQO-XMSQKQJNSA-N 430.593 4.437 10 10 IICE CCN(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)C1CCN(C(=O)OC(C)(C)C)CC1 1230200822 MHKCKRIJRXBFOR-LJQANCHMSA-N 446.636 4.423 10 10 IICE COc1cc([C@H](C)NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc2ccccc12 1253511242 JVWAZHWDKGRNMF-SFHVURJKSA-N 433.552 4.370 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC[C@H]1CCCS1 1287354385 LGOFVMXZMNEVBW-MLJWKTOOSA-N 426.654 4.131 10 10 IICE CC1CCN(CCCCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CC1 1291180980 SWSSCUADJWBGJF-HSZRJFAPSA-N 441.620 4.374 10 10 IICE Cc1cc(CN(C)c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)no1 1304202706 QXBTZZBYXQJOPL-UHFFFAOYSA-N 430.559 4.418 10 10 IICE CCCCN(C)CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1306682826 NYXBCUNWVWLNNQ-UHFFFAOYSA-N 428.968 4.067 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 1313123865 JCPLEPKSGKAEHF-SGTLLEGYSA-N 426.344 4.371 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H](Cc3cccnc3)C3CCCC3)cc2F)C[C@@H](C)O1 1355131728 YLXWMEKPVBNGPH-YYDVJCTNSA-N 439.575 4.500 10 10 IICE COc1ccc(N2CCCN(C(=O)CN(C(=O)c3ccccc3)c3ccccc3)CC2)cc1 1356397721 SUFYNOAASLXMSA-UHFFFAOYSA-N 443.547 4.081 10 10 IICE CC(C)[C@H](Cn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1359665353 XUQLQUZMHHICOU-QFIPXVFZSA-N 425.621 4.473 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nc(C)cs1 1360840083 HCQCTTFBEPKMQX-GDNBJRDFSA-N 435.571 4.235 10 10 IICE COC(=O)/C=C\c1ccc(N(Cc2ccc(OC)cc2OC)CC2CC2)c([N+](=O)[O-])c1 1458341172 UPUIKESKNOXDNK-XFFZJAGNSA-N 426.469 4.215 10 10 IICE COC(=O)CCCc1csc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1465791068 ZWFQTANFGHEQPO-UHFFFAOYSA-N 425.510 4.111 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccn(-c2ccc(Br)cc2)n1 1471340085 XRHZUVPRNJMCMB-UHFFFAOYSA-N 442.361 4.042 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCCC1(F)F 1499154519 SCQIOSDOJQWWCT-MRXNPFEDSA-N 437.510 4.140 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@H]1CCCS1 1503473025 HBVJAPFMHWWUEZ-OAQYLSRUSA-N 443.661 4.235 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCC[C@H]2CC)CCOC1 1516140250 DQXGFEALJQUMGL-KHCICDEESA-N 428.577 4.099 10 10 IICE CCS[C@@H]1CC[C@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1516888678 KPYUYKXJPWHKGY-FCHUYYIVSA-N 443.661 4.397 10 10 IICE CC(C)[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C(F)(F)F 1517322315 LVRDDXVECJIINU-CTXBLAANSA-N 434.480 4.120 10 10 IICE COc1cc(N2CCN(C(=O)c3coc4ccc(Cl)cc34)CC2)cc(OC)c1OC 1521503448 VYWNMHJJIFSNRI-UHFFFAOYSA-N 430.888 4.074 10 10 IICE CC[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)n1nnc(-c2ccc(Cl)cc2)n1 1526185595 LIJOCENMZPVKQI-NRFANRHFSA-N 438.963 4.202 10 10 IICE CCCc1c(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)nnn1-c1cccc(C(C)C)c1 1528317295 FURPTKWYSILGHA-FQEVSTJZSA-N 447.583 4.361 10 10 IICE CC(C)n1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1537250777 CDMMNBATMASGAD-UHFFFAOYSA-N 425.290 4.189 10 10 IICE COc1ccc(-c2cncc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2)c(C)c1 1539705545 FWYBREKPDVXFCD-RUZDIDTESA-N 432.568 4.164 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCCCN1Cc1cccc(F)c1 1544408806 IUUZEUBMHYGSJI-QHCPKHFHSA-N 427.589 4.050 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H](OC)C(C)(C)C)CC2)cc1F 1554960475 JHWOZGNYLNKSOX-OAQYLSRUSA-N 447.599 4.012 10 10 IICE Cc1cc(C(=O)NCc2nc3c([nH]2)CCCC3)c(C)n1-c1ccc(Br)cc1 1558538170 XYYVGSFHQXZZFS-UHFFFAOYSA-N 427.346 4.389 10 10 IICE Cc1cc(C(=O)NC[C@H](O)COc2ccccc2)c(C)n1-c1ccc(Br)cc1 1566332400 FNOMDWPWUADQHC-IBGZPJMESA-N 443.341 4.026 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc(C)c(-c4ccccc4)s3)CC2)cc1 1598029095 QRQIUCLAEBWKJK-UHFFFAOYSA-N 435.593 4.284 10 10 IICE COCC(=O)N1CCCc2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc21 1598087166 RYRJJJVXEMAWMM-UHFFFAOYSA-N 445.519 4.085 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2NC(=O)c2ccsc2)N(C)C)cc1 1603556544 YXBCXYVTVVJOSN-QFIPXVFZSA-N 436.581 4.099 10 10 IICE Cc1nn(C)c(C)c1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1612465026 FSSHBWNHIRCAMR-UHFFFAOYSA-N 435.620 4.211 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1619029172 NZVNMSNCJLPXCI-VWLOTQADSA-N 425.621 4.303 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccccn1 1619843128 VCDZHYOZSGJZSQ-UHFFFAOYSA-N 430.556 4.421 10 10 IICE COc1ccc([C@@H]2C[C@H]2CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1622634963 NGVNUYSSCVMMFZ-XJABCFGWSA-N 428.960 4.329 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2nn(-c3ccc(Cl)c(F)c3)c3c2CCC3)c1 1622778973 CXMUFFUGBZWHFD-GFCCVEGCSA-N 429.879 4.359 10 10 IICE Cc1cc(C(=O)N2CCCNC(=O)[C@@H]2Cc2ccccc2)c(C)n1-c1cccc(Cl)c1 1625199596 FFQAPWBVTIXMKN-QHCPKHFHSA-N 435.955 4.321 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3sc(SC(F)(F)F)nc3C)CC2)cc1 1627619069 DMLUFJLEWFNTAB-UHFFFAOYSA-N 445.532 4.400 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cc(N(C)C)nc3ccccc23)c1 1628732568 RZSGNSNUFADMCM-UHFFFAOYSA-N 426.520 4.451 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)Oc1ccc(F)cc1 1633173429 XJIQPCWNFHDEQX-NRFANRHFSA-N 444.890 4.237 10 10 IICE Cc1cc(C(=O)NCC[C@@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1639185522 ZDMCYXQBIMIGQF-JOCHJYFZSA-N 442.357 4.279 10 10 IICE Cc1cc(C(=O)N[C@H]2COCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1639413162 ZQTOLPGRGKINOB-IBGZPJMESA-N 426.314 4.253 10 10 IICE CCN(CC(F)(F)F)C(=O)CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1 1643615860 ZVRFHXFTMGTEAV-MRXNPFEDSA-N 427.492 4.232 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3cccc(F)c3F)CC2)N(C)C)cc1 1676652766 AIKZQLZFCXPKTB-HSZRJFAPSA-N 444.570 4.298 10 10 IICE C[C@H]1CC[C@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CN1C(=O)OC(C)(C)C 1687248879 ONKCJQXTXBUPRR-ICSRJNTNSA-N 430.593 4.216 10 10 IICE CCN(c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1745977746 CKCBQMGFYOOIRC-UHFFFAOYSA-N 427.637 4.358 10 10 IICE C[C@H]1CC[C@@H](Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)C1 1752074579 NVBPGTLWJCXIGL-PZJWPPBQSA-N 425.621 4.485 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1nc(C)cs1 1763500924 VCFPWZSIGQIPCY-KRWDZBQOSA-N 440.617 4.078 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC=C(C)C 1767765898 BLWUEFWJZIWMLO-UHFFFAOYSA-N 434.588 4.281 10 10 IICE COCCC(C)(C)Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1770971817 MLRQWUMUEXFVRV-UHFFFAOYSA-N 443.636 4.265 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1771446853 YYXHFGBNGDBWSL-CVEARBPZSA-N 439.676 4.143 10 10 IICE COc1cccc(/C=C2/SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)c1OC 1860087670 NBKUXGBZUFOYTJ-RQZCQDPDSA-N 447.534 4.135 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C(C)(C)C)nc4c3cnn4C(C)C)CC2)cc1 1891494782 TVBZYSFCARUTFQ-UHFFFAOYSA-N 435.572 4.281 10 10 IICE O=C(O)[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@H]1c1ccc(O)c(O)c1 1951590855 GAUJAKYPDCXJKP-SFTDATJTSA-N 445.471 4.147 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC12CCC(NCc1ccc(Br)cc1O)CC2 1967784487 KUZNVJURLNLUEV-RYZJOYRSSA-N 425.367 4.470 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1O 2236033490 RTOONQNXEHDOKL-ZIAGYGMSSA-N 443.382 4.336 10 10 IICE COc1ccc(Br)c(CNC2[C@H]3CC[C@H]2CN(Cc2ccccc2)C3)c1O 2236053991 CUBXVYBVTSAKIX-IRXDYDNUSA-N 431.374 4.164 10 10 IICE CN(Cc1cc(O)nc2ccccc12)C(=O)c1ccc(C=C2SC(=S)N(C)C2=O)cc1 2296554320 PBNJYCSCWIETGR-UHFFFAOYSA-N 449.557 4.044 10 10 IICE CCCCOC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)o2)cc1 2297350472 SOOAGDSANNRJLL-UHFFFAOYSA-N 445.518 4.189 10 10 IICE CCOc1ccccc1-n1c(C)cc(C=C2C(=N)N3N=C(SC)SC3=NC2=O)c1C 2297470157 PJSTYWQYGZMXKC-UHFFFAOYSA-N 439.566 4.433 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccc(F)cc3)SC2=S)cc1 2314831844 TWAGMEAPOFLDDQ-UHFFFAOYSA-N 430.526 4.454 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3ccc(O[C@H](C)C(=O)O)cc3)SC2=S)cc1 2314929052 GNAPBMMGBAOWPO-CYBMUJFWSA-N 427.503 4.147 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2ccc(Br)cc2O)C[C@@H]2CCC[C@H]21 2335106062 QSXSPZMCFWKJFC-RRQGHBQHSA-N 425.367 4.422 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352949589 GPVRGWGQPLIABY-FZKCQIBNSA-N 425.367 4.245 10 10 IICE Cc1ccc(CNC(=O)CC[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381145273 CXKYITVNCRINNX-OTVXOJSOSA-N 441.366 4.163 10 10 IICE CC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)SC1=S 2381918 BSNTVMXKBADNQE-WPBJZHHJSA-N 432.479 4.228 10 10 IICE O=C(CCN1C(=O)/C(=C/c2cc(Cl)ccc2O)SC1=S)Nc1ccc(F)cc1 15037661 LDSCYZRSFMQNQR-YBEGLDIGSA-N 436.917 4.415 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(/C=C3\NC(=O)N(Cc4ccccc4F)C3=O)c2C)cc1 33725167 AOSKNOWFRHMAEE-XKZIYDEJSA-N 447.466 4.113 10 10 IICE COc1cccc(CN2CCC[C@@H](COc3ccccc3C(=O)N3CCCCC3)C2)c1O 169764986 PFZJWGWVUAEBAZ-HXUWFJFHSA-N 438.568 4.318 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3ccc(C(=O)OC)cc3)C2=O)cc1OC 206255891 LWHZDILDIPPLDD-LDADJPATSA-N 429.519 4.286 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2cccc(OCc3ccccc3C)c2)SC1=S 206836762 BRCMFVHJGMUDEW-UYRXBGFRSA-N 427.547 4.338 10 10 IICE C[C@H](NC(=O)/C=C\c1ccc(OCc2ccccn2)cc1)c1ccc(N2CCOCC2)cc1 210875450 MNVIQJKPDDGQRP-BTHDMNAMSA-N 443.547 4.388 10 10 IICE CCOc1ccc(O)c(CN(C)Cc2cccc(NS(=O)(=O)c3ccccc3)c2)c1 769236497 AXGMDXKSDXENRA-UHFFFAOYSA-N 426.538 4.224 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)c1 769540313 LFYHEZYKDVCIMD-NQERJWCQSA-N 442.943 4.144 10 10 IICE C[C@H]1C/C(=C\c2ccc(N(C)C)cc2)c2nc3ccccc3c(C(=O)N3CC(CO)C3)c2C1 773957541 VEFORKKRLPZRES-SXZORUHJSA-N 441.575 4.488 10 10 IICE C[C@@H](NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1)c1ccc(N2CCOCC2)cc1 801001733 PFLPQDMUMIJYGK-VQIMIIECSA-N 425.495 4.348 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC(c3noc4cc(F)ccc34)CC2)c([N+](=O)[O-])c1 811848559 KHQPGSPBHFJIFC-CLTKARDFSA-N 425.416 4.445 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1 917385911 AKPFFGCKJZFGOU-UHFFFAOYSA-N 431.561 4.422 10 10 IICE COc1cc(/C=C2\SC(=S)N(CNc3ccc(F)cc3)C2=O)cc(OC)c1OC 1084409208 AZEQDJICNRHKHW-YVLHZVERSA-N 434.514 4.122 10 10 IICE CCn1nc(C)c(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1C 1136597926 NEPZKQUBIOICPA-UHFFFAOYSA-N 430.350 4.015 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1c2ccccc2C[C@@H]1C 1136743199 LELVSZKTQSREBR-WUMKDDEVSA-N 433.596 4.461 10 10 IICE Cc1cc(CC(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C)n1-c1ccc(Cl)cc1 1151319077 FREORERMWHAJFA-NRFANRHFSA-N 435.955 4.491 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](CC)c1ccc(Br)cc1 1162539319 APQAZLRFEXUGSI-GOSISDBHSA-N 434.330 4.240 10 10 IICE Cc1ccc(C(=O)N[C@H](CC(=O)NCc2ccc3cccnc3c2O)c2ccccc2)cc1 1162612744 PFEIZKLYSJYBFK-HSZRJFAPSA-N 439.515 4.426 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)CCCc1ccccn1 1289424319 UQFCHWVEHGMWRW-XMMPIXPASA-N 448.615 4.406 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1cc(Br)ccc1Cl 1290324222 MOJHOMQBBPEGIX-UHFFFAOYSA-N 437.765 4.140 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(OCC3CC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1291518660 OXFCOQOICFNVRW-QGZVFWFLSA-N 429.584 4.440 10 10 IICE Cc1sc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1-c1ccco1 1291755634 IKEGTSUCNZZDLV-GJZGRUSLSA-N 443.544 4.323 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(C(=O)Cc3ccccc3F)CC2)c1C 1292382736 BVJJZFYZHSKNKB-UHFFFAOYSA-N 433.527 4.069 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c1 1298731300 IRLULBKZTSDETP-AREMUKBSSA-N 434.511 4.113 10 10 IICE CC(C)[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1302778312 JNQNPKOFCBUTLY-SFTDATJTSA-N 447.624 4.351 10 10 IICE Cc1cc(C(=O)NCc2cnn3c2CCCC3)c(C)n1-c1ccc(Br)cc1 1304055636 FRDYCOGSKIRGKL-UHFFFAOYSA-N 427.346 4.319 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@](C)(O)[C@H](C)CC 1305384741 VEAQXTQSEHTCFY-DFIYOIEZSA-N 443.636 4.062 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(C)=O 1305576853 JNLLFNXKJWXWPD-SFHVURJKSA-N 436.604 4.361 10 10 IICE CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1353910595 LCEUFRWULCEAMD-CJFMBICVSA-N 433.596 4.245 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2c[nH]c3cccc(Br)c23)cc1 1437376651 AFHJTPBNVRRUGW-UHFFFAOYSA-N 430.346 4.076 10 10 IICE Cc1cc(C(=O)NCC(=O)NC2CCCCC2)c(C)n1-c1ccccc1Br 1442388969 FIWXPVKDGOYQJT-UHFFFAOYSA-N 432.362 4.035 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CN1C(=O)CCOc2ccccc21 1446808212 WDFVYCYXXUIZEM-LJQANCHMSA-N 430.504 4.298 10 10 IICE Cc1ccc(C)c(-n2ccnc2SCC(=O)NCc2cccc(Br)c2O)c1 1448959161 AFZLFMPIGWUXHS-UHFFFAOYSA-N 446.370 4.366 10 10 IICE Nc1c(F)cc(F)cc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1466396346 ITVXHHILYIMQTN-UHFFFAOYSA-N 436.506 4.164 10 10 IICE CC1CCN(c2ccc(Cn3c(-c4cnn(C)c4)nnc3N(C)CCC(F)F)cc2)CC1 1512276898 PJIIQFVHFGFGTE-UHFFFAOYSA-N 443.546 4.055 10 10 IICE CC(=O)Nc1ccc(CN2CCC(NC(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)cc1 1526159969 NORJXGLKZAGHFR-UHFFFAOYSA-N 444.579 4.447 10 10 IICE COc1ccc(CCC(=O)NCc2ccc(N3CCSCC3)cc2)c(Br)c1 1541080928 QAZYWSGANHEGGR-UHFFFAOYSA-N 449.414 4.260 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCOC3(CCCC3)C2)NC(=O)OC(C)(C)C)cc1 1544267789 IIDINVWWJRTRAO-CTNGQTDRSA-N 445.604 4.174 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Cc1ccccc1OC 1546009226 JAGKBPWQPFWVMT-QFIPXVFZSA-N 448.563 4.481 10 10 IICE COC(=O)[C@H](C)CN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CC1 1546229027 VFMOKBCRWPPCSY-CYBMUJFWSA-N 433.346 4.270 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2Cc3ccccc3N(C)C2=O)cc1 1586000059 WXSVNKUNLRHNKU-QFIPXVFZSA-N 427.508 4.486 10 10 IICE Cc1cccc(-c2nnc(N3CCC[C@@H](C(F)F)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1612204320 WGYHIWRMPIBCJM-QGZVFWFLSA-N 444.505 4.383 10 10 IICE CCO[C@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1616610930 XVPVMRJUPWOVDF-QFIPXVFZSA-N 439.629 4.358 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CC(=O)NC[C@H]2c2ccccc2)cc1 1617332101 XWJRACYSAQSYEV-QHCPKHFHSA-N 427.508 4.481 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C3)c2C)c1 1621985029 OGSJEDIIRDEPID-PGRDOPGGSA-N 441.572 4.157 10 10 IICE CCOc1ccccc1N1C[C@H](C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1=O 1623471688 KYPINJYCSBYKRQ-OAQYLSRUSA-N 435.568 4.087 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1623477424 ZDHMGXPJDRJOSM-TZIWHRDSSA-N 433.568 4.230 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4ncccc4C)cc3)CC2)c(OC)c1 1623764512 PYVDKHBSURRLBY-UHFFFAOYSA-N 433.508 4.162 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2cnn(Cc3ccccc3)c2)cc1 1624648793 NOOPDBNTCJECKO-UHFFFAOYSA-N 440.547 4.353 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)C(F)(F)c1ccc(Br)cc1 1624892333 GUSFTAKHCJPNLC-UHFFFAOYSA-N 441.341 4.411 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](OCC3CC3)C2)c(C)n1-c1ccc(Br)cn1 1625716942 UCQZQAJICHXGFF-SFHVURJKSA-N 432.362 4.283 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1 1629235905 DJVNUZFEBGIKFJ-UHFFFAOYSA-N 435.593 4.367 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NCCc2ccc(O)c(O)c2)c2ccccc21 1630334799 HNRQLHZORXWFKC-KRWDZBQOSA-N 426.513 4.076 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)C2 1637134366 MIPHMFPNDDSWQX-PEYYIBSZSA-N 429.344 4.351 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 1639741758 MTEUCBRYSUVGQW-IBGZPJMESA-N 429.476 4.286 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCN(C(=O)C(F)(F)F)C2)c(C)n1-c1cccc(Cl)c1 1640238717 FKCWKYMNHQGYAC-OAHLLOKOSA-N 441.881 4.278 10 10 IICE Cc1cc(CN(Cc2cc(C)c(C)c(S(N)(=O)=O)c2)C2CC2)ccc1N1CCCCC1 1646594881 AGGJTYOPFHVRIQ-UHFFFAOYSA-N 441.641 4.414 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ncnc2c1cnn2-c1ccccc1F 1651627683 QJUCUPARMNEBJJ-UHFFFAOYSA-N 442.292 4.449 10 10 IICE COc1cc(N2CCN(CCc3c(Cl)cccc3Cl)CC2)cc(OC)c1OC 1658172036 CELXTNNAOQYAMX-UHFFFAOYSA-N 425.356 4.384 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NC[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1675831985 WXKQWFINKWTACO-HYBUGGRVSA-N 431.577 4.494 10 10 IICE CCc1nc2cc(CNC(=O)N(C)CCN(C)c3ccc(OC)cc3)ccc2n1C1CC1 1681777737 IYDGQEKBQBAHOU-UHFFFAOYSA-N 435.572 4.220 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(Cc3cccc(C)n3)Cc3cccc(C)n3)C2)cc1 1682645811 JUOHUJPPVMSJDA-QHCPKHFHSA-N 445.567 4.093 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H]1Cc1ccccc1Cl 1683014126 HEAMRBMTWCFOON-GOSISDBHSA-N 449.929 4.372 10 10 IICE Cc1cccc([C@@H]2C(=O)NCCN2C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1 1684599734 IXRQDXIEYOWCFT-XMMPIXPASA-N 430.552 4.094 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CC[C@@H](C(F)(F)F)O2)cc1 1685139798 INEFRTHOFGEPSX-MJGOQNOKSA-N 425.451 4.167 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCOCCCO 1694877057 POVWTTYDQZAMLA-NRFANRHFSA-N 437.588 4.130 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C)[C@H](C)C1CCC1 1695538058 SSDCMHXZMZMREI-LJQANCHMSA-N 448.615 4.456 10 10 IICE CCC[C@H](C)CN(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1709475077 BOVHUOVRHZMIEB-PZJWPPBQSA-N 443.661 4.256 10 10 IICE CC(C)OC1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC1 1751032759 JEXRAWOKQOQCSH-UHFFFAOYSA-N 443.661 4.397 10 10 IICE CC(C)C1CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)CC1 1760953765 RFFXEKPHOGATOD-UHFFFAOYSA-N 448.662 4.025 10 10 IICE CCOCc1nnc(N(CC(C)C)C2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1766248665 JETOCVITQFITCP-UHFFFAOYSA-N 441.620 4.105 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CCSC3)CC2)cc1F 1768705177 YJKLOWNJPMGNHP-KRWDZBQOSA-N 447.624 4.094 10 10 IICE COC(=O)[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1769384020 VGPOADSZUQFXOV-NRFANRHFSA-N 439.604 4.076 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3(N(C)C)CCCC3)CC2)cc1 1770259495 YKABXFVCYQFCJO-UHFFFAOYSA-N 440.636 4.001 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3nc(-c4ccc(Cl)cc4)oc3C)CC2)cc1 1858084078 RARBXJJOVZYOKB-UHFFFAOYSA-N 425.916 4.203 10 10 IICE Cc1cc(/C=C/C(=O)N2CCC3(CC2)OCCO3)c(C)n1-c1ccc(C(F)(F)F)cc1 1858130110 FEFFNGOAUKKWLC-FPYGCLRLSA-N 434.458 4.492 10 10 IICE CCCN1N=C(c2ccc(OC)cc2)/C(=C\c2cc(Br)c(O)c(OC)c2)C1=O 1865666293 IMBJWTICFFYXLP-MHWRWJLKSA-N 445.313 4.212 10 10 IICE O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1ccc(Cl)cc1 1865678079 SBISVWVVOQZDEI-QPEQYQDCSA-N 425.750 4.298 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCC4)nc(-c4cccc(OC)c4)n3)CC2)cc1 1867990721 ULKSDSUHPOPKKI-UHFFFAOYSA-N 445.567 4.088 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1cc(C)ccc1C 2297347748 YSUFZPDENMSAMP-UHFFFAOYSA-N 447.491 4.220 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cc(Cl)ccc2O)SC1=S)Nc1ccc(O)cc1 2314831419 KRCQPNHUGAQGNP-UHFFFAOYSA-N 448.953 4.371 10 10 IICE Cc1ccc(CN[C@@H]2[C@@H]3C[C@@H]4[C@@H]2N(C(=O)OC(C)(C)C)C[C@@H]4C3)c(O)c1Br 2381130155 VBWTXXFYVQJNAG-YDRHNJASSA-N 437.378 4.197 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)C1 436036491 XYYMWWINKWZNCX-IDISGSTGSA-N 431.580 4.302 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)C1 436036492 XYYMWWINKWZNCX-JIPXPUAJSA-N 431.580 4.302 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741180863 DNUMCNFAAPYGAC-PMACEKPBSA-N 434.458 4.436 10 10 IICE O=C(NC1CCN(c2ccccc2)CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745738090 SQRGNVSSRMHPBK-IBGZPJMESA-N 444.526 4.225 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1125945037 IIEZQNONXWYTGR-UHFFFAOYSA-N 449.523 4.405 10 10 IICE CCS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1128490075 ORPODNSIMRISMW-MRXNPFEDSA-N 434.989 4.300 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C1CCC(F)(F)CC1 1129480181 FOFCDAJGYXHUCD-VBKFSLOCSA-N 442.528 4.453 10 10 IICE COc1cccc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1C 1130947861 KMMBDPTYCJSPBE-UNOMPAQXSA-N 445.537 4.477 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1137386904 RBMNROGIABENAY-HXUWFJFHSA-N 433.593 4.016 10 10 IICE COc1ccc(O)c([C@H](C)NCC(=O)Nc2nc(C)c(Cc3ccc(C)cc3)s2)c1 1168713005 SGZQLBPGIHZUJN-HNNXBMFYSA-N 425.554 4.354 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)CS(=O)(=O)c3cccnc3)c2C)ccc1Br 1190146878 LYCZTVHDEGDMGL-UHFFFAOYSA-N 447.354 4.217 10 10 IICE COc1ccc(N2CCN(Cc3ccc(Cl)cc3Br)CC2)c(OC)c1 1197096141 QSZAIXFWJJPTPC-UHFFFAOYSA-N 425.754 4.442 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccc(N4CCN(C)CC4)cc3)c2C)c1 1234325224 BPDRUAGJVUJJGG-UHFFFAOYSA-N 445.611 4.154 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC(OCC3CC3)CC2)nnc1C(C)(C)C 1289426301 LPRLIFJFSJZFEA-UHFFFAOYSA-N 425.621 4.394 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C[C@@H](c2nccn2C)C(F)(F)F)cc1 1290757151 LHUOFHSCAOALOA-IBGZPJMESA-N 434.462 4.344 10 10 IICE CCCCN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCSCC2)cc1 1294193485 YXNFAAVMFBSBKR-UHFFFAOYSA-N 436.629 4.486 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CCCN(c3ccc(Cl)cc3Cl)C2=O)cc1 1297499313 PREHDXVSNJKPJQ-HNNXBMFYSA-N 434.283 4.081 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@H]1CCC=CO1 1298314956 MYYICZZSXNGSKV-JOCHJYFZSA-N 439.604 4.032 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1-c1ccccc1 1312710782 ZUXKCRSFZFHUQC-PMACEKPBSA-N 444.579 4.302 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](C(=O)OC(C)(C)C)C3CCCC3)cc2F)C[C@@H](C)O1 1354659212 UNYSLTHJUAAZEK-YVHKJVDXSA-N 448.579 4.204 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(F)cc1F 1445904410 XKQWTJPPCHIPPJ-OAQYLSRUSA-N 446.494 4.431 10 10 IICE COc1cc(N2CCC(C(C)(C)CNC(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])cc1OC 1458663954 JZZCSLTWHDOFRQ-UHFFFAOYSA-N 437.537 4.379 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H](O)COc1cc(F)cc(Br)c1 1459325781 BCHDHJXTBMYMBH-HXUWFJFHSA-N 439.369 4.305 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](C)Oc3ccc(C)cc3Br)C2)cc1 1461077953 QZSXTVJMVBKMEL-IAGOWNOFSA-N 447.373 4.176 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1 1463814768 RXEAXJZBPUZHFQ-VWLOTQADSA-N 427.548 4.417 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Cl)c1 1464503674 OGSDPYBKLWQIJE-SVMVAKDDSA-N 429.992 4.461 10 10 IICE CCc1ccccc1CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324448 DZBAINJEKLXGIE-QFIPXVFZSA-N 425.573 4.240 10 10 IICE CC(C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(F)cc1 1473271126 SESFDJFTFODWKN-ROUUACIJSA-N 431.527 4.110 10 10 IICE CN(Cc1cccc2ccccc12)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786077 IOLSHHRRQZOSOE-UHFFFAOYSA-N 425.479 4.296 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2CCCC2)n1CCOC(C)(C)C 1503472605 AQMOMYOXVRFBFL-UHFFFAOYSA-N 441.620 4.224 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@@](C)(O)c1ccsc1 1503488430 UKLKAVZBHRRFIR-JOCHJYFZSA-N 440.594 4.242 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(C)c(C(N)=O)cn2)sc(C)c1-c1ccc(F)cc1 1523603625 NUFNRQLXCBIAAB-UHFFFAOYSA-N 441.484 4.094 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CCCCC2 1526893144 INHPVTZFFCMQBE-HNNXBMFYSA-N 432.586 4.313 10 10 IICE Cc1nc(-c2ccccc2)sc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1535345943 RQMANJVCFRSLET-UHFFFAOYSA-N 429.492 4.163 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)CC1 1539188224 LBSVJELCYGGJAZ-UHFFFAOYSA-N 443.510 4.291 10 10 IICE C[C@@H](CC(N)=O)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CCC2 1543524559 DQJDSUUINTULHK-PJCCXHTNSA-N 442.563 4.171 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C(=O)/C=C\c1ccc(Cl)nc1)CCO2 1544512478 GGIXSKAQLCWGTH-TWGQIWQCSA-N 429.904 4.199 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC(OCCCOc3ccccc3)C2)c1 1587311655 CDAASCVVAZYEEJ-UHFFFAOYSA-N 432.520 4.217 10 10 IICE CCC[C@@H](Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1614402592 GJIJPGFXOXLHLA-QHCPKHFHSA-N 434.588 4.392 10 10 IICE Cc1ccc(C(=O)N[C@@H](Cc2nc[nH]n2)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1616723638 KECRHFYYKYEROT-QFIPXVFZSA-N 427.508 4.047 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cccc(OCC(=O)N2CCCC2)c1 1624304946 HTHWRDGIRKEQPT-UHFFFAOYSA-N 445.519 4.160 10 10 IICE COc1ccc(NC(=O)c2ccc(N=NC(N)=O)cc2)cc1OCc1cn2ccccc2n1 1625150966 XJUMJOLHKFMJMF-UHFFFAOYSA-N 444.451 4.337 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CC[C@@H](Nc3ccccn3)CC2)cc1 1627204641 DGFALNPYVSZBAY-ZDXQCDESSA-N 436.600 4.326 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)cc1F 1627604411 HHNPDUZBCRFPFH-QWFCFKBJSA-N 433.568 4.324 10 10 IICE O=C(CCc1cccc(F)c1Br)NCc1ccc(N2CCSCC2)cc1 1630351365 MXXFAYKPNSFOJH-UHFFFAOYSA-N 437.378 4.390 10 10 IICE Cc1ccc(CCC(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1635126217 JWNSEAQAMASTFN-IBGZPJMESA-N 442.003 4.250 10 10 IICE CCCN(C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(C)C 1639281130 LXPNGAQSMZPVIZ-XNTDXEJSSA-N 441.416 4.297 10 10 IICE CCOC(=O)c1cnc(Sc2n[nH]c(-c3ccc(OC)c(Br)c3)n2)s1 1639879419 VAVJBAZSSZDSQA-UHFFFAOYSA-N 441.332 4.027 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@H]3CCCC(=O)N3C)n2)c(C)n1-c1ccc(F)cc1 1641141977 NWYBBIRALCEOGO-LJQANCHMSA-N 426.517 4.306 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCS[C@H](C)[C@H]1C 1693005551 JIAZSKQLCFSITB-RTBURBONSA-N 436.629 4.017 10 10 IICE CN(Cc1ccco1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1696704807 SKXQTLBMBJZUCU-UHFFFAOYSA-N 425.602 4.407 10 10 IICE C=CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1705940431 FFEBELYPBKTZEO-OAQYLSRUSA-N 437.613 4.497 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCCC[C@@H](COC)C2)cc1 1710025540 DNHMALNPRILINP-OAQYLSRUSA-N 436.604 4.421 10 10 IICE CC(C)[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1741407791 WUSIDNZWQSUGBL-NRFANRHFSA-N 443.592 4.045 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2C[C@H](C)O[C@@H](COC)C2)cc1 1746089495 CJONNCDRLCITFM-WMZHIEFXSA-N 441.620 4.070 10 10 IICE CN(C)c1ccc(Cn2c(Nc3cnn([C@@H]4CC4(F)F)c3)nnc2C(C)(C)C)cc1F 1747577542 RCNBDYIRPVJSCW-QGZVFWFLSA-N 433.482 4.349 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3Cc3csc(C)c3)CC2)cc1F 1748849500 RPBXMNIXYGGUEK-UHFFFAOYSA-N 443.592 4.369 10 10 IICE CCCOc1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cn1 1766295479 FJGISZMJQBNJRM-OAQYLSRUSA-N 437.544 4.094 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc3c(s2)CCCCC3)n1CC(C)(C)O 1767112253 VNUZRNMAVMPJOG-UHFFFAOYSA-N 426.586 4.388 10 10 IICE CCOc1ccc(CCNC(=O)CCNCc2ccc(N(CC)CC)cc2)cc1OCC 1857859565 WFHPNBZFTRCXDN-UHFFFAOYSA-N 441.616 4.169 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2ccc(C(C)(C)C)cc2)N2CCOCC2)cc1 1858074603 NRJYXAPVNBWBTI-RUZDIDTESA-N 437.628 4.172 10 10 IICE CN(C)c1ccc([C@H](CNS(=O)(=O)Cc2ccc(Cl)cc2)N2CCCCC2)cc1 1858074894 VXCHZORXBZSBED-QFIPXVFZSA-N 436.021 4.053 10 10 IICE Nc1ccc(OC(=O)Nc2ncccc2OCC(=O)Nc2cccc3ccccc23)cc1 1858682246 IDXVUWHODAZBAJ-UHFFFAOYSA-N 428.448 4.445 10 10 IICE CCN1C(=O)C(Nc2cccc(C(=O)OC)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422535 BYTGUIMLILZOCI-UHFFFAOYSA-N 443.503 4.093 10 10 IICE Cc1ccc([C@H](n2nc(C(F)F)c(CN)c2I)C2(C)CC2)c(O)c1 2079052210 SPIBJFCCIFTRIW-AWEZNQCLSA-N 447.267 4.288 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NCc3cc(Br)ccc3O)CCC[C@H]2C1 2092949356 WGZDZHFYNYFOKH-XKQJLSEDSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NCc3c(O)cccc3Br)C(C)(C)[C@@H]21 2119291553 SSGOBJDBHJYKLG-CSMYWGQOSA-N 425.367 4.278 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cc(Br)cc(F)c2O)[nH]1 2138331923 PXUBPAHSKPASQP-VIFPVBQESA-N 446.342 4.370 10 10 IICE O=C1C(=Cc2ccc(I)o2)SC(=S)N1Cc1ccccc1 2297297268 ZCMWHIDGUNYIDU-UHFFFAOYSA-N 427.288 4.286 10 10 IICE CCOc1cc(Br)cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)c1O 34240709 AXDVUIBANZFYMB-ZSOIEALJSA-N 449.232 4.199 10 10 IICE CCn1nc(C)c(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c1C 743047081 XBLXANZMTCHUFX-UHFFFAOYSA-N 430.477 4.170 10 10 IICE CCOC(=O)c1csc(C2CCN(Cc3cc(Br)cc(C)c3O)CC2)n1 763500188 RNSWWCPMFILASU-UHFFFAOYSA-N 439.375 4.476 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2csc(-c3cnn(C)c3)n2)C1 769664510 FYKYYOIBTIGAPB-UHFFFAOYSA-N 449.580 4.008 10 10 IICE Cc1ccc(C[C@H](C)N(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 769897841 SCKDRSPZMWSCAH-INIZCTEOSA-N 444.578 4.266 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)[C@@H](O)c1ccc(OCc2ccccc2)cc1 773766452 MAYYXSZATXKYGK-CJAUYULYSA-N 449.547 4.484 10 10 IICE CC[C@@H](Nc1cccc2c1CCN2S(C)(=O)=O)c1cc(Br)ccc1O 775550991 FBXREWMDLAKSQU-OAHLLOKOSA-N 425.348 4.040 10 10 IICE COc1cc(Br)ccc1CNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 779661565 SJEPQUZRTGDCCT-UHFFFAOYSA-N 432.362 4.398 10 10 IICE Cc1sc(NS(=O)(=O)c2cnccc2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 785548218 KTRPPIZWUWZGGI-UHFFFAOYSA-N 444.416 4.241 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C23CC(C(F)(F)F)(C2)C3)NC(=O)OC(C)(C)C)cc1 787075544 ZSLCBHGAYHBKPF-ATIQYGATSA-N 441.494 4.167 10 10 IICE CCN1C(=O)/C(=C\c2cn(CCCOc3ccccc3C)c3ccccc23)C(=O)NC1=S 1084446308 YVDKEFBHSJVCDC-HKWRFOASSA-N 447.560 4.065 10 10 IICE CSc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)ccc1Br 1125187255 CAJIAFUYCWNOJR-UHFFFAOYSA-N 439.350 4.077 10 10 IICE COC[C@]1(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCCCN1C(=O)OC(C)(C)C 1136025790 ZPRNGMZNAHCAFG-VWLOTQADSA-N 445.604 4.051 10 10 IICE O=C(CN(Cc1ccccc1)CC(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1167589661 HEWYPEJPSGQONZ-UHFFFAOYSA-N 434.442 4.168 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@@]3(C)Cc3ccc(F)c(F)c3)cc2)CC1 1246382787 QSVUVBCPAQGPQT-VWLOTQADSA-N 442.554 4.023 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)NC(=O)OC(C)(C)C)cc1 1293791455 BQCFZOKUHHRDJA-YSHGAJCASA-N 437.531 4.116 10 10 IICE CCOCc1nnc(N(CC(C)C)C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1297079364 SIJUPXDNTOVKKF-UHFFFAOYSA-N 431.650 4.287 10 10 IICE CCN(Cc1cc(I)cc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 1307575060 USBYIDYUIDJGMR-UHFFFAOYSA-N 442.253 4.243 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(C(=O)c4ccc(C)cc4C)CC3)C2)cc1 1312901776 HWMHKNSQXZBCLP-OAQYLSRUSA-N 449.595 4.443 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2csc(COc3ccc(F)cc3)n2)cc1 1461343237 DVHKEZQGGNJOCO-UHFFFAOYSA-N 429.517 4.078 10 10 IICE Cc1ccc(C[C@H](CO)CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1Br 1469854486 RPXSPNRBTJWDMM-WMZOPIPTSA-N 448.405 4.035 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4c(F)cccc4F)CC3)C2)cc1 1470592226 APMZUBBJJQEWDT-IBGZPJMESA-N 443.538 4.464 10 10 IICE CN(C)c1ccc(CN2Cc3ccccc3C[C@@H]2C(=O)NCCc2ccc(F)cc2)cc1 1473107121 AOEFXQFWLFBIGT-AREMUKBSSA-N 431.555 4.178 10 10 IICE COc1ccc(N2CCCN(C(=O)NC/C=C/c3ccc(Br)cc3)CC2)cc1 1478701530 XAFKVVCGWMAFIM-DUXPYHPUSA-N 444.373 4.393 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCNc1nccc(C(F)(F)F)n1 1512806282 HCVDETJFCPXCEU-AWEZNQCLSA-N 449.481 4.055 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CCS1 1514155000 HERUBHKBSRTDCA-NHCUHLMSSA-N 429.634 4.274 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(N)=O)CC1 1514197281 TUHQMLSLIZUWPM-WEVVVXLNSA-N 432.572 4.021 10 10 IICE O=C(C[C@@]12CCCC[C@H]1C2(F)F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245789 NPVPHXDWPMNXLH-MJGOQNOKSA-N 432.433 4.374 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Br)cc(C)c3C)cc2F)CC1 1528702119 YNNIYZFXWIMNAP-UHFFFAOYSA-N 448.380 4.277 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CCCCC2 1533785112 ZTBWHIMPFXZVSP-HWOWSKLDSA-N 432.586 4.169 10 10 IICE CCOC(=O)[C@@](C)(NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1537966767 RMCXCYFMPWPXOQ-SANMLTNESA-N 434.536 4.123 10 10 IICE CCSc1ccc(Cl)cc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1538131640 FZVGSRVQJFPFAN-UHFFFAOYSA-N 431.989 4.084 10 10 IICE CCN(CC(C)C)c1nc(CC(=O)NCc2ccc(N3CCSCC3)cc2)cs1 1543098721 IBAVMDRYIBUFEI-UHFFFAOYSA-N 432.659 4.038 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCN(C(=O)OC(C)(C)C)C3CC3)c2C)cc1 1546344213 UVFDYXUYYYIVOC-UHFFFAOYSA-N 427.545 4.232 10 10 IICE CCc1nnc(N2CCC(Cn3cc(C)cn3)CC2)n1Cc1ccc(N(CC)CC)cc1 1546473211 SWKBGTXKNYBZKV-UHFFFAOYSA-N 435.620 4.157 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCC(=O)N(C)C)C1 1546686470 RPVJYZWBTZZGSK-OAQYLSRUSA-N 448.615 4.457 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3NC(=O)c3cccs3)C2)cc1 1557133547 OWQWCBPMAGMGTK-KRWDZBQOSA-N 435.549 4.265 10 10 IICE C[C@@H](NC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)c1ccccc1O 1557965306 BJSCZEWAGKMQEZ-CYBMUJFWSA-N 448.903 4.477 10 10 IICE COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1565273174 OTOSGGOTAXYVJV-HYBUGGRVSA-N 436.600 4.130 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1586061328 PHEKNJSZCHXBSC-RUZDIDTESA-N 445.563 4.239 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)[C@@H]2CCSC2)cc1 1615381133 RCJXGSHZHBDPEH-JOCHJYFZSA-N 436.629 4.100 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](CC)[C@H]2CCCO2)sc(C)c1-c1ccccc1 1617103419 LSQUBPFJUMLSLQ-QZTJIDSGSA-N 430.570 4.386 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](C(F)(F)F)C[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 1625376799 BYTREEAWOLJOCR-WMZOPIPTSA-N 441.494 4.091 10 10 IICE C[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)N(C(=O)OC(C)(C)C)C1CC1 1626105476 DHGGPOBOANIWFN-GCJKJVERSA-N 445.604 4.048 10 10 IICE CC(C)(C)OC(=O)N1CCc2sc(C(=O)NCc3ccc4cccnc4c3O)cc2C1 1627073514 QOYVNWLFEIATFZ-UHFFFAOYSA-N 439.537 4.225 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2CC(c3ccccc3)=NO2)cc1 1633065986 GYZYPCOWAKKZHL-VWLOTQADSA-N 429.520 4.488 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C(=O)NC(C)C)C2)c(C)n1-c1ccccc1Br 1634010313 VSOIMFQYXFCZNA-QGZVFWFLSA-N 446.389 4.233 10 10 IICE C[C@@H](NC(=O)N1CCC[C@H](CC(=O)NCc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 1634434976 JTDZTRLPQDUIOB-UYAOXDASSA-N 440.563 4.081 10 10 IICE COc1cc(OC)cc([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1635800467 ORRJCHYCRCZVPF-JOCHJYFZSA-N 428.916 4.228 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)C[C@@H](O)c1ccccc1Br 1636262675 JBTXVTKZEUNBEZ-HRAATJIYSA-N 448.405 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1c(O)cnc2c(Br)cccc12 1638243831 MZHXBORNNPOBBH-AWEZNQCLSA-N 442.357 4.438 10 10 IICE COc1ccc(N2CC[C@H](Nc3cc(C(F)(F)C(F)(F)F)ncc3[N+](=O)[O-])C2)cc1 1640146383 PYKHVWTUNWVUSA-NSHDSACASA-N 432.349 4.343 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1cn(C)nc1Br 1640759053 JCKTZZREEDZQJJ-UHFFFAOYSA-N 435.347 4.130 10 10 IICE CCN(C)c1ccc(CN2CCC(CO[C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1654430614 XNJXBUDMKOYAHY-HSZRJFAPSA-N 431.621 4.381 10 10 IICE COc1ccc2cc(CN(C)C(=O)[C@H](C)N3CCOc4cc(N(C)C)ccc43)ccc2c1 1658081425 CBWQCARZYCJGEA-SFHVURJKSA-N 433.552 4.160 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCc3ccc(OC(C)(C)C)cc3)CC2)cc1 1685812903 ZMICDAKQGZDSIX-UHFFFAOYSA-N 425.573 4.337 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1C[C@@H](C)O[C@H](C2CC2)C1 1693004871 CRRLATDDECSAMT-GCJKJVERSA-N 425.621 4.293 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1OCCC1(C)C 1694110076 VGMHNNYXXJFTAC-KNQAVFIVSA-N 441.620 4.332 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1695653515 IVBLEBXVRVABAI-NRFANRHFSA-N 440.680 4.458 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)C[C@H]2CCCOC2)cc1 1710025645 IIAKJPAQJYDSGE-OAQYLSRUSA-N 434.588 4.097 10 10 IICE CCOCCN(CC)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(C)CC2)cc1 1710818367 PTHKYIDHEYUOAF-UHFFFAOYSA-N 436.604 4.421 10 10 IICE COCCC(C)(C)Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O 1730620300 KHUFMGMLVXEVSK-UHFFFAOYSA-N 429.590 4.039 10 10 IICE Cc1cccc(OCc2nnc(Nc3ccn(C)n3)n2CCCSc2nccs2)c1 1742367934 MTNBTJXIUDCYID-UHFFFAOYSA-N 441.586 4.282 10 10 IICE CC[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1744890356 PNXAIZDECYYINJ-SFHVURJKSA-N 429.584 4.226 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1763606597 JTZBDXAPGKXAQZ-YLJYHZDGSA-N 429.584 4.298 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1C 1768309984 NJHPHKMRCGMIGZ-JEUIMVHRSA-N 439.629 4.356 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(N3CCN(C(=O)c4cccc(F)c4)CC3)cc2)c1 1860855265 ISWCZCHVHZGLKP-UHFFFAOYSA-N 446.526 4.106 10 10 IICE COc1cc(C)c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1OC 1866044323 UUQATGILJGDUBK-QFIPXVFZSA-N 425.573 4.035 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)sc(C)c1-c1ccccc1 1866047739 MAPKQZGHLBOQSX-IBGZPJMESA-N 448.544 4.497 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(CNCc2cc(Br)cc(F)c2O)CC12CCC2 1966053864 WMPCFKLEZLZFHC-HXUWFJFHSA-N 443.357 4.469 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CNCc2ccc(Br)cc2O)CC12CCC2 2116698717 NLQRPDNDDOQKEN-CQSZACIVSA-N 425.367 4.424 10 10 IICE CN(c1ccccc1)N1C(=O)/C(=C2\C(=O)Nc3ccc(Br)cc32)SC1=S 1237823 QSPYGQCVBGVSNK-CCEZHUSRSA-N 446.351 4.024 10 10 IICE COc1ccc(C2(N3CCN(c4cc(C)ccc4C)CC3)C(=O)c3ccccc3C2=O)cc1 20178135 VVKMEBJGLCSQOT-UHFFFAOYSA-N 440.543 4.409 10 10 IICE CCOc1cc(N(CC)CC)ccc1/C=C1/NC(=S)N(c2ccc(OC)cc2)C1=O 33334360 KACRTWNPCGEAIX-XSFVSMFZSA-N 425.554 4.202 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2nnc(-c3ccccc3)s2)C1 435823794 FBOZLEPHACBWRE-UHFFFAOYSA-N 445.592 4.243 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccnc2OCC(F)F)C1 436043710 VXKIIWZNJJBFOW-UHFFFAOYSA-N 428.483 4.085 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2C[C@@H](C)C(=O)N(C)c3ccccc32)C1 570029421 HLYANKAZSZHHRL-LJQANCHMSA-N 444.579 4.054 10 10 IICE CCOC(=O)C1=C(C)N(C)C2=S=C(c3ccccc3)C(=O)N2[C@H]1c1ccccc1Cl 584906373 LGZZEYHLGSWIMY-IBGZPJMESA-N 440.952 4.047 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2ccncn2)c(C)n1-c1cccc(C(F)(F)F)c1 754919491 BWMSQGNWEOMULK-VOTSOKGWSA-N 429.398 4.342 10 10 IICE CC(=O)Nc1sc(NS(=O)(=O)c2c(C)n(C)c3ccccc23)nc1-c1ccccc1 789741139 WZVGYKMDCMXERR-UHFFFAOYSA-N 440.550 4.369 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H](c3ccc(F)cc3)C(F)(F)F)CC2)cc1 792501125 JIYKODRKNIUSFO-LJQANCHMSA-N 425.426 4.406 10 10 IICE CN1CC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1c1ccc(F)c(F)c1 805242894 GFVNCDRTXYJUKX-IAGOWNOFSA-N 430.282 4.222 10 10 IICE Cc1cc(NC(=O)NCc2cc(Br)ccc2O)ccc1OC1CCOCC1 806290241 JHUPQNZGFUIIPQ-UHFFFAOYSA-N 435.318 4.343 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Cl)c(F)cc3Br)C2)cc1 1130826899 MMYDROWYHAZVEL-NSHDSACASA-N 427.701 4.259 10 10 IICE COC(=O)CCn1nc(C)c(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1C 1149751677 SCWRMINSFUTORI-UHFFFAOYSA-N 428.920 4.376 10 10 IICE C[C@@H]1CCCN(C(=O)OC[C@H]2CCCCN2C(=O)c2cc3cc(O)c(O)cc3s2)C1 1157242444 GIUAFNRGYHACMH-GDBMZVCRSA-N 432.542 4.176 10 10 IICE COC(=O)CCCc1nc(CSc2ncc(-c3ccccc3)n2CC(F)(F)F)no1 1165603925 RRWHVQAGMHQFTK-UHFFFAOYSA-N 440.447 4.283 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NCc2ccc(C)cc2)cc1OC 1167261731 IMVTZBSLOHZLFO-UHFFFAOYSA-N 447.535 4.017 10 10 IICE COc1ccc([C@@H](Cc2ccc(F)cc2)NCC(=O)NCc2ccc(N(C)C)cc2)cc1 1168800708 GCJSUYWTFJPNCL-RUZDIDTESA-N 435.543 4.090 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCN([C@H](C)c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 1234555001 HBYWFSFGUHAFMX-JKSBSHDWSA-N 426.536 4.004 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)N(C)C)cc1 1252261759 SOVSQXNWQZRMQS-ROKPMTFOSA-N 448.615 4.257 10 10 IICE CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1296341898 SBQHRZKEQUCUFD-QHCPKHFHSA-N 425.506 4.093 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(Cc2cccnc2)n1CCOC(C)(C)C 1298313990 FXNQHHIBGMYSOY-UHFFFAOYSA-N 448.615 4.316 10 10 IICE CCOC(=O)[C@@H](C)C1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1303358267 PAMLZAXNEQFMMC-AWEZNQCLSA-N 433.346 4.128 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N(CC)CC)cc2)[C@@H]1Oc1ccccc1 1312537584 VBKOYNAZFHVKQQ-SMIHKQSGSA-N 425.573 4.299 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC(Cc3ccc(C(F)(F)F)cc3)C2)N(C)C)cc1 1313411576 HPBGBJDUHWLHJC-JOCHJYFZSA-N 448.533 4.258 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@@H](C)O[C@H](C3CC3)C2)cc1 1313679632 OXVSNUXNODXCPS-XXBNENTESA-N 425.621 4.375 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3csc(C4CCCC4)n3)cc2F)C[C@@H](C)O1 1356036517 JFZMASWIGAZJEW-HZPDHXFCSA-N 431.577 4.412 10 10 IICE Cc1cc(C)cc([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1448338230 MKYOGIJUPYAMGA-HXUWFJFHSA-N 442.357 4.332 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H]1CCC[C@H](C(F)(F)F)O1 1448683751 HXAZZTRQEGLYAZ-YLJYHZDGSA-N 444.494 4.265 10 10 IICE Cc1cc(C(=O)CS[C@@H](C)c2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1459215222 ZBOLPKQJYFDTAQ-KRWDZBQOSA-N 428.579 4.419 10 10 IICE Brc1cc(CNCCOc2ccc3c(c2)OCO3)ccc1N1CCCCC1 1461088170 IGIXPCRNRYKCTB-UHFFFAOYSA-N 433.346 4.337 10 10 IICE Cc1cc(CC(=O)N2C[C@@H](F)C[C@H]2CN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1467984741 VYBQGCXVDMOIIV-UNMCSNQZSA-N 443.563 4.443 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](COC)C1 1504792480 HABLWXRHXHTORJ-NRFANRHFSA-N 437.588 4.252 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccccc3OC(F)(F)F)cc2F)C[C@H](C)O1 1527481764 QPWWTKSSDDEOOH-KBPBESRZSA-N 426.410 4.268 10 10 IICE O=C(CCc1ccccc1C(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1527864060 HMECEINJUWIYTL-UHFFFAOYSA-N 428.401 4.069 10 10 IICE COc1cc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1C 1530398067 OBCDJEXUNXPVRO-XDHOZWIPSA-N 445.537 4.477 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc2ccc(Br)cc2c(=O)o1 1531705400 HAKPCHFNTKZHIQ-UHFFFAOYSA-N 441.325 4.428 10 10 IICE CCN1CCN(C(=O)c2ccc(NC(=O)c3cc(C)n(-c4ccccc4C)c3C)cc2)CC1 1544547884 WNTKNOOYZNWEHF-UHFFFAOYSA-N 444.579 4.433 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)n1[C@H]1CCCOC1 1544676805 MYVYWJFPZUKWKL-WFXMLNOXSA-N 443.563 4.139 10 10 IICE COC(=O)CCN(Cc1ccncc1)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1545671388 IJVULFSIEWLBOK-UHFFFAOYSA-N 425.916 4.348 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2cccc(O)c2)c(C)n1-c1ccc(Cl)cc1 1545682275 ZNJAMPCFZUWEET-UHFFFAOYSA-N 425.916 4.003 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@H]1CCCO[C@@H]1C(C)(C)C 1554175104 HUZCOPPBGJVWDD-QPPBQGQZSA-N 449.599 4.447 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1 1570017359 LBRBPIBGBYFLPV-DLBZAZTESA-N 435.528 4.418 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC/C=C/c1ccccc1 1583747209 NITWXFCHRANZKH-KYBBCCOLSA-N 426.538 4.247 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCc4cc(Br)ccc43)CC2)cc1 1596732693 GBVFRLUNWRNBHQ-OAQYLSRUSA-N 429.358 4.226 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2ncc(-c3ccccc3Cl)o2)N(C)C)cc1 1616858201 IZBWPFPVNJXTKG-OAQYLSRUSA-N 440.975 4.413 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(-c4ccccc4)cc3)CC2)cc1 1624099037 WKUDDKIGWWCUBU-FOCLMDBBSA-N 441.531 4.206 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccn3-c3c(Cl)cccc3Cl)cc2)CC1 1625144948 BNKXGJOCIGVGIJ-UHFFFAOYSA-N 443.378 4.466 10 10 IICE CCC[C@@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 1625951448 BHYBWFUUVXVGTF-HSZRJFAPSA-N 429.992 4.171 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(-c2ccccc2F)c1 1626512272 ZVNTUSYITZBPRX-UHFFFAOYSA-N 438.503 4.014 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1626722730 HBVDRPKGNPKILS-RXVVDRJESA-N 429.605 4.145 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 1626822176 LLONZCONFBIWDG-UHFFFAOYSA-N 449.308 4.332 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCCN3CCN(c4ccncc4)CC3)c2C)c1 1627098371 CPMQZJPIDMJLQQ-UHFFFAOYSA-N 445.611 4.048 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1 1630181032 RNCWKIUPYBCFHS-FNZWTVRRSA-N 437.584 4.157 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 1635228726 JXTNTLYXYZAFBJ-XMMPIXPASA-N 433.527 4.197 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Oc4ccc(F)cc4F)CC3)C2)cc1 1636354455 XWKUHWFLRXNKDA-QGZVFWFLSA-N 445.510 4.053 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c1 1636715110 ALOVHAMJTJGHGM-FCHUYYIVSA-N 444.453 4.171 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@@H](Oc1ccc(F)cc1Br)c1ccccc1 1639444768 YWFFWELLRHBUBX-FQEVSTJZSA-N 446.272 4.436 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@]2(C)CCc3c(C)c(O)c(C)c(C)c3O2)cc1 1639814437 YLXWQCTWTKVHDG-VWLOTQADSA-N 426.557 4.005 10 10 IICE Cc1cc(CNC(=O)[C@@]2(C)C[C@H](NC(=O)OC(C)(C)C)CCO2)c(C)n1-c1ccccc1 1643369369 CRHDDPOJLZDUPQ-CJFMBICVSA-N 441.572 4.173 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2[C@@H](C)CN(C)C)c(C)n1-c1ccc(Br)cn1 1647771274 ZLWFHLYGOMZKPC-YWZLYKJASA-N 447.421 4.444 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC[C@H](O)c2ccc(C(C)(C)C)cc2)N(C)C)cc1 1648477807 FEOVLHJBHIFGKY-ZEQRLZLVSA-N 425.617 4.283 10 10 IICE COCCN(C[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F)c1ccc(OC)c(OC)c1 1652711319 MACZAAZGFDFGNB-HRAATJIYSA-N 425.447 4.339 10 10 IICE Cc1nnc(N(C)Cc2csc(Br)c2)n1Cc1ccc(N(C)C)c(F)c1 1693463797 UXPJDDMTSQAGEW-UHFFFAOYSA-N 438.370 4.300 10 10 IICE CN(Cc1ccc(F)cc1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1696683846 ZFTNQLUHVNKMDD-UHFFFAOYSA-N 443.577 4.093 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](CC)C1 1728199581 VSNCAKFIXZXAHS-HXUWFJFHSA-N 434.588 4.115 10 10 IICE Cc1cc(-c2nnc(N3CCC(F)(F)C3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1742118469 GFKBOGCGLHPRJB-QGZVFWFLSA-N 428.531 4.148 10 10 IICE CCc1nnc(N(C)[C@@H](C)c2ccc([S@](C)=O)cc2)n1CCCSc1nccs1 1744523819 VNMRAHMIMBWYOU-WNNBVUDTSA-N 449.671 4.414 10 10 IICE CC(C)c1nnc(N2CCN(Cc3cccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1760935027 IBHQSZPEMVFXGF-UHFFFAOYSA-N 442.608 4.039 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)C[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1761004714 YXUOLNZBPVPXMF-SFTDATJTSA-N 439.648 4.216 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1ccsc1 1767770559 RIOPTOICWQJPDK-UHFFFAOYSA-N 425.602 4.355 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1772858951 XRJCWILNDLUPPJ-KRWDZBQOSA-N 432.576 4.154 10 10 IICE COC(=O)c1c(NC(=O)CCC(=O)N2CCCCC2)sc2c1CC[C@@H](C(C)(C)C)C2 1866187649 CPDVGBDIAHGLGZ-OAHLLOKOSA-N 434.602 4.417 10 10 IICE CC(C)C[C@H](C(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)N1C(=O)c2ccccc2C1=O 1891452852 UNHBHOLTFBODQG-ZCVJKFOLSA-N 445.563 4.002 10 10 IICE O=C(O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1O 1951735632 POYHNMNPVQPXNE-FQEVSTJZSA-N 449.459 4.248 10 10 IICE O=C(N[C@@H]1CC12CC(NCc1cccc(Br)c1O)C2)OCc1ccccc1 2026164498 TZQFJQIDSPJQIW-NCYVPVAZSA-N 431.330 4.092 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@](F)(CNCc2cc(Br)cc(F)c2O)C1 2101316951 KXTBUELDRVLKFA-GOSISDBHSA-N 435.309 4.123 10 10 IICE O=C1NN(c2ccccc2)C(=O)C1=C1C(=O)N(Cc2cccc3ccccc23)c2ccccc21 2296466036 FHBFHZPQJBXDGB-UHFFFAOYSA-N 445.478 4.218 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)ccc1O[C@H](C)C(=O)O 2314934533 IAYZQAGMVKLOMN-GFCCVEGCSA-N 447.509 4.482 10 10 IICE CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CN1C(=O)[C@H](CC)SC1=S 11635626 MIXWLAIVVUBQSP-AWEZNQCLSA-N 448.591 4.169 10 10 IICE CN(C)c1ccc(CN2CCC[C@@H](c3ccnc(SCCN4CCCC4)n3)C2)cc1 11967015 ZJCZDCGQYLFGFF-OAQYLSRUSA-N 425.646 4.110 10 10 IICE O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccnc1)N2 14547159 HEPZVZBTBUTURQ-SLSDLSHTSA-N 431.561 4.429 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(\C)Nc1ccc(Br)cc1 17095696 LVZGSMCNNCIVOL-CPNJWEJPSA-N 428.286 4.101 10 10 IICE C[C@H]1CN(C2=NC(=O)/C(=C\c3cn(-c4ccccc4)nc3-c3ccncc3)S2)C[C@@H](C)O1 33808778 ZMSDAPPANQSZRZ-QALXIQJFSA-N 445.548 4.014 10 10 IICE COc1cc(/C=C2\C(=N)N3C=C(C)SC3=NC2=O)ccc1OCc1ccc2c(c1)OCO2 103801838 QMTFPJQVOHBRDE-RNKGJLAXSA-N 449.488 4.170 10 10 IICE Cc1cc(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)c(C)n1-c1ccccc1F 109809529 PUOQEXPTVVCJLD-UHFFFAOYSA-N 434.559 4.407 10 10 IICE COC[C@@]1(CNCc2ccc(Br)cc2O)CCCCN1C(=O)OC(C)(C)C 691394615 FZEZEHRZZHQAFF-FQEVSTJZSA-N 443.382 4.051 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCCc3ccc4ccccc4n3)cc2F)C[C@H](C)O1 744305426 PWSRSMHLUGJTET-ROUUACIJSA-N 436.531 4.029 10 10 IICE CCOC(=O)c1c(NC(=O)CCN(C)Cc2cnccn2)sc(C)c1-c1ccccc1 746458680 UYAQWPSDROQOPJ-UHFFFAOYSA-N 438.553 4.151 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1F 747583914 IEDATTLNXXDMCK-LJQANCHMSA-N 425.426 4.194 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN(C)Cc3nc(-c4cccnc4)no3)c2C)cc1 768553781 ZEWVIYQCMPBLNA-UHFFFAOYSA-N 445.523 4.253 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(NC(=O)NC2CC2)cc1 773144301 DJYPGNJFSKDJIP-HXUWFJFHSA-N 447.627 4.353 10 10 IICE O=S1(=O)CCN(c2ccc(CN[C@H](Cc3ccc(F)cc3)c3ccccc3)cc2)CC1 774184040 AMZJEUSSRXVYFY-RUZDIDTESA-N 438.568 4.134 10 10 IICE COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 786874223 JRSFKIVQGFZFBS-LBPRGKRZSA-N 439.946 4.073 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3c(c2)CCN(C(=O)OC(C)(C)C)CC3)c1 789815446 BNVXWGRISNFOHS-MRXNPFEDSA-N 440.540 4.228 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccnc(-c3ccccc3)c2N)cc1 798284656 JVMZMAVVFZWOAQ-JOCHJYFZSA-N 430.552 4.218 10 10 IICE O=S(=O)(Nc1nc(-c2cccnc2)cs1)c1c(Cl)cccc1Br 800924998 LBHHFIPQZUPOMO-UHFFFAOYSA-N 430.736 4.422 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCCN(C(=O)NCCCSc3nccs3)C2)C1 806959528 WGUWLDRWSDJFER-HXUWFJFHSA-N 440.635 4.058 10 10 IICE COc1ccc(C)cc1[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 823327581 SJIZBWTZGMYPCY-CQSZACIVSA-N 444.443 4.178 10 10 IICE CCc1nc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)sc1C 1125059479 DCPBAFUJHBELEZ-GDNBJRDFSA-N 435.571 4.383 10 10 IICE C/C(=C/c1c(Cl)cccc1Cl)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1125326195 VSQCTAVESYLZPE-MLRPBERTSA-N 446.378 4.415 10 10 IICE COc1ccc(N2CCC(NC(=O)CCc3ccc(OC)cc3Br)CC2)cc1 1125751606 VXDIJRJLXFBBSU-UHFFFAOYSA-N 447.373 4.184 10 10 IICE COc1ccc([C@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1C 1133547460 QZQKIPFNMIDWNA-AWEZNQCLSA-N 444.443 4.178 10 10 IICE C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1163900862 CUUDVKYAOQQUBL-CQSZACIVSA-N 441.881 4.115 10 10 IICE Cc1ccc(CN2CCO[C@@H](CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2)cc1 1163942275 RMAAUEARKSNBQF-QHCPKHFHSA-N 445.519 4.447 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@](C)(C(F)(F)F)C1 1197555802 YRJOXOSXBYQOGK-MCMMXHMISA-N 430.426 4.063 10 10 IICE C[C@H]1CC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)CN1C(=O)OC(C)(C)C 1253921162 OMVZBRBXCJGHBY-PKOBYXMFSA-N 443.544 4.485 10 10 IICE Cc1ccc(C(=O)Nc2ccc(CCS(C)(=O)=O)cc2)cc1-n1c(C)cc(C=O)c1C 1295248642 JLQHJTMOMGVAEN-UHFFFAOYSA-N 438.549 4.054 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC([C@](C)(O)C(F)(F)F)CC2)CCCC1 1296107416 QZONHMGSSDZNSO-QFIPXVFZSA-N 438.490 4.081 10 10 IICE Cc1cnc([C@H](C)Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)s1 1304610334 NTIBTMQNPBKRIN-CRAIPNDOSA-N 427.574 4.083 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCC[C@@H](OC(C)(C)C)C2)cc1F 1314659344 WBNKXDRDGBVKHR-LJQANCHMSA-N 429.584 4.268 10 10 IICE COc1ccc(-c2nnc(N3C[C@H](C)O[C@@H](C)C3)n2CCCSc2nccs2)cc1 1315401140 KEFMIJJWJGIEIH-HOTGVXAUSA-N 445.614 4.206 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)Nc3c(C)nn(-c4ccccc4)c3C)CC2)cc1 1319509823 ASZVLJGKTLVFSC-OAQYLSRUSA-N 447.583 4.037 10 10 IICE C[C@@H](OC(=O)CC1(C(F)(F)F)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1324491735 XUMWFZHOJUVHRD-GFCCVEGCSA-N 445.393 4.065 10 10 IICE Cc1ccc(-c2nnc(N3CCC(CCCO)CC3)n2Cc2ccc(N(C)C)c(F)c2)o1 1361204429 WPCUUOYILFHGTO-UHFFFAOYSA-N 441.551 4.089 10 10 IICE CN(C)c1cccc2sc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cc12 1436624562 QUPDKBVCFUHGJL-UHFFFAOYSA-N 431.508 4.012 10 10 IICE Cc1cccc(N2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)c1C 1440765108 HLDPNWNMPXBVOT-UHFFFAOYSA-N 429.564 4.415 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(O[C@@H]3CC3(F)F)cc2)cc1 1442613883 KKOGMLRUUFAOFQ-FCHUYYIVSA-N 430.495 4.360 10 10 IICE COc1ccc([C@@H](NC(=O)c2cccc(O)c2O)c2ccccc2)cc1Br 1443418517 VODCHOPRLHPZKB-IBGZPJMESA-N 428.282 4.388 10 10 IICE CCCOc1ccnc(CC(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)n1 1443633216 MUZNRYGSWAZPNH-UHFFFAOYSA-N 434.540 4.116 10 10 IICE CC(C)[C@@H]1CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CCS1 1444994820 WHQXJVGLWGIKMY-NIFLVVHWSA-N 438.615 4.017 10 10 IICE CCCN(C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)[C@H](C)CC(=O)Nc1ccccc1 1470771300 CJKWNZIBXBFNAJ-CTNGQTDRSA-N 438.572 4.113 10 10 IICE CCCc1c(C(=O)N[C@H](C)c2ccccc2O)nnn1Cc1cccc(Br)c1 1471195679 KYRFOYRIRBFAND-CQSZACIVSA-N 443.345 4.238 10 10 IICE COCCN(Cc1ccc(F)c(Cl)c1)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1478860644 QBOWTETUKJTVDW-SFHVURJKSA-N 449.954 4.172 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC[C@@H](C(F)F)C2)cc1F 1503392061 DTFLETVNGOHFBP-MRXNPFEDSA-N 432.494 4.019 10 10 IICE COCC1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1504702803 YCMRDWOIPQWOOK-UHFFFAOYSA-N 425.621 4.160 10 10 IICE CC(C)(C)OC(=O)NCC[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2cncc(F)c2)C1 1536029518 UTQVQFPZWTZRMQ-CNZFZVQHSA-N 425.504 4.354 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@H]21 1536551130 XCCYTRGBURDDQE-HFKLLZPISA-N 427.386 4.457 10 10 IICE Cc1onc(-c2cccc(Cl)c2)c1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1537483098 LLJIYRDWVURQIA-HXUWFJFHSA-N 426.948 4.402 10 10 IICE CCN1CCN(Cc2ccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)cc2)CC1 1540930811 COKIBNPYMHNASG-UHFFFAOYSA-N 430.596 4.413 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCO[C@@H](C(F)(F)F)C2)cc1 1547443582 BDEWCWUHKBZHQD-GOSISDBHSA-N 425.499 4.064 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)c1 1556675037 BITBTQNNLOGJEO-UHFFFAOYSA-N 434.540 4.253 10 10 IICE Cc1cc(C(=O)NC2(CNC(=O)OC(C)(C)C)COC2)c(C)n1-c1cccc(C(C)C)c1 1557588271 YQNAFGOASUVNFW-UHFFFAOYSA-N 441.572 4.241 10 10 IICE COC(=O)c1ccc(Br)c(CN(Cc2ccccc2O)C[C@H]2CCCO2)c1 1559635055 JAWWBGDGPAXMII-GOSISDBHSA-N 434.330 4.123 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC(C)(C)OC[C@@H]2C)sc(C)c1-c1ccccc1 1559810468 MOEBCZDYNSYNGX-HNNXBMFYSA-N 430.570 4.338 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)NC(=O)OC(C)(C)C)cc1 1565882058 OFTXBIRQIQMNNV-HXUWFJFHSA-N 449.954 4.470 10 10 IICE Cc1ccc(-c2nc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cs2)n1C 1566356299 BAQOXQJZIVDBNT-KRWDZBQOSA-N 444.988 4.210 10 10 IICE CC(C)(C)OC(=O)N1Cc2cccc(C(=O)NCc3cccc(Br)c3O)c2C1 1568605389 NPLCCXMTQBBDJY-UHFFFAOYSA-N 447.329 4.335 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2c[nH]c3cnc(Cl)cc23)cc1 1583918594 JIYIGLZJIREESD-LJQANCHMSA-N 426.948 4.033 10 10 IICE Cc1cc(C(=O)NCCc2csc(N(C)C)n2)c(C)n1-c1ccccc1Br 1584489307 OFYLPZDPWWDICI-UHFFFAOYSA-N 447.402 4.352 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1616754505 LZXSNBIAZVFRKS-LJQANCHMSA-N 439.556 4.284 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(OCCN2CCCC2)cc1 1617173193 MUNHRIHTKGTXMN-UHFFFAOYSA-N 445.563 4.311 10 10 IICE COC[C@@H]1CCCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1619697373 OQSWXXSCEAEGAW-QGZVFWFLSA-N 444.630 4.150 10 10 IICE CCO[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccc1 1629678642 FGOVHGBROGAHRB-YADHBBJMSA-N 441.572 4.212 10 10 IICE Cc1cc(C(=O)Nc2cnn([C@@H]3CCCCO3)c2)c(C)n1-c1ccc(Br)cn1 1634071340 FGVOGNUHOALZOK-IBGZPJMESA-N 444.333 4.400 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1cccc(Br)c1O)C(C)(C)C 1635840008 PWKDXBPRAHCZEY-CQSZACIVSA-N 429.355 4.100 10 10 IICE COc1ccc(N2CCN(C(=O)NCCCCCCc3ccccc3)CC2)c(OC)c1 1636981977 NBDPLYFJAVLZBG-UHFFFAOYSA-N 425.573 4.339 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)O[C@]3(CCOC3)C2)c(C)n1-c1cccc(Br)c1 1639354780 CHQKYNVIJJEUKZ-JOCHJYFZSA-N 447.373 4.267 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@H](Oc1ccc(F)cc1Br)c1ccccc1 1639444769 YWFFWELLRHBUBX-HXUWFJFHSA-N 446.272 4.436 10 10 IICE CCOCn1nc(C)c(C[C@@H](C)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1C 1642091270 OKXBVPBLLNOMOW-GOSISDBHSA-N 436.600 4.439 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C2)c1O 1647788523 ZTANUOIFPFMWEC-RHSMWYFYSA-N 448.457 4.259 10 10 IICE COC(=O)c1ccc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)o1 1651743164 OUNKAJFSOCLSTE-MRXNPFEDSA-N 426.494 4.084 10 10 IICE COC1CCN(c2ccc(CN3CCN([C@@H](C)c4ccc(F)cc4F)CC3)cc2)CC1 1652472719 BPUJZJWAZIBZJN-IBGZPJMESA-N 429.555 4.459 10 10 IICE Cn1c(-c2ccccc2)cnc1SCC(=O)NCCOc1ccc(C(F)(F)F)cc1 1652516515 RGAYGAXDICOXGT-UHFFFAOYSA-N 435.471 4.393 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1ccc(F)cc1)CC1CC1 1681849758 ILKHXBNUZINOOI-UHFFFAOYSA-N 433.474 4.062 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)CCc3ccccc3)cc2Cl)C1 1682023198 BNOFEWNATOPHRE-NQIIRXRSSA-N 429.992 4.369 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2C[C@@H]2C[C@H]2C)c(C)n1-c1ccccc1 1692981276 FRRRRABREMWZRV-NQIIRXRSSA-N 448.615 4.217 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1695072329 FRYZABXVRBQQTP-GOSISDBHSA-N 437.636 4.435 10 10 IICE NC(=O)CCC1CCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CC1 1698505601 ATKCEBHNDKQJKV-UHFFFAOYSA-N 448.662 4.057 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC[C@H](O)C1 1726984365 HUNVUVWCVXFHSY-ONTIZHBOSA-N 441.620 4.068 10 10 IICE Cc1cc(-c2nnc(N3CC[C@](C)(C(N)=O)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1742120334 XYEUCXZNZGEOCO-VWLOTQADSA-N 434.588 4.100 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@@H](C)[C@@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1761678490 GMTMMMVWCNEJRF-HKUYNNGSSA-N 439.629 4.454 10 10 IICE CCOC(C)(C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1767348148 WLKCJBYXUXWHNZ-OAQYLSRUSA-N 427.593 4.181 10 10 IICE C[C@H]1CCCC[C@H]1NC(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860344975 LLYPJCPFUNCICU-LAUBAEHRSA-N 440.547 4.269 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNCc1c(O)cccc1Br)CC(F)(F)F 2053662000 KGDHADBSSUSTAF-SNVBAGLBSA-N 427.261 4.090 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CNCc3cc(Cl)cc(Br)c3O)[C@H]2C1 2138818898 RVNRBXLHYHGIGT-ILXRZTDVSA-N 445.785 4.401 10 10 IICE CCOc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCc1ccc([N+](=O)[O-])cc1 2297347657 QVWFWGUEWLLGRZ-UHFFFAOYSA-N 448.435 4.023 10 10 IICE COc1ccc(C=C2SC(N3CCN(c4cccc(Cl)c4)CC3)=NC2=O)cc1OC 2297468253 KLMUZHPZYMNQHX-UHFFFAOYSA-N 443.956 4.150 10 10 IICE Cc1ccc(CN=c2[nH]c3c(s2)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352940320 DDCRERXIJDZTCG-UHFFFAOYSA-N 440.363 4.204 10 10 IICE O=C1N=C(O)/C(=C/c2cnn(-c3ccccc3)c2)C(=O)N1c1cccc(C(F)(F)F)c1 1180765 QVWSVGRBCMQSDG-MFOYZWKCSA-N 426.354 4.398 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(CC(C)C)C1=O 33490812 LXJBDXMMUIMRJL-VBKFSLOCSA-N 430.599 4.154 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CC(=O)Nc3ccccc32)cc1 97023923 VHGDKQWYCJSXLB-QHCPKHFHSA-N 429.520 4.420 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\c3ccc(OCc4ccccn4)cc3)CC2)cc1 98006673 GPNZRALZLHRULZ-AUWJEWJLSA-N 429.520 4.031 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(C(C)C)nc4c3cnn4C(C)C)CC2)cc1 108433721 IPSQLTQQGZMPCR-UHFFFAOYSA-N 435.572 4.497 10 10 IICE Cc1cccc2c1OCC[C@H]2NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726711961 CXRTWQQCIJNXPR-HXUWFJFHSA-N 431.483 4.388 10 10 IICE COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)NCc1ccc(N2CC=CC2)cc1 741064166 NEORBWHUBRFPSJ-UHFFFAOYSA-N 448.567 4.409 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc3ncccc23)NC(=O)OC(C)(C)C)cc1 742753575 KFMDGHLZYQJHKG-QFIPXVFZSA-N 434.540 4.297 10 10 IICE CCOC(=O)C1CCN(C(=O)c2ccc(NCc3cc(Cl)cc(C)c3O)cc2)CC1 798085269 NJHJEAXIVWFATQ-UHFFFAOYSA-N 430.932 4.381 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCC(CC(F)(F)F)CC1 807063074 OBEQQJHTWKEQHU-UHFFFAOYSA-N 438.538 4.093 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O 808094205 GARFFWVLIWSABT-UHFFFAOYSA-N 435.879 4.250 10 10 IICE Cc1ccccc1N1C(=O)NC(=O)/C(=C/c2cc(Br)ccc2OC(C)C)C1=O 1084556789 UHKFNGKBAJBJJF-WJDWOHSUSA-N 443.297 4.211 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F)cc1 1130245020 NWTVBVVSZQUJDI-KRWDZBQOSA-N 425.451 4.280 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc3c(N)ncnc3c2)cc1 1136698714 UPHYYYKJHMGRNC-UHFFFAOYSA-N 427.508 4.134 10 10 IICE COc1ccccc1Nc1ncccc1C(=O)NCc1cccc(Br)c1O 1139974513 FSFHRWIBRHXKQO-UHFFFAOYSA-N 428.286 4.232 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCCS(=O)(=O)c2ccc(Cl)cc2)cc1F 1144978519 RECRXNOSUXAYFM-UHFFFAOYSA-N 440.968 4.196 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CCc2cccn2C)c(C)n1-c1ccc(Br)cn1 1146677487 CSVFYBUQOWTFKJ-AWEZNQCLSA-N 429.362 4.341 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCC(C)(C)C[C@H]1c1ccccc1 1153663512 MVEHGLSIQYATRT-HKBOAZHASA-N 439.552 4.298 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](CC(C)(C)C)c3ccc(F)cc3)CC2)cc1 1168593956 OEVWNQSIVMLXLA-UKILVPOCSA-N 443.607 4.084 10 10 IICE CC(C)(c1ccccc1)C1(NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1229779776 ATRJRUOFKRNSKA-UHFFFAOYSA-N 429.511 4.111 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CC[C@@H](C)N(C(=O)OC(C)(C)C)C2)cc1 1234098043 XNPVCGWHVNRYNL-QUCCMNQESA-N 432.609 4.462 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC(Cc4ccccc4OC(F)(F)F)C3)C2)cc1 1252923109 KPKDSNTXRICUNC-SFHVURJKSA-N 449.473 4.057 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3csc(-c4cccc(F)c4)n3)C2)cc1 1276831702 BUDJASFBIWEPNB-MRXNPFEDSA-N 425.529 4.143 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C3CCOCC3)C2)n1CCCSc1nccs1 1287405625 CJZNAUDRMPOCSE-GOSISDBHSA-N 435.663 4.368 10 10 IICE Cc1cc(C(=O)NC[C@H](Cc2ccc(F)cc2)C(N)=O)c(C)n1-c1ccc(C(C)C)cc1 1292140797 FDDUAVVSTPAPOB-NRFANRHFSA-N 435.543 4.431 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1294472505 KJEAGAWEMJKZCY-JOCHJYFZSA-N 438.664 4.075 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(N4CC[C@H](N(C)C)C4)cn3)c2C)c1 1295249033 PTQMLOVFUIRQCX-QFIPXVFZSA-N 431.584 4.499 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CC(C)C)c1ccc(Cl)cc1 1296055781 WYTNFUOYIONHFR-OALUTQOASA-N 433.932 4.172 10 10 IICE Cc1cc(C(=O)NN2Cc3ccc(Br)cc3C2=O)c(C)n1-c1ccc(F)cc1 1301005076 ACDJGZANIJGDCD-UHFFFAOYSA-N 442.288 4.297 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1cnc2ccccc2c1 1313260408 WTHLJZLIWNHEOG-UHFFFAOYSA-N 428.330 4.477 10 10 IICE CC(C)n1ncc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1Br 1354578640 YXIWURPVFBPPSN-UHFFFAOYSA-N 438.281 4.254 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(F)c(F)cc2I)cc1 1355016818 ZHPYWSPXPGEGDO-UHFFFAOYSA-N 444.263 4.346 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3csc(C4CCCC4)n3)cc2F)C[C@@H](C)O1 1356036519 JFZMASWIGAZJEW-IYBDPMFKSA-N 431.577 4.412 10 10 IICE Cc1cc(CC(=O)N[C@H]2CS(=O)(=O)Cc3ccccc32)c(C)n1-c1ccc(Cl)cc1 1437934796 YTWPAJXLIUZACG-QFIPXVFZSA-N 442.968 4.076 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](c2ccco2)N2CCCCC2)cc1 1440545707 JXVZRBLHQMFOGG-DEOSSOPVSA-N 433.552 4.386 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1 1469107294 YHYVYWXAXZGXTF-FQEVSTJZSA-N 429.564 4.205 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@H](C)[C@@H]2C(=O)OC(C)(C)C)CCCC1 1526122691 SNXDKTPLDGDGLY-BXKMTCNYSA-N 440.584 4.498 10 10 IICE Cc1ccccc1C[C@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1527450645 SIDQKMYFJMIONF-RZKQZQCBSA-N 442.581 4.473 10 10 IICE CCCNC(=O)Cc1csc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 1535641296 FSDGKMFFLOQAGL-UHFFFAOYSA-N 444.988 4.454 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(C(=O)N(C)c3ccccc3)c2)N(C)C)cc1 1537482256 BYGUPNDSNHMNDG-VWLOTQADSA-N 444.579 4.062 10 10 IICE CC[C@@H](Cc1ccccc1Br)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1538747692 UKPJLKZJZBCTEF-FUHWJXTLSA-N 431.374 4.422 10 10 IICE O=C(C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F)NCc1ccc(N2CCCC2)cc1 1540811859 LFWBJNWXFWYENU-OAQYLSRUSA-N 449.498 4.353 10 10 IICE CC[C@@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1541080312 FNFFTAKIFOJSRC-XLIONFOSSA-N 435.634 4.186 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1545578327 ZEBDZDCBBMNGHM-AVRDEDQJSA-N 425.621 4.474 10 10 IICE CCS(=O)(=O)N1CCC(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CC1 1556140961 UHWRDLZYIRENMG-UHFFFAOYSA-N 445.629 4.009 10 10 IICE C[C@@]1(C(=O)NCc2ccc(N3CCCCC3)cc2)CCN(C(=O)OCc2ccccc2)C1 1557139716 KSPTXHJJKVJONU-AREMUKBSSA-N 435.568 4.342 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](c3ccccc3C)C(C)(C)C)CC2)cc1 1566233171 VPBBHVDCIHYYDN-ZUSJUXBOSA-N 449.595 4.112 10 10 IICE CCCOc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(OCCC)c1 1566347085 XRPNRWGJAULYLN-UHFFFAOYSA-N 430.520 4.374 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CC(=O)c2ccco2)c(C)n1-c1ccc(Br)cn1 1566416676 YJKQOFJYARAILQ-LBPRGKRZSA-N 430.302 4.236 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3cc(C)c(Br)cc3C2)c([N+](=O)[O-])c1 1612966287 BYBJQGVTLPYBQR-GQCTYLIASA-N 431.286 4.415 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)[C@H]1C 1613037199 GVFRETIBTRZNLZ-TWOQFEAHSA-N 433.597 4.103 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CCC(C)(C)C2CC2)CCOC1 1616151278 BCBSQEJBLDEHHN-DEOSSOPVSA-N 428.577 4.099 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCc3sccc3C)CC2)cc1F 1619302164 JMYXWZFJEYWTEA-UHFFFAOYSA-N 443.592 4.488 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CCCO1 1619827653 SUKVVBDUOBZVMT-VWLOTQADSA-N 437.588 4.394 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc4nc(O)n(CC(C)(C)C)c34)CC2)cc1 1623429649 KNHHIGAORXDAOE-UHFFFAOYSA-N 436.556 4.149 10 10 IICE CC(C)(CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1625482645 WLPMRTUZTOLTMP-UHFFFAOYSA-N 444.578 4.352 10 10 IICE O=C1CC(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)(c2cccc(Cl)c2)C1 1630261902 GCHWSXIARCQHMW-LJQANCHMSA-N 447.362 4.081 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1ccc(Cl)c(Cl)c1 1630280633 OTJJDQXOZMPNSV-ACJLOTCBSA-N 445.293 4.413 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc([C@@]4(C)NC(=O)N(C)C4=O)cc3)c2C)c1 1639233149 TZECBINUIBHRQT-AREMUKBSSA-N 444.535 4.360 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)c(C)n1-c1cccc(Br)c1 1641854346 RQEOEXABIHKFJV-INIZCTEOSA-N 446.389 4.233 10 10 IICE CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1Br 1643940119 IEGLFCAYWNVGOT-UHFFFAOYSA-N 449.304 4.299 10 10 IICE COc1cc2c(=O)ncn(CC(=O)c3cc(C)n(-c4ccc(C)c(F)c4)c3C)c2cc1F 1656446273 XZAKGZHNHFMEDO-UHFFFAOYSA-N 437.446 4.282 10 10 IICE COc1ccc([C@H]2CCCCCN2C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1675580155 JCQQOICIRDTFCQ-RUZDIDTESA-N 436.600 4.274 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CC[C@H](c2ccc(Cl)cc2)C1 1683014250 NVMIPNNNXQIPST-KRWDZBQOSA-N 435.902 4.154 10 10 IICE CC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1683303106 JZIRFIXYGOBJJJ-FQEVSTJZSA-N 448.571 4.173 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC[C@H](O)c3ccc(Cl)c(Cl)c3)C2)cc1 1683944845 LJDVXOWCFWZJMN-YWZLYKJASA-N 438.355 4.004 10 10 IICE COc1ccc(C[C@H]2CCCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1687806960 LVXVSTISHYQYNR-ILBGXUMGSA-N 438.616 4.171 10 10 IICE COc1ccc(C[C@@H]2CCCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1687806963 LVXVSTISHYQYNR-UKILVPOCSA-N 438.616 4.171 10 10 IICE CC(C)c1nnc(N(C)[C@@H]2CCCc3c2cnn3C)n1CCCSc1nccs1 1706278995 YXGXEKJYYCMKPF-MRXNPFEDSA-N 431.635 4.288 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@@H]2C)n1CCCSc1nccs1 1708723695 BMXKFPFBMIPHPU-GJZGRUSLSA-N 436.651 4.070 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1CCC1=CCCCC1 1712627159 CPPMAOQPCLBYHW-UNMCSNQZSA-N 426.561 4.235 10 10 IICE Cc1nnc(N2CCC[C@H](C(=O)c3ccc(F)cc3)C2)n1CCCSc1nccs1 1742813882 BKPIMTVZJLMRQI-KRWDZBQOSA-N 445.589 4.464 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CCO[C@H](C)C3)CC2)cc1 1748847130 HFQYBIYTMROXDR-UXHICEINSA-N 441.620 4.116 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N(C[C@@H]1CCOC1)C1CC1 1751432564 JRQUWNOGBHXOFZ-IBGZPJMESA-N 425.621 4.295 10 10 IICE CCC(CC)[C@@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)N1CCOCC1 1764067347 RGQZHJDWEGVHPQ-OAQYLSRUSA-N 443.636 4.055 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1764937038 MYTIQQJWDNKTOQ-DEOSSOPVSA-N 448.615 4.020 10 10 IICE CCOCc1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N2CCSCC2)cc1 1767816555 TUXLJHHFXIKHRJ-UHFFFAOYSA-N 443.661 4.289 10 10 IICE CCCOC(=O)c1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCCO4)SC2=S)c1 1860086837 KHHNUTJKOFRIJJ-XDHOZWIPSA-N 441.530 4.430 10 10 IICE N=C1/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)N=C2SC(C34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)=NN12 2059072193 GEXHFOWXBJYTJR-HHIUSEMDSA-N 435.509 4.430 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C(F)F)c(CN)c1I 2079849019 QRXSHUZNXIJCKT-LBPRGKRZSA-N 435.256 4.206 10 10 IICE COC(=O)c1c(C(F)F)nn([C@H](c2ccc(OC)cc2O)C2CC2)c1Br 2079875122 OVHYQRGQWSDUPS-AWEZNQCLSA-N 431.233 4.083 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@H](NCc1cc(Br)ccc1O)C2 2232281993 NPXSFUXFGZVIHC-SJWGOKEGSA-N 425.367 4.326 10 10 IICE CCCCN1C(=O)C(=Cc2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 2314414673 IMBBTEDFPOKXOI-UHFFFAOYSA-N 442.610 4.440 10 10 IICE COc1cc(N2C(=O)C(=Cc3ccccc3[N+](=O)[O-])SC2=S)cc(OC)c1OC 2321738516 KIZMBCJBHBCBRG-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CC(C)CN1C(=O)C(=Cc2ccc(OCC(=O)Nc3nccs3)cc2)SC1=S 2331594989 YXCIHLXEKHRLBD-UHFFFAOYSA-N 433.580 4.018 10 10 IICE CCOC(=O)c1ccccc1-c1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)o1 2957925 BWTIJZAEBZXCFF-XSFVSMFZSA-N 444.443 4.098 10 10 IICE CCN(c1cccc(C)c1)c1ncnc(N2CCN(c3ccc(OC)cc3)CC2)c1[N+](=O)[O-] 40572256 CSVSLAMWKIJXKH-UHFFFAOYSA-N 448.527 4.186 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)c2cccc(OCc3cscn3)c2)cc1 96982870 WZGNMEVVZOHMHQ-UHFFFAOYSA-N 433.537 4.285 10 10 IICE Cc1ccccc1/C=C1/SC(=S)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 205691596 REZIFLTXQMUFFR-SFQUDFHCSA-N 427.507 4.133 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(Cl)c2-n2cncn2)C1 435609794 CBMQXGOFOKGAPR-UHFFFAOYSA-N 448.958 4.281 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2ccccc2-n2cccn2)C1 435815520 DKICKTFZEJRBJS-FQEVSTJZSA-N 441.579 4.471 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC[C@H](CCNCc2cc(Br)cc(F)c2O)C1 715813142 MGOPGZCXMDOELE-DOMZBBRYSA-N 431.346 4.467 10 10 IICE CC[C@@H](Oc1ccccc1C(C)C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 730030588 KQXSMONVUDWGSS-HSZRJFAPSA-N 428.548 4.384 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](c3cc(F)ccc3F)C(F)F)CC2)cc1 788753299 FQBRIKSXNGZVQT-LJQANCHMSA-N 425.426 4.202 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(Br)nc1 810229155 UERWFSIGTNJONV-KRWDZBQOSA-N 429.406 4.227 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC(c3noc4cc(F)ccc34)CC2)c([N+](=O)[O-])c1 811848560 KHQPGSPBHFJIFC-XVNBXDOJSA-N 425.416 4.445 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CC2(CNC(=O)OC(C)(C)C)CC2)cc1 1125893181 FHQYHGITIWZUHQ-UHFFFAOYSA-N 443.510 4.339 10 10 IICE COc1cccc(-n2cc(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)nn2)c1 1128490578 VQUWOEMLPHFDMM-MRXNPFEDSA-N 439.947 4.096 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)CCCC1 1137973482 XQPMKQZVSVEUFR-JOCHJYFZSA-N 430.907 4.171 10 10 IICE COC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1140146106 AQTFKYLZHXEMPT-HXUWFJFHSA-N 432.520 4.039 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CC(c4ccc(Cl)cc4Cl)=NO3)C2)cc1 1162718790 QQAUQAZMMUAFNS-SZNDQCEHSA-N 448.350 4.138 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 1179028840 FAAPQDVQIPJULN-KRWDZBQOSA-N 442.437 4.229 10 10 IICE CO[C@H](C)c1nc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cs1 1294344059 JOYSTZGAKZWVBR-CYBMUJFWSA-N 449.374 4.346 10 10 IICE Cc1cc(C(=O)N[C@@H](C(=O)OC(C)(C)C)c2ccnn2C)c(C)n1-c1cccc(Cl)c1 1300240232 LHFXTZPFUBTOKN-HXUWFJFHSA-N 442.947 4.294 10 10 IICE CCC[C@@H](Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1306589585 INQJTOWWUDAZMG-QHCPKHFHSA-N 441.620 4.224 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(C)c3C)C2)sc2c1CCCC2 1347874828 GGHCDNHAOWERHY-INIZCTEOSA-N 440.565 4.412 10 10 IICE Cc1cc(C(=O)Nc2ccc(C(N)=O)c(Cl)c2)c(C)n1-c1ccc(Br)cn1 1444198790 ZQGOYFBIYKAFIS-UHFFFAOYSA-N 447.720 4.256 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1445639098 PHTUQDWQPBXPPL-XLIONFOSSA-N 432.492 4.109 10 10 IICE Cc1ccccc1C(C)(C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1450155688 AHFZBOGAIJPYJG-UHFFFAOYSA-N 430.551 4.228 10 10 IICE Cc1cc(COc2ccc(C(=O)N3Cc4cccc(O)c4C3)cc2Br)on1 1455035667 BRJDAXGVSPIXSH-UHFFFAOYSA-N 429.270 4.186 10 10 IICE Cc1cc(CN2CCNC(=O)[C@H]2c2cccc(Br)c2)ccc1N1CCCCC1 1459768997 HOIRPXUQKCSWQI-JOCHJYFZSA-N 442.401 4.421 10 10 IICE O=C(Cc1nc(C(F)(F)F)cs1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1464701482 ACJQODNXDGPXAM-UHFFFAOYSA-N 435.418 4.091 10 10 IICE CC(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1O 1466396436 LWWXXMKOJQVVNH-UHFFFAOYSA-N 443.547 4.212 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1478956778 JANWONJCSNLMEY-JOCHJYFZSA-N 432.568 4.223 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1509256048 RPMAGPRLQMALFI-NRFANRHFSA-N 436.579 4.390 10 10 IICE CN(Cc1cccs1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1517152064 AGBMXBHPWJDMAV-UHFFFAOYSA-N 429.600 4.072 10 10 IICE CC[C@H]1CO[C@H](CC)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1531531948 GZGXILYCWWIEDI-LVRDFQQOSA-N 438.640 4.146 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1[C@H]2c3cc(Br)ccc3C[C@H]21 1536551131 XCCYTRGBURDDQE-ITGOXPRASA-N 427.386 4.457 10 10 IICE CC(C)N(C)CC1CCN(c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1541598836 MMGCZDBQMLOAGY-UHFFFAOYSA-N 442.627 4.356 10 10 IICE Cc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C2CC2)n1 1544270013 ZTLIJAKADUKFJG-OAQYLSRUSA-N 438.572 4.329 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC[C@H]1OC 1545503755 HOIGYZJDOHWWEQ-SXWKCWPCSA-N 441.620 4.332 10 10 IICE CC(=O)c1ccc(N2CCN(C(=O)CSc3ncc(C(C)(C)C)s3)CC2)c(F)c1 1559384649 PDKKGJZDPSPJQB-UHFFFAOYSA-N 435.590 4.223 10 10 IICE CC[C@H](c1ccccc1)N1CCN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 1564962684 NDUVIIJZSKPACR-PXDATVDWSA-N 436.600 4.000 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1[C@@H]2c3cc(Br)ccc3C[C@H]21 1565256057 KWRVONVLQOLPJU-NJDAHSKKSA-N 428.374 4.385 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H](O)COc2cccc(F)c2)cc1 1566327613 BABNLWRAZDUVIY-FQEVSTJZSA-N 436.487 4.477 10 10 IICE CCCN1CCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C(C)(C)C1=O 1567851511 XSWOMZCOLSDZFU-UHFFFAOYSA-N 446.389 4.330 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)cc1 1583919902 TYDLZCCAQBARIN-HXUWFJFHSA-N 448.523 4.218 10 10 IICE Cc1cc(CCNC(=O)[C@H](O)c2cccc(Br)c2)c(C)n1-c1ccccc1 1586622374 SQTQONZAZXQXNG-OAQYLSRUSA-N 427.342 4.249 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(Br)cc3C(F)(F)F)C2)cc1 1587114504 RYLIVDHESHQZJB-CYBMUJFWSA-N 443.263 4.485 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N2CCCC2)c(C)n1-c1cccc(C(C)C)c1 1587610682 APRCQUSZHPKQIK-QFIPXVFZSA-N 425.598 4.355 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)cc1 1623590222 UJKVCUSFUQANAN-UHFFFAOYSA-N 433.434 4.216 10 10 IICE C[C@H](NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1)c1ccc(N2CCOCC2)cc1 1626978470 QWWBPEKGIQHADR-AWEZNQCLSA-N 444.507 4.493 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)C[C@@H](C)NC(=O)OC(C)(C)C 1627448072 JYYCIASWBPOHRY-JKSUJKDBSA-N 427.545 4.328 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1628720588 VBMCRBQPQIRUKH-FQEVSTJZSA-N 425.573 4.352 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](CN1CCCC1)c1ccccc1 1629055398 IWNCBAIMUPOIOR-NFBKMPQASA-N 443.538 4.253 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@@H](O)c3ccc(OCc4ccccc4)cc3)C2)cc1 1629083177 HOGPGTMLLQKWLI-BKMJKUGQSA-N 446.547 4.093 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCO[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1C 1629640100 UHUHSQIUBCZXEX-AVRDEDQJSA-N 441.572 4.157 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3CCCN3Cc3ccc(Cl)cc3)CC2)cc1 1632043986 AXXGTYKRUKHECG-QHCPKHFHSA-N 427.976 4.098 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](COC(C)C)C2)c(C)n1-c1ccccc1Br 1633322132 ZKQGYHRSZIKEFU-QGZVFWFLSA-N 435.362 4.123 10 10 IICE CCc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(O)c1 1634162724 NGRHLUDMTBFGRS-FQEVSTJZSA-N 427.545 4.016 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2 1634939815 TXIXWIQPSDUFOX-UHFFFAOYSA-N 431.529 4.101 10 10 IICE O=C(NCc1cccc(O)c1O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 1644708499 LWIMKJICFXBEML-UHFFFAOYSA-N 427.844 4.202 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1647948438 CVBPULUECQIXKR-FGZHOGPDSA-N 441.572 4.075 10 10 IICE C[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1648229043 QNZBGQBUVISLAH-HUUCEWRRSA-N 443.459 4.048 10 10 IICE COC(=O)c1cnc(SC[C@@H](CNC(=O)OC(C)(C)C)c2ccc(OC)cc2)s1 1652002187 HURNKMXTAAWQCC-CQSZACIVSA-N 438.571 4.339 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@@H]1C[C@@H]1CN(C(=O)c2cc(O)cs2)c2ccccc21 1652447833 LTTMZOIVZJOUAE-CVEARBPZSA-N 444.553 4.224 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H](c4cncn4C(C)(C)C)C3)C2)cc1 1683339762 FTMKSMWOQUXKPI-WOJBJXKFSA-N 439.604 4.062 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@H](Cc3ccccc3)c3ccccn3)CC2)cc1F 1687863010 ADMXXIWWPZIUQS-NRFANRHFSA-N 448.542 4.087 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CC[C@@H](OC)C2)cc1 1695617143 KJPMFJZYUKNHKR-HXUWFJFHSA-N 440.979 4.113 10 10 IICE Cc1ccc(N(C)c2nnc(C(=O)NC(C)C)n2CCCSc2nccs2)cc1 1707510198 QUZBPXNMIPKMRL-UHFFFAOYSA-N 430.603 4.132 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2cccnc2)n1Cc1ccc(N(C)C)c(F)c1 1731100591 HSPPOEWUVFFUMR-MRXNPFEDSA-N 428.581 4.171 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(CC)[C@@H](C)C2CCC2)cc1 1746090308 UGMIGHUOBOBVLN-AVRDEDQJSA-N 438.620 4.139 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC[C@@H]4OCC[C@@H]4C3)nnc2C(C)(C)C)cc1 1746095085 JDCMFSVLINKLJH-IRLDBZIGSA-N 425.621 4.475 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)CC2CCCC2)n1Cc1ccc(N(C)C)cc1C 1770183590 GTPCOIHQZBXKPW-GMAHTHKFSA-N 441.620 4.051 10 10 IICE CCCN(C)c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1772870143 FCFGKIUYPLJWRA-UHFFFAOYSA-N 447.587 4.056 10 10 IICE CCCCCN1C(=O)C(NCCCOCC)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873170075 NHSFHXJLHYMESU-UHFFFAOYSA-N 437.584 4.380 10 10 IICE C[C@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1cc([N+](=O)[O-])ccc1O 1951719951 DLGKTAHYTZLCDX-XMMPIXPASA-N 448.431 4.139 10 10 IICE CCc1ccc(-c2ccc(C=C3SC(=S)N([C@H](CCC(=O)O)C(=O)O)C3=O)o2)cc1 2040480457 QLZUQKHPLKDSDM-OAHLLOKOSA-N 445.518 4.028 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C2(C)CC2)c(C=O)c1I 2080048925 ZNJOVJLTKHERHT-AWEZNQCLSA-N 440.281 4.065 10 10 IICE COc1ccc(Br)c(CNC[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c1O 2236055658 QXIOWJVGHXJWAH-HXUWFJFHSA-N 443.382 4.290 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCSc1ccccc1 2297347744 YMBOVJKRXBNNNJ-UHFFFAOYSA-N 435.505 4.317 10 10 IICE CCCCN1C(=O)C(=Cc2cc3cccc(C)c3nc2N2CCOCC2)SC1=S 2314648107 OQEOXTDNNAZQNY-UHFFFAOYSA-N 427.595 4.381 10 10 IICE COC(=O)c1c(NC(=O)C=CC(=O)NCc2ccccc2)sc(C)c1-c1ccccc1 2321560511 JNANAMOEPUNZIS-UHFFFAOYSA-N 434.517 4.321 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CC=C[C@H]21 14473356 ZALBRIVEQAUVNA-NVAPDCRFSA-N 427.888 4.451 10 10 IICE N=C1/C(=C\c2cccc(Br)c2)C(=O)N=C2SC(Cc3ccccc3)=NN12 33424263 QFJKHYCBUNLNDY-INIXKHHFSA-N 425.311 4.311 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)c4ccc(F)cc4)c(C(=O)O)c3)CC2)cc1 64589455 PXBFUHGVRJFJJV-UHFFFAOYSA-N 449.482 4.111 10 10 IICE C[C@H](C1CC1)n1nccc1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 776021569 AXGUFJRSJZFSBH-CQSZACIVSA-N 437.466 4.031 10 10 IICE COc1cccc([C@H]2[C@@H](NC(=O)c3cc(C)n(-c4ccccn4)c3C)CCN2C2CC2)c1 778494447 NNWYJSDFECIQFD-ZCYQVOJMSA-N 430.552 4.206 10 10 IICE Cn1ncc(Br)c1/C=C1\SC(=S)N(c2ccc(OC(F)F)cc2)C1=O 779202324 AFBXNZOITSFXTD-SDQBBNPISA-N 446.298 4.190 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1 797635443 PUFRXFCDRMEBLF-QGZVFWFLSA-N 443.507 4.157 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)NCc3cc(Br)ccc3O)cc2)C[C@@H](C)O1 806246205 SZDQDYLNMFANKD-OKILXGFUSA-N 434.334 4.090 10 10 IICE Cc1cc(C(=O)CN2CCC(CC(=O)N3CCCC3)CC2)c(C)n1-c1ccc(F)cc1 917120178 ZXGURZALDKDABY-UHFFFAOYSA-N 425.548 4.140 10 10 IICE Cc1cc(CC(=O)N2CCNC(=O)[C@H]2c2cccs2)c(C)n1-c1ccc(Cl)cc1 1126584936 CMAQLZJHRGOPFZ-OAQYLSRUSA-N 427.957 4.051 10 10 IICE Cc1ccc(N2CCC[C@@H](NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2=O)cc1 1137039179 RUXSWINLRYNHCM-RUZDIDTESA-N 443.547 4.069 10 10 IICE C[C@@H](NC(=O)C1CC2(C1)C[C@@H](NC(=O)OC(C)(C)C)CCS2)c1ccc(N(C)C)cc1 1138363831 RFHKQXQNLAGRDX-YEMFZGSSSA-N 447.645 4.499 10 10 IICE Cc1cc(C(=O)NCc2cnc(N3CCOCC3)s2)c(C)n1-c1cccc(C(C)C)c1 1139466991 PAYDOJXHDZLYBQ-UHFFFAOYSA-N 438.597 4.441 10 10 IICE Cc1ccc(F)c(Br)c1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1147838201 RGFNMBCWJTVOKW-UHFFFAOYSA-N 435.337 4.035 10 10 IICE CNS(=O)(=O)c1cccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c1C 1149655321 BNJAONMWBCVXRR-UHFFFAOYSA-N 425.554 4.180 10 10 IICE CCn1ncc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1-c1ccccc1 1150347538 JSMKBCIRYFNEOJ-HXUWFJFHSA-N 438.959 4.323 10 10 IICE C[C@H](NC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(N(C)C)cc1 1154667933 ADCWZVZLQTUEGU-SFHVURJKSA-N 443.547 4.469 10 10 IICE CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1235243225 LRXILQXCEIKOHS-BJKOFHAPSA-N 439.600 4.239 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3C[C@H]3c3cccc(Br)c3)C2)cc1 1245988063 LWQKLZOANXNQLB-ONGXBYRLSA-N 444.373 4.139 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)c1 1291929740 UGNVNTUVHAAZJY-XMMPIXPASA-N 430.552 4.105 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CCCCS1 1298314907 LDLUIKQXYVPPEN-OAQYLSRUSA-N 443.661 4.334 10 10 IICE COC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(F)(F)F)C1 1301298727 WMKKYUNCFNUQQA-KRWDZBQOSA-N 433.478 4.388 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cc(OC)c4ccccc4c3)CC2)c(OC)c1 1313381763 SVVGZDDHUKBCJF-SFHVURJKSA-N 449.551 4.458 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(F)cc1I 1352614589 GZUADFNZESMKIM-UHFFFAOYSA-N 438.284 4.303 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1356037311 WCJSXMVBVJHHML-IYBDPMFKSA-N 436.474 4.246 10 10 IICE CC(C)CN1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1360028266 ZXSRLPRZPOTVRD-UHFFFAOYSA-N 438.664 4.075 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C3)c2C)c1 1454059915 ICGQYJCFAXVQSD-QRWLVFNGSA-N 435.490 4.240 10 10 IICE C/C(=C\c1cccnc1)C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1462930747 NBMOORKRYYJDSJ-GANRHZMWSA-N 425.504 4.354 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cccc(Br)c1O)C1CCCCC1 1467761299 OVDIHJUJOSWQOR-INIZCTEOSA-N 441.366 4.245 10 10 IICE CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1470968876 LKDWMHMHPBKMQP-AUSIDOKSSA-N 438.616 4.363 10 10 IICE CCOC(=O)[C@@H](C[C@@H]1CCCO1)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1471779851 AGSSVVASAWFBDB-JTHBVZDNSA-N 426.557 4.448 10 10 IICE Cc1csc([C@H](C)Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1492638985 KXFSWCZFMOKGDA-QAPCUYQASA-N 427.574 4.083 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2ccc[nH]2)n1CCCOC(F)F 1503473227 LCQNIKMNRNRQKD-UHFFFAOYSA-N 430.503 4.139 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@H]1CSCCS1 1517146865 HJWVXXBVHGNBOP-KRWDZBQOSA-N 432.640 4.121 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@]3(C(=O)O)CCCN(Cc4ccccc4)C3)c2C)c1 1517274468 CXVVRJHTYBGAMZ-HHHXNRCGSA-N 445.563 4.252 10 10 IICE CO[C@H](Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1517838128 JOKVTUWQHXSENM-XZOQPEGZSA-N 441.620 4.427 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)O1 1524586167 IKLSGODATJWWQG-ZFCZOSEKSA-N 430.932 4.071 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)NCc2ccc(N(C)C)cc2C)cc1 1530833040 ATYWWQLUSAHTPK-UHFFFAOYSA-N 427.346 4.248 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4C)c3C(F)F)CC2)cc1 1544744664 KQUJLRLPHWSHGR-UHFFFAOYSA-N 426.467 4.089 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(Br)nc(Br)c1 1545504937 MPGJUUAYEWILDU-UHFFFAOYSA-N 428.124 4.365 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1nc(C)cs1 1545538045 UKXBFKRYPDNCGO-OAHLLOKOSA-N 444.580 4.079 10 10 IICE C[C@H](O)c1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1F 1556525223 KLSABNFOJONMCE-NNLQFVHNSA-N 448.516 4.248 10 10 IICE CCOC(=O)C1=C(CSc2ncc(-c3ccccc3)n2C)NC(=O)N[C@@H]1c1ccccc1 1559341778 CCMMHKQROVVKED-OAQYLSRUSA-N 448.548 4.051 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCC(=O)N(c3ccc(C)c(C)c3)C2)cc1F 1585698720 XDSMHFNEEKUHJA-FQEVSTJZSA-N 425.548 4.348 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC(Nc3cccnn3)CC2)cc1 1615376074 PTZXVQJVSRAYBR-UHFFFAOYSA-N 448.619 4.167 10 10 IICE C[C@H]1CSc2ccccc2N1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1615994935 NLGUFJBZSQOJKN-RCCFBDPRSA-N 443.588 4.056 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC[C@H]2C(=O)N=S(C)(C)=O)cc1 1625972307 HULZZSUOGZKLCO-FQEVSTJZSA-N 441.557 4.027 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(OC(C)(C)C)cn1 1626511044 FOHZUGOJRLBNNT-UHFFFAOYSA-N 427.545 4.261 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](C)[C@@H]3CN(Cc4ccccc4)CCO3)c2C)c1 1628542987 QIXOBCHMSRQGIU-RLWLMLJZSA-N 431.580 4.422 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(CCCc4ccccc4)C3=O)c2C)c1 1635228181 FKQXTDFNIMVANQ-RUZDIDTESA-N 429.564 4.366 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CC(=O)N(c2cccc(C)c2C)C1 1635673527 QGUSZVWGICKPQX-KRWDZBQOSA-N 445.357 4.173 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)c1 1636061004 BIMDWZBXZWCPCD-GFCCVEGCSA-N 429.879 4.359 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1 1638024029 QIYZFPIMBOTCOI-NRFANRHFSA-N 439.556 4.424 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)/C=C/c1ccc(O)c(OCC)c1 1639827476 VSFYPQOJJZYELE-UXBLZVDNSA-N 440.540 4.193 10 10 IICE C[C@]1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CCN(C(=O)OCc2ccccc2)C1 1641997691 VJUYNKXOODNNLH-NRFANRHFSA-N 437.323 4.364 10 10 IICE CCOc1ccc([C@@H](C)NC(=O)CN2CCCc3cc(OC(F)F)ccc32)cc1OC 1644806675 UBPXQBXQWKCWIW-OAHLLOKOSA-N 434.483 4.325 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccc(NC(=O)N(C)C)cc3)c2C)c1 1681976748 KMVPVLYPFGJHFC-UHFFFAOYSA-N 433.556 4.495 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(n4ccc([N+](=O)[O-])n4)CC3)c2C)c1 1683302978 GIAZLWXFNGQRNL-UHFFFAOYSA-N 436.516 4.054 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1(Cc2cccc(F)c2)CCOCC1 1686826168 CEPLGYFYOLNMTG-IBGZPJMESA-N 427.564 4.222 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2C[C@@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1692987736 LOVZHOSTJXWENJ-PXNSSMCTSA-N 448.615 4.360 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H]3[C@@H](COC)[C@@H]3C2)n1Cc1ccc(N(CC)CC)cc1 1694157391 CMSAMTFBXKYFBX-XSEFMFLKSA-N 425.621 4.405 10 10 IICE CC(C)COCCCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1706533405 DSOSZUYZAGOCFL-UHFFFAOYSA-N 429.952 4.398 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)CNC(=O)OC(C)(C)C 1708398695 AVKHFRWPCRFGCS-IAGOWNOFSA-N 431.581 4.294 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3CCCOC3CCCCC3)CC2)cc1 1730181850 SCGCPWSJAZNETB-UHFFFAOYSA-N 427.593 4.051 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)C[C@H]1C 1741261824 IFTVYJVICACOGK-HXUWFJFHSA-N 446.599 4.376 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C(N)=O)C3)n2CCCC(C)(C)C)c(C)n1-c1ccccc1 1742119656 OZMFSXFZNFGEHR-FQEVSTJZSA-N 448.615 4.491 10 10 IICE Cc1ccc(CN(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)o1 1751501377 CEGGQLJHSJTZFN-UHFFFAOYSA-N 441.551 4.137 10 10 IICE COC1(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCC(C)CC1 1769769659 HMYOLRRHYRYCRA-RUPGZQMFSA-N 428.577 4.457 10 10 IICE COC(=O)c1c(NC(=O)C(=O)NCc2ccccc2)sc(C)c1-c1ccc(C)c(C)c1 1860760878 GPQHAFSTLQVUGP-UHFFFAOYSA-N 436.533 4.382 10 10 IICE CCOc1cc(/C=C2/C(=O)N(Cc3ccc(F)cc3)N=C2C)cc(Br)c1O 1865667381 UEUPCPWUNWKSLX-LZYBPNLTSA-N 433.277 4.494 10 10 IICE COC(=O)c1c(NC(=O)C2(C(=O)O)CC2)sc(C)c1-c1ccc(Br)cc1 1866033199 BWBRRGREZSCJBH-UHFFFAOYSA-N 438.299 4.076 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCNCc1cc(Br)cc(F)c1O)C(F)(F)F 1913259756 DPPXMBXQVWIOOW-LBPRGKRZSA-N 445.251 4.229 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C3(C)CC3)c(CN)c2I)c(O)c1 2079025231 KUBSSXCDBRCZGF-INIZCTEOSA-N 439.341 4.257 10 10 IICE C[C@@H](C(=O)N1CCCC[C@H]1c1cccnc1)N1C(=O)C(=Cc2cccs2)SC1=S 2296551062 MZIJFTQMUGABSG-YOEHRIQHSA-N 443.619 4.487 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(c3ccccc3)C2=O)cc1 2321707043 LDZFMEVVFKGZAH-UHFFFAOYSA-N 426.563 4.340 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1cc(Cl)ccc1O)C[C@@H](c1ccccc1O)N2 15830178 VCVCJAGXEZAHKD-SFHVURJKSA-N 443.931 4.224 10 10 IICE biogenic O=C(NC[C@@H]1CCCO1)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1O)[C@@H]1CC=C[C@@H]21 20709585 WAVNCFHPGJQZAM-KNESASJNSA-N 435.480 4.036 10 10 IICE Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 25991741 SMNGYNBDPPFARV-UHFFFAOYSA-N 429.586 4.150 10 10 IICE COc1cc(Br)c(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)cc1OC 59135251 KKFGTGIGNDYPAH-QPEQYQDCSA-N 449.232 4.112 10 10 IICE O=C(CSc1nc2cc(F)c(F)cc2[nH]1)Nc1cccc2c1C(=O)c1ccccc1C2=O 105641323 YNYDCRVXLWLPQW-UHFFFAOYSA-N 449.438 4.347 10 10 IICE CCN1CCN(c2ccccc2NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CC1 482041064 QMJJNRRSPOPBBP-UHFFFAOYSA-N 434.584 4.299 10 10 IICE COc1cc(-c2nnc(CC(=S)c3ccccc3)n2Br)cc(OC)c1OC 642774121 KJVDVNYCLJUGSR-UHFFFAOYSA-N 448.342 4.090 10 10 IICE O=C(NC1CCN(c2ccccc2)CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726709995 ZDFZIBFRCOIWDA-UHFFFAOYSA-N 444.526 4.225 10 10 IICE Cc1nc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)c(=O)[nH]c1C 763484860 HSTXIBXECCNMJC-UHFFFAOYSA-N 437.500 4.309 10 10 IICE Cc1cc(Br)ccc1CN(C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 764766330 IJEROLUAYQASCX-KRWDZBQOSA-N 446.389 4.497 10 10 IICE O=C(Cc1ccc(Cl)c(F)c1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 790542965 NIZKWVFTSVUFDP-UHFFFAOYSA-N 430.829 4.193 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2OCC[C@H]2c2ccccc2)n1C[C@H]1CCCO1 812289186 ZFBDEGAPLIZHQI-GIWBLDEGSA-N 434.540 4.044 10 10 IICE Cc1ccc(-c2nc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)cs2)n1C 1125258392 HVAWBVPZBSWBDE-IYBDPMFKSA-N 442.560 4.140 10 10 IICE CN(c1ccc(CNC(=O)[C@]2(O)CCCN(Cc3ccccc3)C2)cc1)C1CCCCC1 1136446661 QFGROCSSKHNMPD-MHZLTWQESA-N 435.612 4.099 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 1142235625 SUFREXDFJYUVBR-GOSISDBHSA-N 439.556 4.039 10 10 IICE Cc1cc(CCNC(=O)[C@@](C)(O)CSc2cccc(F)c2)c(C)n1-c1ccccc1 1169942077 DIOHUQLEYRBVAS-DEOSSOPVSA-N 426.557 4.435 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@H]1CCCOC1 1178046933 FGSLALPQSCTQIQ-JXFKEZNVSA-N 435.362 4.028 10 10 IICE COC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc(C)n(-c2ccccc2C)c1C 1180367998 OIQYBMCZUASZDD-HXUWFJFHSA-N 441.572 4.110 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc3c(c2)OC(F)(F)O3)Cc2ccco2)cc1F 1191591457 MHKJODRDARJAAO-UHFFFAOYSA-N 434.370 4.394 10 10 IICE CC[C@](CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)(C(=O)OC)c1ccccc1 1275725342 DBJWUGXKVVZONA-AREMUKBSSA-N 436.552 4.155 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1276283385 FLJYRBDWURXBLA-PPNCUWOSSA-N 449.595 4.157 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@](C)(O)c1ccco1 1287359149 JPQJGQKFVDGYBO-RUZDIDTESA-N 437.588 4.214 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2NC(=O)CO3)c(C)n1-c1ccc(Br)cc1 1302904705 OJXBRJWPWBXPPU-UHFFFAOYSA-N 440.297 4.440 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(F)nc3Br)c2C)cc1 1303983363 IIGKJADXONGGJQ-UHFFFAOYSA-N 432.293 4.329 10 10 IICE Brc1cc(CN[C@H]2CCCC[C@H]2N2CCOCC2)ccc1N1CCCCC1 1308305582 QHLAPKMYKOVWDF-RBBKRZOGSA-N 436.438 4.172 10 10 IICE C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1312832591 AFAFLPPGEXHXDX-OAHLLOKOSA-N 437.918 4.227 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1316262324 HAPODOYFKVWBBI-UHFFFAOYSA-N 435.572 4.172 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1316293151 SFWRIFOZGLKCSX-PMVMPFDFSA-N 441.620 4.050 10 10 IICE CC(=O)N[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)c1cccc(Br)c1 1353437327 USSFZZMDOBDTAP-OAQYLSRUSA-N 446.389 4.130 10 10 IICE CCc1ccccc1N1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC)CCCCC3)CC1=O 1353748861 QLKJDBCXJYKUKO-MRXNPFEDSA-N 440.565 4.358 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCN(C)c2ccccc2F)C1 1356584431 VZKWCUNMYWHGNU-UHFFFAOYSA-N 436.575 4.190 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1 1448835774 CKDIZXLDFZYQNK-KKSFZXQISA-N 439.556 4.424 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)CC(NCc1cccc(Br)c1O)C2 1462193322 USOCQFKOSMKTGE-UHFFFAOYSA-N 425.367 4.424 10 10 IICE CCC(=O)N(C)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1462497113 BLVMCRKUZPVTIM-UHFFFAOYSA-N 432.568 4.419 10 10 IICE COC(=O)c1cccc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1469958825 HOOYWBLMZJOVBB-INIZCTEOSA-N 429.948 4.362 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCc1cnc(C(=O)OC)cn1 1472952418 PTWHFKVVVDYOLV-UHFFFAOYSA-N 433.331 4.201 10 10 IICE Cc1cc(CCNC(=O)NCCc2ccnn2-c2ccccc2)c(C)n1-c1ccccc1 1479064387 QODHKSNHFCKZOX-UHFFFAOYSA-N 427.552 4.364 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@](C)(O)C1CCCCC1 1517149878 WEFLWBNAIMVUQR-QPPBQGQZSA-N 428.577 4.193 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)COc3ccc4ccc(=O)oc4c3)cc2Cl)C1 1519552269 TUXLZFPTHYKPMN-MRXNPFEDSA-N 440.927 4.378 10 10 IICE Cc1noc(C)c1C(C)(C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1520853622 BMEIREDGXZOPLR-WJDWOHSUSA-N 447.557 4.073 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(OC)cc1 1523472667 MKROVHMTRVRIIY-HSZRJFAPSA-N 440.927 4.329 10 10 IICE COc1ccc(N2CCN(C(=O)c3oc4ccccc4c3CSC)CC2)c(OC)c1 1534588614 VKTMNOPOIGQEDR-UHFFFAOYSA-N 426.538 4.275 10 10 IICE CC(C)(C)c1nnc(N2CCC[C@@H](N3CCCC3)C2)n1CCCSc1nccs1 1541154978 RDNHSCFADCYPAX-QGZVFWFLSA-N 434.679 4.279 10 10 IICE C[C@H](c1cccs1)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541795935 LGSYEGVIWSJKFH-NVXWUHKLSA-N 429.565 4.294 10 10 IICE CCCOc1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1545816534 MOBJCAJCICYHSS-UHFFFAOYSA-N 432.523 4.296 10 10 IICE Cc1cc(C(=O)N2CCCc3c(OCC(N)=O)cccc32)c(C)n1-c1ccc(Cl)cc1 1556694710 TXQLDJRFNZERCL-UHFFFAOYSA-N 437.927 4.205 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(CCCOCC(F)(F)F)CC3)c2C)c1 1583551451 SJLHFODOMUBWEA-UHFFFAOYSA-N 437.506 4.129 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@@H]1CC1(Cl)Cl 1586884501 KKFFWPRXLLHWHN-ZMTLZGASSA-N 447.384 4.117 10 10 IICE Cc1cc(S(N)(=O)=O)c(C)cc1NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1595192133 WCYAHLIPCKVQLC-UHFFFAOYSA-N 431.945 4.264 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 1595427311 SSMMPEUCUIHBSD-KBMIEXCESA-N 429.564 4.228 10 10 IICE CC[C@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(Br)cc1 1598276736 IEXWNPHGNCUBKO-NRFANRHFSA-N 430.390 4.011 10 10 IICE Oc1c(CNc2ncnc3cc(I)sc23)ccc2cccnc12 1612507375 RMEGLFDEUWIZGA-UHFFFAOYSA-N 434.262 4.162 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCOC1 1614505346 HNUGSELWIXWBOE-RUZDIDTESA-N 437.588 4.130 10 10 IICE COC(=O)CCCOc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1616890892 YZTDYFXAWGGQGV-UHFFFAOYSA-N 434.492 4.491 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(C)cc4)c3C(C)C)CC2)c(OC)c1 1623760220 SVURXFMNRRMBNC-UHFFFAOYSA-N 448.567 4.284 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1(C(=O)Nc2c(F)cccc2F)CC1 1624554213 RMXUVMVTFHPLFQ-UHFFFAOYSA-N 427.495 4.332 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)C1 1625057052 ADEBDMXEQVZCEV-ROUUACIJSA-N 443.548 4.348 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cccc(Cl)c3Cl)CC2)cc1F 1631377414 MQMJNMGUTXTCSS-ZDUSSCGKSA-N 427.303 4.257 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Oc2ccccc2)ccc1O 1631531170 JIWHHYHKIKKNJL-UHFFFAOYSA-N 441.867 4.359 10 10 IICE COc1cccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1O 1637240149 VWLYMUUCNQYILC-UHFFFAOYSA-N 431.536 4.018 10 10 IICE C[C@H]1CN(C(=O)CN(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)CC(C)(C)O1 1642029369 JYEUTCJGDZAIHI-OSICKASQSA-N 436.552 4.004 10 10 IICE Cc1ccc(N2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)c(C)c1 1642054536 UXNKZQVOENCZED-UHFFFAOYSA-N 429.564 4.415 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3c(S(C)(=O)=O)nc4ccccc43)c2C)cc1C 1651701546 ANKZZQYFVYSTLS-UHFFFAOYSA-N 435.549 4.347 10 10 IICE Fc1cc(CNc2cc(SCc3ccccc3)ncn2)cc(F)c1N1CCOCC1 1655551184 YPMAIQPPKPGPIN-UHFFFAOYSA-N 428.508 4.496 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 1682097844 XANSEWMLISOKAR-GKVQRAMASA-N 427.564 4.429 10 10 IICE COc1ccc([C@@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c2ccco2)cc1 1683392916 IRHNEYAHHZYUSG-ISKFKSNPSA-N 436.556 4.046 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@@H](OC)C(F)(F)F 1727503190 CEJFZZMVNBISJD-GOSISDBHSA-N 425.499 4.045 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1746093757 OBEMYQSEBBZBOJ-HXUWFJFHSA-N 448.615 4.162 10 10 IICE C[C@H]1CCCN(CCCCn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752174933 OGSVRFZPFJHNRR-UNMCSNQZSA-N 441.620 4.026 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1765272846 OGQNIKZJZBQFAQ-YLJYHZDGSA-N 433.597 4.105 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3nc(-c4ccc(F)cc4)cs3)CC2)cc1 1858124239 DYKSHZZJXRDQAM-UHFFFAOYSA-N 425.529 4.239 10 10 IICE COCCN1C(=O)C(Nc2ccc(C)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420542 PZQCEAQPNZUTEX-UHFFFAOYSA-N 429.520 4.241 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(F)(F)F)c(N)c1I 2079047205 JPRMCALORYCHGC-SECBINFHSA-N 425.192 4.102 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](CNCc1cc(Br)cc(F)c1O)C2 2117677802 PHKMMXPXIYPSMM-PJODQICGSA-N 429.330 4.171 10 10 IICE COc1ccc(Br)c(CNC[C@H](CC(C)C)NC(=O)OC(C)(C)C)c1O 2227738173 SFMFTUOJGZNPTP-ZDUSSCGKSA-N 431.371 4.192 10 10 IICE CCC1=NN2C(=N)C(=Cc3cccc(OCCOc4ccccc4C)c3)C(=O)N=C2S1 2293582779 ZZMZWDWLZCHRFV-UHFFFAOYSA-N 434.521 4.482 10 10 IICE N=C1C(=Cc2cccc(Br)c2)C(=O)N=C2SC(Cc3ccccc3)=NN12 2297344266 QFJKHYCBUNLNDY-UHFFFAOYSA-N 425.311 4.311 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCOC)C2=O)cc(Br)c1OCC 2297349302 FZVMMQQKEQTVNN-UHFFFAOYSA-N 446.388 4.094 10 10 IICE CN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCCO3)SC1=S 2314522519 MLIXIUPNOMWBKN-UHFFFAOYSA-N 435.530 4.142 10 10 IICE CCCCCN1C(=O)C(=Cc2cc3ccccc3nc2N2CCOCC2)SC1=S 2314647580 DAEMXTRGAZMLIY-UHFFFAOYSA-N 427.595 4.463 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3ccc(O[C@@H](C)C(=O)O)cc3)SC2=S)c1 2314928926 FASLJPBBKNDPQB-ZDUSSCGKSA-N 427.503 4.147 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 10906558 WOQTYUOIXBTUGA-UHFFFAOYSA-N 442.922 4.082 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccc(F)cc4)C3=O)c2C)cc1 16455267 KOXZNCNYVDGDGI-RUZDIDTESA-N 433.483 4.192 10 10 IICE CCOc1ccc(OCC)c(N2C(=O)N=C(O)/C(=C/c3ccc(N4CCCC4)o3)C2=O)c1 33497524 JAHMIOVOYBHGFU-LGMDPLHJSA-N 439.468 4.184 10 10 IICE O=C1NN(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(-c2ccccc2F)o1 33709725 IMNYNPRNJPOOPD-LFIBNONCSA-N 427.229 4.310 10 10 IICE Cc1ccccc1N1CCN(C2=NC(=O)/C(=C\c3cn[nH]c3-c3ccccc3)S2)CC1 33935157 BGJZUKQPXNZDLQ-RCCKNPSSSA-N 429.549 4.178 10 10 IICE C[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccccc1Br 105367892 LJUNWIYVTFXNBJ-INIZCTEOSA-N 432.362 4.188 10 10 IICE COc1cc(/C=C\C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)ccc1OCC(C)C 210873253 MOTZNVAEJODVPC-LHZAFZKQSA-N 438.568 4.457 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)s1 729110425 GVOBSTHHEHQRIH-UHFFFAOYSA-N 448.469 4.185 10 10 IICE CN1CCCC[C@@H]1CN1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 731842351 CHZSQFMXESUAPU-XMMPIXPASA-N 434.588 4.142 10 10 IICE Cc1ccc(CCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 742749968 KPEWDKDSWCNPOQ-JOCHJYFZSA-N 425.573 4.376 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N(C)Cc3cc(Cl)ccc3F)cc2F)CC1 765494299 OULHNBDUQMRBKH-UHFFFAOYSA-N 436.934 4.102 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)[C@H](O)c1ccc(OCc2ccccc2)cc1 773766453 MAYYXSZATXKYGK-IQGLISFBSA-N 449.547 4.484 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](c3cccc(F)c3F)C(F)(F)F)CC2)cc1F 776020010 LZXVDCGWYYWBIN-SFHVURJKSA-N 447.379 4.248 10 10 IICE CCOc1ccc(C(=O)N2CCC(NCc3cc(C)cc(Br)c3O)CC2)cc1 781624729 OAHSTMWMJYMWEQ-UHFFFAOYSA-N 447.373 4.256 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@]4(CCO[C@H](C)C4)C3)n2C)c(C)n1-c1ccccc1 800747815 RASNTDMMKGLMQK-WYEJZRMESA-N 435.572 4.052 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)c1C 804138811 ZYOWFMNGKCUMPU-UHFFFAOYSA-N 440.569 4.315 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1C[C@H]1c1cccc(Br)c1 804733240 MVGOZBXYNOYLTH-LSDHHAIUSA-N 425.120 4.337 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(N3CCCCC3)ncn2)cc1 857449897 LGUUHDFLUCTWBV-UHFFFAOYSA-N 445.567 4.389 10 10 IICE Cc1cc2c(N3CCC[C@@H]3C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)ncnc2s1 1129820041 QJHKPXJFHCWALP-IIBYNOLFSA-N 437.613 4.090 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C2([C@@H](C)NC(=O)OC(C)(C)C)CCOCC2)cc1 1135946400 QNLLADLLNQTWTI-LJQANCHMSA-N 447.620 4.201 10 10 IICE Cc1ccccc1NCCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1136903316 BKICRGWNZNVCBS-QFIPXVFZSA-N 440.588 4.245 10 10 IICE Cc1cc(C(=O)NCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1cccc(C(C)C)c1 1142298855 VGOACOKLSJIZEL-UHFFFAOYSA-N 429.520 4.244 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4ccccc4F)CCCC3)cc2F)CC1 1144592946 XSYQYUXYPISJMH-UHFFFAOYSA-N 427.539 4.235 10 10 IICE O=C(CCCC(=O)c1ccc(Br)cc1)NCc1ccc2cccnc2c1O 1162612463 JSWQVTHGITUSFP-UHFFFAOYSA-N 427.298 4.372 10 10 IICE CC(C)NC(=O)Nc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)c1 1163901009 GFIITFSXFKCXHF-UHFFFAOYSA-N 436.478 4.487 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1 1176755106 MFJIEJAFOASETH-XZOQPEGZSA-N 436.939 4.283 10 10 IICE COC(=O)c1cc(OCc2csc(N(C(C)=O)c3ccccc3)n2)ccc1N(C)C 1189968472 SRZUDDQVOZHWCE-UHFFFAOYSA-N 425.510 4.259 10 10 IICE Cc1cccn2c(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)cnc12 1279232942 WHWOKORZJORDHF-LFIBNONCSA-N 440.525 4.012 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2cc(C(C)(C)C)no2)n1 1289919908 UVFODMUUNUSMHI-UHFFFAOYSA-N 432.528 4.324 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1nc(C)ccc1Br 1297228190 CKDAQHRDWGIFLX-UHFFFAOYSA-N 448.361 4.155 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc([S@@](C)=O)cc2)n1CCCSc1nccs1 1359681012 MJNDKOABTVOJSL-GDLZYMKVSA-N 449.671 4.414 10 10 IICE Cc1c(Cl)ccc2c(CC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)coc12 1444853846 QMIDMGPPRFNDJM-UHFFFAOYSA-N 430.907 4.354 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1[C@H]2CCCC[C@@H]2CCN1C(=O)OC(C)(C)C 1449119935 LJTXSGUXZYAEMN-UWVAXJGDSA-N 437.577 4.310 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccn(-c4ccc(Cl)cc4Cl)n3)CC2)cc1 1458043291 MQGJEMBQWKUZKS-UHFFFAOYSA-N 431.323 4.150 10 10 IICE COc1cccc(C2=NO[C@H](C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)C2)c1 1459579162 LEQYKXGQXFOCCQ-MWTRTKDXSA-N 441.959 4.394 10 10 IICE COC(=O)c1c(NC(=O)CN(C)c2ccc(-c3nccs3)cc2)sc2c1CCC2 1460205765 AWSYDVNGRJDARY-UHFFFAOYSA-N 427.551 4.222 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)OCC23CCC3)sc(C)c1-c1ccccc1 1460346340 WVWRTCXDAXBNIE-MRXNPFEDSA-N 442.581 4.482 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(Nc4ccc(OC)cc4OC)cc3)C2)cc1 1470019388 GZXPMYJNECEKDP-FQEVSTJZSA-N 447.535 4.465 10 10 IICE CCc1ccc2ccccc2c1CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1471292629 WZQMFWPZPRKREE-UHFFFAOYSA-N 433.552 4.451 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)Nc1ccccc1C(=O)c1ccccc1 1473262437 KHWVKWBUDUZERC-JOCHJYFZSA-N 444.531 4.243 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1cc(Cl)ccc1O)CCO2 1479194189 BTVMPZWWPXQSOK-UHFFFAOYSA-N 447.919 4.497 10 10 IICE C[C@@H](NC(=O)N1CCOc2ccc(NC(=O)OC(C)(C)C)cc2C1)c1ccccc1O 1479194645 PTEPOPYBIUUDQB-OAHLLOKOSA-N 427.501 4.404 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCOCC2)cc1 1500026045 YKNCRRAFQUKACM-OAQYLSRUSA-N 448.615 4.021 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CC[C@H](OC)C2)cc1 1501834283 KJPMFJZYUKNHKR-FQEVSTJZSA-N 440.979 4.113 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@H](COC)C2)cc1 1501837080 AVOJOMNFGNFFIR-NRFANRHFSA-N 434.588 4.097 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1C[C@@H](C)[C@H](C(F)(F)F)C1 1510676484 YAFTZQCWOGFSIB-VQIMIIECSA-N 444.505 4.397 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CSCCN2Cc2ccccc2)c(C)n1-c1ccccc1 1522487711 HZWOJENTAOIORT-RUZDIDTESA-N 433.621 4.370 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4ccc(F)cc4)c3C(F)(F)F)C2)cc1 1531730416 WQLREJTZWPSOBT-OAHLLOKOSA-N 448.420 4.048 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1Cc1ccccc1 1531792455 JMCXKAHXUJBEDY-FLWYYKORSA-N 440.565 4.164 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)Cc3ccc(Br)cc3)C2)cc1 1538747686 UEQJMPUDKXMUTQ-SFHVURJKSA-N 431.374 4.422 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1 1540537672 FLDDHWWVSMSZQH-LJQANCHMSA-N 439.547 4.384 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1541080309 FNFFTAKIFOJSRC-FXAWDEMLSA-N 435.634 4.186 10 10 IICE CCc1ccc(OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 1544269808 WJWPFOJERNSIBC-JOCHJYFZSA-N 441.572 4.076 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(Cn4cc(Cl)cn4)s3)CC2)cc1 1545931248 AWIWDTKQUURJMH-UHFFFAOYSA-N 430.961 4.007 10 10 IICE COc1ccc(O)c([C@H](C)NCc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)c1 1559701095 LZABKNZTFQLNJY-LBPRGKRZSA-N 425.485 4.356 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(NC2=NCCC2)cc1 1566357145 XNKCDWXVYHHIEP-HXUWFJFHSA-N 426.948 4.044 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(C)nc(C(C)(C)C)nc3SC)CC2)cc1 1566563154 UPBVOKMRVPYNLT-UHFFFAOYSA-N 428.602 4.166 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)c1 1585665093 LORJVIMXPMVQSF-OAHLLOKOSA-N 431.920 4.173 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)cc1 1594572606 ACADRDQHXUIXGI-HHHXNRCGSA-N 430.548 4.421 10 10 IICE Cc1nc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)sc1C 1611845213 RMBCIIXFSCYUBO-UHFFFAOYSA-N 425.583 4.394 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N(C)Cc1ccc(Br)s1 1611963251 KYKRPUMLOGXTFE-UHFFFAOYSA-N 434.407 4.470 10 10 IICE COC(=O)CN(CCc1cc(Cl)c2c(c1)OCCCO2)Cc1cc(Cl)ccc1O 1615935879 WNAWLOJPNXWFMM-UHFFFAOYSA-N 440.323 4.078 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2c(c1)CCN(C(=O)OC(C)(C)C)CC2 1624480671 YDGCVOFYEHPOMV-UHFFFAOYSA-N 437.584 4.361 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(Sc4ccccc4)CCCC3)cc2)CC1 1626090739 UUGMCOKDVIOJKR-UHFFFAOYSA-N 437.609 4.110 10 10 IICE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@H](OC1CCOCC1)c1ccccc1 1632094469 WWTJWYDCDXJRNY-FPTDNZKUSA-N 427.522 4.368 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(Cc2cccc(F)c2)CCCCC1 1632356487 QAWOBPPKLNUBGL-FQEVSTJZSA-N 443.515 4.021 10 10 IICE CCOC(=O)C[C@@H]1CCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1639234583 MSBVYYYIWQYTNW-KRWDZBQOSA-N 433.346 4.414 10 10 IICE COc1ccc(N(CC(=O)N2CCN(Cc3ccsc3)CC2)Cc2cccs2)cc1 1652703644 VJIZHYQWRYBBEW-UHFFFAOYSA-N 441.622 4.169 10 10 IICE Cc1ccc2c(c1Br)CN(C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)C2 1676653661 UMNBZSYVVCTCJN-FQEVSTJZSA-N 445.405 4.152 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(=Cc2ccc(F)c(F)c2)CC1 1682986454 FTPGRBDPYAIHJZ-UHFFFAOYSA-N 441.522 4.315 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC(Cc2cccc(C(F)(F)F)c2)C1 1682986826 PTYCWHSIGZRVSL-UHFFFAOYSA-N 447.501 4.051 10 10 IICE Cc1[nH]c2ccc(F)cc2c1CCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1684434553 WBSFCHILSJGAII-LJQANCHMSA-N 425.504 4.254 10 10 IICE CO[C@]1(C)CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1697209051 KEAMVIOPSMPPNM-XMMPIXPASA-N 439.629 4.358 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC[C@H]1C 1749214236 CPKICXJFEGYOBJ-WBVHZDCISA-N 449.671 4.431 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763825313 BLAPTCBBCJZPMS-ICSRJNTNSA-N 429.634 4.008 10 10 IICE CNc1cc(C(=O)NCCc2ccc(OC)c(OC)c2)c(Nc2ccccc2)c(F)c1N 1858181365 NXHQHCZPUDNIGP-UHFFFAOYSA-N 438.503 4.183 10 10 IICE CCCC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858591965 DSTCUZHLVUIQRI-FMNNIJNLSA-N 432.336 4.433 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)/C2=C/c2ccc(OC)c(O)c2)cc1 1865664203 FRPAPPWWNHFRCM-FYJGNVAPSA-N 432.451 4.379 10 10 IICE Cc1c(Cl)ccc2c(O)cc(C(=O)N[C@@H](c3ccc(N(C)C)cc3)c3nccn3C)nc12 1866508186 ADSUXXQHDZFWIT-QFIPXVFZSA-N 449.942 4.221 10 10 IICE CC[C@H](NC(=O)[C@H](C)C1CCCC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1867020659 DUVHNZWIIHUSIW-QRWLVFNGSA-N 432.520 4.122 10 10 IICE CC[C@H](C)[C@H](C(=O)O)N1C(=O)C(=Cc2c(Cl)nc3scc(C)n23)SC1=S 2323827178 DUGHPUQGNHMQQQ-WRWORJQWSA-N 429.976 4.058 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380793794 UXIJKLMRQOYTHA-OAHLLOKOSA-N 441.366 4.069 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381134721 HBMSECCTHUAQIU-HIFRSBDPSA-N 441.366 4.115 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)ccc1O 15039022 YBWNRJYBCHCAIP-AQTBWJFISA-N 428.535 4.021 10 10 IICE COc1ccc(-c2nc(-c3ccc(C(=O)NCc4ccc(N(C)C)cc4)s3)no2)cc1 65062908 NMIGRFXTXQJKBL-UHFFFAOYSA-N 434.521 4.470 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccccc3SCc3nc(C)no3)CC2)cc1 110353349 WRVDASOZSUMYFV-UHFFFAOYSA-N 438.553 4.078 10 10 IICE CN(C)CC(C)(C)CN1C(=O)/C(=C\c2cccc(OCC(F)(F)F)c2)SC1=S 727177028 VLKQSBWTXCGFTA-OQLLNIDSSA-N 432.533 4.417 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ncc(-c2ccccc2)cn1 764783492 UTKKZEDHLWQDPV-UHFFFAOYSA-N 441.329 4.343 10 10 IICE CC(C)OCc1cc(NS(=O)(=O)/C=C\c2ccc(Br)cc2)ccc1O 811704252 BZYMVBBTKQXJJJ-KTKRTIGZSA-N 426.332 4.492 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCc2nnc(-c3cc4ccccc4o3)o2)cc1 1130745043 NNMGRGGGIVZCBH-UHFFFAOYSA-N 434.496 4.019 10 10 IICE COC(=O)CC[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1136633285 HJAOIGPYMVOZNN-XMMPIXPASA-N 432.520 4.260 10 10 IICE Cc1cc(C(=O)NC2CN(C(=O)OCc3ccccc3)C2)c(C)n1-c1cccc(Cl)c1 1142061498 ZHMNISDXTVNHHG-UHFFFAOYSA-N 437.927 4.498 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1ncc(-c2ccccc2Cl)o1 1142690444 KASHDAFGMNCQIL-UHFFFAOYSA-N 442.899 4.225 10 10 IICE Cc1ccc(NS(C)(=O)=O)c(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1148048586 WPIKQIHOBVBKLX-UHFFFAOYSA-N 439.537 4.147 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(c2=O)CCCC3)c(C)n1-c1ccc(OC(F)(F)F)cc1 1189070825 ZXOYAFKPOXXUTD-UHFFFAOYSA-N 445.441 4.311 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)NCc1cccc(OC)c1O)NC(=O)OC(C)(C)C 1229525556 XXDNCJBOWAJUQH-LJQANCHMSA-N 443.544 4.028 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H](c2ccccc2)CC1 1251750565 FEZXPGZDZGVVOQ-FQEVSTJZSA-N 429.511 4.281 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1 1264286632 SVCUZGGDNJCZLG-KAMYIIQDSA-N 431.580 4.197 10 10 IICE Cc1nc(Cc2nnc(N3C[C@@H](C)C[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290403750 ATDFIHRUNOWKQD-IYBDPMFKSA-N 442.608 4.370 10 10 IICE Cc1ccc(C(=O)NCc2ccc(OCCOc3ccc(Cl)cc3)cc2)c(O)c1O 1292718211 BQJLLPQTAWZIOG-UHFFFAOYSA-N 427.884 4.447 10 10 IICE Cc1cc(C(=O)N2C[C@@H](O)Cc3ccccc32)c(C)n1-c1ccccc1Br 1297179631 PCJPUJLAQFUZNJ-KRWDZBQOSA-N 425.326 4.420 10 10 IICE CC(C)NC(=O)c1nnc(N2CC[C@H](C)C3(CCC3)C2)n1CCCSc1nccs1 1303359856 FRYDWSMSQPVEDC-INIZCTEOSA-N 448.662 4.072 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCC1(C(=O)OC)CCOCC1 1307274959 VLVZQHYQMAYSHA-UHFFFAOYSA-N 439.375 4.394 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CCN(C(=O)CCc2ccccc2)CC1 1349106195 ADGPFNFIACHCSA-UHFFFAOYSA-N 433.596 4.117 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2noc(C(F)F)n2)c(C)n1-c1ccc(Br)cn1 1451064072 IEGSSSZDJPWOAZ-VIFPVBQESA-N 440.248 4.063 10 10 IICE C[C@@H](NC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1)c1ccc(N(C)C)cc1 1459175890 AGIQZNSGCQMRRV-QVKFZJNVSA-N 436.383 4.310 10 10 IICE COc1ccccc1N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 1460191220 VUFUYICCUTZTKE-UHFFFAOYSA-N 428.488 4.324 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2cc(F)ccc2N(C)C)C1 1463505227 XBMZGFBIQYQZRX-SFHVURJKSA-N 436.575 4.490 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC3(CCOCC3)CO2)c(C)n1-c1ccc(Br)cc1 1471227258 OFSUXQODXYXCOU-IBGZPJMESA-N 447.373 4.172 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)C[C@H](O)COc2ccccc2C(F)(F)F)c1O 1473161700 ZPMCTWXNQKLDRI-HNNXBMFYSA-N 431.838 4.139 10 10 IICE Cc1nnc(N2CCC[C@@H](CN3CCCC[C@@H]3C)C2)n1CCCSc1nccs1 1492846352 FPSVYMBHDUWTAM-HKUYNNGSSA-N 434.679 4.316 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCN1CCOC1=O 1500659414 RJNKWXSYWJJQPJ-UHFFFAOYSA-N 436.560 4.041 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C)C3)n2CCCOC(C)C)c(C)n1-c1ccccc1 1510619246 NZYPTAZPPQNVIN-HXUWFJFHSA-N 437.588 4.393 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(C(=O)OC(C)(C)C)CCCCCC2)N(C)C)cc1 1537484734 ZVGVABGHQCPUKI-OAQYLSRUSA-N 431.621 4.154 10 10 IICE CNC(=O)c1ccc(C)c(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1540699155 OOJHXFBXJQTAIW-UHFFFAOYSA-N 441.329 4.172 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 1545508847 PPFZQMBWEILWMM-UHFFFAOYSA-N 427.682 4.308 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 1556260632 OWIRVMYZUYMBKT-SFHVURJKSA-N 437.565 4.353 10 10 IICE Cc1cc(CC(=O)N2CCCC[C@H]2CCn2ccnn2)c(C)n1-c1ccc(Cl)cc1 1558785150 HUBBTXMNJGBNOH-NRFANRHFSA-N 425.964 4.353 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)N3CCc4ccc(Br)cc43)ccnc21 1616890096 HEWKVOCPUDUNKK-UHFFFAOYSA-N 444.329 4.345 10 10 IICE Cc1ccc(C2=NO[C@H](CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2)cc1C 1617523653 IVUIXGAJVBOYJQ-VWLOTQADSA-N 443.547 4.375 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnccn1 1618908171 LKBBVRRTDKRCGM-UHFFFAOYSA-N 445.571 4.204 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H](C)SC)CC2)cc1 1619301291 DVNGLOJMFAERRO-SFHVURJKSA-N 431.650 4.344 10 10 IICE Cc1cc(CC(=O)N2CCC(CCN3CCOCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1624253020 UHQHQOJAIBNIEQ-UHFFFAOYSA-N 444.019 4.251 10 10 IICE Cc1cc(C(=O)NCCCN(C)CC(F)(F)F)c(C)n1-c1ccccc1Br 1625636981 HSJHSKBDFQUGBZ-UHFFFAOYSA-N 446.311 4.471 10 10 IICE C[C@@H](NC(=O)[C@@]1(C)CC(c2cccc(Cl)c2F)=NO1)c1ccc(N2CCOCC2)cc1 1625882089 CPLXWZPHQKQBEW-IQMFZBJNSA-N 445.922 4.076 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)c2C)cc1 1627730508 SHOXDTOWEOMZCQ-FUHWJXTLSA-N 431.536 4.199 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)c2ccc(C)cc2)cc1 1632050097 RZECXYGNRMXUNZ-JOCHJYFZSA-N 441.572 4.164 10 10 IICE CCN(CCC1CCN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1)CC(C)C 1636353729 HZSCAEXVBOLKTQ-QHCPKHFHSA-N 444.664 4.311 10 10 IICE Cc1cc(CC(=O)N(C)C[C@@H](O)COCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1638544744 NIKQKYDTIGAAHW-XMMPIXPASA-N 440.971 4.326 10 10 IICE COc1ccc(N2CCN(CCNc3cc(C(C)(C)C)nc(C(C)(C)C)n3)CC2)cc1 1650696162 RVVHUGNUIMMMPI-UHFFFAOYSA-N 425.621 4.314 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H](CNC(=O)OC(C)(C)C)[C@H](C)C1 1683426074 UUAPJDVMVRLXIJ-SVFBPWRDSA-N 446.636 4.184 10 10 IICE CC(C)NC(=O)c1nnc(N2CCCC3(CCCC3)C2)n1CCCSc1nccs1 1692535037 KKANVIRXBMEYHI-UHFFFAOYSA-N 448.662 4.216 10 10 IICE CCC[C@@H](C)N(C)c1nnc(C(=O)NC(CC)CC)n1Cc1ccc2c(c1)CCCN2C 1727936168 MRWFAVXKHZVANS-GOSISDBHSA-N 440.636 4.252 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768179172 BDQDDXWPRNFHFT-DEOSSOPVSA-N 429.584 4.270 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@H](C)C1 1771095496 RBFIRMKGOWITKB-LRXVAGHRSA-N 445.583 4.024 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCc4ccc(F)cc4)cc3)CC2)cc1 1872883953 FBLHDJJUJWZZJR-UHFFFAOYSA-N 433.527 4.087 10 10 IICE COc1ccccc1CN1C(=O)C(NC2CC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873166916 KXUMVFRIGASOET-UHFFFAOYSA-N 441.531 4.135 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cc(F)c(Br)cc1[N+](=O)[O-] 1891460517 JVRRBYICUBRLOR-ZFWWWQNUSA-N 448.292 4.415 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NCc3cc(Br)ccc3O)C(C)(C)[C@@H]21 2119292861 HDTZMWICRWJDEE-DJIMGWMZSA-N 425.367 4.278 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@H]2NCc2ccc(Br)cc2O)CC1 2132777537 NXSJJNQCRZCSMC-QGZVFWFLSA-N 425.367 4.424 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@H]2CCN(Cc3ccccc3)[C@H]2C1 2188889733 ZLRPUUOQDZZVLW-XXBNENTESA-N 426.402 4.412 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=O)NC(=S)N(c4ccccc4F)C3=O)c2C)cc1 2296145270 ZNUFTNXUSKXDOA-UHFFFAOYSA-N 433.508 4.373 10 10 IICE CC[C@H](C)c1ccc(N2C(=O)NC(=O)C(=Cc3ccc(O)c(Br)c3)C2=O)cc1 2296398057 QHTIXXPZKASWSP-LBPRGKRZSA-N 443.297 4.335 10 10 IICE CC(C)N1C(=O)C(=Cc2c(Oc3ccccc3F)nc3ccccn3c2=O)SC1=S 2296851524 OYKCYGZWDNXNSJ-UHFFFAOYSA-N 441.509 4.236 10 10 IICE COc1cc(C=C2SC(=S)N(CCC(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 2314827320 BNCXCBWQQLRVNM-UHFFFAOYSA-N 448.953 4.284 10 10 IICE CC[C@H](C)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323827358 YDAVXLYUGDVGAD-ISVAXAHUSA-N 432.336 4.289 10 10 IICE N=C1S/C(=C/c2ccc(-c3cccc(C(=O)O)c3)o2)C(=O)N1c1ccc2c(c1)OCO2 6974441 ARXKWYLPICNGDP-RJFASYANSA-N 434.429 4.429 10 10 IICE Cc1ccc([C@H]2Nc3ccc(S(=O)(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@H]32)s1 14456802 CCSWNPMIFJLQGP-FCQWJQKHSA-N 430.595 4.340 10 10 IICE O=[N+]([O-])c1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)cc1 14550785 ZZUZOJCBIFQLHI-CNNODRBYSA-N 425.510 4.206 10 10 IICE CC(=O)N1c2ccc(N/N=N/c3ccc4c(c3)N(C)[C@@H](C)CC(=O)N4)cc2NC(=O)C[C@H]1C 16956890 BUYYLRRXTCBAKH-UONOGXRCSA-N 449.515 4.048 10 10 IICE Cc1ccccc1N1C(=O)N=C(O)/C(=C/c2c(C)nn(-c3cccc(Cl)c3)c2O)C1=O 33907424 YDQPPMKVXJKKSD-BOPFTXTBSA-N 436.855 4.355 10 10 IICE CC(C)(C)OC(=O)N1CCCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)CC1 385468361 KGZLQRPUCQAKGZ-UHFFFAOYSA-N 446.592 4.009 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cccc(N3CC=CC3)c2)C1 435866801 IPKXDBRSACEAFG-UHFFFAOYSA-N 428.580 4.100 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(C)c3)[C@H]2c2ccc(O)c(O)c2)c1OC 526324650 ZSFDXCWAJAFDJN-QFIPXVFZSA-N 433.460 4.481 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cccc(NC(=O)N2CCCC2)c1 586669376 MHXJBNDHAOGJLW-UHFFFAOYSA-N 439.471 4.342 10 10 IICE CCN1CCN(c2ccccc2NC(=O)NCc2ccc(N(CC)CC)c(F)c2)CC1 731362130 RRJMNDKCOYTIGB-UHFFFAOYSA-N 427.568 4.136 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1 732241909 RTSCKGRUPBMGFD-LJQANCHMSA-N 428.527 4.029 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@@H]2c2ccccc2I)cc1 733801062 RGFIHUGOOFHYKN-LJQANCHMSA-N 449.336 4.404 10 10 IICE Cc1cccc(CN(Cc2cccc(C)n2)C(=O)NCc2ccc(N3CC=CC3)cc2)n1 751796613 IDVGRKCMYSXPHV-UHFFFAOYSA-N 427.552 4.382 10 10 IICE Cc1ccc(CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c(OC[C@@H]2CCOC2)c1 756081872 WGJNYWOUGMDNBF-OAQYLSRUSA-N 437.584 4.351 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2c(F)cccc2I)cc1F 760556179 OEFWWVQPMAABML-UHFFFAOYSA-N 444.263 4.346 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 775970780 DOMROLDUXQJERH-GOSISDBHSA-N 427.854 4.279 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCc3ccc(F)cc3)C2=O)cc2c1OCCO2 790592035 UBZHOVXXVPOZBW-LDADJPATSA-N 431.510 4.049 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC(C)(C)C(F)(F)F)NC(=O)OC(C)(C)C)cc1 795136198 HHPZYUTZANSQSF-INIZCTEOSA-N 431.499 4.413 10 10 IICE O=C(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)N(Cc1ccccc1O)C[C@H]1CCCO1 798114802 IBRFZFXSXPBMAR-QRQLOZEOSA-N 432.467 4.240 10 10 IICE O=C(NCc1cc(Br)ccc1O)C1CCN(c2nc3ccccc3s2)CC1 804738237 IRFVEJICDGFLGL-UHFFFAOYSA-N 446.370 4.297 10 10 IICE CC[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)cc(Cl)c1O 806142825 GEKOUZQZKZIROM-UEXGIBASSA-N 448.394 4.339 10 10 IICE O=C1/C(=C\N2CCOCC2)SC(=S)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1083933287 ATCNEYDMGGFHOW-XYOKQWHBSA-N 442.406 4.263 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C(/C)c3cccc(Cl)c3)CC2)cc1 1124515824 HGKNMKFGGFGPJF-ZPHPHTNESA-N 427.976 4.080 10 10 IICE CC[C@H](C)Oc1ccccc1/C=C\C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549035 BBRCMLHDIOIPMF-JJEJIETFSA-N 430.495 4.308 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCCc3cccc(C(F)(F)F)c3)cc2)CC1 1133847875 TZHWOHIGPDJSQK-UHFFFAOYSA-N 447.501 4.046 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)on2)c1 1135946074 CZJSNWLAUGKRAK-UHFFFAOYSA-N 441.915 4.112 10 10 IICE Nc1c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cccc1C(F)(F)F 1136546253 ATZQCCHNQPVXFB-UHFFFAOYSA-N 429.389 4.288 10 10 IICE O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cc2cc(O)c(O)cc2s1 1137853640 UNACSPUVXKZDDH-CYBMUJFWSA-N 437.304 4.155 10 10 IICE COC(=O)c1ccoc1CSc1ccccc1C(=O)N1CCS[C@@H](C(F)(F)F)C1 1155467978 VNDQWTIILLYJAT-MRXNPFEDSA-N 445.484 4.478 10 10 IICE Cc1ccc(C(=O)N2C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cc1-n1c(C)cc(C=O)c1C 1179676176 GSTQYOQDEQFEPC-IIBYNOLFSA-N 439.556 4.200 10 10 IICE COc1ccc(N(C)CC(=O)N(C)[C@]2(c3ccccc3Cl)CCCCC2=O)cc1F 1191890761 BKPFJODDGIROJV-QHCPKHFHSA-N 432.923 4.421 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)CC(F)(F)F 1276234988 IWSKJGZJMFPHPM-GYBQTFJISA-N 434.480 4.122 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)COc2ccc(Oc3ccccc3)cc2)N(C)C)cc1 1289600229 NMVSFLMLEWWWAP-VWLOTQADSA-N 433.552 4.343 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc([C@]4(C)NC(=O)NC4=O)cc3)c2C)c1 1290886191 WNWHWOSVVVVALC-VWLOTQADSA-N 430.508 4.018 10 10 IICE CC(C)[C@H](C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)N1C(=O)c2ccccc2C1=O 1292259013 XZEXHCGFRWASRX-XMMPIXPASA-N 447.579 4.393 10 10 IICE COC(=O)[C@@H](COC1CCC1)N(C)C(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1295019290 DLCZZGRJEGVERI-HSZRJFAPSA-N 426.557 4.400 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1295562440 KGVMMJGLEWDPSE-HKUYNNGSSA-N 445.882 4.122 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1 1297892471 GENFKZPHMZNMKI-OAQYLSRUSA-N 446.425 4.269 10 10 IICE COc1cc(/C=C/C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc(Br)c1O 1299479049 SPNGLCTXDNTJAT-PPYMECGQSA-N 447.373 4.298 10 10 IICE CCC1CCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)CC1 1306365605 XFMZAMFRYOFOOM-IBGZPJMESA-N 441.620 4.059 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)C1(C)C 1445636395 AOYSQEQXXZEVOB-AZUAARDMSA-N 428.529 4.453 10 10 IICE O=C(C[C@H]1OCc2cc(Cl)ccc21)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445885435 RCLWHCGWAWLJDT-GHTZIAJQSA-N 435.351 4.441 10 10 IICE CC(C)(C)OC(=O)NCc1ncc(C(=O)N(Cc2ccco2)Cc2ccccc2O)s1 1465840966 MPHBWPZLDKUUKC-UHFFFAOYSA-N 443.525 4.309 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)Cc3ccccc3C(F)(F)F)CC2)cc1F 1469523489 IQBOEHRSRLMWFS-OAHLLOKOSA-N 439.453 4.316 10 10 IICE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(F)cc1OC(F)F 1478367713 MYLPYXJYPGVSGB-OAHLLOKOSA-N 437.462 4.166 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)[C@]12CCCO2 1478409310 OFQKKKDRBIHQSM-WWTKIRLPSA-N 435.996 4.102 10 10 IICE COc1cccc(CC2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CC2)c1 1479535288 UDKMMYAQNKMOHF-RUZDIDTESA-N 438.616 4.028 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CC[C@@H](F)C1 1495755651 WLZZBXLNNBPUAZ-OKZBNKHCSA-N 433.547 4.404 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)c(F)c2)C1 1500703075 LCTHIHMHIIKRGZ-UYAOXDASSA-N 430.616 4.213 10 10 IICE CC(C)CN(c1nnc([C@@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C)C(C)C 1509369253 GWVJEOQXIUGUEX-JOCHJYFZSA-N 425.621 4.474 10 10 IICE CCC[C@@H](C)N(C)c1nnc(CC2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1514307950 LNBMUEXPIXVANE-LJQANCHMSA-N 425.621 4.112 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)CCc2nccs2)cc1F 1517003751 OQEMAZVGDOZLSV-UHFFFAOYSA-N 430.597 4.256 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CCCS3)CC2)cc1 1518308778 LJLLYNUAVADCLF-NRFANRHFSA-N 429.634 4.098 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H](C)c3ccc(CC(C)C)cc3)CC2)cc1 1524981835 BWDQISJBGHKYLS-QFIPXVFZSA-N 437.628 4.326 10 10 IICE Cc1nn(CC(=O)NCc2ccc(N(C)C)cc2)c2nc(C(C)C)cc(C(F)(F)F)c12 1531322001 UUOVLRBXEITBMU-UHFFFAOYSA-N 433.478 4.264 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nnn(-c2ccc(OC(C)C)cc2)c1C 1536550004 MELAOEPSCQVADB-GOSISDBHSA-N 435.572 4.098 10 10 IICE Cc1cc(CCC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)ccc1Br 1539236374 SRCLKMPEHNVAHR-NRFANRHFSA-N 432.406 4.175 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnc(Cc2ccc(F)cc2)s1 1546152042 PZBOLQPSZPEVBM-UHFFFAOYSA-N 448.903 4.047 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC[C@H]3CCCCO3)CC2)cc1 1554958786 GIJNVQFHXOAZMJ-HSZRJFAPSA-N 441.620 4.161 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1)OC 1555250710 UWHQEJLMNJOFHX-QFIPXVFZSA-N 437.588 4.250 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3cccnc3)C2)c(C)n1-c1ccc(Br)cn1 1557172728 ZUGSAJAGPKQTMP-QGZVFWFLSA-N 425.330 4.276 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1c(O)cc(F)cc1F 1558957987 FQTROTKUELMMPF-UHFFFAOYSA-N 437.490 4.287 10 10 IICE O=[N+]([O-])c1ccc(N(Cc2ccccc2O)C[C@H]2CCCO2)nc1OCc1ccccc1 1559143190 OBHXZVQTKOEAJG-HXUWFJFHSA-N 435.480 4.460 10 10 IICE COc1cc(C)cnc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1585834689 NCFLYPRXVKQEHI-UHFFFAOYSA-N 438.285 4.123 10 10 IICE Cc1ccccc1OCCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1586620545 ZAPZEQQZFWZFRC-NRFANRHFSA-N 441.572 4.212 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(Br)c(C(F)(F)F)c3)C2)cc1 1587114518 SISVSDQWACOATD-CYBMUJFWSA-N 443.263 4.485 10 10 IICE Cc1cc(Br)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cc1Br 1611430654 FMORJQKOVJJUPV-JTQLQIEISA-N 443.135 4.292 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@](C)(C(N)=O)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1611935858 YBCXKHSELOKEGG-AREMUKBSSA-N 448.615 4.491 10 10 IICE COCCN(C[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CC1)c1ccc(OC)c(OC)c1 1615905020 ZMYZWSJLMRWUJQ-WGSAOQKQSA-N 436.593 4.488 10 10 IICE COC(=O)c1cccc(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)c1 1620686464 IVFHCTGKMYPWDI-UHFFFAOYSA-N 434.492 4.136 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)c1C 1623964325 MJZITMDXWHJHIV-FQEVSTJZSA-N 441.572 4.158 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)NCc2ccc(O)cc2O)C1 1630307576 WOHXPOBOWDOVAI-MOPGFXCFSA-N 446.931 4.018 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(Br)c(Br)[nH]1 1631438479 GXHXGYYBJDUZNI-UHFFFAOYSA-N 428.124 4.054 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1636058908 WIKOKFNYJRXUCG-MRXNPFEDSA-N 425.566 4.167 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N(Cc1ccccc1)C[C@@H](O)c1cccc(OC(F)F)c1 1638990168 FKXDIGDYLDQDNQ-JOCHJYFZSA-N 443.446 4.004 10 10 IICE COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)NCc2cc(O)ccc2O)c1 1643879515 SRWBRJMODFVKNQ-UHFFFAOYSA-N 429.476 4.198 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)N1Cc2cccc(O)c2C1)c1ccc(Br)cc1 1644088111 FWIWHZBPXACOSS-GOSISDBHSA-N 447.329 4.263 10 10 IICE Cc1cc(C(=O)NCc2cnn3c2CCCC3)c(C)n1-c1ccccc1Br 1645368827 WOBCLJGVRUXBSU-UHFFFAOYSA-N 427.346 4.319 10 10 IICE COC(=O)c1ccccc1OCCN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1653349903 XFKFEOIWQXDZOJ-UHFFFAOYSA-N 440.540 4.330 10 10 IICE O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1655104476 ZKYJFCJGZRLXPT-CQSZACIVSA-N 441.713 4.188 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1676549975 QRTSWKGBLZUSIZ-RPBOFIJWSA-N 431.584 4.034 10 10 IICE CCOc1ccc(Cl)cc1CCNC(=O)N1CCCN(c2ccc(OC)cc2)CC1 1680493601 GENTTZVGEMMBMN-UHFFFAOYSA-N 431.964 4.212 10 10 IICE C[C@H]1CN(Cc2ccc(CN(C)C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 1681550873 BAKZQGGWSWTTNT-HBMCJLEFSA-N 438.616 4.264 10 10 IICE C[C@@H]1CCCN(C(=O)OC[C@@H]2CCCCN2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1681552639 QWOGXMPNBNSPSN-KNKQGSTJSA-N 430.593 4.246 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](c3ncccc3C)C(C)(C)C)CC2)c(OC)c1 1685690468 RQSSEIYCIQRZHT-QFIPXVFZSA-N 426.561 4.026 10 10 IICE C[C@H](NC(=O)N1CCOC[C@H]1c1ccc(Br)cc1)c1ccc(N(C)C)cc1 1686173064 AANSYJIZDRORMT-YWZLYKJASA-N 432.362 4.359 10 10 IICE CCOCc1nnc(N2CCS[C@H](C(C)C)C2)n1Cc1ccc(N(CC)CC)cc1 1696349681 BTAREBPEPFXODR-NRFANRHFSA-N 431.650 4.287 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1712118544 SGIFBPAMSSWTJK-UHFFFAOYSA-N 437.588 4.250 10 10 IICE Cc1ccc(-c2nnc(N(C)CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)o1 1724287635 GIWNAWOWNCPGMB-UHFFFAOYSA-N 441.551 4.353 10 10 IICE CC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)C)C1 1727725015 UEFWRCIWFBSIRC-HXUWFJFHSA-N 434.588 4.067 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CCC(=O)NC(C)(C)C 1729405132 PNMFPMODHCNNNQ-UHFFFAOYSA-N 440.636 4.117 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC(C(=O)OC)CC2)cc1 1746093911 TZPIPBLFUZMPQY-UHFFFAOYSA-N 441.620 4.151 10 10 IICE CC(C)c1nnc(N2CCC(c3nccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1760910761 RHOCJUGPEFISQN-UHFFFAOYSA-N 428.581 4.495 10 10 IICE CC[C@@H](C)[C@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)OC 1763443561 IVCHQKXRIYLHCH-BEFAXECRSA-N 429.952 4.397 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1C[C@@H](c1ccsc1)N(C)C 1768682095 SKQOVWQMDWYFSO-FQEVSTJZSA-N 434.569 4.047 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3Cc3ncccc3C)CC2)cc1 1770259523 YYYBOTLSULRDTB-UHFFFAOYSA-N 434.588 4.053 10 10 IICE CN(C)c1cccc(NC(=O)c2cccc(CN3CCN(C(=O)c4cccs4)CC3)c2)c1 1860886370 NIXPYGDVGJMJPS-UHFFFAOYSA-N 448.592 4.024 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1nc2ncccc2cc1Br 1890584941 OWUXCEKGZAPQEA-YJBOKZPZSA-N 437.341 4.311 10 10 IICE O=C(O)CC[C@@H](NC(=O)OCc1ccccc1)c1cc(Br)cc(F)c1O 1951722091 AZCPWLBICCDNMW-OAHLLOKOSA-N 426.238 4.126 10 10 IICE C[C@@H](NC(=O)C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 2017516788 MLSVRBFCYPBXOB-MJGOQNOKSA-N 428.529 4.070 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C3CCC3)c(CO)c2I)c(O)c1 2079013489 LPLSTHHIVKOPOT-GOSISDBHSA-N 438.309 4.261 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)c1O 2227748770 QKVHZXXLAKLRRB-CABCVRRESA-N 429.355 4.089 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1O 2236053577 WYPADIUTVIIDJX-KGLIPLIRSA-N 443.382 4.289 10 10 IICE CCC(C=C1Sc2ccc(OC)cc2N1CC)=C1SC(=S)N(CC(=O)O)C1=O 2295165179 ZIJWUKZCGLJFHC-UHFFFAOYSA-N 436.580 4.078 10 10 IICE COc1ccc(N2CCOCC2)c(NC(=O)C=Cc2cc(Cl)cc(Cl)c2OC)c1 2313806260 ZNCUTPZXKBPBOV-UHFFFAOYSA-N 437.323 4.499 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3ccc(OCCC(=O)O)cc3)SC2=S)cc1 2314931035 LGLUTUWNDKPPBF-UHFFFAOYSA-N 427.503 4.149 10 10 IICE Cc1ccc(CN[C@H]2CN(C(=O)OC(C)(C)C)CC3(CC3)C2)c(O)c1Br 2352941707 UVUIAUHSRPDMQK-OAHLLOKOSA-N 425.367 4.342 10 10 IICE Cc1ccc(CNC(=O)CCCC2CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381143448 REZHUYAXFBXJQP-UHFFFAOYSA-N 441.366 4.117 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc(Br)ccc1O)[C@@H]1CC=C[C@H]21 14461216 NBWONPMIJBUYLO-NVAPDCRFSA-N 443.341 4.357 10 10 IICE CCCn1c(N2CCCCC2)c(/C=C2\SC(=S)N(C(C)C)C2=O)c(C)c(C#N)c1=O 39989955 MEDCGPKHSAYROQ-PDGQHHTCSA-N 444.626 4.038 10 10 IICE CC[C@H](NCCN(CCOC)C(=O)OC(C)(C)C)c1cc(Br)ccc1O 382067234 RJYYBUWZCAHMSA-INIZCTEOSA-N 431.371 4.079 10 10 IICE O=C(NCCc1coc(-c2ccc(F)cc2)n1)N(Cc1ccccc1O)C[C@H]1CCCO1 726710933 ZTGLXKDICTXISL-OAQYLSRUSA-N 439.487 4.120 10 10 IICE Cc1sc(NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])nc1-c1c(F)cc(F)cc1F 729112104 GFFRMJCSUVJSLB-UHFFFAOYSA-N 447.391 4.384 10 10 IICE COc1cc(OC)c(CNC(=O)N(Cc2ccccc2O)C2CCCCC2)c(OC)c1 745655125 AIOPRTKQGUETLV-UHFFFAOYSA-N 428.529 4.463 10 10 IICE C[C@H]1CN(Cc2c(O)ccc3ccc(O)c(CN4C[C@@H](C)O[C@H](C)[C@H]4C)c23)[C@@H](C)[C@@H](C)O1 783547468 XFDKZDPKCUJOHY-WMDIELAYSA-N 442.600 4.246 10 10 IICE C[C@H](NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(N2CCOCC2)cc1Cl 808728668 QQTAZDHFZGVAPD-HNNXBMFYSA-N 428.920 4.459 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)c1C 918134794 RYLZHOUQHYLVIA-QGZVFWFLSA-N 425.554 4.265 10 10 IICE Cc1cc(Br)c(N2C(=O)NC(=O)/C(=C\c3c[nH]c4ccccc34)C2=O)cc1C 1083995637 MBGACICPFJDKHH-OQLLNIDSSA-N 438.281 4.214 10 10 IICE Cc1nc(-c2ccccc2)ncc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126584243 WFLAHWOIASQHLS-GOSISDBHSA-N 438.478 4.452 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(NC(=O)OC(C)(C)C)Cc2ccccc2C1 1136428293 SJUXOUWKZYHRBI-UHFFFAOYSA-N 437.584 4.163 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC(Cc2ccsc2)C1 1148780940 LYSXSXFGWYJUMQ-YVLHZVERSA-N 448.660 4.492 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(CC3CCC3)[C@@H](C)c3ccccc3)CC2)cc1 1167453926 OXRKDIKOXIQMBV-NVQXNPDNSA-N 437.628 4.041 10 10 IICE C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3ccccc23)cc1 1179029794 SVQXGHANMANKMT-QGZVFWFLSA-N 438.549 4.039 10 10 IICE Cc1cc(CCNC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1233973740 JYMFGICQGXGRCA-QGZVFWFLSA-N 428.577 4.191 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1c(C)noc1C 1266353791 COLZQCVLQLPVCY-FDIDWWNZSA-N 447.557 4.289 10 10 IICE CC(C)CN(c1nnc(-c2cccn2C)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1287700312 MHSLOYRYTOSXIZ-UHFFFAOYSA-N 436.604 4.039 10 10 IICE CCOC(=O)c1cnn2ccc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)cc12 1304085553 DUODJSQYTYRVHR-UHFFFAOYSA-N 432.480 4.179 10 10 IICE C[C@]1(c2cccc(CNC(=O)Nc3ccc(N=Nc4ccccc4)cc3)c2)NC(=O)NC1=O 1318107102 QQCXNSCAJXYZIB-XMMPIXPASA-N 442.479 4.478 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)C2CC2)cc1 1354143160 XALVYDQDHWXZBD-WMZHIEFXSA-N 443.950 4.256 10 10 IICE COc1ccc(/C=C(\C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1F 1356037033 RUPUHPBCEZNKFE-JJMLKOEDSA-N 430.495 4.307 10 10 IICE Cc1nnnn1-c1cc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1F 1435008690 IJDPKFRXCSFXOG-UHFFFAOYSA-N 438.894 4.352 10 10 IICE Cc1ccc([C@@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCOCC2)cc1 1441919784 VKCWCZZNQGIBDE-AREMUKBSSA-N 445.563 4.018 10 10 IICE CCN1CC[C@@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C[C@@H]1C 1444620129 VWJISIWPEVWEIO-KBXCAEBGSA-N 433.394 4.196 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@H]3CCCC[C@@H]32)c(C)n1-c1ccc(C(C)C)cc1 1445952385 BKDUSOJJLVSHLY-GOTSBHOMSA-N 428.598 4.399 10 10 IICE Cc1cc(C(=O)Nc2ncc(C(C)(C)O)s2)c(C)n1-c1ccc(Br)cn1 1450645059 ORCDHRQORGNIIC-UHFFFAOYSA-N 435.347 4.188 10 10 IICE Cc1cc(CNC(=O)c2n[nH]c3c2CN(C(=O)OC(C)(C)C)CC3)c(C)n1-c1ccccc1 1454628678 ZIPUUEWFSXIOLQ-UHFFFAOYSA-N 449.555 4.040 10 10 IICE Cc1cc(CC(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1456045155 BEFYURKGMKVAGP-VWLOTQADSA-N 425.573 4.446 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCC3(CCCC3)O2)c(C)n1-c1ccc(Br)cn1 1469668094 IOPORUMEFITLCN-KRWDZBQOSA-N 432.362 4.473 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@@H]1CCC[C@H](OC)C1 1469740235 HMDUGBJNFAGKMV-LKUPVBHCSA-N 432.948 4.224 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2ocnc2C(=O)NCc2cc(Cl)ccc2O)CC1 1469877566 RCKGGZPPPXLEBK-UHFFFAOYSA-N 435.908 4.078 10 10 IICE Cc1cc(CN2CCC(N(CCO)C(=O)OC(C)(C)C)CC2)ccc1N1CCCCC1 1473703842 ATGHRUDSGYUACO-UHFFFAOYSA-N 431.621 4.179 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCNC(=O)c2cccc(Br)c2)cc1 1520158042 IJJFEWNZHLVYQA-UHFFFAOYSA-N 440.341 4.016 10 10 IICE CSC[C@H]1CCCN1c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1520234222 HPCYCRXTRODVEV-GOSISDBHSA-N 440.592 4.234 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccn(-c4ccc(Cl)cc4Cl)n3)C2)cc1 1529403990 MENHLFBMSYUBBQ-OAHLLOKOSA-N 445.350 4.444 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(F)ccc(SCC4CC4)c3F)CC2)c(OC)c1 1534586313 CJMLNWSOOOQABF-UHFFFAOYSA-N 448.535 4.447 10 10 IICE CCn1ncc(Cl)c1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1537251965 VTNLSQPQRAXJJU-UHFFFAOYSA-N 445.708 4.281 10 10 IICE C[C@H]1CCCCN1CCCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1544016961 MONNIDJSFYQYDF-NRFANRHFSA-N 448.615 4.261 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(C)c(S(=O)(=O)NC4CC4)c3)c2C)c1 1544057908 RGKVIKLLNIXBEI-UHFFFAOYSA-N 437.565 4.404 10 10 IICE O=C(/C=C\c1ccsc1C(F)(F)F)NCc1ccc(N2CCC(O)CC2)c(F)c1 1544631289 XUXSOULQSNXVEG-RQOWECAXSA-N 428.451 4.197 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1CCN(c2ccccc2F)C1 1556426671 WTTIFICQJDDXBG-GOSISDBHSA-N 441.547 4.041 10 10 IICE C[C@H](NC(=O)c1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1O)c1ccccc1O 1557968001 OFBVMFYAFSMXOV-ZDUSSCGKSA-N 446.912 4.043 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@]3(C)CCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1585363907 MBQPAEFRVVAPSS-XMMPIXPASA-N 427.545 4.232 10 10 IICE CC(C)(C)c1nnc(N(CCO)Cc2ccccc2)n1CCCSc1nccs1 1597027785 TZWVOPLFNXQOQO-UHFFFAOYSA-N 431.631 4.213 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCCC[C@H]3C)C2)n1Cc1ccc(N(C)C)cc1C 1613997733 FEVKYCMUYJFMPQ-FGZHOGPDSA-N 438.664 4.354 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn(-c2ccc(Br)cc2)c1CC 1623573837 FYHWCZMHJQKBGF-UHFFFAOYSA-N 449.345 4.319 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1630202447 XZXXIUBFKDPQIE-FYYLOGMGSA-N 439.575 4.031 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H]2CCC[C@H](C1)N2C(=O)OC(C)(C)C 1636262988 LNFGNRSWHVVSLZ-YUXAGFNASA-N 444.620 4.175 10 10 IICE C[C@@H]1OC[C@]2(CC[C@@H](CNC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)O2)[C@H]1C 1638513275 JWBYKOGIJGSXRU-DZNWXHPMSA-N 441.572 4.030 10 10 IICE C[C@@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1cc(Cl)cc2c1OCC2 1638652391 ZRWHWIGRFHWGBI-VFNWGFHPSA-N 430.980 4.004 10 10 IICE Cc1cc(C(=O)Nc2cccc3nc(O)[nH]c23)c(C)n1-c1ccc(Br)cn1 1641882836 YEFMTBTVQAMFLH-UHFFFAOYSA-N 426.274 4.086 10 10 IICE COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1F 1657960822 HVQCMJQZQRCUHU-LSDHHAIUSA-N 446.478 4.288 10 10 IICE C[C@@H](NC(=O)NC[C@]1(C(F)(F)F)CCCN1C(=O)OC(C)(C)C)c1ccccc1O 1684251712 LXMAOUAXVUFHIE-YJYMSZOUSA-N 431.455 4.084 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@@H](c3ccccc3F)C2(C)C)N(C)C)cc1 1685686975 UHXATCGJWODQTJ-GMAHTHKFSA-N 426.580 4.472 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1scnc1C 1693005658 JZYIMIXIEXDJGQ-HXUWFJFHSA-N 440.617 4.344 10 10 IICE CCN(CC)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1695639482 VFUGIBFKPCKYLO-UHFFFAOYSA-N 439.629 4.034 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CC[C@@H]1CCCCO1 1696685075 UJUUPJVZVUHBMW-QFIPXVFZSA-N 441.620 4.008 10 10 IICE CO[C@H](C)c1nc(Cn2c(C3CCCC3)nnc2N(C)Cc2ccccc2O)cs1 1697105571 UMFZIVZFDPHIAO-OAHLLOKOSA-N 427.574 4.490 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1709197162 APVNYQYLUPXVCP-WZONZLPQSA-N 448.615 4.456 10 10 IICE COCC(C)(C)Cn1c(C2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1770713166 YFDODAGYOOTKLP-UHFFFAOYSA-N 445.583 4.083 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccc(C)cc3C)sc2CCC(=O)O)cc1 1858034763 GFHMJJDXDNJYJS-UHFFFAOYSA-N 446.550 4.254 10 10 IICE COc1ccc(OC)c(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)c1 1860084371 UVMJUMGBOXLKNP-RQZCQDPDSA-N 432.479 4.026 10 10 IICE Cc1ccc2c(C)c(C(=O)N[C@@H](c3ccc(N(C)C)cc3)c3nccn3C)c(=O)oc2c1C 1866290916 PFKAZFXFFRKHOP-QFIPXVFZSA-N 444.535 4.037 10 10 IICE CC[C@@H](NC[C@H](F)C1CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2112915575 HQWLCYXKJTYFBW-JKSUJKDBSA-N 431.346 4.400 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NCc2ccc(Br)cc2O)C12CCC2 2118413757 QQJQVPZNRCZAKD-WMLDXEAASA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@](NCc3ccc(Br)cc3O)(C2)C1 2138713469 BYQQWQIESMTIBE-VBKZILBWSA-N 425.367 4.424 10 10 IICE COc1ccccc1C=C1SC(=S)N(NC(=O)c2ccc(Br)cc2)C1=O 2296764718 BXVXBAPGHUXZKT-UHFFFAOYSA-N 449.351 4.004 10 10 IICE O=C1NC(=O)N(Cc2ccccc2)C(=O)C1=Cc1ccc(OCc2ccccc2F)cc1 2297357785 IKMQGDVWJVCERJ-UHFFFAOYSA-N 430.435 4.067 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)ccc1O 2321738450 AMRSYAJXUVFESI-UHFFFAOYSA-N 447.534 4.223 10 10 IICE Cc1ccc(CN[C@H]2[C@@H]3[C@@H]2CCCCN3C(=O)OC(C)(C)C)c(O)c1Br 2352944475 INFAQYIMIVLQFG-OIISXLGYSA-N 425.367 4.341 10 10 IICE CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352947998 MDFSGXNGIXVSGB-IAQYHMDHSA-N 429.355 4.019 10 10 IICE CCCCOC(=O)c1ccc(NC(=O)CCCCCN2C(=O)[C@H](C)SC2=S)cc1 11636603 BGEHUJQMEQQTEF-HNNXBMFYSA-N 436.599 4.391 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc(Br)ccc1O)[C@@H]1CC=C[C@@H]21 20696392 NBWONPMIJBUYLO-PXARDIRTSA-N 443.341 4.357 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(CC(C)C)C3=O)c2C)cc1 57496593 SUGGQHGWUUIUGG-XMMPIXPASA-N 425.529 4.032 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 110149507 AKPOONPOOFLFMY-PUZWTLIVSA-N 435.568 4.169 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)cc1)C1CCCCC1 116040074 PSZHRHWNGDKVQY-HSZRJFAPSA-N 435.568 4.082 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2Cc3ccccc3CN2C(=O)CC(C)C)cc1F 731347148 MTQJUYZRAQYUBQ-XMMPIXPASA-N 439.575 4.288 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1nccs1 737670858 OODUWJKTROURPT-UQRISPGASA-N 437.637 4.454 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742800964 NSQITLGMUAMJKV-FPDPHYFHSA-N 443.494 4.281 10 10 IICE CN1CCCc2cc(CNC(=O)N(C)C3C[C@@H]4CC[C@H](C3)N4C(=O)OC(C)(C)C)ccc21 752662259 ZEJFTJFHRYXFAE-WCRBZPEASA-N 442.604 4.141 10 10 IICE CCOC(=O)c1sc([C@@H](C)NC(=O)N(C)Cc2ccc(N(CC)CC)cc2)nc1C 756979179 VKIBOCZUIQZOCE-MRXNPFEDSA-N 432.590 4.377 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 763774206 UHHKZJYAKKMEHS-FPOVZHCZSA-N 428.916 4.305 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)NCc1ccc(N(C)C)c(F)c1 778290197 VPQZNQDBENNNJG-UHFFFAOYSA-N 440.313 4.001 10 10 IICE Cn1ncc(Br)c1/C=C1/SC(=S)N(c2ccc(F)c(Cl)c2)C1=O 779205337 WGYDXLVMQVOUHK-LFYBBSHMSA-N 432.727 4.381 10 10 IICE Cc1c(Br)ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1F 789957051 YGFFXBJTZVSXLU-UHFFFAOYSA-N 435.337 4.035 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(OC(F)F)c(F)c3)n2)cc1 790479326 VAAVVVXKMBQEDX-UHFFFAOYSA-N 430.429 4.360 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](c3ccccc3)c3nc[nH]n3)cc2Cl)C1 800718761 DFCQPQBNQQUXRS-KKSFZXQISA-N 438.963 4.283 10 10 IICE O=C(NCc1cccc(NC(=O)C2CCCC2)c1)NCc1cc(Br)ccc1O 804937458 BBFGDMYTFAIXTB-UHFFFAOYSA-N 446.345 4.283 10 10 IICE C[C@H](c1ccccc1)N1CCC(NC(=O)NCc2cc(Br)ccc2O)CC1 805123764 AILSSTZIKFFTHK-OAHLLOKOSA-N 432.362 4.180 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 810167777 NZGZYBLLFMGZGZ-ZIAGYGMSSA-N 435.565 4.016 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)C2)cc1 1130186030 ZBGDZINIHHSWMY-SFHVURJKSA-N 439.556 4.323 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C)c(NC(=O)c4ccccc4F)c3)C2)cc1 1131030729 UQEGGSJBTSPDCB-LJQANCHMSA-N 447.510 4.404 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H](c1ccncc1)C1CC1 1134646886 YJMISSJRBZBBRP-UMEYKSNOSA-N 443.619 4.392 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccc3n2CCN(C(=O)OC(C)(C)C)[C@H]3C)c1 1137473788 VYHCEVJERDGAPC-GJZGRUSLSA-N 429.517 4.005 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1 1140885571 TUYHCMMGZTYGQZ-IBGZPJMESA-N 433.499 4.469 10 10 IICE CCC[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)c(Cl)c1 1142470001 QIQKNGFLCZXQAM-MRXNPFEDSA-N 431.341 4.342 10 10 IICE C[C@H](CC(=O)c1ccc(F)cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1142713315 SWZXOFLRPWRZHF-JPYJTQIMSA-N 426.532 4.308 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOc1cc(C)ccc1C(C)C 1152402537 ZMFOQOICTUQIGT-UHFFFAOYSA-N 433.932 4.448 10 10 IICE CCOC(=O)c1sc2nc(C)nc(NC[C@@H]3CCN(c4ccc(OC)cc4)C3)c2c1C 1163565768 BHSMTPSTPLBPCT-INIZCTEOSA-N 440.569 4.432 10 10 IICE Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NCc1c(O)cccc1O 1178910101 ACJAFJSBQULUIN-UHFFFAOYSA-N 434.876 4.443 10 10 IICE C[C@H](CSc1ccccc1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251750502 CKDJECQCARRNAK-MRXNPFEDSA-N 435.540 4.124 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c2C)c1 1253531911 NEMGGOHDDZFCFY-KRWDZBQOSA-N 428.577 4.457 10 10 IICE CC(C)CN(c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1287706954 NZKKLDPFZINPQJ-OAQYLSRUSA-N 443.661 4.254 10 10 IICE C[C@H]1CC[C@@H](Cn2c(CNC(=O)c3cccs3)nnc2N(C)Cc2ccccc2O)C1 1291057608 KDYXBAVCYSGYOL-DLBZAZTESA-N 439.585 4.048 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3coc4c(F)c(F)ccc34)cc2F)C[C@H](C)O1 1355129265 DYBZCQNJHFASJI-KBPBESRZSA-N 432.442 4.323 10 10 IICE CC(C)CCn1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1355738590 WIDZKESVZMMSHK-LGMDPLHJSA-N 446.573 4.298 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(OCc2ccccc2)cs1 1357836150 OIGNQLMBTXHSJJ-UHFFFAOYSA-N 426.513 4.233 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)oc1Br 1361063456 OCZNUTNPFLOVRL-LBPRGKRZSA-N 429.261 4.351 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCc3c(CC(N)=O)cccc3C2)cc1 1454677843 HEVMFXGHYSZHHK-UHFFFAOYSA-N 441.535 4.394 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2 1460981550 HMYTYWFTDDZWNF-IQMFZBJNSA-N 444.000 4.391 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](CCC(=O)OC)Cc3ccccc3)ccc21 1466611003 LMJMFGMOXOEQGQ-QFIPXVFZSA-N 436.552 4.199 10 10 IICE CC(C)(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)NCc2cc(Cl)ccc2O)cc1 1469875118 UTDZFKYGMSQVOA-GOSISDBHSA-N 432.973 4.175 10 10 IICE Cc1cc(CCNC(=O)NCCCCNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1478415393 GUIIGYVRMCQJBX-UHFFFAOYSA-N 428.577 4.241 10 10 IICE COc1cccc(CNC(=O)N[C@@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)c1O 1478969193 DTZGELSJUXSNQX-GOSISDBHSA-N 427.501 4.235 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC1(C(=O)OC(C)(C)C)CCC1 1479040462 AHOJOSJMNZQKSZ-UHFFFAOYSA-N 441.366 4.198 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1Cc1ccsc1Br 1503489277 NWFDGKQRSVPGTB-UHFFFAOYSA-N 433.375 4.445 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CC1 1504020918 FMMOOHLFWAWWHA-OAQYLSRUSA-N 444.630 4.374 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1cnn(Cc2ccccc2)c1Br 1520359606 QZMJYYUOXLKNQB-UHFFFAOYSA-N 432.665 4.136 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3c(C)nn(Cc4ccc(C)cc4)c3Cl)C2)cc1 1531730187 SNQDBOUOSKCQCY-IBGZPJMESA-N 438.959 4.219 10 10 IICE Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)c(O)c1O 1538666374 NWIWEZDMKRXUOO-UHFFFAOYSA-N 432.885 4.113 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1 1540537761 JCJYKLXFIGVHHL-VWLOTQADSA-N 441.547 4.242 10 10 IICE C[C@H](CN1CCCC1)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1541873063 JDAAIWABZOXIQV-GOSISDBHSA-N 425.602 4.004 10 10 IICE CC(C)c1ccc([C@H](CNC(=O)Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)cc1 1543072797 ATOGHCAPQBZMTH-IBGZPJMESA-N 428.529 4.146 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)[C@H]2CCC[C@@H](C)C2)cc1 1547444291 LJOOXBAAEBFPGX-KNQAVFIVSA-N 440.636 4.326 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](CCc1ccccc1)c1ccccn1 1565127000 HSKWPLARTUWPNL-AREMUKBSSA-N 444.579 4.216 10 10 IICE Cc1[nH]c2ccccc2c1SCCNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1565452916 NXYJGOWQPQEFMQ-QFIPXVFZSA-N 439.629 4.237 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)cc1 1565785320 GISYHJBNLBIXKH-QGZVFWFLSA-N 441.572 4.068 10 10 IICE CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1583919367 PWSNLYWZXKTIOW-XUZZJYLKSA-N 439.556 4.437 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(Cl)cc3Br)C2)cc1 1584444275 LPIBKNUKKDEUAK-AWEZNQCLSA-N 437.765 4.296 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCC(=O)N(c3cccc(F)c3)C2)c(C)n1-c1ccccc1 1587464971 BWCQDRRYQDTNIW-NRFANRHFSA-N 433.527 4.335 10 10 IICE C[C@H]1CC[C@@H](C)CN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1612716618 HQTKTXGMDXMNRF-UXHICEINSA-N 425.621 4.376 10 10 IICE COc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(OC2CCCC2)c1 1616858684 QNSNKGQFGUWRFV-QHCPKHFHSA-N 425.573 4.115 10 10 IICE O=C(Cc1nc(-c2ccccc2)cs1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634806 JDNISQPLNNIEDS-LJQANCHMSA-N 441.984 4.492 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] 1625567625 NBPMEICVDOWVNC-UHFFFAOYSA-N 448.445 4.398 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)COC[C@H](C)c1ccccc1 1626512205 XJQAWYMRLXZXEE-IBGZPJMESA-N 426.557 4.195 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4c(Br)c(F)ccc4[nH]3)C2)cc1 1627163388 UEKGHQCCONBGOP-CYBMUJFWSA-N 446.320 4.334 10 10 IICE Cc1cc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)n1-c1ccccc1 1629964477 ZPUOOUVHANHUIL-UHFFFAOYSA-N 435.543 4.053 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(NC2=NCCC2)cc1 1630280660 PCBPJXAOBFHDGS-SFHVURJKSA-N 428.483 4.291 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccccc2F)c(C)n1-c1ccccc1Br 1635451275 GRIGTHLDAVKRJX-HXUWFJFHSA-N 431.305 4.459 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 1636058677 MTOQNCZBUPEQHV-UHFFFAOYSA-N 443.500 4.256 10 10 IICE CN(C(=O)OC(C)(C)C)c1cccc(C(=O)NCc2cccc(Br)c2O)c1 1640089087 ZKDULRBLPMTWEZ-UHFFFAOYSA-N 435.318 4.456 10 10 IICE CCOc1ccc(Nc2ncccc2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1640232461 QSDMVVGMGMWGNH-XMMPIXPASA-N 447.583 4.323 10 10 IICE CS(=O)(=O)c1ccc(CN(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)o1 1652703419 OUQBKLDDPAACIQ-YVMONPNESA-N 425.506 4.174 10 10 IICE COc1ccc2c(c1)CCCCN2C[C@@H](O)c1ccc2c(c1)CN(C(=O)C(F)(F)F)CC2 1652934231 JFDNAUAZJSYGLZ-JOCHJYFZSA-N 448.485 4.019 10 10 IICE CN(CCN1C(=O)c2ccccc2C1=O)CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1654022877 SCFMOPBSFLUZTR-UHFFFAOYSA-N 441.491 4.269 10 10 IICE COc1ccc([C@@H](NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c2ccccc2)cc1 1683944316 BYKDZNIFSNFVIO-BWKNWUBXSA-N 431.536 4.371 10 10 IICE CC[C@H]1CCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763366650 KRQTYFMDNLWQSZ-NRFANRHFSA-N 425.621 4.211 10 10 IICE O=C1/C(=C\c2ccc(Br)cc2F)SC(=S)N1CCCn1ccnc1 1858590798 JKFJVEBJLILZNR-RIYZIHGNSA-N 426.336 4.076 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ccc(C)cn2)sc(C)c1-c1ccc(C)c(C)c1 1860748530 DZLJJQRBDQFLMN-UHFFFAOYSA-N 437.521 4.408 10 10 IICE O=S(=O)(Nc1cc(Br)cc(C(F)(F)F)c1)c1cccc2nsnc12 1891525994 FSIVQNWUDYCCSD-UHFFFAOYSA-N 438.250 4.273 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(C)(C)C)c(C(=O)O)c1I 2079027228 QHBYOUKYCCEVBN-LBPRGKRZSA-N 442.297 4.497 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C2CC2)c(C(=O)O)c1I 2079986415 OHXPYPGBPCUASY-ZDUSSCGKSA-N 440.281 4.385 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@@H]1NCc1cc(Br)ccc1O 2144145374 RMTXEHVTVILOKT-PKOBYXMFSA-N 433.346 4.435 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccc(C(=O)O)cc2)cc1 2332139409 DPFIEFJAYOCUCR-UHFFFAOYSA-N 428.444 4.237 10 10 IICE Cc1cccc(N2CCN(C3=NC(=O)/C(=C/c4c[nH]nc4-c4ccccc4)S3)CC2)c1 1873566 NIODHFWLUWHXCB-QNGOZBTKSA-N 429.549 4.178 10 10 IICE COc1ccc([C@@H]2N=C(c3ccc4c(c3)OCO4)C[C@H](c3ccccc3O)N2)cc1OC 53363255 CLEAOMNBWGEQGZ-KBMIEXCESA-N 432.476 4.361 10 10 IICE CCN(C(=O)c1ccccc1-c1ocnc1C(=O)NCc1cccnc1)c1ccccc1 65080247 UGTBCZKFYPUFND-UHFFFAOYSA-N 426.476 4.333 10 10 IICE O=S(=O)(Nc1ccc(F)c(F)c1)c1ccc(NCc2ccc(N3CC=CC3)cc2)nc1 301571579 METLPDDFPLWEIH-UHFFFAOYSA-N 442.491 4.149 10 10 IICE COc1ccc(OC)c([C@H](C)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743565226 UXDXGUQZDDXFBY-HOTGVXAUSA-N 449.498 4.334 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(-c2cccnc2)cc1 747495747 NLOBBFJUMPNMHU-GOSISDBHSA-N 434.515 4.285 10 10 IICE CCOC(=O)c1c(NC(=O)CCN[C@@H]2CCOC[C@@H]2C)sc(C)c1-c1ccccc1 763921597 VGFMAKKUMOLXDB-MAUKXSAKSA-N 430.570 4.243 10 10 IICE CN(Cc1ccc(F)c(Cl)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 764472853 PHFHBBJDWDBDNG-UHFFFAOYSA-N 444.982 4.353 10 10 IICE O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 772495018 PRFCVVGWMOZCPC-NNMXDRDESA-N 445.510 4.334 10 10 IICE Cc1nc2c(s1)[C@H](NC(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)CCC2 780833976 IRBXZQMLPVWBEC-KBXCAEBGSA-N 436.528 4.399 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(Br)cc2c1OCCO2 1124622405 DTISEGNUTTUNTI-UHFFFAOYSA-N 431.330 4.093 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c2ncccc12 1125132192 VGDNEXYRDZQLIF-UHFFFAOYSA-N 429.442 4.329 10 10 IICE Cc1ccc2nc(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)[nH]c2c1 1129274490 LCYMLDVDYAZUPU-GZTJUZNOSA-N 440.525 4.240 10 10 IICE CCOC(=O)c1sc2nc(C)nc(NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2c1C 1164318040 LDIOSYXWBQTHKI-SFHVURJKSA-N 441.601 4.266 10 10 IICE COC(=O)c1cc(OCc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)ccc1N(C)C 1189977272 JREJDQGDNCVKIV-UHFFFAOYSA-N 439.533 4.259 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1 1230524914 NCEZJAONKZWOAY-UHFFFAOYSA-N 432.609 4.321 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CSc4ccc(Br)cc43)C2)cc1 1248182870 HNRZRLODSMOAMZ-KDOFPFPSSA-N 448.386 4.183 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCC[C@@H]1CCC2(CCOCC2)CO1 1248646137 OZJVSFGGPCYUDN-QHCPKHFHSA-N 429.605 4.184 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H](c2ccccc2)CC1 1251750566 FEZXPGZDZGVVOQ-HXUWFJFHSA-N 429.511 4.281 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(Cc2cccc(F)c2)CC1 1251751120 WPGMZTWMUSENRP-UHFFFAOYSA-N 447.501 4.105 10 10 IICE CC(C)N1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1287994411 VKIKCBOCUCQYQK-UHFFFAOYSA-N 430.616 4.041 10 10 IICE Cc1cscc1Cn1c(N(C)Cc2ccccc2O)nnc1[C@@]1(OC(C)C)CCOC1 1290362929 WSNMDXMAAKMKMV-HSZRJFAPSA-N 442.585 4.079 10 10 IICE CCC1CCN(c2nnc(C(=O)N3CCCC3)n2Cc2ccc(N(CC)CC)cc2)CC1 1293445595 KPIVHKFOMKMBLA-UHFFFAOYSA-N 438.620 4.035 10 10 IICE Cc1cc(C(=O)NC2CCN(C3CCCC3)CC2)c(C)n1-c1ccc(Br)cn1 1294385937 PKOBDZIAEUKUKB-UHFFFAOYSA-N 445.405 4.388 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(C)nn(Cc3ccc(Cl)cc3)c2C)cc1 1300281893 TWTWVHQQWMHVJV-UHFFFAOYSA-N 440.975 4.419 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)c(F)c1 1305370327 OHVFMBCHDFQJFN-JXFKEZNVSA-N 439.583 4.292 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@](O)(CC)C2)sc(C)c1-c1ccccc1 1307992869 CYTKPHQCPJOWAC-HSZRJFAPSA-N 430.570 4.076 10 10 IICE CCN(C)c1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1Cc1ccc(N(C)C)cc1C 1313568562 DDHCNQIFOQADRF-FQEVSTJZSA-N 442.608 4.229 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCCCS3)CC2)cc1F 1315512785 NQCICHFTQDPNHR-SFHVURJKSA-N 447.624 4.336 10 10 IICE CCOC(=O)c1c(NC(=O)c2cnn3c2OCCC3)sc(C)c1-c1ccc(C)cc1 1350796246 CWLHZIRKXQTYHT-UHFFFAOYSA-N 425.510 4.440 10 10 IICE COC(=O)[C@H](C)CN(Cc1ccccc1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1352408528 CDLYCSYHECDTRF-LJQANCHMSA-N 448.563 4.367 10 10 IICE COc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(OCCC(C)C)c1 1434912317 VTAHULJZNMMLAY-IBGZPJMESA-N 426.557 4.448 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3cc(F)cc(N4CCOCC4)c3)ccc21 1437021147 ANPCHMYBFYCONR-UHFFFAOYSA-N 440.515 4.237 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Cl)c(Br)cc3F)C2)cc1 1437582056 VKNNRNZOFVPWFC-LLVKDONJSA-N 427.701 4.259 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc2n(n1)CCC[C@H]2NC(=O)OC(C)(C)C 1445654258 JOGMFYOGEUZUCX-QGZVFWFLSA-N 428.533 4.001 10 10 IICE Cc1cc(C(=O)N(C)[C@@H](CCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1445894142 RUGPYIRHNIXMSY-FQEVSTJZSA-N 442.357 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1447316676 WVRAOBGPISWCAK-FQEVSTJZSA-N 425.529 4.036 10 10 IICE C[C@H](CN(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nccs1 1458215985 ODGACMWIUJNAHQ-YYTPVVGHSA-N 449.598 4.136 10 10 IICE Cc1noc(C[C@@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)C2)n1 1469961612 WFRUCTOAJOYTFJ-APWZRJJASA-N 445.995 4.432 10 10 IICE CC(C)N(CC(F)(F)F)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1515101517 LIYNDNSJHAXHMK-ZROIWOOFSA-N 434.480 4.216 10 10 IICE Cc1cnc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1516530924 DBFJMFKXKMAQPO-ZENNRRHLSA-N 435.571 4.059 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@H](CN(C)C)Oc2ccccc21 1517788640 MNLQKGWCMBUBTE-ARKBFRDHSA-N 431.536 4.393 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Oc1ccc2c(c1)CCCO2 1524344789 FUIBHUHWRXCXHB-XDHOZWIPSA-N 443.521 4.348 10 10 IICE CC[C@H](CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)CC(F)(F)F 1529164490 KUVMGELAKUGBQX-NSHDSACASA-N 434.370 4.079 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCCc3ccc(Br)s3)C2)cc1 1529708593 PRUQJNUYEMOQQH-HNNXBMFYSA-N 437.403 4.485 10 10 IICE COC(=O)COc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1538422927 ZZVHQYBDHMSEFI-INIZCTEOSA-N 430.932 4.058 10 10 IICE CC[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)[C@H](O)c1c(F)cccc1F 1545596698 XUUXOUSRKMMVGQ-DHLKQENFSA-N 440.490 4.356 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(OC2CCCC2)c(OC)c1 1546152255 YKBAIDZGBUQDMF-UHFFFAOYSA-N 447.915 4.191 10 10 IICE COc1cc(Br)cc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 1565323816 CPSFXQHIJMRACX-GOSISDBHSA-N 449.345 4.054 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(-n4nccc4C(F)(F)F)c3)CC2)cc1 1566562625 MCIVABVRSXYDDT-UHFFFAOYSA-N 444.457 4.252 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1627390532 FSADHNIALRDAKF-MHECFPHRSA-N 432.520 4.057 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)[C@H]2CCCCO2)NC(=O)OC(C)(C)C)cc1 1629678517 BNYKIMYILXZAQL-WOJBJXKFSA-N 433.593 4.030 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3C2=O)c(C)n1-c1ccccc1Br 1631827245 ROGLKCPBVLUNGU-GOSISDBHSA-N 439.309 4.230 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)c2ccccc2Br)c(C)n1-c1ccccn1 1638083164 CBJCZVFBBNOBQD-IBGZPJMESA-N 428.330 4.057 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(OC(F)(F)F)c(Cl)c1 1638529882 ZABCJQYWUUWDIL-UHFFFAOYSA-N 431.794 4.150 10 10 IICE CNC(=O)Oc1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1641344906 UFPLCWRJJHCKHX-UHFFFAOYSA-N 443.301 4.222 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)c(C)n1-c1ccc(Br)cc1 1641855310 WPVIXAQNOUHHRO-MRXNPFEDSA-N 446.389 4.233 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)[C@@H](C)c3ccccc3Br)C2)cc1 1683782792 VHPHQSVJMCFWLY-JKSUJKDBSA-N 432.362 4.439 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCO[C@H](C)C1 1693995503 HSHKWJXQQCIZRC-TUNNFDKTSA-N 441.620 4.080 10 10 IICE C#CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(=O)OC)CC1 1705525364 FZFMXEKASXMOMS-UHFFFAOYSA-N 445.567 4.155 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](F)(C#N)C1 1705653912 SNTRXOORTOHWMX-DEOSSOPVSA-N 448.571 4.161 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)[C@@H]2CCCc3c2cnn3C)nnc1C(C)(C)C 1707305469 AQIXCQQDALEBQC-OAQYLSRUSA-N 435.620 4.246 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1Cc1ccc(OCC2CC2)nc1 1711095358 KAIFAPDTVPRZRL-UHFFFAOYSA-N 435.572 4.441 10 10 IICE CC1CCN(c2ccc(Cn3c(C(C)C)nnc3N(C)CC(=O)NC(C)(C)C)cc2)CC1 1726592757 QDWHGPXIFAOXHX-UHFFFAOYSA-N 440.636 4.037 10 10 IICE CCN(Cc1ccccc1)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1728437706 XKWBKZFTTZHUNH-SFHVURJKSA-N 429.615 4.447 10 10 IICE C[C@@H]1CN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)CC(C)(C)C1 1752281893 UJAIJLKJYKLHSO-INIZCTEOSA-N 448.662 4.025 10 10 IICE CC[C@@H](C)c1nnc(N2CC=C(C(F)(F)F)CC2)n1Cc1ccc(N2CCOCC2)cc1 1763572155 RXMVAYVBOLCYLE-QGZVFWFLSA-N 449.521 4.375 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1765534530 FHANXHGHGXFPFS-WIYYLYMNSA-N 429.634 4.356 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(Cc4ccc(C(=O)O)cc4)C3=O)n12 1858590740 GYYAGLOMWMSCAA-AWNIVKPZSA-N 449.966 4.457 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCC[C@H]4C)nc(-c4cccnc4)n3)CC2)cc1 1868003033 VHGKGRCEFBOJEA-HXUWFJFHSA-N 444.583 4.253 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)CC12CC2 1965989010 SWWXBUPXGOGDSL-AWEZNQCLSA-N 429.330 4.316 10 10 IICE O=C(N[C@H]1CC12CC(NCc1cccc(Br)c1O)C2)OCc1ccccc1 2026164497 TZQFJQIDSPJQIW-JGCRXCKMSA-N 431.330 4.092 10 10 IICE CN=c1cc(C(=O)C(=O)c2ccc3cc(OCc4ccc(OC)cc4)ccc3c2)cc[nH]1 2059918779 XLBVHRNKASYJFY-UHFFFAOYSA-N 426.472 4.352 10 10 IICE CC(C)[C@H]1[C@@H](NCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2126372080 OSSSSTGQLLVFOX-HOTGVXAUSA-N 431.346 4.417 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(CNCc2cc(Br)cc(F)c2O)C1 2136105924 IIOVBIHYIDIIGC-ORAYPTAESA-N 429.330 4.031 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)CC2)c1O 2236051014 NDQOMUBVUKVLFY-KBPBESRZSA-N 443.382 4.479 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccccc3C(=O)O)C2=O)cc1 2293039509 GTHQYKCVZCYVTI-UHFFFAOYSA-N 440.546 4.177 10 10 IICE Cc1c(C=C2C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c2ccccc2n1C 2313565200 ZSNDMPIIWWJJAT-UHFFFAOYSA-N 428.275 4.460 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)C2=Cc2ccccc2C(=O)O)cc1 2332131822 JKHHNLGSYPTAOB-UHFFFAOYSA-N 430.435 4.363 10 10 IICE Cc1ccc(CN(C)C(=O)CC(C)(C)NC(=O)OC(C)(C)C)c(O)c1Br 2352673364 QDTNFYDSQOEMPE-UHFFFAOYSA-N 429.355 4.115 10 10 IICE Cc1ccc(CNC[C@]23CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352678208 DAYMHCHBWNGQIK-YWZLYKJASA-N 425.367 4.200 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457445 NMFAWQPPLQLABQ-OLWVPUELSA-N 428.554 4.304 10 10 IICE CCCN1C(=O)/C(=C\c2c(Sc3ccccc3)nc3ccccn3c2=O)SC1=S 33339862 NYCZPXGTMHCOHQ-DTQAZKPQSA-N 439.587 4.457 10 10 IICE CCCC1=NN2C(=N)/C(=C/c3cccn3-c3ccc([N+](=O)[O-])cc3Cl)C(=O)N=C2S1 96462510 YMJZIURXXYXMRX-JBTBNTSXSA-N 442.888 4.458 10 10 IICE COc1ccc(N2CCCN([C@H](C)C(=O)N3CCC(Cc4ccccc4)CC3)CC2)cc1 108088749 DNPPETATCIBSKJ-JOCHJYFZSA-N 435.612 4.077 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(-c4ccco4)nc4onc(C)c34)CC2)cc1 110362639 KKXVEPASDIILSK-UHFFFAOYSA-N 432.480 4.199 10 10 IICE CCOc1ccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526278782 DTNLAGCTLFZLSP-HSZRJFAPSA-N 443.459 4.430 10 10 IICE CC(=O)N1CCCc2ccc(S(=O)(=O)Nc3nc(-c4ccc(F)cc4)cs3)cc21 737381336 LLSGRPSSEOUANL-UHFFFAOYSA-N 431.514 4.049 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(Cl)s1 748025120 SQEXCHNGYRKBOS-JTQLQIEISA-N 442.971 4.460 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 762262624 ZRCBTBBZNWFNPA-UHFFFAOYSA-N 433.439 4.290 10 10 IICE Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 772882930 JMSWYQBGPYAIAI-OAQYLSRUSA-N 426.948 4.312 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3[nH]ccc3s2)NC(=O)OC(C)(C)C)cc1 793575693 XMQVHAKIBFWPDV-KRWDZBQOSA-N 428.558 4.291 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N1CCCC[C@@H]1C(F)F 800209053 PXOKKWIEXJPLGL-KECPUOCWSA-N 430.567 4.376 10 10 IICE COCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)CC1 802684965 UZBXTYGYPLVVLF-QHCPKHFHSA-N 449.599 4.394 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1CCCN(c2nc3ccccc3s2)C1 804737971 XOUZUFGCMYYGSY-CYBMUJFWSA-N 446.370 4.297 10 10 IICE CCOc1cccc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)c1O 809759071 ZGRGZOARKMJSQQ-UHFFFAOYSA-N 425.447 4.259 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc2ccccc2cc1OC(F)F 1129660139 LEBWCKREWOLFQY-UHFFFAOYSA-N 448.416 4.486 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1c(F)ccc(Br)c1F 1129974148 NLZCVQUIQXXSGY-ZDUSSCGKSA-N 425.317 4.392 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N(CC(F)F)CC(F)F 1134086340 ALTCURNTYBIAQX-XFFZJAGNSA-N 440.509 4.088 10 10 IICE COC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1135563246 NMNFRMZQDFLFSJ-UHFFFAOYSA-N 428.286 4.291 10 10 IICE O=C1C[C@@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CN1c1ccccc1F 1229108359 FKXOUNXUEOXODI-GOSISDBHSA-N 425.504 4.181 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C(C)=C/c3cccc(Cl)c3)CC2)cc1 1264273590 JLOWQBLZDRDHPH-HTXNQAPBSA-N 427.976 4.080 10 10 IICE CN(C)c1ccc(N(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1274329814 MYCNZOBHLQMCPQ-XMHGGMMESA-N 443.569 4.146 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1292572004 DYEJRDBEPDBBII-IBGZPJMESA-N 441.572 4.480 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)c2C)cc1 1295098083 KELSXYBZVPALJD-DEOSSOPVSA-N 431.536 4.024 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@@]23CCN(C(=O)OCc2ccccc2)C3)cc1 1354542073 VACBFNCSTHWKBQ-ZEQKJWHPSA-N 435.568 4.198 10 10 IICE COc1ccc(N2CCC(NC(=O)CSc3ccccc3Br)CC2)cc1 1358164808 FABNPLPOCCSARE-UHFFFAOYSA-N 435.387 4.335 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cccc2[nH]ccc12 1438773978 AEEGCCZSBAMFQE-XDHOZWIPSA-N 439.537 4.215 10 10 IICE COc1cccc(N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1440369662 KWBSXDYFOINCCA-UHFFFAOYSA-N 431.536 4.186 10 10 IICE Cc1cc(C(=O)Nc2nnc([C@H]3CCCO3)s2)c(C)n1-c1ccc(Br)cn1 1454994585 YELJHKSLILPILJ-CQSZACIVSA-N 448.346 4.207 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)Cc1cccc(Br)c1OC(F)F 1460281411 XXDBGKTYGKURTH-UHFFFAOYSA-N 444.272 4.321 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(C(=O)N=S(C)(C)=O)cc3)ccc21 1460574124 BKAKRBBEIIOTDC-UHFFFAOYSA-N 441.553 4.025 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCN3CC(F)(F)F)cc2Cl)C1 1469959668 LXCOPJSMGGWZLK-NVXWUHKLSA-N 446.945 4.402 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@H]1Cc1ccccc1 1531792461 JMCXKAHXUJBEDY-XLZBRSFNSA-N 440.565 4.164 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cncc(I)c3)c2C)c1 1534759950 OSJIWLMQQIZDJQ-UHFFFAOYSA-N 445.304 4.332 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 1537458643 GWKTXWDWZQYCHQ-UHFFFAOYSA-N 447.482 4.037 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3c(C)nn(-c4ccc(Cl)cc4)c3C)C2)cc1 1538746504 KXELNMABFQCTRT-LJQANCHMSA-N 438.959 4.089 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2ccc(F)cc21 1538861039 SNBIAYBNRMBLBR-WOJGMQOQSA-N 430.501 4.145 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccncc1 1540518194 DTZKUUKNISIMKC-IZZNHLLZSA-N 428.580 4.022 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1541577858 CJAOVTDVQCXQQF-NRFANRHFSA-N 425.621 4.258 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccn(-c4ccccc4[N+](=O)[O-])n3)c2C)c1 1544078663 BAXKQIGFHOWAJL-UHFFFAOYSA-N 429.480 4.426 10 10 IICE Nc1cc(C(F)(F)F)ccc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1545040473 GCPXCIRZXQPGEA-ZDUSSCGKSA-N 429.389 4.288 10 10 IICE CCc1nnc(N2CCCO[C@H](c3ccccc3)C2)n1CCCSc1nccs1 1546518813 OJDLXALSSQKZLJ-SFHVURJKSA-N 429.615 4.447 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1548039076 XYHFBQBLRIELEH-HKBOAZHASA-N 445.583 4.023 10 10 IICE COc1cc(/C=C/C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc(Br)c1O 1587548055 WNIVNHHIPKPRDI-JXMROGBWSA-N 445.357 4.435 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](O)COc2ccccc2Br)cc1 1587954855 RELFHULTFTXSSZ-IBGZPJMESA-N 443.341 4.026 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCc3cccc(Cl)c3O)cc2CC1 1606868100 IYGNPEYSMKFBFK-UHFFFAOYSA-N 430.932 4.311 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(OC3CCCC3)nc2)cc1 1626013414 OIYHRFFITDLBDM-UHFFFAOYSA-N 431.536 4.482 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3nc(-c4ccccc4)cs3)cc2F)C[C@@H](C)O1 1626159474 YHYXTPAZMUXANF-IAGOWNOFSA-N 439.556 4.422 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CCCC1 1628191659 OTXGUVWPLAUIIW-KRWDZBQOSA-N 441.572 4.044 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2scnc2C(F)F)NC(=O)OC(C)(C)C)cc1 1629685404 MRPHYUWISSZNFV-CQSZACIVSA-N 440.516 4.143 10 10 IICE Cc1cc(C(=O)NCc2ccnc(N3CCN(C)CC3)c2)c(C)n1-c1cccc(C(C)C)c1 1630132309 DAHGBYQVJNHVQI-UHFFFAOYSA-N 445.611 4.294 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)C2)cc1 1630618669 DFRRQVBIJSFQST-RXVVDRJESA-N 447.620 4.309 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c[nH]nc1-c1cccc(Cl)c1 1631425986 UZSNDXPOOXUKFI-GOSISDBHSA-N 445.350 4.484 10 10 IICE COc1ccc(N2CCC(NC(=O)C3=Cc4ccccc4O[C@H]3C(F)(F)F)CC2)cc1 1632045164 YHVGDSGUIQOEBK-OAQYLSRUSA-N 432.442 4.187 10 10 IICE Cc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1S(=O)(=O)Nc1cccc(Cl)c1 1643168402 BMIMTCRVGJHRQZ-UHFFFAOYSA-N 442.924 4.311 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(O[C@@H](C)c4ccccc4)nc3)C2)cc1 1643351365 SEINMPSYGVSLHY-PMACEKPBSA-N 431.536 4.487 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2CC(=O)NC1CCN(Cc2ccccc2C)CC1 1646307498 SWJPDWRKXABRHG-DEOSSOPVSA-N 449.639 4.419 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c(C)n1-c1ccccc1 1674925014 YMJJBWPSWOUDFP-AOYPEHQESA-N 435.543 4.146 10 10 IICE C[C@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1)c1ccc(N(C)C)cc1 1681778475 BYPVBCQWCUSFCJ-HSQYWUDLSA-N 440.544 4.237 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)[C@H](C)c3ccccc3Br)C2)cc1 1683782789 VHPHQSVJMCFWLY-CVEARBPZSA-N 432.362 4.439 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)C2CC2)cc1 1684759475 DFNOYERLXBKPPU-IBGZPJMESA-N 444.620 4.464 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3c(C)nn(C)c3C)n2Cc2ccc(N(C)C)cc2C)o1 1693040996 FJTWKFTYCDCVRK-UHFFFAOYSA-N 447.587 4.256 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCSC1 1694129361 CPSCVYZVTMEPPF-ROUUACIJSA-N 447.624 4.409 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N2CCCN(C(C)(C)C)CC2)cc1 1695623409 BSEVCXNXPWEXSI-UHFFFAOYSA-N 438.664 4.436 10 10 IICE C[C@H]1CCC[C@H]1Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1726540206 USXAABNEWWJBDC-FPOVZHCZSA-N 425.621 4.485 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C1 1728409944 ONNQAJITWMXVFR-KRWDZBQOSA-N 436.695 4.383 10 10 IICE CO[C@@]1(C)CCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1748472894 JZOOPQUASKEYGX-JXFKEZNVSA-N 437.635 4.164 10 10 IICE COCCO[C@@H](C)c1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1749940019 QATPTGOPHSJLDS-QUCCMNQESA-N 443.636 4.297 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763246305 DCXSWEBVKYKFTM-YKSBVNFPSA-N 439.648 4.358 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(SC)CC1 1763712764 XIARBXMKUAAEAA-SFHVURJKSA-N 429.634 4.413 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1)OC 1765558745 YHQNLLQMCQHATL-QFIPXVFZSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3ccc(N(C)Cc4ccccc4)cc3)CC2)cc1 1858121427 BZCZKTPYAOPVGJ-UHFFFAOYSA-N 429.564 4.223 10 10 IICE COC(=O)c1c(NC(=O)C(=O)NCc2ccc(F)cc2)sc(C)c1-c1ccc(C)cc1 1860760827 DSKSFEHNTWTOFQ-UHFFFAOYSA-N 440.496 4.213 10 10 IICE Cc1cc(O)c([C@@H](n2nc(C(F)(F)F)c(C(N)=O)c2Br)C2(C)CC2)cc1C 2080032138 AUGMPHQXQXSWRB-CQSZACIVSA-N 446.267 4.475 10 10 IICE COc1ccc(N2C(=O)C(=Cc3ccc(-c4cccc(Cl)c4)o3)C(=O)NC2=S)cc1 2294259255 XVKABSWSIUSPOY-UHFFFAOYSA-N 438.892 4.440 10 10 IICE O=C(CCN1C(=O)C(=CC=Cc2ccccc2)SC1=S)Nc1cccc(C(=O)O)c1 2297350895 REKMQJYETOXPRJ-UHFFFAOYSA-N 438.530 4.171 10 10 IICE Cc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(Br)ccc2OC(C)C)C1=O 2313548368 UHKFNGKBAJBJJF-UHFFFAOYSA-N 443.297 4.211 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccc(OC)cc3)SC2=S)cc1 2314836743 JLQXZZVZEAANIF-CQSZACIVSA-N 442.562 4.322 10 10 IICE CCN(CC)CCCN1C(=O)C(=Cc2c(Cl)nc3scc(C)n23)SC1=S 2323767676 HPHAIQSGOICRLW-UHFFFAOYSA-N 429.036 4.291 10 10 IICE CCCN1N=C(c2ccc(OC)cc2)C(=Cc2cc(Br)cc(OC)c2O)C1=O 2332124702 HLQNACUYJCZRJH-UHFFFAOYSA-N 445.313 4.212 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@@H]1[C@@H](NCc1cccc(Br)c1O)C2 2333989193 QFAWNNVFZYQQAK-JSQNDZKTSA-N 425.367 4.326 10 10 IICE Cc1ccc(Cc2cnc(NC(=O)CCN3C(=O)[C@@H](C)SC3=S)s2)cc1Cl 11635993 UUIDZNJELLTSFP-LLVKDONJSA-N 440.015 4.273 10 10 IICE CC1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@H](c2ccc(O)cc2O)N3)CC1 13639872 HAEWHHKKTAJPCU-KHCICDEESA-N 440.565 4.345 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C\c2ccccc2OCCC(=O)O)SC1=S 16911398 QUTHEMIBPCYNEN-QGOAFFKASA-N 429.519 4.345 10 10 IICE N=C1/C(=C\c2ccc(Br)cc2)C(=O)N=C2SC(Cc3ccccc3)=NN12 33424271 JHULHRVOZFFGEG-INIXKHHFSA-N 425.311 4.311 10 10 IICE COC(=O)[C@H](C)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 34860200 ORPCSXKGDSGQEN-BXUJETTOSA-N 443.546 4.037 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 251317357 FZHFETZVPJXVCI-XOTWJMMUSA-N 427.526 4.498 10 10 IICE COc1cc(N2CCN(c3nnc(-c4ccccc4Cl)s3)CC2)cc(OC)c1OC 302235289 UUEZIYXSEUEBDI-UHFFFAOYSA-N 446.960 4.211 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H](Cc3noc(-c4ccncc4)n3)C2)cc1 581781634 FKZBFCUIJUIBLD-IBGZPJMESA-N 427.508 4.244 10 10 IICE Cc1nccn1-c1ccccc1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 683474232 YPWWCSXCVFFLIT-UHFFFAOYSA-N 441.579 4.218 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c[nH]nc1-c1ccc(F)cc1 726625662 LPSDFPJYCHUERK-UHFFFAOYSA-N 430.430 4.216 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCCc3ccc4ccccc4n3)cc2F)C[C@@H](C)O1 744305424 PWSRSMHLUGJTET-HDICACEKSA-N 436.531 4.029 10 10 IICE Cc1ccc(C2CCN(C(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)CC2)cn1 783257644 WKEOPUPPMUIYAD-UHFFFAOYSA-N 447.627 4.011 10 10 IICE C[C@H](NC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(N2CCOCC2)cc1 792501136 JUDQKYLMHHYHCL-IFXJQAMLSA-N 425.426 4.326 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OC[C@@H](F)C(F)(F)F 800126259 CAYVYDHCZARHDE-ZJRUKIMVSA-N 427.466 4.173 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccnc(-c2ccco2)c1 1125130977 DSWNOUVLGORSQH-UHFFFAOYSA-N 431.414 4.127 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3CCCCCC[C@@H]3NC(=O)OC(C)(C)C)CC2)cc1 1127275747 NMMIJXSJXPLKDO-VXKWHMMOSA-N 445.604 4.208 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)COc3ccc(N4CCCC4=O)cc3)c2C)c1 1132043871 NUUIELUEUDDBRD-UHFFFAOYSA-N 431.536 4.225 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)c(Br)[nH]1 1142416866 IPWDTMIPZWQBLQ-UHFFFAOYSA-N 429.156 4.268 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3(c4ccccc4)CCN(C)CC3)c2C)cc1 1149686493 GOAALMHSHMNGPY-UHFFFAOYSA-N 431.580 4.496 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Br)cc1Cl 1152400742 FIPXVTINSPSHDO-UHFFFAOYSA-N 447.112 4.277 10 10 IICE COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1155017318 YNDKXSNNMRIDCN-DJJJIMSYSA-N 433.346 4.270 10 10 IICE Cc1cc(CC(=O)N[C@@H](CCNC(=O)OC(C)(C)C)C(F)F)c(C)n1-c1ccccc1 1159013112 RISXKIBUKYRTSA-IBGZPJMESA-N 435.515 4.301 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](CC(=O)NCc3ccc(F)cc3)C2)c(C)n1-c1ccccn1 1163211387 COWRHEFFVYXGJB-OAQYLSRUSA-N 448.542 4.187 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C)CC1CC1 1165313887 NNCMECWWBIRAFU-MRXNPFEDSA-N 433.346 4.176 10 10 IICE CCOC(=O)CN(Cc1coc(-c2ccc(Br)cc2)n1)Cc1ccccc1O 1195359316 UYJCUNNMPVFKKE-UHFFFAOYSA-N 445.313 4.375 10 10 IICE CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NCc1cc(Cl)ccc1O 1225061399 GPUSTPHUXYKFII-APPDUMDISA-N 427.726 4.384 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(CCOc4ccccc4)CC3)c2C)c1 1254075321 YDFYRBIVAJPNQR-UHFFFAOYSA-N 446.595 4.309 10 10 IICE CCOc1cc(-c2ccccc2)sc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1288331246 XLFJKRAYRPRCTN-UHFFFAOYSA-N 435.593 4.496 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCO3)n2CCCCCO)c(C)n1-c1ccccc1 1289356213 NQQOFCRJDZRFBP-JOCHJYFZSA-N 437.588 4.130 10 10 IICE Cc1cc(N(C)C)cc(C)c1CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1291640132 XRWWAYKNBHSCCJ-UHFFFAOYSA-N 449.517 4.084 10 10 IICE CC[C@@H](C)c1nc(C)c(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1 1294859484 MRYDWCDCKLOGCS-FOIQADDNSA-N 445.007 4.289 10 10 IICE CCNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CC1 1296225252 XOXOZSDETIMAFF-UHFFFAOYSA-N 434.588 4.114 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CCCC2CCCC2)CCOC1 1296546491 REMKYDMHRRQSHV-XMMPIXPASA-N 428.577 4.243 10 10 IICE COc1cc(OC)c(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1C=O 1297010395 OLFFNLDHOHKIDE-HNNXBMFYSA-N 430.932 4.336 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CC[C@H](C(C)(C)C)C2)cc1F 1298055424 DAPMGBMXNYGHOO-OALUTQOASA-N 429.584 4.298 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1-c1ccccc1 1312710786 ZUXKCRSFZFHUQC-VQTJNVASSA-N 444.579 4.302 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1C[C@@]12CCCN(C(=O)OC(C)(C)C)C2 1356267713 RVDLTMDRAFAHND-PXDATVDWSA-N 427.589 4.282 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1CCC[C@@H]1C1CC1 1436752353 VXAJECIETISHRU-BXXXDOFISA-N 432.586 4.360 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1F 1443770414 LNDBWWYDXDXNBA-QFIPXVFZSA-N 429.536 4.239 10 10 IICE O=C1CC(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)(c2cccc(Cl)c2)C1 1444993102 YOIBFIYEYGLWCV-QGZVFWFLSA-N 448.897 4.327 10 10 IICE Cc1cc(C(=O)NCC(C)(C)[C@H]2COCC23OCCO3)c(C)n1-c1cccc(C(C)C)c1 1451237700 KTNRRSWXUXIDEO-HSZRJFAPSA-N 440.584 4.363 10 10 IICE COc1cccc(-n2ccnc2SCC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c1 1451643878 GSRJMYHIHCCVPS-SFHVURJKSA-N 438.597 4.095 10 10 IICE COC(=O)c1cnc(N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1C(F)(F)F 1458303708 LLAKBQGVWJOCRI-KRWDZBQOSA-N 437.462 4.139 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1c(C)nc2ccc(Br)cn12 1460978713 AGDNLMLBWJJYNV-AWEZNQCLSA-N 429.362 4.141 10 10 IICE CCOc1ccc(-c2noc(CCC(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)n2)cc1 1460981343 HAXOMJPISHKNPN-SFHVURJKSA-N 436.556 4.190 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)c2ccc(Br)cc2)N(C)C)cc1 1463278945 HTDZEWDPMBYCJV-FQEVSTJZSA-N 432.406 4.212 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc3cc(O)c(O)cc3s2)cc1C 1464815340 PBPOQBKNZBIEBK-HNNXBMFYSA-N 428.535 4.083 10 10 IICE CC[C@H](C)c1nnc(N(C)C2CCC3(CC2)OCCO3)n1Cc1ccc(N(C)C)c(F)c1 1495067757 UTUUWNYZNDSPNG-KRWDZBQOSA-N 445.583 4.167 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1CCN(C)C1CCCCC1 1503487916 PEUBNLDCRQEJEB-QFIPXVFZSA-N 427.593 4.126 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](COC)C1 1504792482 HABLWXRHXHTORJ-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CC(C)CN(c1nnc([C@@H]2CCC(=O)N2)n1CCCSc1nccs1)C1CCCC1 1509377429 KMMBGQNFQODJBL-KRWDZBQOSA-N 448.662 4.273 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCO[C@H](C(F)(F)F)C1 1510675814 VHYLAXFIBFKNJW-SFHVURJKSA-N 439.526 4.057 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1512653743 TZTCARKOYMTSCL-HOYKHHGWSA-N 439.629 4.455 10 10 IICE CCc1nnc(N2CCC[C@@H]2c2ccc(COC)o2)n1Cc1ccc(N(C)C)c(F)c1 1513894435 UMPNHDXLQKROSI-HXUWFJFHSA-N 427.524 4.175 10 10 IICE C[C@H](c1cccs1)N(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1541795683 GQLKAVYYJVZTNO-OAHLLOKOSA-N 439.564 4.191 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1555627576 GSSXESKSQQNARK-FPOVZHCZSA-N 443.636 4.297 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCCN3C(=O)c4ccccc4C3=O)c2C)c1 1556514988 HINKPOQDTQEYLH-UHFFFAOYSA-N 429.520 4.127 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3sc4cc(F)ccc4c3Cl)cc2)CC1 1584507038 KUTMBLUJRPJONX-UHFFFAOYSA-N 445.947 4.326 10 10 IICE C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccccc2O)c1 1587444284 BGTIIFXOHNQNLP-DLBZAZTESA-N 436.533 4.023 10 10 IICE CCCCN1C(=O)c2ccc(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)cc2C1=O 1596481392 CWWYVQPVDSXVIZ-UHFFFAOYSA-N 429.520 4.420 10 10 IICE Cc1cc(C(=O)NC[C@]2(N3CCOCC3)CCSC2)c(C)n1-c1ccc(C(C)C)cc1 1597460720 YAAJPIPQVBCQNA-RUZDIDTESA-N 441.641 4.155 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nn(-c2ccc(F)cc2F)c2c1CCC2 1597801207 ZBUZHFUKWHTTSK-INIZCTEOSA-N 438.522 4.375 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CC(=O)NC[C@@H]2c2ccccc2)cc1 1617332098 XWJRACYSAQSYEV-HSZRJFAPSA-N 427.508 4.481 10 10 IICE C[C@@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(F)(F)F 1620305826 ZVBALIWODQYJBV-RHSMWYFYSA-N 448.468 4.228 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1 1623451957 PGZYYZKSQWDOKG-UHFFFAOYSA-N 443.491 4.067 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2CCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1628495391 KYROVLGREYBJFO-FUHWJXTLSA-N 425.520 4.260 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncc(Cc2ccccc2)o1 1629055250 GACCNKVWLDOWKO-QGZVFWFLSA-N 427.451 4.266 10 10 IICE COc1cc(C)ccc1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1629939515 SBCZRCYTXQVQEH-UHFFFAOYSA-N 428.330 4.499 10 10 IICE Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c(C)n1-c1cccc(Br)c1 1631509611 BFCQWWOVQIRSIF-UHFFFAOYSA-N 429.314 4.240 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H](O)c1ccc(Cl)c(Cl)c1 1632040275 PFHCABVWDDUYDI-SFHVURJKSA-N 445.293 4.413 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccccc3C(=O)c3ccc(F)cc3)c2)CC1 1633444135 LMRWWCKANKTNNY-UHFFFAOYSA-N 431.511 4.451 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)COc1ccc(F)cc1 1640759427 UVKVPKFRWJSYCD-UHFFFAOYSA-N 428.485 4.221 10 10 IICE O=C(CN[C@H](c1ccccc1)C1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 1653800689 PBFUCISDNMWGOU-AREMUKBSSA-N 439.575 4.190 10 10 IICE CCOc1ccc(CN(CC(=O)Nc2cnccn2)c2ccc(OC)c(Cl)c2)cc1 1657745917 RDMMXNYPTIYZGY-UHFFFAOYSA-N 426.904 4.183 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1671363967 ZABSNHSKXGUESR-NRFANRHFSA-N 444.938 4.026 10 10 IICE O=C(NCc1c(O)cccc1F)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1cccc(F)c1 1673498134 KATGDSBBBVZVBC-JTHBVZDNSA-N 437.490 4.138 10 10 IICE CCN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](C)c1cccc(OC)c1 1683196040 XQSXILJOBJCGNL-MRXNPFEDSA-N 433.499 4.103 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)C1CC(C)(C)CC(C)(C)C1 1685330989 JDCXVTOZCIUYFB-UHFFFAOYSA-N 428.621 4.135 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCCCC[C@@H]1c1ccncc1 1686724384 ZJDIFDAFLCFQKC-OAQYLSRUSA-N 430.499 4.023 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCS[C@H](C)[C@H]2C)cc1 1710027015 VPIYFYSNNGZOHT-QWFCFKBJSA-N 429.634 4.007 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1712776588 BIZCOHLVKOMFEE-RXVVDRJESA-N 447.624 4.495 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@@H](C)CCSC)n1Cc1ccc(N2CCOCC2)cc1 1726866025 MJCYPZJGQXNDPR-MOPGFXCFSA-N 431.650 4.254 10 10 IICE CC[C@H](C)CN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1727070078 GFYCSDKQFIZXIC-SFHVURJKSA-N 437.636 4.435 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H](C)Cc1cccs1 1764717407 UMWVHUPQFVZEHZ-IBGZPJMESA-N 439.629 4.254 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(COCC)n2Cc2ccc3c(c2)CCCN3C)CC1 1766328566 JRCYQHIJQOARHO-JOCHJYFZSA-N 441.620 4.031 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1C[C@H](C)O[C@@H](C)C1 1767771769 PKHJLEKAOBWGGI-PMACEKPBSA-N 441.620 4.255 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2ccc(Cl)nc2)n1CC(C)(C)O 1768651156 HHLSCYBEJLMWJA-UHFFFAOYSA-N 440.979 4.001 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)c2nccn2C)cc1 1866230658 OXNNWWBQEGFHPS-OAQYLSRUSA-N 449.555 4.353 10 10 IICE C[C@](NC(=O)OCc1ccccc1)(C(=O)O)c1cc(Cl)cc(Br)c1O 1951857186 BLNVOBCWFPMMEB-QGZVFWFLSA-N 428.666 4.034 10 10 IICE CNCc1nn(Cc2cccc(C(F)(F)F)c2O)c(C(F)(F)F)c1Br 2079235347 UIJUMZLRZPKTMG-UHFFFAOYSA-N 432.162 4.157 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3c(O)cccc3Br)C(C)(C)[C@@H]21 2119291556 SSGOBJDBHJYKLG-OAUYIBNBSA-N 425.367 4.278 10 10 IICE Cc1ccc(N2NC(=O)C(=Cc3ccc(-c4ccc(Cl)c(C(=O)O)c4)o3)C2=O)cc1C 2296648938 LPXDURNSEICMKK-UHFFFAOYSA-N 436.851 4.376 10 10 IICE C[C@@H]1Oc2ccccc2C=C1C=C1SC(N2CCN(Cc3ccccc3)CC2)=NC1=O 2314433404 MWCKZGZQIYNGJF-SFHVURJKSA-N 431.561 4.182 10 10 IICE CC[C@@H](C)N(CC(=O)NCc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2352942161 ALWCPZUCCJTJOA-CYBMUJFWSA-N 429.355 4.115 10 10 IICE Cc1ccc(CNC(=O)[C@H]2N(C(=O)OC(C)(C)C)CCC2(C)C)c(O)c1Br 2380718754 AYAQXHXAZIHWKF-MRXNPFEDSA-N 441.366 4.115 10 10 IICE CCCOC(=O)CCN1C(=O)/C(=C\c2cc(Br)ccc2OC)SC1=S 40938348 SICFIWKELDBMDB-GXDHUFHOSA-N 444.372 4.002 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3cccc(Cl)c3)C2=O)cc1OC 102468461 PITCWEHHMPLGKJ-LICLKQGHSA-N 448.953 4.294 10 10 IICE CCCCN1C(=O)/C(=C2/SC(=S)N(CCCCCC(=O)OC)C2=O)c2ccccc21 206709397 QSSXYXLUTCEKGO-VHEBQXMUSA-N 446.594 4.138 10 10 IICE CCN1C(=O)/C(=C\c2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCO3)SC1=S 210032378 IWRURXNVFSFKJK-YBFXNURJSA-N 435.530 4.489 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(O)c(OC)c1)N2 226654177 RXQBFGRONAKLEI-IEGUWTFLSA-N 428.554 4.258 10 10 IICE CCc1cc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(C(=O)OC)cc4)c3C)cnc2s1 302691516 XJQVGZWDJYDVIH-UHFFFAOYSA-N 449.532 4.097 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)C2CC2)cc1 729315036 VKNHIYDIXHXMMD-UHFFFAOYSA-N 429.520 4.449 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N[C@@H](c3ccccc3)c3ccco3)cc2F)CC1 730116534 RCPKUGKAJABPPP-DEOSSOPVSA-N 436.531 4.149 10 10 IICE CC1CCN(c2ccc(CNC(=O)N3CCC(N(C)C(=O)OC(C)(C)C)CC3)cc2)CC1 731048317 IZYDFMRRNXSAAJ-UHFFFAOYSA-N 444.620 4.464 10 10 IICE CC(=O)NCc1ccc(N[C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)cc1 733321396 BRDPEJLQAXFJMX-QHCPKHFHSA-N 441.491 4.482 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(-c4cscn4)c3)cc2F)C[C@H](C)O1 742557369 UXHPLPRANOGLOQ-HOTGVXAUSA-N 425.529 4.493 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742800967 NSQITLGMUAMJKV-YWMUFLPLSA-N 443.494 4.281 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)NC(=O)NCc2ccc(N3CCSCC3)cc2)c(C)c1 749788476 KMMLMULJRHLOFJ-DEOSSOPVSA-N 449.624 4.294 10 10 IICE COc1ccc(N2CCN(C(=O)C[C@@H](C)C3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 764527593 HTJBBQYEZAMKKS-LJQANCHMSA-N 445.604 4.017 10 10 IICE O=[N+]([O-])c1ccc(OC(F)F)c(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768670875 RDPXFTGYRDSZPK-UHFFFAOYSA-N 446.498 4.018 10 10 IICE Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 772402919 DIVCSTPDMQYNKQ-INIZCTEOSA-N 438.311 4.310 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C=C\c2cncc(C)c2)cc1 772687745 IUQYRSPSQLAASU-RAXLEYEMSA-N 429.520 4.047 10 10 IICE COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCc1cc(Br)ccc1O 809713459 QWZQJTHWFXQYQX-NSHDSACASA-N 427.726 4.324 10 10 IICE CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2sccc2-n2c(C)ccc2C)c1 919568528 GFHYKBWQALNIAD-OAHLLOKOSA-N 425.510 4.298 10 10 IICE CCC[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccn1 1136903841 NCSUTUPIYMUIAK-IRLDBZIGSA-N 440.588 4.414 10 10 IICE Cc1ccc(C(=O)Nc2ccccc2CN2CCC(O)CC2)cc1-n1c(C)cc(C=O)c1C 1137963817 ALPDISKBRLFWMZ-UHFFFAOYSA-N 445.563 4.424 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C2CCC(C(=O)N(C)C)CC2)cc1 1144711128 IBJRUGNIQDTFTJ-UHFFFAOYSA-N 437.584 4.189 10 10 IICE Cc1cc(C(=O)CSc2ncc(CO)n2C)c(C)n1-c1ccc(OC(F)(F)F)cc1 1165754013 ASDQXXGFLXLERD-UHFFFAOYSA-N 439.459 4.194 10 10 IICE O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NCc1c(O)ccc2c1CCCC2 1185519235 VWMNUEZOJYXTBT-UHFFFAOYSA-N 430.404 4.085 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@H]3CCC3CCCCC3)cc2)CC1 1251104267 LZIKHAPTADZDAR-DEOSSOPVSA-N 440.632 4.423 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCc3ccc(S(C)(=O)=O)cc3)cc2Cl)C1 1270440669 SYNGCOMBGQWQMO-QGZVFWFLSA-N 449.016 4.229 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H]3C[C@@]3(C)c3cccc(Br)c3)C2)cc1 1278861335 IHDWUXZUUFJZPT-WEYGHZABSA-N 429.358 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCOc2ccc(Br)cc2C1 1312883736 DSCBMXRDYGRDFW-MRXNPFEDSA-N 446.389 4.359 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3cc(OC)c4ccccc4c3)CC2)c(OC)c1 1313381761 SVVGZDDHUKBCJF-GOSISDBHSA-N 449.551 4.458 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cccs2)n1Cc1ccc(N2CCOCC2)c(F)c1 1359781621 OBJKHZKNFWHYLM-UHFFFAOYSA-N 443.592 4.199 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 1435285202 CINUHLMZVORZNU-INIZCTEOSA-N 425.529 4.378 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NC(=O)c1ccc(OC)cc1)c1ccccc1 1442356863 XPIQASFAUBSNFY-VWLOTQADSA-N 445.563 4.281 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1445968287 LPEWWXPINULJFJ-ZDUSSCGKSA-N 444.329 4.457 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3CO)c2C)c1 1446281715 JHBUXRGPMJQOTM-JYFHCDHNSA-N 431.580 4.015 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1448003640 IJXRIDUZIODNOD-WIYYLYMNSA-N 439.556 4.202 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1 1453875571 FCNGVNWDSFYCSK-XMMPIXPASA-N 425.529 4.036 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-c2csnn2)cc1 1467631354 MAOXAWWZHLVAQN-UHFFFAOYSA-N 438.553 4.207 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](NC(=O)NCc2c(O)cccc2F)C1 1478949135 NEEFRZMHVJFSAP-YLJYHZDGSA-N 443.519 4.124 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C 1501151414 QTHXGNCXACBKCL-GOSISDBHSA-N 434.588 4.258 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCN(C(C)(C)C)CC2)cc1 1501838121 KODDZQVMLPFVIC-UHFFFAOYSA-N 447.631 4.155 10 10 IICE CCOC(=O)c1c(NC(=O)c2coc(S(C)(=O)=O)c2)sc(C)c1-c1ccc(C)cc1 1523248710 YKCRGLOUTYFQCB-UHFFFAOYSA-N 447.534 4.457 10 10 IICE CC(C)(C)OC(=O)/C=C\c1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)co1 1541081443 YVJDLQFWOADEQA-HJWRWDBZSA-N 428.554 4.118 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3occc3NC(=O)OC(C)(C)C)cc2F)C[C@H](C)O1 1542113195 QWDXICFONXGHFR-GJZGRUSLSA-N 447.507 4.309 10 10 IICE CN(c1ccc(CNC(=O)CCN2CCN(c3ccccc3)CC2)cc1)C1CCCCC1 1542411952 GIUSAVSYDNPMGS-UHFFFAOYSA-N 434.628 4.284 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc2nc(O)n(C3CC3)c2c1 1545508683 KISFEQXIRKPBFC-UHFFFAOYSA-N 430.302 4.207 10 10 IICE COc1cccc(-c2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)on2)c1 1545632139 CYMZGIKONRKXNQ-GOSISDBHSA-N 441.915 4.104 10 10 IICE COCC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccco1 1546122936 CBJCVAZOANEEFB-QGZVFWFLSA-N 432.318 4.352 10 10 IICE CCc1cc(=O)oc2c(C)c(O)c(CN(CCOC)C[C@H]3CCCN4CCCC[C@@H]34)cc12 1565538543 HUCOICWDMNKTBK-OFNKIYASSA-N 442.600 4.082 10 10 IICE Cc1ccccc1Oc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)nc1 1566022737 BVCZADUEEAUQLS-UHFFFAOYSA-N 435.499 4.213 10 10 IICE Cc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1566356749 NCZHJPVYCKUUFJ-OAHLLOKOSA-N 438.311 4.310 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@H]3CNC(=O)OC(C)(C)C)cc2Cl)C1 1568141708 CNOBCLWKESMNJB-SZMVWBNQSA-N 435.996 4.353 10 10 IICE O=C(Cc1ccc(OCc2ccccc2)cc1)NCc1ccc(N2CCC(O)CC2)cc1 1585539240 AENZVJTXVMHRQG-UHFFFAOYSA-N 430.548 4.086 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](c3ccccc3)N3CCN(C)CC3)c2C)c1 1587880818 JOEHBKAODSROJL-AREMUKBSSA-N 430.596 4.007 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C3(n4cc(Br)cn4)CC3)c2C)c1 1587886383 NEACVMFAEHOTFB-UHFFFAOYSA-N 427.346 4.167 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1596963177 FNNWZGQSERHJOW-NRFANRHFSA-N 447.620 4.406 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C(=O)OC(C)(C)C)CC[C@H]3C)ccc21 1598054529 ZLLSSZSTCZBZAA-UZLBHIALSA-N 428.573 4.487 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)C[C@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1613201077 XJJFIAPROBGULH-CMKODMSKSA-N 429.584 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1615381860 GWKVTUXPCWGZDB-HSZRJFAPSA-N 448.615 4.020 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CC[C@H](C)C3)CC2)cc1F 1619302481 RGQIXFOWHNIJRC-ZWKOTPCHSA-N 429.584 4.486 10 10 IICE COc1cc(Br)c(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1OC 1625688861 LVGRTYLJAQNMCE-UHFFFAOYSA-N 435.101 4.409 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)c1cccc(C(=O)c2ccccc2)c1 1627013607 GZQYNJXTJWEDCK-LJQANCHMSA-N 445.515 4.319 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)N(Cc3ccccc3)[C@H]2c2ccccc2)c1 1633282949 QJNFVZQKHBEBQI-OZXSUGGESA-N 428.532 4.497 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)[C@@]12CCCO2 1638249475 DOTNDBXIUZUURE-VWPQPMDRSA-N 447.373 4.313 10 10 IICE COC(=O)COc1ccc(N(C)CCC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1 1642689138 KKCJXKWJQDWTOR-CTXDPNEZSA-N 432.561 4.243 10 10 IICE C[C@@H](Cc1c(F)cccc1F)NC(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1644823972 ZQTGKWOGRCWTNR-ZDUSSCGKSA-N 428.401 4.363 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2C[C@H](C)O)sc(C)c1-c1ccccc1 1645480024 LAOBPBUJLPOTPP-QFBILLFUSA-N 444.597 4.464 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 1647826712 GMWPHZSXVWJSMH-UHFFFAOYSA-N 428.876 4.424 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C(F)=C/c3ccc(F)c(C(F)(F)F)c3)cc2)CC1 1651024361 QHMBTFQMCMIHKY-MOSHPQCFSA-N 439.428 4.223 10 10 IICE O=C(CNC1(C(=O)N2CCOCC2)CCCCC1)Nc1ccc(N=Nc2ccccc2)cc1 1655866774 NOJFJXZXMUHUAV-UHFFFAOYSA-N 449.555 4.192 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]2[C@@H]1CCN2C(=O)OC(C)(C)C 1683254375 PMUOBRXBDOLYMJ-BWAGFHJFSA-N 444.620 4.175 10 10 IICE CCOC[C@@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1696381233 TXTVQIGIWAHUEB-TZIWHRDSSA-N 443.661 4.256 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1723207555 WREJSYMJCHCQPG-OAQYLSRUSA-N 436.579 4.390 10 10 IICE CN(Cc1cccs1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1729426874 PJZZHZQLGZGVKG-UHFFFAOYSA-N 425.602 4.158 10 10 IICE C[C@H]1CCC[C@@](Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752093909 XGWYNLZPPDZRNG-RXFWQSSRSA-N 448.615 4.116 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3n[nH]c4ccc(Br)cc34)cccc21 1866017900 XERPUILKJZPCSG-UHFFFAOYSA-N 446.260 4.353 10 10 IICE Cc1ccc(NC(=O)c2c3c(n4ccccc24)C(=O)c2ccccc2C3=O)c([N+](=O)[O-])c1 1873931968 HQKWRHOGJJANAN-UHFFFAOYSA-N 425.400 4.184 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2c(O)cccc2Br)C1 1952578445 PHXUTDKMIZYVIC-HOCLYGCPSA-N 434.286 4.329 10 10 IICE Cc1nnc(NC(=O)CCCCCN2C(=O)C(=Cc3cccs3)SC2=S)s1 2296882520 XXADEZMEDYPTLS-UHFFFAOYSA-N 438.625 4.308 10 10 IICE CC1=NN(c2ccc(Br)c(C)c2C)C(=O)C1=CNc1ccccc1C(=O)O 2297316926 ZSHVMJLGUMRKBU-UHFFFAOYSA-N 428.286 4.483 10 10 IICE CN(C)c1ccc([C@H](NC(=O)C=Cc2ccc(-c3cccnc3)cc2)c2nccn2C)cc1 2330596397 WFYYUTARGZZMMR-SANMLTNESA-N 437.547 4.467 10 10 IICE Cc1ccc(CN(C)C(=O)CC(C)(C)CNC(=O)OC(C)(C)C)c(O)c1Br 2381129863 QJWXXQAGNCTMLY-UHFFFAOYSA-N 443.382 4.363 10 10 IICE Cc1ccc(C)c(-n2c(SCC(=O)c3ccc(O)c(O)c3)nc3ccccc3c2=O)c1 23564396 QQXXTLKUMWLKTK-UHFFFAOYSA-N 432.501 4.389 10 10 IICE Cc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 47152310 IJOZVZUTRBGXRC-GPLLRDDGSA-N 427.507 4.132 10 10 IICE N=C1/C(=C\c2ccc(OCC(=O)O)cc2)C(=O)N=C2SC(CCC3CCCCC3)=NN12 103117804 VRVXKBAAZPZUQS-MJEQIIAOSA-N 440.525 4.130 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)cc1 205691399 HQXRYXWUUWRLBH-SFQUDFHCSA-N 427.507 4.133 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2cccc(O)c2)SC1=S)Nc1nccs1 210758599 JMWFKZJATYXKRF-NTCAYCPXSA-N 433.580 4.249 10 10 IICE COc1cccc(N2CCC[C@@H](NC(=O)c3cc(C)n(-c4ccc(C#N)cc4)c3C)C2)c1 303669474 JIFDTADFTFPWIE-OAQYLSRUSA-N 428.536 4.373 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526175744 HRENWSBDOIVABO-JOCHJYFZSA-N 437.423 4.311 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1nnc(SCc2ccc(F)cc2)s1 543914452 LVOHYACBENXBOD-UHFFFAOYSA-N 445.545 4.466 10 10 IICE COc1cccc(Cl)c1CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 764995778 VEPMNBITVIXCLE-UHFFFAOYSA-N 442.865 4.063 10 10 IICE CC(=O)Nc1c(C)ccc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C 768879585 YDZVJKPDKJQDMH-UHFFFAOYSA-N 449.599 4.116 10 10 IICE Cc1ccc(-n2nc(C)c(CC(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c2C)cc1Cl 773742554 XKRWHYPLEMSXJZ-AWEZNQCLSA-N 427.932 4.152 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)cc1 784397463 OWTNRUDJWUDKDQ-HSZRJFAPSA-N 442.523 4.488 10 10 IICE CCOC(=O)c1cc(NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ncc1Cl 795129441 NYHIHEROHYHNNZ-UHFFFAOYSA-N 428.964 4.056 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)Nc1nnn(Cc2ccc(C(F)(F)F)cc2)c1C 801796469 CEBHVHUJFNAFFY-UHFFFAOYSA-N 446.477 4.350 10 10 IICE CCc1noc(C[C@]2(O)CCCN(Cc3ccc(N(CC)Cc4ccccc4)cc3)C2)n1 856593788 RABZLPXLIARXEC-AREMUKBSSA-N 434.584 4.228 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@H](C)c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917011261 UXTGLPSSCLFWBB-FGTMMUONSA-N 447.982 4.402 10 10 IICE COc1ccc(N2CCN(C(=O)CSCc3coc(-c4ccc(F)cc4)n3)CC2)cc1 917952789 HOLWHIGTJORSLR-UHFFFAOYSA-N 441.528 4.071 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CCC(=O)N2C(C)C)sc(C)c1-c1ccc(F)cc1 1124558726 VMQIZEUPXBQSEU-INIZCTEOSA-N 432.517 4.377 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C[C@@H]2CCCO2)C(F)(F)F)C1 1130476016 YBPCSGVZBSXALV-KKSFZXQISA-N 437.506 4.024 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2C[C@@]2(C)c2cccc(Br)c2)cc1 1130547525 KZCSMYDVFMOLGK-UNMCSNQZSA-N 431.374 4.330 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](COC(C)C)NC(=O)OC(C)(C)C)c2C)c1 1132044161 QTERHOCEXOYWFX-QFIPXVFZSA-N 443.588 4.337 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H](c1ccncc1)C1CC1 1134646186 ICXCPZQWZFBSOM-ZPBCLNFZSA-N 441.553 4.080 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1 1135733085 SPRCJXDJSVWVTG-KRWDZBQOSA-N 431.939 4.337 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1 1136408789 ADAVWAMDPVCNCO-NLFFAJNJSA-N 429.564 4.401 10 10 IICE CC(=O)N1C[C@H](C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)Oc2ccccc21 1137816968 WXUVGEQZEJAOAX-AVRWGWEMSA-N 430.504 4.296 10 10 IICE CC(C)(C)c1ccc(C2CCN(C(=O)c3cc(NS(C)(=O)=O)ccc3O)CC2)cc1 1141168298 OESZVNNYCBRWLG-UHFFFAOYSA-N 430.570 4.081 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1141985236 LLPNSMDUQINJKI-RXVVDRJESA-N 433.593 4.063 10 10 IICE C[C@@H](C(=O)NCc1cccc(Br)c1O)N1CCC(Cc2ccccc2)CC1 1156793544 ZDJVXRKQLSPGRY-INIZCTEOSA-N 431.374 4.114 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3cccnc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1188879401 IUESYNDGUUVJOU-AREMUKBSSA-N 444.535 4.262 10 10 IICE CC(C)C[C@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(=O)OC(C)(C)C 1230278439 NJINQMMIVUFHKF-UXHICEINSA-N 434.577 4.087 10 10 IICE CCc1cc(O)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1296351112 YGTFOFDVNCNSBP-WOJGMQOQSA-N 430.526 4.324 10 10 IICE CCN(Cc1ccccc1)c1ccc(CNCc2cccc([C@@]3(C)NC(=O)NC3=O)c2)cc1 1320073127 ZILSDZPDAYTVDC-HHHXNRCGSA-N 442.563 4.058 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1ccc([N+](=O)[O-])cc1 1348497243 OCDFAKSIBZBNBS-BOPFTXTBSA-N 446.481 4.069 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(c4ccc(Cl)cc4)CCCC3)cc2)CC1 1455869645 XJGNIKHWFSDNKV-UHFFFAOYSA-N 439.987 4.170 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)OC(C)(C)C)C[C@@H]3C(C)C)cc2)CC1 1460442048 IJBWHBUXFIDASD-HSZRJFAPSA-N 431.621 4.379 10 10 IICE CC[C@H](C)[C@H](NC(=O)c1ccc(C)c(O)c1O)C(=O)N1CCC(Cc2ccccc2)CC1 1465004291 NREUZUNWDOFMFH-JTSKRJEESA-N 438.568 4.032 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCSC1(C)C 1496723506 ZGMJMIJMWSDQCA-QGZVFWFLSA-N 445.633 4.070 10 10 IICE Cc1ccccc1Cc1nnc(N(C)C[C@@H]2CCOC2)n1CCCSc1nccs1 1511291004 DRSHTXRHXZSXAC-SFHVURJKSA-N 443.642 4.289 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCCN(C(C)C)CC3)nnc2C(C)(C)C)cc1 1515529790 QIMVIKJFRHHCPK-UHFFFAOYSA-N 426.653 4.391 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c(C(F)(F)F)c3)CC2)cc1 1519576091 ZMXAQMJTYPHJKY-UHFFFAOYSA-N 443.263 4.439 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCc2cnc3c(Cl)cnn3c2)c1 1523907340 JXIGSLLSXKGFIN-UHFFFAOYSA-N 428.323 4.416 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1529276854 BBGVLWFFMDPTTF-KRWDZBQOSA-N 448.533 4.439 10 10 IICE C[C@@H](NC(=O)CN(C(=O)c1ccccc1)c1ccccc1)c1ccc(N2CCOCC2)cc1 1535557477 ANBJCIYMXOGZRM-OAQYLSRUSA-N 443.547 4.047 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3CN(C(=O)C4CCCCC4)C3)cc2Cl)C1 1539911723 CDMUYIGCTFXMBD-QGZVFWFLSA-N 432.008 4.231 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCS[C@H](C)[C@@H]2C)cc1 1547446588 BRJQDOMRFHHCEA-QKNQBKEWSA-N 443.661 4.397 10 10 IICE COC1CCN(c2ccc(CN[C@@H](CNC(=O)OC(C)(C)C)C3CCCC3)cc2)CC1 1559795646 KWBLBWNPBLFQCO-QHCPKHFHSA-N 431.621 4.475 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)c3ccc(F)cc3)cc2Cl)C1 1564649308 AJQWNJBFMPFXCW-VQIMIIECSA-N 433.955 4.291 10 10 IICE CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1565127495 UJEIZTLKXPGTNT-UHFFFAOYSA-N 449.517 4.487 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc4cc(Br)ccc4s3)cc2)CC1 1583475831 MXWIMDGTSLPOBS-UHFFFAOYSA-N 444.398 4.346 10 10 IICE CCN(CC)C(=O)OC[C@H]1CCCCN1C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1586858242 LJZZZDMPIIPLHR-OAQYLSRUSA-N 443.588 4.378 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3c(Cl)cc(Cl)cc3Cl)cc2)CC1 1598010278 YBRRWQLVQSYAQW-UHFFFAOYSA-N 440.758 4.279 10 10 IICE COC1CCN(c2ccc(CN3CCCN(C(=O)c4cccc(Cl)c4)CC3)cc2)CC1 1615245373 IDMXJOZARNSVNN-UHFFFAOYSA-N 442.003 4.303 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@@H](C)O[C@@H](COC)C2)cc1 1615381554 YMOWOYJVBLJNLO-DENIHFKCSA-N 443.636 4.001 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)cc1 1626746531 JQKURNXWZCEQII-UHFFFAOYSA-N 435.499 4.064 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1c2ccccc2CCN1C(=O)OC(C)(C)C 1629932030 YACZRMMPBQGJGN-QFIPXVFZSA-N 437.540 4.013 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1630713761 VKTLTAPKRBAJGX-UHFFFAOYSA-N 431.536 4.268 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCC3(c4ccc(F)cc4Cl)CC3)C2)cc1 1633907304 MXGFTAYMSCXIRS-INIZCTEOSA-N 431.939 4.345 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1634218729 JCPBFRMGXQKUGJ-RXVVDRJESA-N 441.330 4.411 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 1640257121 JVXCJAVJJXPPMS-IYBDPMFKSA-N 432.517 4.198 10 10 IICE COc1ccc(C(=O)c2ccccc2C(=O)N(C)CCN(C)c2ccc(OC)cc2)cc1 1644439216 ZFWSGHHDUSHNAQ-UHFFFAOYSA-N 432.520 4.143 10 10 IICE COc1ccc(N2CCN(Cc3nnc(-c4ccc(Cl)cc4Cl)o3)CC2)c(OC)c1 1654564664 MERRBMBYBRQTSX-UHFFFAOYSA-N 449.338 4.383 10 10 IICE Cn1c(=O)c([N+](=O)[O-])c(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc21 1655198700 NPMAQAITNUWERV-CQSZACIVSA-N 444.438 4.129 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)cc1 1673892675 ULGTWERHYIIUHU-MOPGFXCFSA-N 435.572 4.376 10 10 IICE Cc1cc(CCNC(=O)N2CCn3cnc(C(F)(F)F)c3C2)c(C)n1-c1ccccc1 1674930067 JXCCNBYCHRRAEI-UHFFFAOYSA-N 431.462 4.077 10 10 IICE COc1ccc([C@H](NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c2ccccc2)cc1 1683944319 BYKDZNIFSNFVIO-SQJMNOBHSA-N 431.536 4.371 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1cn(C(F)F)c2ccccc12 1684553917 REDWKDYRTYRRNZ-UHFFFAOYSA-N 428.483 4.215 10 10 IICE Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1685328219 SUPOEGJEQSDEAT-RPBOFIJWSA-N 448.611 4.174 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC2(Cc3cccc(Cl)c3)CC2)N(C)C)cc1 1686735214 SHHBUJDWJMDUGZ-JOCHJYFZSA-N 429.008 4.331 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 1686826103 APGVITSEQUIXRB-SFHVURJKSA-N 440.563 4.191 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1693937245 PAACTXLEEUCOLQ-IBVKSMDESA-N 448.615 4.374 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C[C@H](C)O1 1694919943 KJVGMCVLIQZTTL-UGKGYDQZSA-N 437.588 4.393 10 10 IICE CCC[C@H](C)CN(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1695077408 VDXQLOBBZIVHQE-NRFANRHFSA-N 448.615 4.021 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](F)C1 1697735571 OQXOBFRUVXKXCA-JKSBSHDWSA-N 425.552 4.429 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@H]2C)n1CCCSc1nccs1 1708723704 BMXKFPFBMIPHPU-LSDHHAIUSA-N 436.651 4.070 10 10 IICE FC1(F)CCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)CC1 1712869727 RWNQOGRYAXGFKG-UHFFFAOYSA-N 436.557 4.138 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H](C(F)F)C1 1724235440 KYLZUCKZGZUPLC-UYAOXDASSA-N 433.547 4.424 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCOc2ncccc2Cl)o1 1742181900 SXHWWJDZXZYEKV-UHFFFAOYSA-N 439.903 4.316 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C[C@H](C)O1 1745001420 JHMDYKIQIZSUII-XQBPLPMBSA-N 437.588 4.391 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1745231891 VZWCKEAEDBOVNA-GOSISDBHSA-N 436.604 4.456 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4cccnc4)n3CCCC(C)C)CC2)cc1F 1768705145 XFVCZLDUSZQMPJ-UHFFFAOYSA-N 438.551 4.251 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NC2CCCC2)sc(C)c1-c1ccc(OCC)cc1 1860762348 CWKCSJDBOZKFOU-UHFFFAOYSA-N 444.553 4.296 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C(C)C)C2)sc(C)c1-c1ccc(C)c(C)c1 1865926769 LIQHMTVPKYWKGC-QGZVFWFLSA-N 428.554 4.322 10 10 IICE Cc1cc(C)c2[nH]cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(=O)c2c1 1866079467 YVPBBZCFUJIGIB-DEOSSOPVSA-N 446.595 4.168 10 10 IICE CCCCn1cc(OCCC(C)C)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870351308 VIVPKAICSZGKIY-UHFFFAOYSA-N 441.616 4.404 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCNCc1cccc(Br)c1O)C(F)(F)F 1913260108 IDTCGFYEDOAPPS-GFCCVEGCSA-N 427.261 4.090 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@@H]2NCc2cc(Br)ccc2O)C1 1918889233 VOPKVCAIDNUVIO-PXNSSMCTSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](CNCc2cc(Br)ccc2O)(C2CC2)C1 2093193634 SWWJDFAJVUIVSZ-HXUWFJFHSA-N 425.367 4.282 10 10 IICE CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OC(=O)c1cccc([N+](=O)[O-])c1 2293185134 JPRWREQIVYNBBZ-UHFFFAOYSA-N 444.490 4.044 10 10 IICE O=C1N=C(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)SC1=Cc1ccc(Cl)cc1 2297580110 PMCAZKFEXLSJRC-UHFFFAOYSA-N 446.359 4.422 10 10 IICE Cc1ccc(CNCC2(F)CC(CNC(=O)OC(C)(C)C)C2)c(O)c1Br 2352941906 XCJWGMLMPLXKER-UHFFFAOYSA-N 431.346 4.196 10 10 IICE CC[C@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 6573953 JEMUTZMUJIQXJD-HUCUOGIVSA-N 446.594 4.188 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C2CC2)c(C)n1-c1cccc(Br)c1 16375456 COFKFPYSLMUYHX-UHFFFAOYSA-N 432.347 4.153 10 10 IICE COc1ccc(N2CCN(c3ncc4c(n3)CCN(Cc3ccc(Cl)cc3)C4)CC2)cc1 21640147 WTSJAMKRBUNXAD-UHFFFAOYSA-N 449.986 4.024 10 10 IICE COc1ccc(N2CCCN(C(=O)c3sc(NC(=O)C(C)(C)C)cc3C)CC2)cc1 108431891 PRLAFTBHLKRRBU-UHFFFAOYSA-N 429.586 4.402 10 10 IICE COC(=O)c1cc2ccccc2c(CN(C)Cc2nc([C@H](C)OCC(C)C)no2)c1O 744439522 DDUILWSZBWNZLD-HNNXBMFYSA-N 427.501 4.081 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@@H]3CCN(c4ncccc4Cl)C3)cc2)CC1 757689573 RRXWOXFFJHYGRB-LJQANCHMSA-N 427.980 4.049 10 10 IICE Ic1cccc2ncnc(NCc3ccc(N4CC=CC4)cc3)c12 762800879 MDAWXSJZTYTWCK-UHFFFAOYSA-N 428.277 4.223 10 10 IICE Cc1nn(-c2ccccc2)cc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 781462015 UYEDMLWLHPJKJX-UHFFFAOYSA-N 444.583 4.034 10 10 IICE Cc1cc(C)c(N2CC[C@H](NC(=O)N(Cc3ccco3)Cc3ccccc3O)C2=O)c(C)c1 788937717 RJMRUZGNYSYUHN-QFIPXVFZSA-N 447.535 4.428 10 10 IICE CCN1C(=O)/C(=C\c2cn(Cc3cccc4ccccc34)c3ccccc23)C(=O)NC1=S 1084171323 UMLGWDBCTROMOC-HMAPJEAMSA-N 439.540 4.489 10 10 IICE CN(C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(Br)nc1 1126579296 VXKRJMLNXITSDF-UHFFFAOYSA-N 446.345 4.414 10 10 IICE C[C@@H](NC(=O)[C@@H]1CCCN1Cc1ccc(Cl)cc1)c1ccc(N2CCOCC2)cc1 1136442953 KKXVLRFUSZIISH-JPYJTQIMSA-N 427.976 4.018 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CCCN3C(=O)OC(C)(C)C)c2C)cc1 1147021954 XIPAZWGLLKASGI-IBGZPJMESA-N 427.545 4.232 10 10 IICE Cc1cc(C(=O)NCC[C@@]2(O)C(=O)Nc3ccccc32)c(C)n1-c1ccc(C(C)C)cc1 1153786866 RBXUNLMTRMMVFB-SANMLTNESA-N 431.536 4.177 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2CCS(=O)(=O)C3(CCC3)C2)cc1 1156395336 DASKMTHPQLWXJB-GOSISDBHSA-N 440.569 4.398 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4cccs4)C3=O)c2C)cc1F 1165401289 NBHBMKLQVFRKTE-QHCPKHFHSA-N 439.512 4.253 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CC[C@H](C(=O)OC(C)(C)C)c3ccccc32)C1 1168421843 QIOIQAMSLRTKEQ-MJGOQNOKSA-N 442.556 4.462 10 10 IICE Cc1cccc(-n2c(S)nc3cc(C(=O)N[C@H](C)c4ccccc4O)ccc3c2=O)c1C 1171723559 UWJLMWKKGSIHFU-MRXNPFEDSA-N 445.544 4.488 10 10 IICE COc1cn(C)nc1[C@H](C)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1178929911 WRXGQKATDIDALY-ZDUSSCGKSA-N 431.334 4.090 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCN1Cc1ccc(F)cc1 1294162208 ZLJBIFRDVOFQDH-UGKGYDQZSA-N 447.501 4.177 10 10 IICE O=C(C[C@@H]1CCC[C@H](C(F)(F)F)O1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860039 PRFOEOBPNQVKMZ-XYJFISCASA-N 434.886 4.016 10 10 IICE COc1cccc(OC)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1295589938 GMFWGHNZYFYWTB-UHFFFAOYSA-N 445.563 4.321 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3NC(=O)c3ccsc3)C2)cc1 1299769669 GFLSTLWWSSQKLC-KRWDZBQOSA-N 435.549 4.265 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)c3ccc(N4CCNC4=O)cc3)c2C)cc1 1299808463 ZWPVSBLGZNSPIZ-KRWDZBQOSA-N 432.524 4.123 10 10 IICE CC(C)N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1cccc(F)c1 1307428451 HWORXARAXWTQCZ-UHFFFAOYSA-N 430.479 4.450 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)c(F)c1 1316450980 PQHGNOILTCFOIA-QGZVFWFLSA-N 442.608 4.095 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Nc2ccccc2OC)cc1 1451925718 YAZXAUFOSMVHAY-UHFFFAOYSA-N 434.492 4.350 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H]2CS(=O)(=O)c3ccccc32)cc1 1460324088 ZUOGWIIBNAGMGF-KRWDZBQOSA-N 448.548 4.469 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCC(=O)c2c(F)cccc2F)cc1 1464600246 BLHGCYVZJFTIEI-LJQANCHMSA-N 430.495 4.202 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(C)n1-c1ccc(Br)cn1 1468281100 QYYQXDVQZSDVNY-UHOSZYNNSA-N 432.362 4.017 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C3)cc2)CC1 1473252198 JSSKLVHZYIXZJD-FPOVZHCZSA-N 431.621 4.427 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCC2)nnc1N1C[C@H](C)O[C@@H](C(F)(F)F)C1 1510671572 DADAOOGKOZFWIS-HNAYVOBHSA-N 437.510 4.124 10 10 IICE CCO[C@H](CCn1c(-c2cnn(C)c2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1516105213 HYDQMXCLISYDKD-JOCHJYFZSA-N 438.576 4.006 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(Br)cc4)no3)CC2)cc1 1518371610 VNLSOCINDWUCIU-UHFFFAOYSA-N 442.313 4.075 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(S(C)(=O)=O)c(Cl)cc1Cl 1525762379 OPWZXSYBMVTHLV-ZDUSSCGKSA-N 443.396 4.132 10 10 IICE Cc1cc(CCNC(=O)c2ccc(=O)n(-c3cccc(F)c3)c2)c(C)n1-c1ccccc1 1587460718 CQHAZQWRDRTQJN-UHFFFAOYSA-N 429.495 4.357 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C[C@H](c3ccc(O)cc3)C3CC3)cc2F)C[C@@H](C)O1 1596693996 ATXMUXZFOQVYES-YVHKJVDXSA-N 426.532 4.345 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)C[C@@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1613201076 XJJFIAPROBGULH-BJLQDIEVSA-N 429.584 4.440 10 10 IICE CC[C@@H](C)CN(CC)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1613397325 TYLRXSFMOGBSCI-CTNGQTDRSA-N 443.661 4.256 10 10 IICE CCOc1ccc(C[C@@H](CNC(=O)c2sccc2-n2c(C)ccc2C)C(=O)OC)cc1 1626803355 WUTJMGZQVBXHAO-IBGZPJMESA-N 440.565 4.316 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(F)c(S(=O)(=O)NC4CC4)c3)c2C)c1 1629557240 ZZMPLYWKDMQVJX-UHFFFAOYSA-N 441.528 4.235 10 10 IICE Cc1cc(C(=O)N[C@@]2(CO)CCCC(C)(C)C2)c(C)n1-c1ccc(Br)cn1 1633160679 NBMYOSCVAJBKJP-NRFANRHFSA-N 434.378 4.313 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)C2CC2)cc1 1634218898 LJCWGJXUWNERDV-AOYPEHQESA-N 439.575 4.340 10 10 IICE COc1cc(OC)cc(N2CC[C@H](NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)c1 1634973048 TUYGSMFXXRHWGT-FQEVSTJZSA-N 433.552 4.428 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCn4c(Br)cnc4C3)c2C)c1 1638569102 TYEVRQQXSUIGKY-UHFFFAOYSA-N 427.346 4.326 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 1639966158 WMIGWLJDYRKYPM-MRXNPFEDSA-N 427.715 4.273 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cccc(F)c1F 1642514612 OTRJEWVWJNRSGW-UONOGXRCSA-N 434.442 4.418 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2ccccc2F)c(C)n1-c1cccc(Br)c1 1652030483 PHGKDONQWKCVSI-IBGZPJMESA-N 445.332 4.329 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(c3ccccc3)C3CCC3)cc2F)C[C@@H](C)O1 1655309310 JRUMMQZFYHSCCJ-KDURUIRLSA-N 425.548 4.115 10 10 IICE COc1ccc(C[C@@H]2CCCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1687806964 LVXVSTISHYQYNR-ZCYQVOJMSA-N 438.616 4.171 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCc3ccncc3)CC2)cc1 1697470844 OPKBGVIIDDVXFA-UHFFFAOYSA-N 448.615 4.230 10 10 IICE C[C@H]1CCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1708129372 ACSOPMNXNUFXOE-SFHVURJKSA-N 436.579 4.390 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CN(C(=O)OC(C)(C)C)C1 1763506827 MVCDVDFLNUYJCG-MRXNPFEDSA-N 429.565 4.001 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H]2NCc2cccc(Br)c2O)C1 1918886960 BKBFCRMPGMZYOX-OXQOHEQNSA-N 425.367 4.424 10 10 IICE CN[C@@H](c1ccc2c(c1)CCN2C)[C@H](NC(=O)OC(C)(C)C)[C@H](C)OCc1ccccc1 2044755262 VXXBCNDUBDPENG-GLYQVZKVSA-N 439.600 4.438 10 10 IICE O=[N+]([O-])c1ccc(O)c(Cn2ncc(C3CCCCC3)c2I)c1 2070313556 WZLGYAYLGWCTIO-UHFFFAOYSA-N 427.242 4.198 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cc(Br)ccc2O)[nH]1 2082943854 FZTHKJHVDIBWHL-JTQLQIEISA-N 428.352 4.231 10 10 IICE CC(C)(C)OC(=O)NCC1(F)CC(CNCc2cc(Br)cc(F)c2O)C1 2111959092 HBDFZPIHUDTZJU-UHFFFAOYSA-N 435.309 4.026 10 10 IICE COc1cccc(C=C2SC(=S)N(CCCC(=O)Nc3cccc(O)c3)C2=O)c1 2296885552 ZPWDPFWLEBNRCD-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551126 FCGBWFYRUSJTSC-HFMPRLQTSA-N 434.540 4.493 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@H]3CCCc4cc(OC)ccc43)cc2F)CC1 730194656 UKNMVQPZZYLAMJ-OAQYLSRUSA-N 439.575 4.103 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 743289044 QTDGTXSRTDFVPT-NRFANRHFSA-N 425.573 4.237 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(C(C)(C)C(F)(F)F)cc3)cc2)CC1 764891222 CMJBRCLFRUOSMS-UHFFFAOYSA-N 447.501 4.125 10 10 IICE COc1ccc(C(=O)CCC(=O)NCc2cccc(Br)c2O)c(Cl)c1 765731467 JHFJCZPKMCVUCV-UHFFFAOYSA-N 426.694 4.096 10 10 IICE O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1cc(Br)ccc1O 804934571 BWRMOJLPTBGOSC-UHFFFAOYSA-N 442.313 4.128 10 10 IICE CCN(c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1)C(C)C 916668799 AGAJOKNHUUDUCU-UHFFFAOYSA-N 428.552 4.343 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1 917873634 OZNIJHQUBMMURP-UHFFFAOYSA-N 436.868 4.325 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C(/C)c3ccccc3Cl)CC2)cc1 1124584847 GHHZEYVVSDNRIK-HNENSFHCSA-N 427.976 4.080 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cnc(CNC(=O)OC(C)(C)C)s2)C2CC2)cc1 1124905372 HNECUNQKJCZRBL-UHFFFAOYSA-N 430.574 4.039 10 10 IICE Cc1oc(Br)cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657939 MUSATTVGADKHRI-GFCCVEGCSA-N 429.261 4.351 10 10 IICE COc1ccc(-n2nnc(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)c2C)cc1 1132044869 ZDBFLUMUHWKPQI-UHFFFAOYSA-N 429.524 4.230 10 10 IICE Cc1nn(-c2ccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cc2)c(C)c1Cl 1134881715 FPMNPSHVJMHRKS-JOCHJYFZSA-N 439.991 4.241 10 10 IICE CC(C)c1ccc(-n2cc(O)c(C(=O)NCc3ccc(N4CCSCC4)cc3)n2)cc1 1136281597 KADZQVWCYVFKBC-UHFFFAOYSA-N 436.581 4.185 10 10 IICE Cc1ccc(C(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1137359036 CTKCZSXUCHLDAZ-VWLOTQADSA-N 434.536 4.466 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC(C)(C)CCNC(=O)OC(C)(C)C)c1 1142476693 ACHNHYXHELQTNF-UHFFFAOYSA-N 427.545 4.330 10 10 IICE Fc1cc(CNc2ncnc3ccc(Br)cc23)cc(F)c1N1CCOCC1 1163459363 AFFGKDHTMFRXOC-UHFFFAOYSA-N 435.272 4.119 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCc3c[nH]c4cc(F)c(Cl)cc34)C2)cc1 1230300117 BLZBEAJRSXLFSO-OAHLLOKOSA-N 444.938 4.337 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 1251981488 NAXXQWVJTBJMSM-IOMROCGXSA-N 432.609 4.127 10 10 IICE C[C@H](CN(C)C(=O)OC(C)(C)C)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1264452611 VRLXPTXRAVEMBG-GOSISDBHSA-N 429.561 4.377 10 10 IICE Cc1cc2c(Br)ccc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2o1 1350933838 SLAPCHAGCNLOBU-UHFFFAOYSA-N 447.304 4.409 10 10 IICE COc1ccc(N2CCC(NC(=O)c3sc(-c4c(C)noc4C)nc3C)CC2)cc1 1352538348 SHYKYUADFDNMOU-UHFFFAOYSA-N 426.542 4.131 10 10 IICE Cc1cc(C(F)(F)F)n2nc(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)cc2n1 1438180952 ZXSUQHZQFYWXGH-UHFFFAOYSA-N 441.457 4.437 10 10 IICE CC(=O)Nc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1440808910 HRAFZHWDVMEIFN-UHFFFAOYSA-N 441.329 4.140 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](Oc3ccccc3)C(C)(C)O)cc2Cl)C1 1448445372 ANOPKGKFHHZMOD-VGOFRKELSA-N 430.976 4.411 10 10 IICE COc1cc(N2CCN(C(=O)/C=C/c3ccc(C(C)(C)C)cc3)CC2)cc(OC)c1OC 1458760157 CWHNIOPPROFHCG-FMIVXFBMSA-N 438.568 4.372 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c(Sc2ccccc2)n1 1462468510 OXDZVZHYXLWOLN-UHFFFAOYSA-N 432.593 4.223 10 10 IICE COc1cc([C@@H](C)NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc(OC)c1OC 1464234736 MQBQQUIVLGDPSQ-MRXNPFEDSA-N 436.508 4.423 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cccc(O)c3)CC2)c(C)n1-c1ccc(Cl)cc1 1466015190 NKGCXOOYNVZUIQ-UHFFFAOYSA-N 437.927 4.051 10 10 IICE CCOc1ccc(N2CCN(C[C@@](C)(O)c3ccc(Br)cc3F)CC2)cc1 1473296866 SJTPWVZFUJCNQB-OAQYLSRUSA-N 437.353 4.017 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CC1 1517892725 PEFLMRBRYIQVRK-NRFANRHFSA-N 444.630 4.374 10 10 IICE O=C(/C=C/c1ccc(Cl)nc1)N(CCCn1ccnc1)c1ccc(Br)cn1 1526309356 KFWQNBFLIQTFFF-XVNBXDOJSA-N 446.736 4.226 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2=O)cc1 1528554584 JCTPEIHGIMGNJY-NZQKXSOJSA-N 449.595 4.096 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(C)CCN(C)c1ccc(OC)cc1)O[C@@H](C)C2 1531374386 AQAVGUHAHSTMPN-HYVJGQCMSA-N 438.568 4.116 10 10 IICE Cc1cc(CNC(=O)c2ccccc2S(=O)(=O)C(F)(F)F)c(C)n1-c1ccccc1 1534768184 UITKOVMZOKETMN-UHFFFAOYSA-N 436.455 4.318 10 10 IICE CCCCc1nc(C)c(CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1535561164 JKVVOFABEOMOPH-UHFFFAOYSA-N 440.657 4.185 10 10 IICE CCn1ncc2c(C(=O)N(C)CCN(C)c3ccc(OC)cc3)cc(-c3ccccc3)nc21 1538161350 VYDJRRYEOGUZPN-UHFFFAOYSA-N 443.551 4.335 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CC=C(c4ccc(F)cc4)CC3)CC2)cc1F 1564441774 WRUBMIDGAVXPBZ-FQEVSTJZSA-N 427.495 4.441 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(NC(=O)CC(C)C)ccc3Cl)CC2)cc1F 1566347024 UUYCMRPPFNLOAN-UHFFFAOYSA-N 447.938 4.435 10 10 IICE CCCCN(CC)c1ccc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1 1566850201 ZCGVVJHCLXXJLT-UHFFFAOYSA-N 432.948 4.487 10 10 IICE C[C@@H](NC(=O)[C@@H]1Cc2ccc(O)cc2N1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1567777342 SXDRWSJBPMUHNW-VFNWGFHPSA-N 425.529 4.002 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 1570514528 FTPFWYGUGOVCAD-UHFFFAOYSA-N 449.532 4.307 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C=C(/c3ccc(Cl)cc3)C(F)(F)F)cc2)CC1 1583475672 KVDYQSVMPGQBFF-ZHZULCJRSA-N 437.893 4.354 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c1C(F)F 1585665943 XGROKRBPNSEBRL-LBPRGKRZSA-N 446.420 4.124 10 10 IICE COC(=O)COc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c(C)c1 1597010042 GYHFJRWAVAYFSS-UHFFFAOYSA-N 434.492 4.328 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1CC 1613370497 GQZZOYGTFSGYQD-SFHVURJKSA-N 446.603 4.495 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)c1 1624377457 QEBDAXVGTJAWFV-GOSISDBHSA-N 427.508 4.321 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C(C)=C\c3c(Cl)cccc3Cl)CC2)cc1 1625952013 SQLRBYOKGXXIDX-MSUUIHNZSA-N 448.394 4.344 10 10 IICE COc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1N1CCOC1=O 1634386638 BGJCHDGTOWEVOR-UHFFFAOYSA-N 447.491 4.053 10 10 IICE CC[C@H](CCc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1640527433 FFILAQXWMBWLFV-QGZVFWFLSA-N 444.578 4.396 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(Oc2ccc(Cl)cn2)c1 1641204302 RAJYZRQHFNYEFE-UHFFFAOYSA-N 437.927 4.418 10 10 IICE COc1ccc(N(C)CC(=O)N2N=C(c3ccc(C)cc3)C[C@@H]2c2ccco2)cc1OC 1641641576 HWYSCDAAQCLEBQ-OAQYLSRUSA-N 433.508 4.419 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(Nc4nccs4)cc3F)C2)cc1 1643347382 XROSXTZECBUEFK-OAHLLOKOSA-N 426.517 4.291 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)Cc1ccccc1 1644441697 YYMZAHJOXRHENJ-OYRHEFFESA-N 441.591 4.214 10 10 IICE CCOc1ccc(N2CCN(CCC(=O)Nc3ccc(N(C)C(C)C)c(F)c3)CC2)cc1 1644993440 KPMXKPSMNMBKSC-UHFFFAOYSA-N 442.579 4.220 10 10 IICE COc1cc(N2CCN(Cc3ccc(Br)c(C)c3)CC2)cc(OC)c1OC 1645224391 SSURMZBHQUZWFW-UHFFFAOYSA-N 435.362 4.106 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2Cc1cccc(S(C)(=O)=O)c1 1653349989 YODMCOQEGQBHEZ-UHFFFAOYSA-N 430.570 4.068 10 10 IICE CCc1cccc2c1N(CC(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CCC2 1657668061 FMBUCLUZBPYBBW-KDURUIRLSA-N 439.575 4.071 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)OCc2ccccc2)c1O 1658628107 YFHOOXSPGMTOAY-PEYKTXOXSA-N 427.928 4.496 10 10 IICE COc1ccc(N2CCN([C@@H](C)c3nc(-c4ccc(F)c(C)c4)no3)CC2)c(OC)c1 1659861142 LNGHHGCZTQEJBH-INIZCTEOSA-N 426.492 4.085 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC[C@H]1CC 1696248487 MWEMQYRVGKUMGV-FGZHOGPDSA-N 441.620 4.114 10 10 IICE CCC[C@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709489445 MKOHSBTUJRGPMY-IBGZPJMESA-N 425.621 4.427 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(CC)C[C@H]2CCCO2)cc1 1710026201 ALFWUMQFWVAVKM-PKTZIBPZSA-N 441.620 4.420 10 10 IICE CC(C)CC[C@](C)(O)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1723367136 ZIPSOPSXALCSOV-QHCPKHFHSA-N 428.602 4.460 10 10 IICE C[C@@H]1CCC[C@H](N(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1726519843 AHTFNOKOCKQGRY-CVEARBPZSA-N 429.619 4.389 10 10 IICE Cc1cccc(CCCn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)n1 1742338997 UPPLUDOQDUQSSU-UHFFFAOYSA-N 428.540 4.327 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)cc1C 1749937445 DFHBTZNFJZFKHG-DFQSSKMNSA-N 429.609 4.050 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@H](C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1761678270 DCESRUQSHVECDX-HXUWFJFHSA-N 437.588 4.130 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2CCC[C@@H](C(=O)OC)C2)cc1 1764938173 GGIOOLRGWVZYJB-OAQYLSRUSA-N 439.604 4.220 10 10 IICE CCN(c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1)C(C)C 1766476128 IVSQITUBGJWSPC-HXUWFJFHSA-N 429.634 4.008 10 10 IICE CN(C[C@@H]1CCOC1)c1nnc(Cc2ccc(F)cc2)n1CCCSc1nccs1 1768812990 PSPIVWUHMSQDMZ-KRWDZBQOSA-N 447.605 4.120 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)ccc1O 1860087480 AMRSYAJXUVFESI-GIJQJNRQSA-N 447.534 4.223 10 10 IICE CC1=NN(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679560 TZCVAVBFUYVUFG-AWNIVKPZSA-N 434.235 4.479 10 10 IICE CC(=O)N1CCCc2cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)ccc21 1865992576 LFZUOLJYZKJMLG-SANMLTNESA-N 448.611 4.009 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCc3ccccc3)C(=O)N(C(C)C)C2=O)cc1 1873162359 RGLFZWUWTAERQI-UHFFFAOYSA-N 427.548 4.415 10 10 IICE Cc1cccc(NC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(CCN(C)C)C2=O)c1 1873421450 YTNPNBRZMQUKRQ-UHFFFAOYSA-N 442.563 4.156 10 10 IICE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 1999536557 LRRFWMDPESTKLS-FYYLOGMGSA-N 425.573 4.050 10 10 IICE COc1cccc(CNc2ccc(Br)cc2I)c1O 2231664480 DZTKGPMLHRPGKS-UHFFFAOYSA-N 434.071 4.380 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236046501 VEQIDBNQFZYINT-AWEZNQCLSA-N 443.382 4.290 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3Cc3cccc(C)c3)C2=O)cc1Cl 2293205586 PAFTYPIXJGJYCI-UHFFFAOYSA-N 449.894 4.173 10 10 IICE CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 2313548594 ZGIQSABUZGQVGE-UHFFFAOYSA-N 449.688 4.168 10 10 IICE CCN1C(=O)C(=Cc2cc(Br)ccc2OCc2ccccc2F)NC1=S 2313653161 WXFKYFHMCLEDII-UHFFFAOYSA-N 435.318 4.245 10 10 IICE CC[C@H](C)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323829836 ZFVZIFLKSHBZAD-SDBXPKJASA-N 432.336 4.289 10 10 IICE CC(C)C[C@@H]1NCCc2cc(N=Nc3nncs3)c(NS(=O)(=O)C(F)(F)F)cc21 2333141272 AWPSFGIGOANSQW-LBPRGKRZSA-N 448.496 4.448 10 10 IICE CC[C@H]1SC(=S)N(CCC(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)C1=O 11635817 ZSOSSUATLANPBQ-CQSZACIVSA-N 440.015 4.355 10 10 IICE CCOC(=O)[C@@H](OCC)c1cc(-c2ccc(S(C)(=O)=O)cc2)n(-c2ccccc2)c1C 40431073 RSDWFRPCZDPSCL-QHCPKHFHSA-N 441.549 4.497 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3cccc(Br)c3)=NN2C2=NC(=O)CS2)cc1 72413081 MOAZHYNTWPKFNJ-SFHVURJKSA-N 443.370 4.296 10 10 IICE Cc1cc(C(=O)NCc2cccc(NC(=O)CN(C)C)c2)c(C)n1-c1ccc(Cl)cc1 108651899 WBLATTWXHUDVLF-UHFFFAOYSA-N 438.959 4.178 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@H](COc3ccccc3)C2)C1 436035872 FORPPXHIKXJQRC-NRFANRHFSA-N 431.580 4.335 10 10 IICE O=S(=O)(Nc1nc(-c2ccc3ccccc3c2)cs1)c1cnn(C2CCOCC2)c1 749737515 HWPGECUSTOYQAA-UHFFFAOYSA-N 440.550 4.312 10 10 IICE C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cc(Br)c(F)cc1O 756596146 YBWXXNUPROHVAY-CQSZACIVSA-N 435.337 4.497 10 10 IICE C[C@H](N[C@H](CO)c1cccc(Br)c1)c1cc(Br)cc(F)c1O 756760475 JQUJZUXVKWGQRB-BJOHPYRUSA-N 433.115 4.441 10 10 IICE Cc1cc(CCNC(=O)Nc2cccn(CC(F)(F)F)c2=O)c(C)n1-c1ccccc1 757255247 RMHYHUQNUCPAEG-UHFFFAOYSA-N 432.446 4.182 10 10 IICE Cn1ncc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1C(F)F 759863902 FEZYFJMWEFCIQH-XYOKQWHBSA-N 442.538 4.039 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C 764545990 CSQHYQUKZVOMPY-NQIIRXRSSA-N 432.609 4.318 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3cccnc3-n3ccnc3)no2)C1 809328958 ZKOCKDLHUCLTFH-UHFFFAOYSA-N 439.523 4.087 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnc(OC2CCOCC2)c(Cl)c1 857508012 MBQSQJWJVGYALY-UHFFFAOYSA-N 431.703 4.235 10 10 IICE CCc1nc2ccccc2c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1C 1129661113 GDIUTXAYQOJSSV-UHFFFAOYSA-N 425.479 4.150 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3cccc(C(F)(F)F)c3)CC2)c(OC)c1 1132031917 BUWYEXNXFPELQN-UHFFFAOYSA-N 436.474 4.349 10 10 IICE COc1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(Cl)c1OC 1136480063 AIBKVMOIWAKFEA-HXUWFJFHSA-N 446.975 4.174 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(-c2cnn(C)c2)nc2c(C)c(C)ccc12 1140203410 JCJOUOSCOSSTTM-UHFFFAOYSA-N 435.524 4.373 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@]2(C)CCN(Cc3ccccc3)C2)cc1 1144569494 XQCSFIMYAUODPB-MHZLTWQESA-N 429.564 4.230 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(O)c(Br)c2)cc1 1150395480 PEPVQXQVGZKCBW-UHFFFAOYSA-N 441.325 4.234 10 10 IICE O=C(CCNC(=O)OCC1c2ccccc2-c2ccccc21)NCc1c(O)cccc1F 1156178312 ZODLCQQOIKWYMX-UHFFFAOYSA-N 434.467 4.076 10 10 IICE C[C@@H](CO)n1c(C(F)(F)F)nc2cc(NC(=O)c3ccc(N=NC(N)=O)cc3)ccc21 1158510930 OVSBYSJCJKKACJ-JTQLQIEISA-N 434.378 4.023 10 10 IICE COc1ccc(CN(C)[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1167325454 BQYWLJCHVOWXIK-KRWDZBQOSA-N 442.515 4.238 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCCC[C@H]2CCO)sc(C)c1-c1ccccc1 1194306596 LBMNSFOQOCQGGY-IBGZPJMESA-N 444.597 4.466 10 10 IICE C[C@@H](CC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)n1cc(Br)cn1 1265001674 FPDPLGIJVABQEB-ZDUSSCGKSA-N 447.299 4.254 10 10 IICE Cn1nc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1-c1ccc(F)cc1 1265567675 WUQUYHPJIGEZJD-QGZVFWFLSA-N 444.457 4.226 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1289356221 OBJWZVOZHVXCDU-UHFFFAOYSA-N 434.588 4.114 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c1 1298012177 UWFTVFLMEVNEOZ-MSOLQXFVSA-N 429.520 4.003 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccoc2)cc1F 1298053272 JKDDCWAKWGBPDG-UHFFFAOYSA-N 440.910 4.476 10 10 IICE CC1(C)CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)CCO1 1303974247 GNCHLDJNFMHEIB-UHFFFAOYSA-N 447.605 4.262 10 10 IICE CCc1nnc(N2CCO[C@H](CCc3ccccc3)C2)n1CCCSc1nccs1 1306221003 IHUYGKKGAWKUNH-LJQANCHMSA-N 443.642 4.317 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C[C@H]2CCCO2)c(C)n1-c1ccc(C(C)C)cc1 1307277334 ZOVOTOOKYLLURT-HXUWFJFHSA-N 439.585 4.358 10 10 IICE CSc1ccc([C@H](CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)N(C)C)cc1 1312757497 ZLVZPEMKPHBXNC-IRLDBZIGSA-N 443.613 4.108 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1314270685 BVZGBIIHIFHQQM-QFIPXVFZSA-N 434.588 4.240 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2cccs2)cc1F 1314661923 VHLAURMHGUTYFM-QGZVFWFLSA-N 429.565 4.123 10 10 IICE COC(=O)CC[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1359943576 GLOAANQDYGEKPP-QFIPXVFZSA-N 434.536 4.339 10 10 IICE COc1ccc(OC)c(CN2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)c1 1441018968 QTGMRWNJUCIKDN-UHFFFAOYSA-N 447.579 4.378 10 10 IICE Cc1cc(CC(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 1444962197 WIESZICCYSWHEL-INIZCTEOSA-N 427.898 4.385 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccc4ccccc4c3)CC2)cc1F 1459745901 BJDOGXCSWGNXLD-OALUTQOASA-N 435.543 4.375 10 10 IICE C[C@@H]1[C@H](c2ccccc2)c2ccccc2CCN1CC(=O)NCc1ccc(N(C)C)cc1 1459786599 MHNYRIZIFMZDGK-LYZGTLIUSA-N 427.592 4.448 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc4cc(C(C)(C)C)ccc4[nH]3)CC2)cc1 1464539729 IJQOXBGXOJHRLF-UHFFFAOYSA-N 434.584 4.026 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3cc(Cl)ccc3Cl)CC2)c(OC)c1 1473732819 PUTZCKVNEMHXAX-CQSZACIVSA-N 438.355 4.160 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)sc2c1CCCCC2 1515317886 REXXQHXWNYDAIG-INIZCTEOSA-N 440.565 4.412 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 1515929558 XFMCSWGLPRWOEN-HNNXBMFYSA-N 432.476 4.014 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccccc1 1538843204 FTMCVICHHJYYEA-HFZDXXHNSA-N 431.580 4.042 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(Cl)c1 1540459684 SIOWGOFTZDEFPX-UHFFFAOYSA-N 431.920 4.017 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(C(=O)c2ccccc2)c[nH]1 1545509060 YADFZJCKLFGDJG-UHFFFAOYSA-N 427.298 4.376 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@H]1C1CC1 1557291217 GKCRWCGBVKYLHZ-VQTJNVASSA-N 445.357 4.128 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3ncn(-c4ccccc4)n3)c2C)cc1 1559355761 NDOLTKNMLNVCRV-UHFFFAOYSA-N 446.532 4.436 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1 1567106525 JLTBYBFRDRUMHL-JOCHJYFZSA-N 435.955 4.498 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 1568735948 OXTMBSIGZRTFAD-OXJNMPFZSA-N 433.545 4.396 10 10 IICE CC[C@@H](C(=O)N(C)Cc1ccc(N(CC)CC)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1587460306 USXIWNVAYVYZQH-NRFANRHFSA-N 440.979 4.449 10 10 IICE CCc1nnc(Cn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)s1 1613908020 GUEVODAUFPZZBM-UHFFFAOYSA-N 439.633 4.274 10 10 IICE CC[C@@H]1CCCN1c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1614168990 RCKICJBFLRMLTA-GOSISDBHSA-N 428.581 4.266 10 10 IICE CCCCC[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)(C)C 1617322944 NVTKLSVRRJXAET-FRFYRWIFSA-N 429.605 4.011 10 10 IICE Cc1ccccc1C[C@@H](CO)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1625275476 UFCCCSMMUNJAGT-FQEVSTJZSA-N 441.369 4.498 10 10 IICE CCN(C(=O)c1ccc(N=NC(N)=O)cc1)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 1628477101 UIVKXBXACPRMDR-UHFFFAOYSA-N 437.548 4.202 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnc(-c2cccc(Cl)c2)s1 1630481435 ULKCUQCTBVFRSM-UHFFFAOYSA-N 430.913 4.375 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(F)c(Br)c1 1631425991 VCISIEOBXSKNKM-HNNXBMFYSA-N 441.728 4.342 10 10 IICE O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cc2cc(O)c(O)cc2s1 1633694955 MYQOYTYOJRNUOK-GFCCVEGCSA-N 438.427 4.220 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccccc2Cl)c(C)n1-c1ccc(Br)cn1 1635800866 UHERZGDORXVHRR-GOSISDBHSA-N 448.748 4.368 10 10 IICE Cc1cc(C(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c(C)n1-c1cccc(F)c1 1652735653 KHJYHLLFVJPVSK-GJZGRUSLSA-N 425.504 4.163 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1707270063 GMXPPYMKEXKVHO-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1708362936 WKUPKQSZVDCASC-LCXONAHVSA-N 444.620 4.336 10 10 IICE C[C@@H]1CCN(c2nnc(CCOc3ccccc3)n2CCCSc2nccs2)C1 1726622052 MUNUKXRKNAXYFN-QGZVFWFLSA-N 429.615 4.385 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC2(C)C)n1CCCSc1nccs1 1727212757 AJUYGUMWYGRCQS-UHFFFAOYSA-N 436.651 4.214 10 10 IICE CC(C)CCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1750796871 IUDCUBWTODILFJ-QFIPXVFZSA-N 427.593 4.039 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](n3cc(C)cn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752755198 GVHDDBVWRZLNHL-ICSRJNTNSA-N 439.583 4.391 10 10 IICE Cc1nc(CCn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)cs1 1762308603 UZNCVJPYGNWJRM-UHFFFAOYSA-N 440.960 4.343 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1765062008 AICONCYVHAAZGR-PZJWPPBQSA-N 425.621 4.376 10 10 IICE C[C@H](N)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)c(Br)c1 2144879023 MOQYVIOOCJBYMO-SFHVURJKSA-N 432.406 4.198 10 10 IICE COc1ccccc1C=C1SC(=S)N(CCC(=O)Nc2ccc(C(C)=O)cc2)C1=O 2297349606 YKFGVPVMKIOLLM-UHFFFAOYSA-N 440.546 4.128 10 10 IICE Cc1ccc(CNC[C@]23C[C@H](CCN2C(=O)OC(C)(C)C)C3)c(O)c1Br 2352688485 UWIBBNUCARYBOT-LDTOLXSISA-N 425.367 4.342 10 10 IICE Cc1ccc(CNC(=O)C2(CCNC(=O)OC(C)(C)C)CCC2)c(O)c1Br 2381129040 DMRNBHLDXQOXGH-UHFFFAOYSA-N 441.366 4.164 10 10 IICE CN(C)c1ccc(CNC(=O)COc2ccccc2-c2nnc(-c3ccccc3)o2)cc1 15733434 ZSXOMJJIFOOEQK-UHFFFAOYSA-N 428.492 4.165 10 10 IICE COc1cccc(OC)c1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCc2ccccc21 15780699 QBDHLXOZAPPMAV-QHCPKHFHSA-N 445.563 4.304 10 10 IICE CCN(CC)c1c(/C=C2/SC(=S)N(C3CCCC3)C2=O)c(C)c(C#N)c(=O)n1CC 33475942 RKFFLORSJWHPKC-LDADJPATSA-N 444.626 4.038 10 10 IICE COc1ccc(N2CCCN(Cn3nc4ccc(C(F)(F)F)cn4c3=S)CC2)cc1 97507308 UKEZERSCEQUKBI-UHFFFAOYSA-N 437.491 4.062 10 10 IICE O=C(NCCc1coc(-c2ccc(F)cc2)n1)NCc1ccc(N2CCSCC2)cc1 726706840 UADZLNCATFVUPU-UHFFFAOYSA-N 440.544 4.076 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1ccc3c(c1)CCCN3C)O[C@H](C)C2 730828692 WZMWCYSNDUAXQI-QGCDCVKKSA-N 435.568 4.146 10 10 IICE O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1)N(Cc1ccco1)Cc1ccccc1O 756103274 BCFUHZRAGYKWSO-QGZVFWFLSA-N 427.451 4.254 10 10 IICE Fc1cc(CN[C@@H]2CC[C@H](c3ccccc3)C2)ccc1N1CCN(c2ncccn2)CC1 780511004 MKPPQALUCGPGDI-XZOQPEGZSA-N 431.559 4.368 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)cc1 784397464 OWTNRUDJWUDKDQ-QHCPKHFHSA-N 442.523 4.488 10 10 IICE CCOC(=O)c1cc2cc(S(=O)(=O)Nc3nc(-c4ccccn4)cs3)ccc2s1 795609535 FXDBMTVTOBDELI-UHFFFAOYSA-N 445.547 4.397 10 10 IICE COCCn1c([C@H]2Cc3ccccc3O2)nnc1N(C)Cc1ccc(N2CCCCC2)cc1 802396269 QFUOOXSZVMYGDK-XMMPIXPASA-N 447.583 4.227 10 10 IICE CCOc1ccc([C@@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 824261086 YMMZKVPDTLJJTJ-CQSZACIVSA-N 444.443 4.260 10 10 IICE Cc1cc(-c2nc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)co2)ccn1 1125945714 PVCFGWVBDORAJL-UHFFFAOYSA-N 428.439 4.045 10 10 IICE CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1cccc(Cl)n1 1129546372 CUAZZXGHDYBCLR-ACCUITESSA-N 437.999 4.441 10 10 IICE Cc1cc2c(N3CCC[C@@H]3C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)ncnc2s1 1129820039 QJHKPXJFHCWALP-HRAATJIYSA-N 437.613 4.090 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccnc2c1CCN2C(=O)OC(C)(C)C 1141980399 SANWNBJTERATMT-UHFFFAOYSA-N 438.572 4.496 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)[C@@H](C)C1 1146709485 KLJZMJAMENJFGJ-ROUUACIJSA-N 439.556 4.377 10 10 IICE Cc1cc(C(=O)NCC2(S(=O)(=O)NC(C)(C)C)CC2)c(C)n1-c1cccc(C(C)C)c1 1153516053 BBEMJBIDRSDSJE-UHFFFAOYSA-N 445.629 4.198 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 1156288602 ZUEBWPNFSLVMEP-LEWJYISDSA-N 439.512 4.087 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)CCc1nccc(C(F)(F)F)n1 1180226438 WPXMUXQGWVWWQM-UHFFFAOYSA-N 430.430 4.030 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)C2)cc1 1299771180 ZVGWJFLAFQPMKY-NSHDSACASA-N 442.274 4.306 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCOC1 1306565552 DSXDHCCTSSCPBA-CJAUYULYSA-N 437.588 4.129 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1 1313545299 MHKAFYLDENARNT-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(C)(C)Oc1ccc(Br)cc1 1440675045 WEJHBKCPHHXOHK-UHFFFAOYSA-N 447.373 4.102 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN(C(C)=O)c2ccccc2)cc1 1443634687 QLLNPFGMBKYQGJ-UHFFFAOYSA-N 431.536 4.348 10 10 IICE Cc1nc(Cl)c(Cl)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445887983 WNYVVIJPYQFLDR-AWEZNQCLSA-N 428.747 4.450 10 10 IICE CCS(=O)(=O)Cc1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1460957239 JBVUTRPZOFCHFA-UHFFFAOYSA-N 440.565 4.102 10 10 IICE CN1C[C@@H](CNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)[C@H](c2ccccc2)C1 1471496822 XRJRGTPDHAYKCO-BVAGGSTKSA-N 446.595 4.403 10 10 IICE CO[C@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC[C@H]1C 1504501539 HGWQHPOKTLVNLZ-QAPCUYQASA-N 444.630 4.149 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)CCc2c(NC(=O)OC(C)(C)C)cnn2C)cc1 1540459863 ZRTDXHJBVSGTHJ-UHFFFAOYSA-N 443.592 4.205 10 10 IICE Cc1ccc(C(=O)NCc2ccccc2CN2CCCC2=O)cc1-n1c(C)cc(C=O)c1C 1543284778 PLZSSPLCCXKXNZ-UHFFFAOYSA-N 443.547 4.267 10 10 IICE CC(C)COc1cccc(OCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1545632436 LVAPEKUIQCERTP-FQEVSTJZSA-N 446.975 4.240 10 10 IICE CCOCc1nnc(N2CCC(CC(F)(F)F)CC2)n1Cc1ccc(N(C)C)cc1C 1548122285 GJFAOUKPVORJAH-UHFFFAOYSA-N 439.526 4.406 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(-c4ccc(C=O)o4)ccc3O)c2)CC1 1556090101 IOWOMWHGZRCDTB-UHFFFAOYSA-N 433.508 4.247 10 10 IICE CCOC(=O)[C@H](C)C1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1558239278 KMLBWRGSJGIRLR-CQSZACIVSA-N 433.346 4.128 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)c(OC)c1 1560083384 WGAVQKVVCKPZJJ-CQSZACIVSA-N 438.355 4.160 10 10 IICE Cc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1NC(=O)N(C)C 1567938714 BSLVIZUIEWTLDV-UHFFFAOYSA-N 432.524 4.490 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(-c4ccccc4)c3C(F)F)C2)cc1 1584444775 ZQBBXWPQIQJXKK-INIZCTEOSA-N 426.467 4.075 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Cl)c([N+](=O)[O-])cc2NC(C)=O)cc1F 1585697805 CHSCXUWEAJTPLG-UHFFFAOYSA-N 436.871 4.122 10 10 IICE CCc1nc(OC)ccc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1585711802 HPXLUNKXNIDUPM-VBKFSLOCSA-N 447.607 4.334 10 10 IICE CCCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1Cc1ccccc1 1598364792 WJBFUWMLURAHNY-NRFANRHFSA-N 432.568 4.149 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1615381692 CSPHINHUBGTIML-FQEVSTJZSA-N 448.615 4.162 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](CS(C)(=O)=O)c3ccccc3)cc2Cl)C1 1617899464 AAJJGWMUZNZYRP-XLIONFOSSA-N 449.016 4.021 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCSc2ccccn2)NC(=O)OC(C)(C)C)cc1 1618253566 OONDEJJGZBGNFC-LJQANCHMSA-N 444.601 4.012 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Sc3nc4ccccc4s3)CC2)cc1F 1622564091 PIFYMYMUJJTPMV-CQSZACIVSA-N 431.558 4.273 10 10 IICE O=C(NCc1cccc(Br)c1O)C(F)(F)c1cccc(Br)c1 1623365114 XCJAPMXRDKSQIY-UHFFFAOYSA-N 435.062 4.325 10 10 IICE O=C(CCC(=O)Nc1c(-c2ccccn2)nc2ccccn12)CCC(=O)c1cccs1 1629107183 CZVRIARZOIPGRD-UHFFFAOYSA-N 432.505 4.409 10 10 IICE Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1OC(F)(F)F 1632039712 DUBHAMHPCZITTP-UHFFFAOYSA-N 445.388 4.168 10 10 IICE COc1ccccc1-c1ccnc(C2CCN(C(=O)c3ccc(N=NC(N)=O)cc3)CC2)n1 1634264489 KJESNPJHPQWHBJ-UHFFFAOYSA-N 444.495 4.334 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)O[C@]3(CCOC3)C2)c(C)n1-c1ccccc1Br 1634918071 ZUWWJJJSVXSQIT-JOCHJYFZSA-N 447.373 4.267 10 10 IICE C[C@H]1Cc2cnccc2N1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1643138317 KGZVITROXRMBPB-MFVBVHDHSA-N 429.592 4.102 10 10 IICE CC(=O)c1cc(F)cc(CN2C[C@H](CNC(=O)OC(C)(C)C)Cc3ccccc32)c1O 1648093053 WMTDYYVIQQIPPB-INIZCTEOSA-N 428.504 4.438 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)(F)F)CC2)c(C)n1-c1ccc(Br)cc1 1652840110 QRJYYTNGJGRFPJ-UHFFFAOYSA-N 440.332 4.270 10 10 IICE COc1ccc(N(C)CC(=O)Nc2nc(C)c(Cc3ccc(C)cc3)s2)cc1OC 1653261475 YRYVVCSTXYOCSE-UHFFFAOYSA-N 425.554 4.443 10 10 IICE CC1CCC(N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C2CC2)CC1 1657004668 CASVEWRENLBKPS-XTBIFASLSA-N 431.596 4.099 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1nc(-c2ccncc2)cs1 1685012159 GKODEDKFDRGQRZ-UHFFFAOYSA-N 447.358 4.405 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(N)=O)C1 1694984791 XIESQACAZHLGPX-MRSBXDGLSA-N 432.572 4.021 10 10 IICE CCN(c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1)C(C)C 1695560297 CUMSBBNVWVJJNW-UHFFFAOYSA-N 435.551 4.005 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1696375452 JNGDDASXWYQZDR-OAQYLSRUSA-N 434.588 4.097 10 10 IICE CO[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C 1697691681 DKNNUANBMHNLAN-HTAPYJJXSA-N 429.584 4.125 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728921000 DWEXEZDGXHCENO-GOTSBHOMSA-N 448.615 4.403 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3cc(C)on3)n2Cc2ccc(N(C)C)cc2C)n1 1751605314 PCXNEACVRQDALO-UHFFFAOYSA-N 431.544 4.004 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1cccs1 1760993268 AIBSUVQMPNCURA-UHFFFAOYSA-N 439.629 4.254 10 10 IICE Cc1ccc(CN(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)s1 1761774895 OZTPJMHTVUXZNM-KRWDZBQOSA-N 429.565 4.042 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@H]1CCOC1 1769684212 NEPWOSOCMXOGMU-NRFANRHFSA-N 437.588 4.252 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ccc(Cl)cn2)sc(C)c1-c1ccc(C)cc1 1860749849 DROIZKSZKYZPQL-UHFFFAOYSA-N 443.912 4.444 10 10 IICE CCCN1N=C(C(F)(F)F)/C(=C/c2ccc(OC(=O)c3ccccc3)c(OC)c2)C1=O 1865675894 FYYBXBHPPKJFNA-VBKFSLOCSA-N 432.398 4.468 10 10 IICE Oc1ccc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1878709447 GTGVAUBNVLJYDN-IAGOWNOFSA-N 429.280 4.307 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C3(C)CC3)c(CN)c2I)c(O)c1 2079026163 WTTCDWNNPKPIQJ-MRXNPFEDSA-N 437.325 4.011 10 10 IICE OCc1ccc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc1Br 2153339278 SHMIRMFGLGPDDM-ZRZAMGCNSA-N 427.386 4.434 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCN(C(=O)OC(C)(C)C)C23CC3)c1O 2236054846 MTPQNVAHBYBBIH-CYBMUJFWSA-N 441.366 4.043 10 10 IICE Cc1ccc(CN[C@]23CCCN(C(=O)OC(C)(C)C)C[C@H]2C3)c(O)c1Br 2352945054 QADNWEZJNKWNGZ-QRWLVFNGSA-N 425.367 4.342 10 10 IICE CC(C)(C)OC(=O)CN1C(=O)S/C(=C/c2ccc(-c3cccc(C(=O)O)c3)o2)C1=O 9259858 REZMHTGZGSOWNA-MHWRWJLKSA-N 429.450 4.023 10 10 IICE CC(C)C[C@H]1NCCc2cc(/N=N/c3nncs3)c(NS(=O)(=O)C(F)(F)F)cc21 199856828 AWPSFGIGOANSQW-HONQATIXSA-N 448.496 4.448 10 10 IICE CCCC1=NN(c2ccccc2)C(=O)/C1=C(\C)Nc1cc(C(=O)OC)ccc1C(=O)OC 205940459 ICFQGCHQSVTBER-RCCKNPSSSA-N 435.480 4.149 10 10 IICE COc1ccc(N2N=C(c3ccccc3)/C(=C(/C)NCCc3ccc(O)cc3)C2=O)cc1 205954287 UIANXQNZZACNRP-HKOYGPOVSA-N 427.504 4.258 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1OCC 206923662 QYTHRCAEFOWBIJ-CPNJWEJPSA-N 442.562 4.339 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S)NCc1ccccc1 210758729 BLFCNRPKWYQKHY-HMMYKYKNSA-N 440.590 4.470 10 10 IICE CCOc1ccc(S(=O)(=O)N(CC)c2cccc3c2C(=O)c2ccccc2C3=O)cc1 586254875 WMXXCSRKCMDDCR-UHFFFAOYSA-N 435.501 4.076 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3cccc(Cl)c3)cc2F)C[C@H](C)O1 753779119 LEOKRAIAOBXCLM-YESZJQIVSA-N 433.955 4.060 10 10 IICE C[C@@H](Cn1ncc2ccccc21)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 790574260 KFZSIRKHZGNDND-FUHWJXTLSA-N 428.483 4.059 10 10 IICE COc1ccc(Cn2nc(C)c(CNCc3cc(Br)ccc3O)c2C)cc1 809712976 XSJXYGDJRUFHRG-UHFFFAOYSA-N 430.346 4.315 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2cnn(Cc3ccccc3)c2)c1 1136039812 XNQAXAZXAKLFDV-UHFFFAOYSA-N 426.520 4.424 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(OCC(=O)OC(C)(C)C)c2)cc1F 1136730126 CUHCQBAUQZJGOF-UHFFFAOYSA-N 430.520 4.322 10 10 IICE COC(=O)CC[C@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)C(=O)OC(C)(C)C 1164239717 JGJAFUFHEDMKLR-IBGZPJMESA-N 448.947 4.141 10 10 IICE Cc1sc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1-c1ccco1 1291755633 IKEGTSUCNZZDLV-GASCZTMLSA-N 443.544 4.323 10 10 IICE Cc1cc(C(=O)NC[C@@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1293622114 ROLLREURKWASLY-JOCHJYFZSA-N 427.342 4.494 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(F)(F)Cc2ccccc2)NC(=O)OC(C)(C)C)cc1 1293793824 TYQZGOAAEIGOOB-FQEVSTJZSA-N 447.526 4.313 10 10 IICE COc1cc(Br)c(C(=O)NCc2ccc(N3CCCCC3)cc2)cc1OC 1299788454 PAKAUYGMYRLPNC-UHFFFAOYSA-N 433.346 4.387 10 10 IICE CCOc1ccc(N(Cc2nnc(C(=O)NCc3ccc(F)cc3)s2)CC2CC2)cc1 1308001212 LOBJXWYQIFZTJC-UHFFFAOYSA-N 440.544 4.423 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1ccccn1 1314464749 MUILWCJKSLQUNT-UHFFFAOYSA-N 444.583 4.463 10 10 IICE C[C@@]1(c2cccc(CNC(=O)Nc3ccc(N=Nc4ccccc4)cc3)c2)NC(=O)NC1=O 1318107096 QQCXNSCAJXYZIB-DEOSSOPVSA-N 442.479 4.478 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3c[nH]c4cccc(Br)c34)C2)cc1 1436969407 GPGJPPMIFVAUNF-OAHLLOKOSA-N 442.357 4.124 10 10 IICE C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445878792 BWOKVJAXFUYKGT-YOEHRIQHSA-N 449.960 4.215 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1448003585 IJXRIDUZIODNOD-GHTZIAJQSA-N 439.556 4.202 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)c2ccc(N3CCCNC3=O)cc2)c1 1450404311 POAIBZTXTNQKEG-SFHVURJKSA-N 444.535 4.317 10 10 IICE Cc1cc(C(=O)CSc2nnc(N)n2C)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1 1458836277 SDMXJHOLVXDTML-UHFFFAOYSA-N 443.882 4.452 10 10 IICE CCCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@@H]1C[C@H](OCC)C12CCCC2 1470771082 AFHZARUDPARBPH-PTUXOGIPSA-N 429.605 4.433 10 10 IICE CCCCO[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(C)C 1473259610 KJFGIIJVJOQHLT-DHIUTWEWSA-N 448.563 4.316 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H](c4ncc(Br)cn4)C3)cc2)CC1 1473792725 FIZIUQHCYRYEHI-GOSISDBHSA-N 445.405 4.234 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccc(N4CCC(O)CC4)cc3)c2C)c1 1479030690 OSHTZWZWKXXFHP-UHFFFAOYSA-N 446.595 4.363 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CC1(O)CCCCC1 1517148855 RKPMFKPYPKXFDS-TZIWHRDSSA-N 442.604 4.234 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)O1 1524586165 IKLSGODATJWWQG-IDCXYZFESA-N 430.932 4.071 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CSC[C@H]3c3ccccc3)cc2F)C[C@H](C)O1 1526004331 ZOGPELUQNQFKFU-IDPBPBMLSA-N 428.573 4.202 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C1Cc2ccccc2C1 1526773019 BUHASQLPVYGAGE-UDWIEESQSA-N 440.565 4.043 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1SC(F)(F)F 1528261698 NPEQXNZYLBEMPU-UHFFFAOYSA-N 432.414 4.343 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3cccc(NC(=O)OC(C)(C)C)c3)C2)cc1 1529706368 GNKDVEOIGJYXHN-LJQANCHMSA-N 439.556 4.227 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3sc(NC(=O)c4ccco4)cc3C)C2)cc1 1529709303 WPWROZLJHVQHNN-MRXNPFEDSA-N 439.537 4.167 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cn3nc(C(F)(F)F)c4c3CCOC4)c2C)c1 1531612523 RVPDOGOHLMXPAK-UHFFFAOYSA-N 446.473 4.007 10 10 IICE Cc1cc(C(C)(C)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)ccc1Br 1536925340 USGFNWWBFFJXBS-UHFFFAOYSA-N 444.417 4.103 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc3n(n2)CCN(C(=O)OC(C)(C)C)C3)cc1 1538421986 LIQJKMVSASFSQD-UHFFFAOYSA-N 435.528 4.294 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(C(=O)N=[S@@](C)(=O)N(C)C)cc2)cc1 1539033773 RSDPBYLPKFDNAC-WJOKGBTCSA-N 438.553 4.061 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(N4CCO[C@@H](C)C4)nc3)c2C)c1 1540791412 CLSACILWRXSMNF-FQEVSTJZSA-N 432.568 4.261 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3scnc3-c3ccccc3)cc2F)C[C@@H](C)O1 1544675790 AQADIOMJPIDPKM-IAGOWNOFSA-N 439.556 4.422 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3csc(COc4ccccc4)n3)CC2)cc1 1545931231 ABKBFVNABAAXDV-UHFFFAOYSA-N 437.565 4.012 10 10 IICE CCN(CCC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1547568818 MRLVHMXPHKYIFB-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COCCO[C@@H](C)c1nnc(N2C[C@@H]3CCC[C@@]2(C)C3)n1Cc1ccc(N(C)C)cc1C 1555681353 UVEZWUGYTKRMKN-DFIYOIEZSA-N 441.620 4.194 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCc1cccc(OCC(F)(F)F)c1 1564629208 VUCULFUDZLZJNE-KRWDZBQOSA-N 437.506 4.475 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(-c2ccc(Br)cc2)ns1 1611430741 HEGABDCNASJQRE-NSHDSACASA-N 433.327 4.345 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@H]1c1cnn(C)c1 1611963448 QQVAYOUTLHOPKR-QFIPXVFZSA-N 435.620 4.364 10 10 IICE Cc1ccc([C@H](C)N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)c1 1615239385 CVXDMLMXGZSCEI-HBMCJLEFSA-N 441.591 4.365 10 10 IICE CCOCc1nnc(N(C)C2CCC(C)CC2)n1Cc1ccc(N2CCSCC2)cc1 1616663963 SGYAZDONRCXOPF-UHFFFAOYSA-N 443.661 4.431 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)cc1F 1633752928 ISYWBOFNBXCNED-IBGZPJMESA-N 435.499 4.473 10 10 IICE CCOC(=O)CS[C@H](CNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1636347378 RKHQGOKXMOLHDQ-GOSISDBHSA-N 442.503 4.360 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(CCc3ccccc3)Cc3ccncc3)C2)cc1 1636354295 WPYLUXUIUVMZER-DEOSSOPVSA-N 444.579 4.371 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cnc(OC2CCOCC2)c(Cl)c1 1639735118 QWVFIQNXTBIERV-UHFFFAOYSA-N 429.948 4.213 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(Nc4nccs4)cc3F)C2)cc1 1643347381 XROSXTZECBUEFK-HNNXBMFYSA-N 426.517 4.291 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3ccsc3)n2)c(C)n1-c1ccc(Br)cc1 1643570131 OSRBWNJEQNGUNZ-UHFFFAOYSA-N 442.342 4.455 10 10 IICE COC[C@@H]1CC[C@@H]([C@H]2COCCN2C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)O1 1646250556 JEYOHJCFTQHILQ-CAOCKLPOSA-N 440.584 4.253 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCc2ccc(C(F)(F)F)cn2)CCCC1 1646520297 GHZXZTXZYMFERG-UHFFFAOYSA-N 431.458 4.301 10 10 IICE Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NCc3cccc(Cl)c3O)cc2)ccc1F 1653564004 WMRMGQSGJMTQSP-UHFFFAOYSA-N 448.903 4.224 10 10 IICE O=C(CN1CCCC[C@@H]1c1ccc(Cl)cc1)NCc1ccc(N2CCOCC2)c(F)c1 1653606891 SDMWAAHADFUXPA-JOCHJYFZSA-N 445.966 4.159 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(C(=O)c4ccccc4Cl)CC3)C2)cc1 1683945379 RTVMUCIBDLRIAB-SFHVURJKSA-N 441.959 4.232 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccccn4)n3CCC=C(C)C)CC2)cc1F 1697471715 LQVHMLGSSFCBBH-UHFFFAOYSA-N 436.535 4.171 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1 1730444667 JHMSWXPZGBFDKH-KRWDZBQOSA-N 434.544 4.260 10 10 IICE Cc1occc1CN(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)c(F)c1 1742067035 BNCVQCDADFCLIS-UHFFFAOYSA-N 434.519 4.055 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2C[C@@H](C)O[C@@H](COC)C2)cc1 1746089493 CJONNCDRLCITFM-AUSIDOKSSA-N 441.620 4.070 10 10 IICE CC[C@H](C)NC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=CCC1 1763926922 XVNCVBSBNJTUPD-IBGZPJMESA-N 446.599 4.424 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1CCC(C)(C)C1CC1 1767112378 ZQONKDTXXDJIOQ-UHFFFAOYSA-N 434.544 4.094 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)c2cc(Cl)c(Cl)cc2C(=O)O)c2nccn2C)cc1 1865859233 OJWIMOZAHJJLBO-GOSISDBHSA-N 447.322 4.011 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@]2(NCc2cc(Br)ccc2O)C1 2126055413 LWMCVAYTUJFCHQ-OALUTQOASA-N 429.330 4.126 10 10 IICE COc1ccc2cc(C=C3SC(=S)N([C@@H](C(=O)O)C(C)C)C3=O)c(Cl)nc2c1 2297580109 PKTBUNATOUCKBJ-OAHLLOKOSA-N 436.942 4.207 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(O)cc3)C2=O)ccc1OCCC(=O)O 2314934382 HIDFYSQNWFWCOE-UHFFFAOYSA-N 445.518 4.050 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1C 8608871 ZAHZYRLVRJWOSY-AREMUKBSSA-N 449.620 4.452 10 10 IICE O=C(Cn1c(=O)cnc2ccccc21)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 10909779 UWLMXIBTTWTALF-MHZLTWQESA-N 435.483 4.161 10 10 IICE COc1ccc([C@H]2N=C(c3ccc4c(c3)OCO4)C[C@H](c3ccccc3O)N2)cc1OC 53363256 CLEAOMNBWGEQGZ-CLOONOSVSA-N 432.476 4.361 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(C3CC3)[C@H](C)c3cccc(C(F)(F)F)c3)nc12 72018891 AHJLIFQAUBJMNX-CYBMUJFWSA-N 448.445 4.356 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](Cn2cccn2)c2ccccc2)C1 683445255 FLEXATHJMRQRAX-XMMPIXPASA-N 441.579 4.162 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc(-n4cccn4)nc3)no2)C1 685224448 WEPMWBVYPLSFMW-UHFFFAOYSA-N 439.523 4.087 10 10 IICE COCCOc1cc2c(cc1CNCc1ccc(N(C)C3CCCCC3)cc1)OCO2 742734242 RKVJBIKGNRHDIB-UHFFFAOYSA-N 426.557 4.499 10 10 IICE C[C@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(-c2cccnc2)cc1 747591184 DMYNLHWIEFMVQJ-FQEVSTJZSA-N 430.552 4.488 10 10 IICE COc1ccccc1[C@@H](O)CN[C@@H](C)c1cc(Br)cc(Br)c1O 756458168 KCMGNMUANOVCPY-BONVTDFDSA-N 445.151 4.310 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCc4cn(C5CCCC5)nc43)CC2)cc1F 764755199 DOYFCVZUCXLQPC-OAQYLSRUSA-N 441.551 4.055 10 10 IICE CC[C@@H](NC(=S)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccs1 768297421 ZJKBJTSXLCVLLQ-OAQYLSRUSA-N 428.671 4.396 10 10 IICE Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)NCc1cc(Br)ccc1O 804739928 ZDJLRVIQOYHMEI-UHFFFAOYSA-N 448.748 4.470 10 10 IICE CN(C)c1ccc(CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c(C(F)(F)F)c1 809690417 PXDHEJAKFXOFPS-CYBMUJFWSA-N 425.417 4.052 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(S(=O)(=O)NC(C)(C)C)cc2)c1 864016068 OYZIZWIKJIICBZ-UHFFFAOYSA-N 427.364 4.152 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2cccc(OCC(F)(F)F)n2)CCCC1 1128653970 MXONMBFSSXZVKI-UHFFFAOYSA-N 447.457 4.181 10 10 IICE Cc1cc(C(=O)NC[C@H](C)CN2CCCCC2)c(C)n1-c1ccc(Br)cn1 1136335261 UJYWDJLGCAQBHR-HNNXBMFYSA-N 433.394 4.103 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCOc2ccc(Br)cc21 1141803046 DNEYEXKLKKOOCQ-GOSISDBHSA-N 447.398 4.185 10 10 IICE CSCC[C@@H](CC(=O)NCc1ccc(N2CCCCC2)cc1)NC(=O)OC(C)(C)C 1142844391 PKAKOUQQKUZTKJ-IBGZPJMESA-N 435.634 4.330 10 10 IICE C[C@H](NC(=O)c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1)c1ccccc1O 1171730916 RNFHQSGTQMEZHQ-AWEZNQCLSA-N 430.913 4.337 10 10 IICE O=C(NCc1cccc(Cl)c1O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1 1246170228 XWHQOSIQQQZSNC-UHFFFAOYSA-N 440.931 4.164 10 10 IICE CC1(C)CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)CCS1 1289037047 ATYCWGHDFVEKGM-UHFFFAOYSA-N 446.671 4.235 10 10 IICE Cc1ccc(CN(C)c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)o1 1289642739 CQYWAMBFRUYPOP-MRXNPFEDSA-N 433.603 4.349 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@H]2CCC3(CCC3)CO2)NC(=O)OC(C)(C)C)cc1 1293802420 RZRXCVNVYQHDSK-RTWAWAEBSA-N 445.604 4.174 10 10 IICE CN(CC(C)(C)C)c1nnc(C(=O)Nc2ccccn2)n1CCCSc1nccs1 1298222772 WVHJJNKBNPQYRK-UHFFFAOYSA-N 445.618 4.047 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1312028714 XONMRELCHOTSTG-NRFANRHFSA-N 440.588 4.335 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 1312529780 WEWYHIPZQJGMDR-WOJBJXKFSA-N 430.593 4.264 10 10 IICE COC(=O)[C@@H]1CC[C@@H]1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1349819227 FVKRNWMKXDCXPO-DLBZAZTESA-N 427.501 4.494 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C3=C(c4ccccc4)CCCC3)CC2)cc1 1353707603 WDLPENBFIWJQQS-UHFFFAOYSA-N 433.596 4.351 10 10 IICE O=C(COc1cc(Cl)cc(Cl)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1356423117 YDIMYDVXUKGBGY-UHFFFAOYSA-N 448.394 4.221 10 10 IICE O=C(C/C=C/c1ccc(Br)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 1444664779 RGYQQIWYAXLUOU-OWOJBTEDSA-N 443.385 4.378 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccccc3S(=O)(=O)C(F)F)c2C)c1 1462081450 CKAZGQIHTSLDKA-UHFFFAOYSA-N 432.492 4.329 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cccn(Cc3ccccc3)c2=O)c1 1465816904 ISNKLFKYVMJBRP-UHFFFAOYSA-N 425.488 4.369 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1C 1472941234 MSOYRVUAPZWRTF-UHFFFAOYSA-N 426.494 4.276 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3C[C@H](c4ccc(Br)cc4)C3)C2)cc1 1478740084 FSLBVHQTMUMSND-WDSOQIARSA-N 444.373 4.282 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CC4)n3C[C@@H](SC)C(C)(C)C)CC2)cc1F 1518310911 NLMLGOFOXRCFNK-HXUWFJFHSA-N 447.624 4.408 10 10 IICE CN(C)c1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc2n1 1524059044 UTGLGXKFBVSEFW-INIZCTEOSA-N 440.494 4.301 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccn(-c4ccc(Cl)cc4Cl)n3)C2)cc1 1529403989 MENHLFBMSYUBBQ-HNNXBMFYSA-N 445.350 4.444 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(c4ccccc4)CCCCCC3)cc2)CC1 1535156750 NRTUUPXUDYBIRG-UHFFFAOYSA-N 433.596 4.297 10 10 IICE Cc1noc(C(C)C)c1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1538292310 ADFWXRMEOKNPQO-GDNBJRDFSA-N 433.530 4.476 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCOc1ncccc1F 1541325881 OTUIVCZNUMNJQX-UHFFFAOYSA-N 438.551 4.251 10 10 IICE COCc1c(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)sc2cccc(F)c12 1543632617 NVEABQBSBCLTQD-UHFFFAOYSA-N 444.528 4.166 10 10 IICE Cc1ccc(CN2CC[C@@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1556451631 PBGQUWIHNUFVLV-XMMPIXPASA-N 443.547 4.054 10 10 IICE COc1ccc(Br)c2[nH]c(C(=O)NCc3ccc4cccnc4c3O)cc12 1557120319 APKKIBKYVKIGQU-UHFFFAOYSA-N 426.270 4.123 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCc2cccc(Br)c2C)cc1 1565331130 VXOPIGIZTHNNOI-UHFFFAOYSA-N 434.378 4.086 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(C(F)(F)F)c1O 1566154698 GOLLYEGPPQXWQT-LBPRGKRZSA-N 430.373 4.411 10 10 IICE C/C=C/c1ccc(OCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1566356487 GSRDFMPFFMVKCD-GECPCNCSSA-N 444.959 4.247 10 10 IICE COc1ccc(C=O)c(OCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1568141923 IZHBXOPCLDJVAR-MRXNPFEDSA-N 430.932 4.093 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSCc1csc(C)n1 1568378450 FCSCDKDJTLMHOQ-UHFFFAOYSA-N 435.615 4.073 10 10 IICE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1586060256 DQNPGASAWOBSSP-NHCUHLMSSA-N 448.652 4.047 10 10 IICE COCCN(CC1CCN(C)CC1)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1587817342 XPVFHLGHCDHFDZ-UHFFFAOYSA-N 432.008 4.107 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCCN2CCN(c3ccccc3)CC2)c1 1595488959 XBJLATRRNSVGMV-UHFFFAOYSA-N 430.596 4.345 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(-c4ccccc4)c3N)cc2F)C[C@H](C)O1 1596695249 OEJLLZWJTGEWMQ-IRXDYDNUSA-N 434.515 4.014 10 10 IICE Cc1nnc(N2CCO[C@H](c3ccc(F)c(F)c3)C2)n1CCCSc1nccs1 1612611112 MXBWUZBRNDKJDO-KRWDZBQOSA-N 437.541 4.082 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1614116431 IUSLADGXWHQTSO-AZUAARDMSA-N 429.584 4.125 10 10 IICE O=C(COCC1CCCC1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1618369281 TXICLUULFCTEER-UHFFFAOYSA-N 429.318 4.304 10 10 IICE CC(C)(C)OC(=O)N[C@]1(C)CCCC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1625970013 OORTVBVWBPPRTR-HYBUGGRVSA-N 447.645 4.330 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1-n1c(C)cc(C=O)c1C 1628053040 MGRCYXIHQGCXDJ-OAQYLSRUSA-N 449.938 4.404 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1c(C)cc(C)c(Br)c1C 1630486702 OQZMGSDRYVUNDN-UHFFFAOYSA-N 448.357 4.214 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCCC2)[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1643394671 QKHNFFYSUSSVOO-OAQYLSRUSA-N 427.589 4.473 10 10 IICE COc1ccc(N2CCN(Cc3cncc(-c4cc(F)ccc4OC)c3)CC2)cc1F 1644919452 NSDUMULPQRETGA-UHFFFAOYSA-N 425.479 4.366 10 10 IICE Cc1cccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1672133485 UVSUIVDHULFAIO-SFHVURJKSA-N 442.991 4.114 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](Cc3ccccc3)c3ccccn3)C2)cc1 1673825402 AUYDETUOHUODFR-PXDATVDWSA-N 430.552 4.200 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CCC(C)(C)CN1C(=O)OC(C)(C)C 1675208838 XBXKGQIEKQNKFZ-FQEVSTJZSA-N 432.609 4.320 10 10 IICE C[C@@H](NC(=O)N(Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1)c1ccc(N(C)C)cc1 1681778477 BYPVBCQWCUSFCJ-ZPMCFJSWSA-N 440.544 4.237 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4cccc(C(F)(F)F)c4C3)C2)cc1 1683504522 WCQZOCASMAIGOP-MRXNPFEDSA-N 433.474 4.308 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCc1nc(Cc2ccccc2F)no1 1685256888 NSDKXRSLABZQQI-UHFFFAOYSA-N 437.519 4.131 10 10 IICE C[C@@H](CNC(=O)OC(C)(C)C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O 1706829132 RNZBRLJBHOOMIY-KRWDZBQOSA-N 445.608 4.370 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N1CC[C@@H](C)C1 1707304784 FWZYRCCIQMOIDI-CQSZACIVSA-N 443.393 4.305 10 10 IICE CC(C)c1nnc(N2CCC[C@H](C[C@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1723171234 CNTJPRCKAVXMOW-UYAOXDASSA-N 429.584 4.298 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)CCC(F)(F)F 1724236033 PXNDRQDEOPASAN-SFHVURJKSA-N 425.499 4.331 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726968156 RQMJHYUDVOLCIA-WOJBJXKFSA-N 425.621 4.285 10 10 IICE COC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C[C@@H](C)O1 1749544565 UYAFDQWOFJMGJL-KNQAVFIVSA-N 437.588 4.249 10 10 IICE CC(C)c1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCOC[C@H]2C)n1 1868228023 JMCUWKNRVHJTCM-MRXNPFEDSA-N 442.519 4.344 10 10 IICE CC(C)C(=O)Nc1ccc(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1874179258 VNISVWYSCRUZKP-UHFFFAOYSA-N 426.472 4.238 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Cl)cc(Br)c2O)C12CC2 1925568748 MBSJUCZTYMLTOE-CQSZACIVSA-N 431.758 4.440 10 10 IICE O=C(O)CC[C@H](NC(=O)OCc1ccccc1)c1cc(Br)cc(F)c1O 1951722089 AZCPWLBICCDNMW-HNNXBMFYSA-N 426.238 4.126 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)[C@@H]2C[C@@H]21 2057596841 YMZBWWSVDWVNGH-QEJZJMRPSA-N 431.758 4.296 10 10 IICE COc1ccc(CC2=NN3C(=N)C(=Cc4c[nH]c5ccccc45)C(=O)N=C3S2)cc1OC 2296400367 XITAQKVOGXOSPD-UHFFFAOYSA-N 445.504 4.047 10 10 IICE CN1C(=O)C(=C2SC(=S)N(c3cccc(Br)c3)C2=O)c2ccccc21 2296879807 DHVJSDGPISHVGJ-UHFFFAOYSA-N 431.336 4.202 10 10 IICE CC1=NN(c2cccc3ccccc23)C(=O)C1=CNc1ccc(C(=O)N2CCOCC2)cc1 2297109840 CDWRTJHRIIVSQR-UHFFFAOYSA-N 440.503 4.031 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](C(=O)O)c3ccccc3)C2=O)ccc1OC 2314766599 BFJCOHXVCKNPEM-GOSISDBHSA-N 429.519 4.121 10 10 IICE Cc1ccc(CNC(=O)C(C)(C)C(C)(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380749617 QEHZJPNOUYHMQS-UHFFFAOYSA-N 443.382 4.409 10 10 IICE CC[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381147461 RKHAAOMCUZKPEP-CZUORRHYSA-N 441.366 4.115 10 10 IICE COc1ccc(/C=C2\C(=O)N(c3ccc(Br)c(C)c3)C(=O)N=C2O)c(OC)c1 33323229 BOCKDTRKUYBPDS-DHDCSXOGSA-N 445.269 4.281 10 10 IICE Cc1cccc(NC(=O)CCN2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)c1 47152175 SRIOZZNHZACIQA-ATVHPVEESA-N 427.507 4.133 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(C(F)(F)F)cn3)CC2)c(C)n1-c1ccccn1 108137870 CCOGXLVIAVSWFL-UHFFFAOYSA-N 443.473 4.302 10 10 IICE COc1ccc2[nH]cc(C3=CCN(c4cc(C)nc5nc(C(F)(F)F)nn45)CC3)c2c1 520324074 ATURUWGDAVVNNM-UHFFFAOYSA-N 428.418 4.235 10 10 IICE Cc1cc(C(=O)CN(C)C2CCN(CCc3ccccn3)CC2)c(C)n1-c1ccc(F)cc1 750046760 BOQHUBJEZPEYCB-UHFFFAOYSA-N 448.586 4.450 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CCO[C@@H]1c1cnn(-c2ccccc2F)c1 752922815 PEHLNOCLZXFSPH-WIOPSUGQSA-N 448.542 4.396 10 10 IICE CCOC(=O)[C@@H](Cc1ccccn1)NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 760629770 VIVHLFLDANRGKQ-OAQYLSRUSA-N 425.916 4.047 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 768239979 YGDDBXFXZWIXIF-IFMALSPDSA-N 447.595 4.274 10 10 IICE Cc1nc2ccccc2c(C)c1CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768532411 DTCWVQWNUJYWJV-UHFFFAOYSA-N 442.607 4.243 10 10 IICE FC(F)(F)COc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768670975 VBQPNAACGLEQCP-UHFFFAOYSA-N 433.518 4.450 10 10 IICE COC(=O)c1ccc(CNC(=S)Nc2ccc(OC(F)(F)F)cc2)nc1C1CC1 779718725 KBFUOFXLPYMIGD-UHFFFAOYSA-N 425.432 4.131 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)[C@H]2C[C@@H]2C(F)F)sc(C)c1-c1ccccc1 801481065 DOPCWUHILMDNTH-KBPBESRZSA-N 437.464 4.283 10 10 IICE Cc1cc(CCNC(=O)/C=C/c2cc3cnn(C(C)C)c3[nH]c2=O)c(C)n1-c1ccccc1 899596006 VDDMXLIHRRWDRH-ZHACJKMWSA-N 443.551 4.085 10 10 IICE CC[C@H]1CCCC[C@H]1OCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125130942 CNBXAOWWJMKPDY-OXJNMPFZSA-N 428.495 4.144 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@@H]2C(=O)Nc3c(Br)cccc32)cc1 1125235850 WCYYYEAOQXGLBJ-KRWDZBQOSA-N 430.346 4.038 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@H](NC(=O)c2ccccc2)c2ccccc2)cc1 1130544820 VCMVIDBWKFSNIH-VWLOTQADSA-N 445.563 4.151 10 10 IICE Cc1cccc(NC(=O)CN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1C 1136120770 GOQIEGHHFBIJLZ-UHFFFAOYSA-N 431.536 4.163 10 10 IICE CN(c1ccc(CNC(=O)[C@@]23C[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1)C1CCCCC1 1136446246 BAFUQNAWCSSXLE-UQBPGWFLSA-N 427.589 4.329 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c(SC)c3)CC2)cc1F 1137422921 OLLAGFSXIWWEJL-UHFFFAOYSA-N 439.350 4.281 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F 1147838438 WSVJNLLEJYCXIW-IRLDBZIGSA-N 430.951 4.498 10 10 IICE Cc1nc(-c2ccccc2)ncc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348366 PRJPOGAQWWIOET-HXUWFJFHSA-N 436.943 4.205 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(C)c1NC(=O)c1ccncc1 1162108679 SQTMSJILUUCWTI-LJQANCHMSA-N 430.552 4.378 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)Nc1nc(-c2cccs2)cs1 1192014521 SZQZKYRHUNDTQU-MRXNPFEDSA-N 429.567 4.197 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3C[C@H](c4ccccc4)[C@@](F)(CO)C3)c2C)c1 1254073450 IBRCZSBAZSBESX-RSXGOPAZSA-N 435.543 4.412 10 10 IICE CC[C@H](C)CN(CC)c1nnc([C@@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1291755507 YYYQVYZSWKHKAI-SIKLNZKXSA-N 425.621 4.475 10 10 IICE CC[C@](O)(C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1294858229 BLVTZURWPXUHKS-SIKLNZKXSA-N 437.367 4.077 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H]2OCCC[C@H]2C1 1304238207 MHDQHIGZMPFWRY-UNMCSNQZSA-N 425.621 4.295 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H](C)CC3)n2CCCSc2nccs2)n1 1304755597 DIFPAKMMZXBOJR-INIZCTEOSA-N 445.662 4.405 10 10 IICE CO[C@H](c1ccc(F)cc1)[C@@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357613340 YRTQKYOSLABFGC-DWXRJYCRSA-N 437.559 4.439 10 10 IICE CNC(=O)c1cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)ccc1Cl 1357987686 MZYPHWWMSFAKFJ-UHFFFAOYSA-N 425.916 4.180 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1C[C@]1(F)c1ccccc1 1452000442 YJONZUSIVABWIC-XVIVJJLESA-N 446.594 4.483 10 10 IICE COc1ccc(N(Cc2ccc(S(=O)(=O)NC3CC3)cc2)Cc2ccco2)cc1F 1459671034 KBQKVZOBDSWUBK-UHFFFAOYSA-N 430.501 4.075 10 10 IICE CS[C@@H]1CCCC[C@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1461307864 BAYFMIYATYWCNK-ILADNBMGSA-N 438.615 4.207 10 10 IICE C[C@@H](CC(=O)NCc1ccc2c(c1)CCCN2C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1464509969 FDLNHBNLGBDVAR-GHTZIAJQSA-N 429.605 4.359 10 10 IICE CN(c1ccc(CNC(=O)c2cc(C(=O)OC(C)(C)C)nn2C)cc1)C1CCCCC1 1464543255 XAXNNYWTPYNVEX-UHFFFAOYSA-N 426.561 4.074 10 10 IICE COC(=O)COc1ccc([C@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1466726667 IHAQSMOZWMNHSD-KRWDZBQOSA-N 436.508 4.146 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCC[C@H](C(F)F)C1 1510676322 XJVHEVHMSHRPQR-IBGZPJMESA-N 426.515 4.244 10 10 IICE COc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)ccc1OCc1ccccc1 1539234387 CQAFLVYCKBQZKL-DEOSSOPVSA-N 447.579 4.373 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc(C)n(C4CCCCC4)c3C)CC2)cc1 1542432302 YZQVLJOFODWLHG-UHFFFAOYSA-N 438.616 4.171 10 10 IICE COc1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1OC(C)C 1545632806 WKFSTYUYIGAYKK-SFHVURJKSA-N 432.948 4.236 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1548039079 XYHFBQBLRIELEH-QHAWAJNXSA-N 445.583 4.023 10 10 IICE CCOCCC1(Cn2c(C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCCC1 1548227424 NHDQILGUGSWQSE-UHFFFAOYSA-N 441.620 4.047 10 10 IICE CCOc1cc(C(=O)NCc2c(O)cccc2F)ccc1OCCOc1ccccc1 1596912716 QXPQSQPRSIQUCC-UHFFFAOYSA-N 425.456 4.318 10 10 IICE COC(=O)C[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1cccc(C)c1 1597737337 FFIAXLOPTWVPOG-HSZRJFAPSA-N 447.579 4.137 10 10 IICE O=C(NCC1(C(=O)NCCCSc2nccs2)CCCC1)OCc1ccccc1 1616242493 WAUDWUKNXQJHCG-UHFFFAOYSA-N 433.599 4.228 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)[C@@H]3CN(Cc4ccccc4)CCO3)c2C)cc1 1618337395 ZBVJZATZJCZZQB-IBVKSMDESA-N 447.579 4.122 10 10 IICE CCOC(=O)COc1cccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1624424789 BMJDZNWYIYAFJR-UHFFFAOYSA-N 434.492 4.409 10 10 IICE CCOc1ccc(N(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1625553314 GIYUKMIWFITBBV-RGEXLXHISA-N 444.553 4.479 10 10 IICE CCN1CCc2nc3ccccc3c(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)c2C1 1630179676 HLFACEXJYZUIKR-LJQANCHMSA-N 430.596 4.348 10 10 IICE C[C@@H]1C[C@@H](C)N(C(=O)c2cc3cc(O)c(O)cc3s2)C[C@@H]1CNC(=O)OC(C)(C)C 1639532749 ULFCAOFSEGIUPM-NFAWXSAZSA-N 434.558 4.324 10 10 IICE C[C@H](NC(=O)c1cccn1-c1cccc(I)c1)c1ccccc1O 1642827237 CZKAUNQUVBRGKJ-ZDUSSCGKSA-N 432.261 4.279 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3csc(NC4(C)CCCC4)n3)C2)cc1 1643346996 RZXMPXUXENKDNQ-QGZVFWFLSA-N 428.602 4.082 10 10 IICE C[C@H]1[C@H](c2ccc(Br)cc2)OCCN1Cc1ccc(N2CCOCC2)cc1 1654181334 YUIYTGAXHDLJNM-HTAPYJJXSA-N 431.374 4.248 10 10 IICE COc1cc(N2CCN(C(=O)NCc3ccc(C(C)(C)C)s3)CC2)cc(OC)c1OC 1675784376 RUSOQFPFXJXKNQ-UHFFFAOYSA-N 447.601 4.103 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC(C)(C)c3ccccc3Br)C2)cc1 1682646592 UJFKZJFTZSJFSQ-OAHLLOKOSA-N 432.362 4.271 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3cccc(C(F)(F)F)c3C2)N(C)C)cc1 1687806273 BRFJLFZOWAAGDA-OAQYLSRUSA-N 434.506 4.142 10 10 IICE CCC[C@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1709480661 OMOYIDDHDDUOKG-IBGZPJMESA-N 449.647 4.443 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1Cc1ccc2c(c1)CCCN2C 1726884018 ZYDQMGYPUJBGEV-INIZCTEOSA-N 442.011 4.246 10 10 IICE CCN(CC)C1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1728396638 ZVTWAYUBHNEGLN-UHFFFAOYSA-N 430.616 4.140 10 10 IICE CO[C@]1(C)CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1748477242 NZICZTZAMNFAFE-RUZDIDTESA-N 425.621 4.439 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1763139795 DWLRTPYBUDLZKK-GOSISDBHSA-N 445.702 4.410 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](C)[C@@H](O)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1763825438 ZFEQZORHWMIAPC-VIZSFHNOSA-N 425.621 4.283 10 10 IICE CCC[C@@H](Cn1c([C@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1763859479 XFSTXCGYHBRMSC-KNQAVFIVSA-N 429.609 4.332 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2cc(C)on2)cc1 1764939423 UKJUGOPILKLCDE-JOCHJYFZSA-N 438.576 4.347 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccccc3OC)n2CCCSc2nccs2)CCO1 1765251269 BQLYZGKLIAERLH-INIZCTEOSA-N 445.614 4.208 10 10 IICE O=C1/C(=C\c2cccc([N+](=O)[O-])c2)SC(=S)N1C1CCN(Cc2ccccc2)CC1 1858593898 CJHWSMYCIQINGY-XSFVSMFZSA-N 439.562 4.461 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nc(=Nc3cc(Cl)ccc3O)nc(N3C[C@H](C)C[C@@H](C)C3)[nH]2)C1 1871732291 AYPBGQYPPFTKCN-QBPKDAKJSA-N 445.011 4.361 10 10 IICE CCOC(=O)c1c(C)nn([C@H](c2ccc(C)cc2O)C(C)C)c1I 2079116013 KQXYBYGOAUBDFG-INIZCTEOSA-N 442.297 4.232 10 10 IICE CCOC(=O)c1c(C(F)F)nn([C@@H](c2ccc(OC)cc2O)C2CC2)c1Br 2079872593 CCLVMCROECDFMM-OAHLLOKOSA-N 445.260 4.474 10 10 IICE CCc1nn([C@@H](c2ccc(OC)cc2O)C(C)(C)C)c(Br)c1C(=O)OC 2079977559 NXYKKHDLDWFIEE-INIZCTEOSA-N 425.323 4.344 10 10 IICE C[C@@H](NCc1c(O)cccc1Br)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116239058 PHQCMFTYDMQSAA-SJKOYZFVSA-N 425.323 4.492 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2c(O)cccc2Br)C12CCC2 2120838351 YWUGRTQKVZCPRE-AWEZNQCLSA-N 425.367 4.424 10 10 IICE NCc1ccc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(Br)c1 2153349168 RPNDOAXXHVLBLA-ZRZAMGCNSA-N 426.402 4.400 10 10 IICE CCOc1cc(C=C2SC(NC(C)=O)=NC2=O)ccc1OCc1cccc(Cl)c1 2293117095 YFYGUQPHEGPDPG-UHFFFAOYSA-N 430.913 4.424 10 10 IICE CC1=NN2C(=N)C(=Cc3cn(Cc4ccc5c(c4)OCO5)c4ccccc34)C(=O)N=C2S1 2296397876 DMORCOAEZZMHMO-UHFFFAOYSA-N 443.488 4.057 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 2296807941 BKRRYNQFMLLPRD-UHFFFAOYSA-N 439.518 4.381 10 10 IICE CC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)SC1=S 2323813820 GCRWUUDAJBPTQK-MRXNPFEDSA-N 443.546 4.339 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352675434 GPVRGWGQPLIABY-VGWMRTNUSA-N 425.367 4.245 10 10 IICE O=C(NC[C@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476241 HJGRQAURCQFWEW-SCYDXJQRSA-N 435.480 4.036 10 10 IICE Cc1cc(OC[C@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)ccc1Cl 40317324 UNVRPWKBZLSYAO-GGAORHGYSA-N 432.992 4.135 10 10 IICE CC(=O)N1N=C(c2cccc(Br)c2)O[C@H]1c1cc(Br)ccc1O 64819685 FEXBYCKGYUQSSP-INIZCTEOSA-N 440.091 4.156 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N(CCCCCC(=O)N2CCOCC2)C1=O 211906472 OGRWYVPGNJOZLY-UJRWZAMLSA-N 444.622 4.253 10 10 IICE COc1ccc([C@@H]2Nc3ccc(C(=O)NC[C@@H]4CCCO4)cc3[C@@H]3C=CC[C@@H]32)cc1OC 226875187 WZSJEHQOMYRBNY-ZDQHKECQSA-N 434.536 4.439 10 10 IICE Cc1cc(C(=O)COC(=O)c2cnc(-c3cnn(C)c3)s2)c(C)n1-c1ccc(F)cc1 732687796 YQZNENGBQBKVAJ-UHFFFAOYSA-N 438.484 4.130 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742800966 NSQITLGMUAMJKV-FYINFDKHSA-N 443.494 4.281 10 10 IICE CC1(C)CCC(=CC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 751683152 GLGVPYVXGLDMGB-UHFFFAOYSA-N 437.563 4.085 10 10 IICE O=C(CCc1cc2ccccc2nc1O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 767794385 JMCNXUWXJVZYHM-HXUWFJFHSA-N 439.943 4.013 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C=C/c2cncc(C)c2)cc1 772687744 IUQYRSPSQLAASU-JLHYYAGUSA-N 429.520 4.047 10 10 IICE O=C1CCc2cc(-c3csc(NS(=O)(=O)c4c(F)cccc4Cl)n3)ccc2N1 780702716 CXQGFKKYWDJROO-UHFFFAOYSA-N 437.905 4.288 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(Br)c(OC(F)(F)F)c1 800880840 KYSXHAXTSVIFOI-UHFFFAOYSA-N 445.235 4.437 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)s1 810028793 RLCIIQKFVDQPMX-LJQANCHMSA-N 431.602 4.220 10 10 IICE CCOc1cccc(/C=C/C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1125196174 CQLMEJKAVZRFOP-RMKNXTFCSA-N 434.458 4.270 10 10 IICE CCOc1ccc([C@]2(C(=O)N3CCN(c4ccc(OC)cc4)CC3)CC2(Cl)Cl)cc1 1127276672 LUTKPCBXHNSKRX-QFIPXVFZSA-N 449.378 4.258 10 10 IICE COc1ccccc1N1CC[C@H](NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1=O 1137511573 KDPITRXDQIIOIK-FQEVSTJZSA-N 437.927 4.291 10 10 IICE COc1ccc(C[C@H](C)CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1153485234 FRFLVYYWFPYUFG-SFHVURJKSA-N 448.563 4.461 10 10 IICE Cc1cc(C(=O)N2NC(=O)C[C@H]2c2ccccc2)c(C)n1-c1ccc(Br)cc1 1160290691 KPWPVONSBYTVAC-FQEVSTJZSA-N 438.325 4.475 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O 1162115309 SIZAGUFUMVEDMP-OAHLLOKOSA-N 446.473 4.332 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCC[C@H]1CCC2(CCOCC2)CO1 1248646135 OZJVSFGGPCYUDN-HSZRJFAPSA-N 429.605 4.184 10 10 IICE C[C@@H]1COCC[C@H]1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1291300013 HPSCJGBMWJBSCX-CTNGQTDRSA-N 425.621 4.485 10 10 IICE CCC[C@@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1cccc(Cl)c1 1292281714 HFWZGMGRPYTQNE-HSZRJFAPSA-N 429.992 4.171 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1sc2nc(C)nc(N)c2c1C 1294685655 QZBIGLDRDAVRTG-UHFFFAOYSA-N 435.347 4.021 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)Cc2ccsc2)cc1 1295414392 GYJHABQEAUHSSN-UHFFFAOYSA-N 433.585 4.328 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1CCCCC1 1297241783 CILIPYPIYUEGTP-UHFFFAOYSA-N 427.593 4.120 10 10 IICE Cc1cc(C(=O)N(C)C(C)(C)CN2CCOCC2)c(C)n1-c1cccc(Br)c1 1299255438 XPLHILKGHMDCFK-UHFFFAOYSA-N 448.405 4.039 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@@H]2CCOC2)n1CCCC(F)(F)F 1314735892 DLRUVKIIKIRQLV-GOSISDBHSA-N 437.510 4.361 10 10 IICE Cc1cc(CCNC(=O)N2CCn3c(nnc3C3CCCC3)C2)c(C)n1-c1ccccc1 1352771299 FDDSJQMVWRTBEO-UHFFFAOYSA-N 432.572 4.111 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C3(c4ccccc4Cl)CCC3)CC2)cc1 1356063806 DIMSNBRIUSYLQV-UHFFFAOYSA-N 442.003 4.099 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1nc(-c2ccccn2)cs1 1443443602 ATHGIZWEFNWCQI-UHFFFAOYSA-N 430.533 4.398 10 10 IICE O=C(NCc1cccc(Br)c1O)C(F)(F)c1ccccc1Br 1448961058 HFPRBNAJRHHTOB-UHFFFAOYSA-N 435.062 4.325 10 10 IICE Cc1ccn(-c2ccccc2CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n1 1466004906 CPFLUKLEECCORI-UHFFFAOYSA-N 426.520 4.260 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)c(OC)c1 1470857860 HCLNWFQOKSXOPE-UHFFFAOYSA-N 433.552 4.382 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3c3ccccc3Cl)cc2)CC1 1479343764 LHOPVODRGMPJDN-JOCHJYFZSA-N 440.975 4.088 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1515524489 FDIZFBCCUCWUIS-QHCPKHFHSA-N 434.588 4.096 10 10 IICE CCc1cc2c(CC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)csc2s1 1524851271 LAWSBWDPFRKXIZ-UHFFFAOYSA-N 436.549 4.499 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc4nc(C(F)F)[nH]c34)cc2F)C[C@H](C)O1 1543233713 QQPDAZCRBFXIHS-STQMWFEESA-N 432.446 4.183 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)CCCC1 1545584956 LBTKZVOXBZJYDX-JOCHJYFZSA-N 446.469 4.397 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H]2CCCO2)c(C)n1-c1cccc(Br)c1 1558606726 DHFRAUFUIRAAMP-WOJBJXKFSA-N 447.373 4.267 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc([C@@H]4CCCN(C)C4)c3)cc2F)C[C@@H](C)O1 1558915501 PXKFZHZELYDABE-DNVFCKCGSA-N 439.575 4.179 10 10 IICE COc1cc2nc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)[nH]c2cc1OC 1565694138 BVZZUEDUJHEJAT-UHFFFAOYSA-N 432.480 4.361 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2c(Cl)ccc(I)c2F)c1 1566374270 BEJWMMSWXCSVSC-MRVPVSSYSA-N 449.647 4.289 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)Cc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1 1566374932 ZCTWZCPSRXJNQK-INIZCTEOSA-N 440.540 4.114 10 10 IICE Cc1cc(C)nc(-n2nc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)cc2C)n1 1583700487 STDZIQKHGAXKPL-UHFFFAOYSA-N 432.572 4.286 10 10 IICE Cc1cc(C(=O)NCc2cccc(N(C)C)c2)c(C)n1-c1ccc(Br)cn1 1583985605 VGGXEXUVMKKMRF-UHFFFAOYSA-N 427.346 4.248 10 10 IICE CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1584444008 BXMAKGGPLXIENP-MRXNPFEDSA-N 429.542 4.362 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)c2cccc(O)c2)NC(=O)OC(C)(C)C)cc1 1586620544 YZHAKBMSWUQZDF-OAQYLSRUSA-N 441.572 4.118 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@H]2[C@H]2CCCCC2=O)c(C)n1-c1ccc(Cl)cc1 1597142203 QSYDJILKTAUECO-YADHBBJMSA-N 428.960 4.277 10 10 IICE C/C=C\C[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C(=O)OCC 1611354222 RTJIPZDOJRHWGJ-LZCIBIBXSA-N 433.346 4.484 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3cccs3)c3ccc(F)cc3)nc12 1616287110 GZANYOMKYRJDBR-UHFFFAOYSA-N 426.473 4.019 10 10 IICE C=CC(=O)N1CCC(C(=O)NCc2cc(Cl)cc(Cl)c2O)(c2ccccc2)CC1 1625684541 UVLWQLQLXFGKIR-UHFFFAOYSA-N 433.335 4.062 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)cc1 1627984398 QJPQCBQFKNYTMH-UHFFFAOYSA-N 449.517 4.371 10 10 IICE COc1cccc(OC)c1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1628839336 QTPGDUCFGVCLNY-UHFFFAOYSA-N 444.329 4.199 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)c1ccccc1 1633061433 GMGMEBPEBXBEHT-AREMUKBSSA-N 432.520 4.157 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C\C(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)C1 1633402155 UCHLJLXMIIWLRZ-GKUQOKNUSA-N 429.517 4.467 10 10 IICE C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635992305 CALBDSWDEDRZPO-YJBOKZPZSA-N 433.474 4.028 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccccc2CN2CCC(O)CC2)cc1 1637723203 DHAVOZXKSXJUCO-UHFFFAOYSA-N 445.563 4.045 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)NCc2cccc(Br)c2O)C(C)(C)C1(C)C 1640084387 UJAJGCPICNDQTF-UHFFFAOYSA-N 426.351 4.165 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCCCC[C@H]3c3ccc(Cl)cc3)nc12 1653588175 HIBPNBXHDPYUOI-AZUAARDMSA-N 442.947 4.471 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1Cc2ccccc2N(C(=O)OC(C)(C)C)C1 1683756821 MOPNSIYOTPSCOP-FQEVSTJZSA-N 438.572 4.260 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H](CCc3ccccc3)c3ccccn3)cc2)CC1 1684703638 YPFYJGNHKXIXJC-SANMLTNESA-N 443.595 4.007 10 10 IICE CCN(Cc1cccc(Br)c1)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1687022418 ANEUSUABPGANIP-GOSISDBHSA-N 432.362 4.268 10 10 IICE CC(C)C(C)(C)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1691533403 QKJNCEYNUUTRSF-UHFFFAOYSA-N 448.615 4.495 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CCN1CCCC(C)(C)C1 1729421073 YOVPTZZKJKTKEJ-UHFFFAOYSA-N 425.621 4.475 10 10 IICE COc1ccc(OCc2nnc(N3CCCC3)n2CCCSc2nccs2)cc1 1730198580 PKZAFZNGVUWSCS-UHFFFAOYSA-N 431.587 4.105 10 10 IICE COC[C@@H]1CCCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1749476363 RCVUZWITRAILNS-KNQAVFIVSA-N 445.583 4.026 10 10 IICE Cc1occc1CN(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)c(F)c1 1751358035 ITHFCRSJSGULBC-UHFFFAOYSA-N 434.519 4.055 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](n3cc(C)cn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752755197 GVHDDBVWRZLNHL-AZUAARDMSA-N 439.583 4.391 10 10 IICE Cc1cscc1Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1762244652 OJJTZVADYKKKLE-UHFFFAOYSA-N 439.629 4.467 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1763242619 QJMGWISCEWCZSX-UGKGYDQZSA-N 425.621 4.376 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)cc1 1766809129 QFHSYHWJSWFSNS-LJQANCHMSA-N 431.650 4.254 10 10 IICE CCc1sc(NS(=O)(=O)c2ccc(OC)cc2OC)nc1-c1ccc(OC)cc1 1858034367 NWCGREBMRMTIFH-UHFFFAOYSA-N 434.539 4.199 10 10 IICE Cc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CCn2c-3nc3ccccc3c2=O)cc1 1860344937 IPFKDTMLYXUOGB-UHFFFAOYSA-N 448.526 4.199 10 10 IICE CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 1860568541 CIGNHWFLRJIJGO-UHFFFAOYSA-N 443.459 4.456 10 10 IICE CCCc1nc(N(C)Cc2ccccc2)cc(N2CCN(c3ccc(OC)cc3)CC2)n1 1867974850 ANVLEMYFVNYQHK-UHFFFAOYSA-N 431.584 4.401 10 10 IICE COc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(CN3CCN(C)CC3)cc2)c1C 1874165895 PKUGIWHKDMMRQW-UHFFFAOYSA-N 432.568 4.102 10 10 IICE CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1CNCc1cc(Br)cc(F)c1O 1965970103 IMCWWGMDLBBAKE-AWEZNQCLSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)N2CCC[C@@H]2CN=[N+]=[N-])C1 2060638749 AMIXSIAQKXPPCH-AUSIDOKSSA-N 443.548 4.132 10 10 IICE COC(=O)c1c(C2CCC2)nn([C@@H](C)c2ccc(C)cc2O)c1I 2079004259 OGQPXMKCNJBKQL-NSHDSACASA-N 440.281 4.165 10 10 IICE CC(C)(C)OC(=O)N1C[C@]2(F)CCC[C@@]2(NCc2cc(Br)ccc2O)C1 2126055415 LWMCVAYTUJFCHQ-RTBURBONSA-N 429.330 4.126 10 10 IICE COc1ccc2ccc(OC)c(C=C3C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)c2c1 2294094911 DJXHEXNHPGMIBJ-UHFFFAOYSA-N 436.851 4.177 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1cn(Cc2ccc(F)cc2)c2ccccc12 2296321180 OLDJNUNUBFGOSR-UHFFFAOYSA-N 443.434 4.084 10 10 IICE COc1ccc(C(=O)Oc2c(Cl)cc(C=C3SC(=S)NC3=O)cc2OC)cc1 2297306912 BGUCGBFDLSIEMA-UHFFFAOYSA-N 435.910 4.065 10 10 IICE CCCN1N=C(C(F)(F)F)C(=Cc2ccc(OC(=O)c3ccccc3)c(OC)c2)C1=O 2332134061 FYYBXBHPPKJFNA-UHFFFAOYSA-N 432.398 4.468 10 10 IICE CC[C@@H]1[C@H](C(=O)NCc2ccc(C)c(Br)c2O)CCN1C(=O)OC(C)(C)C 2381139925 CNOPWUGHHDNGTG-HUUCEWRRSA-N 441.366 4.115 10 10 IICE COc1cc([C@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@@H]32)ccc1O 14459036 VYITUVMZDWJWNS-AXHZCLLHSA-N 440.565 4.402 10 10 IICE COc1ccc(OC)c(/C=C2\C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)c1 33406224 VYBUSGBNBBPGCO-QNGOZBTKSA-N 429.432 4.447 10 10 IICE O=C(O)c1cc(/C=C2/C(=O)N(c3ccccc3)C(=O)N=C2O)ccc1OCc1ccccc1 59942158 DZODLOXSIBLTJD-XSFVSMFZSA-N 442.427 4.471 10 10 IICE CCCCCCOc1ccc(-c2nc3sc(=Cc4ccc(N(C)C)cc4)c(=O)n3n2)cc1 254732960 NKWWLVJFXDPHFC-UHFFFAOYSA-N 448.592 4.391 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCCC3)cs1 727241995 QAPMZANJGSRQPR-UHFFFAOYSA-N 446.550 4.486 10 10 IICE COc1ccc([C@@H]2CCCCCN2C(=O)CN(C)c2cc(OC)c(OC)c(OC)c2)cc1 741794879 DEVOITSBMAWEHC-NRFANRHFSA-N 442.556 4.301 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(c3ccc(F)cc3)CC2)NC(=O)OC(C)(C)C)cc1 742750526 DIKHDNJWEIXSDL-OAQYLSRUSA-N 441.547 4.306 10 10 IICE CC[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccc(OC)c1 765283238 YAWVZBAJWAWXSC-QHCPKHFHSA-N 435.547 4.192 10 10 IICE COCC[C@H]1CCCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 768386342 ZNTVFGGVTLMLJB-QZTJIDSGSA-N 425.520 4.105 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H]1CCCC(F)(F)C1 769338381 QZTPPCARACPWEJ-LQELWAHVSA-N 430.567 4.424 10 10 IICE CCOC(=O)c1csc(CCNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 787460225 FEZSFQBUQLDZGS-UHFFFAOYSA-N 445.972 4.282 10 10 IICE O=S(=O)(Cc1cc(Cl)cc(Cl)c1)NCc1cc(Br)ccc1O 796191449 UPHCXNCLBTVEAF-UHFFFAOYSA-N 425.131 4.081 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CO[C@H]3CCCc4ccccc43)cc2F)C[C@@H](C)O1 797436810 PHRYRZBYVKDTDJ-RHGYRFJNSA-N 426.532 4.150 10 10 IICE O=C(NCc1ccc(COCC(F)(F)F)cc1)NCc1cc(Br)ccc1O 804882592 MQXVBFGKPJGBHD-UHFFFAOYSA-N 447.251 4.233 10 10 IICE COc1ccc(Nc2ccccc2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 919971750 WCOQRORWSKRWEH-UHFFFAOYSA-N 449.526 4.469 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CC(F)(F)CNC(=O)OC(C)(C)C 1135964596 HNSZOTJFHCDXTG-UHFFFAOYSA-N 425.520 4.185 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OC)cc(Br)c2OC)cc1F 1136729453 BKMVBRDTVYNDHF-UHFFFAOYSA-N 439.325 4.382 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCCN(Cc2ccccc2)C1 1137438611 OYEAVEGXIWOVKG-REWPJTCUSA-N 442.003 4.038 10 10 IICE Cc1nc(SC(F)(F)F)sc1CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1158716320 AMDLKCPYYDFAGI-OAHLLOKOSA-N 446.564 4.091 10 10 IICE CCCS(=O)(=O)Nc1ccccc1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1170857682 JSZNYUDABMXULY-UHFFFAOYSA-N 439.581 4.484 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(C)(c4ccc(Cl)cc4)CC3)cc2)CC1 1246305712 YZIVJVFAJPSVHU-UHFFFAOYSA-N 441.019 4.355 10 10 IICE COC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)C)C1 1301296393 LEFBVRRROGQPDL-NRFANRHFSA-N 437.588 4.250 10 10 IICE CC(C)Cc1nnc(N2CCOC[C@H](C3CCC3)C2)n1CCCSc1nccs1 1302981792 MXTLDCJCKYGANY-GOSISDBHSA-N 435.663 4.368 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1304885427 YAEBIGUXEUPXDT-UHFFFAOYSA-N 428.556 4.361 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cc(C)cc(C)c1 1307535171 LKVYDAZOGLWKBO-BGYRXZFFSA-N 427.564 4.199 10 10 IICE C[C@H](CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1313356970 VZDWUUQFRQUDTC-IERDGZPVSA-N 447.421 4.221 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)C[C@H]2CCCO2)cc1 1313678117 AOLKNRNOHIEWTO-FGZHOGPDSA-N 427.593 4.029 10 10 IICE Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NCc1ccc2c(c1)CCCN2C 1442387512 QPDZNLRUDLNEPY-UHFFFAOYSA-N 439.357 4.256 10 10 IICE COc1cccc(F)c1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1456472939 ILGOTTOZSDOAJB-UHFFFAOYSA-N 432.293 4.329 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)N2CCOc3cc(N(C)C)ccc32)c1 1456881879 LFFMWOHMVWNGNG-UHFFFAOYSA-N 442.409 4.080 10 10 IICE COc1ccc(N2CCN(Cc3cc(Cl)cc(Br)c3)CC2)c(OC)c1 1473731985 LFYWYATVVMAYHS-UHFFFAOYSA-N 425.754 4.442 10 10 IICE Cc1ccc(C(C)(C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1515146216 JIFLJWFGTNZXDU-LDADJPATSA-N 443.569 4.172 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(C)(C)n2cc(NC(=O)OC(C)(C)C)cn2)cc1 1516598639 DVIQRZZUSYGCDK-UHFFFAOYSA-N 429.565 4.128 10 10 IICE O=C(CCCc1ccc(Br)cc1)NCc1ccc(N2CCOCC2)c(F)c1 1527481351 JZJGQBHJRZPTGT-UHFFFAOYSA-N 435.337 4.064 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccnc(Oc3ccc(F)cc3F)c2)N(C)C)cc1 1539704551 BORKXHQSBOXVNE-NRFANRHFSA-N 440.494 4.251 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccccc3N3CCN(C)CC3)cc2Cl)C1 1539913407 RWESOAJFHLEOCM-LJQANCHMSA-N 441.019 4.258 10 10 IICE Cc1cccc(C(=O)N2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1540669028 IWHVVGQCRQSLDZ-UHFFFAOYSA-N 429.564 4.320 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(Cc2ccc(C(=O)NC3CC3)cc2)Cc2ccco2)cc1 1540735127 JHBDCFMUXGAGNX-UHFFFAOYSA-N 445.479 4.177 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)C[C@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1542182221 BLLUFBNIPOWDQQ-OALUTQOASA-N 448.615 4.360 10 10 IICE CC[C@@H](C)c1nc(C)c(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)n1 1542490210 HOALLWSVNKWETG-JPYJTQIMSA-N 438.616 4.423 10 10 IICE CC[C@@H](Cn1c(C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)NC(=O)OC(C)(C)C 1545954761 KEECDNQNUGONRR-FQEVSTJZSA-N 442.608 4.126 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1C[C@@H]1CCN(CC(F)(F)F)C1 1554175896 ZUKONKMZVVOHSP-MRXNPFEDSA-N 437.510 4.162 10 10 IICE CN(C[C@H]1CCCO1)c1nnc(Cc2ccccc2F)n1CCCSc1nccs1 1554322491 XSGXSNOYVGRZHI-QGZVFWFLSA-N 447.605 4.262 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(-n3ccccc3=O)cc2F)c1 1557465788 JMSHUHVORRDIMA-UHFFFAOYSA-N 429.451 4.449 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC[C@H](C)N(C)C(=O)OC(C)(C)C 1565692316 ARGDKTKLFCKCLL-INIZCTEOSA-N 427.545 4.282 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@H](C(=O)OC(C)(C)C)CC[C@H]2C)cc1 1570475132 GUUPHJVIJRTQHH-DYESRHJHSA-N 438.568 4.418 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1585665059 LFJKYZUQBZJQFM-PPJWLVRDSA-N 435.612 4.186 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)C2)cc1 1585665970 XXZIOLLFHCJZCG-WIYYLYMNSA-N 445.604 4.063 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccc(F)cc2)no1 1595584145 MMWFXERUHYDUAM-SFHVURJKSA-N 429.879 4.234 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613195446 AUUBPKMLJFLKGS-XUVXKRRUSA-N 425.621 4.141 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(F)(F)c2ccccc2Br)N(C)C)cc1 1616858989 XSRVCZFUGNVFOT-SFHVURJKSA-N 440.332 4.026 10 10 IICE O=C(Cc1nc(C2CCCC2)cs1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634632 DOEYUUHOXGANIJ-SFHVURJKSA-N 434.005 4.483 10 10 IICE CCCOc1ccc(C(=O)CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1623164412 ATJZODWOCODPRX-UHFFFAOYSA-N 434.536 4.317 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nn(-c2ccccc2F)c2c1CCCC2 1623363378 GENBPOXMAFAPTQ-UHFFFAOYSA-N 444.304 4.288 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCC(=O)c1ccc2ccccc2c1 1623928342 LROVJIQWWBORPA-UHFFFAOYSA-N 439.895 4.364 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(C(=O)N3CCCCC3)c2)cc1 1626105264 ACIJFHJLRCMXCC-VWLOTQADSA-N 449.595 4.200 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)c1ccccc1Br 1626429760 ABGVXUJTHNDXAL-OAQYLSRUSA-N 441.325 4.133 10 10 IICE COC1CCC(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CC1 1627271932 MRBQCPKBCCEBDE-UHFFFAOYSA-N 429.318 4.303 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2coc3cc(O)ccc23)NC(=O)OC(C)(C)C)cc1 1629685619 PSBNJTLHICBYGH-HXUWFJFHSA-N 439.512 4.200 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 1633595278 PSHAHCWSLLAKGM-UHFFFAOYSA-N 441.281 4.043 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc(-c2ccc(C)cc2F)nc1C 1643245502 QHOQMNMJJLAJGC-UHFFFAOYSA-N 442.512 4.477 10 10 IICE Cc1cc(C(=O)CSc2ccc3c(c2)CCC3)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1651730498 XOOWFZOSIICFSW-UHFFFAOYSA-N 440.590 4.205 10 10 IICE CN(C)c1ccc([C@@H](CNc2ncnc(C(F)(F)F)c2Br)N(C)C)cc1 1652309597 CHABUJLUAOGTDM-CYBMUJFWSA-N 432.288 4.039 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4cccc(F)c4F)CC3)C2)cc1 1673823423 SKEKZWGRTBLCHZ-LJQANCHMSA-N 443.538 4.464 10 10 IICE Cc1cc(CNC(=O)N(C)C[C@@H]2CN(c3ccccc3)C(=O)O2)c(C)n1-c1ccccc1 1683307618 LXEZRVNFBYVQDS-HSZRJFAPSA-N 432.524 4.261 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCn3c(cc4c(Cl)cccc43)C2)N(C)C)cc1 1684607448 QAXCLCHIHIAEKF-HSZRJFAPSA-N 439.991 4.189 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@@H]1CNC(=O)OC(C)(C)C 1686826512 JZGXWIVDUSRYAQ-WIYYLYMNSA-N 432.609 4.081 10 10 IICE CC(C)c1ncc(CN(C)c2nnc(C3CC3)n2CCCSc2nccs2)cn1 1723133001 INCVHVIZLPBVMS-UHFFFAOYSA-N 429.619 4.344 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCCC2)nnc1N(C)CC1COC(C)(C)OC1 1724236018 PSQFPPNPWNJBHI-UHFFFAOYSA-N 441.620 4.194 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCN1CCCCC1 1747755051 YRPXXUHSRONOPC-IFMALSPDSA-N 441.620 4.025 10 10 IICE CO[C@@H]1CCCN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C1 1749180609 ZRFCUDQUVVGOKY-GOSISDBHSA-N 447.605 4.262 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)CCc2nccs2)cc1 1764936424 ZBIPENARPNNBLK-UHFFFAOYSA-N 449.628 4.314 10 10 IICE CCN1C(=O)C(Nc2cccc(NC(C)=O)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422832 RJNWJKJCQWWFRH-UHFFFAOYSA-N 442.519 4.264 10 10 IICE CN[C@H](c1ccccc1O)C1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1 1942397252 DFNINXQSLFTERE-JOCHJYFZSA-N 425.573 4.212 10 10 IICE C[C@@H](NCc1cccc(Br)c1O)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116250438 GXUXWECRDQAGHZ-MLGOLLRUSA-N 425.323 4.492 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)c1cc(Br)ccc1I 2225801246 TYAVGHZLQXCXPK-QWRGUYRKSA-N 435.063 4.015 10 10 IICE Cc1cccc(N2C(=O)C(=C3C(=O)Nc4ccc(Br)cc43)SC2=S)c1 2293544038 WYXJHSXAGGNPIL-UHFFFAOYSA-N 431.336 4.486 10 10 IICE CCOC(=O)c1ccc(NCN2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)cc1 2313501866 LFZLCCNDTCXRGN-UHFFFAOYSA-N 443.506 4.042 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccc(Cl)cc3)C2=O)c(C(=O)O)c1OC 2314929713 QRHNSJDVCNNTOT-UHFFFAOYSA-N 435.910 4.461 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CCCN(Cc3ccccc3)C2)c(O)c1Br 2380770135 YWUBXHDTGQTMIN-IBGZPJMESA-N 431.374 4.334 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C)c(O)c1Br 2381146458 LSXFHZNKHBMUOB-KBPBESRZSA-N 441.366 4.115 10 10 IICE CN(C)c1ccc(CN2Cc3nc[nH]c3C[C@H]2c2nc(-c3ccc(Cl)cc3)no2)cc1 12490047 CTWMMFHPMGULKQ-NRFANRHFSA-N 434.931 4.479 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(Cc3ccc(C)cc3)C2=O)ccc1OCC(=O)O 210187991 MSOKJHDGKOVRKE-YBFXNURJSA-N 443.546 4.259 10 10 IICE C[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 732040094 RBCBGJVKIJSVGQ-ASSNKEHSSA-N 426.428 4.034 10 10 IICE C[C@@H]1Cc2ccccc2[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732241461 JQWLOBZCAQHXPS-VFNWGFHPSA-N 433.474 4.275 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741184261 BWUCKGGPNLYYIV-WOJBJXKFSA-N 434.458 4.483 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)c3nc(C)ncc3Cl)c2C)cc1 745379740 VEYPRTXUCZLDOJ-UHFFFAOYSA-N 427.888 4.284 10 10 IICE COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)NCCCSc1nccs1 758585037 DWSRNTVRUXYHET-UHFFFAOYSA-N 448.614 4.472 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 779533978 LRUAYFDXPUBOPH-NCUBBLFSSA-N 425.529 4.413 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NS(=O)(=O)c2cccc3ccccc23)c1 788090508 OOXUDBNGSPLHGL-UHFFFAOYSA-N 445.544 4.133 10 10 IICE Cc1cc(C(=O)CN(C)Cc2nncn2C(C)C)c(C)n1-c1ccc(OC(F)(F)F)cc1 795629684 GMFPNVRVYOEIGZ-UHFFFAOYSA-N 449.477 4.480 10 10 IICE C[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)NCc1cc(Br)ccc1O 813783000 WONCCNVQSDEYDJ-CYBMUJFWSA-N 444.370 4.037 10 10 IICE COc1ccc(Cl)cc1CCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1126136415 YLCRFZYUQYPVCM-UHFFFAOYSA-N 439.987 4.429 10 10 IICE COC(=O)Nc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)c1 1126583772 UGRIWWVMEUQLCK-MRXNPFEDSA-N 433.455 4.174 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3C(=O)Nc4c(F)cccc43)cc2Cl)C1 1128490515 UBUWFZDVQZAXCY-PBHICJAKSA-N 429.923 4.458 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(NC(=O)OC(C)(C)C)c(C)c3)C2)cc1 1130826946 ODRSJFCQPYELCC-SFHVURJKSA-N 425.529 4.359 10 10 IICE COC(=O)COc1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1Cl 1137647186 ABZXWHYTHAVHMM-UHFFFAOYSA-N 440.883 4.364 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN([C@H](C)c3ccsc3)CC2)cc1 1138536543 XVFKNUZFZKVFSD-LJQANCHMSA-N 435.593 4.416 10 10 IICE COC(=O)C1(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CCCCCC1 1141378905 LJHMPYMVANRICE-UHFFFAOYSA-N 448.361 4.247 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc2c(c1)nc(O)n2CC(F)(F)F 1142418318 CRCCAEHZFZBVKL-CQSZACIVSA-N 434.462 4.040 10 10 IICE Cc1cc(CCNC(=O)c2nn(-c3ccc(F)cc3F)cc2O)c(C)n1-c1ccccc1 1150450038 RUGANCHLDCOCST-UHFFFAOYSA-N 436.462 4.236 10 10 IICE Cc1ccc(C[C@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cc1 1154316538 NOHPVNKANBLXHU-HXUWFJFHSA-N 441.369 4.498 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@]3(C(=O)OC(C)(C)C)CCCO3)cc2Cl)C1 1155727483 SYSHPJYDBKNEQI-MWTRTKDXSA-N 436.980 4.083 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(OCC(F)(F)F)c2ccccc2n1 1162612830 RHWDOWJUOFPANI-UHFFFAOYSA-N 427.382 4.360 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1164486315 SUMVDEVAHVSSEN-AOMKIAJQSA-N 442.357 4.278 10 10 IICE Cc1ncccc1/C=C/C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1289102839 SSHSQMDTJJOLIT-JEJOPICUSA-N 425.504 4.273 10 10 IICE Cc1cc(-c2nnc(N3CCOCC3)n2CCOCCC(C)C)c(C)n1-c1ccccc1 1289360417 IDICASFLYJTOKI-UHFFFAOYSA-N 437.588 4.252 10 10 IICE C[C@@H]1CC[C@@H](Cn2c(CNC(=O)c3cccs3)nnc2N(C)Cc2ccccc2O)C1 1291057609 KDYXBAVCYSGYOL-IAGOWNOFSA-N 439.585 4.048 10 10 IICE CCc1nn(C)c(CC)c1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1295174843 NUHMRFOQBYRCSX-UHFFFAOYSA-N 444.377 4.040 10 10 IICE COc1cc(N2CCN(Cc3ccc(C)c(Br)c3)CC2)cc(OC)c1OC 1307667386 SYEQFDHFGHYSKR-UHFFFAOYSA-N 435.362 4.106 10 10 IICE C[C@H](CCCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccco1)Cc1ccccc1O 1312760725 JUDBMBXPFNTYKV-QGZVFWFLSA-N 431.533 4.390 10 10 IICE CO[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)C[C@H]1OC 1316329155 OOQLRRGWZWXANG-ZRZAMGCNSA-N 437.588 4.249 10 10 IICE COC(=O)c1ccc(Cl)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1353605675 XOEIMTACBNHMFL-UHFFFAOYSA-N 439.943 4.487 10 10 IICE CCOC(=O)c1c(NC(=O)/C=C\c2cnc(OC)nc2)sc(C)c1-c1ccc(F)cc1 1353964604 JNGJSDKPDJLCFO-YHYXMXQVSA-N 441.484 4.490 10 10 IICE CC(=O)CCc1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1 1359897732 XNTNAJJECROLBE-UHFFFAOYSA-N 436.474 4.244 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(Br)c(Cl)c3)C2)cc1 1436969302 DKFRQTYUDFTCPD-OAHLLOKOSA-N 437.765 4.296 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2csc(-c3ccc(F)c(F)c3)n2)N(C)C)cc1 1439959102 CCJOTTQKXVGLFO-HXUWFJFHSA-N 430.524 4.187 10 10 IICE Cc1cc(C(=O)N2CCC([C@@H]3CCCO3)CC2)c(C)n1-c1ccc(Br)cn1 1447881763 XPRTULVOBLSJRF-IBGZPJMESA-N 432.362 4.283 10 10 IICE Cc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(C)cc1Br 1460738985 CAATUXMKFYCHHL-UHFFFAOYSA-N 439.300 4.111 10 10 IICE COc1ccc(N(Cc2ccccc2)Cc2ccc(S(=O)(=O)N(C)C)cc2)cc1OC 1460970760 FFIPIRWSDCTGMB-UHFFFAOYSA-N 440.565 4.161 10 10 IICE Cc1cccc([C@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCOCC2)c1 1464141921 SDHHQXBZYWMXQR-SANMLTNESA-N 445.563 4.018 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)O[C@H]1COc2ccccc21 1520031446 NGMPMIAWTYSMOJ-SZLZGVTBSA-N 429.494 4.094 10 10 IICE C[C@@H]1CN(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c2ccccc2N(C)C1=O 1524109915 UAKKOLWTYSFHOQ-QGZVFWFLSA-N 449.551 4.239 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)cc1 1528645209 YYKQPMPELLZWGE-SFHVURJKSA-N 441.400 4.115 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1 1528925503 ZPQUOKBZEAAOKT-HYBUGGRVSA-N 437.584 4.300 10 10 IICE CC(C)c1nc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)co1 1535382446 MLICXSVEVIBYFG-SXGWCWSVSA-N 434.514 4.272 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)nc(-c2ccc(Cl)cc2)n1 1535558178 KQUBWPBJWYSLQQ-QGZVFWFLSA-N 436.943 4.433 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCOc3cc(C)ccc3C(C)C)cc2F)CC1 1537534483 AVQYBIATRZHXQP-UHFFFAOYSA-N 441.591 4.485 10 10 IICE Cc1cc(CC(=O)N2CCN(Cc3cccc(O)c3)CC2)c(C)n1-c1ccc(Cl)cc1 1539692034 HXRDWQNGMJOSRG-UHFFFAOYSA-N 437.971 4.340 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C 1543309834 IRUVLJGSBDOESL-HXUWFJFHSA-N 427.545 4.186 10 10 IICE C[C@H]1CCCN([C@@H](C)Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)C1 1544077502 IDQGBPPHCNJOJP-PMACEKPBSA-N 425.621 4.473 10 10 IICE CCC1(CC)CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1546103386 IUZBUOHHYQNHMO-UHFFFAOYSA-N 429.584 4.442 10 10 IICE C[C@H](NC(=O)N1CCN(C(=O)OC(C)(C)C)CCC12CCC2)c1ccc(N(C)C)cc1 1564598034 XPYDKXXBZRFJLF-SFHVURJKSA-N 430.593 4.389 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CCc3cc(Br)cc(F)c32)C1 1584836098 WTNANQWXFPGFPG-CQSZACIVSA-N 425.298 4.091 10 10 IICE CC(C)[C@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(=O)OC(C)(C)C 1584899253 UHVFHUGOSZLFDA-FQEVSTJZSA-N 441.616 4.138 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@H](C)O1 1614218461 LLLOQXYRVHGWTP-HOTGVXAUSA-N 433.603 4.489 10 10 IICE COC1CCN(c2ccc(CN3CCC(CN(C)C(=O)OC(C)(C)C)CC3)cc2)CC1 1615469050 HCJIFGBPHAMFKT-UHFFFAOYSA-N 431.621 4.381 10 10 IICE COCc1nc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(-c2ccccc2)s1 1616867291 UEVDFEQGHGKGIA-HXUWFJFHSA-N 438.597 4.055 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC3(C)CCOCC3)CC2)cc1 1619301707 VKGKKABGTFZMMV-UHFFFAOYSA-N 441.620 4.118 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cnn3c2N[C@@H](C2CC2)C[C@H]3C(F)F)cc1 1624540769 COKANLMBIWOPFW-UXHICEINSA-N 431.531 4.402 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1csc(NC(=O)c2cccs2)n1 1624626759 WIGHMJUPSGLJTG-UHFFFAOYSA-N 440.594 4.258 10 10 IICE Cc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)N2CCOCC2)o1 1628920723 UJFPWDZWQIKVNA-JOCHJYFZSA-N 441.959 4.452 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C(=O)c1ccc(Br)s1 1631166427 FFMJPGWELDBQMD-UHFFFAOYSA-N 447.148 4.210 10 10 IICE Cc1ccc(C(=O)NCc2csc(-c3ccn(C)n3)n2)cc1-n1c(C)cc(C=O)c1C 1634722114 PKFZVNSKFZRVTP-UHFFFAOYSA-N 433.537 4.002 10 10 IICE Cc1cccc(-n2ncc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2C)c1 1635940274 AUDIPQGVKRTCIM-HXUWFJFHSA-N 438.959 4.243 10 10 IICE COc1c(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc(Cl)cc1C(N)=O 1636374791 CYEMYPNNRIZFPP-UHFFFAOYSA-N 439.899 4.228 10 10 IICE COc1ccc(N2CC[C@H](CNc3ncnc4cc(F)c(Br)cc34)C2)cc1 1640063732 QLUCIXXZCIYXER-CYBMUJFWSA-N 431.309 4.478 10 10 IICE C[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1)c1ccccc1O 1643738982 ZTWBXUMFYUYWDV-CYBMUJFWSA-N 448.903 4.477 10 10 IICE COc1cncc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1650744339 WKBIZWRDVGSJKQ-KRWDZBQOSA-N 430.430 4.411 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2[C@H]1C(C)(C)[C@@H]2NCc1ccc(N2CCOCC2)cc1 1655916518 WOWRKDJJBTWOGA-VSKRKVRLSA-N 429.605 4.037 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(Cc2cccc(Cl)c2)CC1 1673744080 JSWYPSIBQYRXAO-LJQANCHMSA-N 429.008 4.173 10 10 IICE CC1(C)C[C@@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ccc(F)cc2O1 1679299166 DWFLYLMCSPEPEQ-LJQANCHMSA-N 449.473 4.042 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3ccc(Br)cc3OC)C2)cc1 1686130670 ZFGDNSDLNMCEEW-GDBMZVCRSA-N 448.361 4.105 10 10 IICE CCCCCCNC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 1686826287 FHJDRDFFWIMOEQ-RBBKRZOGSA-N 430.637 4.110 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@H](C)[C@@H]3CCCC[C@@H]32)n1CCCSc1nccs1 1692511978 SSZXXILNVYRYFC-ULQDDVLXSA-N 448.662 4.070 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N(C)Cc1c(C)nn(C)c1C 1693006360 XBCSRVDKETXZAJ-UHFFFAOYSA-N 437.636 4.276 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Br)s2)n1CC1(O)CCC1 1696699967 NWLKPACAJPLUQI-UHFFFAOYSA-N 449.374 4.026 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)CC1 1711596137 QUDBHEULWQYDTI-VWLOTQADSA-N 436.604 4.102 10 10 IICE CC(C)c1nnc(N2CCN(C)c3ccccc3C2)n1CCCSc1nccs1 1723186761 UQYAOYDIFVVZSA-UHFFFAOYSA-N 428.631 4.497 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2CC2(O)CCC2)c(C)n1-c1ccccc1 1742117323 LBHRLROJSUADKA-UHFFFAOYSA-N 429.515 4.359 10 10 IICE Cc1cc(-c2nnc(N3CCC(F)(F)C3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1742118468 GFKBOGCGLHPRJB-KRWDZBQOSA-N 428.531 4.148 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1766528585 FMMVINRWHIOVPS-UHFFFAOYSA-N 432.576 4.012 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1768007071 LZRCHKNEPJCDSM-OAQYLSRUSA-N 425.621 4.160 10 10 IICE CCOCCN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1768112584 BBSTXMUULUPEOP-HSZRJFAPSA-N 441.620 4.277 10 10 IICE CN(C[C@H]1CCCO1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1768980939 BSJPIHXPCCIOHC-OAQYLSRUSA-N 443.661 4.083 10 10 IICE CC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 1858592009 GCRWUUDAJBPTQK-PUMYGXPMSA-N 443.546 4.339 10 10 IICE COc1cccc(OCCCOc2c(C=C3SC(=S)NC3=O)cccc2OC)c1 2297347775 MPFOKXBFUYZJBS-UHFFFAOYSA-N 431.535 4.041 10 10 IICE COc1ccc(-c2ccc(C=C3C(=N)N4N=C(C(C)C)SC4=NC3=O)o2)c([N+](=O)[O-])c1 2297348084 GDKNRRSGTDEGAT-UHFFFAOYSA-N 439.453 4.139 10 10 IICE COc1ccc2c(C=C3SC(=S)N([C@@H](Cc4ccccc4)C(=O)O)C3=O)c[nH]c2c1 2297471778 BECPYPHDBTVBQG-SFHVURJKSA-N 438.530 4.074 10 10 IICE CCOC(=O)CCCN1C(=O)C(=Cc2ccc(OC)c(Br)c2)SC1=S 2314740265 FEAREHMIMKUXBZ-UHFFFAOYSA-N 444.372 4.002 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14471401 MGYCDGRZADLPHE-MRUHUIDDSA-N 427.888 4.451 10 10 IICE Cc1ccccc1NC(=O)[C@H](C)N1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S 47152301 GLXCJURTHRUXAS-MFVBVHDHSA-N 427.507 4.132 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 226802585 WQXCMCBHUSCVAL-WOIUINJBSA-N 427.526 4.452 10 10 IICE COc1cc(N2CCN(C(=O)CC34C[C@H]5C[C@@H](CC(F)(C5)C3)C4)CC2)cc(OC)c1OC 758036529 YEZBDHQINQRGST-LYBIEXDWSA-N 446.563 4.060 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NCc2ccc(N(C)C)cc2)cc1 763264510 DDGHTRAGIUCVHE-KRWDZBQOSA-N 426.561 4.338 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cncc(Br)c2)C1 766398058 FMUVPQRIPSNLMX-UHFFFAOYSA-N 442.357 4.309 10 10 IICE Cc1cc(Br)c(O)c(CN[C@@H](CCO)c2ccccc2Br)c1 781640248 XSUFJXPYROKYIT-INIZCTEOSA-N 429.152 4.439 10 10 IICE COc1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)ccc1O 798099473 AMPPPUUZMWRBRA-WJDWOHSUSA-N 434.564 4.082 10 10 IICE Cc1ccccc1[C@@H](O)C1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 804989070 LKFKYRGRALSQET-CPJSRVTESA-N 437.584 4.048 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3sc(-c4ccccc4)nc3C(F)F)cc2)CC1 1132899376 UAZLPVOYJSBJNN-UHFFFAOYSA-N 442.535 4.430 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(CC(=O)NC3CCCC3)CC2)c1 1136390677 PBAYTHHBUNUMEE-UHFFFAOYSA-N 435.568 4.208 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)OC(C)C)c2C)c1 1141424757 OABQQBPSECILJR-DEOSSOPVSA-N 434.536 4.401 10 10 IICE Cc1ccc(C(=O)N2CCC[C@@H](C(=O)Nc3ccccn3)C2)cc1-n1c(C)cc(C=O)c1C 1148333676 HVWMAWIBSYNYBF-OAQYLSRUSA-N 444.535 4.101 10 10 IICE COc1cc(N2CCN(Cc3ccc(OCc4ccccc4)nc3)CC2)cc(OC)c1OC 1169072856 NTTIEPNDCJKQHH-UHFFFAOYSA-N 449.551 4.009 10 10 IICE C[C@H](N[C@H](C)c1c(F)cccc1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1197979140 RRNFXGVKKGZOFZ-KGLIPLIRSA-N 434.442 4.418 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc4cc(Br)ccc4[nH]3)C2)cc1 1225808154 PGYVREHPFFRWGB-MRXNPFEDSA-N 443.345 4.017 10 10 IICE C[C@H]1[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1302197392 IPENGSBOIQQXJH-PMOUVXMZSA-N 432.542 4.219 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@@H](C)C3)n2CCCSc2nccs2)n1 1304483158 DGMLPJGUAPOYQP-HNNXBMFYSA-N 432.644 4.229 10 10 IICE CCN(CC)CCNC(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1354312174 JIGQORSEBCDNKM-UHFFFAOYSA-N 446.595 4.347 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2C[C@@]2(C)COCCO2)c(C)n1-c1ccccc1 1361045699 GGHDTRWEXNAMQP-VWLOTQADSA-N 437.588 4.250 10 10 IICE Cc1c(Cl)ccc2c(CC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)coc12 1436623362 CLQDFAOPXBFMOO-UHFFFAOYSA-N 434.870 4.368 10 10 IICE COCc1ccc([C@@H]2COCCN2C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)o1 1456032636 YHPDJMQRACOIOH-QHCPKHFHSA-N 436.508 4.168 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3cn(C)nn3)C2)c(C)n1-c1ccc(Br)cc1 1457174846 IPTSRSSTPNKPNW-INIZCTEOSA-N 442.361 4.005 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H]2CS(=O)(=O)c3ccccc32)cc1 1460324096 ZUOGWIIBNAGMGF-QGZVFWFLSA-N 448.548 4.469 10 10 IICE CC(=O)N1CCN(Cc2ccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)cc2)CC1 1466448921 CIUVNHOOTYMNQN-UHFFFAOYSA-N 444.579 4.319 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1478841034 OBDWOFJSKLWFKU-RTBURBONSA-N 446.636 4.327 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC3(c4ccc(Br)cc4)CC3)C2)cc1 1478958237 YLAZBKWKOHCOBF-GOSISDBHSA-N 444.373 4.067 10 10 IICE CCOCCN(CC)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N(C)C)c(F)c1 1503196064 ZYEXMJFZJQZEJH-UHFFFAOYSA-N 446.958 4.110 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(I)cc2F)cc1 1525918882 RNENMWPSKBPHDE-UHFFFAOYSA-N 426.273 4.207 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1535557559 BGEFLPVWZMLHFB-OAHLLOKOSA-N 442.922 4.301 10 10 IICE C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)c2ccc(N=NC(N)=O)cc2)c1 1542090696 LDNHWSSFPZLSAH-CQSZACIVSA-N 440.479 4.053 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(OCc4cccs4)c3)CC2)c(OC)c1 1543631392 AFVLBMVXNKASGJ-UHFFFAOYSA-N 438.549 4.307 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c1 1544871368 YIHIMMPVDWCDGF-JOCHJYFZSA-N 439.556 4.378 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 1546150756 XBFRGGSZEIWWEB-QGZVFWFLSA-N 443.463 4.285 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1552511262 AEZVNOHCTRXOSB-GUDVDZBRSA-N 447.624 4.146 10 10 IICE C[C@@H](NS(=O)(=O)c1cccc(C(=O)NCc2cc(Cl)ccc2O)c1)c1ccccc1 1557385655 HANFWGBTLMCNME-OAHLLOKOSA-N 444.940 4.015 10 10 IICE CCO[C@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1565797489 CSJYKWZTBFEWHS-ROUUACIJSA-N 432.362 4.329 10 10 IICE COc1cc(OC)c2c(c1)N(C(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)CCC2 1584572797 WKVGUGSPQFMMJK-UHFFFAOYSA-N 432.520 4.446 10 10 IICE CCC[C@H](Cn1c([C@@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1614395729 XBXRCHILPNKUQQ-PKOBYXMFSA-N 433.572 4.081 10 10 IICE Cc1cc(C(=O)COc2ccc(C(N)=O)cc2F)c(C)n1-c1ccc(OC(F)F)cc1 1615050055 PMXNXQFCLKFMPA-UHFFFAOYSA-N 432.398 4.195 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Cl)cc(Br)c2F)N(C)C)cc1 1616867271 STEVLBKCWXHVQI-QGZVFWFLSA-N 442.760 4.340 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCCCOC(C)C)CC2)cc1 1619301582 QGWRRGNFEVERJO-UHFFFAOYSA-N 441.620 4.476 10 10 IICE C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1625146040 VJTLXIKNXQTJCI-JOCHJYFZSA-N 443.591 4.113 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(Nc4nccs4)cc3F)CC2)cc1 1632158072 PDXXTSXVEHOIGH-UHFFFAOYSA-N 426.517 4.387 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](CS(C)(=O)=O)c1ccccc1 1632697022 DAGRUDHBUAVJHE-CVDCTZTESA-N 437.561 4.310 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](C)[C@@H](C)C(=O)Nc3ncccc3O)c2C)c1 1636133452 ZSZNMGRRWRUQDA-QZTJIDSGSA-N 434.540 4.205 10 10 IICE C[C@@](O)(C(=O)NCc1cc(Cl)cc(Cl)c1O)c1ccc(F)c(Br)c1 1637134435 NEADCNILHDYXAD-INIZCTEOSA-N 437.092 4.125 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)CCCNC(=O)OC(C)(C)C)ccc21 1637524904 HQOGZFWKHRCASS-MRXNPFEDSA-N 431.577 4.328 10 10 IICE Cc1cc(C(=O)NCC[C@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1639185523 ZDMCYXQBIMIGQF-QFIPXVFZSA-N 442.357 4.279 10 10 IICE COc1ccc([C@@H](CNC(=O)OC(C)(C)C)CN2CCOc3cc(N(C)C)ccc32)cc1 1642567206 KMCHSVLZGPMEBQ-IBGZPJMESA-N 441.572 4.269 10 10 IICE COC(=O)[C@H]1c2ccccc2OCCN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1646111607 NCNWCJPZXLEMQQ-XMMPIXPASA-N 432.520 4.460 10 10 IICE NC(=O)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1ccccc1Cl 1655149870 ZCNKLCUMKCKDTF-QGZVFWFLSA-N 437.883 4.235 10 10 IICE CCN(Cc1nnnn1-c1ccc(Cl)cc1C(F)(F)F)c1ccc(OC)c(OC)c1 1657760016 PNSACIDDVUUQJV-UHFFFAOYSA-N 441.841 4.378 10 10 IICE CCN(CC)CC[C@@H](NC(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccccc1 1676793687 HOEWWVXCTVNQIR-RUZDIDTESA-N 438.616 4.390 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)C[C@H]2CCCCO2)cc1 1695626395 UICRMJZBNUPYRV-JTHBVZDNSA-N 441.620 4.072 10 10 IICE FC1(F)CCN(c2nnc(-c3ccc(Cl)nc3)n2CCCSc2nccs2)C1 1731172856 STFHHOMLLZTPNB-UHFFFAOYSA-N 442.948 4.478 10 10 IICE CC(=O)Nc1cccc(C(=O)N(c2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)c1 1859891459 CYVDAKYUGOORFQ-UHFFFAOYSA-N 426.472 4.476 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NC(C)(C)C)sc(C)c1-c1ccc(OCC)cc1 1860762982 YLAOFBKRDAVRCD-UHFFFAOYSA-N 432.542 4.152 10 10 IICE COC(=O)c1c(NC(=O)CCN2C(=O)CSC2=S)sc(C)c1-c1ccc(C)cc1 1865767604 AUNVYASHALBHPT-UHFFFAOYSA-N 448.591 4.007 10 10 IICE COc1cccc(O)c1[C@H](C(=O)O)N(C)C(=O)OCC1c2ccccc2-c2ccccc21 1958766088 VYTZJFSLVQZPLM-HSZRJFAPSA-N 433.460 4.407 10 10 IICE CC(C)(C)OC(=O)N1CCc2[nH]c(=NCc3cc(Cl)cc(Cl)c3O)sc2C1 2198519782 UROJFLPKDFQUFK-UHFFFAOYSA-N 430.357 4.483 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c1O 2227748777 QKVHZXXLAKLRRB-LSDHHAIUSA-N 429.355 4.089 10 10 IICE CC(C)(C)OC(=O)NC(C)(C)c1csc(=NCc2cccc(Br)c2O)[nH]1 2267672260 ZLLTXSOEPAADLW-UHFFFAOYSA-N 442.379 4.405 10 10 IICE Cc1ccc(-c2ccc(C=C3SC(=S)N(CCCC(=O)O)C3=O)o2)cc1[N+](=O)[O-] 2296509304 IPFMLUHJMNDAHQ-UHFFFAOYSA-N 432.479 4.229 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3nnc(CC)s3)C2=O)cc1 2296753949 GAJQILBWPKIPTQ-UHFFFAOYSA-N 446.623 4.283 10 10 IICE C[C@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314837520 TYZFVOUQVNMBCV-LLVKDONJSA-N 447.925 4.477 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc1)C(=O)O 2314927546 HBJICPNKYQESTK-INIZCTEOSA-N 443.502 4.033 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cccc(C)c3C)C2=O)ccc1OCC(=O)O 9927836 SFMGPBWJFULMTK-VCHYOVAHSA-N 429.519 4.181 10 10 IICE COc1ccccc1C(=O)NN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 33333915 JHMPAKQWPKPPJL-XNTDXEJSSA-N 449.351 4.004 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3cc(C)cc(C)c3)nc3ccccn3c2=O)SC1=S 39835751 FDIFBIFZWPEYRF-SFQUDFHCSA-N 437.546 4.325 10 10 IICE CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/Nc1ccc2c3c(cccc13)C(=O)N(C)C2=O 100927550 SSYQWVJEIXHGBH-XDHOZWIPSA-N 444.878 4.438 10 10 IICE COc1ccc(/C=C2\SC(=S)N(c3ccc(C)cc3C)C2=O)c(C(=O)O)c1OC 210400603 TZPCPBGYMYVJAS-YBEGLDIGSA-N 429.519 4.425 10 10 IICE Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NC(CNC(=O)OC(C)(C)C)CNC(=O)OC(C)(C)C 389237365 WRGNDMBIFXSAOK-RDJZCZTQSA-N 449.592 4.257 10 10 IICE CCCNC(=O)Nc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 586609343 BGVROCMWEIUENQ-UHFFFAOYSA-N 427.460 4.246 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cccc(N[C@@H](C)C(C)C)c3C)CC2)cc1 743408149 CGBWLOTWMPEGLE-NRFANRHFSA-N 438.616 4.012 10 10 IICE C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 780840405 GXINXPVQVBDKES-XLIONFOSSA-N 438.538 4.091 10 10 IICE Cc1nc2ccc(S(=O)(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cc2s1 794001858 IXGRCWPXGFVNSV-UHFFFAOYSA-N 432.508 4.437 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(OCC2CCOCC2)cc1 806289402 NEACIWWBJNZARJ-UHFFFAOYSA-N 435.318 4.282 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\c3cc(OC)c4c(c3)OCCO4)SC2=S)cc1 814274039 XDUBRFXMOXUEMU-LDADJPATSA-N 429.519 4.271 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1125187359 DNQDZMIAFPQBFM-HUUCEWRRSA-N 447.482 4.077 10 10 IICE COc1ccc2c(c1)CC[C@H](C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)C2 1125878816 VWNSUEWDBCERTD-SFHVURJKSA-N 430.495 4.187 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N1CCC[C@H]1C(F)(F)F 1135027764 BLYYBQYQLDMHQY-UKVQZPPCSA-N 434.530 4.283 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(S(=O)(=O)c2ccc(F)cc2)CCCCC1 1136429099 ZOPNLKKVDCQRGK-UHFFFAOYSA-N 446.588 4.417 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nc3ccc(Br)cn3c2F)cc1F 1144986140 UFEQMCQVUVCKFY-UHFFFAOYSA-N 437.288 4.151 10 10 IICE O=C(NCc1cccc(Cl)c1O)NC[C@H](C(=O)OCc1ccccc1)c1ccccc1 1234466103 PXQCOMGTHQAJFS-FQEVSTJZSA-N 438.911 4.372 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCO[C@H](c2ccncc2)C1 1252619444 LMYIOTFYYJKMJQ-MJGOQNOKSA-N 434.334 4.002 10 10 IICE CC[C@@H](C)[C@H](Cn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C)OC 1291424897 DIUQQJBPPZLMCR-UTKZUKDTSA-N 447.599 4.111 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1 1291622198 XVWOEYRHPDTDCS-UHFFFAOYSA-N 428.847 4.002 10 10 IICE Cc1cc2n[nH]cc2cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1296363004 PZUYLOCGCDYGSW-NVMNQCDNSA-N 440.525 4.240 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H]2CCCO2)c(C)n1-c1ccccc1Br 1304200019 FQCNEQNNFNPLBU-ROUUACIJSA-N 447.373 4.267 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1OCCC1(C)C 1305379986 BZMBIJHVJPDLLC-KNQAVFIVSA-N 441.620 4.080 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)NCc1cccc(C(F)F)c1 1320517971 DSPUBWORTZSETN-UHFFFAOYSA-N 428.527 4.156 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCN(C3CCC3)C[C@@H](C)C2)nnc1C(C)(C)C 1361097461 BOYNPRWEZPUNGO-LJQANCHMSA-N 438.664 4.309 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cnc(Nc3ccccc3)nc2C(F)(F)F)c1 1445964183 CEBSLCGAJQCEDC-GFCCVEGCSA-N 432.402 4.444 10 10 IICE CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1449592121 OHHSZDJZECXZSF-GOSISDBHSA-N 443.548 4.347 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1c1ccc(Cl)c(F)c1 1450723076 UZEBLIBLPKVEPU-SJCJKPOMSA-N 445.705 4.327 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C/SCc2ccco2)NC(=O)OC(C)(C)C)cc1 1465325795 ZSTDUUIMFHJDOF-CMQXMCPJSA-N 445.585 4.475 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(-c2ccc(OC)cc2)on1 1465851370 RLLMTOOWQLYDLF-UHFFFAOYSA-N 431.286 4.481 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1470774122 WBDBGWCKRQVYTF-RXVVDRJESA-N 449.473 4.076 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@]3(C=Cc4ccccc4O3)C2)N(C)C)cc1 1471546808 FUZSVNRPIFNAOH-OZXSUGGESA-N 434.584 4.005 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)c1ccc(OC)cc1OC 1471578771 QOACXFLLSSFDOO-CYBMUJFWSA-N 437.334 4.465 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)c1cc(F)ccc1OC 1472953249 PNVLCSZJZCNRPH-UHFFFAOYSA-N 428.485 4.464 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCCC1(F)F 1499154515 SCQIOSDOJQWWCT-INIZCTEOSA-N 437.510 4.140 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CSc3nnnn3C3CCCC3)cc2Cl)C1 1519551388 MMSRYUJBSLIJRK-HNNXBMFYSA-N 449.024 4.086 10 10 IICE CSC[C@H]1CCCN1c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1520255910 OBLWASGDRWQPBW-QGZVFWFLSA-N 446.671 4.235 10 10 IICE CC[C@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N(C4CC4)C3)c2C(=O)OC(C)(C)C)C1 1523612865 CPRNRXJFQHOXMV-UONOGXRCSA-N 432.586 4.168 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@H]2Cc3c(Br)cccc3[C@@H]21 1525761650 FGKSUOMGLVZHLN-JASAOFIISA-N 427.386 4.457 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(NC(=O)c3cccs3)c2)N(C)C)cc1 1537482085 AXKQBEOCEQXYHQ-NRFANRHFSA-N 436.581 4.099 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Br)c(Cl)c2F)N(C)C)cc1 1537482302 DATMJATVDSEOBV-MRXNPFEDSA-N 442.760 4.340 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@](C)(CC)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1545406209 WYBVJRKGSIDFAE-HOYKHHGWSA-N 429.584 4.442 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@H](C)Cc1ccsc1 1559778597 WBBZYASWTRRIDI-QYZOEREBSA-N 447.620 4.070 10 10 IICE CCCN(Cc1ccccc1O)C(=O)C1=NN(c2ccccc2)[C@H](C(=O)OC(C)(C)C)C1 1566305297 PNAVBENGEMWXGY-NRFANRHFSA-N 437.540 4.107 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-c2csc(C)n2)s1 1566849288 JEJBWYGFABCOPF-UHFFFAOYSA-N 436.942 4.354 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)CC1CC1 1583724280 XDUYZOZYLLPOGT-INIZCTEOSA-N 433.346 4.176 10 10 IICE COC(=O)c1cccc(CC(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 1585493672 XOKFIGONAGNOFJ-UHFFFAOYSA-N 432.520 4.324 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc4ccc(C(C)(C)C)cc4[nH]3)CC2)cc1 1587447588 JNFIBOCBUSBIGC-UHFFFAOYSA-N 448.611 4.416 10 10 IICE Cc1cc(CNC(=O)c2cnc3c(c2)c(C(F)(F)F)nn3C)c(C)n1-c1ccccc1 1596490674 NFONLNYKCYBKNL-UHFFFAOYSA-N 427.430 4.325 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1613206629 IILUOPURVFNDBX-XMSQKQJNSA-N 425.621 4.346 10 10 IICE CN(c1ccccc1)c1ccccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1616588673 DAHAVULBTNLUAO-UHFFFAOYSA-N 442.563 4.086 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2cccc(F)c2)cc1 1629549974 DCQJIACWIJNWCV-XZOQPEGZSA-N 445.498 4.386 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C(=O)NC(C)C)C2)c(C)n1-c1cccc(Br)c1 1630504902 LGTOLQKHJFFBGS-QGZVFWFLSA-N 446.389 4.233 10 10 IICE CCc1ccc(-c2nc(CC(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)cs2)cc1 1631378162 ZXLJTONFSMOXJN-UHFFFAOYSA-N 439.556 4.412 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 1633789488 KATGLEKZZKSTEF-UHFFFAOYSA-N 436.449 4.154 10 10 IICE COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1634661651 UJMANYPKUNFXRK-YJYMSZOUSA-N 433.346 4.270 10 10 IICE O=C(CCN1CCN(c2cccc(Cl)c2)CC1)NCc1cc(Cl)cc(Cl)c1O 1637133311 DMQPKTHNMAJLTL-UHFFFAOYSA-N 442.774 4.181 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1F 1639327215 NEAJWGMVOHRFJK-FQEVSTJZSA-N 435.499 4.473 10 10 IICE Cc1cc(CCNC(=O)c2ccc(NCc3nccn3C)cc2)c(C)n1-c1ccccc1 1642090864 HFGPFAZYGCAUJP-UHFFFAOYSA-N 427.552 4.412 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Cn3cc([N+](=O)[O-])cc(Br)c3=O)c2C)c1 1656385698 XFOMIOMHUCFTMF-UHFFFAOYSA-N 444.285 4.118 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC2(c3ccc(F)cc3F)CCCC2)N(C)C)cc1 1684606804 JRKDITVBKJECGA-QFIPXVFZSA-N 430.543 4.402 10 10 IICE CCN(CC(C)C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N2CCC(C)CC2)cc1 1695613372 JPBHXPUJXUGVHT-UHFFFAOYSA-N 435.620 4.446 10 10 IICE C[C@@H]1CCC[C@@H](N(C)c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1726520847 MHPDLCACMIUGRT-IAGOWNOFSA-N 448.662 4.168 10 10 IICE CN(CCC1CCOCC1)c1nnc(-c2ccc[nH]2)n1CCCSc1nccs1 1729510920 HRRBPNTVKNQRQM-UHFFFAOYSA-N 432.619 4.165 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)cc1C 1763608942 GLOFFNGYCGYXME-PZJWPPBQSA-N 426.653 4.382 10 10 IICE CC(C)C[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858592307 MSUMLZKUNSXYGU-DTCSVVGVSA-N 432.336 4.289 10 10 IICE CCc1ccccc1Nc1ncc([N+](=O)[O-])c(N2CCN(c3ccc(OC)cc3)CC2)n1 1871310887 IGOJKBRMOXXRMK-UHFFFAOYSA-N 434.500 4.026 10 10 IICE CC1(C)C[C@@H](N(Cc2ccccc2)c2cc3c(cc2Br)[C@@H](O)C(=O)N3)CO1 1915453951 HTVUGSPBFIAMOR-AUUYWEPGSA-N 431.330 4.009 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NCc2ccc(Br)cc2O)C12CCC2 2118413756 QQJQVPZNRCZAKD-RHSMWYFYSA-N 425.367 4.328 10 10 IICE CC[C@@H](C)NCc1ccc(N(C)C[C@H](O)COCc2ccccc2)c(Br)c1 2239998886 IIYVCRKNQZDOTM-XLIONFOSSA-N 435.406 4.351 10 10 IICE CCN1C(=O)C(=Cc2ccc(N(CC)CC)o2)C(=O)N(c2ccc(Cl)cc2)C1=S 2294262195 QVTDDTQJDFABOJ-UHFFFAOYSA-N 431.945 4.343 10 10 IICE CC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(Cn2cncn2)cc1 2294474317 AOMFBBIJIAHHLM-UHFFFAOYSA-N 429.509 4.045 10 10 IICE Cc1ccc(-c2ccc(C=C3SC(=S)N(CCCC(=O)O)C3=O)o2)c([N+](=O)[O-])c1 2297464368 ILYQNFNUADOPGS-UHFFFAOYSA-N 432.479 4.229 10 10 IICE COc1cc(C=C2C(=O)NN(c3cc(Cl)cc(Cl)c3)C2=O)ccc1OCC(C)C 2297578174 WBVOYXJJVLIULZ-UHFFFAOYSA-N 435.307 4.498 10 10 IICE CCOC(=O)CCN1C(=O)C(=Cc2ccccc2OCc2ccccc2)SC1=S 2314741421 ZDXMAZUJVVRRHT-UHFFFAOYSA-N 427.547 4.420 10 10 IICE CCOc1cc(C=C2SC(=S)N(C3CCCCC3)C2=O)ccc1O[C@@H](C)C(=O)O 2314936099 VAPFAUQTCLUYAW-ZDUSSCGKSA-N 435.567 4.471 10 10 IICE CN(C)c1ccc(CNCc2ccc(I)c(Br)c2)cc1 2377355521 UBKLELNMXMDGLU-UHFFFAOYSA-N 445.142 4.410 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CC[C@@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2381136477 GSQUWSSWMKHZBU-VQTJNVASSA-N 441.366 4.163 10 10 IICE N=C1/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)C(=O)N=C2SC(N3CCCC3)=NN12 20356232 YYEPETIKXLLMGW-WQCWKDQBSA-N 425.901 4.272 10 10 IICE CCCC1=NN2C(=N)/C(=C\c3cccn3-c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)N=C2S1 32964128 MDRFWQWIMFHJDS-CHLNCNNDSA-N 442.888 4.458 10 10 IICE COc1ccc(N2CCN(c3ncnc(Sc4cccc5cccnc45)c3N)CC2)cc1 40728000 UMSYMSVHNKKELG-UHFFFAOYSA-N 444.564 4.093 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccccc3SCc3noc(C)n3)CC2)cc1 110356198 IGRBXSSCHRBNCF-UHFFFAOYSA-N 438.553 4.078 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(NC(=O)Oc3ccccc3)CC2)c1O 727428630 WKVRYODLYWOKEZ-UHFFFAOYSA-N 434.492 4.085 10 10 IICE COc1cccc(C[C@H](C)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743606693 KJJMHBSENRUKEH-WMZOPIPTSA-N 433.499 4.196 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1 743670708 LIDBQEXSNPYISZ-NRFANRHFSA-N 426.561 4.160 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c(C)n1-c1ccccn1 753198694 VEHQAFAGCLZKDG-HXUWFJFHSA-N 426.524 4.294 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3cc(C)n(-c4cccc(Br)c4)c3C)[C@H]2C1 755202198 KDLZZTUHKTXBRI-GIVPXCGWSA-N 447.373 4.265 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@@H](C)c2nc(-c3cccnc3)no2)C1 769662637 DWUQRFXJQLDLRD-KRWDZBQOSA-N 445.523 4.157 10 10 IICE Cc1cc(C(=O)COC(=O)c2coc(C3CCOCC3)n2)c(C)n1-c1ccc(F)cc1 786724500 VCFDSESDNSGOBG-UHFFFAOYSA-N 426.444 4.155 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CSCC(=O)Nc1ccc(F)cc1 788143308 YMBCDNBOLUXDIG-UHFFFAOYSA-N 429.561 4.146 10 10 IICE COC[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1cccc(C(F)(F)F)c1 806829824 WOZKTABJSSBBRI-OAHLLOKOSA-N 447.251 4.360 10 10 IICE O=C(Cn1c(-c2cscn2)nc2ccccc21)NCc1cc(Cl)cc(Cl)c1O 807838145 JIJDAYCBTPRIAD-UHFFFAOYSA-N 433.320 4.489 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc4c(F)ccc(F)c4c3)cc2F)C[C@@H](C)O1 1125255808 CCRXVNYZKOSHIW-OKILXGFUSA-N 429.442 4.196 10 10 IICE CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1132048430 VAKBTEMNGWHIGP-DEOSSOPVSA-N 445.563 4.414 10 10 IICE O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1cc2cc(O)c(O)cc2s1 1136634922 VIAVXZMZOGQMDY-SFHVURJKSA-N 432.501 4.292 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)Cc1ccc(O)cc1 1136657745 BQHRGCMVMDIDST-SFHVURJKSA-N 440.927 4.215 10 10 IICE COC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc(C)n(-c2ccccc2C)c1C 1180367997 OIQYBMCZUASZDD-FQEVSTJZSA-N 441.572 4.110 10 10 IICE CN1CCC[C@@H](c2cccc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2)C1 1182951938 NMWXTBGNWIJMJW-OFNKIYASSA-N 442.003 4.249 10 10 IICE CCOC(=O)CN(Cc1cc(C)nc(-c2ccc(Cl)cc2)n1)Cc1ccccc1O 1195358772 OREYHDPTZOICLU-UHFFFAOYSA-N 425.916 4.376 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC(=O)c4ccccc4O3)cc2Cl)C1 1235835842 WZHBLCISQYKUEZ-SJLPKXTDSA-N 441.959 4.410 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)c2ccccc2)cc1 1246300707 BNSQCDNHCVJZBE-SANMLTNESA-N 444.579 4.036 10 10 IICE COCCN(Cc1cccs1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1264297729 RAKXWYRCUNZDPF-UHFFFAOYSA-N 425.598 4.145 10 10 IICE Cc1ccccc1-n1ncc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 1294859065 HKXMJHTXNMWYJR-FQEVSTJZSA-N 438.959 4.243 10 10 IICE CCCCOCCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1306759961 BWCSOWMELGRDJQ-UHFFFAOYSA-N 427.593 4.088 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3cc(C(C)C)ccc3C)cc2F)CC1 1352959975 JPYAQPALXAGSFD-FQEVSTJZSA-N 441.591 4.483 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C4CCOCC4)cc3)cc2F)C[C@H](C)O1 1357835638 HTDBURBVSOXATK-ROUUACIJSA-N 426.532 4.263 10 10 IICE CN(C)[C@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(Cl)cc1 1435066257 UGZMGDBUJOSAPD-FQEVSTJZSA-N 437.918 4.329 10 10 IICE Cc1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c(C)n1-c1cccc(Br)c1 1440750052 WDAHQPUCIYYMLE-UHFFFAOYSA-N 437.301 4.289 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)ccc21 1442402872 SCORONQCPYBGKV-QGZVFWFLSA-N 432.351 4.045 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 1444320515 STSDSAPMICGEKA-UHFFFAOYSA-N 427.957 4.294 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(O[C@@H](C)C(=O)OC)c(F)c3)ccc21 1461639628 QZBOTQJGFPKTIC-INIZCTEOSA-N 442.487 4.236 10 10 IICE CS(=O)(=O)c1cc(C(=O)NCc2cc(Cl)cc(Cl)c2O)c(Cl)cc1Cl 1468668107 UQCJYXGNDMCTOE-UHFFFAOYSA-N 443.135 4.339 10 10 IICE CCOc1ccc([C@]2(C(=O)NCc3ccc4cccnc4c3O)CC2(Cl)Cl)cc1 1469251130 XDFIVTVJCZYEPX-NRFANRHFSA-N 431.319 4.471 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(CCC(=O)OC(C)(C)C)CC3)C2)cc1 1478859480 GKUHEJWXUZVCNZ-FQEVSTJZSA-N 445.604 4.065 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)[C@@H]1CC 1500312394 LZTSBWSFKPLIPV-QFIPXVFZSA-N 434.588 4.258 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCCCS(C)(=O)=O 1501451856 QPPDUZOTLRDFAR-UHFFFAOYSA-N 443.617 4.024 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2sc(Cc3ccc(F)cc3)nc2C)cc1 1527595395 LDUDYKZIFKJTTG-UHFFFAOYSA-N 427.545 4.398 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CCN(C(=O)OCc2ccccc2)CC1 1531693346 IIXFZITYHPQJNF-UHFFFAOYSA-N 435.568 4.294 10 10 IICE CN(c1ccc(CNC(=O)c2cnn(CCO)c2-c2ccccc2)cc1)C1CCCCC1 1544252356 HYNPGBAIXHILGS-UHFFFAOYSA-N 432.568 4.241 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N(C)C)c(F)c1 1545902166 IQPAWKACUQAONH-HXUWFJFHSA-N 444.599 4.075 10 10 IICE O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1557140500 YFNNHAXRYIKFPD-RUZDIDTESA-N 439.531 4.044 10 10 IICE O=C(N[C@@H](C(F)F)C1CCCCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1557558632 HSPBGDGVZMZLGP-QGZVFWFLSA-N 444.525 4.198 10 10 IICE CSc1cc(Br)ccc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1565985965 OYBIQCAVRXBNGI-UHFFFAOYSA-N 449.414 4.310 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1 1586649160 IOMVVNIRGUGCAP-UHFFFAOYSA-N 439.556 4.201 10 10 IICE Cc1sc2ncn(NC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)c(=O)c2c1C 1587378194 VANOSSNQXHLQQM-UHFFFAOYSA-N 440.956 4.449 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@]3(O)CCN(Cc4ccccc4)C3)c2C)c1 1618657032 BFJJFMODBDWNQX-MHZLTWQESA-N 431.580 4.078 10 10 IICE Cc1cc(CC(=O)N2CCC(C(=O)Nc3ccc(O)cc3)CC2)c(C)n1-c1ccccc1 1622319592 RFOBFWRXAOHUQP-UHFFFAOYSA-N 431.536 4.220 10 10 IICE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccc(N(C)C)cc1 1623316395 TZNDLRCXPIJUSN-GOSISDBHSA-N 443.547 4.296 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(Cl)c(Cl)cc3N)cc2F)C[C@@H](C)O1 1626158015 HUSWLOHDOMTOBP-VXGBXAGGSA-N 426.319 4.258 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4cccc(C(F)(F)F)c4nc3O)C2)cc1 1627158828 GUTGVJMKFUXEMI-CQSZACIVSA-N 445.441 4.224 10 10 IICE Cc1cc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)ccc1N1C(=O)CCC1=O 1628045989 ARYIJAPJZCKRRK-UHFFFAOYSA-N 429.476 4.121 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2n[nH]cc2C(=O)N2CC(C)(C)c3ccc(F)cc32)C1 1628327765 FJZKJUMCSWOMRW-AWEZNQCLSA-N 428.508 4.211 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)Nc2ccccc2)c(C)n1-c1ccc(Br)cn1 1628813891 LZVYXCIONAMXBY-CQSZACIVSA-N 441.329 4.009 10 10 IICE COc1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1OC(F)F 1629815991 QCTVJRXERLWHLU-UHFFFAOYSA-N 428.435 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(OC[C@H]3CCCCO3)CC2)cc1 1634967316 PFINZYUCYHYFLO-RUZDIDTESA-N 438.568 4.026 10 10 IICE Cc1cc(C(=O)NCc2ncc3c(n2)CCC3)c(C)n1-c1ccc(Br)cc1 1637749470 GGSGOSWNAHQFMG-UHFFFAOYSA-N 425.330 4.065 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3ccc(F)cc3F)CC[C@H]2C)c([N+](=O)[O-])c1 1640452697 GNWZOFINAFLWFC-UFRMUOTOSA-N 431.439 4.164 10 10 IICE Cc1cc(CNC(=O)[C@H](NC(=O)NCc2ccccc2)C(C)C)c(C)n1-c1ccccc1 1642459228 FWZGAUVJXUYENE-XMMPIXPASA-N 432.568 4.234 10 10 IICE CC(C)(C)OC(=O)N[C@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1643394851 YOQCXPDNTYWHJP-MPJJRAAHSA-N 427.589 4.233 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)NCc1c(O)cccc1F)NC(=O)OC(C)(C)C 1645050286 FZPBQBSMUYULDM-GOSISDBHSA-N 432.492 4.202 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3c(O)cnc4ccc(Cl)cc34)cc2F)C[C@@H](C)O1 1648474287 HLVJWTWIWMTZEX-ZIAGYGMSSA-N 443.906 4.277 10 10 IICE CCOc1ccc(N(CC)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1653718577 VTNCCUDJNXTNQL-UHFFFAOYSA-N 428.488 4.326 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2[C@H](C)CO)sc(C)c1-c1ccccc1 1654194447 PRSBUNHKDVZAPZ-VQIMIIECSA-N 444.597 4.322 10 10 IICE CCOC(=O)CN(Cc1ncc(-c2ccc(Br)cc2)o1)Cc1ccccc1O 1654805748 APAPUXCRTIILND-UHFFFAOYSA-N 445.313 4.375 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2CC[C@H](NC(=O)NCc3c(O)ccc4c3CCCC4)[C@H]1C2 1684800820 IRYSDLQBKFMSRU-TYCQWZJGSA-N 443.588 4.248 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1695070410 AWYYEOGDDJXLBD-CJFMBICVSA-N 443.636 4.366 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@H]1C 1695815317 WWYKQJVOPNYNKR-UXHICEINSA-N 438.664 4.216 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1708574681 NMLUTBMGKHHKBR-HFJWLAOPSA-N 448.615 4.313 10 10 IICE CCN(CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)C(C)C 1710163003 BSEITJUHWXIDJY-IFMALSPDSA-N 443.636 4.269 10 10 IICE CC(C)c1nnc(N2CCC[C@H](OCC(F)(F)F)C2)n1Cc1ccc(N(C)C)c(F)c1 1723178550 YRTVIANPDFDJMO-INIZCTEOSA-N 443.489 4.203 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@@H]1CCSC1 1747749846 FBMVBGGKNDKTKW-ZDUSSCGKSA-N 448.390 4.131 10 10 IICE CCC1CCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)CC1 1765166068 UAAMEBASCBZAGG-LJQANCHMSA-N 429.609 4.051 10 10 IICE CCc1ccc2[nH]c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc(=O)c2c1 1866487409 DVWKVFPQDZHWPU-VWLOTQADSA-N 446.595 4.114 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(Br)cc2O)C(F)(F)CC1 1967846684 OWCNUXDYMVZRTC-OAHLLOKOSA-N 435.309 4.279 10 10 IICE CCN1CCc2cc([C@@H](N)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999537491 ZMMOJRZVZPEBPT-JTHBVZDNSA-N 425.573 4.179 10 10 IICE CCc1ccc(C=C2SC(=S)N(CC(=O)Nc3cc(Cl)ccc3O)C2=O)cc1 2296881322 ALQVMBWQMJOFCS-UHFFFAOYSA-N 432.954 4.448 10 10 IICE COc1cc(NC(C)=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C)c(OC)cc1Cl 2313681569 IDOVZWUOENJPTB-UHFFFAOYSA-N 430.848 4.374 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551045 IPQSQFWUYLXWDV-JNEVIBOXSA-N 427.526 4.498 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(C)C2=O)ccc1OCC(=O)Nc1ccc(C)cc1 33458150 UVDOZLLCUFYVNR-UNOMPAQXSA-N 442.562 4.242 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3ccc(Br)c(C)c3)C(=O)N=C2O)ccc1O 38179743 QZYHZZYEJMFDIH-ZROIWOOFSA-N 445.269 4.369 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)c(-n4cccc4)cc3OC)CC2)cc1 110137357 ULCYYAYQNSTRLX-UHFFFAOYSA-N 425.916 4.110 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C\c3cccc(OC)c3OC(F)F)CC2)cc1 209669495 HLWDUCYKDDQQIA-GHXNOFRVSA-N 432.467 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2C[C@H](C)C(=O)N(C)c3ccccc32)C1 570029420 HLYANKAZSZHHRL-IBGZPJMESA-N 444.579 4.054 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3[nH]c4ccc(F)cc4c3Cl)cc2F)CC1 730235025 JRXSBZYKJOKEOB-UHFFFAOYSA-N 432.902 4.171 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)COC(=O)Cn3ccc(=O)c4ccccc43)c2C)c1 744524288 PMAJGLSMKLUQGT-UHFFFAOYSA-N 442.515 4.452 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 753779530 LHMJGJMKXOWSGA-XWGVYQGASA-N 433.600 4.263 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCO[C@@H](c2cccs2)C1 761654397 BIDPZANIULZQIV-GOSISDBHSA-N 437.512 4.101 10 10 IICE C[C@@H]1C[C@@H](COC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 782676821 LRRXRPMXMFVJFR-WREPLZKASA-N 425.597 4.088 10 10 IICE Cc1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)nn1[C@@H](C)C1CC1 784115619 JNIVFPRFFUKJFW-ZDUSSCGKSA-N 444.447 4.098 10 10 IICE CNC(=O)c1cccc(CCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 800049587 RBDVKHPDCVQCII-QGZVFWFLSA-N 427.976 4.185 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccncc4)no3)cc2Cl)C1 800050235 QQSUVFGKCBPRQE-INIZCTEOSA-N 439.947 4.270 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H]2CCC3(CCOCC3)[C@@H]2O)cc1 802244422 URBGUTCRFCHHNR-FDDCHVKYSA-N 436.556 4.466 10 10 IICE C[C@H]1CN(c2ccccc2NC(=O)NCc2cc(Br)ccc2O)C[C@@H](C)O1 806217676 NXWBXRVADUCOKS-OKILXGFUSA-N 434.334 4.090 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@@H](C)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 812251923 JRXQKVXMNBXILT-SIKLNZKXSA-N 435.572 4.147 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CCN(c4ccccc4Cl)C3)cc2F)C[C@@H](C)O1 1125187543 GIPWMPBZHUHJTG-ZIFCJYIRSA-N 445.966 4.235 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(C(N)=O)cc2OC(C)C)CCCC1 1129925647 IRVCBVJFLBYQCK-UHFFFAOYSA-N 435.524 4.054 10 10 IICE Cc1cc(C(=O)[C@@H](C)n2nnc(C(F)(F)F)n2)c(C)n1-c1ccc(OC(F)F)cc1 1190097930 ZJHVYJJRGHEQGX-LLVKDONJSA-N 429.349 4.145 10 10 IICE C[C@H](NC(=O)N[C@H](C)CCc1ccc(I)cc1)c1ccccc1O 1227642960 GEVSIEFPRJOIMB-KGLIPLIRSA-N 438.309 4.378 10 10 IICE CC[C@@H](C)c1nnc(N(C)C2CCC3(CC2)OCCO3)n1Cc1ccc(N(C)C)cc1C 1291432963 PWQQWECDQYYCAN-GOSISDBHSA-N 441.620 4.336 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)[C@H](C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1295512444 KHFIRIGQQDAICV-QRWLVFNGSA-N 442.357 4.146 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1 1296626669 XVPJTGRWMYRGMB-LEWJYISDSA-N 439.556 4.472 10 10 IICE COc1cc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)ccn1 1302149537 NJQDRWBSJZLEJC-UHFFFAOYSA-N 428.330 4.233 10 10 IICE CCC[C@@H](C)N(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1306577912 RPDFLAUEAAXBMF-HXUWFJFHSA-N 427.637 4.358 10 10 IICE C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)c1ccc(N(C)C)cc1 1306829454 FSLCGHDQVMOYHJ-CPJSRVTESA-N 445.563 4.468 10 10 IICE C[C@](Cc1ccccc1)(NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)C1CC1 1312832794 DLDGXXJWXLGDNA-XMMPIXPASA-N 429.511 4.012 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)C[C@H]2CCCCO2)cc1 1313678297 HGUJTAJZUNJKMK-FGZHOGPDSA-N 427.593 4.029 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(C4CCOCC4)cc3)cc2F)C[C@@H](C)O1 1357835636 HTDBURBVSOXATK-QZTJIDSGSA-N 426.532 4.263 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CN(Cc4ccccc4)C[C@H]3C)ccc21 1438328179 NAMYMENANWWMAE-NTKDMRAZSA-N 433.596 4.402 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@@H]1CCN(C2CCCCC2)C1=O 1459464799 LBJOYMMLMMGKKA-JOCHJYFZSA-N 427.589 4.398 10 10 IICE COc1ccccc1S(=O)(=O)CCCN1CCCc2cc(OC(F)(F)F)ccc21 1459691205 LHDIFFQBIIZUEJ-UHFFFAOYSA-N 429.460 4.210 10 10 IICE COc1ccc([C@@H](NC(=O)Cc2ccc(O)c(O)c2)c2ccccc2)cc1Br 1464875089 TUAKOVYCHSYAFE-QFIPXVFZSA-N 442.309 4.317 10 10 IICE Cc1c(Br)ccc(F)c1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1465394831 COHOZBUGNITCDZ-UHFFFAOYSA-N 435.337 4.035 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1nc2cc(Cl)ccc2s1 1469230172 GXMLXKNPJMAQGM-UHFFFAOYSA-N 432.929 4.180 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)Cc3ccccc3C(F)(F)F)CC2)cc1F 1469523487 IQBOEHRSRLMWFS-HNNXBMFYSA-N 439.453 4.316 10 10 IICE COCCC1(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)CCCC1 1504771342 MJXCAXZKVAWSNK-UHFFFAOYSA-N 435.572 4.203 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(-c2csnn2)cc1 1520922975 XOMCQACLXPJVSY-UHFFFAOYSA-N 430.480 4.205 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(N4CCCCC4)cc3)cc2F)C[C@H](C)O1 1542113496 ZTBNTLNLDNJJJV-OALUTQOASA-N 425.548 4.360 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](c2ccsc2)N(C)C)n1 1542564047 PJCKLAMMSSAEQE-NRFANRHFSA-N 448.596 4.355 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1CCCN(C)C1CCCCC1 1554175716 UNBHXOSBEJONNR-UHFFFAOYSA-N 448.615 4.261 10 10 IICE Cc1cc(C(=O)N2CCC(c3nc(N(C)C)n[nH]3)CC2)c(C)n1-c1ccc(C(C)C)cc1 1556578954 JWEZPDRGJDVVQP-UHFFFAOYSA-N 434.588 4.421 10 10 IICE CCOC(=O)Cc1cnc(N(C)C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)s1 1557006280 TZUYRHQHCODUJV-UHFFFAOYSA-N 439.537 4.054 10 10 IICE O=C(CCN1CCN(c2cccc(Cl)c2)CC1)NCc1ccc(N2CCCCC2)cc1 1557140240 UHHJYFSBJYPGMK-UHFFFAOYSA-N 441.019 4.159 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c1 1566185425 HAKUOQINQBJCSK-RUZDIDTESA-N 443.547 4.331 10 10 IICE CC[C@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1586061347 PLKYEVSEIPHHJV-LEWJYISDSA-N 432.406 4.428 10 10 IICE COC(=O)c1c(C)csc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1586917006 LEOSVFMMWHPVDM-UHFFFAOYSA-N 425.554 4.203 10 10 IICE C[C@@H](NC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl)c1ccccc1O 1587444892 QQZMBGYIFOAXJV-SNVBAGLBSA-N 427.238 4.405 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1cnc(C2CC2)o1 1596761687 ZTHFWHDAUMQUBM-SXGWCWSVSA-N 432.498 4.026 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1 1598222472 DYODIHLMOSPXNV-RUZDIDTESA-N 435.543 4.345 10 10 IICE Cc1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(Cl)n1 1598365904 RHYVYWMYBIOWDI-MHWRWJLKSA-N 449.960 4.090 10 10 IICE CC(C)CCN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1606906030 OHZMYWFQIICYSI-UHFFFAOYSA-N 436.629 4.424 10 10 IICE O=C(c1ccccc1)c1c[nH]c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 1611011853 ZALXMCZVFSBHGF-UHFFFAOYSA-N 439.462 4.246 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N(C)C[C@@H](C)c1nccs1 1611964504 ZKMXCMLNSVQTCC-YLJYHZDGSA-N 440.617 4.249 10 10 IICE COCCN(CC(=O)NCc1ccc(N(C)C)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 1615323907 XQNZEXYUEXKSTO-QGZVFWFLSA-N 437.506 4.097 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2ccc[nH]2)n1CCCOC(F)(F)F 1617893170 IWVHDAJYRZJSIF-UHFFFAOYSA-N 448.493 4.436 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1Cc1nc(C(C)(C)C)cs1 1617940755 QYICANOGBUYJEH-UHFFFAOYSA-N 448.596 4.408 10 10 IICE Cc1cc(C(=O)N[C@H](c2ccccc2)C2(CO)CCOCC2)c(C)n1-c1ccc(F)cc1 1639175863 AMOYZPHIPBTHJC-XMMPIXPASA-N 436.527 4.493 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cccc(Nc4ccccc4)c3)cc2)CC1 1645591356 ICSROGCZZBELCJ-UHFFFAOYSA-N 428.536 4.062 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)C[C@@H](O)COCc2ccccc2)c1 1648694424 RUWNBMDXOODZIA-OAQYLSRUSA-N 426.944 4.397 10 10 IICE CCN(C)c1ccc(CN(C)[C@@H](C(=O)OC)c2cc(OC)ccc2Br)cc1 1654517974 UTECLDJQYLARDP-HXUWFJFHSA-N 435.362 4.260 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCc2cc(Br)cnc2OC)cc1 1683949291 NITHCIBOVXGVMM-UHFFFAOYSA-N 435.366 4.041 10 10 IICE COC(=O)C1(CCCCNC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CCC1 1684445043 WVAQDQYVLJKWAV-UHFFFAOYSA-N 425.573 4.449 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCn3c(cc4cc(Cl)ccc43)C2)N(C)C)cc1 1685608801 HIGLBANDIWGETQ-QHCPKHFHSA-N 439.991 4.189 10 10 IICE CC1CCN(C(=O)OC[C@@H]2CCCCN2C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 1686173178 DDBLZOGZGBKEPX-UGKGYDQZSA-N 430.593 4.246 10 10 IICE CCOC(C)(C)Cn1c([C@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695986734 WRJWLDIAHZJFDU-LJQANCHMSA-N 429.609 4.332 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)Cn1c(CC2CC2)nnc1N(C)Cc1ccccc1O 1709897328 IKICUTDGXKZZNA-QGZVFWFLSA-N 443.592 4.218 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1 1728382094 XNUXFVGSGAGQKJ-HSZRJFAPSA-N 448.615 4.486 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC(NC(C)C)CC2)cc1 1728383534 XFWWVAAILUPKOA-UHFFFAOYSA-N 426.653 4.338 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1)OC 1745267136 SAFMFHGKOOKTMW-KNQAVFIVSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)[C@H]2CCSC2)cc1 1764938199 GRLQZKHMWMCGTD-SFTDATJTSA-N 429.634 4.356 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1OCC[C@H]1C 1771032372 SIARLZRVDVHZHU-WZONZLPQSA-N 437.588 4.250 10 10 IICE CCCCCN1C(=O)C(NC2CCN(C)CC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873170802 RFTOUKKLPSRPPJ-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@H]2NCc2cc(Br)ccc2O)C1 1918889234 VOPKVCAIDNUVIO-XLIONFOSSA-N 425.367 4.424 10 10 IICE C[C@H](C(=O)O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951904170 ZSIPUMNIWPINFS-NYHFZMIOSA-N 447.487 4.268 10 10 IICE COc1cccc([C@@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@@H]2C(=O)O)c1O 1952767962 MCSLIMSLOPECMV-RLWLMLJZSA-N 445.471 4.239 10 10 IICE C[C@H](NC(=O)C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 2017518892 MLSVRBFCYPBXOB-HKUYNNGSSA-N 428.529 4.070 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCc1cc(Br)ccc1O)C2 2103452541 UVPSPDUBKIBKIQ-AYGBPOKTSA-N 425.367 4.422 10 10 IICE CC[C@@H](NCC1(COC)CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2178020895 ZZNWVPLQWMQHGX-MRXNPFEDSA-N 443.382 4.079 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)c1cc(I)ccc1Br 2225798354 GEEQCNNXUVBYMY-QWRGUYRKSA-N 435.063 4.015 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)[C@@H](Cc1ccccc1Br)NC(=O)OC(C)(C)C 2237422208 SJGYQKVNJKVPMP-OAHLLOKOSA-N 440.342 4.044 10 10 IICE CCc1cc(C)cc(OCCOc2ccc(C=C3C(=N)N4OC(C)=CC4=NC3=O)cc2)c1 2297347427 JZYNYYLOVMPVNF-UHFFFAOYSA-N 431.492 4.466 10 10 IICE CC(C)CN1C(=O)C(=Cc2ccc(OCC(=O)Nc3ccc(O)cc3)cc2)SC1=S 2331594826 FOYORWYVOAQOIH-UHFFFAOYSA-N 442.562 4.267 10 10 IICE CC1=NN(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(N(C)C)c([N+](=O)[O-])c1 6134698 YJMFVSSKTWAROM-MHWRWJLKSA-N 429.274 4.229 10 10 IICE COCCNC(=O)c1cccc2c1N[C@@H](c1cc(Br)ccc1O)[C@H]1CC=C[C@H]21 14461215 NBWONPMIJBUYLO-IVZHQMGZSA-N 443.341 4.357 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3ccc(OCc4ccc5c(c4)OCO5)c(Cl)c3)C(=N)N2O1 20236904 YUAZCLROLNSJQA-YBLUKIPYSA-N 437.839 4.098 10 10 IICE CCOc1cccn2c(C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)c(CC)nc12 71449784 KAIMCUWNPCYRSW-UHFFFAOYSA-N 439.471 4.323 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)c2ccc(Br)cn2)C1 435548884 RQJQRNQDWVWWIT-UHFFFAOYSA-N 441.373 4.228 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1F 726250464 WZABSCQLOZFBJY-ICSRJNTNSA-N 448.583 4.213 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc(Cl)c1 761745554 KTLXLOJMACQRTO-NDXORKPFSA-N 426.944 4.478 10 10 IICE O=C(Cc1noc(-c2ccc(-n3cccc3)c(F)c2)n1)Nc1nc(-c2ccncc2)cs1 771106362 CUAXFSQMXZGWDF-UHFFFAOYSA-N 446.467 4.366 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C(C)=C1CN(C(=O)OC(C)(C)C)C1 776668975 ZGOJGBPTBYVMPY-UHFFFAOYSA-N 439.350 4.070 10 10 IICE CCN(CC)Cc1nc(C2(NCc3cc(C)cc(Br)c3O)CCCC2)no1 781632269 RZIFQBLVGAYSIE-UHFFFAOYSA-N 437.382 4.247 10 10 IICE Cc1cc(C(=O)O[C@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)cnn1 786403214 VASMZGFFFLJTFT-OAHLLOKOSA-N 429.423 4.222 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnn(CC(F)(F)F)c2)cc1 786940371 SJSQXNHOPPDDOA-UHFFFAOYSA-N 432.446 4.367 10 10 IICE C[C@@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)c(F)cc1O 797103068 MAYNSWBVFFCBCG-SNVBAGLBSA-N 444.732 4.231 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3cccnc3-n3ccnc3)cc2Cl)C1 799863555 WXKPSVTXGZJJPS-KRWDZBQOSA-N 438.963 4.156 10 10 IICE Cc1nn(C)c(C)c1CCCNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799966683 PVBAVNBCWGIRHH-INIZCTEOSA-N 432.012 4.359 10 10 IICE COCc1ccccc1CS(=O)(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 805089055 AHUPQZCFMVRXOS-QGZVFWFLSA-N 437.005 4.342 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(OC)c4ncccc34)n2)cc1 917844697 BPUNPSWOORRRRG-UHFFFAOYSA-N 427.507 4.176 10 10 IICE COc1cc(N2CCN(C(=O)Cc3coc4cc(Cl)ccc34)CC2)cc(OC)c1OC 1127836830 NPRRFVRYNYBVHM-UHFFFAOYSA-N 444.915 4.003 10 10 IICE CCOC(=O)N(C)CCCC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 1136698876 ZYQRCLDSFPRJMV-UHFFFAOYSA-N 427.545 4.163 10 10 IICE Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)NCc3cc(O)ccc3O)cc12 1153879921 ZQGNVSSOMHLUBM-UHFFFAOYSA-N 427.913 4.449 10 10 IICE C[C@@H]1CCCN(C(=O)OC[C@@H]2CCCCN2C(=O)c2cc3cc(O)c(O)cc3s2)C1 1157242447 GIUAFNRGYHACMH-ZBFHGGJFSA-N 432.542 4.176 10 10 IICE Cc1ccc(C(=O)N[C@@H](CC(=O)NCc2ccc3cccnc3c2O)c2ccccc2)cc1 1162612745 PFEIZKLYSJYBFK-QHCPKHFHSA-N 439.515 4.426 10 10 IICE COC(=O)/C=C\c1ccc(N(CCCO)Cc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 1162773117 AHYNXYDXJRURGT-YVMONPNESA-N 439.295 4.477 10 10 IICE CC[C@@]1(C(C)C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)C1=O 1165650152 SLMNUBPTWJUEQB-QFIPXVFZSA-N 433.911 4.426 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@](C)(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1233974046 KPONFIJXOQETDJ-VWLOTQADSA-N 425.573 4.400 10 10 IICE COc1cc(F)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(Cl)c1 1264993090 ZFZJTCPHIZOVJH-UHFFFAOYSA-N 428.838 4.488 10 10 IICE C[S@@](=O)(=NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1 1289018871 JOALZNWTVBSKCO-IICOEKGASA-N 448.566 4.101 10 10 IICE Cc1cc(-c2nnc(N(C)CCCCCO)n2C[C@H]2CC=CCO2)c(C)n1-c1ccccc1 1289356394 RLGHZFNEUNQRLO-HSZRJFAPSA-N 449.599 4.297 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CCc1nc(C(F)(F)F)cs1 1302578306 HLNNGLPISZKPRS-UHFFFAOYSA-N 425.480 4.462 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1cc(C(=O)OC)ccc1OC 1307272940 SQOYDVWZRAAGKK-UHFFFAOYSA-N 440.521 4.429 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2C[C@H](OCc3ccccc3)C2(C)C)N(C)C)cc1 1312555707 KYZJOBMBANDSAF-VXNXHJTFSA-N 438.616 4.038 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCCOC(C)C)CC2)cc1 1315512031 HBZIUBWVLNVNMS-UHFFFAOYSA-N 443.636 4.407 10 10 IICE CCOc1ccc(N2CCN(Cc3nnc(-c4ccccc4Br)o3)CC2)cc1 1340943524 CWQSOBWMFGLRFN-UHFFFAOYSA-N 443.345 4.220 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@H]2CCC[C@@H]2C)c(C)n1-c1ccccc1 1361044805 FRPPBWMZWMBRKF-WAOWUJCRSA-N 448.615 4.489 10 10 IICE COC(=O)CN(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CCCC1 1445922667 FUHVGIKDFQSDPV-UHFFFAOYSA-N 433.346 4.414 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@H]2CCCCO2)c(C)n1-c1ccc(Br)cn1 1452671765 OJURNLJKMMQMBH-QUCCMNQESA-N 432.362 4.329 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)[C@H](C)N4C)cc2Cl)C1 1459584017 OVEOFXKUVAXAOQ-HOTGVXAUSA-N 440.975 4.283 10 10 IICE COC(=O)c1cc(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)oc1C 1464112666 SCZZUCVLWRSJIH-UHFFFAOYSA-N 445.313 4.475 10 10 IICE CC(C)(C)OC(=O)Nc1ccn(C(C)(C)C(=O)NCc2cc(Cl)cc(Cl)c2O)n1 1468667479 HGRBFZXRENVHTL-UHFFFAOYSA-N 443.331 4.294 10 10 IICE Cc1cc(CCNC(=O)N2CCN(CCOc3ccccc3)CC2)c(C)n1-c1ccccc1 1470968890 LPLJHMVJSLJWAB-UHFFFAOYSA-N 446.595 4.043 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCCC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1510603793 DCTNFKRTHDCISG-UHFFFAOYSA-N 448.615 4.457 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCN(CC(C)C)CC1 1510672406 IKDKCVWSSFJNBC-UHFFFAOYSA-N 426.653 4.067 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(Cl)c(Br)cc1F 1516762775 VEPJEXWDDZTHAI-UHFFFAOYSA-N 445.691 4.147 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@H]1c1cccc(F)c1 1524258781 YGURQYKFZZEYAP-DGOQMPSRSA-N 444.528 4.228 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)C[C@@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1542182220 BLLUFBNIPOWDQQ-KDURUIRLSA-N 448.615 4.360 10 10 IICE CC(C)(C)OC(=O)NC[C@H](C(=O)NCCCSc1nccs1)c1ccc(F)cc1 1542956408 VKLKTFUYXTXSIH-INIZCTEOSA-N 439.578 4.189 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Nc2cnccn2)c1 1545040423 DZOXKYDLJJNNII-GOSISDBHSA-N 439.466 4.220 10 10 IICE CCC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C(C)(C)C 1556659172 VVDWJYDWZZYJCM-LJQANCHMSA-N 449.529 4.046 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3cnc4cc(Cl)c(Cl)cc4n3)cc2)CC1 1559282056 ZBICDMOFQHKEBM-UHFFFAOYSA-N 430.339 4.250 10 10 IICE C[C@@H](CNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(Br)cc1 1565412086 QLYHNWZXYFVBHU-KRWDZBQOSA-N 446.389 4.231 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C)n1-c1ccc(F)cc1 1567597405 ZJGARCVJZMQAQR-XMMPIXPASA-N 435.543 4.254 10 10 IICE COc1cc(/C=C\C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc(Br)c1O 1595317889 GVEPSKLZZMOIOA-WDZFZDKYSA-N 445.357 4.434 10 10 IICE Cc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(Cl)n1 1598365905 RHYVYWMYBIOWDI-YBEGLDIGSA-N 449.960 4.090 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2C[C@H]2NC(=O)CC2(C)C)c(C)n1-c1ccccc1 1611933710 MOWJYQCZXKTMRN-JOCHJYFZSA-N 448.615 4.360 10 10 IICE CCC1(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCOCC1 1613733387 KUNZOEYFUUVGPK-UHFFFAOYSA-N 441.620 4.081 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(C)c(F)c1 1616615673 KBCAEAOWRZVADU-IUKKYPGJSA-N 445.554 4.244 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCN(C)C2CCCCC2)NC(=O)OC(C)(C)C)cc1 1618253095 KKYWOMPWURAOFW-JOCHJYFZSA-N 446.636 4.089 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 1625794935 YLXNWGKMDWKOTR-PGRDOPGGSA-N 431.939 4.113 10 10 IICE Cc1cc(C)c(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1Br 1628857954 TVVRPKLVCCEKOO-UHFFFAOYSA-N 445.401 4.412 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1occc1CN1C(=O)Cc2ccccc21 1630180297 NSRAGJCQUOWEOY-GOSISDBHSA-N 431.536 4.104 10 10 IICE Cc1noc(C)c1[C@H](C)CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1632313325 DKSMNTUDBJIONA-LLVKDONJSA-N 431.334 4.390 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCOC[C@@H]2C(=O)OC(C)(C)C)cc1 1632839321 JKPJOUOVMVIQGA-OAQYLSRUSA-N 438.528 4.351 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](C)Cc3cn(C)c4ccc(F)cc34)CC2)cc1 1636112703 BIFQPLUNWGQKLK-GOSISDBHSA-N 438.547 4.179 10 10 IICE COC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1637190768 GBKFUVJTLJYYSO-NRFANRHFSA-N 441.572 4.110 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3c[nH]cc3-c3ccc(Cl)s3)cc2)CC1 1638488332 FLJVFHPLQNRFHC-UHFFFAOYSA-N 442.972 4.028 10 10 IICE O=C(N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1639503275 CWJSKPMBBJPBNM-LBPRGKRZSA-N 431.819 4.448 10 10 IICE COc1ccc(Cn2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cn2)cc1 1640291728 RAPQOWZEQXMOFY-UHFFFAOYSA-N 442.519 4.341 10 10 IICE Cc1c(NCC(C)(C)C)cccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1645591611 JBSUYRJRPCQZAW-UHFFFAOYSA-N 436.600 4.085 10 10 IICE CC(C)(C)OC(=O)NC[C@@]12CCCC[C@H]1CN(Cc1ccc(N3CCOCC3)cc1)C2 1648669257 VFAQEUBYYZWWPT-SQJMNOBHSA-N 429.605 4.040 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1680561705 DXXRMFPVIHQQRS-KBAYOESNSA-N 435.996 4.496 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(-c2ccccc2)n1CCCSc1nccs1 1695695700 RJKIXKFAPBULBJ-UHFFFAOYSA-N 439.614 4.344 10 10 IICE CCOCc1nnc(N2C[C@H](C)C(F)(F)[C@H](C)C2)n1Cc1ccc(N(CC)CC)cc1 1696359107 VWUMEFOZEDEVFJ-HDICACEKSA-N 435.563 4.437 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCOC1 1705654191 ZOPPCEBOAJGENX-OAQYLSRUSA-N 449.624 4.192 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)C3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1707272386 KWIIEPVCQPGMKL-GOSISDBHSA-N 434.588 4.114 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1CCc1cc(C(F)(F)F)ccn1 1729419616 WSODLACHTMSQLJ-UHFFFAOYSA-N 442.445 4.272 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)c(F)c1 1763557146 DPCSDQODZOLHJO-DEYYWGMASA-N 443.489 4.201 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C)CCOCC1 1771066512 SKOYIOJEGZSJGI-UHFFFAOYSA-N 437.588 4.252 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(-c3ccccc3)c2)N2CCOCC2)cc1 1858074890 VTEKOCRCVZVWGD-SANMLTNESA-N 429.564 4.223 10 10 IICE COc1ccc(/C=C/C(=O)NCc2ccc(C(=O)Nc3cccc(N(C)C)c3)cc2)cc1 1859101434 DFQQXWOOGJZXHV-LFIBNONCSA-N 429.520 4.343 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)cc(F)c2O)[C@H]2CCC[C@H]21 1925970721 OAJJBPQYELWHOY-VNQPRFMTSA-N 429.330 4.171 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@@H](CNCc2cccc(Cl)c2O)C1 2025242846 DJJMRRWOCIMRGR-FQEVSTJZSA-N 445.991 4.257 10 10 IICE C[C@H]1C[C@H](CNCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2115816132 BCRJUEBPSIERRG-QWHCGFSZSA-N 431.346 4.419 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(CNCc2cc(Br)cc(F)c2O)C1 2136105922 IIOVBIHYIDIIGC-BFUOFWGJSA-N 429.330 4.031 10 10 IICE CC[C@H](NC[C@@]1(N(C)Cc2ccccc2)CCOC1)c1cc(Br)ccc1O 2155164641 CJNTUKFXNWUVIT-UNMCSNQZSA-N 433.390 4.487 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)cc(F)c2O)C2(CCC2)C1 2264442353 MVTSRSSZXVTZGL-HNNXBMFYSA-N 429.330 4.173 10 10 IICE CCOC(=O)COc1c(C=C2SC(=S)N(Cc3ccccc3)C2=O)cccc1OC 2297500022 FKOJTWKGTGOUSV-UHFFFAOYSA-N 443.546 4.039 10 10 IICE CC[C@H](N[C@]12CO[C@H](C1)[C@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2359240943 IWCCMSNPVTUPKI-VZHLBOQGSA-N 441.366 4.020 10 10 IICE Cc1ccc(CN(C)C(=O)CN(C(=O)OC(C)(C)C)C2CCC2)c(O)c1Br 2380768213 JPIVMSOFCDCWEN-UHFFFAOYSA-N 441.366 4.211 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14473545 USBAQQJDZNTAJR-WHSLLNHNSA-N 427.888 4.451 10 10 IICE CCOCCCNc1cc(N2CCN(CC)CC2)c2noc3c2c1C(=O)c1ccccc1-3 20857855 HTTUODJSGRBTOM-UHFFFAOYSA-N 434.540 4.020 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCc4cccc(C)c4)cc3)CC2)cc1 35853392 BXCQVTRCDOQIFT-UHFFFAOYSA-N 429.564 4.256 10 10 IICE Cc1noc(C)c1COc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 252013839 UMONOSDXMNMXFZ-QFIPXVFZSA-N 436.508 4.397 10 10 IICE CC(=O)Nc1cccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526394091 LXTJWXWWWRXIFU-JOCHJYFZSA-N 434.423 4.253 10 10 IICE CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 729345865 AMADXRDQUCGSDZ-VWLOTQADSA-N 433.596 4.293 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cccc(C[S@@](=O)C(C)(C)C)c3)CC2)cc1 734935766 AESUSDGLGQVXQW-SSEXGKCCSA-N 429.586 4.097 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cnn(-c3cccc(Cl)c3)c2)cc1 751407949 WVAOBXRQNQCFNJ-HSZRJFAPSA-N 438.959 4.413 10 10 IICE CN1C(=O)C[C@H](NCc2cccc(Br)c2O)[C@@H]1c1ccc(Cl)c(F)c1 754832668 JRTQIGDEIXGHBU-RDJZCZTQSA-N 427.701 4.009 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@H](c2cccs2)C1 761769997 CNDIKLLNOUQLOK-YJBOKZPZSA-N 437.512 4.101 10 10 IICE Cc1ccc(/C=C\C(=O)NCc2ccc(N(C)C(=O)/C=C/c3ccc(C)nc3)cc2)cn1 765480565 MSSJRWKFIQVYOL-YCRUPXPOSA-N 426.520 4.099 10 10 IICE O=C([C@H]1CC12CCN(Cc1ccc(N3CCCCC3)c([N+](=O)[O-])c1)CC2)N1CCCCC1 779605713 XBUSZYVCUFXTES-OAQYLSRUSA-N 440.588 4.200 10 10 IICE COc1cc(Br)cc(CN2C[C@@H](C)[C@](C)(CNC(=O)OC(C)(C)C)C2)c1O 810163950 OMRMRSFQIQVBTD-ZUOKHONESA-N 443.382 4.146 10 10 IICE COC(=O)/C=C\c1ccc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 918736247 UPHPBEWVISBNGZ-BFJGBIGKSA-N 426.313 4.348 10 10 IICE O=C1/C(=C\c2ccc3c(c2)OCO3)C(=O)N(c2ccccc2)C(=S)N1Cc1ccccc1 1084446570 XAZUEISFNBBVOZ-DEDYPNTBSA-N 442.496 4.159 10 10 IICE C/C=C/c1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(OC)c1 1136480434 MLFSVPKUZFVLDM-BVBLWJPBSA-N 438.568 4.381 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](Cc3ccccc3)C(=O)N3CCCC3)c2C)c1 1142674906 WXPZMTISILQCDF-RUZDIDTESA-N 429.564 4.366 10 10 IICE Cc1ccc2[nH]c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cc2c1Br 1158717070 LUNJHCWTRCDOCH-HXUWFJFHSA-N 443.389 4.338 10 10 IICE Cc1cc(C(=O)NCc2noc3ccc(F)cc23)c(C)n1-c1ccc(Br)cn1 1171914493 BYSQZLOJRDDSBA-UHFFFAOYSA-N 443.276 4.462 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](c1ccc(F)c(F)c1)c1nccn1C 1251503971 AVAOIYAKKKJHEA-JOCHJYFZSA-N 441.526 4.474 10 10 IICE COc1ccc(N2CCC(NC(=O)C(F)(F)c3cccc(Br)c3)CC2)cc1 1264933801 KSLCIZGXRFBKOZ-UHFFFAOYSA-N 439.300 4.335 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@H]1Cc1ccccc1 1294481917 OVTWOKCKAUCNJC-RVPSJEOCSA-N 440.565 4.261 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(F)(F)F 1301038227 DCWHWWGTKOCLGT-MRXNPFEDSA-N 439.457 4.336 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1OCCC1(C)C 1305379992 BZMBIJHVJPDLLC-UGKGYDQZSA-N 441.620 4.080 10 10 IICE COCCC1(NCc2ccc(Br)cc2O)CCN(C(=O)OC(C)(C)C)CC1 1308909573 AOZPTCNTVUJGRK-UHFFFAOYSA-N 443.382 4.051 10 10 IICE CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)C1 1435046408 UYWSIUQDTNVMBD-FQEVSTJZSA-N 435.568 4.113 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1440715737 RQJZUBUPFLIAMK-QHCPKHFHSA-N 437.584 4.381 10 10 IICE CCc1ccccc1OCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1441654257 VQAYFBSTYZMMDN-UHFFFAOYSA-N 436.474 4.190 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc2c1ccn2CC(C)C 1446818727 YGMZBYNLQBQOQL-UHFFFAOYSA-N 428.916 4.472 10 10 IICE COC(=O)c1ccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1Cl 1459352682 MCCNUBPGBCCCTD-UHFFFAOYSA-N 440.927 4.453 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c(C)n1-c1cccc(Br)c1 1464901593 YLMWVJNZVXBOCQ-HOCLYGCPSA-N 446.389 4.376 10 10 IICE COc1ccc(CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1465952303 ZYIWWCMZDYFQGV-GOSISDBHSA-N 437.367 4.421 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)CC1(O)CCOCC1 1472496548 GIXISGCIAVERES-IBGZPJMESA-N 436.474 4.230 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)c(OC)c1 1479103491 VHVILQPIHNFHLW-UHFFFAOYSA-N 448.567 4.143 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCO[C@H]3c3ccc(Cl)c(F)c3)CC2)cc1 1479118593 YPNSCGIVCMMAQL-YADHBBJMSA-N 447.938 4.240 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCN1C(=O)OC(C)(C)C 1509138926 PMMPRLUEXIAHJN-LJQANCHMSA-N 443.592 4.218 10 10 IICE Cc1cccc(CCCn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)n1 1511199607 WLOXLXOATDFSQA-UHFFFAOYSA-N 448.596 4.312 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCO[C@](C)(CC)C2)cc1 1515529971 APZMVASBAKSBDF-WIOPSUGQSA-N 441.620 4.420 10 10 IICE CCOC(C)(C)Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1516090276 VBLUHPGXJKPNCS-OAQYLSRUSA-N 441.620 4.224 10 10 IICE CCSCCCn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1516939869 NAEKYLIVPRISOT-UHFFFAOYSA-N 431.650 4.192 10 10 IICE COCC[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1519011710 OYZNLZVPPNIEGZ-IBGZPJMESA-N 425.621 4.160 10 10 IICE CCOC(=O)c1c(NC(=O)COC2CCN(C)CC2)sc(C)c1-c1ccc(F)cc1 1523603120 FRXJRNKIAKZZFM-UHFFFAOYSA-N 434.533 4.089 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Oc1cccc2c1OCCC2 1537468877 SXWKQJLXGCICEN-QGOAFFKASA-N 443.521 4.348 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@H](O)C(F)(F)F)c(C)n1-c1ccccc1Br 1545995924 BOICIJVYMSLROW-SJORKVTESA-N 445.279 4.384 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CC(N)=O)CC1 1547019738 CTPPMVFCGKJDGI-UHFFFAOYSA-N 434.588 4.245 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(CCC(F)(F)F)Cc1ccccc1 1565127007 HTBOTRKLQSCHCR-UHFFFAOYSA-N 435.490 4.312 10 10 IICE COCCN(Cc1ccc2c(c1)OCO2)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1565193022 MQXJCESCZZDGJE-UHFFFAOYSA-N 449.551 4.489 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1611255472 MRSGQOZLZLHZKG-CQSZACIVSA-N 429.575 4.108 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCO[C@@H]1C(C)C 1614012328 QUCNYNDCLFUFHG-GBXCKJPGSA-N 441.620 4.017 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCC(C)(C)NC(=O)OC(C)(C)C)cc1 1626107537 YNWFDKAKTPLCHM-OAQYLSRUSA-N 447.620 4.344 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1csc([C@@H](C)NC(=O)OC(C)(C)C)n1 1626722854 LGQDNDGINXCYQA-JKSUJKDBSA-N 446.617 4.464 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)c1 1630930916 KUVQBCHCAQQJBL-HXUWFJFHSA-N 445.563 4.057 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c2C)cc1 1633345641 GEERMVOVEVTSBY-NRFANRHFSA-N 429.561 4.382 10 10 IICE CCOc1ccc(-c2nc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cs2)cc1 1633789227 FRDVDZDQMKGCNB-UHFFFAOYSA-N 437.565 4.100 10 10 IICE COC(=O)[C@@H](C)N(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CCC1 1634013684 KYXGIGUDXVKLDX-OAHLLOKOSA-N 433.346 4.413 10 10 IICE CCN(C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@@H](C)Cc1ccc(OC)cc1 1636353623 FJZXPTZPLADYMB-FPOVZHCZSA-N 425.573 4.193 10 10 IICE COCCN1[C@@H](C)CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@H]1C 1638978546 MVGFRVUDUMXUJI-CALCHBBNSA-N 448.405 4.038 10 10 IICE Cc1ccc(C(=O)N2CCCC[C@H]2COC(=O)NC2CC2)cc1-n1c(C)cc(C=O)c1C 1642093026 OOMOWXALCMIOAM-QFIPXVFZSA-N 437.540 4.098 10 10 IICE CC(C)CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1647297948 WRZDEHHGDANUHO-UHFFFAOYSA-N 444.475 4.081 10 10 IICE CCc1ccc2c(c1)CCN2C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1648616651 SYGYXTUXJZCIJR-UHFFFAOYSA-N 428.535 4.020 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C=Nc4ccccc4S3(=O)=O)c2C)cc1F 1651775106 UCQOWGLQPDGFCJ-UHFFFAOYSA-N 425.485 4.089 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cc1 1652802771 YKSNHJGVVCLVMY-AREMUKBSSA-N 448.538 4.484 10 10 IICE CCOC(=O)c1csc(CC2CCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)n1 1681551247 DFOZUVLQYPDKRE-INIZCTEOSA-N 444.601 4.111 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H](CCc3ccccc3)c3ccccn3)cc2)CC1 1684703637 YPFYJGNHKXIXJC-AREMUKBSSA-N 443.595 4.007 10 10 IICE Cc1cc(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c(C)n1-c1ccccc1 1686984385 WSGARUOOGBAPIO-UHFFFAOYSA-N 431.584 4.201 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCO[C@H](C(C)(C)C)C1 1693006386 XRXYPMSIICXSON-VXKWHMMOSA-N 441.620 4.194 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2ccccc2O)cn1 1695615588 BKSBKHNGMLVYGJ-UHFFFAOYSA-N 446.555 4.478 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCCCO4)n3CCC(C)C)CC2)cc1 1711864969 DETJCSBEQPGAKV-JOCHJYFZSA-N 427.593 4.291 10 10 IICE CCOc1ncc(CCC(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC)cn1 1866260418 MIBIFVSREHIDPG-UHFFFAOYSA-N 425.510 4.270 10 10 IICE Oc1c(F)cccc1Cn1nc(C2CC2)c(I)c1C(F)(F)F 2079041528 ZGJNDCDNDSRWGZ-UHFFFAOYSA-N 426.151 4.277 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C(F)(F)F)c(C(N)=O)c2Br)cc1C 2080033296 JOYMCWHLNXHFGU-CYBMUJFWSA-N 432.240 4.085 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C(C)(C)C)c(C(N)=O)c2Br)c(O)c1 2080056163 PLWBDLXWLLUYFQ-MRXNPFEDSA-N 436.350 4.146 10 10 IICE COc1ccc(Br)c(CNCC[C@@]2(C)CCN2C(=O)OC(C)(C)C)c1O 2227748999 DEQKPHSGYOBTRD-IBGZPJMESA-N 429.355 4.043 10 10 IICE COc1ccc(Br)c(CNC[C@@H](NC(=O)OC(C)(C)C)c2ccco2)c1O 2236052679 KJELOKSNQBVJPZ-CQSZACIVSA-N 441.322 4.112 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)[C@H](Cc1ccc(Br)cc1)NC(=O)OC(C)(C)C 2237413767 LMNOILMVBKNCNV-HNNXBMFYSA-N 440.342 4.044 10 10 IICE CCSC1=NSC2=NC(=O)C(=Cc3cc(C)n(-c4ccccc4OC)c3C)C(=N)N12 2297333728 JWCNJCQXEJFLMN-UHFFFAOYSA-N 439.566 4.433 10 10 IICE CC(C)CCN(C)c1ccc(C=C2C(=O)NN(c3ccc(Br)cc3)C2=O)cc1 2297458344 SWTCYYAFSFPXLQ-UHFFFAOYSA-N 442.357 4.393 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H]1C[C@H]2NCc1cc(Br)cc(F)c1O 2329598701 SWWOXFVOKLOKOW-QMMBQJITSA-N 429.330 4.075 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccccc3C)C2=O)ccc1O 15039125 PKYPYJRUQHJZIH-UYRXBGFRSA-N 442.562 4.329 10 10 IICE COCCn1c(C)cc(/C=C2\C(=O)N(c3ccc(C)c(Cl)c3)C(=S)N=C2O)c1C 33349588 IIWGFECSMLBPMH-YVLHZVERSA-N 431.945 4.385 10 10 IICE CC(=O)N1c2ccccc2N(S(=O)(=O)c2ccc(C)cc2)[C@H]1c1ccc(N(C)C)cc1 59354188 PMVWVPRMMXDIRT-DEOSSOPVSA-N 435.549 4.322 10 10 IICE COc1ccc(N2CCN(C(=O)CSCCCOc3cc(C)ccc3C)CC2)cc1 115386617 RMVBRQKKTFLKBW-UHFFFAOYSA-N 428.598 4.163 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C\c3c(C)nn(-c4ccccc4)c3C)CC2)cc1 207249301 WNEVDRIALYHBCA-YPKPFQOOSA-N 430.552 4.296 10 10 IICE CCOc1cccc(CN2CCOc3ccc(C(=O)NCc4ccc(C)cc4)cc3C2)c1O 257193924 SEOHAYZLSUZTPU-UHFFFAOYSA-N 446.547 4.424 10 10 IICE O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCc1ccc(N2CCC(CO)CC2)cc1 736196229 PKLRLAQWOHEWKS-JXMROGBWSA-N 435.955 4.427 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(O)nc4ccc(Br)cc34)ccc21 737531926 PBOVZYBGFXKQQX-UHFFFAOYSA-N 426.314 4.015 10 10 IICE CSCC[C@@H](NC(=O)c1ccccc1)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 746429600 OBCLJUYQGYPUCW-XMMPIXPASA-N 449.620 4.305 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ncccn1 753779516 LHMJGJMKXOWSGA-JRFVFWCSSA-N 433.600 4.263 10 10 IICE O=C(CCC(=O)c1ccc(F)c(F)c1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 755416418 PMSUUIGWTHIJHV-HNNXBMFYSA-N 438.421 4.314 10 10 IICE CC[C@H](C)n1ncc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C1CC1 768914944 KYXVCLWZRZWTGT-IBGZPJMESA-N 435.616 4.194 10 10 IICE CN(C)c1ccc(CNc2ccc(F)c(N3CCCS3(=O)=O)c2)c(C(F)(F)F)c1 792879115 FWONDRNQKJOKBG-UHFFFAOYSA-N 431.455 4.063 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](c3cnn(C)c3)C(F)(F)F)cc2Cl)C1 800565222 IMYMCOPJOHLGNE-UGSOOPFHSA-N 443.901 4.413 10 10 IICE Cc1cc(I)cc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c1 1129973584 JXLGMWFCYDTSPY-HNNXBMFYSA-N 436.337 4.335 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1142370530 CSMPMQBQWOWSNF-KHCICDEESA-N 444.019 4.390 10 10 IICE C[C@H](CC(=O)NCc1ccc2cccnc2c1O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1142728663 ZKMQTKBABFAHCX-APWZRJJASA-N 427.545 4.230 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]([C@@H](O)c3ccc(Br)cc3)C2)cc1 1160290190 JRUMDCSSXYDIIW-QAPCUYQASA-N 445.317 4.197 10 10 IICE CC1(C)CN(C(=O)OCc2ccccc2)[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1160600652 WRWMKCHZWKXRRJ-SFHVURJKSA-N 437.323 4.362 10 10 IICE O=C(N[C@H](C(=O)NCc1ccc2cccnc2c1O)c1ccccc1)OCc1ccccc1 1162607314 NFBITSKABOEVCJ-QHCPKHFHSA-N 441.487 4.224 10 10 IICE CCOC(=O)c1sc2ccccc2c1CN1CCN(Cc2ccc(N(C)C)cc2)CC1 1192427797 NGFMHAMUFFEREQ-UHFFFAOYSA-N 437.609 4.462 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C1 1230196180 VRFREKDVNAHNMO-ZJOUEHCJSA-N 446.636 4.327 10 10 IICE CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1246305643 YQUSQTBTFRSXFW-UHFFFAOYSA-N 435.399 4.477 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](c1ccc(Br)cc1)N1CCCC1 1265457777 VLYYLGJBUBZFLM-NRFANRHFSA-N 444.373 4.078 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC[C@H]2CC[C@H](C(F)(F)F)O2)C1 1288684288 LHMFOVIFZCSPHU-IIBYNOLFSA-N 437.506 4.024 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2nc([C@@H](C)OCC(C)C)no2)c1 1293950067 OTKVWWAXVCNDPU-GOSISDBHSA-N 438.528 4.295 10 10 IICE Cc1cc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(C)n1-c1cccc(Cl)c1 1296268332 NIDWGRIUSFEKEV-HSZRJFAPSA-N 437.971 4.244 10 10 IICE Cc1cc(CNC(=O)C2(F)CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1302268347 ZZETYBKFBKLVKR-UHFFFAOYSA-N 429.536 4.450 10 10 IICE CCc1nnc(N2C[C@@H](C)O[C@H](c3ccsc3)C2)n1Cc1ccc(N(C)C)c(F)c1 1306109603 GIIDRSFOUFCXMZ-QRWLVFNGSA-N 429.565 4.122 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1ccc(C(N)=O)o1 1306450814 LIZKPBWUAPFGRZ-MRXNPFEDSA-N 431.414 4.304 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)C[C@@H]1C 1306459983 DBRDYNJGPSEMCN-QRGKHIHXSA-N 446.599 4.376 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1315768570 XOKBOIXFEBFZNU-IBGZPJMESA-N 437.588 4.250 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C2CC2)cc1 1353228615 KFULMPQCDVUUDU-MRXNPFEDSA-N 429.923 4.089 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2C[C@]23CCCN(C(=O)OC(C)(C)C)C3)C2CC2)cc1 1354141214 HHJYCNJRGINSPP-OFVILXPXSA-N 427.589 4.281 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 1357723389 UJQZJKJALBVWTK-ONDHQXCVSA-N 446.544 4.476 10 10 IICE CCC1(CC)[C@@H](OC)[C@@H](C)[C@H]1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357950308 JXMURIGKPYKXEL-MUEKUWCCSA-N 425.617 4.364 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)ccc(Br)c3C)CC2)c(OC)c1 1438183852 DZGVJRPCUFKKFO-UHFFFAOYSA-N 433.346 4.046 10 10 IICE COc1ccc(N2CCN(C(=O)c3oc4ccccc4c3Br)CC2)cc1F 1445848972 VZISZWNYTRYCGO-UHFFFAOYSA-N 433.277 4.305 10 10 IICE Cc1cccc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1445914422 ZSPWZRKMRHKIIY-IBGZPJMESA-N 428.330 4.023 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CO)c2ccccc2OC(F)(F)F)c1 1448933409 FPULUFSXAREMKJ-FQEVSTJZSA-N 446.425 4.269 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCCc1cccs1 1457989322 LVYSPFVAKVCMCW-GHRIWEEISA-N 434.583 4.228 10 10 IICE CN(c1ccc(CNC(=O)c2cc(NC(=O)OC(C)(C)C)n(C)n2)cc1)C1CCCCC1 1464537260 MEFMAJOWDQIXNV-UHFFFAOYSA-N 441.576 4.466 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C\SCc2ccco2)NC(=O)OC(C)(C)C)cc1 1465325798 ZSTDUUIMFHJDOF-XYELWLDHSA-N 445.585 4.475 10 10 IICE COC(=O)c1cc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)cn1C 1465491397 UCEXMXGOSDDGKG-UHFFFAOYSA-N 430.302 4.234 10 10 IICE Cc1noc2nc(C(C)C)cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c12 1465951944 SGPFKKPXIQEMFW-KRWDZBQOSA-N 442.947 4.408 10 10 IICE CC(C)c1cnc(S[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1C 1472997801 ORDKINIPLJCXBX-CQSZACIVSA-N 433.533 4.438 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)[C@H](OC)c3ccccc3Cl)C2)cc1 1478466437 ITPHTRFWRHRKAX-JKSBSHDWSA-N 431.964 4.250 10 10 IICE CC[C@H](C)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1495379027 BEYSLBVJXQZKEY-SFHVURJKSA-N 429.584 4.442 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1Cc1nnc(C(C)(C)C)s1 1503487939 PMUKVSUAOYFCRN-UHFFFAOYSA-N 428.606 4.406 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccccc3OCc3ccccc3)CC2)cc1 1519575681 WGCTXKDFSHDGEI-UHFFFAOYSA-N 432.520 4.002 10 10 IICE C[C@@H](C1CC1)n1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1524167093 FBVABDMZVVKNQE-SGPNVBEDSA-N 444.557 4.223 10 10 IICE COc1cc(Cl)c(F)c(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)c1 1530461125 DFWQQKXDQMXEBH-UHFFFAOYSA-N 441.890 4.232 10 10 IICE CCC(F)(F)C(C)(C)CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1535312187 IQGWTSNAHZJMLX-UHFFFAOYSA-N 430.407 4.172 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3ccc(OC)cc3Br)C2)cc1 1537108574 AGZRWVLPCINPGJ-INIZCTEOSA-N 447.373 4.042 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1cnc(Br)c(Br)c1 1539054256 PDCQAEYZFXKEMO-UHFFFAOYSA-N 432.459 4.049 10 10 IICE CC(C)(C)OC(=O)[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(C)(C)C 1545632272 HCXXDDGSIPWTBN-HKUYNNGSSA-N 438.996 4.130 10 10 IICE CC/C=C\Cn1c(-c2ccc(C)o2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1546784136 ZNLWEDBRJPOVEQ-WAYWQWQTSA-N 425.508 4.287 10 10 IICE C[C@@H](NC(=O)c1cccc2c1OCCN(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 1556260604 OGBRAHLKJZATRG-QGZVFWFLSA-N 439.556 4.373 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](O)c3cc(Cl)ccc3OC)ccc21 1556597784 VRLPYELRXSTWBL-NRFANRHFSA-N 430.932 4.030 10 10 IICE CC1CCN(c2cccc(NC(=O)c3ccc(NCCN4CCOCC4)c(F)c3)c2)CC1 1565859366 CTBPYGNXGPDOSF-UHFFFAOYSA-N 440.563 4.058 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1c(F)cccc1F 1566359874 QISQRBASYBJCSQ-OAQYLSRUSA-N 446.494 4.431 10 10 IICE COc1ccc(CNC(=O)/C=C/C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)cc1 1597567523 QJQQGCMGYVCELA-KBZZJAQTSA-N 444.531 4.363 10 10 IICE CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1=O 1608448692 XAKPLFHCYJRPDK-SANMLTNESA-N 444.535 4.213 10 10 IICE COc1cc(N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])cc1OC 1611753195 VHNJMBYJVHUEFH-UHFFFAOYSA-N 439.434 4.343 10 10 IICE FC(F)Oc1ccc(-n2nnnc2CN2CCCc3cc(OC(F)(F)F)ccc32)cc1 1615954557 SMMNSQAOFQTYEA-UHFFFAOYSA-N 441.360 4.115 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC2CCCC2)n1CCC(C)(C)O 1617893497 OLHADRDSFQBMIY-UHFFFAOYSA-N 425.621 4.408 10 10 IICE COc1ccc(N2CCN(C(=O)CCCOc3ccc4c(c3)CCCC4)CC2)cc1F 1622563646 AEXIVVIXHNFFKC-UHFFFAOYSA-N 426.532 4.221 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(C(=O)N3CCCCC3)c2)cc1 1626105262 ACIJFHJLRCMXCC-RUZDIDTESA-N 449.595 4.200 10 10 IICE CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1626946464 OTKFESXAFDYVPS-UHFFFAOYSA-N 431.536 4.271 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc4ccccc4cc3NC(=O)C(C)C)C2)cc1 1629084482 PBTHJOAMLVMVCO-FQEVSTJZSA-N 431.536 4.452 10 10 IICE Cc1nc(CCCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cs1 1629679095 KTZBCMVVHZFYLM-FQEVSTJZSA-N 446.617 4.222 10 10 IICE Cc1noc(-c2ccc(CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc2)n1 1632443137 GUBFGHRVIPXGRA-UHFFFAOYSA-N 428.492 4.124 10 10 IICE CC(=O)N1CCN(c2ccc(NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)cc2)CC1 1632630851 ZSKPSRQAWLYOLH-UHFFFAOYSA-N 430.552 4.323 10 10 IICE C[C@H](NC(=O)c1nn(-c2ccc(Cl)cc2C(F)(F)F)cc1O)c1ccccc1O 1635804238 QVYKKMGCXKIRBF-JTQLQIEISA-N 425.794 4.447 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCN(c4cccc(Cl)c4C)CC3)C2)cc1 1636354130 QZISRVDDZKFOLN-LJQANCHMSA-N 442.991 4.015 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCCC23OCCO3)c(C)n1-c1ccccc1Br 1637025436 WXWQQLCXNJEECE-LJQANCHMSA-N 433.346 4.272 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1c[nH]nc1[N+](=O)[O-] 1648493404 FEEVPXIMWBZOPG-MRXNPFEDSA-N 433.390 4.243 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NCc3ccc(C4CCCCC4)cc3)cc2)CC1 1681384962 DNYIEJJKYPYBAE-UHFFFAOYSA-N 448.611 4.435 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H](N(C)C(=O)OC(C)(C)C)C1 1683421084 DOLWEPJENVTEDZ-NQIIRXRSSA-N 432.609 4.033 10 10 IICE C[C@@H]1CN(CCOc2ccc(CCNC(=O)NCc3cccc(Cl)c3O)cc2)C[C@H]1C 1685931806 JQKJYPLKZULYBY-QZTJIDSGSA-N 445.991 4.054 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)CC[C@H]1C 1705895561 LAOXBRIRIFSWQK-RBUKOAKNSA-N 446.599 4.280 10 10 IICE O=C(CCCCCNC(=O)c1ccccc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1859466350 RKRQZJZYJMYHIG-UHFFFAOYSA-N 440.499 4.391 10 10 IICE CCN1C(=O)Cc2cc(-c3nc(NS(=O)(=O)c4ccc(C)cc4)sc3C)ccc21 1859570581 WOLCTZVXWSMWNA-UHFFFAOYSA-N 427.551 4.137 10 10 IICE COC(=O)c1c(NC(=O)C2CCN(C(=O)C3CC3)CC2)sc(C)c1-c1ccc(C)cc1 1860627349 FDUPGERRQUSUEU-UHFFFAOYSA-N 440.565 4.406 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ncc(C)s2)sc(C)c1-c1ccccc1 1860767731 FRHCSWAFDFJZAK-UHFFFAOYSA-N 429.523 4.242 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC12CC(NCc1cc(Cl)cc(Br)c1O)C2 1965973251 WYNWFHOWCDBGGO-HZEYSBKDSA-N 431.758 4.344 10 10 IICE COc1ccc([C@H](n2nc(C(F)(F)F)c(CO)c2Br)C2(C)CC2)c(O)c1 2079873046 JNYJSOKORSDFIG-AWEZNQCLSA-N 435.240 4.260 10 10 IICE C[C@H](C(=O)Nc1ccc2oc(=O)ccc2c1)N1C(=O)C(=Cc2ccccc2)SC1=S 2296552765 NZHKEBGQYPZAGL-CYBMUJFWSA-N 436.514 4.021 10 10 IICE O=C(O)Cc1ccc(N2C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)cc1 2321585778 IQXKYGZDRDRHOF-UHFFFAOYSA-N 434.882 4.281 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(C(=O)OC)c3)C2=O)ccc1OC 2321718262 RPJUWYZDOYZOKJ-UHFFFAOYSA-N 429.519 4.286 10 10 IICE Cc1ccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCCC2)c(O)c1Br 2380725815 MVGWARHESXOLKG-INIZCTEOSA-N 441.366 4.163 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380741070 CIAMSLWEYGGCJJ-HUUCEWRRSA-N 441.366 4.163 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)c3cc(C)cc(C)c3)c3ccco3)CC2)cc1 38605921 AKZIZYWUJSABEA-DEOSSOPVSA-N 433.552 4.198 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccn4c(-c5cccc(Cl)c5)nnc4c3)CC2)cc1 65296766 IVGNXFMDWGTICR-UHFFFAOYSA-N 447.926 4.021 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1ccc2nccnc2c1 102739357 CTZQKGNOLMNIES-CPNJWEJPSA-N 434.546 4.250 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc4c(c3)ncn4C)no2)C1 564254748 ZCVNJFUUMPAEKZ-UHFFFAOYSA-N 426.524 4.393 10 10 IICE CN1CC[C@H](NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H]1c1ccccc1 758968974 ZOMGWGJPWRMRFS-VXKWHMMOSA-N 444.526 4.001 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@H]3CCCCN3C2=O)c(C)n1-c1cccc(C(F)(F)F)c1 761206618 LZXZKEYZQSOFJC-GOSISDBHSA-N 433.430 4.112 10 10 IICE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 779706667 VWWDNPVAZLFRSY-PXNSSMCTSA-N 443.544 4.343 10 10 IICE CCn1c(CNC(=O)NCc2ccc(N(C)C)cc2C)nc2cc(Br)ccc21 790373552 CLIPXVORPXCYQG-UHFFFAOYSA-N 444.377 4.193 10 10 IICE Cc1cc(-c2nnc(N3CCC(C(=O)N4CCCCC4)CC3)n2C)c(C)n1-c1ccccc1 800742494 QJVZNCRGUJBZHX-UHFFFAOYSA-N 446.599 4.119 10 10 IICE C[C@H](CC(=O)N(C)Cc1ccccc1Cl)NCc1cc(Br)ccc1O 809712741 CTQYMLFBHCUAOH-CYBMUJFWSA-N 425.754 4.335 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 810449796 NYRXPMXNPMVTKF-AWEZNQCLSA-N 439.528 4.333 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccccc1OCc1ccccc1F 1084650617 UTTFTBRDIOLRRQ-UYRXBGFRSA-N 434.398 4.210 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1CCN(C2CCCCC2)C1 1139584738 JLRROIHFHZNBBU-LJQANCHMSA-N 429.605 4.030 10 10 IICE COCC(=O)N1CCc2c(NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)cccc21 1153877113 OUWWXJQTPMZZFC-UHFFFAOYSA-N 431.536 4.499 10 10 IICE C[C@@H](NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1)c1ccccc1O 1171722742 CNEIKJJOFMXHNJ-UKRRQHHQSA-N 449.320 4.023 10 10 IICE Cc1cc(C(=O)N[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccn1 1171814832 NYBRQNXFNQFZSJ-QGZVFWFLSA-N 426.561 4.255 10 10 IICE O=C(NCc1cccc(-c2nc(CC(F)(F)F)no2)c1)NCc1cccc(Cl)c1O 1229445903 KYBPXBRSANFCRL-UHFFFAOYSA-N 440.809 4.200 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1[C@H]2CC[C@H]1CC(CC(F)(F)F)C2 1233603457 DTEQQBGFGKWFNU-OALUTQOASA-N 425.495 4.053 10 10 IICE CC(C)(C)OC(=O)Nc1ccnc(CNC(=O)NCc2c(O)ccc3c2CCCC3)c1 1251120816 MUYLTXJSZPMDJP-UHFFFAOYSA-N 426.517 4.012 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2cnn(-c3ccccc3)n2)c(C)n1-c1ccccc1 1253808775 XSAMJORKAIUHNL-UHFFFAOYSA-N 428.540 4.059 10 10 IICE COc1ccc([C@@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccc2)cc1 1256237093 QRNPUFLHZNFHQU-FTJBHMTQSA-N 446.595 4.453 10 10 IICE Cc1nn(C)c(C)c1Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1290558694 SAOKXYLMMBUUMD-UHFFFAOYSA-N 435.620 4.112 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1293620427 WCGUHAHCNJMIHS-IBGZPJMESA-N 425.529 4.036 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CCc2cc(Br)ccc21 1293928700 IUQOFVMOLSBHGE-JOCHJYFZSA-N 443.385 4.004 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCc3cccc(C)n3)CC2)cc1 1300247188 IUUNYHHGGSPOAH-UHFFFAOYSA-N 448.615 4.148 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H]2OCCC[C@@H]2C1 1304238204 MHDQHIGZMPFWRY-IFMALSPDSA-N 425.621 4.295 10 10 IICE COC(=O)/C=C/c1ccc(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c([N+](=O)[O-])c1 1306983332 WZGAVASGRQAMAC-WQRDJFRPSA-N 447.438 4.463 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC/C=C/c3ccc(Br)cc3)C2)cc1 1312995278 UMDDVWIRQCHHIB-NLJSWGTCSA-N 444.373 4.439 10 10 IICE CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3cccc(Cl)c3C)n2)cc1 1318242351 YAZXJFFAFJIFPT-UHFFFAOYSA-N 435.958 4.209 10 10 IICE CC(C)Cn1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C(F)F)n1 1356036383 FTBGVMJEZBGYRT-HUUCEWRRSA-N 438.494 4.159 10 10 IICE CC(=O)N1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)CC1 1359375069 YJICVOWJAVZIJD-UHFFFAOYSA-N 448.615 4.457 10 10 IICE Cc1cccc(CNC(=O)c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)cc2)c1 1442385461 BKKSIWUKHYZJHN-UHFFFAOYSA-N 427.548 4.237 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2n[nH]cc2I)c1 1453767972 DCPYKFRERGTVAV-UHFFFAOYSA-N 440.672 4.328 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2ccc(C3(C)OCCO3)cc2)cc1 1471031753 PZDHMPJDYMLYPU-UHFFFAOYSA-N 449.551 4.477 10 10 IICE CCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1527481224 GOJIKNIRXQGCKZ-CALCHBBNSA-N 430.520 4.167 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(C)c(NC(=O)c3ccccc3)c2)cc1 1531374843 MABWTUCMLABWEJ-UHFFFAOYSA-N 431.536 4.464 10 10 IICE C[C@@H](NC(=O)c1cc(Br)cnc1Br)c1ccc(N(C)C)cc1 1537680556 YBKIZRFKOFPXCB-SNVBAGLBSA-N 427.140 4.164 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1541577859 CJAOVTDVQCXQQF-OAQYLSRUSA-N 425.621 4.258 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CCC(OC(C)C)CC1 1542226638 DUMUFEIGNPCFMX-HSZRJFAPSA-N 441.620 4.336 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCO[C@@H]2C(C)C)c(C)n1-c1ccc(Br)cn1 1544926913 BVFIAXUZXIONEX-OXJNMPFZSA-N 434.378 4.433 10 10 IICE CCOc1ccc2c(c1)[C@H](NC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)CCO2 1556275453 PMJBJPICMGZUIL-XMMPIXPASA-N 432.520 4.488 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cc(O)c(F)cc1F 1556919961 XQDRNCSZPLMSJE-CHHVJCJISA-N 440.518 4.352 10 10 IICE CCN1CCC(N2CCCN(C(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)CC1 1557073290 JLKLDPZPLKPXST-UHFFFAOYSA-N 443.035 4.380 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)c([N+](=O)[O-])c1 1559053588 XGAPWHMXEUUEPP-SOFGYWHQSA-N 435.402 4.126 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@H]3c3ccc(C(C)C)cc3)CC2)cc1 1559718242 DLEZDGDPEIDBMS-VPUSJEBWSA-N 437.628 4.139 10 10 IICE COC(=O)COc1ccc(N(C)Cc2nc3ccccc3n2-c2ccc(OC)cc2)cc1 1559741324 LFGCNMXRRIDUCZ-UHFFFAOYSA-N 431.492 4.222 10 10 IICE Nc1c(Cl)c(F)cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1Cl 1566357166 XYRBZLZUSXWTKJ-GFCCVEGCSA-N 446.737 4.468 10 10 IICE C[C@@H](C1CC1)n1nccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1584821610 WBSZMXRDXYIEKH-IGWPVBGESA-N 444.557 4.223 10 10 IICE CCc1nc(C)c(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1596303056 KKBGFBOOFLZZFE-MHWRWJLKSA-N 434.514 4.019 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CC(=O)N(CCc4ccc(F)cc4)C3)c2C)c1 1624075517 RSZFIQMVXHHRED-HSZRJFAPSA-N 447.554 4.249 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)cc1 1624286084 GJBXUGSSFZYGBX-UHFFFAOYSA-N 428.876 4.332 10 10 IICE CN(c1ccc(CNC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)cc1)C1CCCCC1 1627006591 RYJXYLAPIBVUGC-UHFFFAOYSA-N 426.582 4.322 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3Cc4cc(Br)ccc4O3)cc2)CC1 1628608971 RQTZZBQDDBKYJJ-NRFANRHFSA-N 429.358 4.305 10 10 IICE COc1ccc(OC)c(CN2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)c1 1629506884 ANWSOZJGCCVHPV-UHFFFAOYSA-N 433.552 4.069 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(-n3ccnn3)cc2)cc1 1633066470 OSIYZVPZHFHPLV-UHFFFAOYSA-N 427.508 4.189 10 10 IICE Cc1cc(C(=O)Nn2cc(Br)cn2)c(C)n1-c1ccccc1Br 1636963739 ZGSHRBFVWDHLEP-UHFFFAOYSA-N 438.123 4.200 10 10 IICE Cc1cc(C(=O)Nc2ccnc(-n3cccn3)c2)c(C)n1-c1ccc(Br)cn1 1637364675 VLWMQCOWIJHCPY-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CCc1nc(C)c([C@H](C)N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)s1 1641837480 CGFYUIDKHZFDCT-HNNXBMFYSA-N 447.560 4.421 10 10 IICE C[C@H]1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c2ccccc21 1642168470 XGNOJWVTNQQILB-IPMKNSEASA-N 425.548 4.069 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](n3ccnn3)CC2)c(C)n1-c1ccccc1Br 1642467753 OKOUDZAEVXOTRD-KRWDZBQOSA-N 442.361 4.316 10 10 IICE O=C(NCc1cccc(O)c1O)c1cccnc1SCc1cccc(Br)c1 1643809843 UQJUEZPREXCKCQ-UHFFFAOYSA-N 445.338 4.478 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cccc4c3CCN4C(=O)OC(C)(C)C)C2)cc1 1645242928 VUVYVJREDIAFEP-KRWDZBQOSA-N 437.540 4.002 10 10 IICE O=C(NCc1c(O)cccc1F)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1 1646028193 BKBWMOLLTKNIRJ-UHFFFAOYSA-N 444.388 4.457 10 10 IICE Cc1cc(C(=O)Nc2ccc(CO)c(CO)c2)c(C)n1-c1cccc(Br)c1 1647829626 UPKOAGOATQSNKA-UHFFFAOYSA-N 429.314 4.094 10 10 IICE COc1ccc(C(=O)NCc2c(O)ccc3ccccc23)c(I)c1 1652708554 HMWMETXBQUPJLR-UHFFFAOYSA-N 433.245 4.089 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]3[C@@H](C2)C3(F)F)sc(C)c1-c1ccccc1 1653831044 ZCWXMKSTHJPBRK-HZPDHXFCSA-N 434.508 4.426 10 10 IICE COC(=O)c1ccc2c(c1)[C@H](CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)CCC2 1683252946 AYDNOVJECIKZPQ-AVRDEDQJSA-N 437.584 4.198 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@H](C)C1 1698221678 JHLWQTUHEPZXPP-RTBURBONSA-N 437.588 4.108 10 10 IICE Cc1c(CN(C)c2nnc(CC(C)(C)C)n2CCCSc2nccs2)cnn1C 1707014804 MTNUCUQKHMOSLS-UHFFFAOYSA-N 433.651 4.184 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCC(NC(C)C)CC1 1707305567 DKZURNXMCQKVBU-UHFFFAOYSA-N 438.664 4.400 10 10 IICE C[C@@H]1CCC[C@](Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1708027836 RKHYIGYKLHDNFG-ZJCBTPCYSA-N 441.620 4.025 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@H](CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1709316017 FZAVNYOSZSJIDV-CNNODRBYSA-N 443.661 4.397 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccc(Cl)cc3)n2CCCSc2nccs2)CCO1 1726668597 SMPVSJLOIOBGGC-CQSZACIVSA-N 436.006 4.463 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1730849885 AQXDHKAEEYZVDY-SFTDATJTSA-N 443.636 4.297 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)Cc2cnn(C)c2)cc1 1746091998 ADFJSEFBVPNPGT-UHFFFAOYSA-N 435.620 4.275 10 10 IICE COCC1(C)CCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1749389631 VEHBTITTZHYYKO-NRFANRHFSA-N 445.583 4.026 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@@H]3C)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1761676345 GMBZWSULRNPUHZ-QUCCMNQESA-N 448.615 4.360 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC1(C)C 1769110360 SBXCYXDNSJJCPI-OAQYLSRUSA-N 439.629 4.214 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N([C@@H]2CC(=O)N(c3ccc(C)cc3)C2=O)C1=O 1772759310 MHYXYOUEGHKRLY-NCFHLEHDSA-N 448.569 4.475 10 10 IICE COC(=O)c1cccc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)c1 1860086998 UXRPMSKIWPRUPD-OVCLIPMQSA-N 429.548 4.205 10 10 IICE COC(=O)c1c(NC(=O)CC2CCS(=O)(=O)CC2)sc(C)c1-c1ccc(C)c(C)c1 1866195841 XKNXJDQHVLXWBS-UHFFFAOYSA-N 449.594 4.280 10 10 IICE O=C(O)C=C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951381072 HDVMCZNOBAPQAM-QGZVFWFLSA-N 445.471 4.188 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]21CNCc1c(O)cccc1Br 2089369523 ONTTUXGFTIUDRN-VLIAUNLRSA-N 425.367 4.424 10 10 IICE NCc1ccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)c(F)c1Br 2093142686 IYWNCYZJCYJWPR-UHFFFAOYSA-N 428.296 4.004 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@H](F)CNCc2ccc(Br)cc2O)CC1 2106954873 CVDOUMXHSQMSJH-MRXNPFEDSA-N 431.346 4.230 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1ccc(I)c(Br)c1 2225802093 XNTAVXYXBZRHTD-MNOVXSKESA-N 435.063 4.015 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@H](N)c3ccnn3Cc3ccccc3)cc2)CC1 2270550822 JPVSKQLRNNOBTQ-DEOSSOPVSA-N 447.583 4.037 10 10 IICE CSc1ncc(CNc2cc(F)c(I)cc2[N+](=O)[O-])s1 2284631087 SZIOPEVZCDWKIR-UHFFFAOYSA-N 425.248 4.129 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCc3ccc(OC)c(OC)c3)C2=O)ccc1O 2296664704 YMNPZTURDKTKKQ-UHFFFAOYSA-N 445.562 4.252 10 10 IICE CCOC(=O)COc1c(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)cccc1OC 2297356864 CTBLSTJIIGQJJA-UHFFFAOYSA-N 447.509 4.182 10 10 IICE CN1C(=O)C(=C(Cc2ccccc2)C(=O)Nc2nc3ccccc3s2)SC1=S 2314489877 UBXOUUHSDNKYCL-UHFFFAOYSA-N 425.560 4.222 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccccc2C(=O)O)cc1 2332131938 WIGUAHNIPYFLMG-UHFFFAOYSA-N 428.444 4.237 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3CC[C@H]2CN3C(=O)OC(C)(C)C)c(O)c1Br 2352685903 ZHILCSYFBZRSMX-XHSDSOJGSA-N 425.367 4.341 10 10 IICE CC[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1=O 8891494 SDLHPBPPRAYPMJ-VWLOTQADSA-N 433.483 4.273 10 10 IICE COc1ccc(-n2c(C)cc(CNS(=O)(=O)c3ccc(OC)c(Cl)c3)c2C)cc1 9527515 OOSYLMRRZDWANQ-UHFFFAOYSA-N 434.945 4.243 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@H]3C=CC[C@H]32)cc1O 14457161 ZOVVGTLONBBCFS-JKSBSHDWSA-N 428.554 4.304 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccccc2O)SC1=S)Nc1ccc(O)cc1 15044321 XFPYRYZWFJZRRG-RGEXLXHISA-N 442.562 4.498 10 10 IICE Cc1ccc(Oc2nc3ccccn3c(=O)c2/C=C2/SC(=S)N(C(C)C)C2=O)cc1 35212412 SHHBOIDGSQQIFS-SFQUDFHCSA-N 437.546 4.405 10 10 IICE CCCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1OC 40840462 LZFJQZMPPCMGBP-UYRXBGFRSA-N 442.562 4.339 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 40888762 ZDXMAZUJVVRRHT-RGEXLXHISA-N 427.547 4.420 10 10 IICE C[C@@H](Oc1ccc(-c2cnc3ccccc3n2)cc1)C(=O)NCc1ccc(N(C)C)cc1 65031770 QZBITLQQIIHFBI-GOSISDBHSA-N 426.520 4.447 10 10 IICE CCO[C@H]1C[C@](NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)(C(=O)OC)C1(C)C 781997821 PBPMPPLWLVNFAT-RDPSFJRHSA-N 438.528 4.377 10 10 IICE Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)c(C)n1-c1ccccn1 914903166 HRCLRMBQDZFXQK-LJQANCHMSA-N 432.524 4.273 10 10 IICE CCOc1ccc(NCN2C(=O)/C(=C/c3cc(OC)ccc3OC)SC2=S)cc1 1084481962 WLHBYMVMKPXQKV-UNOMPAQXSA-N 430.551 4.373 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1125187358 DNQDZMIAFPQBFM-GJZGRUSLSA-N 447.482 4.077 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3cc(Br)cnc3OC)ccc21 1127326886 PEMJHZATKDHCDI-UHFFFAOYSA-N 447.329 4.428 10 10 IICE CCCN1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@H](CC)C3)CC1=O 1128128188 HAAYGJQRFNZLAU-LSDHHAIUSA-N 434.602 4.415 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(C)c(-c2ccccc2)s1 1138055304 RWWGWABFXVZZSV-KRWDZBQOSA-N 425.506 4.039 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccccc2N(C)C(=O)c2ccc(Br)o2)c1 1147957842 YLBXTDWQVPYWKP-UHFFFAOYSA-N 443.297 4.263 10 10 IICE COc1ccc(-n2cc(CNC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)nn2)cc1 1149759965 ZLQGRJIYBPMZDY-UHFFFAOYSA-N 435.915 4.267 10 10 IICE C[C@H](NC(=O)c1ccc2n1CCN(C(=O)OC(C)(C)C)[C@H]2C)c1ccc(N(C)C)cc1 1154669108 RCKXBEVYOKKWPE-IRXDYDNUSA-N 426.561 4.357 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2cccc3c2OC(F)(F)O3)cc1 1167256833 DJLLDYSCKPAQFE-UHFFFAOYSA-N 440.446 4.130 10 10 IICE CCCN(CC(F)(F)F)C(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1191582381 QEQHUNDNPFRTRL-UHFFFAOYSA-N 428.476 4.327 10 10 IICE CC(=O)N(C)c1ccc(CNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1 1253197360 OHKGDXGLMTYUMU-UHFFFAOYSA-N 434.540 4.240 10 10 IICE Cc1cc(C(=O)NCCc2ccc(CO)cc2)c(C)n1-c1cccc(Br)c1 1295590687 SELRXUCKNNMFLQ-UHFFFAOYSA-N 427.342 4.321 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 1307922776 AOOLQAAKIFUDHH-QHCPKHFHSA-N 443.632 4.382 10 10 IICE COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1308062151 QQUMGIVKJOCUBU-DLBZAZTESA-N 442.515 4.457 10 10 IICE Cc1sc(NC(=O)CSc2nncn2C)c(C(=O)OC(C)C)c1-c1ccccc1 1353000739 UIPBSVHUFLKJAP-UHFFFAOYSA-N 430.555 4.148 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](c1cccc(Br)c1)N1CCCC1 1435286582 MEAVOLFXJBLRAS-NRFANRHFSA-N 444.373 4.078 10 10 IICE Cc1cc(OC(F)F)c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1435574269 WBIDLWLSTIAQGJ-UHFFFAOYSA-N 435.540 4.120 10 10 IICE Cc1ccccc1CC(=O)N1CCN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 1443001705 AFPNYEIZDVSYII-UHFFFAOYSA-N 429.564 4.238 10 10 IICE COc1ccc(/C=C(\C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1F 1445887968 WKIBBNHKHSYGLU-JVVYVMHDSA-N 432.923 4.377 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnn(-c4cccc(Cl)c4)c3CC)CC2)cc1 1446416802 RUTKYEYECVHPRI-UHFFFAOYSA-N 438.959 4.449 10 10 IICE CCC[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@H](O)c1ccccc1 1448956065 DFRGMENRVLQNQI-WNCULLNHSA-N 433.596 4.426 10 10 IICE COCc1csc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1453529142 YAYFZLBMNCDEHU-UHFFFAOYSA-N 434.359 4.390 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3nccs3)C2)c(C)n1-c1ccc(Br)cn1 1455223598 RZIWUQFIDLYQSW-AWEZNQCLSA-N 431.359 4.338 10 10 IICE CN(C)[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Cl)cc1 1465952252 YVCVCTVBZPPQRF-TZIWHRDSSA-N 436.383 4.083 10 10 IICE CCOC(=O)c1n[nH]c([C@@H](CC(C)C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)n1 1467593815 FXNHPMPAGRGGDO-LJQANCHMSA-N 437.544 4.215 10 10 IICE O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)NCc1cc(Cl)ccc1O 1469876087 AUVBRQHBTSQQRY-UHFFFAOYSA-N 440.912 4.295 10 10 IICE Cc1cc(C(=O)NCCOCCN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1470242984 XXUWVTIUHGYKLJ-UHFFFAOYSA-N 449.979 4.361 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2C)cc1 1472281327 VFFXARAYHHHJNK-VWLOTQADSA-N 434.584 4.201 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C(C)(C)C1 1479075456 LOUOMCRIEQIWQQ-FQEVSTJZSA-N 431.577 4.106 10 10 IICE C[C@H]1CN(c2nnc(C3CCC3)n2CCCSc2nccs2)C[C@H](C(F)(F)F)O1 1494323962 TWIVINWSITTWGV-GXTWGEPZSA-N 447.552 4.341 10 10 IICE CCOCCC1(Cn2c(CC)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCC1 1516671016 YLVQBVXVZIGCQD-UHFFFAOYSA-N 441.620 4.163 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)CCCC4)cc2F)C[C@H](C)O1 1516818320 UAAQLUOCNAGACY-ROUUACIJSA-N 426.532 4.013 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](c1cccc(Br)c1)N1CCCC1 1530833735 SZYQYPHIMXNBEM-NRFANRHFSA-N 430.390 4.277 10 10 IICE CC[C@@H](Cc1cccc(Br)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1533682275 CRBACWDCJBABPP-FQEVSTJZSA-N 444.417 4.086 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(Cl)nc(C2CC2)c1 1534129479 FCIQPYBKWVKRJO-UHFFFAOYSA-N 439.865 4.398 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccnc2OC2CCCC2)cc1 1543835854 JEJBADLZNBIFQJ-UHFFFAOYSA-N 431.536 4.482 10 10 IICE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(-c2ccc(F)cc2)cc1 1566452870 USSKRSMNDBMFQJ-CQSZACIVSA-N 428.485 4.061 10 10 IICE Nc1c(Br)cc(Cl)cc1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1597088799 AYOLTFXSMVBNIX-CQSZACIVSA-N 439.737 4.212 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C1 1612673084 XHIDCYWOKDCXAF-CALCHBBNSA-N 428.631 4.385 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)c2C)c1 1613642107 MCKPXMLQTIFXOD-UHFFFAOYSA-N 432.436 4.010 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1csc(-c2ccc(C)cc2)n1 1631531087 GUAHWOHZIJPLLZ-UHFFFAOYSA-N 444.940 4.222 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-n2c(C)ccc2C)cc1 1632701527 GHHVIFFUXIFOCQ-UHFFFAOYSA-N 426.900 4.269 10 10 IICE Cc1ccc(-n2ncc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)c2C(C)C)cc1 1633789723 PKYBXYOVDAIUOI-UHFFFAOYSA-N 432.568 4.195 10 10 IICE CC[C@H](C)c1nc([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n[nH]1 1634754528 IPGIXPRWGHXJFS-WCQYABFASA-N 445.365 4.374 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(NCC(C)(C)C)c3C)CC2)c(OC)c1 1634886954 YNSFMFDNUUNFDG-UHFFFAOYSA-N 425.573 4.433 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@H]2CC(=O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1635623322 UEEWITLGKVJROA-OAQYLSRUSA-N 440.927 4.383 10 10 IICE CCN(C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)[C@@H](C)Cc1ccc(OC)cc1 1636353624 FJZXPTZPLADYMB-PZJWPPBQSA-N 425.573 4.193 10 10 IICE COc1cc(NCCCNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)ncn1 1638690359 YKIPQCNYVISWMP-UHFFFAOYSA-N 433.516 4.199 10 10 IICE COc1ccc(C)cc1CSCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1643791452 WTJIJYQSENDERS-HDICACEKSA-N 446.588 4.306 10 10 IICE CC(C)(C)OC(=O)NC[C@]12CCCC[C@H]1CN(Cc1ccc(N3CCOCC3)cc1)C2 1648669255 VFAQEUBYYZWWPT-OFVILXPXSA-N 429.605 4.040 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1 1680689976 QDOSAUQDBQHNKL-CMKODMSKSA-N 432.609 4.079 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(Cc3ccccc3)C[C@H](O)c3ccccc3)C2)cc1 1683782681 SJBMOSLKMUYUKQ-BVAGGSTKSA-N 445.563 4.219 10 10 IICE Cc1cc(CNC(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1-c1ccccc1 1686491379 CBHKSPGYZCOAFP-RBUKOAKNSA-N 430.552 4.260 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1ccccn1 1698013402 HIHLNFZBJCJNEF-UHFFFAOYSA-N 430.556 4.073 10 10 IICE CC(C)Cc1nnc(N2CCO[C@H](c3ccco3)C2)n1CCCSc1nccs1 1706428606 VPEAKOXKMAGOBH-KRWDZBQOSA-N 433.603 4.286 10 10 IICE CN(CCc1cccs1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1711179584 LHXFKSCADCALNN-UHFFFAOYSA-N 439.629 4.201 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@@H](C)C1 1749800327 YUVJBTVHFFBDSO-YFXJRYMSSA-N 441.620 4.194 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)C[C@H](C)c1nccs1 1761697343 CSBIKLLEDUGVFG-SFHVURJKSA-N 447.612 4.459 10 10 IICE CC[C@H]1CCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1765169057 ILMLKMVZERJFRX-HNNXBMFYSA-N 428.943 4.483 10 10 IICE CCOCc1nnc(N2CCC[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)cc1C 1766347794 WOKHYQGFOSMKEK-QGZVFWFLSA-N 425.499 4.016 10 10 IICE COc1ccccc1-c1nnc(N2CCCO[C@@H](C)C2)n1CCCSc1nccs1 1768886519 JSFHNXCXOBAUCK-INIZCTEOSA-N 445.614 4.208 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC(F)F)C1 1770275334 SUBMQTPTPRUXTQ-IBGZPJMESA-N 445.514 4.207 10 10 IICE COc1ccc(/C=C/C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1OC 1865909706 LUIUARRHCVLPTP-DDCFWYMVSA-N 437.584 4.126 10 10 IICE C/C(=C\c1ccccc1)C(=O)N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866809165 CVVKPZDRJIGUQJ-INFVRCAFSA-N 438.483 4.009 10 10 IICE CCCC[C@@H](NC(=O)/C(C)=C/c1ccccc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1868748512 MOXMCYZDMXYORB-LOMRAVHASA-N 449.595 4.122 10 10 IICE CCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCCc2ccccc2)C1=O 1873170415 YZYVKEBEJPXEQA-UHFFFAOYSA-N 427.548 4.416 10 10 IICE CCOC(=O)[C@H]1CCCN(C(=O)c2ccc3[nH]c(-c4ccc(N(CC)CC)cc4)nc3c2)C1 1873507132 WOEQPUUHRHGDKO-FQEVSTJZSA-N 448.567 4.491 10 10 IICE [N-]=[N+]=N[C@@H]1CCCN(C(=O)CC[C@H](NC(=O)OCc2ccccc2)C(F)(F)F)CC1 2180964066 RQBBVNHIKRSLER-CVEARBPZSA-N 427.427 4.315 10 10 IICE CC[C@H](C)N1C(=O)C(=Cc2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 2296546081 LRCPGRFVERWDAJ-AWEZNQCLSA-N 430.599 4.071 10 10 IICE COc1cccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)C2=O)c1 2296944630 BEXUDILTPVQHNU-UHFFFAOYSA-N 449.894 4.423 10 10 IICE COC(=O)CCCN1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 2314939420 HKSZVHAFWLEGKW-UHFFFAOYSA-N 432.479 4.009 10 10 IICE Cc1ccc(CN[C@@H]2[C@@H]3C[C@H]4[C@@H](C3)CN(C(=O)OC(C)(C)C)[C@H]42)c(O)c1Br 2381130154 VBWTXXFYVQJNAG-OLEVXBPZSA-N 437.378 4.197 10 10 IICE COc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)Cc3ccccc3-4)C(=O)NC2=S)cc1 2280914 WXAAHKFWUKVUFH-LPYMAVHISA-N 426.497 4.098 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc(O)cc3)SC2=S)cc1 15040029 YVIKFUMCWYNAFD-RGEXLXHISA-N 442.562 4.411 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccc(F)cc4)C3=O)c2C)c1 16455639 XSZLCXCZNLZGIC-AREMUKBSSA-N 447.510 4.500 10 10 IICE O=C(/C=C\c1ccc(Oc2cccnc2)c(F)c1)NCc1ccc(N2CCOCC2)cc1 207061726 UFKRHANBDRCDIK-POHAHGRESA-N 433.483 4.179 10 10 IICE COc1cccc(N2CC[C@@H](CNC(=O)N(Cc3ccco3)Cc3ccccc3O)C2)c1 726716599 NGQCTQPGHFOLFY-IBGZPJMESA-N 435.524 4.232 10 10 IICE Cc1cc(CCNC(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)c(C)n1-c1ccccc1 750634484 KPAMHRFDPCSZQW-VWLOTQADSA-N 439.600 4.396 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H](C)c2nc(-c3cccnc3)no2)C1 769662639 DWUQRFXJQLDLRD-QGZVFWFLSA-N 445.523 4.157 10 10 IICE COc1cccc(CNC(=O)NCc2cc(-c3c(OC)ccc4ccccc34)no2)c1O 779406781 YOESKHZSPCZBMO-UHFFFAOYSA-N 433.464 4.217 10 10 IICE C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 780840402 GXINXPVQVBDKES-FXAWDEMLSA-N 438.538 4.091 10 10 IICE COc1c([N+](=O)[O-])ccc(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)c1O 802657080 ZDLXPLZIYSAHRK-FCHUYYIVSA-N 433.508 4.067 10 10 IICE Cc1nc(COC(C)(C)C)oc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 857457044 INAVBOJFNHGVJE-HNNXBMFYSA-N 437.487 4.298 10 10 IICE COCCOc1cc2c(cc1/C=C1/SC(=S)N(c3ccc(C)cc3)C1=O)OCO2 920755849 RZGVNOMMWWRSID-VXLYETTFSA-N 429.519 4.155 10 10 IICE CCN1C[C@H](C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)CC1=O 1124783662 GHIFZULAACMNJG-OAHLLOKOSA-N 426.517 4.164 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2c(F)ccc(F)c2c1 1137437968 FFQGHQPORSRQFM-MRXNPFEDSA-N 431.870 4.266 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 1137816835 SMWNNPVZJKPUQE-KRWDZBQOSA-N 447.926 4.489 10 10 IICE CCc1nnc(N(C)Cc2ccc(C)s2)n1Cc1ccc(N2CCSCC2)cc1 1292831602 MGPWJHNKKNZZFQ-UHFFFAOYSA-N 427.643 4.448 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)c1cccc(Cl)c1 1293953274 HNEQCAXHTQZBFK-FQEVSTJZSA-N 445.947 4.397 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1c[nH]c2nccc(Cl)c12 1297228535 MOOMJJDZOSENNW-UHFFFAOYSA-N 442.947 4.147 10 10 IICE CN(Cc1ccsc1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1298430068 MGXNKXBFUXDZLC-UHFFFAOYSA-N 439.629 4.450 10 10 IICE C[C@@H]1C[C@H]1c1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n[nH]1 1299911230 RKQFNXAJROYEQT-RLYUOEPHSA-N 432.596 4.215 10 10 IICE O=C(CCSc1nc2ccccc2s1)NCc1ccc(N2CCC(O)CC2)cc1 1301350634 SJDMKIQBVFOJDF-UHFFFAOYSA-N 427.595 4.056 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC(=O)NC1CCCCC1 1302575387 JENYDHYOVMZLDP-UHFFFAOYSA-N 438.620 4.087 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)c(F)c1 1305370330 OHVFMBCHDFQJFN-UZLBHIALSA-N 439.583 4.292 10 10 IICE COc1ccc2c(c1)nc(CNC(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)n2C 1312551260 ODJLUZAHSLOJSK-UHFFFAOYSA-N 431.540 4.297 10 10 IICE CCOC(=O)c1c(NC(=O)c2nnn(C(C)(C)C)n2)sc(C)c1-c1ccc(C)cc1 1352235209 FIXKYHRASGNLGT-UHFFFAOYSA-N 427.530 4.202 10 10 IICE C[C@@H](NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CCCC1(C)C)c1ccc(N2CCOCC2)cc1 1357128139 KJCSRWVETIRSQA-NQIIRXRSSA-N 445.604 4.126 10 10 IICE COC[C@H](CC(C)(C)C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1437139979 BPSZMQQJYUCSEJ-LUYJPIOASA-N 440.656 4.297 10 10 IICE COc1ccc(N2CCN(C(=O)C(Cc3ccccc3)Cc3ccccc3)CC2)c(OC)c1 1438183664 CCINYYMDQMCQJE-UHFFFAOYSA-N 444.575 4.454 10 10 IICE COc1cc(C)c([S@@](C)=O)cc1OC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1469226109 FITKQIXSZBKHGY-WJOKGBTCSA-N 439.533 4.489 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2Cl)C1 1469960024 NBPYBAVKHDXUGA-MRXNPFEDSA-N 445.951 4.396 10 10 IICE O=C(NCc1c(Cl)cccc1-n1ccnc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1478717574 YUFRWDXTDFZNSG-SFHVURJKSA-N 440.931 4.122 10 10 IICE C[C@H](Cc1cn(C)c2ccc(F)cc12)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1478810285 CVACNFCOOXBTGY-DYESRHJHSA-N 439.531 4.345 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](N3CCCC3=O)C2)n1CCCSc1nccs1 1512965849 IQMKAKKSVWAVLN-IRXDYDNUSA-N 448.662 4.022 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@](C)(O)[C@@H](C)CC 1513018128 LMITYLAKWNBWDO-LLJLJFOGSA-N 447.599 4.063 10 10 IICE COc1cccc(-c2nnc(N3C[C@H](C)O[C@H](C)C3)n2CCCSc2nccs2)c1 1518379867 XSGHSFWMTCLYJS-IYBDPMFKSA-N 445.614 4.206 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CN3Cc4ccccc4OC3=O)cc2Cl)C1 1524703468 LVIIRROPGIMDSL-MRXNPFEDSA-N 427.932 4.207 10 10 IICE Cc1ccc(Br)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)n1 1528582903 HABYHZKMBAAPIU-UHFFFAOYSA-N 440.288 4.153 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1531501814 CEEDEDDRXXLLRD-ZDUSSCGKSA-N 437.468 4.317 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@@H]1C[C@H]1C(F)(F)F 1534462406 YAUXERUCVUWWKJ-WFTPXNGTSA-N 434.530 4.044 10 10 IICE Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1538157923 QTJAZPUWMXLNMI-XMMPIXPASA-N 435.955 4.298 10 10 IICE O=C(CCc1cc(F)ccc1[N+](=O)[O-])N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1539581867 KZGBBJSEKVXJFH-MRXNPFEDSA-N 437.418 4.053 10 10 IICE CC(C)[C@H](Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1541307506 HDPQVKANIYTKNA-VXKWHMMOSA-N 435.572 4.349 10 10 IICE CC(C)Cc1nnc(NC(=O)CCC(=O)NCc2ccc(N3CCC(C)CC3)cc2)s1 1543143092 SUYOFHPJGLXDCT-UHFFFAOYSA-N 443.617 4.008 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)c2sccc2-n2c(C)ccc2C)c1 1545455575 UZSIEHUILIKZBI-CQSZACIVSA-N 431.583 4.485 10 10 IICE CCc1nc(CCn2c([C@H](C)CC)nnc2N(C)Cc2ccc(N3CCCC3)cc2)no1 1546368316 UNCQPYYAUZPVRH-GOSISDBHSA-N 437.592 4.216 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@@H]2c2ccc(Br)cn2)c([N+](=O)[O-])c1 1559207254 HOEYYRCPOGAVJJ-DXWDOBMASA-N 432.274 4.280 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC2(c3c(F)cccc3F)CCC2)N(C)C)cc1 1564931948 PAMPHEOGDWETHX-OAQYLSRUSA-N 430.543 4.055 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H](N(C)c4ccc(C)cc4)C3)C2)cc1 1564962045 CVTMTMGVSMJXSY-ZJSXRUAMSA-N 436.600 4.140 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC2(CS(C)(=O)=O)CCC2)cc1 1585123851 RQLYBPVMGXUYSK-UHFFFAOYSA-N 428.558 4.113 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ocnc1C(F)F 1585834487 DYWFIKLZENKCNS-UHFFFAOYSA-N 434.200 4.337 10 10 IICE CC[C@@H](C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccc(Br)cc1 1587490696 NZPRBCMJMFFNBZ-LJQANCHMSA-N 447.373 4.309 10 10 IICE CCCCNC(=O)[C@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1587661240 MRFZLFKZZDQKDI-HXUWFJFHSA-N 434.005 4.108 10 10 IICE Cc1cc(C(=O)Nc2ccc(Cl)c(C(N)=O)c2)c(C)n1-c1ccc(Br)cn1 1588249659 MXXXJPCWBMQDFD-UHFFFAOYSA-N 447.720 4.256 10 10 IICE Cc1cc(CC(=O)N2CCc3nc(N(C)C)sc3C2)c(C)n1-c1ccc(Cl)cc1 1593851198 ZSYSQMRSVLEAEK-UHFFFAOYSA-N 428.989 4.397 10 10 IICE Cc1cc(C)c(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cn1 1597403576 UZYLINYJLQEIRI-LICLKQGHSA-N 431.608 4.058 10 10 IICE CN(C)c1ccc(CN2C[C@@H](O)C[C@H]2c2nc(-c3ccc(OC(F)(F)F)cc3)no2)cc1 1616154668 SPEZHHAOXASHMC-HKUYNNGSSA-N 448.445 4.009 10 10 IICE CCOC(=O)[C@H](CC)N(C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C1CC1 1625355904 CBPYWFBHDGXDNZ-SFHVURJKSA-N 448.361 4.198 10 10 IICE CC(=O)NCCN(Cc1ccc(C)s1)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1625883804 WNEHYENRTYUGLB-UHFFFAOYSA-N 427.545 4.382 10 10 IICE O=C(NC[C@H]1CCN(c2cccc(Br)c2)C1)c1cc2cc(O)c(O)cc2s1 1626614483 KFFVJZZAXIHPNO-GFCCVEGCSA-N 447.354 4.331 10 10 IICE O=C(/C=C/C1CCOCC1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1627272039 QIMMDRMABZIHHR-QPJJXVBHSA-N 427.302 4.080 10 10 IICE Cc1ccc(C(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1628159303 WYNTVWIZJTYGIL-NRFANRHFSA-N 439.556 4.344 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 1631531451 RMMRDMPOAKTINV-QGZVFWFLSA-N 430.464 4.440 10 10 IICE Cc1cc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccc(F)cc1 1633005637 DBYZRSYVTJUZSX-UHFFFAOYSA-N 445.535 4.037 10 10 IICE CCOCn1nc(C)c(C[C@H](C)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1C 1642091271 OKXBVPBLLNOMOW-SFHVURJKSA-N 436.600 4.439 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@H](C)c3cccc4ccccc34)CC2)cc1F 1644919518 QHXKJLCGCMWQSJ-RTBURBONSA-N 435.543 4.375 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@]3(CO)CCC[C@@H]23)sc(C)c1-c1ccccc1 1660219318 WSGBWQOTLNNARJ-HOYKHHGWSA-N 442.581 4.076 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)cc2Cl)C1 1680357873 LNTPJKZCLDFYCJ-HZPDHXFCSA-N 439.000 4.289 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCc4ccccc4NC3=O)cc2Cl)C1 1680561316 BVDPTLHDWQIEIP-IERDGZPVSA-N 440.975 4.329 10 10 IICE Cc1cc(CCNC(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c(C)n1-c1ccccc1 1684445201 YJOABQLGDPYCMU-QFIPXVFZSA-N 430.552 4.021 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3CC3CCCCC3)cc2)CC1 1685244479 RLYGTVOWLCJWOF-HSZRJFAPSA-N 426.605 4.033 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@H](c3ccccc3F)C2(C)C)N(C)C)cc1 1685686974 UHXATCGJWODQTJ-GGAORHGYSA-N 426.580 4.472 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1710387108 XZKBAIOTVOSMSW-IBGZPJMESA-N 437.588 4.393 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(C)(C)C(F)(F)F 1727593346 NPSIVRCQHMETTN-UHFFFAOYSA-N 425.499 4.154 10 10 IICE CC(C)Cc1nnc(N(C)[C@H](C)c2ccco2)n1Cc1ccc(N2CCOCC2)c(F)c1 1741430851 FRFPOKWXBLEMBF-GOSISDBHSA-N 441.551 4.291 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1752722406 WSIPRVYLMHXRQL-DLBZAZTESA-N 444.630 4.483 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1770784533 QASWUFPAUUCOKK-PKOBYXMFSA-N 443.592 4.279 10 10 IICE CN(C)c1ccc([C@H](NC(=O)c2ccc(C(=O)c3ccccc3)cc2)c2nccn2C)cc1 1865964972 FURJOKUPHMEBFW-DEOSSOPVSA-N 438.531 4.237 10 10 IICE CC(C)CN1C(=O)/C(=C\c2ccc(OCC(=O)Nc3ccc(O)cc3)cc2)SC1=S 1871287030 FOYORWYVOAQOIH-YBFXNURJSA-N 442.562 4.267 10 10 IICE C[C@@H](c1ccccc1O)N(C)c1ncc(I)cc1Br 1877546430 UQXQGIZNLATEKO-VIFPVBQESA-N 433.087 4.352 10 10 IICE O=C(O)[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@@H]1c1ccc(O)c(O)c1 1951590849 GAUJAKYPDCXJKP-RTWAWAEBSA-N 445.471 4.147 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@@H](O)c1ccc(N2CCCC2)cc1 2044730833 RKDMDGBOSPOCLR-ZEQRLZLVSA-N 439.600 4.346 10 10 IICE Cc1ccc(N2C(=O)C[C@@H](N3C(=O)C(=CC=Cc4ccccc4)SC3=S)C2=O)cc1 2053493716 DNRROVRYDPUHRR-GOSISDBHSA-N 434.542 4.085 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3c(O)cccc3Br)CCC[C@H]12 2087287573 TWPQKFAOLPDJCL-FXAWDEMLSA-N 425.367 4.424 10 10 IICE Oc1cccc(Br)c1CN[C@@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156287994 KDXZOCILBSBFOD-PGRDOPGGSA-N 431.374 4.068 10 10 IICE CC[C@H](C)Oc1ccccc1C=C1SC(=S)N(NC(=O)c2ccc(OC)cc2)C1=O 2297561680 SMZFDYCPGXNEMF-AWEZNQCLSA-N 442.562 4.419 10 10 IICE Cc1ccc(CNCC23CC(CCN2C(=O)OC(C)(C)C)C3)c(O)c1Br 2352688486 UWIBBNUCARYBOT-UHFFFAOYSA-N 425.367 4.342 10 10 IICE CC[C@@H](C)[C@@H](C(=O)NCc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2380740728 ZHBBGRRQOCHZMD-WBMJQRKESA-N 443.382 4.361 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@H]2CCN2C(=O)OC(C)(C)C)c(O)c1Br 2381128853 AMNYOLJHPISIOX-HNNXBMFYSA-N 441.366 4.211 10 10 IICE COc1ccccc1/C=C1/SC(=S)N(NC(=O)c2ccccc2Br)C1=O 33403168 DYUJASKLDVLUKX-XNTDXEJSSA-N 449.351 4.004 10 10 IICE COc1cccc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 36803391 KAUUZBNYSWQHIQ-LDADJPATSA-N 431.510 4.169 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(CC(C)C)C3=O)c2C)cc1 57496596 SUGGQHGWUUIUGG-DEOSSOPVSA-N 425.529 4.032 10 10 IICE CC(C)(C)c1ccc(/C=C2/SC(=S)N(CCC(=O)NCc3cccnc3)C2=O)cc1 102860819 BXCALKMSDBJJML-CPNJWEJPSA-N 439.606 4.287 10 10 IICE CCCSc1nnc(-c2ccccc2N/C=C2/C(=O)N(c3ccccc3)N=C2C)c(O)n1 103682579 YMBOGHSYUNKTCU-NBVRZTHBSA-N 446.536 4.465 10 10 IICE COc1ccc(N2CCCN(C(=O)c3c(Br)c4ccccc4n3C)CC2)cc1 108575915 FGZCIQZQUYBTKS-UHFFFAOYSA-N 442.357 4.302 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 733656897 DZQHGHBKTJYSCS-IBGZPJMESA-N 443.544 4.487 10 10 IICE COc1cccc(F)c1[C@H](C)NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743661423 XTGFLWIVRYHQLG-GJZGRUSLSA-N 437.462 4.465 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)C[C@@H](O)c2cccs2)C1 768099774 YYAVHPADFOFMMN-HTAPYJJXSA-N 425.598 4.098 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cc1F 768735477 UZYKQEPPYPGZRH-QGZVFWFLSA-N 428.527 4.057 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1cnn(-c2ccncc2)c1C(F)F 784054185 JMAOZFSUUFSEHO-UHFFFAOYSA-N 431.406 4.167 10 10 IICE Cn1c(=O)oc2cc(S(=O)(=O)Nc3nc(-c4ccc5ccccc5c4)cs3)ccc21 906373333 RZPXGNNHXHLOLE-UHFFFAOYSA-N 437.502 4.209 10 10 IICE CS[C@@H]1CC[C@@H](N(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1126591626 VDBIWCYXGLPNOD-KDUYSQSBSA-N 438.615 4.160 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1 1127189065 FHARTIVCVYQYDA-JYRVWZFOSA-N 431.536 4.394 10 10 IICE CO[C@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 1135745938 IBWLBWXYUYKLMK-PXDATVDWSA-N 445.604 4.050 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC(C)(C)c1ccc2c(c1)OCCO2 1136438239 HLYDUFSNGLSAMV-UHFFFAOYSA-N 432.520 4.385 10 10 IICE Cc1cc(C(=O)NCc2ccnc(OCCN(C)C)c2)c(C)n1-c1cccc(C(C)C)c1 1153058881 LNSGIJPNVUUYSA-UHFFFAOYSA-N 434.584 4.483 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cc(Br)c2nccnc2c1 1162800393 GOUKPZDWCMIPHP-UHFFFAOYSA-N 425.330 4.313 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)s2)c(F)c1 1167762225 KFGOXHBVLRZEDX-UHFFFAOYSA-N 439.556 4.457 10 10 IICE COc1ccc(N2CCN(c3c([N+](=O)[O-])cnc4ccc(Cl)cc34)CC2)c(OC)c1 1187379888 GPUZJLWCOHWSNX-UHFFFAOYSA-N 428.876 4.140 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@@H](c4nccn4C)C3)cc2Cl)C1 1227210265 ZDFRGWICDPQNGB-HGHGUNKESA-N 445.995 4.029 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)N(C)C)cc1 1256231861 HEJWXJWRHYKEPF-JTHBVZDNSA-N 445.007 4.262 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccc([C@@H]3CCCCN3C(=O)OC(C)(C)C)n2C)c1 1301046520 DTWAHLLPMFLSTI-IBGZPJMESA-N 427.545 4.431 10 10 IICE Cc1cc(C(=O)COc2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccc(C(C)C)cc1 1307281801 YFTBEXMFIBDPDL-UHFFFAOYSA-N 426.538 4.127 10 10 IICE CCN(CC)c1ccc(Cn2c(N(C)C3CCC3)nnc2[C@@]2(OC(C)C)CCOC2)cc1 1313677936 BEYYXMLUMOQCSX-RUZDIDTESA-N 441.620 4.202 10 10 IICE CO[C@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC[C@@H]1C 1315714934 DJHNTXNHAVOGFO-WMZOPIPTSA-N 429.615 4.445 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N(CCN1CCOCC1)c1ccccc1 1351831111 DOFZAVUIBAASEI-SEYXRHQNSA-N 445.563 4.402 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cccc(-c4c(F)cccc4F)c3)cc2)CC1 1439333727 VYSWOJXSHBTVCW-UHFFFAOYSA-N 449.501 4.264 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)cc1 1450295431 USUWQRLDYJVWDE-DENIHFKCSA-N 448.454 4.169 10 10 IICE Cc1cc(CNC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)c(C)n1-c1ccccc1 1462084819 LNPGBFFSMNHDBA-HSZRJFAPSA-N 429.520 4.031 10 10 IICE CN(c1ccc(CNC(=O)[C@H](c2ccccc2F)N2CCOCC2)cc1)C1CCCCC1 1464540970 RLMJGHSIQBXRRV-VWLOTQADSA-N 439.575 4.284 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)[C@@H]1CCCOC1 1466780769 RVWWYRUQTOZNFS-OFNKIYASSA-N 426.557 4.306 10 10 IICE CC[S@](=O)CCn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1516872332 KFIRWSNQWBCZEJ-HKBQPEDESA-N 443.661 4.016 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3scc(Br)c3C)cc2F)CC1 1537534737 HUXSHRXEDUOUFS-UHFFFAOYSA-N 440.382 4.030 10 10 IICE Cc1cc(CC(=O)Nc2ccc(CN3C(=O)CCCC3=O)cc2)c(C)n1-c1ccccc1 1538024185 QGPKKMRKYUAASI-UHFFFAOYSA-N 429.520 4.314 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(C)n(-c3cccc(Cl)c3)c1C)C[C@@H]2O 1543434525 DXCNQBWNHAHQLW-FQEVSTJZSA-N 440.927 4.454 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1544267137 CMMGXPZWFNGGRE-MSOLQXFVSA-N 425.520 4.260 10 10 IICE Cc1cc(C(=O)N[C@H](CC(N)=O)c2ccccc2)c(C)n1-c1ccccc1Br 1556774560 BRLLYEAQCJCAQM-LJQANCHMSA-N 440.341 4.203 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2ccn(-c3ccccc3)n2)cc1 1584104730 YWKYMLYJFWEEGP-UHFFFAOYSA-N 426.520 4.293 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H](N3CCCC3=O)CC2)c(C)n1-c1ccc(Cl)cc1 1584984425 CNBLXSXTJLBMMR-NRFANRHFSA-N 427.976 4.294 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(CNC(C)=O)c2)cc1 1585492236 GJWVIEVIDOSZQL-UHFFFAOYSA-N 431.536 4.244 10 10 IICE COc1ccc(CNC(=O)/C=C/C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)cc1 1597567524 QJQQGCMGYVCELA-NIQRWSHPSA-N 444.531 4.363 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCCc2cccnc21 1616408139 BGEBXMFXBTYBPB-NAVNFMRLSA-N 441.553 4.006 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCN(C)C3CCCC3)CC2)cc1 1619301338 HELWOZBNQWLNAA-UHFFFAOYSA-N 440.636 4.001 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(c4cccc(OC(F)(F)F)c4)CC3)CC2)cc1 1623430096 VACTYYDDOSMSOC-UHFFFAOYSA-N 434.458 4.364 10 10 IICE C[C@H](NC(=O)Cc1c[nH]c2ccc(Br)cc12)c1ccc(N2CCOCC2)cc1 1626978294 MAQDGVKWZVOJKT-HNNXBMFYSA-N 442.357 4.187 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC=C(c3cn(C(C)C)nn3)CC2)cc1 1628395179 HHJKTZPYGPSAPK-UHFFFAOYSA-N 445.567 4.328 10 10 IICE COC(=O)c1ccc(OCCNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1 1628781178 UOETXSPFOOAHFP-UHFFFAOYSA-N 426.900 4.343 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(C)CCN3CCN(c4ccccc4)CC3)c2C)c1 1629855274 YHUVZCDGWIBHGZ-UHFFFAOYSA-N 430.596 4.297 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)[C@@H](OC)c3ccccc3Cl)CC2)cc1F 1634425038 KZMBTZDACSHXSN-YCRPNKLZSA-N 435.927 4.096 10 10 IICE CCN(Cc1nc2c(s1)C[C@@H](C)CC2)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1636354503 YZUNBSWRWFZETM-ROUUACIJSA-N 442.629 4.335 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1Cl)NCc1ccc(N2CCC(OC)CC2)cc1 1647967865 NUWLECJZLDZBMJ-QHCPKHFHSA-N 430.976 4.219 10 10 IICE CC(C)N(CC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)cc1)Cc1ccc(N(C)C)cc1 1657024426 YDFAJMUIMZWCSX-OYRHEFFESA-N 438.616 4.215 10 10 IICE CC(=O)N(C)c1ccc(CNCc2cc(Br)cc(Br)c2O)cc1 1658305486 KWOUPIGUWNVEMA-UHFFFAOYSA-N 442.151 4.190 10 10 IICE C[C@@H](NC(=O)N1CC[C@]2(CCCCN2C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671852176 SHMYBQZZOONZPF-HOYKHHGWSA-N 430.593 4.389 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCCOc3ccc(Cl)cc3)C2)cc1 1673823098 NBSGQHVKBSVASP-GOSISDBHSA-N 431.964 4.285 10 10 IICE O=C(NCc1ccc(Br)c(Br)c1)NCc1c(O)cccc1F 1676348526 JCCHMURZJCRJSJ-UHFFFAOYSA-N 432.087 4.056 10 10 IICE C[C@H](NC(=O)NCc1ccc(CNC(=O)OC(C)(C)C)cc1F)c1ccc(N(C)C)cc1 1680281021 TVKWVFZZEHEACF-INIZCTEOSA-N 444.551 4.477 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@](CO)(C(F)(F)F)C3)cc2Cl)C1 1682024389 RPGBDNORCCJSFZ-LIRRHRJNSA-N 433.902 4.033 10 10 IICE Cc1cc(CCNC(=O)N2CCc3nc(C(C)(C)C)ncc3C2)c(C)n1-c1ccccc1 1684445180 YGSAAYLFMPVCSB-UHFFFAOYSA-N 431.584 4.492 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C)OC 1695112810 MBIMWRBKWWZBHV-DENIHFKCSA-N 437.588 4.393 10 10 IICE CCN(CC(C)C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1746016059 NXPIADCZPJPMFO-UHFFFAOYSA-N 441.551 4.353 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCCC(C)(C)C2)cc1 1746086038 HRCRCPUHMVEDNM-UHFFFAOYSA-N 438.620 4.035 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCC(OC(C)C)CC1 1761697455 GVWJBOQQXPBBHV-UHFFFAOYSA-N 436.604 4.100 10 10 IICE C[C@@H]1CCC[C@H]1Cn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 1762875685 KJKAVLAMXRKGGG-SJORKVTESA-N 439.585 4.048 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765512451 CLGNXXOGBMBOCQ-FQEVSTJZSA-N 448.615 4.222 10 10 IICE CCCc1nc(C)c(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)o1 1765620719 YNMZMVZONAGKPE-LJQANCHMSA-N 425.533 4.159 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CCc1csc(C(C)(C)C)n1 1767112763 CWJJWLZTLCYTKW-LJQANCHMSA-N 441.601 4.468 10 10 IICE Oc1ccc(F)cc1Cn1nc(C2CC2)c(I)c1C(F)(F)F 2079036142 QNTDINLXJPCEPL-UHFFFAOYSA-N 426.151 4.277 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@@H](NCc1ccc(Cl)cc1O)CO2 2160182996 RGRDQWAWSMULFZ-HXUWFJFHSA-N 430.932 4.096 10 10 IICE COc1ccc(Br)c(CNCC2(NC(=O)OC(C)(C)C)CCCC2)c1O 2227748433 AFDWYTJPLBRYLZ-UHFFFAOYSA-N 429.355 4.090 10 10 IICE CCOc1ccc2c(c1)C(=C1SC(=S)N(Cc3ccc(Cl)cc3)C1=O)C(=O)N2 2296417321 XWRASXKDJVPHNE-UHFFFAOYSA-N 430.938 4.462 10 10 IICE Cc1ccc(Sc2ccc(C=C3C(=O)NC(=O)N(c4ccc5c(c4)OCO5)C3=O)o2)cc1 2313556114 NBCNIKIHTZLBHZ-UHFFFAOYSA-N 448.456 4.134 10 10 IICE CC[C@@H](C)[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323829833 ZFVZIFLKSHBZAD-AMIZOPFISA-N 432.336 4.289 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457543 DCTOPAUENYQMDX-DFIYOIEZSA-N 435.568 4.299 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(NC(=O)c3ccccc3Cl)C2=O)ccc1OC 40939981 ZDAOXYNKZYBIPX-BOPFTXTBSA-N 448.953 4.294 10 10 IICE O=C1C(=C/C=C\c2ccc([N+](=O)[O-])o2)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 108512175 JGPQYIZGGANBQE-GHXNOFRVSA-N 445.456 4.492 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCc1ccc(N2CC=CC2)cc1)c1ccccc1 743623999 MXWDIEGOPXCGGV-QFIPXVFZSA-N 436.556 4.128 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N3CCCC[C@H]3c3cccn3C)cc2F)C[C@@H](C)O1 746758650 NPFJWTCVPMGSSN-PNCHPQGNSA-N 428.552 4.215 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1F 753737698 CAFJSPHQJDOKRO-IAGOWNOFSA-N 438.421 4.185 10 10 IICE C[C@@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)c(F)cc1O 757637614 LIQBDZCMNZGCAU-BXUZGUMPSA-N 449.299 4.357 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 781680487 RHJUWNMIABTUIF-XSBJJCPUSA-N 436.386 4.378 10 10 IICE C[C@H](NCc1ccc(I)cc1Cl)c1cc([N+](=O)[O-])ccc1O 794840198 HDFJOBJQFAQDNU-VIFPVBQESA-N 432.645 4.409 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3C[C@@H]3c3ccccc3OC(F)F)CC2)cc1 798090242 IBSZQIVNIBUTFP-UXHICEINSA-N 431.483 4.074 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(N(C)CCC(C)C)cc3)C2=O)cc1 1084467439 LPOWBKIGCZWCBP-CJLVFECKSA-N 435.524 4.234 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C/c3ccsc3C(F)(F)F)cc2F)CC1 1125976343 WPCHISARGMKIHZ-GQCTYLIASA-N 441.494 4.378 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)c1 1128206592 LQPYQJJVNWBOFH-UHFFFAOYSA-N 430.936 4.303 10 10 IICE Cc1ccccc1C(C)(C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1129328590 AIYIXWJBUDRLTF-UHFFFAOYSA-N 428.444 4.344 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Cl)c(-n3cccc3)cc2OC)cc1 1130744863 KINJERBITDJQEZ-UHFFFAOYSA-N 427.932 4.356 10 10 IICE COc1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(Cl)c1OC 1136480062 AIBKVMOIWAKFEA-FQEVSTJZSA-N 446.975 4.174 10 10 IICE O=C(c1ccc(Cn2cc(Cl)cn2)s1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1151902345 BDCANZOTFDQJON-KRWDZBQOSA-N 431.945 4.173 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](C)C(=O)NCc3ccccc3)cc2Cl)C1 1235835266 VNJGDUYHEHIZAK-ROUUACIJSA-N 442.991 4.080 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)N3CCCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 1264733366 YRFZEXICWFLSHW-JOCHJYFZSA-N 449.595 4.130 10 10 IICE CCOC1CC(CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1296918607 KOBOEJMEEVCUMO-UHFFFAOYSA-N 426.586 4.478 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@@H](O)c1cccnc1 1302356309 JCOQFKZKAPUSOM-ZEQRLZLVSA-N 449.551 4.008 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2COc3cccc(Br)c3C2)cc1 1313197349 KPBPIGKLZXUGGU-KRWDZBQOSA-N 446.389 4.440 10 10 IICE CCOCCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1314461234 MFIWJPDRJBFXBV-QFIPXVFZSA-N 427.593 4.183 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CCCSC3)CC2)cc1F 1315511823 FOEZZOWVFZKDNT-SFHVURJKSA-N 447.624 4.094 10 10 IICE COc1ccc(CCCNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 1351555436 SHSVIQSEGVKJEQ-UHFFFAOYSA-N 449.595 4.174 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccn(CCc2ccccc2)n1 1352891076 AMRBWRDTRDAXLT-UHFFFAOYSA-N 440.494 4.126 10 10 IICE Cc1cc(C(=O)N2CCN(CC(F)(F)C(F)F)CC2)c(C)n1-c1cccc(Cl)c1 1444146398 KBKHHDHBUJPYTJ-UHFFFAOYSA-N 431.861 4.406 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3ccccc3)C(=O)C2(C)C)c(C)n1-c1ccc(F)cc1 1450304085 ZSUMVDZAANJCSG-UHFFFAOYSA-N 433.527 4.496 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3cc(N(C)C)c(Br)cn3)ccc21 1460117197 CBSDXPVODDZRCH-UHFFFAOYSA-N 445.361 4.380 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)cc1 1460123173 WGDMVIZTZWWZRG-HSZRJFAPSA-N 440.569 4.209 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C\SCc2ccco2)NC(=O)OC(C)(C)C)cc1 1465325797 ZSTDUUIMFHJDOF-WXFJXSOESA-N 445.585 4.475 10 10 IICE CC(C)(Cc1ccccc1Cl)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1470448841 ACSBKRXGKSHLPL-UHFFFAOYSA-N 437.918 4.275 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](c4cccc(Br)c4)C3)C2)cc1 1470773483 PNYFGUWKCBJJMB-IEBWSBKVSA-N 444.373 4.236 10 10 IICE C[C@H](NC(=O)N1CCC[C@@H]([C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 1478471023 MDCIQUUMCAQRFV-CEWLAPEOSA-N 444.620 4.492 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3ccc(Br)cc3Cl)CC2)cc1 1527714516 APUWEBCJAPYYGF-UHFFFAOYSA-N 437.765 4.393 10 10 IICE C[C@H]1CCc2sc(-c3nnc(N(C)Cc4ccccc4O)n3C[C@@H](C)N(C)C)cc2C1 1543868690 SWJJLDZGIVLMCE-DLBZAZTESA-N 439.629 4.424 10 10 IICE Cc1cc(C(=O)N(C)[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c(C)n1-c1ccc(F)cc1 1558829638 NDTMUTKWJWBHSK-AERCQKQUSA-N 427.520 4.171 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCC[C@@H]1Cc1ccccc1F 1565126652 AWMNWSPQAFVZCH-JOCHJYFZSA-N 425.548 4.094 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1c(O)cccc1Cl 1569682215 KGDSBJNIYIHZCY-GDNBJRDFSA-N 436.917 4.415 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1cccc(O)c1 1595595281 AMQQBSGJDYEDGJ-NRFANRHFSA-N 426.900 4.487 10 10 IICE O=C(NCc1c(O)cccc1F)C1(Cc2ccc(F)cc2Br)CCOCC1 1596913068 USPCUATULHCKDJ-UHFFFAOYSA-N 440.284 4.089 10 10 IICE CC[C@@H](C)n1nc(C)c(-c2cc(C(=O)NCc3cccc(Br)c3O)n[nH]2)c1C 1623363413 GOZWZBKEHKPFSL-LLVKDONJSA-N 446.349 4.259 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(OC(F)F)c(Cl)c1 1623928293 KXYZQZAXLVMUKS-UHFFFAOYSA-N 434.222 4.116 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@](C)(O)c2ccccc2Br)cc1 1626193940 LGYAXWRMHBXCDD-QFIPXVFZSA-N 427.342 4.494 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3c(C)n(C)n(C4CCCCC4)c3=O)ccc21 1628272463 BOGJEIMDRCJRCW-UHFFFAOYSA-N 438.572 4.471 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc2cccnc2c1O)c1cccc(Cl)c1 1630532064 FUEYHYVTUQWKAZ-IBGZPJMESA-N 441.915 4.476 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)CC(=O)N(C)[C@H](C)c2ccccc2)c1 1633674581 HIGHVKJPRPEWBI-LJQANCHMSA-N 431.536 4.198 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(c3ccc(F)c(F)c3)CC2)N(C)C)cc1 1638918538 XBFXHHWNLJOWDA-QHCPKHFHSA-N 430.543 4.223 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(Cc4nc(C(C)C)n[nH]4)CC3)ccc21 1640614705 XMBJTWZTZNOYEE-UHFFFAOYSA-N 437.588 4.241 10 10 IICE Cc1cc(C(=O)Nc2cc(-c3ccco3)nn2C)c(C)n1-c1ccc(Br)cn1 1641500771 YHIXYQXLVUZKAX-UHFFFAOYSA-N 440.301 4.497 10 10 IICE Cc1cccc(COc2cccc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)c2)c1 1642155223 JHKFTQFCBZOENK-UHFFFAOYSA-N 430.548 4.465 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)cc1[N+](=O)[O-] 1643836645 CNRINNGIYCBEML-UHFFFAOYSA-N 443.843 4.099 10 10 IICE Cc1cc(C(=O)NCc2cnn3c2CCCC3)c(C)n1-c1cccc(Br)c1 1647491307 VYVITUFMIGGIBE-UHFFFAOYSA-N 427.346 4.319 10 10 IICE Cc1cc(N(C)C)ccc1CNc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-] 1655122406 CAFMKPMZLFRSNZ-UHFFFAOYSA-N 446.573 4.146 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(C(=O)N(C)C)cc2)Cc2ccccc2)cc1OC 1656583667 XCWWXZXSUZHRKQ-UHFFFAOYSA-N 447.535 4.051 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)C[C@@H]4CCOC4)nnc3C(C)(C)C)cc2)CC1 1693699758 KDMIVORGSBJVAM-NRFANRHFSA-N 425.621 4.333 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C(N)=O)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1707274278 TUDMSHJCRZOKJR-HXUWFJFHSA-N 434.588 4.100 10 10 IICE Cc1ccc(-c2nnc(N3CCS[C@@H](C)[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1724327326 SVKWSDPOLZUGDE-CVEARBPZSA-N 429.565 4.430 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](CC(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742699683 XYRUZQUGHXKANB-QFIPXVFZSA-N 449.647 4.435 10 10 IICE CCCCCN(c1nnc([C@H]2CCC(=O)N2)n1Cc1ccc(N(C)C)cc1C)C(C)C 1765666225 JAQWKRVGOXZRFZ-OAQYLSRUSA-N 426.609 4.057 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@@H](C)N(CC)C[C@@H]2C)cc1 1766614661 OFOLKSORSRJCNQ-RTWAWAEBSA-N 426.653 4.290 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4cccnc4)n3CCC(C)C)CC2)cc1 1770257479 ASWJIGZRXOLYDY-UHFFFAOYSA-N 434.588 4.035 10 10 IICE C[C@@H]1C[C@H](CNCc2cc(Br)cc(F)c2O)CN(C(=O)OC(C)(C)C)C1 2115922170 GWDNWXWXELEIGB-CHWSQXEVSA-N 431.346 4.277 10 10 IICE CCN1C(=O)C(=Cc2cn(Cc3cccc4ccccc34)c3ccccc23)C(=O)NC1=S 2313656662 UMLGWDBCTROMOC-UHFFFAOYSA-N 439.540 4.489 10 10 IICE CCCOC(=O)CCCN1C(=O)C(=Cc2ccc(OC(C)C)c(OC)c2)SC1=S 2314761286 RKUAEOWYWDPWBI-UHFFFAOYSA-N 437.583 4.417 10 10 IICE CCOc1ccc(C=C2SC(=S)N([C@H](C(=O)OC)c3ccccc3)C2=O)cc1OC 2314769915 WWMSIDWKYRMONC-IBGZPJMESA-N 443.546 4.209 10 10 IICE COc1ccc2c(c1)c(C=C1SC(=S)N(Cc3cccc(C(=O)O)c3)C1=O)cn2C 2326974294 ZUTVJYHZCPQILY-UHFFFAOYSA-N 438.530 4.287 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccc(F)cc1 15039588 QHQGXKYLUKDLTJ-ATVHPVEESA-N 445.497 4.354 10 10 IICE CC[C@@H](C)Oc1ccccc1/C=C1\SC(=S)N(NC(=O)c2ccc(OC)cc2)C1=O 33770865 SMZFDYCPGXNEMF-RMENWYJGSA-N 442.562 4.419 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)COc2ccccc2C=O)cc1 72413073 MQTXVSKLWDFTBC-DEOSSOPVSA-N 427.504 4.322 10 10 IICE C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N(C)Cc1c(F)cccc1Cl 734155520 FMJNGJYRHVHGHQ-IAGOWNOFSA-N 433.955 4.013 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3c([N+](=O)[O-])ccc(C)c3C)n2)cc1OC 764527436 SGAABIYWSAIXNN-UHFFFAOYSA-N 449.510 4.153 10 10 IICE CCCN1C(=O)CCc2cc(NC(=O)NCc3cc(Br)ccc3O)ccc21 806387691 LBOTYHBOMUCMEK-UHFFFAOYSA-N 432.318 4.166 10 10 IICE Cc1cccc(Br)c1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 811913179 MYDBRXBMOQHYDJ-UHFFFAOYSA-N 442.401 4.220 10 10 IICE CC(C)N(Cc1c(O)ccc2ccc(O)c(CN(C(C)C)[C@@H]3CCOC3)c12)[C@@H]1CCOC1 812291639 PDUSBVVHWXLVGW-NHCUHLMSSA-N 442.600 4.250 10 10 IICE CN(C(=O)c1cn(C)nc1[C@@H]1CCCN(C(=O)OCc2ccccc2)C1)c1ccsc1 1130660635 KQKKMTQUVBZGLD-GOSISDBHSA-N 438.553 4.274 10 10 IICE Cc1cc(C(=O)NCCc2ccc(CO)cc2)c(C)n1-c1ccccc1Br 1137814923 RYHXBLJKWRAQJV-UHFFFAOYSA-N 427.342 4.321 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@](CO)(Cc2ccc(F)cc2)C1 1141638648 VDAGKRTUPTUBPA-SANMLTNESA-N 434.511 4.113 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H]2C[C@H](NC(=O)OC(C)(C)C)C[C@H]1C2 1230200360 IWMHYGOTLLJPAS-YSNWRPKNSA-N 444.620 4.079 10 10 IICE Cc1c(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cccc1[N+](=O)[O-] 1296420533 KQPAGAYTXHJTQI-UHFFFAOYSA-N 443.301 4.398 10 10 IICE CC1(C)CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)CCS1 1303977355 KLOGKDBXPITIOR-UHFFFAOYSA-N 446.671 4.235 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@H](c3ccco3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305553367 BWIVQMHOAQXVRK-IERDGZPVSA-N 427.524 4.216 10 10 IICE Cc1cnn([C@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(N=NC(N)=O)cc1 1306772011 MQBPOCWQXNFGEG-FQEVSTJZSA-N 431.500 4.053 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@H]2C(=O)Nc3c(F)cccc32)sc2c1CC[C@@H](C)C2 1348718347 FYIORFPMSUXFKJ-BXUZGUMPSA-N 430.501 4.253 10 10 IICE CS[C@@H]1CCC[C@@H](NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1435165206 IBGTVHSVPFVSBQ-KDUYSQSBSA-N 438.615 4.207 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1CCC[C@H]1C1CC1 1436752368 VXAJECIETISHRU-ZWILPSFYSA-N 432.586 4.360 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCN2CC(F)F)c(C)n1-c1cccc(Br)c1 1453483497 YYHGEIOUHZWXLL-QGZVFWFLSA-N 440.332 4.316 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@H](C)c3ccc4ccccc4c3)CC2)cc1F 1459745896 BJDOGXCSWGNXLD-MOPGFXCFSA-N 435.543 4.375 10 10 IICE Cc1ccc(C(=O)NCc2cccnc2OCC(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1464104604 VNLDINHBRGNATO-UHFFFAOYSA-N 445.441 4.481 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)C12CCC2 1474210366 XYAMFPHGDPESGU-OAHLLOKOSA-N 429.330 4.316 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(OC(F)(F)F)cc1 1478573278 MJRSLPYNNOWQIB-HNNXBMFYSA-N 437.462 4.107 10 10 IICE Cc1c(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nnn1-c1ccccc1 1519550091 FWTGPRINBXYLPB-QGZVFWFLSA-N 437.975 4.324 10 10 IICE CC(C)(C)Cc1nnc(N2C[C@@H]3CCC[C@H](C2)C3O)n1CCCSc1nccs1 1541171042 IUZGQBUBUTVIIA-BYICEURKSA-N 435.663 4.103 10 10 IICE CC[C@H](c1ccccc1)N(C[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)C(C)C 1560021555 NRQUANHELQWSCD-AOYPEHQESA-N 425.617 4.040 10 10 IICE CCC1(CC)CN(C(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 1597008105 MACVFXRPSWFYHF-PFONDFGASA-N 447.579 4.005 10 10 IICE Cc1cc(CC(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)c(C)n1-c1ccccc1 1598374611 LQDBFHGTWOIKLL-OAQYLSRUSA-N 445.563 4.120 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CC(F)(F)F)n1 1612186252 SLECHRKFZGXCOB-UHFFFAOYSA-N 430.478 4.447 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Cl)c2ccccc2c1O 1623928489 NSUANBFXPSNDBA-UHFFFAOYSA-N 434.275 4.373 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCCN(C(=O)OCC(C)C)CC3)c2C)cc1 1627545491 LIKWUZMZOZTWJM-UHFFFAOYSA-N 427.545 4.043 10 10 IICE COC(=O)[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(C)cc1 1628624911 OMNQNKQRWFMTQW-HSZRJFAPSA-N 432.520 4.210 10 10 IICE O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2)c1)c1cc2cc(O)c(O)cc2s1 1630063312 CBVLRMJWDOCOMB-UHFFFAOYSA-N 440.502 4.366 10 10 IICE CC(C)(C)OC(=O)Nc1cnn(C(C)(C)C(=O)NCc2ccc(N3CCCCC3)cc2)c1 1630698164 NCHNGCNQPNHDTN-UHFFFAOYSA-N 441.576 4.272 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c(F)c(F)c(Br)c(F)c1F 1634940077 ZCEBVGHYZJVZDF-UHFFFAOYSA-N 427.188 4.127 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccccc2OCCN(C)C(=O)OC(C)(C)C)c1 1636061482 OIYDDUJUCGIKDM-MRXNPFEDSA-N 444.528 4.138 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(CCCOC(C)(C)C)CC3)c2C)c1 1637577381 CVTGBALRQANVIS-UHFFFAOYSA-N 440.632 4.435 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)O[C@@]3(CCOC3)C2)c(C)n1-c1cccc(Br)c1 1639354781 CHQKYNVIJJEUKZ-QFIPXVFZSA-N 447.373 4.267 10 10 IICE COc1nn(C)cc1C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1641203124 WKEIVWSMZRMTKR-SFHVURJKSA-N 432.446 4.354 10 10 IICE Cc1ccc(C(=O)N2C[C@@H](CCNC(=O)OC(C)(C)C)Cc3ccccc32)c(O)c1O 1645198263 SDQKLKJBDDIDPD-INIZCTEOSA-N 426.513 4.140 10 10 IICE CC(=O)c1cc(F)cc(CN2CCN([C@H](C)c3ccc(Br)cc3)CC2)c1O 1653371515 PWWMBSSHTJREIX-CQSZACIVSA-N 435.337 4.375 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2C(=O)c2ccc(F)cc2)N(C)C)cc1 1653421035 HKUYFTPVZKKOIY-XMMPIXPASA-N 433.527 4.155 10 10 IICE C[C@@H](NC(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)c1ccccc1)c1ccc(N(C)C)cc1 1671845300 YNAZTTKIPNMOJO-NLFFAJNJSA-N 444.579 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@](O)(c2ccc(Cl)cc2)C1 1673745312 SWECTVJQGVDPMQ-MHECFPHRSA-N 429.992 4.339 10 10 IICE O=C(NCc1cc(Cl)ccc1O)NC[C@H](C(=O)OCc1ccccc1)c1ccccc1 1681493604 KQPQIHHTGUONST-NRFANRHFSA-N 438.911 4.372 10 10 IICE COc1ccc(OC)c([C@H](O)[C@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1683307480 HTZLFUSUGUBTFT-BXKMTCNYSA-N 437.540 4.033 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC3(c4ccc(Br)cc4)CC3)C2)cc1 1683944576 HOVDKEQLPCKXKF-QGZVFWFLSA-N 430.346 4.025 10 10 IICE CC(C)C1CCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1691970283 XVWJULXMNADDER-UHFFFAOYSA-N 436.579 4.390 10 10 IICE Cc1coc(C)c1Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1693310516 HGSRGSDVVUXWDO-UHFFFAOYSA-N 437.588 4.307 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1727028741 QCKTWSSCEKFFEP-QWHCGFSZSA-N 435.541 4.198 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCS[C@@H](C)C2)cc1 1728379955 MKCRCIPOZWVZBH-IBGZPJMESA-N 436.629 4.485 10 10 IICE CCC(CC)(Cn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1743974370 KUFXLFVERSBXMA-UHFFFAOYSA-N 441.620 4.161 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCNC(C)=O)C1 1765158287 AZRRDXABPOMMDY-OAQYLSRUSA-N 434.588 4.115 10 10 IICE CCS[C@H]1CCCCN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768381953 CJTAJBIMBSVKKO-OALUTQOASA-N 447.624 4.147 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3ccc(F)cc3F)SC2=S)N(C)C)cc1 1858594442 ZMNLVOWGWBYWDF-HRYJJRBTSA-N 434.533 4.478 10 10 IICE C[C@H]1N(Cc2ccccc2)CC[C@]1(CN)N(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 2074363236 CEGCWJOHXOMUQW-FQRUVTKNSA-N 438.616 4.139 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3cccc(Br)c3O)C(C)(C)[C@@H]21 2119292228 AIFOSYHNWLZRCR-XOKHGSTOSA-N 425.367 4.278 10 10 IICE Cc1ccc(C)c(-n2c(C)cc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1 2297352738 RBDUYYSMYXCPBK-UHFFFAOYSA-N 446.580 4.383 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)c(C)n1-c1ccc(F)cc1 2297463213 PIQBAEHJJACIQW-UHFFFAOYSA-N 435.406 4.415 10 10 IICE CCCN1C(=O)C(=Cc2ccc(OCc3ccc(Cl)cc3)c(OC)c2)C(=O)N(C)C1=O 2297578658 ZVOYWVZQZCHJRF-UHFFFAOYSA-N 442.899 4.142 10 10 IICE CCCCCOc1ccc(C=C2SC(=S)N(CCC(=O)OC)C2=O)cc1OCC 2314769203 ORQHLHIJZMTXLQ-UHFFFAOYSA-N 437.583 4.419 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3C)C2=O)ccc1O[C@@H](C)C(=O)O 2314932312 MBGCVCLUYMCQMA-ZDUSSCGKSA-N 429.519 4.261 10 10 IICE O=C(NCCCN1CCOCC1)c1ccc(-n2c(-c3ccccc3)cc3c2CCCC3)cc1 20489471 LUQVTWZSEYUCTN-UHFFFAOYSA-N 443.591 4.475 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1 105175236 ROVFZDTVOXMMBJ-UHFFFAOYSA-N 443.594 4.277 10 10 IICE COc1ccc(N2CCCN(C(=O)CCC(=O)c3ccc(Br)cc3)CC2)cc1 108579752 JRUVSYZMRZYXAO-UHFFFAOYSA-N 445.357 4.160 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3ccccc3C(=O)OC)C2=O)cc1OC 210225607 ICVVAECQEFNIDK-LDADJPATSA-N 429.519 4.286 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 727471936 RZOLRHVFGCDXOU-NRFANRHFSA-N 426.948 4.064 10 10 IICE O=C1C[C@@H](N2CCO[C@H](c3ccco3)C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 753976816 AYINAQMLBQXWMX-IRLDBZIGSA-N 430.464 4.400 10 10 IICE Cc1ccc(C(=O)N(Cc2ccccc2)C[C@@H](O)c2cccc(OC(F)F)c2)c(O)c1O 771668913 SKYAJGMTJSPJNZ-HXUWFJFHSA-N 443.446 4.384 10 10 IICE C[C@@H](NC[C@@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(N2CCOCC2)c(F)c1 773082851 XCPZHNFFJLEPQK-AEFFLSMTSA-N 440.481 4.183 10 10 IICE Cc1cc(F)cc([C@]2(F)CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)C2)c1 799893766 WPDRHOYESYZKIP-UUOWRZLLSA-N 429.511 4.312 10 10 IICE O=C1N[C@@H](Cc2cccc(Cl)c2)C(=O)N1C1CCN(c2ccc(OC(F)F)cc2)CC1 804148501 KCNXPJUJBDZEFG-IBGZPJMESA-N 449.885 4.073 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccc([N+](=O)[O-])c1Cl 809915135 SRWDYNLFMDZDKP-UHFFFAOYSA-N 443.935 4.102 10 10 IICE C[C@]12CCN(C(=O)CCCN3C(=O)/C(=C/c4cccs4)SC3=S)C[C@@H]1C2(F)F 816786835 OOFQLGVYJJAMEG-AHFYBYRISA-N 442.578 4.233 10 10 IICE Cn1cc([C@H](NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C2(CO)CCC2)cn1 821288739 WBLXYFZWPGHOHE-QHCPKHFHSA-N 432.528 4.268 10 10 IICE Cc1cc(-c2nc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)co2)ccn1 857456833 QOSJPHXUCLTLQW-INIZCTEOSA-N 428.439 4.045 10 10 IICE Cc1cc(C(=O)O[C@@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)nn1C 919587559 SUYITLMNJLOLJX-HNNXBMFYSA-N 431.439 4.166 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N(CC(F)(F)F)C1CCC1 1125023062 ZQYRKMYXABQEHB-XNTDXEJSSA-N 446.491 4.360 10 10 IICE COc1ccccc1Oc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)nc1 1137728281 ZFMCBIXBLLWOBA-HXUWFJFHSA-N 434.492 4.410 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CC[C@@H](Nc4ccccn4)CC3)cc2F)C[C@@H](C)O1 1141901476 HGUGLRNTXFWQKH-GHSBBIOCSA-N 440.563 4.121 10 10 IICE Cc1cc(CN2CCC[C@@H](NS(=O)(=O)c3cccc(F)c3)C2)ccc1N1CCCCC1 1191985682 FSDGRFWJVUVJSB-JOCHJYFZSA-N 445.604 4.067 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1230301354 XRRIKCHNPYYORK-ROUUACIJSA-N 443.975 4.388 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(COc4cccc(F)c4)cc3)C2)cc1 1252302620 PZNUPBXOVZKUAM-JOCHJYFZSA-N 449.526 4.491 10 10 IICE COCCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c1C 1292258344 QTKBBUUHENXDRW-UHFFFAOYSA-N 441.572 4.134 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccn(CCc2ccccc2)n1 1294686045 UQNMROBMNCSNFN-UHFFFAOYSA-N 428.330 4.256 10 10 IICE O=C(NCc1c(O)cccc1O)[C@H](Oc1cccc(Br)c1)c1ccccc1 1304050057 HOKGRBRSRNCIRG-HXUWFJFHSA-N 428.282 4.297 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCc2ccccc2)CCN(C)C)CCCC1 1354963477 XOADUZXCBLIMPR-UHFFFAOYSA-N 433.596 4.162 10 10 IICE O=C(Nc1cccc(N2CCCCCC2)c1)c1cc(Br)ccc1-n1cnnn1 1360776563 IOGQOTKCFOSZHW-UHFFFAOYSA-N 441.333 4.058 10 10 IICE Cc1c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)oc(=O)c2ccccc12 1435063740 HULAQIQGZYCDCT-UHFFFAOYSA-N 428.435 4.102 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Cc1cccs1 1435332616 MCNPOKQVWOHRHB-QCUKBLKESA-N 448.610 4.474 10 10 IICE COc1ccc(CCCCCC(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cc1 1438183682 CJRJJMFUWWDNBX-UHFFFAOYSA-N 426.557 4.164 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@H](C)[S@@]1=O 1449309665 NXVMYUCJYKXLAE-YGCGBWEQSA-N 437.403 4.228 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N([C@H](C)c4ccccc4)C3=O)c2C)cc1 1472976567 XUQUASRMYAHCAB-GOSISDBHSA-N 443.503 4.137 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H](C)c3ccc(Br)cc3)C2)cc1 1478861381 ZRYLMPUSCAEPFM-IRXDYDNUSA-N 446.389 4.387 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCC1(CNC(=O)OC(C)(C)C)CC1 1478923258 FYSHNEAGJKSMAH-UHFFFAOYSA-N 430.593 4.123 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC[C@H](C(F)F)C2)cc1F 1503392055 DTFLETVNGOHFBP-INIZCTEOSA-N 432.494 4.019 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(C)(C)C(F)(F)F 1508909793 LNEHPZCXCZOKPB-UHFFFAOYSA-N 439.526 4.463 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(O[C@@H]4CCOC4)c3)cc2Cl)C1 1524256033 QCTKSWPXOUSTGX-QFBILLFUSA-N 429.948 4.069 10 10 IICE CC(C)(C)Oc1cccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 1525807282 ZZDQVMOPWUAPLV-UHFFFAOYSA-N 437.462 4.044 10 10 IICE Cc1ccc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)n1 1528643972 SHBKRYPCTSBWBS-UHFFFAOYSA-N 430.268 4.423 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(=O)c1cc(Cl)cc(Cl)c1 1533991473 ATEKOKQEZNVZHS-UHFFFAOYSA-N 446.378 4.025 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)cc1 1542490396 MEZAPEZWEWSHQQ-KRWDZBQOSA-N 435.883 4.275 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)C[C@@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543033865 RPCKOJDWNDRRIR-HDICACEKSA-N 435.620 4.045 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccco1 1547310659 CKOKGJJGACKXPI-UHFFFAOYSA-N 446.555 4.060 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(CC)C[C@H]2CCCO2)cc1 1547443955 IBURMMLMFYFIGJ-HSZRJFAPSA-N 434.588 4.240 10 10 IICE COc1ccc(C)cc1[C@H](C)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559895152 RHRKDBVSLXUXGS-INIZCTEOSA-N 428.488 4.068 10 10 IICE COc1cc(OC)c(CCNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c(OC)c1 1565688777 IRNMELJLPZZOOG-UHFFFAOYSA-N 426.488 4.232 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 1567777414 VZZSSGKIMCEIIC-INIZCTEOSA-N 443.594 4.414 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)cc1F 1585698813 ZPSRYEKKUPZVHU-UHFFFAOYSA-N 435.927 4.208 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cnc(CC3CC3)s2)NC(=O)OC(C)(C)C)cc1 1586619164 DOMKBFUQJSUFFZ-GOSISDBHSA-N 444.601 4.157 10 10 IICE Cc1cc(C(=O)NCC2(CN3CCOCC3)CCCCC2)c(C)n1-c1ccc(F)cc1 1587844291 CMWOVMRDJHJGRA-UHFFFAOYSA-N 427.564 4.246 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)CNC(=O)N1CCCC1 1610124573 ZLXGEQZZURMYMR-IBGZPJMESA-N 448.489 4.104 10 10 IICE Cc1cc(CN(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)no1 1611937375 IGCFJMKOZIEXEK-UHFFFAOYSA-N 440.617 4.110 10 10 IICE CCOC(=O)C[C@@H](SCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C)C(=O)OCC 1613757237 RVQASNIOCLAXHY-OAQYLSRUSA-N 449.544 4.342 10 10 IICE CCOCc1nnc(N2C[C@@H](C)C[C@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616731565 PGDNHCNJJNNKLJ-AZUAARDMSA-N 429.634 4.041 10 10 IICE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)N(Cc1ccco1)Cc1ccccc1O 1622309373 JFIQIFOURJZFPH-INIZCTEOSA-N 449.532 4.485 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(C3CC3)[C@H]2c2cccc(OC)c2)cc1 1623451934 ORVDVLDYLDONOI-AHWVRZQESA-N 449.595 4.252 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3CC(O)(c4cccc(Cl)c4)C3)cc2F)C[C@@H](C)O1 1625090036 MPGPSGQZNFLHAN-TUBKTZJHSA-N 446.950 4.007 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(c3cc(F)cc(Br)c3)CC2)N(C)C)cc1 1627463933 GXKUPBRBEJDKPJ-FQEVSTJZSA-N 448.380 4.105 10 10 IICE COc1ccc(C(=O)CCC(=O)Nc2c(-c3ccccn3)nc3ccccn23)cc1OC 1629108017 RSCHFYZAIRTZAT-UHFFFAOYSA-N 430.464 4.015 10 10 IICE Cc1sc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc1-c1ccco1 1631425676 LYLFHSGRJOZZHP-KRWDZBQOSA-N 445.972 4.394 10 10 IICE COC(=O)c1ccc(Sc2ccc(Cl)cn2)c(NC(=O)Cc2ccc(O)c(O)c2)c1 1635884782 AIEXOEKSIILAPM-UHFFFAOYSA-N 444.896 4.265 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2CCS(=O)(=O)C(C)(C)C2)cc1 1639737803 MUTIOTMLYBCBEI-KRWDZBQOSA-N 428.558 4.254 10 10 IICE COc1cc(N[C@@H]2CCCN(Cc3ccc(N4CCC(OC)CC4)cc3)C2)cc(OC)c1 1644830768 UXMLILIIFVOFSX-OAQYLSRUSA-N 439.600 4.396 10 10 IICE CCN1CCO[C@H](C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)C1 1648493754 LDHGOUYDPBQLFS-FPOVZHCZSA-N 435.490 4.019 10 10 IICE Cc1cc(C(=O)CN2C(=O)c3ccc(F)cc3C2=O)c(C)n1-c1ccc(OC(F)F)cc1 1651842039 APZPRUJCOYJBDT-UHFFFAOYSA-N 442.393 4.314 10 10 IICE COCCN(CCOc1cc(F)cc(Br)c1)c1ccc(OC)c(OC)c1 1652711854 WSAAPZDNUKDJIX-UHFFFAOYSA-N 428.298 4.137 10 10 IICE COC(=O)c1cc(OCc2csc(N(C(C)=O)c3ccccc3F)n2)ccc1N(C)C 1656825427 DBJZAHYUHHANNU-UHFFFAOYSA-N 443.500 4.398 10 10 IICE COC1CCN(c2ccc(CN(Cc3ccccc3)[C@@H](C)CN3CCOCC3)cc2)CC1 1657198206 XMTZNGWAYWJMBI-QHCPKHFHSA-N 437.628 4.025 10 10 IICE Brc1cc(CNCc2ccccc2Cn2cncn2)ccc1N1CCCCC1 1657845430 GCAKKFWVXBBCJR-UHFFFAOYSA-N 440.389 4.369 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@H](Oc3cncc(Br)c3)C2)c1O 1659186905 XCZRWMPXWOVZGO-HNNXBMFYSA-N 425.710 4.059 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCC3(O)CCC(F)(F)CC3)cc2Cl)C1 1681828104 PQOQTCSWQRFNBY-HNNXBMFYSA-N 429.939 4.316 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)Cc3cn(C)c4ccc(F)cc34)C2)cc1 1681963968 MQJSMNFQUMOHBS-QZTJIDSGSA-N 438.547 4.083 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(CCc3ccccc3)Cc3cccnc3)C2)cc1 1683782637 RQLLQQLSKKTSEX-HSZRJFAPSA-N 430.552 4.123 10 10 IICE COC[C@@H](NC(=O)NCc1c(O)ccc2c1CCCC2)c1cccc(Br)c1 1684723527 RBMTUUCZOSTSLW-LJQANCHMSA-N 433.346 4.220 10 10 IICE C[C@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1687155701 UFCZFWUAGQSSAV-RUZDIDTESA-N 443.538 4.233 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CC[C@H](OCC(C)C)C1 1693006259 SOVOTAOEMUTEJU-GOTSBHOMSA-N 441.620 4.194 10 10 IICE Cc1ccccc1Cc1nnc(N(C)Cc2ccon2)n1CCCSc1nccs1 1707659845 SGALJXVCDZEYDQ-UHFFFAOYSA-N 440.598 4.441 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1708746832 YWRCWOKFYSRGNI-SFHVURJKSA-N 440.636 4.246 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)[C@@H](C)C1 1748076652 ZBFBLAOCLCVZEL-ROUUACIJSA-N 448.615 4.217 10 10 IICE CC(C)Cc1nnc(N2CCS[C@@H](C(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1761045135 SEDBCEMFKXFQOA-JOCHJYFZSA-N 427.662 4.485 10 10 IICE COc1cccc(O)c1[C@](C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1951722019 ANWVYFIUDWIHLK-VWLOTQADSA-N 433.460 4.239 10 10 IICE COc1ccc([C@H](C2CC2)n2nc(C3CCC3)c(N)c2I)c(O)c1 2080043143 QDSYFMOTLXHBCF-KRWDZBQOSA-N 439.297 4.051 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@H]1C[C@H]2NCc1cc(Br)cc(F)c1O 2108256709 SWWOXFVOKLOKOW-OXUXUCFPSA-N 429.330 4.075 10 10 IICE CC[C@H](N[C@@]12CO[C@@H](C1)[C@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2281189062 IWCCMSNPVTUPKI-NVALYEJGSA-N 441.366 4.020 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)C2=O)cc1 2296938852 BIZANWFVFJMDEB-UHFFFAOYSA-N 449.894 4.423 10 10 IICE CCOC(=O)c1ccc(N2N=C(C(F)(F)F)C(=Cc3ccc(N(C)C)cc3)C2=O)cc1 2297312502 ALOWJGUVGIUFQV-UHFFFAOYSA-N 431.414 4.278 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)C2=CNCc2cccnc2)cc1 2297358590 CVENUGUFIVTVBU-UHFFFAOYSA-N 441.516 4.125 10 10 IICE CCc1ccc(Oc2nc3c(C)cccn3c(=O)c2C=C2SC(=S)N(C)C2=O)cc1 2314509751 YNLRYIKSYUDUBQ-UHFFFAOYSA-N 437.546 4.189 10 10 IICE Cc1ccc(S(=O)(=O)NN2C(=O)/C(=C\c3cccc4ccccc34)SC2=S)cc1 6856206 MCSFLAIKRZEEOD-CPNJWEJPSA-N 440.571 4.243 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 226740827 MGYCDGRZADLPHE-VWKPWSFCSA-N 427.888 4.451 10 10 IICE COc1ccccc1CC1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 726610785 JBSJVLFDMLCHIJ-UHFFFAOYSA-N 439.625 4.413 10 10 IICE COc1ccc(OC)c(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c1 729110604 POMWVYDCNZZDDO-UHFFFAOYSA-N 444.456 4.354 10 10 IICE COc1ccc(CC2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)cc1 749933667 QEYOIDQUIWYRKC-FQEVSTJZSA-N 437.584 4.257 10 10 IICE COC1CCC(Cc2noc(-c3cc(NS(=O)(=O)c4cccs4)ccc3O)n2)CC1 762412985 GHDWOTJAJSQQMK-UHFFFAOYSA-N 449.554 4.052 10 10 IICE Cc1ncsc1/C=C\C(=O)NCc1ccc(N(C)C(=O)/C=C/c2scnc2C)cc1 765478640 ILWUXSZERYOASH-PNQPDEHRSA-N 438.578 4.222 10 10 IICE Cc1cccc2c1CN(C(=O)OC(C)(C)C)CCN2C(=O)c1cn(C)nc1-c1cccnc1 770773936 KZHTZBOMFYAYBB-UHFFFAOYSA-N 447.539 4.188 10 10 IICE C[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1cncc(F)c1 782067142 JJPUGBJEPHSMJN-GFQQVXNGSA-N 435.571 4.141 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(=O)NCc1csc(-c2ccccc2)n1 788466098 YPVPMIWNCKLHSC-UHFFFAOYSA-N 448.592 4.075 10 10 IICE COCCOC1CCC(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 796195530 MBNZSVQSXRMZQJ-UHFFFAOYSA-N 431.504 4.181 10 10 IICE COC(=O)C[C@](C)(NCc1cc(F)cc(C(C)=O)c1O)c1ccc(Br)cc1 796497875 QCKRGECPVVYERX-FQEVSTJZSA-N 438.293 4.065 10 10 IICE Cc1ccccc1[C@@H](O)C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 804968421 DDQNKDYRCQWIPO-DEOSSOPVSA-N 439.625 4.203 10 10 IICE O=C(NCc1cc(Br)ccc1O)N[C@@H](c1cccc(F)c1)c1ccccn1 807047647 GVCSCLNQMVZNTO-IBGZPJMESA-N 430.277 4.278 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1124549118 CHBMWNARKDVDMG-UHFFFAOYSA-N 433.512 4.020 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Br)cc3cccnc23)N(C)C)cc1 1134882865 WCCRJGBYQYJOOJ-FQEVSTJZSA-N 441.373 4.096 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccccc2)cc1 1135825163 IBMFSJLUZMVBRS-UHFFFAOYSA-N 443.956 4.137 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1csc(NC(=O)c2ccccc2)n1 1136025248 CBTRHHGPCUFDBP-UHFFFAOYSA-N 434.565 4.197 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@@H](C)[S@]1=O 1157481652 CAPKRZJTMTZFGE-LNMHWPHBSA-N 437.403 4.228 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC3(C(=O)OCc4ccccc4)CCC3)c2C)cc1 1161249556 WISACYJQPLAPOZ-UHFFFAOYSA-N 432.520 4.499 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1313100037 GVQCCNVWPNGPEW-IBGZPJMESA-N 440.588 4.287 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC2(C)C)C2CC2)cc1 1313348570 MRKMBJNVWKMSEC-HXUWFJFHSA-N 430.593 4.072 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)C1(C)C 1314257656 RYXQBHVHAOVINU-RTWAWAEBSA-N 443.661 4.082 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc(-c4ccccc4)oc3C)CC2)cc1 1349003207 DMBDTJQYLDLBRO-UHFFFAOYSA-N 433.552 4.206 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CSCN2C(=O)c2ccc(C(C)(C)C)cc2)cc1F 1351738496 ONEGZYPAZSKVGV-OAQYLSRUSA-N 443.588 4.021 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)CSc3ccc(F)cc3)cc2F)CC1 1360091042 BOUVSVKRIOLCQV-KRWDZBQOSA-N 433.568 4.151 10 10 IICE Cc1ccc(C)c(N2N=C(C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CCC2=O)c1 1440685066 RINCYVPFXOJPMG-UHFFFAOYSA-N 432.568 4.435 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(Cl)c1 1447866341 OFZKTHNLCPIUQS-LJQANCHMSA-N 447.963 4.113 10 10 IICE Cc1nc2c(c(NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)n1)CCCC2 1458371208 YILKYQCXLOKCNU-OAQYLSRUSA-N 425.577 4.408 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC(C)(C)C)CC(C)(C)C)cc2F)C[C@@H](C)O1 1459889860 JFWGEBKBTBBCPG-KDURUIRLSA-N 435.628 4.450 10 10 IICE Cc1ccc(C(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1464352817 XRWNCRDKINYFJA-UHFFFAOYSA-N 439.556 4.298 10 10 IICE COc1cc(Br)c(N)c(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 1464980912 GZEDLQPFAZFZSD-UHFFFAOYSA-N 432.362 4.206 10 10 IICE Cc1cc(CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1469643639 ZFUHYCUXSHZNTI-NRFANRHFSA-N 426.561 4.197 10 10 IICE C[C@H](NC(=O)N[C@H]1C[C@@](CNC(=O)OC(C)(C)C)(c2ccccc2)C1)c1ccccc1O 1479409552 YDYZGOTZIAHTCG-FXJWSJNKSA-N 439.556 4.378 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C[C@@H](C)S1 1494328117 LOCWJDHGZFCYDV-BZUAXINKSA-N 439.676 4.489 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(F)F)C1 1504891512 BDKYIBQXPKEWOQ-GOSISDBHSA-N 429.515 4.481 10 10 IICE CC(C)C(=O)c1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 1525834200 MMRCFXKFRZNJFQ-UHFFFAOYSA-N 442.427 4.461 10 10 IICE Cc1cc(CC(=O)N[C@H](C)c2ccc(N3CCCNC3=O)cc2)c(C)n1-c1ccccc1 1534449756 HAGDVNVDPHTPSU-LJQANCHMSA-N 430.552 4.434 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC2C[C@@H](C)O[C@H](C)C2)cs1 1542898534 WLHIANQYZIYFRO-HZPDHXFCSA-N 441.601 4.179 10 10 IICE Cc1nc(Cc2nnc(N(C)CCC(F)F)n2Cc2ccc3c(c2)CCCN3C)cs1 1542902436 HOXGHWSGSYTGMT-UHFFFAOYSA-N 446.571 4.156 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@H](OC(C)(C)C)[C@H]1n1cccn1 1564771468 QYACLCSFFXXKIA-FSSWDIPSSA-N 427.593 4.066 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H]1C[C@H](Oc2ccccc2)C1(C)C 1565127651 ZBXJGZUJRJIIDQ-RPWUZVMVSA-N 437.584 4.035 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(Cc4noc(C(C)(C)C)n4)CC3)c2C)c1 1586753979 GYWXCCOXWZCDHR-UHFFFAOYSA-N 449.599 4.349 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1Cc2cc(F)c(F)cc2C1 1611210738 OBOSRDXDYQBAJZ-WSVATBPTSA-N 448.491 4.238 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1C[C@@H]1CCCC[C@@H]1C(F)(F)F 1617940710 QNCMBQYOODWKLN-JQHSSLGASA-N 438.494 4.493 10 10 IICE CC(C)c1ccc(-n2cnnc2SCC(=O)NCc2ccc3cccnc3c2O)cc1 1630527362 KQAGNDIORPJDCT-UHFFFAOYSA-N 433.537 4.053 10 10 IICE Cc1cc(C(=O)NCC(=O)OC2CCCCC2)c(C)n1-c1ccc(Br)cc1 1630775982 RMGLSSIVAHPMMT-UHFFFAOYSA-N 433.346 4.462 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1638700827 WSEVPACEHAAGMA-MHZLTWQESA-N 446.547 4.466 10 10 IICE C=CC(=O)N1CCC(C(=O)NCc2ccc(N3CCCCC3)cc2)(c2ccccc2)CC1 1639735164 SIVZYEHWOYYDDK-UHFFFAOYSA-N 431.580 4.040 10 10 IICE CC[C@@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1640088557 SQZCOCNCCDHTRR-IUODEOHRSA-N 429.355 4.100 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc(-c2ccc(OC)cc2)nc1C 1643242178 FCANAEBEGSOASO-UHFFFAOYSA-N 440.521 4.038 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(Cl)c(F)cc1Br 1643245273 MQCAXDCFBFNDOT-UHFFFAOYSA-N 444.684 4.153 10 10 IICE CC(C)c1ccc(CN(C(=O)CN[C@@H](C)c2ccc(N3CCOCC3)cc2)C2CC2)cc1 1653993749 KRAQZNRGTYGJMP-NRFANRHFSA-N 435.612 4.488 10 10 IICE Cc1cccc(OC[C@@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1672133536 WDXKJVOCOPZDLL-QUCCMNQESA-N 445.991 4.124 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3COC4(CCCCC4)O3)cc2Cl)C1 1680794041 JRKAQTAYFGYBFG-PKOBYXMFSA-N 435.996 4.451 10 10 IICE CCc1ccccc1[C@H](CNC(=O)N1Cc2cccc(O)c2C1)NC(=O)OC(C)(C)C 1686673854 UJUZPLKSZMHUMD-FQEVSTJZSA-N 425.529 4.246 10 10 IICE Cc1nc(Cc2nnc(N(C)CCC(C)C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1707747811 FZVVQRYIUGYCPN-UHFFFAOYSA-N 430.597 4.370 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H]2CSC)n1Cc1ccc(N2CCOCC2)cc1 1708505225 URVXMRFAANDJJE-GHTZIAJQSA-N 429.634 4.008 10 10 IICE CC(C)[C@@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CCS1 1723235468 BNTSLUDHEGQRSN-CVEARBPZSA-N 439.676 4.346 10 10 IICE CCc1nnc(N(C)Cc2c(C)nn(C)c2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1727502556 FYQZSPZTEPGBAV-UHFFFAOYSA-N 435.620 4.112 10 10 IICE COCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C 1749605360 WACLUEFFTUEPMF-RUZDIDTESA-N 439.604 4.232 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1766614083 KJQSFIJLXJRIAP-DEOSSOPVSA-N 448.615 4.164 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccc(F)c(C)c4)n4ccccc34)CC2)cc1 1858343375 DGYDXDAMOJSKCJ-UHFFFAOYSA-N 444.510 4.420 10 10 IICE CCCC[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858591977 FCFQSJGWAMJZAP-ALFJJAPYSA-N 432.336 4.433 10 10 IICE CCCCN(C)C(=O)Cn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@@H]21 1860347460 QJUUFMHWEVQJAL-RUZDIDTESA-N 430.552 4.047 10 10 IICE CCOC(=O)c1c(NC(=O)C2CCN(C(C)=O)CC2)sc(C)c1-c1ccc(F)cc1 1860626749 QQNBZGAHDIBHOM-UHFFFAOYSA-N 432.517 4.236 10 10 IICE COc1ccc(C=C2SC(=S)N(CC(=O)OCc3ccc(Cl)cc3)C2=O)cc1 2042444583 KALSZGNTULLPJR-UHFFFAOYSA-N 433.938 4.293 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cccc(Br)c3O)C[C@]2(C)C1 2116284820 IBZBAVUHEYYARK-AUSJPIAWSA-N 425.367 4.280 10 10 IICE CCOC(=O)c1sc(N2N=C(C)C(=Cc3cc(C)n(-c4cccnc4)c3C)C2=O)nc1C 2293638407 VDZGSHMXBMUTBH-UHFFFAOYSA-N 449.536 4.237 10 10 IICE CC[C@@H](C)n1cc(C=C2C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c2ccccc21 2296929591 MUWYVJYOMIBAQC-CQSZACIVSA-N 431.448 4.007 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)C2=Cc2ccc(OC)c(O)c2)cc1 2332100168 RZTZQCKAPDUGSN-UHFFFAOYSA-N 432.451 4.379 10 10 IICE Cc1ccc(CN(C)C(=O)CN(C(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2380773473 QCIJGAFXSZRTTK-UHFFFAOYSA-N 443.382 4.457 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl 550279669 SNJWUNBBSMDOOR-UHFFFAOYSA-N 429.948 4.108 10 10 IICE CCOc1ccc(S(=O)(=O)N(c2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)cc1 586254939 XNUBFWYCYMPEFV-UHFFFAOYSA-N 449.528 4.464 10 10 IICE CC(C)CNC(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 586619207 RAYBRARJVAGUOG-UHFFFAOYSA-N 441.487 4.492 10 10 IICE CN(C)Cc1cc(CNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)ccc1F 734677317 PUYAFRNQDPAKFG-UHFFFAOYSA-N 438.547 4.458 10 10 IICE O=[N+]([O-])c1cc(CN[C@@H](CO)c2cccc(Br)c2)ccc1N1CCCCC1 765288134 ZJOVPPYVIHLLPX-SFHVURJKSA-N 434.334 4.171 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 765771215 VPRJRZHFYRSJPA-QWHCGFSZSA-N 430.220 4.473 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)C[C@@H](O)c2cccs2)C1 768099776 YYAVHPADFOFMMN-VGOFRKELSA-N 425.598 4.098 10 10 IICE C[C@H](C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cn(C)c2ccccc12 772212207 NSSPIOKZEABKFI-FQEVSTJZSA-N 430.596 4.130 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3C[C@@H](C[C@@H]4COCC(=O)N4)c4ccccc43)c2C)c1 807705046 AXDYEJDANHVLOR-NHCUHLMSSA-N 443.547 4.052 10 10 IICE C[C@@H](Oc1ccc(F)cc1)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCO1 812264446 JCDFQRJPEODEEJ-UZLBHIALSA-N 426.492 4.078 10 10 IICE CC(C)n1ncc2cc(/C=C\C(=O)N3CCCc4cc(Br)ccc43)c(=O)[nH]c21 918677152 NVCPXDIRJXRPPX-YVMONPNESA-N 441.329 4.061 10 10 IICE O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC(F)F)cc3)cs2)s1 920044569 JHPCYJKFVQLEPV-UHFFFAOYSA-N 433.439 4.182 10 10 IICE COc1cccc(O[C@H](C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1126527030 LCIHLOMRYODUHN-LJQANCHMSA-N 435.568 4.000 10 10 IICE CCOC(=O)[C@@H](COC)N(C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1)C1CC1 1128080232 MAIFLEDLRFWVDZ-JOCHJYFZSA-N 438.528 4.351 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(N4C[C@@H](C)O[C@H](C)C4)nc3)c2C)c1 1132263279 CAWPBZNBTCZKHR-WOJBJXKFSA-N 432.568 4.341 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@H]2CCN(c3ccccc3Cl)C2=O)c1 1136689222 ANRRAKYDFMXROD-QHCPKHFHSA-N 449.938 4.438 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CCOCC2)C2(CO)CCC2)c(C)n1-c1cccc(Cl)c1 1143573473 MRTVRTIRQIXLPY-QFIPXVFZSA-N 430.976 4.435 10 10 IICE C[C@@H](CSC(F)(F)F)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1147505483 JXDMMOGVNPIJDB-XJKSGUPXSA-N 449.539 4.324 10 10 IICE CO[C@@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1227208223 LVTGVANCURWKDO-LIRRHRJNSA-N 433.902 4.439 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@@H](c4nccn4C)C3)cc2Cl)C1 1227210273 ZDFRGWICDPQNGB-PLMTUMEDSA-N 445.995 4.029 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@@H](c2ccc(F)cc2)CC1 1233605745 YOPRIVDBNVBCJK-HXUWFJFHSA-N 425.548 4.266 10 10 IICE COc1cccc([C@@H]2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)C2(C)C)c1 1256237019 PBTCYPFYPMHFME-BJKOFHAPSA-N 438.616 4.342 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccn(-c2ccc(Br)cc2)n1 1276283879 NZOLWFCGFLSWHR-MRXNPFEDSA-N 441.373 4.370 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1 1294532257 SAYACHZPJAOVHX-OAQYLSRUSA-N 443.547 4.189 10 10 IICE Cc1cc([C@](C)(O)Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)c(C)o1 1304152458 NRLFZDOYBUXBHW-XMMPIXPASA-N 426.561 4.326 10 10 IICE C[C@H]1C[C@H]1Cn1c(-c2cc(Br)cn2C)nnc1N(C)Cc1ccccc1O 1304951886 OYMSOXTYLDKEEO-ZFWWWQNUSA-N 430.350 4.044 10 10 IICE Brc1cc(CN[C@H]2CCCC[C@@H]2N2CCOCC2)ccc1N1CCCCC1 1308305584 QHLAPKMYKOVWDF-UNMCSNQZSA-N 436.438 4.172 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCOc2ccc(Br)cc2C1 1312883735 DSCBMXRDYGRDFW-INIZCTEOSA-N 446.389 4.359 10 10 IICE CC[C@H](C(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1 1356036127 ASZAEYLEMLKIPE-SFHVURJKSA-N 435.337 4.235 10 10 IICE CN(c1ccc(CNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1)C1CCCCC1 1442450639 QXUXDNHCCHXEHU-UHFFFAOYSA-N 425.485 4.065 10 10 IICE Cc1cc(C(=O)N2CCn3ncc(Br)c3C2)c(C)n1-c1cccc(Cl)c1 1453475312 HZLRMADCARMGDY-UHFFFAOYSA-N 433.737 4.363 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc2c(c1)CCOC2 1461635192 ZVPGFOBFYONHBA-YBFXNURJSA-N 442.537 4.128 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)CCCC1 1461738998 WOGWSMJSCOCLGO-VWLOTQADSA-N 441.572 4.044 10 10 IICE CCO/C=C\[C@](O)(CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468481142 LUGAODOGKDEENJ-VJIACCKLSA-N 430.854 4.321 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCC[C@H]3COC(=O)NC3CC3)c2C)c1 1471033856 IRPSHGNFNVUQQO-QHCPKHFHSA-N 438.572 4.355 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)NCc1cc(Cl)cc(Cl)c1O 1479498010 LLYCRHKEMDIOMA-SNPRPXQTSA-N 430.332 4.039 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CO[C@@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1534550464 XHFOVCWFTJCWTC-GGAORHGYSA-N 440.584 4.280 10 10 IICE CC(C)c1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1541339458 BPKWINPXBAOWOI-GOSISDBHSA-N 429.584 4.298 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1 1544343263 VIJDRSYJQVPKSY-NVQXNPDNSA-N 431.580 4.422 10 10 IICE Cc1ccc(-n2cc(C(=O)NCc3ccc(N4CCOCC4)cc3)c(C(C)(C)C)n2)cc1 1583335306 VZQHCFPQGIHFRN-UHFFFAOYSA-N 432.568 4.245 10 10 IICE Cc1cc(C(=O)N2CC(=O)N(C(C)C)C(C)(C)C2)c(C)n1-c1ccc(Br)cc1 1587102548 DNDBGLPIYWORJS-UHFFFAOYSA-N 446.389 4.328 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(S(C)(=O)=O)ccc3Cl)c2C)c1 1587880746 HLBVWTMHXLDSBF-UHFFFAOYSA-N 430.957 4.389 10 10 IICE C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1612821172 NLEXGXBBYLUBEP-APWZRJJASA-N 441.576 4.143 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCn2cccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1613182831 COOWVMKPRRLKNG-OAQYLSRUSA-N 435.620 4.409 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCS1 1613295204 COIFJOWXDQLEQV-GHTZIAJQSA-N 429.634 4.413 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1613663397 FIXCUSJACPSLEP-LJQANCHMSA-N 437.588 4.129 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@@H](C)N(CC)C[C@@H]3C)nnc2C(C)(C)C)cc1 1615382535 ZTOMEPKFMZSOIM-UXHICEINSA-N 426.653 4.389 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C/c3ccc(F)c4ccccc34)cc2)CC1 1616601539 ZMBXESQGLFCXIO-XYOKQWHBSA-N 431.511 4.010 10 10 IICE CCOCc1nnc(N2CC[C@@H](C)[C@@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616775716 VXLVJYWORJFZFW-NQIIRXRSSA-N 429.634 4.041 10 10 IICE Cc1cc(CC(=O)NCc2ccc(Cn3cncn3)cc2)c(C)n1-c1ccc(Cl)cc1 1625413861 YJVAJGAFLKDSBD-UHFFFAOYSA-N 433.943 4.246 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1 1632133775 HMUUSHWQMAEOFC-SFHVURJKSA-N 437.565 4.252 10 10 IICE C[C@@H](NC(=O)NCc1cc(Br)ccc1Br)c1ccccc1O 1634405724 DXQNCZBOMJYRNT-SNVBAGLBSA-N 428.124 4.478 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)[C@H]1Oc1ccccc1 1639222165 PAKJWKITAXKOBE-ISJGIBHGSA-N 434.536 4.458 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1cc(Br)c(O)c(Br)c1 1639966178 WYKDYKKIZOBHNB-UHFFFAOYSA-N 435.499 4.206 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(Cl)cc3C(C)C)CC2)cc1 1640807469 JTUKQGVEAQBANX-ZHACJKMWSA-N 441.959 4.316 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](Cc2ccncc2)C(=O)OC(C)(C)C)c1C 1643733308 NTYGTQPMWZIAAI-JOCHJYFZSA-N 433.552 4.480 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)Nc1ccc(Cl)nc1 1644585148 WHUWODATRQPLEE-UHFFFAOYSA-N 430.936 4.151 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1)c1ccc(N(C)C)cc1 1671851652 HSWVVQPAAXVEKD-CRAIPNDOSA-N 431.378 4.154 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)C[C@@H]2O 1675108196 LJQVJNQGHDQDJM-QFIPXVFZSA-N 449.551 4.179 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1csc2ccccc12 1676130331 FJCDDOJNCOIHQR-MRXNPFEDSA-N 436.581 4.163 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccc(SC)c(OC)c3)C2)cc1 1683337130 VNESZBHBSAKZEH-SFHVURJKSA-N 429.586 4.094 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2ccc(Cl)c(Cl)c2)CC1 1684141773 MVLDOXNUBNCAQF-UHFFFAOYSA-N 434.367 4.443 10 10 IICE Cc1ccc([C@@H](CC(F)(F)F)NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1686018176 JDYQSLFBHZVDNX-OAQYLSRUSA-N 434.506 4.240 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(CC)C1 1709899170 MGHPHKRBGGSPIB-SANMLTNESA-N 448.615 4.457 10 10 IICE C[C@H]1CN(c2nnc(CC3CC3)n2CCCSc2nccs2)C[C@H](C(F)(F)F)O1 1726715024 OGRUBCDCQSCNHN-GXTWGEPZSA-N 447.552 4.026 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752767626 GKJAHJHKEAFAOU-RBUKOAKNSA-N 429.584 4.442 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1766611414 FBVYIGHNZIMTEB-VWLOTQADSA-N 434.588 4.240 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@@H](C(F)F)C2)cc1F 1768495202 YIEJCIJNHWMGHX-QGZVFWFLSA-N 430.478 4.075 10 10 IICE CNc1cc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)c(Nc2ccccc2)c(F)c1N 1858181022 DFIUGNYOPCUCOY-UHFFFAOYSA-N 440.475 4.471 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)cc1 1860074859 TZKMIBMHMZBVCU-XDHOZWIPSA-N 444.553 4.479 10 10 IICE COC(=O)c1ccc(/C=C2/C(=O)N(Cc3ccccc3F)N=C2c2ccc(OC)cc2)cc1 1865675387 FIEQGXCSEGUTNF-PXLXIMEGSA-N 444.462 4.451 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(Br)c2O)C[C@H]1C1CC1 1895874236 LOVLOYDXEQUZJQ-WBVHZDCISA-N 425.367 4.422 10 10 IICE CN[C@H](c1ccc2c(c1)CCCN2C)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044757134 VCWBABHUCHFXJW-ISKFKSNPSA-N 439.600 4.440 10 10 IICE Cc1c(C2(C)CC2)nn(Cc2cc(Br)ccc2O)c1I 2079800190 RPMCSVRYHCENHZ-UHFFFAOYSA-N 447.114 4.364 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@H]1CCNCc1ccc(Br)cc1O 2226208170 SWWXOYLDGRTZSU-AWEZNQCLSA-N 435.309 4.279 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@H](C)N(C(=O)OC(C)(C)C)C2)c1O 2227748505 AWLCMEHCNSAIOL-QWHCGFSZSA-N 429.355 4.041 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCCC[C@@H]2NC(=O)OC(C)(C)C)c1O 2236054301 HBRLNUGTQHDNQQ-HOTGVXAUSA-N 443.382 4.479 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccc(O)c(OC)c2)cc1 2332134730 DJTXTKVFXWFVIG-UHFFFAOYSA-N 430.460 4.253 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1ccccc1Cl 20236603 WNWZJVHVSOMMKL-FQGGWLGYSA-N 437.839 4.018 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3C)C2)sc2c1CCCC2 21347639 SDLLPMIACPRYFS-OAHLLOKOSA-N 426.538 4.104 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)c(C)n1-c1ccc(F)cc1 23156343 BTGLRVPWBBLACZ-DEOSSOPVSA-N 439.506 4.176 10 10 IICE CN(C)c1ccc([C@H]2Nc3ccc(Cl)cc3C(=O)N2NC(=O)c2ccc(O)cc2)cc1 39919433 PQWOKJZQRVWPLR-NRFANRHFSA-N 436.899 4.023 10 10 IICE CC(C)C1=NN2C(=N)/C(=C\c3ccccc3OCCOc3ccccc3)C(=O)N=C2S1 103494457 KATIHWFLTCUOAE-ZBXKHPAOSA-N 434.521 4.420 10 10 IICE Cc1cc(/C=C/C(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)c(C)n1-c1ccccc1 110705475 CFQBEDMHVMDUSU-BTUVCSFDSA-N 442.607 4.212 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1OC 206172133 LZFJQZMPPCMGBP-CPNJWEJPSA-N 442.562 4.339 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC(Cc4cc(OC)cc(OC)c4)C3)ccc21 485825128 TWVZEBCYOJCPCC-UHFFFAOYSA-N 436.552 4.236 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(NC(=O)CC4CCCC4)CC3)ccc21 521791876 HBBFNKSRIIQQNL-UHFFFAOYSA-N 439.600 4.206 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NCc1cc(Br)cc(F)c1O 715828012 NKBYZWDLLPBZAG-HNNXBMFYSA-N 429.330 4.173 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cnn(-c3cccc(Cl)c3)c2)cc1 751407951 WVAOBXRQNQCFNJ-QHCPKHFHSA-N 438.959 4.413 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](C)c3ccc(-n4ccnc4C)cc3)CC2)cc1 754926008 MGJWAQRAEZEQDD-IBGZPJMESA-N 433.556 4.172 10 10 IICE COc1cc(N2CCN(C(=O)CC3CCC(C(F)(F)F)CC3)CC2)cc(OC)c1OC 759224106 BHMGWNCZQBFYSX-UHFFFAOYSA-N 444.494 4.120 10 10 IICE CC[C@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nc2ccccc2[nH]1 769037572 PKGAGHCVZBVIIA-QFIPXVFZSA-N 446.599 4.045 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H](O)c2cc(F)cc(Cl)c2)C1 787815647 FCQZGYLYGWKEEO-QHCPKHFHSA-N 443.950 4.050 10 10 IICE O=C(NCc1ccc(Oc2ccc(F)cc2)nc1)NCc1cc(Br)ccc1O 804922831 HGCXXQAPUYETMW-UHFFFAOYSA-N 446.276 4.481 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](c4nncn4C4CC4)C3)n2C)c(C)n1-c1ccccc1 809806667 DZXYQWVYUSPXTQ-IBGZPJMESA-N 442.571 4.200 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3CCCCCC[C@H]3NC(=O)OC(C)(C)C)CC2)cc1 1127275746 NMMIJXSJXPLKDO-FGZHOGPDSA-N 445.604 4.208 10 10 IICE CCCN1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C(C)(C)C1=O 1138520050 VOPGAFOYGQMXAB-UHFFFAOYSA-N 446.389 4.330 10 10 IICE C[C@H](CC(=O)NCc1ccc2cccnc2c1O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1142728667 ZKMQTKBABFAHCX-VQIMIIECSA-N 427.545 4.230 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2c3ccc(Br)cc3nn2C)cc1F 1144978526 RERBYSZRVPHSLF-UHFFFAOYSA-N 433.325 4.251 10 10 IICE CC(C)COc1ccc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1150347121 FRZYABYZEPZFMI-NRFANRHFSA-N 430.976 4.404 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCCc3c(C(F)(F)F)[nH]c4ccccc34)C2)cc1 1230857502 CCTAICPLUGARTI-OAHLLOKOSA-N 446.473 4.316 10 10 IICE CCC(CC)c1cc(Cn2c(C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)on1 1291979261 YWSJYOPQBWWYNO-UHFFFAOYSA-N 442.539 4.001 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCCC(=O)N1CCc2ccccc21 1293040396 HFTFGZNIFVVWIQ-UHFFFAOYSA-N 429.520 4.006 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2cccnc2Cl)NC(=O)OC(C)(C)C)cc1 1293793258 NAFPCTNTWBIQJA-IBGZPJMESA-N 446.979 4.116 10 10 IICE CCc1ccc(Br)cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1293989670 RHTFYTCUYORPOJ-UHFFFAOYSA-N 435.337 4.042 10 10 IICE Cc1cc(C(=O)N[C@H]2[C@H](C)N(C(=O)OC(C)(C)C)CC[C@H]2C)c(C)n1-c1ccccn1 1297536600 AAILZWXBXQMFCJ-FYINFDKHSA-N 426.561 4.253 10 10 IICE Cc1cccnc1[C@@H](C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1305303905 FWJORZIBQJWPRD-IZCBMXNHSA-N 431.608 4.310 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCc3cc(Br)ccc32)cc1 1313222122 NVRSDNJNHIWFHD-HXUWFJFHSA-N 432.362 4.223 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C1 1314271277 DJCBFRIDMROZTM-JTHBVZDNSA-N 441.620 4.072 10 10 IICE C[C@H](Oc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1354785690 WJWADZRRYYBWSN-AWEZNQCLSA-N 442.865 4.279 10 10 IICE CNc1ccc(C(F)(F)F)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1355129533 FRIHVVMYCXQHRC-OKILXGFUSA-N 439.453 4.430 10 10 IICE Cc1cc(O[C@H](C)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1Cl 1356037193 UOCVBAZCFRNMSG-BRWVUGGUSA-N 434.939 4.485 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NC1CCN(c2ccc(OC)cc2)CC1 1359816613 NUKBYHIJCJTHHU-ATIYNZHBSA-N 435.612 4.329 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)CCCCCO 1361095348 IZGPHHOWLLZDES-UHFFFAOYSA-N 442.995 4.015 10 10 IICE COc1cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)ccc1C 1442224250 UGWUIYULNUWTRE-UHFFFAOYSA-N 428.330 4.499 10 10 IICE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)c(Cl)c1Cl 1443711288 LTVAVMJWDHGZPN-QMMMGPOBSA-N 437.732 4.215 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(OCCCc3ccccc3)C2)cc1 1445084627 WRLVQRHDXCTLFO-UHFFFAOYSA-N 430.548 4.309 10 10 IICE Cc1cc(C(=O)N[C@H](c2nc(=O)o[nH]2)C(C)(C)C)c(C)n1-c1ccccc1Br 1452151431 OOGAUQPHVWVWAG-MRXNPFEDSA-N 447.333 4.050 10 10 IICE CSc1ccc(/C=C\C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1458016806 HJEMTGYJDQIJDI-NTMALXAHSA-N 427.639 4.332 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(c3cccc(Cl)c3)CCCCC2)c1 1468235493 SFHZPXFPWRJRAV-UHFFFAOYSA-N 436.961 4.049 10 10 IICE CC(C)(C)OC(=O)N1CCCc2c(CNC(=O)NCc3c(O)cccc3F)cccc21 1470389557 UEKMJHLNCYDLIF-UHFFFAOYSA-N 429.492 4.218 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1cc(Cl)cc(Cl)c1F 1471087789 LWEULLSBHKNLFR-UHFFFAOYSA-N 440.346 4.341 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CN(C(=O)OC(C)(C)C)CC34CC4)c2C)cc1 1472372067 VICLNDMXJSQOQY-OAQYLSRUSA-N 439.556 4.232 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC[C@](C)(CC)O1 1503013915 HNLHGQBYBIWTIE-DHLKQENFSA-N 441.620 4.399 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2C[C@@H](C)O[C@H](C)C2)cc1 1515532874 SYLXQXDQRCUNJR-KNKQGSTJSA-N 427.593 4.028 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC(C)(C)OC(C)(C)C2)cc1F 1517003617 LYGDXBCLTXIFPM-FQEVSTJZSA-N 445.583 4.167 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@]3(C)CCCS3)CC2)cc1F 1518309050 OFYDQAYKITZTDX-QHCPKHFHSA-N 447.624 4.336 10 10 IICE C[C@H](CCc1ccco1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1524802693 DDGFHROWVCPAHU-VVTMIQRTSA-N 432.542 4.148 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)c3ccc(Br)cc3)cc2F)CC1 1530377425 SINCNULSRRCENY-INIZCTEOSA-N 448.380 4.150 10 10 IICE COC(=O)[C@H](C)[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1534151039 LORZEDUEEAKKEO-NSYGIPOTSA-N 434.536 4.195 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1 1542490757 XRUYKFAKUXYRMR-RTWAWAEBSA-N 436.474 4.013 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC1CC(OC(C)(C)C)C1 1543147596 ZHUXFCWSDHKDPS-UHFFFAOYSA-N 441.620 4.043 10 10 IICE C[C@]1(C(=O)NCc2cccc(Br)c2O)CC(c2cccc(Cl)c2F)=NO1 1556481195 NVNJFSNRYWVWPL-GOSISDBHSA-N 441.684 4.147 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCc4cc(C)cc(Br)c4C3)C2)cc1 1565055570 GEAMQYGKWZCVII-KRWDZBQOSA-N 444.373 4.113 10 10 IICE CC(C)Oc1cc(Cl)ccc1CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1565287617 JIMPIKXAOOYFES-NRFANRHFSA-N 432.996 4.295 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CC(c4ccc(OC)c(C)c4)=NO3)ccc21 1567999500 PUIKGFPEFHSGRU-OAQYLSRUSA-N 449.551 4.145 10 10 IICE COCCCOc1cccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1583213239 XYIKLNYURVWBOO-UHFFFAOYSA-N 449.595 4.140 10 10 IICE CNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1584894969 GUDGQKXKILJUOR-HSZRJFAPSA-N 429.524 4.255 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(-c4ccc(Cl)cc4Cl)c3)C2)cc1 1598364377 RUENMXZJXJWCAJ-HNNXBMFYSA-N 445.350 4.444 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1612945204 YVJIGIYFLCZRIQ-PKOBYXMFSA-N 429.584 4.298 10 10 IICE CON(C)c1nnc(-c2ccccc2Br)n1CCCSc1nccs1 1620120771 LMGYQCXLSRWVRC-UHFFFAOYSA-N 440.392 4.344 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2ccc(O)cc2c1O 1620752858 CJNRMLHNKXKKDV-OAHLLOKOSA-N 428.435 4.251 10 10 IICE CN(c1ccc(CNC(=O)[C@]2(C)CN(C(=O)OC(C)(C)C)CCO2)cc1)C1CCCCC1 1625905471 UNKIZQAWFIRDFY-VWLOTQADSA-N 445.604 4.098 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)c2ccccc2)c(C)n1-c1ccccc1Br 1628035525 IWQIHUCSMODMJP-JOCHJYFZSA-N 427.342 4.494 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C 1630181022 RCXJHBNZOCVQEG-CVDCTZTESA-N 425.573 4.059 10 10 IICE O=C(NC1(c2ccccc2F)CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1638950874 BBZPTGJLEOZNDG-UHFFFAOYSA-N 446.525 4.203 10 10 IICE CCOC(=O)C[C@@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)CC(C)C 1640882612 ZCGGTICRQSFREC-FQEVSTJZSA-N 441.616 4.140 10 10 IICE COc1ccc(N(CC(=O)N2c3ccccc3NC(=O)C[C@@H]2C(F)(F)F)CC2CC2)cc1 1643139824 JHMHBVQEOYSXJB-HXUWFJFHSA-N 447.457 4.218 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)CC[C@H]1C1CC1 1643394559 LGAGWJHQEKOXMN-VXKWHMMOSA-N 427.589 4.471 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4cc(C(F)(F)F)ccc4C3)C2)cc1 1682188305 NBYYNMLTANKBMQ-MRXNPFEDSA-N 433.474 4.308 10 10 IICE CCO[C@]12CCC[C@@]1(NC(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)CCO2 1686268261 AXQUCVIIBMKHIN-ZQMYSKGWSA-N 435.996 4.451 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1686826453 IRFJBBQYGIJSOY-GHTZIAJQSA-N 444.620 4.223 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(C)[C@H]2CCC[C@H](C)C2)cc1 1695623449 DLLWSUSATDVJOQ-NYVOZVTQSA-N 438.620 4.139 10 10 IICE CC(=O)Nc1ccc(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cn1 1722807263 XYOPWMHFDMKFCW-UHFFFAOYSA-N 447.587 4.040 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCSC(C)C)CC2)cc1F 1730180904 VXSYCJDXTXZLRA-UHFFFAOYSA-N 435.613 4.192 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(=O)NC)C1 1765769241 ADZQNBXWIAOWLV-RUZDIDTESA-N 434.588 4.115 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)C(C)(C)C1 1767787398 ACZFYVDTZFHCDM-SFHVURJKSA-N 448.615 4.361 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)(C)C)C1 1771329728 FKARLNSMRIMTCP-NRFANRHFSA-N 437.588 4.393 10 10 IICE COc1cc(N2CCC(NC(=O)C34CC5CC(CC(C5)C3)C4)CC2)cc(OC)c1OC 1858044366 PVSOTJNICCKGMB-UHFFFAOYSA-N 428.573 4.014 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)Cc4ccc(Cl)cc4)cn3)CC2)cc1 1858421322 MJTQCMBKVBKZHZ-UHFFFAOYSA-N 436.943 4.251 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@@H](C)[C@@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 1858588399 DABHEVGAQJTHJY-NEUTWTPCSA-N 434.539 4.335 10 10 IICE O=C1/C(=C\c2cc(Br)ccc2O)C(C(F)(F)F)=NN1Cc1ccccc1 1865672370 YYSYKBFZFZSODQ-ZROIWOOFSA-N 425.204 4.499 10 10 IICE Cc1cc(C)c2c(=O)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c2c1 1866413636 FUDLRPZPDYYCQR-DEOSSOPVSA-N 446.595 4.168 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4cccc(N(C)C)c4)cc3)CC2)cc1 1872884070 JLNDXJAJXYXZBO-UHFFFAOYSA-N 444.579 4.336 10 10 IICE CN(Cc1ccccc1I)c1ccc(CO)cc1Br 2265545322 KTORQTYLXUUJIF-UHFFFAOYSA-N 432.099 4.182 10 10 IICE CC1=NN(c2ccc(I)cc2)C(=O)C1=CNc1ccc(O)cc1C 2297104443 WTVOQGXWIHTBKS-UHFFFAOYSA-N 433.249 4.024 10 10 IICE COc1cc(C=C2C(=N)N3C(SC)=NSC3=NC2=O)ccc1OCc1ccccc1 2297341032 HQSVPSPUNBYADA-UHFFFAOYSA-N 438.534 4.214 10 10 IICE CCOC(=O)c1ccc(NC(=O)CCN2C(=O)C(=Cc3ccccc3)SC2=S)cc1 2297476546 MSBTWFQRYNHNGS-UHFFFAOYSA-N 440.546 4.093 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc(O)cc2)SC1=S)Nc1ccccc1C(F)(F)F 2314828196 RFXMOEONMGHHLF-UHFFFAOYSA-N 438.452 4.251 10 10 IICE O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccnc1)N2 14547160 HEPZVZBTBUTURQ-HWBMXIPRSA-N 431.561 4.429 10 10 IICE N=C1/C(=C\c2ccc(OCc3ccccc3)cc2)C(=O)N=C2SC(N3CCCCC3)=NN12 20356462 YZEPOLVZMAUGOD-DWCAQMBTSA-N 445.548 4.328 10 10 IICE Cn1c(CCc2ccccc2NS(=O)(=O)c2cccc3nsnc23)nc2ccccc21 21357014 MYMKUSSNDLHUKK-UHFFFAOYSA-N 449.561 4.164 10 10 IICE Cc1nc(-c2ccc(N3CCN(C(=O)c4ccc(-n5c(C)ccc5C)cc4)CC3)cc2)no1 35552673 YGNMFPRSJDVYHB-UHFFFAOYSA-N 441.535 4.415 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1OCC 40940516 QYTHRCAEFOWBIJ-UYRXBGFRSA-N 442.562 4.339 10 10 IICE Cc1ccsc1[C@@H]1Nc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2[C@@H]2C=CC[C@@H]21 226671809 TVZJABPZMJNSFD-CQSHLORDSA-N 430.595 4.340 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccccc3OC)[C@H]2c2ccc(O)c(O)c2)c1 526407906 SQUBCUZHXYFWGV-QHCPKHFHSA-N 449.459 4.181 10 10 IICE COc1ccc(OC)c(N2C(=O)/C(=C\c3ccc4c(c3)CCCN4C)SC2=S)c1 726625920 QLIFPHSZWGIIDP-UDWIEESQSA-N 426.563 4.492 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCCC4)cs2)cc1 733732055 URIZMEWMOBVMND-UHFFFAOYSA-N 442.562 4.205 10 10 IICE COC(=O)/C=C\c1ccc(S(=O)(=O)Nc2nc(-c3cc(C)ccc3OC)cs2)cc1 747858244 QZCTUFLHIWYMBA-XFFZJAGNSA-N 444.534 4.114 10 10 IICE C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(Cl)c(Cl)c1O 756770391 WPPYPXLNDOPYJM-CQSZACIVSA-N 443.396 4.475 10 10 IICE CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 769107263 XIROBXUPACBJJE-XYPWUTKMSA-N 425.913 4.316 10 10 IICE CN(CCC(F)(F)F)[C@H](CNC(=O)NCc1ccccc1O)c1ccc(Cl)cc1 790883738 XQOPWRBLPONGGE-QGZVFWFLSA-N 429.870 4.470 10 10 IICE CCn1c([C@H]2OCC[C@H]2c2ccccc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 801968335 ZZBHFBHPGYSMFJ-ZEQRLZLVSA-N 447.583 4.016 10 10 IICE Cc1ccc(F)cc1-c1nnc(NC(=O)NCc2cc(Br)ccc2O)s1 806498964 ITQJQGFIVHHXBV-UHFFFAOYSA-N 437.294 4.442 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(C)[C@H](C)c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917011264 UXTGLPSSCLFWBB-KZNAEPCWSA-N 447.982 4.402 10 10 IICE O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc(-c3cccc(Br)c3)cs2)s1 920041873 PETFUUCHXJWHGP-UHFFFAOYSA-N 446.329 4.343 10 10 IICE Cc1ccc(-c2ccc(/C=C3/C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)cc1[N+](=O)[O-] 1084432705 RVAGNIPPGWWFPC-AQTBWJFISA-N 431.404 4.172 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC[C@H](C)N(C)Cc2ccccc2)C1 1126867653 FPWUVBHJFCWPKE-QFIPXVFZSA-N 446.639 4.435 10 10 IICE CC[C@@](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)(C(=O)OC)c1ccccc1 1128910185 BIZNSUIZODWSSJ-SANMLTNESA-N 434.536 4.123 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(C2CCN(C(=O)OC(C)(C)C)CC2)o1 1135690202 RTAYADPZCIOPAT-UHFFFAOYSA-N 442.560 4.127 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC(=O)OCc3ccccc3Cl)c2C)cc1 1136739123 KYRHMUCBUKNWMQ-UHFFFAOYSA-N 426.900 4.229 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2ccc3ccccc3c2)cc1 1137389490 LEFDHUANROYZDE-SANMLTNESA-N 426.516 4.452 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)[C@@H]1OCCc2sccc21 1139584612 HMPOBPCYIYTEJI-MWTRTKDXSA-N 444.597 4.387 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@](C)(Cc2ccccc2)[C@@H](C)O)C1 1140089253 LOIVFHOELDKYJM-LYZGTLIUSA-N 447.623 4.154 10 10 IICE CC(C)CN(CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)C(=O)OC(C)(C)C 1142712970 LRENFTPKFFPJBP-QFIPXVFZSA-N 447.620 4.153 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CCO)c3cc(Cl)cc(Cl)c3)C2)cc1 1230858886 PWOLXHBKRVHLFC-YLJYHZDGSA-N 438.355 4.004 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(OCc4ccccc4F)CC3)C2)cc1 1252114640 DPXUIRRVSYITII-IBGZPJMESA-N 441.547 4.051 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1C[C@H](C)O[C@@H](C)C1 1289424566 YIFXBQSGHQYVMJ-IRXDYDNUSA-N 440.979 4.030 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCN1CCSCC1 1291443075 QVJOSGFFBMTDED-FQEVSTJZSA-N 442.677 4.077 10 10 IICE O=C(Nc1sc2c(c1C(=O)NCCCSc1nccs1)CCC2)c1ccco1 1292996424 DNYZAYXZSICWFO-UHFFFAOYSA-N 433.580 4.451 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCS[C@@H](C(C)C)C2)cc1 1295420520 RJHCABHIFFUTDZ-IFMALSPDSA-N 443.661 4.254 10 10 IICE COc1ccccc1-c1nnc(N(C)C[C@H]2CCCO2)n1CCCSc1nccs1 1300473529 GHEMJNUAMKYAQP-MRXNPFEDSA-N 445.614 4.208 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1300833492 DUHBUGZMXRYDIP-HXUWFJFHSA-N 443.592 4.045 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2CCOCC2)n1Cc1ccc(N2CCSCC2)cc1 1305390647 DZIJKQSMBVJQLE-IBGZPJMESA-N 443.661 4.256 10 10 IICE CCOc1ccc(NC(=O)CN(Cc2ccco2)c2ccc(OC)c(F)c2)c([N+](=O)[O-])c1 1307528529 HVGVJSMDIMEWOK-UHFFFAOYSA-N 443.431 4.380 10 10 IICE CC1(C)Cc2cc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)ccc2O1 1355708477 QFTNTYVDFJMHNJ-UHFFFAOYSA-N 434.458 4.186 10 10 IICE CCc1ccc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)cc1 1435078487 XEPMIFFPEXDFJQ-LJQANCHMSA-N 447.501 4.259 10 10 IICE CCC(CC)(C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)c1ccc(OC)c(OC)c1 1436972543 RZFJMSCTHTYRFD-LJQANCHMSA-N 440.584 4.413 10 10 IICE O=C(C[C@H]1OCc2cc(Cl)ccc21)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445885464 RCLWHCGWAWLJDT-WIYYLYMNSA-N 435.351 4.441 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@]3(c4ccccc4)CCC(=O)NC3)cc2Cl)C1 1459574424 FOHOXYUTZWUOBV-BVZFJXPGSA-N 439.987 4.041 10 10 IICE COC(=O)c1c(NC(=O)CN2CCCCc3cc(OC)ccc32)sc2c1CCCC2 1459780884 WRCYMRORAYGQBO-UHFFFAOYSA-N 428.554 4.204 10 10 IICE CC(=O)Nc1ccc(OC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1463779851 HWKNXRPCPJZNTO-UHFFFAOYSA-N 428.286 4.429 10 10 IICE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCCC2)cc1)c1ccc(N2CCCNC2=O)cc1 1470343320 OYXNCWPLFMSMOY-LJQANCHMSA-N 435.572 4.109 10 10 IICE CCOc1cc(Br)c(CC(=O)NCc2cccc(Cl)c2O)cc1OCC 1472316079 KZMMBWIDTRCGQF-UHFFFAOYSA-N 442.737 4.464 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1 1503135224 JHLBHFHSZSZTPP-HXUWFJFHSA-N 434.588 4.016 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N2CCCC[C@@H](COC)C2)cc1 1515526311 GCKZUGBXXQTZHY-JOCHJYFZSA-N 425.621 4.378 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1c(F)cccc1F 1534810774 WMCIPLNYUCTUTE-WJDWOHSUSA-N 436.480 4.358 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)on2)c1 1535558144 JZGZUEWQYGYLSA-OAHLLOKOSA-N 441.915 4.331 10 10 IICE COc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1OC 1537657280 OTQBLSNSAVSVCQ-ATVHPVEESA-N 446.525 4.073 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)c1 1545173748 DXXIZLBNZXCBDA-LJQANCHMSA-N 437.515 4.259 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@](C)(CC)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1545406212 WYBVJRKGSIDFAE-UUOWRZLLSA-N 429.584 4.442 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCN1CCC(C)CC1 1555760366 MHBMUVRFOVAWOM-UHFFFAOYSA-N 436.604 4.472 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@H]2Cc3c(Br)cccc3[C@@H]21 1556481700 YUVBPNZXXWJESY-VBNZEHGJSA-N 437.131 4.119 10 10 IICE O=C(CCc1cc(Br)c(Br)s1)N1Cc2cccc(O)c2C1 1558035840 OMXWQMCOYMOPIP-UHFFFAOYSA-N 431.149 4.454 10 10 IICE CC[C@H](c1ccc(F)cc1)N1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1 1559272237 OOXYOSVUCGDASM-XGHQVWIYSA-N 427.476 4.193 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Cc3ccc(Br)cc3)CC2)cc1F 1566347096 XUJCXMZPQKYHEP-HNNXBMFYSA-N 435.337 4.124 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(Br)cnc1OCC1CC1 1585264562 UFDRTLAKNNXXAC-HNNXBMFYSA-N 446.389 4.368 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)ccc3Cl)CC2)c(OC)c1 1595990799 WXDVVUDPLALFIW-UHFFFAOYSA-N 439.737 4.082 10 10 IICE CCOC(=O)Cc1cc(Cl)c(=O)n(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)c1 1613788993 DKUGKUAHZDEQPZ-UHFFFAOYSA-N 444.890 4.037 10 10 IICE CC(C)(C)c1coc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1617017571 KGQLGHGMJOJVQB-XNTDXEJSSA-N 447.557 4.019 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@@H]3CCCN(c4ccccc4)C3=O)c2C)cc1 1617210890 UGNNPYJPAVJPSN-XMMPIXPASA-N 431.536 4.370 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@H](c1ccsc1)N(C)C 1617940856 SFNMABKPWOKCHT-CTNGQTDRSA-N 441.601 4.226 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)oc1Br 1622634925 MPKXSWZKVSVTKQ-AWEZNQCLSA-N 427.726 4.104 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)cc1)C1CCCCC1 1631386179 LKHZSHNHQJLCFB-NRFANRHFSA-N 440.632 4.436 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@@H]4CC[C@H](N(C)C)C[C@H]4C3)cc2Cl)C1 1634720129 OOINAAVYYSLACE-HZEGPAAWSA-N 433.040 4.448 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CSC(c4ccccc4O)=N3)cc2Cl)C1 1635125827 HUQDKFHGIYRUAM-KXBFYZLASA-N 444.000 4.460 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](N3CCC3)[C@@H](F)C2)c(C)n1-c1ccc(Br)cc1 1635745757 QUJBNIZZSDETHY-VQTJNVASSA-N 434.353 4.115 10 10 IICE CCOc1cc(NC2CCN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CC2)ncn1 1638132781 CANJLEYSIIGUHV-UHFFFAOYSA-N 449.555 4.008 10 10 IICE Cc1cc(C(=O)NCCCN2CCCO[C@@H](C)C2)c(C)n1-c1ccc(Br)cc1 1638478536 RDDLLAADHUSUFI-KRWDZBQOSA-N 448.405 4.087 10 10 IICE CCN(CC(=O)Nc1nc(-c2ccco2)cs1)Cc1cc(Br)ccc1O 1641893022 WFBKKTIHNAZIMS-UHFFFAOYSA-N 436.331 4.332 10 10 IICE COc1cccc(CNC(=O)N[C@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)c1O 1682837342 XFPGMJHZZDCOHW-LJQANCHMSA-N 443.544 4.246 10 10 IICE CC[C@@H](C)[C@H](Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1693970945 MYLONTYCGMIUCX-XXBNENTESA-N 449.603 4.033 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(NC(C)=O)CC1 1694981810 QFBNHELWTPGNGF-UXBLZVDNSA-N 446.599 4.424 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)[C@@H](C)C1 1698221677 JHLWQTUHEPZXPP-OALUTQOASA-N 437.588 4.108 10 10 IICE CC[C@H](C)CN(CC)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCOCC2)cc1 1708594853 BCYVTTJSARKMCX-NRFANRHFSA-N 448.615 4.021 10 10 IICE CC[C@H](C)NC(=O)CCn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1762052778 WMUYPAQZLQVTQV-IBGZPJMESA-N 440.636 4.117 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)C)CCO1 1763475869 KPABTSKVLKMVPB-JOCHJYFZSA-N 437.588 4.393 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@H](c3nccs3)C2)n1Cc1ccc(N(C)C)cc1C 1763810973 WPCDWRPJZWLPAH-UZLBHIALSA-N 440.617 4.249 10 10 IICE COc1ccc(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)[C@H](C)C(=O)N3)c(C)s1 1859572429 HDVPBGQCIKXNDT-LBPRGKRZSA-N 443.550 4.292 10 10 IICE CCOc1c(/C=C2/C(=O)N(c3ccccn3)N=C2c2ccc(OC)cc2)cccc1OC 1865670330 UPMVCYNYILVVIU-CAPFRKAQSA-N 429.476 4.332 10 10 IICE COc1ccc(N2CCN(c3cc(N4C[C@@H](C)Cc5ccccc54)nc(C)n3)CC2)cc1 1869292840 HREQBJMCOQRENK-IBGZPJMESA-N 429.568 4.451 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](CNCc2c(O)cccc2Br)(C2CC2)C1 1965955978 MUTKSAZETGPATN-HXUWFJFHSA-N 425.367 4.282 10 10 IICE O=C(COC(=O)C=Cc1cccc(Cl)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 2040420664 FNAKVAVWEOUUNS-UHFFFAOYSA-N 445.858 4.311 10 10 IICE O=C1C(=Cc2ccc(F)cc2)SC(=S)N1CC(=O)N1CCCC[C@@H]1c1cccnc1 2296311796 BPOLYMDTYKKTPM-GOSISDBHSA-N 441.553 4.176 10 10 IICE COc1ccc2nc(C=C3SC(=S)N([C@H](C(=O)O)c4ccccc4)C3=O)ccc2c1 2296607507 NCLSXSRWTVUNMO-IBGZPJMESA-N 436.514 4.271 10 10 IICE COc1ccc(N2CCN(Cc3cc(=O)c(OCC=Cc4ccccc4)co3)CC2)cc1 2297479237 DVMLPYZYOKRJOE-UHFFFAOYSA-N 432.520 4.063 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3ccc(O[C@H](C)C(=O)O)cc3)SC2=S)c1 2314928925 FASLJPBBKNDPQB-CYBMUJFWSA-N 427.503 4.147 10 10 IICE COc1cccc(C=C2SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)c1OC 2321738535 NBKUXGBZUFOYTJ-UHFFFAOYSA-N 447.534 4.135 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H](NCc3cc(Br)cc(F)c3O)C[C@@H]21 2333002382 FHHSXHYOHXYJCL-CFMVVWHZSA-N 429.330 4.075 10 10 IICE CCCCCS(=O)(=O)CC(=O)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 110850425 UDGAUBIYADERGD-DEOSSOPVSA-N 425.550 4.356 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@H](COCc3ccccc3)C2)C1 435826127 KZBLLVSGBWZZJB-QHCPKHFHSA-N 445.607 4.473 10 10 IICE CC(=O)Nc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526332184 ASRHKXYQDKEGDD-JOCHJYFZSA-N 434.423 4.253 10 10 IICE Cc1cc(C(=O)COC(=O)c2cccc(NC(=O)N(C)C)c2)c(C)n1-c1ccc(F)cc1 740373662 UPLCGULORZVYKZ-UHFFFAOYSA-N 437.471 4.366 10 10 IICE O=C(NCc1ccc2ccccc2n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745825623 QVYCKRJLHDHFHA-SFHVURJKSA-N 426.467 4.304 10 10 IICE COc1ccc(C(=O)CCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 779891010 UJCGRFLOSNKIPQ-INIZCTEOSA-N 430.932 4.026 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(C)n1-c1ccc(F)cc1 780403498 MVHMLIBRPVULMQ-FQEVSTJZSA-N 447.489 4.376 10 10 IICE Cn1c(C(F)F)nc2cc(C(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)ccc21 798407418 NZGZMOGURFPSTP-UHFFFAOYSA-N 439.510 4.295 10 10 IICE Cc1ncc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c(C2CC2)n1 798513652 IMSGYPQFVJBYSA-MHWRWJLKSA-N 444.607 4.344 10 10 IICE COc1cc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc(OC)c1O 800702065 IBCNSMOCSFBLJM-HNNXBMFYSA-N 447.963 4.299 10 10 IICE COc1cc(Br)cc(CN2CC[C@]23CCCN(C(=O)OC(C)(C)C)C3)c1O 812761047 CZZQNRGCDPTHNO-FQEVSTJZSA-N 441.366 4.139 10 10 IICE COc1ccc(CCCCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1OC 1125451906 QXMQLFPWVNYJIK-LJQANCHMSA-N 426.557 4.131 10 10 IICE CCC[C@]1(C(=O)OCC)CCCN1C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1128523574 QWZVYMHKNLQKQV-RUZDIDTESA-N 426.557 4.253 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2c3ccccc3C[C@@H]2CNC(=O)C(F)(F)F)cc1 1130086575 DVJRGWNGCOOTCT-HXUWFJFHSA-N 441.453 4.344 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(-c2ccccc2)nn1C 1139584371 DUKJOGPKNCEZIC-UHFFFAOYSA-N 434.540 4.089 10 10 IICE COC(=O)[C@H]1CCc2sc(NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)nc2C1 1142601170 AARWAPXWXRWONI-AWEZNQCLSA-N 427.501 4.220 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)cc1F 1144979130 ZMAAZSKXHGHMOO-UHFFFAOYSA-N 426.580 4.132 10 10 IICE Cc1cc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c(C)n1-c1ccc(Br)cc1 1147690958 JBTKJWHICBDHKH-MJGOQNOKSA-N 439.300 4.401 10 10 IICE O=C(CCOc1ccccc1-c1ccccc1)NCc1ccc(N2CCC(O)CC2)cc1 1148701439 XXOLFYFMSMALMU-UHFFFAOYSA-N 430.548 4.400 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@H](OC(C)(C)C)[C@H]1n1cccn1 1158288832 OWZAIBIXHJXDMR-PUHATCMVSA-N 434.540 4.030 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1 1264442298 CYGFZNBRTZHXNQ-HXUWFJFHSA-N 427.976 4.192 10 10 IICE O=C([C@@H]1CCOc2ccc(Br)cc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 1295406137 PIEBZKWKOWGIOR-ZWKOTPCHSA-N 446.341 4.229 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)cn2C)n1CC1(C)CC1 1298360007 PQBGEDIGEQIBQM-UHFFFAOYSA-N 430.350 4.188 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CCCO1 1305195649 CCRMYJFLPHNTKR-HNNXBMFYSA-N 435.644 4.185 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)CCC2CC2)cc1F 1314661554 UMNMXLHCKKQSTL-UHFFFAOYSA-N 428.943 4.483 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1 1316376716 JBVXEQAASGUFGN-SFHVURJKSA-N 449.628 4.474 10 10 IICE CNC(=O)c1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1Cl 1355092580 YBCSFIYRTPRSQT-UHFFFAOYSA-N 425.916 4.180 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3nccc4c(Br)cccc34)C2)cc1 1436968511 COPTUNJHYGASAP-HNNXBMFYSA-N 440.341 4.262 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NCc1ccc2cccnc2c1O 1451946583 DGMFZEOKKYDFQD-NRFANRHFSA-N 433.508 4.091 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1nn(-c2ccccc2)cc1Br 1464076881 SXRVMELYRPASJY-UHFFFAOYSA-N 425.330 4.165 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)cc1 1466932556 XVILKNUDMNKTKP-DENIHFKCSA-N 436.474 4.049 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CSc3ncnc4sc(C)c(C)c34)C2)cc1 1469281068 WGGCJOUQKPZFCU-INIZCTEOSA-N 442.610 4.052 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H](O)C(F)(F)C(F)(F)F)cc1 1471525449 KFVKCWARICHRQX-MRXNPFEDSA-N 430.377 4.456 10 10 IICE CC(C)c1ccc2c(c1)[C@H](NC(=O)NCc1cc(F)c(N3CCOCC3)c(F)c1)CC2 1478493594 DVQBEUNJRWXSGI-JOCHJYFZSA-N 429.511 4.412 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1479128992 OWIGGSGMCHOEAR-NUZGMZIFSA-N 430.593 4.072 10 10 IICE Cc1ccc(OCc2nnc(N3CCOC[C@H]3C)n2CCCSc2nccs2)cc1 1492399881 DKKGWHSIOCJUAL-QGZVFWFLSA-N 445.614 4.030 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1CC 1501187447 XEZJPRYSBRFDHJ-HXUWFJFHSA-N 434.588 4.258 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCc1ccncc1 1517145978 DBGRELFKRWAFMF-IFMALSPDSA-N 435.572 4.176 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCO[C@H](c3ccnn3C)C2)c(C)n1-c1ccc(Cl)cc1 1525878394 NKUPKDIVBDIVSD-UGKGYDQZSA-N 426.948 4.060 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc2c1OCCO2 1530426896 WRHRDBZOIYHAEY-HNNXBMFYSA-N 430.932 4.286 10 10 IICE COC(=O)c1ccc2c(c1)NC(=O)CN2C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1534361613 GUTRURYQVWDIIZ-UHFFFAOYSA-N 437.883 4.133 10 10 IICE CCn1ncc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1Br 1539912572 JGAPUKINCCVREI-ZDUSSCGKSA-N 439.785 4.485 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@H](Cc1ccccc1)c1ccccn1 1565436975 YPWOHPQTNAAGFS-LJQANCHMSA-N 426.314 4.333 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(F)ccc(C(F)(F)F)c1Br 1567467736 QIMDLGGEKYBTHB-MRVPVSSYSA-N 436.199 4.379 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2cc(Br)ccc2Cl)cc1 1586649362 MDGMYEVGTJLJRI-UHFFFAOYSA-N 425.754 4.248 10 10 IICE CCCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccccc1C 1616858013 DNPIUHNLPDIUFC-RUZDIDTESA-N 433.600 4.232 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3ccncc3s2)NC(=O)OC(C)(C)C)cc1 1618252228 BHRCJQBCETVGCN-SFHVURJKSA-N 440.569 4.358 10 10 IICE Cc1cc(C(=O)NCc2nc(C(F)F)no2)c(C)n1-c1ccc(Br)cc1 1627091339 LRMDCZBHLULNMD-UHFFFAOYSA-N 425.233 4.107 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2COC(=O)N2CCC(C)CC2)c(C)n1-c1ccccn1 1627096528 JXYDITLJVATSHA-OAQYLSRUSA-N 438.572 4.352 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(NC(=O)C3CC3)cc2)cc1 1629111557 PPYPDEKUPLXFSE-UHFFFAOYSA-N 429.520 4.114 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnn(-c2ccccc2)c1Br 1631265543 GTQLVILHSJWABR-UHFFFAOYSA-N 427.346 4.363 10 10 IICE CC(C)N(Cc1ncc(-c2ccc3c(c2)OCO3)[nH]1)C(=O)c1ccc(N=NC(N)=O)cc1 1633508933 TVNUTNCNEQCDMY-UHFFFAOYSA-N 434.456 4.019 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1c(O)cnc2c(Br)cccc12 1638243832 MZHXBORNNPOBBH-CQSZACIVSA-N 442.357 4.438 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCOc2ccc(C)cc2Br)cc1 1640771904 UASAZZBTCVWJFJ-UHFFFAOYSA-N 435.362 4.130 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 1648606770 XYAZFDWTGPNZOB-INIZCTEOSA-N 427.715 4.273 10 10 IICE C[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)(C)c1ccccc1 1653136473 VMADWZJYRYBOAL-KRWDZBQOSA-N 426.516 4.356 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 1679890921 SNPNOIOEEITLBR-OXJNMPFZSA-N 446.389 4.207 10 10 IICE C[C@H](NC(=O)N1CCCC[C@@H]1COC(=O)N1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 1681552641 QWOGXMPNBNSPSN-XQBPLPMBSA-N 430.593 4.246 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1696558185 LGHXBTYUPUWMNZ-AEFFLSMTSA-N 435.613 4.003 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCO3)n2CCOC(C)C)c(C)n1-c1ccccc1 1724196429 QKLATQMKWPOSJD-JOCHJYFZSA-N 437.588 4.393 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C)[C@@H](C)C3)n2CCCSc2nccs2)n1 1726061241 YSVMSUGWFBSQMF-CVEARBPZSA-N 445.662 4.261 10 10 IICE CS[C@@H](C)Cn1c(-c2ccc(C)o2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1731035514 UVWOBSOUYGBMJK-SFHVURJKSA-N 441.601 4.071 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)sc2c1CC[C@@H](C(C)(C)C)C2 1865922665 LGPIJZLURBEONH-ZIAGYGMSSA-N 434.602 4.271 10 10 IICE C[C@H](CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1)C(=O)c1cccc(F)c1 1866036882 UVUSCEYJHJLTDK-DVECYGJZSA-N 439.575 4.444 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2C[C@H]1C[C@@H]2NCc1cc(Br)cc(F)c1O 2108256708 SWWOXFVOKLOKOW-OVTCNUJSSA-N 429.330 4.075 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2cc(Br)ccc2OCc2ccccc2F)S1 2293394508 OGKWCMGPFHUFQF-UHFFFAOYSA-N 449.301 4.274 10 10 IICE Cc1ccc(CNC[C@@H]2CC3(CC3)CN2C(=O)OC(C)(C)C)c(O)c1Br 2352944645 KNXLQWIJSYTCCG-HNNXBMFYSA-N 425.367 4.342 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@H](c2cccnc2)c2ccc3cccnc3c2O)c1 54620938 NCINUFKDONDFPN-OAQYLSRUSA-N 443.459 4.110 10 10 IICE COC(=O)c1ccccc1-n1c(C)cc(/C=C2\NC(=O)N(Cc3ccccc3F)C2=O)c1C 96472483 LADTYJOQWHQUMI-BKUYFWCQSA-N 447.466 4.113 10 10 IICE COCCNCc1ccc(N2CCC(OCc3ccccc3)CC2)c(Br)c1 384175414 UTFMVJXXOHCVCZ-UHFFFAOYSA-N 433.390 4.371 10 10 IICE Cc1cc(C(=O)COC(=O)C2CCC(=O)CC2)c(C)n1-c1ccc(Br)cc1 751674882 DFAQARNQJYRAOW-UHFFFAOYSA-N 432.314 4.342 10 10 IICE CN1CC[C@@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 754842992 WNNHPHZPKIMWDU-YADHBBJMSA-N 430.955 4.324 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3cc(C)n(-c4ccccc4Br)c3C)[C@H]2C1 755203422 PEHUOXSUEVCMPZ-CZAAIQMYSA-N 447.373 4.265 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2cc(C)oc2C)cs1 761344720 ZWBMNSGTPYYQIS-UHFFFAOYSA-N 447.538 4.178 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCC[C@@H]2c2csc(C)n2)c([N+](=O)[O-])c1Br 772217045 XGAVQXZQMUVYHS-SNVBAGLBSA-N 443.279 4.381 10 10 IICE C[C@@H](NC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(N2CCOCC2)c(F)c1 794822280 BDWVUJDVAGRWLH-VNCLNFNDSA-N 429.502 4.118 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)NC(=O)OC(C)(C)C)cc1 796731026 UUQDDACJADCQIB-JZXOWHBKSA-N 443.510 4.413 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)F 808095353 CKQGUDXNFFYFJF-UHFFFAOYSA-N 445.825 4.061 10 10 IICE CCOc1cc2c(cc1/C=C/C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O[C@@H](C)C2 920881780 RHIJKHDYVAMSTH-CECVADTLSA-N 436.552 4.136 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3SC(F)(F)F)CC2)c(OC)c1 1132032368 UEIBORCAEHKUII-UHFFFAOYSA-N 426.460 4.278 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C)[C@@H](n3ccnc3)C2)c(C)n1-c1ccc(Br)cn1 1137483958 JWOQHMOFHXJFDT-KUHUBIRLSA-N 442.361 4.171 10 10 IICE COCC(C)(C)N1CCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)CC1 1142655513 GUOVKPZGOFITTC-UHFFFAOYSA-N 448.405 4.039 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C/c1ccccc1C(F)(F)F 1152401823 PXNYFSOBKOAKFF-RMKNXTFCSA-N 427.806 4.279 10 10 IICE COc1ccc(Br)cc1-c1ncc(C(=O)NCc2c(O)cccc2F)s1 1156178036 SRTCPSADMAMAAB-UHFFFAOYSA-N 437.290 4.356 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)CCCNC(=O)OC(C)(C)C)cc1 1159428126 TWUKTOXFNVWYMP-KRWDZBQOSA-N 441.572 4.259 10 10 IICE CCCc1c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cnn1-c1ccccc1C 1264733301 VVJABNAPMVNWMU-UHFFFAOYSA-N 432.568 4.494 10 10 IICE C[C@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1264849987 RYNOOIFAOIKYFS-VVTMIQRTSA-N 429.542 4.032 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1293414410 GWSZEMHUIAMLIU-FQEVSTJZSA-N 434.588 4.210 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H]3[C@@H](C2)C3(F)F)NC(=O)OC(C)(C)C)cc1 1293791454 BQCFZOKUHHRDJA-OWYHZJEWSA-N 437.531 4.116 10 10 IICE COc1cc(F)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(Cl)c1 1294860197 RWIDNYHTDSRMGG-AWEZNQCLSA-N 427.303 4.241 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CCOCC(F)F 1298315600 XPQTWTSASIGVLM-UHFFFAOYSA-N 435.563 4.385 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)CC(C)(C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1304195507 NECVKKNZBMLYKF-GOSISDBHSA-N 448.615 4.313 10 10 IICE Cc1noc(CCCn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)n1 1304895086 FJPRJUIWGGFSTN-UHFFFAOYSA-N 437.592 4.136 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](SC)C(C)(C)C 1306179622 WUYNCFJIWFWENT-HXUWFJFHSA-N 431.650 4.344 10 10 IICE CC[C@H](C)N(CCc1ccccc1F)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065901 ZKLBAIJHHQFMQU-IBGZPJMESA-N 427.564 4.340 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H](CC(C)C)N(C)C)CC2)cc1 1315515250 IHOWXQGSBPFHRQ-QFIPXVFZSA-N 442.652 4.103 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3N2C(=O)OC(C)(C)C)cc1F 1357200106 IMNRXCSXKDVDFZ-LMNJBCLMSA-N 433.568 4.466 10 10 IICE CCCCOc1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1OC 1360091317 NHGITYOZMWUSMM-UHFFFAOYSA-N 443.563 4.085 10 10 IICE CC(=O)[C@@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1(C)C 1439876495 YBGAYTOSVSPHCQ-LSDHHAIUSA-N 441.329 4.349 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H](c3cccc(C)c3)C(C)(C)C)CC2)cc1 1442056041 ULFXXFOUGZCPQB-ODUIWNOOSA-N 449.595 4.112 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(C)(C)N2C[C@@H](C)C[C@@H](C)C2)CCCC1 1464462789 GXCITFKKQAKHRR-KDURUIRLSA-N 425.617 4.401 10 10 IICE Cc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1OCCN(C)C 1468850541 WFGPZLNQSQLZFB-UHFFFAOYSA-N 448.611 4.295 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccccc3[N+](=O)[O-])cc2Cl)C1 1478528039 LERGYBODTREXSA-MRXNPFEDSA-N 445.951 4.396 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1495431781 FYIHPTVBCDYJQI-UNMCSNQZSA-N 449.647 4.489 10 10 IICE CCOC[C@@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1503161239 XSPCWIVITSMTHG-OAQYLSRUSA-N 425.621 4.296 10 10 IICE Fc1ccccc1OCc1nnc(N2CC=CCC2)n1CCCSc1nccs1 1505312006 BYNSBTVZYHIPKB-UHFFFAOYSA-N 431.562 4.401 10 10 IICE CCN(CC)[C@@H](C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1515521416 OMQRSEPMKIXYSK-NZQKXSOJSA-N 440.636 4.097 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@H]2CS(=O)(=O)c3ccccc32)c1 1523032724 XYOKYELRHDYDLZ-INIZCTEOSA-N 428.941 4.048 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(c4cccc(Cl)c4)CCCC3)cc2)CC1 1535157407 WPUMEPWHAVXGHM-UHFFFAOYSA-N 439.987 4.170 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H]([C@@H]2CCOC2)C1 1542226948 NPMYXCOQRNGHLV-NHCUHLMSSA-N 425.621 4.152 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCS[C@H](C)C1 1542227036 QQFMZTMXTPNISB-MRXNPFEDSA-N 443.020 4.358 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4sc([N+](=O)[O-])cc4c3=O)c2C)cc1C 1559410673 SMQOONVTTNOJCZ-UHFFFAOYSA-N 436.493 4.273 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Br)cs1 1566356989 UFISTCVBUDJUCM-AWEZNQCLSA-N 429.767 4.264 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](CN3CCN(C)CC3)c3ccccc3)c2C)c1 1584730252 PESYTGVABWESSF-MHZLTWQESA-N 444.623 4.429 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(O)c3ccsc3c2)c1 1585512833 BEFXEJQTMWMHBY-UHFFFAOYSA-N 431.517 4.351 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1586706429 WHLIMIFSOOVYSR-NHCUHLMSSA-N 429.536 4.100 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)CC(C)C 1597133169 BMTVDWNMNUEWMS-VWLOTQADSA-N 428.573 4.260 10 10 IICE CC[C@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1cccc(C(F)(F)F)c1 1598028642 MIDJRFVCXRDKSM-QFIPXVFZSA-N 449.517 4.146 10 10 IICE CC[C@H](C)[C@H](Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1613137244 BSBQAMWEMDBBBA-CVDCTZTESA-N 441.620 4.332 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 1624220628 KTMFXJNXCAMXRX-IEBWSBKVSA-N 439.556 4.282 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(N=S(C)(C)=O)cc1 1626517188 WXXXGWRWOCZBMK-UHFFFAOYSA-N 445.585 4.048 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@@H](C)[S@@]1=O 1627248493 AXUAHTFDMJAJLF-BWXRKXKISA-N 437.403 4.228 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@@]23CCCN(C(=O)OC(C)(C)C)C3)cc1F 1627604668 NOXGBSHFNVAXAS-HOYKHHGWSA-N 433.568 4.325 10 10 IICE COC(=O)[C@H](C)Oc1ccc(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1F 1629557772 WKTQQSITYSIYFR-INIZCTEOSA-N 440.471 4.434 10 10 IICE CCc1nc2c(C(=O)N(Cc3ccc(N(C)C)cc3)c3ccc(OC)cc3)ccnc2[nH]1 1633066332 LOTIVOKACFAYBC-UHFFFAOYSA-N 429.524 4.442 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2cccc(Br)c2)c(C)n1-c1ccc(F)cc1 1634805157 LMZSEZSBNOZIGB-HXUWFJFHSA-N 431.305 4.459 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccccc2)c(C)n1-c1ccc(Br)cc1 1636136047 BELJCCGQZRQCTK-HXUWFJFHSA-N 427.342 4.190 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)c1 1638028786 IABSLDVWMMHWFN-UHFFFAOYSA-N 432.885 4.462 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C 1638570225 WSSDLHPFCBGEAY-RTWAWAEBSA-N 439.556 4.328 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)c1ncnc2c1c(Br)nn2C(C)(C)C 1642413208 WVZWTIIOYNFBIF-UHFFFAOYSA-N 431.382 4.436 10 10 IICE CC(C)(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)NCc2ccc3cccnc3c2O)cc1 1643283106 GKKOXTPICHZNLF-FQEVSTJZSA-N 449.576 4.069 10 10 IICE COc1ccc(N2C[C@H](NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2=O)cc1 1645152314 QXKCPDXHJYNNOL-HXUWFJFHSA-N 431.536 4.255 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)/C=C1/SCC(=O)N1C 1654253755 YUTFKHHNDNMSMB-LASGFXPTSA-N 449.498 4.345 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H]3COC(=O)NC3CCCCC3)cc2)CC1 1654386141 MJNONRIHFYNVMO-HSZRJFAPSA-N 429.605 4.325 10 10 IICE COc1cc(N2CCN(C(=O)NC(C3CCCC3)C3CCCC3)CC2)cc(OC)c1OC 1676266179 RCOMYWSYKIGIMN-UHFFFAOYSA-N 445.604 4.293 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1710955824 KVRFJAOKBAJBBG-IEBWSBKVSA-N 449.640 4.393 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1712794544 ZNHRUGDCPMBNAS-IBGZPJMESA-N 445.677 4.236 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H](C)C1 1741112342 CQHLLZQUOFUVPR-RTBURBONSA-N 448.615 4.361 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@@H](C)CCSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1743546103 HBBZPRFFDMIWAU-ROUUACIJSA-N 449.640 4.393 10 10 IICE CCc1nnc(N2CCC[C@H](c3noc(C(C)C)n3)C2)n1CCCSc1nccs1 1744656123 DHLHHQZQELSXNK-HNNXBMFYSA-N 447.634 4.370 10 10 IICE CCOCc1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1767902146 ZBGJWOUDFWORLX-LJQANCHMSA-N 429.634 4.043 10 10 IICE COc1ccc(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)C(C)(C)C(=O)N3)cs1 1859572453 IXLVMKSHHGTFTF-UHFFFAOYSA-N 443.550 4.158 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccc4c(c3)OCO4)C(=O)N(C3CC3)C2=O)cc1 1873422312 QMODEKYBCCLFDG-UHFFFAOYSA-N 441.487 4.177 10 10 IICE CCOC(=O)c1ccccc1NC(=O)c1c2c(n3ccccc13)C(=O)c1ccccc1C2=O 1873952448 HOOYWTMLSCGFIF-UHFFFAOYSA-N 438.439 4.144 10 10 IICE O=C(O)C[C@@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1 1951418236 IOOKTOLHLKXLKH-INIZCTEOSA-N 433.460 4.195 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2060638745 ALKXXEOFVPYHSI-HSZRJFAPSA-N 443.548 4.037 10 10 IICE CCc1nn([C@@H](c2ccc(C)cc2O)C(C)C)c(I)c1C(=O)O 2079125291 NFZXFRLETWQYQW-OAHLLOKOSA-N 428.270 4.008 10 10 IICE Oc1cccc(Br)c1CN[C@@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156293683 VXBXMZAOIPPICB-SFHVURJKSA-N 431.374 4.068 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C)c(C)c3)C2=O)ccc1OCC(=O)O 2297576559 MKVMUPCDDYTMOM-UHFFFAOYSA-N 429.519 4.181 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1OC 2318756662 QPPHFQPGYITPTK-UHFFFAOYSA-N 445.518 4.294 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)cc1 2321734499 NTBJGTXYUVTAOW-UHFFFAOYSA-N 426.563 4.328 10 10 IICE O=C(Cn1cnc2ccccc2c1=O)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 10909158 KYODKEWFGHFSHL-AREMUKBSSA-N 435.483 4.161 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N(NS(=O)(=O)c2ccc(C)cc2)C1=O 103039072 KCPBIJRLUJKCAR-MIXLFBTASA-N 430.576 4.036 10 10 IICE Oc1ccc(OC(F)(F)F)cc1[C@H](c1ccc(OC(F)(F)F)cc1)N1CCNCC1 575265515 WNVZSKKEUMEBPB-KRWDZBQOSA-N 436.352 4.184 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)cc1 739064147 NCEJSLPMNYJAOG-UHFFFAOYSA-N 436.600 4.227 10 10 IICE Cc1nn(C(C)(C)C)cc1[C@@H](C)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767029363 ICTVWKXJLQGJOB-OAHLLOKOSA-N 444.535 4.011 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N[C@@H]1CCSc2ccccc21 768687461 NTZKFPYPLNDFRW-HSZRJFAPSA-N 436.625 4.255 10 10 IICE COc1ccc2ccccc2c1-c1cc(CNCc2ccc([N+](=O)[O-])c(OC)c2O)on1 775057916 QGBLJFHEQVVMKM-UHFFFAOYSA-N 435.436 4.416 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCOc2c(Cl)cccc21 775776764 FUSYYGHZJSZMAB-NRFANRHFSA-N 429.948 4.232 10 10 IICE CCN1CC[C@H](NC(=O)N[C@H](C)c2cc(OC)ccc2O)[C@@H]1c1cc(F)c(F)c(F)c1 782536456 PTAOQISLQYCXRD-NWXLUKJOSA-N 437.462 4.014 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3cn(C)nc3C(F)(F)F)cc2Cl)C1 799959566 HDAHSIVHCNLNRB-ZDUSSCGKSA-N 443.901 4.328 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCCc2occc21 1126246951 XCERBITZQDPACG-JIHKLPAASA-N 430.526 4.204 10 10 IICE Cc1csc([C@@H](C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1147504435 FUGRGKTZRISCQW-MAUKXSAKSA-N 432.590 4.003 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1[C@@H]2c3cc(Br)ccc3C[C@H]21 1230199971 FHNMGYKTWPZWNU-GZPVHCRCSA-N 442.401 4.392 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(S(=O)(=O)c3ccc(C)cc3)CCCC2)cc1 1264668172 BXHYUGDJIMMVOO-UHFFFAOYSA-N 428.598 4.244 10 10 IICE Cc1ccc(CC[C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1265461058 PXYYNTGDUFTBSD-ITRAFESCSA-N 446.569 4.456 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccco2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291446767 NOMLVJCAPSUWAM-KRWDZBQOSA-N 427.524 4.045 10 10 IICE CCc1nnc(N2C[C@H](C)O[C@@H](c3ccsc3)C2)n1Cc1ccc(N(C)C)c(F)c1 1306109601 GIIDRSFOUFCXMZ-MGPUTAFESA-N 429.565 4.122 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3O)C3CCCCC3)cc2)CC1 1313212338 QVFHHIOKVHDVHB-UHFFFAOYSA-N 436.600 4.189 10 10 IICE CCOc1ccccc1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1351233101 SDTUMCYSAJMOEB-UYRXBGFRSA-N 444.553 4.132 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H](O)c2cccc(Br)c2)cc1 1441155327 WIVVYXYFOGPXGF-OAQYLSRUSA-N 443.341 4.371 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1449702087 NRDNXPWCCHOVJP-GJZGRUSLSA-N 446.569 4.422 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@H](CO)C2CC2)c(C)n1-c1ccccc1Br 1450039842 UMIVBJODPPRBKL-WIYYLYMNSA-N 431.374 4.384 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCC3(CCC3)O2)c(C)n1-c1ccc(Br)cn1 1456554343 BOKRXYDLOQDGQC-KRWDZBQOSA-N 432.362 4.473 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)cc1 1456651989 WAKXCVZHXKKDQN-XZOQPEGZSA-N 427.508 4.247 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)[C@H]1CCC[C@H](OC)C1 1461289785 XZJRLGZJLSRAOP-DJPFJPOOSA-N 432.948 4.224 10 10 IICE O=C(NCC1(Cc2ccccc2)CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1466214947 QVDGOXRSOZUBJU-UHFFFAOYSA-N 442.562 4.007 10 10 IICE CCOCc1nnc(N2CC[C@H](c3ccccc3)C2)n1CCCSc1nccs1 1516509387 NMKFXJNZKAUDPW-SFHVURJKSA-N 429.615 4.447 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1Cc1nc(C(F)(F)F)cs1 1517142223 DUCAMZMITBFLQY-UHFFFAOYSA-N 434.447 4.139 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)c1ccc2c(c1)CCO2 1518472140 ZUQWQIVYOPPLMA-QFIPXVFZSA-N 438.911 4.327 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCN(c3nc4ccccc4s3)C2)cc1 1527596308 UZWGGHCDMZYSQX-GOSISDBHSA-N 438.597 4.116 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c(Cl)c1 1529802783 CQDSBBLLSPWVMC-UHFFFAOYSA-N 431.920 4.316 10 10 IICE CCOc1ccc(CCCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1OCC 1534018419 RBPRUNJPLJMHCX-UHFFFAOYSA-N 426.557 4.164 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(-c4ccccc4Cl)s3)CC2)c(OC)c1 1534586278 AUMUPOHDFSOMEN-UHFFFAOYSA-N 443.956 4.443 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C=C/[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1540567477 NKPWFIIUPYVZIB-RDPWEWGOSA-N 427.589 4.449 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@@H](O)C(F)(F)F)c(C)n1-c1ccccc1Br 1545995922 BOICIJVYMSLROW-IAGOWNOFSA-N 445.279 4.384 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCCN(C(C)(C)C)CC2)cc1 1547444262 NMAIGVBOBLVSCF-UHFFFAOYSA-N 449.647 4.478 10 10 IICE Fc1ccc(Cc2nnc(N3CCSCC3)n2CCCSc2nccs2)cc1 1555980356 IAAQWUUZECHFKT-UHFFFAOYSA-N 435.619 4.200 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCc1ccc(C(C)(C)C)cc1 1556102126 SAXLIWOQCNIMOJ-NRFANRHFSA-N 441.568 4.399 10 10 IICE O=C(Cc1nc(C2CCCCC2)cs1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1570168130 NUQMGLODXQSVHU-UHFFFAOYSA-N 435.540 4.165 10 10 IICE COc1cc(-c2ccccc2)sc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1583379591 WHDPNAMETAMOLL-UHFFFAOYSA-N 444.503 4.469 10 10 IICE Cc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1F 1585074096 OEAZOXKPNJERMM-WQRHYEAKSA-N 432.517 4.181 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4cc(Br)ccc4o3)C2)cc1 1585665002 JWSHNXFZQCSGOW-CQSZACIVSA-N 429.314 4.460 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cnc(F)c(Cl)c1 1611252535 YHVDBZYURDAPFU-VGOFMYFVSA-N 439.896 4.243 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)[C@H](C)c1ccco1 1611964509 ZMUOQINSKPAPOH-LJQANCHMSA-N 430.556 4.477 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1Cl 1623360344 VQQZUEKRVMUWPS-GFCCVEGCSA-N 436.942 4.399 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(CN4CCN(C)CC4)cc3)c2C)c1 1624582062 CEFTZTKCEGQDEN-UHFFFAOYSA-N 444.623 4.388 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1 1624626087 LAMUEOBTJSMVHF-UHFFFAOYSA-N 427.548 4.342 10 10 IICE Cc1cc(CC(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)c(C)n1-c1ccccc1 1632259552 CNDSWWYKJAOJPW-UHFFFAOYSA-N 431.536 4.220 10 10 IICE Cc1c(Br)ccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1N 1632290861 SEWUZXHFVATBBS-UHFFFAOYSA-N 431.378 4.122 10 10 IICE Nc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cccc1C(F)(F)F 1634753117 FMOMXDVZEOXOOA-LBPRGKRZSA-N 429.389 4.288 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C2)c1O 1647788524 ZTANUOIFPFMWEC-WMLDXEAASA-N 448.457 4.259 10 10 IICE Cc1ccc(S(=O)(=O)N(CCC(=O)N[C@@H](C)c2ccccc2O)c2ccccc2)cc1 1648892229 RMOOHNZNCQNPGO-IBGZPJMESA-N 438.549 4.163 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)c2cccnc2)c(C)n1-c1ccccc1Br 1653443379 GAJFJZBIJAKPAW-HXUWFJFHSA-N 428.330 4.057 10 10 IICE CCOc1ccccc1CN1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)[C@@H](C)C1 1658397927 YPEBCLVNFXOYOB-QFIPXVFZSA-N 437.628 4.407 10 10 IICE COc1ccc([C@H](NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c2ccccc2)cc1 1683944318 BYKDZNIFSNFVIO-PXDATVDWSA-N 431.536 4.371 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](NC(=O)NCc1c(O)ccc2c1CCCC2)C1CCCC1 1686301523 KIRJRSXUMWHZPR-HXUWFJFHSA-N 431.577 4.154 10 10 IICE CCc1csc(CC2CCN(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2)n1 1686854923 JTYLMUNNZPEKFI-IBGZPJMESA-N 442.629 4.205 10 10 IICE CC(C)c1nnc(N2CCO[C@H](c3nccs3)C2)n1CCCSc1nccs1 1691895974 CNWHDMMTTFZVSW-AWEZNQCLSA-N 436.632 4.075 10 10 IICE C#CCN(CC#CC)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1705600709 JPTOOQHLJNOWCF-UHFFFAOYSA-N 447.652 4.075 10 10 IICE C[C@H]1C[C@H](C)CN(C(C)(C)Cn2c(CC3CC3)nnc2N(C)Cc2ccccc2O)C1 1707962271 UYTAHFDBRMKGSY-OALUTQOASA-N 425.621 4.329 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1726976307 NRQKKHYKSBPFFL-RXVVDRJESA-N 429.634 4.008 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1741442696 GZIGSEPMYNOBTN-MOPGFXCFSA-N 429.584 4.125 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C)[C@@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742697357 HWHOCVCGJOWRKA-MJGOQNOKSA-N 435.620 4.045 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@@H](C)N(CC)C[C@@H]2C)cc1 1746089808 HQWBOGGNHAFOAP-RTWAWAEBSA-N 447.631 4.154 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCC[C@@H]1C 1761198005 FMYAEDMKXRHGON-FPOVZHCZSA-N 438.620 4.089 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1766454705 JQVKCKXWQOHDSZ-HXUWFJFHSA-N 425.621 4.259 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)CCc2nccs2)cc1 1766616113 RTLNDUWVTQNECN-HXUWFJFHSA-N 440.617 4.160 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccc(C)cc4)n4ccccc34)CC2)cc1 1858346048 YBHZODBGDVGOQY-UHFFFAOYSA-N 426.520 4.281 10 10 IICE O=C1/C(=C\c2ccc(O)cc2O)C(C(F)(F)F)=NN1c1ccc(Br)cc1 1865654461 UYHORBKRCYCAOF-QPEQYQDCSA-N 427.176 4.209 10 10 IICE CCOC(=O)c1c(NC(=O)Cc2ccc(N)cc2)sc(C(=O)Nc2ccccc2)c1C 1865957147 ZXXTUEPBPYQVPN-UHFFFAOYSA-N 437.521 4.249 10 10 IICE Cc1ccc2nc3c(c(C(=O)N[C@@H](c4ccc(N(C)C)cc4)c4nccn4C)c2c1)CCC3 1866276015 UTVGYKLDSNJCSL-VWLOTQADSA-N 439.563 4.351 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(Br)cc2)N2CCCCC2)cc1 1868005054 BZNBEGVQLBQQMG-QFIPXVFZSA-N 444.417 4.401 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cc([N+](=O)[O-])ccc1Br 1891428901 NEBFSPUPLZKJCR-HOCLYGCPSA-N 430.302 4.276 10 10 IICE Oc1ccc(Br)cc1Cn1nc(C2CCC2)cc1I 2070168679 HIYYKAMEXYCAGT-UHFFFAOYSA-N 433.087 4.272 10 10 IICE O=C(CN1C(=O)SC(=Cc2ccc(N3CCCC3)cc2)C1=O)Nc1ccccc1F 2293983755 VKOFLALXIRCLDY-UHFFFAOYSA-N 425.485 4.101 10 10 IICE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=Cc1cccn1-c1ccc2ccccc2c1 2294280052 URHDKPPYRZYNIG-UHFFFAOYSA-N 425.419 4.436 10 10 IICE CC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=S)N(c4ccccc4C)C3=O)o2)cc1 2297460998 DHMSNEDKEGYFFS-UHFFFAOYSA-N 430.485 4.289 10 10 IICE Brc1cc(CNCc2ccc3c(c2)CCO3)ccc1I 2377324730 RJBJAVZTEHWUHS-UHFFFAOYSA-N 444.110 4.278 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380748063 ZCBPHZYOCWMOGX-HIFRSBDPSA-N 441.366 4.163 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2380772174 LMBWBSLGNOZXAG-INIZCTEOSA-N 443.382 4.361 10 10 IICE O=C(O)c1ccc(Nc2cc(N3CCOCC3)c3noc4c3c2C(=O)c2ccccc2-4)cc1 2457275 UMGCDNSPXNSYKS-UHFFFAOYSA-N 441.443 4.318 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476160 BPZKKQIBBYQNHW-AYBUPXMNSA-N 443.525 4.204 10 10 IICE O=C(COc1ccccc1/C=C1\SC(=S)NC1=O)Nc1cccc(C(F)(F)F)c1 15056124 DHWOBVQKRBLNEB-NVNXTCNLSA-N 438.452 4.212 10 10 IICE Cc1cc(C)cc(OCCOc2cccc(/C=C3/C(=O)NN(c4ccccc4)C3=O)c2)c1 35315344 DBRPBDYBKLBTIN-ULJHMMPZSA-N 428.488 4.223 10 10 IICE Cc1ccccc1NC(=O)[C@@H](C)N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S 47152302 BKEKRQQXDIOUGM-GPLLRDDGSA-N 427.507 4.132 10 10 IICE COc1ccc(C)cc1C(=O)CCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 170568727 MKZPYLDLBRGKAD-UHFFFAOYSA-N 427.456 4.381 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1 435828529 UPPHVKUUJVYYOE-HXUWFJFHSA-N 441.579 4.471 10 10 IICE CC[C@@H](NC[C@H]1CN(C)CCN1Cc1ccccc1)c1cc(Br)ccc1O 694741860 MBMMFESSCDTUHC-PZJWPPBQSA-N 432.406 4.012 10 10 IICE C[C@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](c2ccccc2)O1 726720654 ZAABRHCFAIRIPT-JTSKRJEESA-N 445.510 4.428 10 10 IICE CC(C)(C)c1ccc(CCCC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 727308979 XKFXEZASCIBHFT-JOCHJYFZSA-N 435.612 4.325 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCC(N(C)C(=O)OC(C)(C)C)CC2)cc1F 731364382 ZDWRVDOEQGXPRE-UHFFFAOYSA-N 436.572 4.213 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)COC(=O)c3cnc(-c4cnn(C)c4)s3)c2C)c1 732686338 DZWXZRVEHFPTIZ-UHFFFAOYSA-N 434.521 4.299 10 10 IICE O=C(NCc1ccc2ccccc2n1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 734270372 RSDJXZOTOWSGLN-UHFFFAOYSA-N 444.457 4.090 10 10 IICE Cc1cc(F)ccc1CN(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 753082657 VDZUEMSVDSUQKB-UHFFFAOYSA-N 439.453 4.331 10 10 IICE O=C(NCCCSc1nccs1)[C@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1 753576595 ZAUDDKSFLYJGBL-INIZCTEOSA-N 446.425 4.122 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)CC2 758411132 COGHHNFTKRTSAH-INIZCTEOSA-N 432.490 4.166 10 10 IICE COC(=O)c1cc(NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)ccc1Br 775378396 IZYRVKSZQZKUQQ-UHFFFAOYSA-N 446.345 4.498 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN(C)C3CCN(c4cnccn4)CC3)c2C)cc1 789370092 CKHLKHOHNLDBFP-UHFFFAOYSA-N 447.583 4.066 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC[C@H]2c2nc(C(=O)OC)c(C)s2)c1O 794663476 MXKSORKBMDYKKO-SFHVURJKSA-N 440.521 4.221 10 10 IICE C[C@H](NC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1)c1ccc(N2CCOCC2)cc1 801001731 PFLPQDMUMIJYGK-LPHOPBHVSA-N 425.495 4.348 10 10 IICE COCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)CC1 802684964 UZBXTYGYPLVVLF-HSZRJFAPSA-N 449.599 4.394 10 10 IICE Cc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1C(=O)N1CCCCC1 806466455 APUBOMLJKKXSFF-UHFFFAOYSA-N 446.345 4.411 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(OC(F)F)c2)n1C[C@H]1CCCO1 812258062 YTUULLFHDSSGTJ-GOSISDBHSA-N 430.455 4.068 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(C(=O)NC4CCCC4)cc3C)CC2)cc1 920873454 FGFGKXGNXZSECM-UHFFFAOYSA-N 436.556 4.030 10 10 IICE COc1cccc([C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 1128247103 MPXOISSRVSNVJP-HRAATJIYSA-N 427.545 4.204 10 10 IICE Cc1cc(CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1-c1ccccc1 1129357539 AAXZHTJHDTWEMY-UHFFFAOYSA-N 444.984 4.270 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](C)Oc1ccc(F)cc1Br 1129974396 OLIDZWZZMBKWRC-CABCVRRESA-N 437.353 4.477 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccc(I)cc2O)cc1 1135734659 GFUPHWPOEKYFLE-UHFFFAOYSA-N 438.309 4.115 10 10 IICE C[C@H](NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(=O)N1c2ccccc2C[C@H]1C 1228460208 RREPUIUVENQOMP-UXHICEINSA-N 434.584 4.185 10 10 IICE C/C(=C/c1ccccc1)CN(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1230475258 FCJUKZVFUVDTHG-PYCFMQQDSA-N 432.612 4.464 10 10 IICE CCC(CC)(CNC(=O)N1CCCN(c2ccc(OC)cc2)CC1)C(=O)OC(C)(C)C 1252095199 YVEUMEJFIBHNFU-UHFFFAOYSA-N 433.593 4.065 10 10 IICE CCCN(CCC)S(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1269587982 MYJJIDWNVHSFAZ-GOSISDBHSA-N 431.602 4.054 10 10 IICE C[C@@H](CCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N1CCCCC1 1288567433 VCHRHRAGFVCLAD-UGKGYDQZSA-N 427.593 4.126 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)CCS1 1293610052 BRYLGYKZVHUIOG-KRWDZBQOSA-N 446.671 4.235 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1 1300091458 FCDHDTQDDICSPV-UHFFFAOYSA-N 443.510 4.291 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(N)=O)C1 1305281168 VLKWDMRHPSRABF-HXUWFJFHSA-N 448.615 4.491 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCn3c(cc4ccc(Cl)cc43)C2)N(C)C)cc1 1313419061 RWXKWEREKMJHHY-QHCPKHFHSA-N 439.991 4.189 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)sc2c1CCCC2 1349148377 WFFIYIBMDQCUHK-HNNXBMFYSA-N 426.538 4.022 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3cc(Cl)cc(Cl)c3)cc2F)C[C@@H](C)O1 1350933556 PBSPOHLZKANJCG-OKILXGFUSA-N 441.330 4.441 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4cccc(Cl)c4s3)cc2)C1 1356433399 MFGHXYFLLHVUNP-MRXNPFEDSA-N 427.957 4.186 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1[C@H]1CCCOC1 1444988618 QEAYRVACQCUTOH-QUCCMNQESA-N 447.526 4.457 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(CO)(Cc3ccccc3)CC2)c1 1448598118 ZJUNGZZOJQYFFI-UHFFFAOYSA-N 430.548 4.364 10 10 IICE Cc1cc(C(=O)NCC(C)(C)[C@@H]2COCC23OCCO3)c(C)n1-c1ccc(C(C)C)cc1 1451242937 ZKKZSTZOWGMRFM-QHCPKHFHSA-N 440.584 4.363 10 10 IICE Cc1ccc(CN(Cc2cccc(S(C)(=O)=O)c2)c2ccc3c(c2)OCCO3)s1 1459686867 HOUCRERIXVABIU-UHFFFAOYSA-N 429.563 4.438 10 10 IICE COc1ccc([C@H](CNC(=O)OC(C)(C)C)CN[C@@H](C)c2cc(OC)ccc2O)cc1 1459848116 GEWVJCFZRPYHJP-WMZOPIPTSA-N 430.545 4.369 10 10 IICE COc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1C(F)(F)F 1465952190 XEUWPAPQNLCJBO-MRXNPFEDSA-N 442.865 4.467 10 10 IICE COc1ccc(N(CCc2ccccc2)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1 1473251885 YCFVCZUXBNOSDT-QHCPKHFHSA-N 426.557 4.380 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cc(C(F)(F)F)nn3C)cc2Cl)C1 1478528680 SMYUFMIZUWHDBL-CYBMUJFWSA-N 443.901 4.328 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2COC(C)(C)OC2)n1Cc1ccc(N(C)C)cc1C 1495171844 BKFHBIBKOOPVCO-KRWDZBQOSA-N 429.609 4.050 10 10 IICE CCOCCN(CC)c1nnc(CC2CCCC2)n1Cc1ccc2c(c1)CCCN2C 1516725577 MDRVLXCANDGGTQ-UHFFFAOYSA-N 425.621 4.304 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(Br)n(C)n3)cc2Cl)C1 1524255467 PELMFPVCLGDFGR-LBPRGKRZSA-N 425.758 4.002 10 10 IICE CC(C)Cc1coc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1538227991 YKJLTQRQLAUVOV-MHWRWJLKSA-N 433.530 4.242 10 10 IICE CC(C)(C)OC(=O)[C@@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)C 1539581907 MCMHMNYCPJATKM-CRAIPNDOSA-N 440.531 4.377 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c(F)c1 1546150052 CYOXXKVZXZIMDS-UHFFFAOYSA-N 433.527 4.451 10 10 IICE CCN(CC1CCC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1547540866 YEZSXHQMNUKSCM-UHFFFAOYSA-N 434.588 4.067 10 10 IICE Cc1cc(C(=O)Nc2cccc(C[S@@](C)=O)c2)c(C)n1-c1ccc(Br)cn1 1565753275 PAFHXANQQDIYIL-HHHXNRCGSA-N 446.370 4.382 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@@H](O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cn1 1566326068 YFJHRHYEFCKPPY-ZUOKHONESA-N 446.320 4.243 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(-c2cccc(Cl)c2)nc1O 1587459784 HMZPJLBOSJKQFG-UHFFFAOYSA-N 437.927 4.216 10 10 IICE COc1ccc2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c(C)nc2c1 1595574724 ZAHMFNFLLWIMSI-LJQANCHMSA-N 439.943 4.305 10 10 IICE O=C(NC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1cccc(O)c1O 1596059117 XUCIJBMSAHXUKQ-GOSISDBHSA-N 428.941 4.342 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](C(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1613267249 GSBSZYJNWVJEGQ-PKOBYXMFSA-N 433.547 4.158 10 10 IICE CCN1CCN(c2nnc(-c3ccccc3C)n2CCCSc2nccs2)C[C@H]1C 1615859653 RIJXIVANZJBFRY-GOSISDBHSA-N 442.658 4.423 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCOc3cccc(C(F)(F)F)n3)c2C)cc1 1624579876 PUWUMHPRXKXUTR-UHFFFAOYSA-N 433.430 4.325 10 10 IICE CCNC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1630410783 UNRPGASNTDYDNP-UHFFFAOYSA-N 441.329 4.254 10 10 IICE Cc1cc(Cl)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1[N+](=O)[O-] 1631612179 JSDVPYHKOSMQCD-GOSISDBHSA-N 431.920 4.444 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(I)c(F)cc1F 1635958868 BKBNTHSHFIFIEO-UHFFFAOYSA-N 443.231 4.084 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NCc2c(O)ccc3c2CCCC3)c1 1635959963 RJTNHTRBNVRHEN-UHFFFAOYSA-N 441.421 4.489 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(c4cccc(C(F)(F)F)c4)CCC3)cc2)CC1 1638003759 FPOCETXGCOHBCU-UHFFFAOYSA-N 446.517 4.336 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)[C@]12CCCO2 1638250234 JCQDPNSWITVUAA-KCZVDYSFSA-N 447.373 4.313 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NC(=O)c3cc4cc(O)c(O)cc4s3)C[C@H]2C1 1638771290 BRZQOMMYUFFOTO-AEGPPILISA-N 432.542 4.078 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(CC(C)C)C2=O)c(C)n1-c1ccc(F)c(Cl)c1 1640560637 MIDPMYWFNGWCOS-QFIPXVFZSA-N 433.911 4.426 10 10 IICE CC(C)c1cccc(N(CCO)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1646583363 GXZXHUCGNSUIHO-UHFFFAOYSA-N 442.515 4.023 10 10 IICE COC(=O)[C@@](C)(Cc1ccc(F)cc1)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1651014525 DVIQNODQQXJCRB-XMMPIXPASA-N 426.463 4.277 10 10 IICE COc1ccc(N(C)CC(=O)N(C)[C@]2(c3ccccc3Cl)CCCCC2=O)c(OC)c1 1652957633 MRDDMPSDVSATEP-DEOSSOPVSA-N 444.959 4.290 10 10 IICE Cc1cc(CNC(=O)NCC2(C(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccccc1 1682225610 NEFDZIOXLSVOER-UHFFFAOYSA-N 441.572 4.032 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccccc3SC(F)(F)F)C2)cc1 1683786257 FBSPHALIZNWBIQ-OAHLLOKOSA-N 425.476 4.385 10 10 IICE O=C(NCCc1c[nH]c2c(Cl)cccc12)NCc1ccc(N2CCC(CO)CC2)cc1 1684308429 NFLOWTQGKCHTDC-UHFFFAOYSA-N 440.975 4.072 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](CO)c2ccc(Cl)cc2)c(C)n1-c1ccccc1 1684444546 OBCIXIXZILXESL-OAQYLSRUSA-N 425.960 4.365 10 10 IICE C[C@H]1CCC[C@@](Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1693632428 ZROBWIDVCZFLEI-RXFWQSSRSA-N 448.615 4.116 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1694798091 ZEGCKVWWZAAUKF-SIKLNZKXSA-N 438.620 4.033 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1712177030 VOTHNEGHJNKTHK-IEBWSBKVSA-N 443.592 4.279 10 10 IICE CCCCN(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1728033038 YGSSGXZDEIPFGJ-FQEVSTJZSA-N 429.634 4.010 10 10 IICE CCN(CC)[C@@H](Cn1c(C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)c1ccco1 1728374852 SZEHOMUYVSZGIS-QHCPKHFHSA-N 436.604 4.499 10 10 IICE CCN1CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@H]1C 1728615537 ZENNXTVYTGOREE-OAHLLOKOSA-N 432.619 4.016 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)C3)n2CCCNC(=O)C(C)C)c(C)n1-c1ccccc1 1761676604 OJPWZQQBFAMKGZ-IBGZPJMESA-N 448.615 4.361 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C)N2CCC[C@@H](C)C2)n1 1761916915 SFJCXXBQDBHAAF-UYAOXDASSA-N 434.588 4.111 10 10 IICE CCc1nnc(N2CCC[C@@H](Oc3ncccc3F)C2)n1CCCSc1nccs1 1763053311 MTVIOMMBXVJDNQ-OAHLLOKOSA-N 448.593 4.061 10 10 IICE CCC[C@@H](C)CN(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763807359 RFEPQDQZARIDNF-XMSQKQJNSA-N 445.583 4.026 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1C[C@@H]1CCCC[C@@H]1C(F)(F)F 1767111903 JVIMWJKUVBXTOP-YJBOKZPZSA-N 448.493 4.389 10 10 IICE CC(=O)Nc1cccc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)c1 1860085541 QPPZCQCBJWZVDA-LZYBPNLTSA-N 428.564 4.377 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(Br)cc2O)C[C@@H]1C1CC1 1895872822 BLQJFVBUWSVDHE-IAGOWNOFSA-N 425.367 4.422 10 10 IICE Oc1cccc(F)c1Cn1nc(C2CC2)c(I)c1C(F)(F)F 2079035481 FMFHRKCSRAJRET-UHFFFAOYSA-N 426.151 4.277 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(NCc2cc(Br)cc(F)c2O)C[C@H]2CC[C@H]1C2 2188301640 LXOTUHNBKSFICY-SIFORAMQSA-N 443.357 4.467 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)c1O 2236055271 OZVNHGFZHVCQHV-UHOFOFEASA-N 441.366 4.041 10 10 IICE COc1ccc(Br)c(CN[C@@H]2[C@@H]3CCCCN(C(=O)OC(C)(C)C)[C@H]32)c1O 2236055446 PWDXRZLZMBBDPX-JCURWCKSSA-N 441.366 4.041 10 10 IICE COc1ccc(-c2ccc(C=C3C(=O)N(c4cccc(C(=O)O)c4)N=C3C)o2)c([N+](=O)[O-])c1 2294005079 YIZVJJCNRKYIRZ-UHFFFAOYSA-N 447.403 4.368 10 10 IICE O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)C1=Cc1ccc(OCc2ccccc2)cc1 2296079365 KLPFHOWWQPCFHN-UHFFFAOYSA-N 444.462 4.109 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=O)NC(=S)N(Cc4ccccc4)C3=O)c2C)cc1 2296167022 NGUGJTLHQJMJIA-UHFFFAOYSA-N 429.545 4.229 10 10 IICE COc1ccc(-c2csc(N3N=C(C)[C@H](N=Nc4ccc(C(=O)O)cc4)C3=O)n2)cc1 2297734716 FIUUXVWPOYFVBS-SFHVURJKSA-N 435.465 4.392 10 10 IICE CCOC(=O)c1cccc(N2C(=O)C(=Cc3ccc(OC)c(OC)c3)SC2=S)c1 2314732272 OFWBXNTZUNRKKD-UHFFFAOYSA-N 429.519 4.286 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2ccc(OCCc3ccccc3)cc2)SC1=S 2314768360 KRNPJMZCBDVXAM-UHFFFAOYSA-N 427.547 4.072 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccc(C)cc4)C3=O)c2C)cc1 8643544 GESADJHDVBXCLL-SANMLTNESA-N 429.520 4.361 10 10 IICE CCC1=NN2C(=N)/C(=C\c3ccc(OCc4ccc(F)cc4)c(OC)c3)C(=O)N=C2S1 33333351 FBRDJHBJVKDINL-HCNNPVLLSA-N 438.484 4.442 10 10 IICE CC(C)C[C@@H]1NCCc2cc(/N=N/c3nncs3)c(NS(=O)(=O)C(F)(F)F)cc21 199856851 AWPSFGIGOANSQW-GKTNPMIISA-N 448.496 4.448 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3cccc(OCC(F)(F)F)c3)SC2=S)cn1 726986797 YDKYWZUWLLBUJM-RIYZIHGNSA-N 426.441 4.437 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NC[C@@H](C)c3ccc(F)cc3F)cc2F)C[C@@H](C)O1 743555009 OJADPKOVQKOBKY-OAGGEKHMSA-N 435.490 4.320 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)c1 743672254 HFNKKZPXYJVYML-BEFAXECRSA-N 429.517 4.027 10 10 IICE COc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(OC(F)F)c1 768670979 VLMZZKYWXQLYNW-UHFFFAOYSA-N 431.527 4.118 10 10 IICE CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)Cc1ccc(N2CCN(C)CC2)cc1 775641736 BPRXAFLLPLYQJQ-UHFFFAOYSA-N 448.533 4.306 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cncn2Cc2ccccc2)C1 785017559 FDSXKLVMIRRPSK-UHFFFAOYSA-N 442.563 4.396 10 10 IICE COc1cc(Br)ccc1[C@H](C)NC(=O)NCc1ccc(N2CC=CC2)cc1 786776963 HNCMKBZKROTOAW-HNNXBMFYSA-N 430.346 4.394 10 10 IICE CCOc1cccc(/C=C\C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1125196175 CQLMEJKAVZRFOP-TWGQIWQCSA-N 434.458 4.270 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CCN(CC(F)(F)F)c3ccccc32)C1 1126705864 RFFAMGMXXVWCAG-HNNXBMFYSA-N 425.451 4.015 10 10 IICE CNS(=O)(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)cc1 1135261572 CHJPLHJWHJKKQO-UHFFFAOYSA-N 425.554 4.378 10 10 IICE Cc1cc(=O)oc2cc(N(C)C(=O)/C=C/[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc12 1157108368 XZEUSJMIDHOQGP-YRYLYKBFSA-N 426.513 4.268 10 10 IICE COC(=O)[C@@H]1Cc2ccc(O)cc2CN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1176915882 PHHNVVZUXYXXMW-QHCPKHFHSA-N 444.491 4.346 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Oc4ccccc4)ccc3O)cc2F)CC1 1293088153 PPSLYNFICNCWDU-UHFFFAOYSA-N 449.526 4.396 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccc1 1293417199 XHAVBSGMXFTYFV-HNNXBMFYSA-N 428.510 4.308 10 10 IICE CC1=CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1304589747 YKVRWQGCNBCGFF-UHFFFAOYSA-N 427.568 4.047 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H](O)COc1cccc(C(F)(F)F)c1 1307499709 OEZVCLVEGLKCDW-MRXNPFEDSA-N 448.279 4.435 10 10 IICE Cc1cc(CCNC(=O)N2CCC(Oc3ccc(F)nc3)CC2)c(C)n1-c1ccccc1 1313100111 IGDFKOLWHFBPCR-UHFFFAOYSA-N 436.531 4.424 10 10 IICE CC[C@@H](NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1cc(C)ccc1C 1313154141 PTOWJHPUSGHGKC-OAQYLSRUSA-N 441.572 4.312 10 10 IICE CN(CCc1cccc(Br)c1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1313419924 VXZHVSSSNJAHJP-NRFANRHFSA-N 447.421 4.002 10 10 IICE C[C@H](Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1316497961 JSOGZRCCPXYVCG-MRXNPFEDSA-N 431.581 4.122 10 10 IICE CN(Cc1ccc(F)cc1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1348123544 PJSYENNSNJSEKX-LDADJPATSA-N 432.517 4.215 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1361048672 FZPNTYWDXPZKIU-OALUTQOASA-N 448.615 4.313 10 10 IICE CC(C)(C)N(Cc1ccccn1)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1435953332 JQYFDCJDWHZMEG-UHFFFAOYSA-N 443.459 4.206 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1-n1nnnc1C 1443005183 JDLBZCLPFRVIPZ-UHFFFAOYSA-N 430.512 4.256 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(=O)c3ccc(Cl)cc3o2)cc1 1464596846 NNZAYFAJQRIPTG-IBGZPJMESA-N 440.927 4.334 10 10 IICE C[C@@H](c1ccccc1)[C@@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C(N)=O 1469960132 OLXJNVQQICVHAO-HYFFOGBASA-N 442.991 4.033 10 10 IICE CCOC(=O)c1sc(-c2ccccc2)cc1NC(=O)CN(C)c1ccc2c(c1)OCO2 1473285050 WYVZCNBOXLIABE-UHFFFAOYSA-N 438.505 4.395 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)C[C@@H]1C 1500458407 MBUGWDIHCIZTBI-IBGZPJMESA-N 434.588 4.210 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1504787812 DDNFMCCFXAXCOO-FQEVSTJZSA-N 437.588 4.394 10 10 IICE CCC[C@@H](Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O)OC 1514332432 QOJIUEGIYWDXBY-INIZCTEOSA-N 448.365 4.193 10 10 IICE Cc1c(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)nnn1Cc1ccncc1 1522907888 MCSMKDXKGILOTN-UHFFFAOYSA-N 434.931 4.272 10 10 IICE CCc1c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)nnn1Cc1ccc(F)cc1 1535142867 GILUBCBJSIDPCR-UHFFFAOYSA-N 431.515 4.365 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCC[C@H]2C(=O)OC(C)(C)C)C1 1537428100 GIQPYFGQVGUMBH-CTNGQTDRSA-N 439.600 4.034 10 10 IICE Cc1cc(CC(=O)NCC2CCC(S(C)(=O)=O)CC2)c(C)n1-c1ccc(Cl)cc1 1537772701 BLHVCMDYTVTTAS-UHFFFAOYSA-N 437.005 4.010 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2Cc3cc(F)ccc3NC2=O)cc1 1565656139 PXJATQSIIIPBNL-HSZRJFAPSA-N 447.510 4.245 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](c1ccc(Cl)cc1)N(C)C 1566306441 KZLXVCXRCYTYRV-GOSISDBHSA-N 425.754 4.460 10 10 IICE CC(C)(C)OC(=O)c1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1566357191 YNXZFOHHSCYRNH-FQEVSTJZSA-N 444.959 4.395 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1567650247 QKKLJUGTEQXSFQ-GOSISDBHSA-N 427.545 4.232 10 10 IICE CC[C@@H](C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1586061349 PLKYEVSEIPHHJV-NHCUHLMSSA-N 432.406 4.428 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(NCc4nc(C)cs4)c3)CC2)cc1F 1595483627 XVDXLCBNKGPYAI-UHFFFAOYSA-N 440.544 4.174 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3Cl)CC2)c(OC)c1 1595989931 MJSJXFNMZSRKLO-ZWKOTPCHSA-N 435.351 4.463 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc4c(cc3[N+](=O)[O-])OCCCO4)c2C)c1 1596482141 LJBAWBAWTBXQBR-UHFFFAOYSA-N 435.480 4.402 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3cc(Cl)ccc3Br)C2)cc1 1598363867 JUYNAYSOHSISMT-AWEZNQCLSA-N 437.765 4.296 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3sc(C)nc3-c3cccs3)C2)cc1 1598364158 NTAYTNOTSTWOQY-INIZCTEOSA-N 427.595 4.374 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2C)cc1 1613321725 DILOWCPTBVVGMB-UHFFFAOYSA-N 426.494 4.276 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4cccc(C(F)(F)F)c4)c3C)C2)cc1 1617262915 OKCALPKWQQUQMB-KRWDZBQOSA-N 444.457 4.217 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 1625794933 YLXNWGKMDWKOTR-AVRDEDQJSA-N 431.939 4.113 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H](c2cccc(Br)c2)N2CCCC2)c1 1630366684 VWHYDSCUOPKQDG-XOBRGWDASA-N 433.346 4.178 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1coc2c(C)c(Cl)ccc12 1632701570 IPYKPBSUAFIRFC-UHFFFAOYSA-N 436.291 4.498 10 10 IICE COc1ccc(CCNC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c(Cl)c1OC 1635583214 SNMQEDXACIMJCT-INIZCTEOSA-N 433.980 4.205 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(C(=O)OC(C)(C)C)C(C)(C)C3(C)C)C2)cc1 1638650188 RHIOHFDNEUNZOG-KRWDZBQOSA-N 430.589 4.032 10 10 IICE O=S(=O)(CCN1CCCc2cc(OC(F)F)ccc21)c1cccc(Br)c1 1642061058 KSKHWPUDDXNQOQ-UHFFFAOYSA-N 446.313 4.277 10 10 IICE COc1ccc(N2CCN(Cc3cc(Br)cc4cccnc34)CC2)c(OC)c1 1644225328 GLTUMIBYJXYNLB-UHFFFAOYSA-N 442.357 4.337 10 10 IICE CCOc1ccc(N2CCN(Cc3nc(-c4ccc(Br)s4)no3)CC2)cc1 1652964703 PUXLUMSIVWXJRM-UHFFFAOYSA-N 449.374 4.282 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3)C2)cc1 1680824970 RQSNRJGPOWDTGB-HOTGVXAUSA-N 449.382 4.159 10 10 IICE COc1cccc(CN(C[C@H]2CCCO2)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c1 1683420920 AXXDXQUOYUCQLY-NBGIEHNGSA-N 439.600 4.391 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CC=C(C(F)(F)F)CC1 1693006304 VCGNBRHVZRVZAC-UHFFFAOYSA-N 430.478 4.395 10 10 IICE C[C@@H]1CC[C@@H](C)N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1693607256 PYLAMPQZPOHLAB-QZTJIDSGSA-N 429.584 4.224 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(C)(C)CN(C)C 1694109280 NUDJJVNEXDLEEB-FQEVSTJZSA-N 442.652 4.105 10 10 IICE CC[C@]1(C)CC[C@@H](Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)O1 1694426699 IUHVOLJDTDLCHU-WIOPSUGQSA-N 441.620 4.475 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)C[C@@H]1CCCO1 1696424765 RJCFEXMKJNYFIW-QFIPXVFZSA-N 437.588 4.394 10 10 IICE C[C@H](Cn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1698452250 LPJFLSGVXZKVSH-QGZVFWFLSA-N 443.592 4.266 10 10 IICE Cc1cc(-c2nnc(N3CCOCC3)n2CCSC(C)C)c(C)n1-c1ccccc1 1707275645 NAZFZDOVWGPMCO-UHFFFAOYSA-N 425.602 4.331 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccoc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1708401299 BMNNIBWRIDXXJU-LJQANCHMSA-N 437.588 4.278 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)C(F)(F)[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708570086 SJVGXBYGSXVFTR-GBESFXJTSA-N 447.574 4.404 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1709480727 JUFRIMMDRCSVAY-QYBDOPJKSA-N 448.615 4.456 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743803103 LJEGSKMQNIZUKV-ZWKOTPCHSA-N 431.675 4.335 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@@](C)(OC)CC2)cc1 1746095144 KYXKLXYLARSMHP-RCZVLFRGSA-N 441.620 4.420 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(N)=O)C1 1763323487 XVHYIUUNSOHEOR-SANMLTNESA-N 448.615 4.491 10 10 IICE CCSCCCn1c([C@@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1768400391 XKLWLVPSFGWSDM-KRWDZBQOSA-N 435.613 4.409 10 10 IICE CC[C@@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2cccnc2)C1=O 1873168542 YYCWKZPURNTCFE-QGZVFWFLSA-N 428.536 4.157 10 10 IICE COc1cccc(O)c1[C@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)C[C@@H]1C(=O)O 1952756750 HWUMWSNYKZVHEI-IBVKSMDESA-N 445.471 4.239 10 10 IICE CCOC(=O)c1ccccc1NCN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2293065461 FOQVWSCHUZBFGN-UHFFFAOYSA-N 443.506 4.042 10 10 IICE Cc1ccc(N2C(=O)C(=Cc3ccc4c(c3)OCO4)C(=O)N(c3ccccc3)C2=S)cc1 2296645046 QGMSUAWVVLGHSK-UHFFFAOYSA-N 442.496 4.472 10 10 IICE CC1=NN(c2ccc(Br)cc2Br)C(=O)C1=C(C)NCC(C)C 2296735005 YXWZYFCOKJMTNJ-UHFFFAOYSA-N 429.156 4.454 10 10 IICE COc1ccc(OCCCOc2ccc(C=C3C(=N)N4C=CSC4=NC3=O)cc2)cc1 2297313883 APIAWDURXYXEER-UHFFFAOYSA-N 435.505 4.320 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3cccc(O)c3)SC2=S)cc1 2314836361 DPKQKPVESCFNCU-CYBMUJFWSA-N 428.535 4.019 10 10 IICE CC1=NN(c2ccc(Br)cc2Br)C(=O)/C1=C(\C)NCC(C)C 4391332 YXWZYFCOKJMTNJ-XNTDXEJSSA-N 429.156 4.454 10 10 IICE CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\Nc1ccc2c3c(cccc13)C(=O)N(C)C2=O 16694247 WTJJOQPQXRAHOO-UNOMPAQXSA-N 444.878 4.438 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)ccc1OC(=O)c1ccco1 208520745 MNAZEGKXCFENHE-LDADJPATSA-N 446.415 4.012 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 727247391 SWBGNPLZLXGWME-UHFFFAOYSA-N 432.523 4.096 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cc(C(=O)OC)cs3)n2)c1C 727248516 UCVUDOKDHJRANO-UHFFFAOYSA-N 439.584 4.287 10 10 IICE O=S(=O)(Nc1nc(-c2sccc2Br)cs1)c1cccnc1Cl 739382077 IUMHOUCDHFFIEB-UHFFFAOYSA-N 436.765 4.483 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CC3C[C@H]4CC1C[C@@H](C3)C4)c2[N+](=O)[O-] 743720685 IINJDRHTIVCNNQ-PJPHBNEVSA-N 430.460 4.021 10 10 IICE C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 754143815 XEQAZGXVKJHOSR-ANYHLBQASA-N 427.476 4.067 10 10 IICE COc1cc(N2CCN(Cc3cccc(OCc4ccccn4)c3)CC2)cc(OC)c1OC 761220037 SIDCLDWTPCSGPV-UHFFFAOYSA-N 449.551 4.009 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1 761745551 KTLXLOJMACQRTO-DQLDELGASA-N 426.944 4.478 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc2nccnc2c1Br 806674445 ARALBESIIJYFKM-UHFFFAOYSA-N 426.318 4.314 10 10 IICE Cc1cc(C(=O)N2CCN(C3CC3)C[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1141550896 NADWBCPZEQLNDY-HNNXBMFYSA-N 430.390 4.413 10 10 IICE CCN1CCN(Cc2ccc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)cc2)CC1 1141603639 XAAAMYUGZWYLSQ-UHFFFAOYSA-N 446.595 4.493 10 10 IICE CC(C)(C)OC(=O)N1CCCc2c(CNC(=O)c3ccc(N=NC(N)=O)cc3)cccc21 1141716696 RRTSNACQIZRDOJ-UHFFFAOYSA-N 437.500 4.467 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@H]1c1ccccn1 1142285729 JENIAZUMOAMMRR-OGBKAESYSA-N 441.553 4.176 10 10 IICE C[C@H](NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]([C@H]2CCCO2)C1)c1ccc(N(C)C)cc1 1154667995 BBJRLHMNPOCSGJ-RGMHLJPOSA-N 445.604 4.125 10 10 IICE Cc1cc(C(=O)NCCn2cc(Br)ccc2=O)c(C)n1-c1ccc(Cl)cc1 1159852290 HHUGWPLRCPBGOQ-UHFFFAOYSA-N 448.748 4.102 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(F)cc3NC(=O)c3ccoc3)CC2)cc1 1253853479 OQEWWTQRBZUPAQ-UHFFFAOYSA-N 437.471 4.032 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H](c2ccc(F)cc2F)c2nccn2C)cc1 1256214776 AFLVQHUNABLREI-JOCHJYFZSA-N 441.526 4.476 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(C)nc(NC)n2)sc(C)c1-c1ccc(F)cc1 1264290730 USXXTRHSIJXZSU-UHFFFAOYSA-N 428.489 4.432 10 10 IICE CC(C)CCN(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1287590024 ZGODIIZHUVPMDE-OAQYLSRUSA-N 429.634 4.213 10 10 IICE Cc1cscc1Cn1c(N(C)Cc2ccccc2O)nnc1[C@]1(OC(C)C)CCOC1 1290362930 WSNMDXMAAKMKMV-QHCPKHFHSA-N 442.585 4.079 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCOC[C@H]3CC(=O)c3cccs3)c2C)cc1 1294366878 ZEXLZYXYGQZMAP-LJQANCHMSA-N 438.549 4.278 10 10 IICE Cc1ccc(C(=O)N(C)CC(=O)NCCC2=CCCCC2)cc1-n1c(C)cc(C=O)c1C 1304000734 XHARPUXHJVQCTR-UHFFFAOYSA-N 435.568 4.294 10 10 IICE C[C@@](Cc1ccccc1)(NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)C1CC1 1312832793 DLDGXXJWXLGDNA-DEOSSOPVSA-N 429.511 4.012 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)N2CCN(C3CC3)c3ccc(F)cc32)C1 1448022767 RCFYIZDIBVPTTB-SCBHQAGPSA-N 429.536 4.344 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC1(c2c(F)cccc2F)CCC1 1478823830 ATXUUNYGRBBVTP-UHFFFAOYSA-N 429.511 4.065 10 10 IICE CC1CCN([C@H](C)Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CC1 1512265185 COYBJLAGLBMXIP-HXUWFJFHSA-N 425.621 4.473 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@H](OC)C(C)C)CC2)cc1 1518309699 RGRVCBWMWIBRHV-JOCHJYFZSA-N 443.636 4.263 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cnn1C1CCCC1 1521009792 LYMUSDPBTIHLIF-UHFFFAOYSA-N 441.595 4.162 10 10 IICE CCOc1ccccc1OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1530482314 ZQHMQFBUUDDJAL-AQTBWJFISA-N 431.510 4.421 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)N(C)C)cc1 1539234821 GVBFIPOUVVBZBH-FQEVSTJZSA-N 437.481 4.361 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C[C@@H]2C(=O)Nc3ccc(Br)cc32)cc1 1539307009 GHZPURMACBQTIG-IBGZPJMESA-N 444.373 4.380 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CCC[C@H](C(F)F)C1 1542226817 KFGZYORLQALBDG-RBUKOAKNSA-N 433.547 4.076 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCCCSc1nccs1)c1ccc(F)cc1 1542956409 VKLKTFUYXTXSIH-MRXNPFEDSA-N 439.578 4.189 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)c1ccccc1 1556217884 OALPPGYHAAGEBG-SANMLTNESA-N 434.536 4.354 10 10 IICE COc1ccc(Cl)cc1N1C[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)CC1=O 1556884228 RSIGKYLFSLMCBZ-LLVKDONJSA-N 443.714 4.030 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Br)c1O 1566154720 GXJYPWQKLNJMQX-LBPRGKRZSA-N 441.272 4.155 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1c(O)cccc1Cl 1569682216 KGDSBJNIYIHZCY-XNTDXEJSSA-N 436.917 4.415 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1)C1CCCCC1 1583701034 WWEWOTFQKJDPSW-SFHVURJKSA-N 441.522 4.403 10 10 IICE Cc1ccccc1CC(C)(C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1584602433 OGUGOFHLMXCTKT-UHFFFAOYSA-N 444.578 4.314 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](C)COc2ccccc2OC)CCCC1 1596597674 PRHRSISTFKLXIF-GOSISDBHSA-N 436.552 4.369 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H]2CCC3(CC(C(=O)OC(C)(C)C)C3)O2)cc1 1597338153 DHQSNCUOXFWMIX-HLTVDCFTSA-N 438.568 4.493 10 10 IICE C[C@H](CC(=O)NCc1ccc2c(c1)CCCN2C)C1CCN(C(=O)OC(C)(C)C)CC1 1597849869 XZSMPTRRNMBHQN-GOSISDBHSA-N 429.605 4.359 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N2CCSCC2)cc1F 1617669285 QSGPXFNTEVAOIP-YLJYHZDGSA-N 447.624 4.003 10 10 IICE C[C@@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CC(c2cccc(Cl)c2F)=NO1 1625969791 KXEJCKVLDVVELI-QFIPXVFZSA-N 447.963 4.232 10 10 IICE CCN1CCc2nc3ccccc3c(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)c2C1 1630179675 HLFACEXJYZUIKR-IBGZPJMESA-N 430.596 4.348 10 10 IICE CN(C)[C@@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1630257158 PWFQJBBTYLXZPB-PZJWPPBQSA-N 436.383 4.083 10 10 IICE Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NCc1cccc(O)c1O 1637033874 BECFSYOFXIHRSJ-UHFFFAOYSA-N 434.876 4.443 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnc4c(Cl)cccc4c3=O)c2C)cc1 1641222839 LHDTXIJUMLMUNH-UHFFFAOYSA-N 436.899 4.134 10 10 IICE COc1cc(OC)c2c(c1)N(C(=O)/C=C/[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CCC2 1641445789 DKSKGQSDGQASEG-DVQDXYAYSA-N 430.545 4.186 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1cccc(C(F)(F)F)c1 1651377610 DUZCKHNIVBDTOS-LJQANCHMSA-N 431.414 4.152 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3nc(-c4ccc(Cl)cc4)no3)C2)cc1 1682645335 CXXTWSZVKLBJFF-PBHICJAKSA-N 441.919 4.038 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(CNC(=O)NCc2cc(Cl)ccc2O)c(F)c1 1683602260 SQNDAFWIRXFSFT-UHFFFAOYSA-N 437.899 4.209 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCc3cccc(Br)c3C)CC2)cc1 1685208263 WTIQGGHLQAAULO-UHFFFAOYSA-N 446.389 4.231 10 10 IICE CC[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ncc(-c2ccccc2)[nH]1 1685608757 GDBJIXFJKZMYLD-FYYLOGMGSA-N 434.588 4.196 10 10 IICE Cc1occc1C(=O)NC1CCN(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1 1687286646 ONAVQKGHNQUTIY-UHFFFAOYSA-N 434.540 4.100 10 10 IICE CCN(CC(C)C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1709985322 OPLPRCLBKKTYJO-UHFFFAOYSA-N 435.620 4.053 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCS[C@@H](C)[C@H]2C)cc1 1710028179 RPAPMTNYLUXFEF-LVCYWYKZSA-N 429.634 4.354 10 10 IICE CN(Cc1cnn(C)c1)c1nnc(-c2ccccc2F)n1CCCSc1nccs1 1711104890 MBYASBMONBNHRP-UHFFFAOYSA-N 443.577 4.093 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1727046112 RBUBLKGJIUZHOQ-UUOWRZLLSA-N 447.599 4.054 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCOC3)n2CCCCCCO)c(C)n1-c1ccccc1 1742118277 YVWMVLAQSUNEGF-JOCHJYFZSA-N 437.588 4.130 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCC[C@H]1CC 1764083322 CVYXVNFRIWIEQG-MSOLQXFVSA-N 427.593 4.365 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCC(F)(F)C2)cc1 1766614368 ONNMYBVKIYHPFT-UHFFFAOYSA-N 426.515 4.004 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccccc4C)n4ccccc34)CC2)cc1 1858355003 ODVGVADLFSWIHS-UHFFFAOYSA-N 426.520 4.281 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)cc(F)c2O)[C@@H]2CCC[C@@H]21 1925970718 OAJJBPQYELWHOY-BPUTZDHNSA-N 429.330 4.171 10 10 IICE COc1cccc([C@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@H]2C(=O)O)c1O 1952767959 MCSLIMSLOPECMV-HFZDXXHNSA-N 445.471 4.239 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(NCc2cc(Br)cc(F)c2O)C[C@H]2CC[C@H]1C2 2188301641 LXOTUHNBKSFICY-TVSHIAKJSA-N 443.357 4.467 10 10 IICE CN1CCc2cc([C@@H](O)c3ccc(Br)cc3I)ccc21 2207267391 LJWLWVRFLIIGKY-MRXNPFEDSA-N 444.110 4.128 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@H](NCc1cccc(Br)c1O)C2 2226145382 WLDXECUAWLHECW-JLJPHGGASA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCCCCN2C(=O)OC(C)(C)C)c1O 2236054758 MHKFJDGJKADODK-CQSZACIVSA-N 443.382 4.433 10 10 IICE Cc1ccc(CNC(=O)[C@@](C)(NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2381137748 QCMNSGUGHXJNSA-HXUWFJFHSA-N 443.382 4.409 10 10 IICE COc1cccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)c1O 14459696 LVGUFMFPNVUCGP-JKSBSHDWSA-N 426.538 4.012 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@H](C)C(=O)O)C2=O)ccc1OCc1ccccc1C 33633604 OZVYHFIZDXLQOA-HIPSJFSSSA-N 443.546 4.257 10 10 IICE CCOc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1[N+](=O)[O-] 728839712 XZNNPLGMCZYSET-UHFFFAOYSA-N 425.407 4.264 10 10 IICE CCN(C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)[C@H](C)Cc1ccc(OC)cc1 731403565 OVMVSRFKSJXVSW-UXHICEINSA-N 425.573 4.256 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NC(=O)[C@H]2C[C@H]2C)cc1 743808566 XPWMELAGOLBWLA-ACJLOTCBSA-N 431.330 4.412 10 10 IICE S=c1n(CN2CCCc3cc(OCc4ccccc4)ccc32)nnn1C1CCOCC1 766355861 NOTBTHNDFVDADL-UHFFFAOYSA-N 437.569 4.150 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCCCC[C@@H]1c1ccncc1 769041236 HJFCCKXFIZCUGL-AREMUKBSSA-N 447.627 4.441 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H]1c1ccccc1I 779519415 DBVMGCBOBRKJOJ-SIJIIQCFSA-N 435.261 4.079 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CN(C)C(=O)N4)cs2)s1 799187181 NVWGIRGLTIMKMT-UHFFFAOYSA-N 434.568 4.212 10 10 IICE Cn1ccnc1[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(Cl)cc1 806342990 QVVLMAUVHBVYAT-QGZVFWFLSA-N 449.736 4.130 10 10 IICE C[C@H](NCc1c2c(nn1C)CCCC2)c1cc(Br)cc(Br)c1O 812736977 KVUJKRHRBOCJDF-JTQLQIEISA-N 443.183 4.380 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@H](c3ccc(Br)cc3)C2)c([N+](=O)[O-])c1 920337611 RXNUWERGAYTZEB-FOTOIKQHSA-N 447.285 4.121 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)cc1 1136698806 XTARSKRCSFTZEJ-UHFFFAOYSA-N 449.463 4.245 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(CN2C(=O)CCC2=O)cc1 1137816771 QXRWOPSRRCRWLV-IBGZPJMESA-N 442.515 4.445 10 10 IICE Cc1cc(C(=O)N[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c(C)n1-c1ccc(F)cc1 1137894499 UZHYZELSKHSZMW-INIZCTEOSA-N 427.426 4.047 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2cccc(C(F)(F)F)c2nc1O 1139974697 KKZFWBKIIWMDGT-UHFFFAOYSA-N 441.203 4.357 10 10 IICE CCc1ccc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CC2)cc1 1141340880 VEKDUMSZIMYOSS-UHFFFAOYSA-N 445.563 4.263 10 10 IICE C[C@H]1CCCN(C(=O)OC[C@H]2CCCCN2C(=O)c2cc3cc(O)c(O)cc3s2)C1 1157242445 GIUAFNRGYHACMH-GOEBONIOSA-N 432.542 4.176 10 10 IICE COc1c(F)cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(OC)c1F 1158590808 SUOGTLPKJIKRFA-UHFFFAOYSA-N 428.435 4.383 10 10 IICE COc1ccc(N(CCc2ccccc2)C[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1 1167881172 JGGAVJNDKXCHCC-HSZRJFAPSA-N 446.547 4.069 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](n3cccn3)C(F)(F)F)cc2Cl)C1 1235835864 XCZAJDYJZPFMNQ-RDTXWAMCSA-N 443.901 4.376 10 10 IICE C[C@@H]1[C@@H](NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CCN1C(=O)OC(C)(C)C 1313102467 NWSOPLZQGRPHHR-NQIIRXRSSA-N 430.593 4.216 10 10 IICE C[C@H](NC(=O)N(C)Cc1ccc(N2CCCC2)cc1)C1CCN(C(=O)OC(C)(C)C)CC1 1313171559 VQCPUVWPFLNPQS-IBGZPJMESA-N 444.620 4.464 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC=C(COC)CC2)cc1 1313677542 SQJXNLPWBSDNKH-UHFFFAOYSA-N 432.572 4.018 10 10 IICE CO[C@@H]1CCC[C@@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1315690047 FWOFSJCBIXKPNP-UGESXGAOSA-N 442.604 4.354 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C\c1cnccc1C)CCC2 1358157035 YCNZTOQHJMZQFJ-HJWRWDBZSA-N 432.476 4.341 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)CCCC1 1444269288 XSLPRHLVBMOFID-QHCPKHFHSA-N 441.522 4.226 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F 1455215459 RJVBFFIGLDEBJN-IFMALSPDSA-N 444.453 4.171 10 10 IICE COc1ccc(CNC(=O)NCCCCCC2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1 1479289027 VIZYCBICECFJGQ-UHFFFAOYSA-N 449.592 4.408 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OC(F)F)cc3F)cc2F)C[C@@H](C)O1 1516809312 AUWJDMPKFQNLSD-BETUJISGSA-N 426.410 4.110 10 10 IICE COc1ccc2c(c1)OC[C@H](C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)C2 1530426875 WQHXDXXGTIBGRP-VQIMIIECSA-N 428.960 4.452 10 10 IICE CCN(C(=O)Cc1cc(C)n(-c2ccccc2)c1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1534783893 CEZFVTLRWHRJLJ-QFIPXVFZSA-N 425.573 4.495 10 10 IICE CC(C)c1ccc([C@@H](CNC(=O)Cc2ccc(O)c(O)c2)NC(=O)OC(C)(C)C)cc1 1543072798 ATOGHCAPQBZMTH-LJQANCHMSA-N 428.529 4.146 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1556515874 PZUNFTPXNXJYFR-OAQYLSRUSA-N 428.447 4.162 10 10 IICE CCc1ccc(C2CCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CC2)cc1 1565363577 SOXWSHCYBKWILS-UHFFFAOYSA-N 448.611 4.040 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@H]3CCCC[C@@H]32)c(C)n1-c1cccc(C(C)C)c1 1566370534 DHAGSEHQYOADOE-GOTSBHOMSA-N 428.598 4.399 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc2c(c(OC)c1)O[C@H](C)C2 1568378680 JOMPHWOKVXUKRQ-MRXNPFEDSA-N 440.540 4.021 10 10 IICE CC(C)N(C)c1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1584975902 GJPSSKXVJKHWEO-UHFFFAOYSA-N 445.566 4.351 10 10 IICE CCOC(=O)[C@@]1(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CCCOC1 1586247855 DPLONUZLJJXKTL-RUZDIDTESA-N 426.557 4.307 10 10 IICE COCCn1ncc2ccc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)cc21 1597763138 RMPUXLOHMMHSPG-UHFFFAOYSA-N 430.508 4.463 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(N(C)C)ncnc32)c(C)n1-c1cc(Cl)cc(Cl)c1 1613527356 HLYYYFGBBLPIQI-UHFFFAOYSA-N 443.338 4.490 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1616602592 MXYNQZJOVWLMHJ-IAGOWNOFSA-N 437.635 4.164 10 10 IICE COCCCN(C)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=CCC1 1619834506 JZGDIRMTEVWHGF-UHFFFAOYSA-N 448.615 4.087 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@H]2CCCC[C@H]2O)sc(C)c1-c1ccccc1 1620476925 DMJUZMPSZGOXFV-QZTJIDSGSA-N 430.570 4.074 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(F)c(Br)cc1N 1622328428 YHNLXKLPAHUTOY-UHFFFAOYSA-N 446.114 4.301 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2cccc(F)c2Br)N(C)C)cc1 1627464613 PAZLASPUOHWODO-LJQANCHMSA-N 436.369 4.006 10 10 IICE C/C=C\C[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C(=O)OCC 1633749482 NZZXSLAKUVEKNK-WPGJWXSHSA-N 433.346 4.484 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccccn3)C2)c(C)n1-c1ccc(Br)cc1 1636530583 HFNGTSSCPLEKCF-SFHVURJKSA-N 439.357 4.260 10 10 IICE CC(=O)Nc1cccc2c1CN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)CC2 1637410476 NGKMBPADQRQZSW-UHFFFAOYSA-N 430.552 4.363 10 10 IICE CSCC[C@H](NC(=O)c1ccccc1)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1642459557 PGWAGZVEGBVFTJ-QHCPKHFHSA-N 435.593 4.262 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)ccc1N(C)C 1652165320 QKKXIMWIBOBCSW-QFIPXVFZSA-N 442.512 4.024 10 10 IICE COc1cc(N2CCC[C@H]([C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1655512817 YVEGKZPWBBOWOQ-IRXDYDNUSA-N 449.548 4.476 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NC(=O)NCc3c(O)ccc4c3CCCC4)C[C@H]2C1 1673507664 CTWRNXUEHDBFKV-GBESFXJTSA-N 443.588 4.106 10 10 IICE COc1cc(CCNC(=O)N2Cc3cccc(O)c3C2)cc(OC)c1OCc1ccccc1 1674718028 GDFXWOVVNBQMEK-UHFFFAOYSA-N 448.519 4.256 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C(=O)OCC(C)C)CC3)c2C)c1 1675108001 JDOHYRRFFWXSPM-UHFFFAOYSA-N 426.561 4.022 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC[C@@H]1CC 1696322684 VTVSSYCDGXXOIT-SFTDATJTSA-N 441.620 4.366 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@]3(CCO[C@H]3C)C2)n1Cc1ccc(N(CC)CC)cc1 1708562714 QSOQMSQCWZZDNJ-ZYLNGJIFSA-N 441.620 4.070 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Nc2ccn(C)n2)nnc1[C@@H]1CCO[C@H]1C(C)(C)C 1742142075 RQXIUQHWNWIFND-TZIWHRDSSA-N 437.592 4.097 10 10 IICE CCOCc1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1747086906 WOOIAOSABHKHJN-FQEVSTJZSA-N 443.661 4.289 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(N)=O)C1 1750538217 WVYDCYYOFGGLHU-OAQYLSRUSA-N 446.599 4.411 10 10 IICE C[C@@H]1CCCC[C@@H]1NC(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860344976 LLYPJCPFUNCICU-UTKZUKDTSA-N 440.547 4.269 10 10 IICE Cc1nnc([C@H](CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c2ccccc2)o1 1868182136 VAOQLHWLAXIYHN-HXUWFJFHSA-N 437.455 4.314 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@]21CNCc1cc(Br)ccc1O 2089360471 XPTPOBMWCWDEEY-YWZLYKJASA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2c(O)cccc2Br)CC12CC2 2115368292 PZRDKCVWBRQYFQ-CQSZACIVSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CNC[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)c1O 2236053533 WJZYURPZHKNGMZ-ZIAGYGMSSA-N 443.382 4.146 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2ccc(OCc3ccccc3F)c(Br)c2)S1 2293218331 GXGFYEVWPUYUHD-UHFFFAOYSA-N 449.301 4.274 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccccc3C)C2=O)ccc1OCc1ccccc1 2313549244 QSAOGHVPMLQDOS-UHFFFAOYSA-N 442.471 4.249 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](C(=O)OC)c3ccccc3)C2=O)ccc1OC 2314767006 CLTFUXCCOOTLHA-IBGZPJMESA-N 443.546 4.209 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380753055 BOSWBKJTMGMKQU-HIFRSBDPSA-N 441.366 4.163 10 10 IICE Cn1c(SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc2ccccc21 8808336 HLGCVELWWQUDNR-UHFFFAOYSA-N 427.485 4.080 10 10 IICE COc1ccccc1-n1c(C)cc(/C=C2/C(=O)N(Cc3ccco3)C(=S)N=C2O)c1C 33457474 NKSIEJUPJAQTQY-LDADJPATSA-N 435.505 4.363 10 10 IICE CCCN1C(=O)/C(=C/c2csc(N(C(C)=O)c3ccc(OC)cc3)n2)SC1=S 98002422 FGEPMQSEKKQGIZ-YBEGLDIGSA-N 433.580 4.448 10 10 IICE Cc1ccc(-c2ccc(/C=C3\SC(Nc4ccccc4C(N)=O)=NC3=O)o2)c([N+](=O)[O-])c1 208335351 CJTDQLUMIMTFOA-ODLFYWEKSA-N 448.460 4.345 10 10 IICE CCc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C2\SC(=S)N(C)C2=O)cc1 213179651 YNLRYIKSYUDUBQ-ATVHPVEESA-N 437.546 4.189 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)Cc2nc(-c3cccs3)no2)C1 557062836 RRJIAZSWTHDWLX-UHFFFAOYSA-N 449.580 4.178 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccnc(Cl)c2F)c(C)n1-c1ccc2c(c1)OCO2 766934970 QLWRVISWZJVYCE-UHFFFAOYSA-N 430.819 4.050 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](O)c2c(F)cccc2Cl)C1 768045695 QPDYNGORNUHINT-JOCHJYFZSA-N 443.950 4.050 10 10 IICE CC(C)(C)OC(=O)N1CCC(SCC(=O)NCc2ccc(N3CCCCC3)cc2)CC1 777783542 CVNOZXLWLNRNPX-UHFFFAOYSA-N 447.645 4.426 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(n3ccc(C(F)(F)F)n3)CC2)c1O 778578822 VRFLLDKGORGYLQ-UHFFFAOYSA-N 433.430 4.384 10 10 IICE CCOC(=O)c1sc([C@@H](C)NC(=O)NCc2cc(Cl)cc(Cl)c2O)nc1C 805198793 SFEZAUBPIXNHNO-SECBINFHSA-N 432.329 4.201 10 10 IICE CCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(F)(F)Oc1ccccc1 812035470 IUYGJJDBCMMNQE-UHFFFAOYSA-N 443.498 4.152 10 10 IICE CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 813683847 FOYNDPLSZIRJFB-IBGZPJMESA-N 435.351 4.315 10 10 IICE Cc1nc(COC(C)(C)C)oc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 857457045 INAVBOJFNHGVJE-OAHLLOKOSA-N 437.487 4.298 10 10 IICE COC[C@@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(F)cc1 1122007715 HGKFYJHPZGURJE-YLJYHZDGSA-N 437.462 4.083 10 10 IICE CC[C@@H](CSC)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1127579542 QNZFHRHOUWLXMR-CNYBTUBUSA-N 426.604 4.017 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@H](C)c3ccc(Cl)c(Cl)c3)CC2)cc1 1136453876 AEYZYYUHPXTFAH-MRXNPFEDSA-N 436.383 4.044 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1c2ccccc2C[C@H]1C 1136743197 LELVSZKTQSREBR-FOVJLYNBSA-N 433.596 4.461 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)c1C 1137978914 RTDHROFKSCLHFC-OAQYLSRUSA-N 445.563 4.499 10 10 IICE Cc1ccc([C@H](CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)N2CCCC2)o1 1143106267 JJGBILYHKQCWKL-DEOSSOPVSA-N 433.552 4.304 10 10 IICE CCC(CC)[C@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1147517092 CLFKBXFUMRZXIC-VJHGBBPISA-N 449.595 4.194 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(OC)nc2ccccc12 1156287313 LXHSQOULPFEQJI-UHFFFAOYSA-N 435.524 4.246 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccsc4)C3=O)c2C)cc1C 1165615736 STWVUPYWEYWHBD-XMMPIXPASA-N 435.549 4.422 10 10 IICE CN1CCC(CNC(=O)N(Cc2ccco2)Cc2ccccc2O)(c2ccccc2)CC1 1235561318 LVOPQLKDOKUDNU-UHFFFAOYSA-N 433.552 4.361 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](Oc4ccncc4)C3)cc2Cl)C1 1235834896 RYYLGQDLUOJUEN-YLJYHZDGSA-N 428.964 4.334 10 10 IICE COc1cc(C)ccc1CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1265960011 SUBRCFCGEDBMHP-XDHOZWIPSA-N 444.553 4.050 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1293653653 PNFZAWWONDJLKY-NHCUHLMSSA-N 429.634 4.356 10 10 IICE Cc1cc(CC(=O)N(C[C@@H](O)CC(C)(C)C)C2CCN(C)CC2)c(C)n1-c1ccccc1 1297761777 CERNWVMHCSGADP-VWLOTQADSA-N 439.644 4.357 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCC(=O)c2cncc(Br)c2)c1C 1302349458 NWTNWYKYVHNNIH-UHFFFAOYSA-N 426.314 4.173 10 10 IICE C[C@H]1[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1350627953 DPWICQYLFDLOOO-GOEBONIOSA-N 434.492 4.046 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)c3ccccc3[S@@](=O)C(F)(F)F)ccc21 1350629344 WODMUMVLUZWQNX-WJOKGBTCSA-N 443.402 4.342 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(=O)c(OC)co2)sc(C)c1-c1ccc(C)cc1 1350799072 NZMLJSNSCKCQKX-UHFFFAOYSA-N 427.478 4.423 10 10 IICE COc1ccc(F)cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1356409020 HCCTYWGFQUUJCG-LICLKQGHSA-N 434.489 4.203 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cncc(-c4ccc(C)cc4)c3)cc2F)CC1 1360091083 DGUMNBIBLICGKY-UHFFFAOYSA-N 432.543 4.268 10 10 IICE Cc1cc(Cn2c(N(C)Cc3ccccc3O)nnc2[C@]2(OC(C)C)CCOC2)cs1 1361083428 DDYKCOODLRAZFM-QHCPKHFHSA-N 442.585 4.079 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1OC(F)(F)F 1435572723 MBZUKAOPAWOYEB-UHFFFAOYSA-N 433.474 4.047 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(CNC(=O)C(C)(C)C)ccc2Cl)cc1 1437383214 SSYIDQVQYQYJAS-UHFFFAOYSA-N 445.991 4.219 10 10 IICE CCN(CC)CC1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1442664920 PBGGWVBNNZRTKO-UHFFFAOYSA-N 447.421 4.446 10 10 IICE Cc1cc(CC(=O)NCC2CCN(C3CCOCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1453174389 VVMQSEWQHXLIEN-UHFFFAOYSA-N 444.019 4.297 10 10 IICE Cc1ccc(Cc2sc(NC(=O)CN3CCOc4cc(N(C)C)ccc43)nc2C)cc1 1459874827 JKPJJELQNASTRH-UHFFFAOYSA-N 436.581 4.254 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C(F)F)c(C)n1-c1ccccc1 1460677548 ZTIJQUOFGPRSGN-HXUWFJFHSA-N 447.526 4.350 10 10 IICE CC(=O)c1ccc(Nc2ccccc2C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 1464449361 GOTFSPXTCAMLGQ-UHFFFAOYSA-N 429.520 4.399 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](OCCN3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1465871597 YKLOHPLNVZVLHS-QHCPKHFHSA-N 429.992 4.003 10 10 IICE O=C(c1cc(F)c(Br)cc1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 1466290257 USMMDMBSHUREBH-ZDUSSCGKSA-N 426.257 4.254 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@H](CNCc3cc(Cl)cc(Br)c3O)[C@H]2C1 1474260359 UFPFZCRTHPQHTK-ZSOGYDGISA-N 431.758 4.011 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2CC2CC2)c(C)n1-c1ccccc1 1510608655 ZJOAJAXJOYTSTL-UHFFFAOYSA-N 434.588 4.114 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cc(COC(C)(C)C)on1 1511776847 RQBMVQMDVGJPOD-UHFFFAOYSA-N 438.576 4.175 10 10 IICE CCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1514840357 RDVGZKRZLYOQLH-FGZHOGPDSA-N 441.620 4.080 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2[C@@H]3CCCC[C@H]3CCN2C(=O)OC(C)(C)C)cc1F 1527013376 AYCVFBZWNHRALP-UEXGIBASSA-N 433.568 4.324 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1530817337 ASVHUCJZQFYACS-JOCHJYFZSA-N 434.458 4.146 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1n[nH]c2ccc(Cl)cc12 1534129758 MHGJCIHRRSWHNO-UHFFFAOYSA-N 438.837 4.002 10 10 IICE CC[C@H](Oc1ccccc1C(C)C)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1534278034 LEQNHGVZPVGEFM-QFIPXVFZSA-N 426.557 4.333 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(OC)cc3OCCC(C)C)C2)cc1 1537109267 LQRKOFUWVODULN-IBGZPJMESA-N 426.557 4.385 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(F)cc(Br)c1F 1544410102 WSFLESIXSJWGJE-UHFFFAOYSA-N 427.314 4.211 10 10 IICE Cc1cc(CC(=O)N[C@H](CO)c2ccc(Br)cc2)c(C)n1-c1ccccc1 1556823815 KLVRAKFLHQQUFT-OAQYLSRUSA-N 427.342 4.249 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](C)C[C@H](C)NC(=O)OC(C)(C)C)CCCC1 1557180286 BRLVUFHILGJQJF-SJORKVTESA-N 443.588 4.337 10 10 IICE Cc1occc1-c1nnc(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)n1C 1559334249 ARRVBCCXSFWFBS-UHFFFAOYSA-N 425.489 4.300 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)[C@@H](C)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1564800803 BXKCFHGOOJFDSQ-MSOLQXFVSA-N 444.576 4.359 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CSC[C@H]3C(=O)NCCC(C)C)c2C)c1 1585061306 VAOXDDXNRGTALO-QFIPXVFZSA-N 427.614 4.388 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@@H]2[C@@H]2CCCCC2=O)c(C)n1-c1ccc(Cl)cc1 1597142200 QSYDJILKTAUECO-FCHUYYIVSA-N 428.960 4.277 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOc1cc(Cl)cc(Cl)c1 1597566883 CWWCTPDYWQCVLI-UHFFFAOYSA-N 446.714 4.323 10 10 IICE CCC1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)C[C@@H](C)C(=O)NC)CC1 1613737070 AKBJVDRZMIOJAP-GOSISDBHSA-N 448.615 4.361 10 10 IICE COC1CCN(c2ccc(CN3CCC(S(=O)(=O)c4ccc(C)cc4)CC3)cc2)CC1 1620555203 WVTIJXKCQDURKH-UHFFFAOYSA-N 442.625 4.049 10 10 IICE Cc1cc(CC(=O)NCCNC(=O)c2ccc(Cl)cc2)c(C)n1-c1ccc(Cl)cc1 1624015865 JLPHNZPIHFBAGG-UHFFFAOYSA-N 444.362 4.490 10 10 IICE Cc1cc(C(=O)Nc2n[nH]c3cc(O)ccc23)c(C)n1-c1ccc(Br)cn1 1624740598 UJQYLVFIBXKTIM-UHFFFAOYSA-N 426.274 4.086 10 10 IICE Cc1cc(C(=O)NC[C@](C)(O)c2ccccc2)c(C)n1-c1cccc(Br)c1 1628198953 TUIDFFQDSRUXAX-QFIPXVFZSA-N 427.342 4.494 10 10 IICE COC(=O)CCN(C[C@@H]1CCCO1)C(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1629327491 NOBLLRDGEKQDSE-QFIPXVFZSA-N 426.557 4.402 10 10 IICE C[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@H]1CCNC(=O)OC(C)(C)C 1632029247 NPSOXDNFEHJWOK-ZFWWWQNUSA-N 434.558 4.468 10 10 IICE C[C@@H](CCNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1634128104 OLCGTGNZGKJWNV-HNNXBMFYSA-N 430.551 4.178 10 10 IICE CCOC(=O)c1c[nH]nc1[C@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1634178586 WHKDCCRBOANWFB-INIZCTEOSA-N 440.931 4.277 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc(Cl)ccc3Br)C2)cc1 1636424427 SROHIBATACKZMD-OAHLLOKOSA-N 438.753 4.189 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 1639966157 WMIGWLJDYRKYPM-INIZCTEOSA-N 427.715 4.273 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCC[C@H](NC(=O)C(F)(F)F)[C@@H]3C)c2C)c1 1640263804 VBPUVKAZVGQXGC-PXNSSMCTSA-N 435.490 4.383 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(F)cc(Br)cc3[nH]2)cc1 1644437466 DFHHHQWZGGKWKD-UHFFFAOYSA-N 434.309 4.287 10 10 IICE Cc1cc(C(=O)CS(=O)(=O)c2cccc(C(F)(F)F)c2)c(C)n1-c1ccc(F)cn1 1651927313 AGMQBVUYDLONDC-UHFFFAOYSA-N 440.418 4.304 10 10 IICE O=C(CN1CCC(CC(F)(F)F)CC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1658608771 ZOBHEBYIGWEUEI-UHFFFAOYSA-N 430.426 4.065 10 10 IICE COc1cc(N2CCN(C(=O)NCC[C@@H]3C[C@H](C)CC(C)(C)C3)CC2)cc(OC)c1OC 1681970763 QDEAYDVLSIDQMI-RBUKOAKNSA-N 447.620 4.397 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C 1683252995 CHRBJQIWEOCXAY-BJLQDIEVSA-N 432.609 4.079 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 1685676242 XHBMRBKKVQFNFV-SFHVURJKSA-N 445.604 4.498 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1726833896 SLBMAGONLZKPLT-CLOONOSVSA-N 441.620 4.068 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@H](C(F)(F)F)C2)cc1F 1729328610 MXSATNJNPIKJHP-INIZCTEOSA-N 448.468 4.372 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)CC1CC(F)(F)C1 1742142110 SGGINYLQAIZPDO-FQEVSTJZSA-N 433.547 4.424 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)C(C)C 1769683908 JWRXLDUQBBMJHE-RUZDIDTESA-N 439.604 4.232 10 10 IICE CCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1-c1ccc(F)cc1F 1862338711 FRMZWQQTWHRVET-UHFFFAOYSA-N 440.494 4.209 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)C1(C)C 2127901022 YBFADBIKEYDNNL-SWLSCSKDSA-N 431.346 4.323 10 10 IICE Oc1cccc(Br)c1CN[C@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156287995 KDXZOCILBSBFOD-XMSQKQJNSA-N 431.374 4.068 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1ccc(Br)cc1I 2225793211 UIXRDEUJRPEICS-GHMZBOCLSA-N 435.063 4.015 10 10 IICE Cc1c(N2C(=O)C(=Cc3ccc(F)cc3)SC2=S)c(=O)n(-c2ccccc2)n1C 2296663403 KPTBMWMHJAXFIB-UHFFFAOYSA-N 425.510 4.029 10 10 IICE CCOc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)c2C)cc1 2313557723 KLXZVWSEUJRWRO-UHFFFAOYSA-N 447.466 4.298 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H](C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2381128779 ZPQJRLSFPHFNQD-ZDUSSCGKSA-N 443.382 4.363 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc(Br)ccc1O)N2 14460955 GVDHMLUQYWVWLX-BXTJHSDWSA-N 449.370 4.232 10 10 IICE O=C(O)CN1/C(=C/C=C2/SC(=S)N(c3ccccc3)C2=O)Sc2ccccc21 33313288 OUZFXLQMYQTECB-VUTUTYQISA-N 426.544 4.474 10 10 IICE CCC1=NN2C(=N)/C(=C\c3ccc(OCCOc4cccc(C)c4)cc3)C(=O)N=C2S1 33684139 WXOPVHVPRGMKMX-VKXGLNTFSA-N 434.521 4.482 10 10 IICE CC[C@@H](C)N1C(=O)/C(=C\c2cc3cccc(C)c3nc2N2CCOCC2)SC1=S 208278632 QQFLWQGGWUVRCM-COYFKBPASA-N 427.595 4.380 10 10 IICE CC[C@H](NCC[C@H]1CN(Cc2ccccc2)CCO1)c1cc(Br)ccc1O 312364342 YZMXFGVAKPZJJZ-FPOVZHCZSA-N 433.390 4.487 10 10 IICE Oc1cc2c(cc1CNc1cc(I)ccc1Br)OCO2 312680955 ZMDRTQBKKABPGT-UHFFFAOYSA-N 448.054 4.100 10 10 IICE CCCN(C[C@H]1CCCCO1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 730119605 XAUKRQBBRSNANF-LJQANCHMSA-N 443.510 4.033 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3coc(-c4ccc(F)cc4)n3)cc2F)C[C@H](C)O1 733216840 AOMYCULHFBPARZ-HOTGVXAUSA-N 441.478 4.092 10 10 IICE CO[C@H](C)c1noc(CN(C)C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 747933661 RUZGOEXCOXMFNB-CQSZACIVSA-N 447.333 4.219 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c(C)o1 754694914 ROUTYFDBZDTOER-UHFFFAOYSA-N 446.428 4.025 10 10 IICE Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1N1CCOC1=O 766768080 HKANKGAXDPDSQU-UHFFFAOYSA-N 446.551 4.312 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O 1139123188 DXIXAZFCBUVIPR-IBGZPJMESA-N 445.357 4.337 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 1141737929 NWXLORYSCLVPNA-UHFFFAOYSA-N 435.267 4.090 10 10 IICE CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1142782644 MRTXMZVZPZYUNO-MOPGFXCFSA-N 439.600 4.072 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CCC(F)(F)CC1 1144101036 MDCZANVXFRDPKU-LBPRGKRZSA-N 444.525 4.198 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OC4CCCC4)nc3)cc2F)C[C@H](C)O1 1264689018 GXHIAIQFUWUTTQ-IRXDYDNUSA-N 427.520 4.086 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc([C@]4(C)NC(=O)NC4=O)c3)c2C)c1 1290915276 ZRQLVZBTLXWFOL-VWLOTQADSA-N 430.508 4.018 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCN1Cc1ccc(F)cc1 1294162207 ZLJBIFRDVOFQDH-SIKLNZKXSA-N 447.501 4.177 10 10 IICE CCCOC[C@H](Cc1cccc(Br)c1)NC(=O)c1ccc(N=NC(N)=O)cc1 1296662114 GVNFGWFUYPARGV-SFHVURJKSA-N 447.333 4.379 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccncc1 1296816586 WQUVKSPPATVFDY-QHCPKHFHSA-N 425.916 4.351 10 10 IICE COC[C@@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1301276048 AQGCUKKDCISKHC-HXUWFJFHSA-N 429.584 4.127 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@]1(C)OCCc2sccc21 1302847280 HGJHFDDQMZTICE-QHCPKHFHSA-N 426.586 4.368 10 10 IICE COc1ccc(C[C@](C)(CO)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1OC 1303361254 JSSSOQPDRGFFKQ-AREMUKBSSA-N 436.552 4.143 10 10 IICE Cc1cc(C(=O)Nc2cnc(CC3CC3)nc2)c(C)n1-c1ccc(Br)cn1 1449417199 YJGXCUACHSHRAP-UHFFFAOYSA-N 426.318 4.246 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H](COC)C2)sc(C)c1-c1ccccc1 1459479499 KJDWFNRTYFXYAR-KRWDZBQOSA-N 430.570 4.197 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(NC4CCOCC4)CC3)cc2Cl)C1 1478528657 RIGRVGQMDXAHBR-SFHVURJKSA-N 449.039 4.019 10 10 IICE COCc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1525539503 IQILSPIDLJCVBB-PDGQHHTCSA-N 430.526 4.202 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(S(C)(=O)=O)c(Cl)cc2Cl)cc1 1527397029 XQBDWSQVLCGPKK-UHFFFAOYSA-N 429.369 4.173 10 10 IICE C[C@H](NC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(N(C)C)cc1 1537679634 LXCVKXOJZRUXEQ-IBNJYYFUSA-N 434.367 4.456 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(c3ccc(Br)cc3)CCC2)N(C)C)cc1 1539236059 OMFIINDSLGRYEQ-OAQYLSRUSA-N 444.417 4.356 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H](c1ccccc1)c1ncc[nH]1 1556426205 BCGJNHOQJSBNRZ-QFIPXVFZSA-N 448.567 4.320 10 10 IICE Cc1cc(C(=O)N(CCN2CCOCC2)[C@@H]2CCSC2)c(C)n1-c1ccc(Cl)cc1 1556834664 PWSGCRGJRIQCKP-OAQYLSRUSA-N 448.032 4.027 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(O)CCc4ccccc43)cc2Cl)C1 1564650256 UUMRDNMIDZXSGN-OSPHWJPCSA-N 427.976 4.210 10 10 IICE CC[C@H](C)c1nnc(N2CCOC[C@H](C3CCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1613355457 NOCJUTGNNOUBEK-FXAWDEMLSA-N 429.584 4.298 10 10 IICE CCc1nnc(N2CCC[C@@H](C[C@@H]3CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613996500 GJCVMZPSSYNMIT-VXKWHMMOSA-N 425.621 4.378 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@H](C)SC)CC2)cc1 1619301290 DVNGLOJMFAERRO-GOSISDBHSA-N 431.650 4.344 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Cl)ccc1-n1cncn1 1622328232 QWVMICAJXLQJLP-UHFFFAOYSA-N 435.709 4.051 10 10 IICE Cc1cc(C(=O)N2C[C@]3(C)CN(C)C[C@]3(C)C2)c(C)n1-c1cccc(Br)c1 1630892101 CANTWQYJRIJTOG-SZPZYZBQSA-N 430.390 4.270 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1scc(C)c1I 1631265846 PEZFTDQNRPDWMJ-UHFFFAOYSA-N 428.339 4.389 10 10 IICE Cc1ccc(C(=O)N(C[C@@H]2CCCO2)[C@@H]2CCSC2)cc1-n1c(C)cc(C=O)c1C 1632984479 JWSSBTHBAMSVHT-YADHBBJMSA-N 426.582 4.342 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccnn2C)C(C)C)c(C)n1-c1ccc(Br)cn1 1634111333 OBTPUYHFQWJXJF-SFHVURJKSA-N 444.377 4.155 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](C(=O)NCc3ccccc3)C2)c(C)n1-c1ccc(Cl)cc1 1638811442 XPQHZOFDNRSBNE-OAQYLSRUSA-N 449.982 4.455 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CSc2nccn2C(C)(C)C)cc1 1640367584 GXGSITJIPBVPNL-UHFFFAOYSA-N 428.524 4.387 10 10 IICE Cc1cc(C(=O)NCCCNC2CCCCC2)c(C)n1-c1ccc(Br)cn1 1641309916 VZKLPSNKCXZWLE-UHFFFAOYSA-N 433.394 4.294 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3cc(OC)ccc3[N+](=O)[O-])c2C)cc1 1644033382 MFWYAIRQMISBJN-UHFFFAOYSA-N 438.436 4.059 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H]3CN(C)CCN3Cc3ccccc3)c2C)c1 1647781794 SONQYZJJWZHSRV-SANMLTNESA-N 444.623 4.257 10 10 IICE CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)N[C@@H](C)c3ccccc3O)c2)cc1 1648891728 FPXHBZFZLLOJMD-INIZCTEOSA-N 440.521 4.083 10 10 IICE C[C@H](Nc1ccc(C(=O)NCc2cccc(Cl)c2O)cc1[N+](=O)[O-])c1ccccn1 1653564012 WUMCJGPBEZJJLE-ZDUSSCGKSA-N 426.860 4.452 10 10 IICE Cc1ccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1680563105 PBOGSWBFGODMSY-NQIIRXRSSA-N 429.992 4.288 10 10 IICE C[C@@H]1CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCc2ccc(Cl)cc21 1683195925 SRDOEORSPZPQFJ-OAHLLOKOSA-N 449.929 4.326 10 10 IICE Cc1ccc(CN2CCO[C@@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1684483637 WFAZWXKULYAIGF-SANMLTNESA-N 446.595 4.103 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cccc(NC(=O)OC(C)(C)C)c3)C2)cc1 1687023837 WMZKCYITDQRICF-LJQANCHMSA-N 440.544 4.120 10 10 IICE CCC1(CC)CN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)CCS1 1708872884 OZTAXMZQHWHLNL-FQEVSTJZSA-N 443.661 4.317 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@H](C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1724199793 WCLHNRZZWRTRJL-LJQANCHMSA-N 437.588 4.129 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@@H](C)N(CC)C[C@H]2C)cc1 1728379086 GFOFJFRSXBMRAX-NHCUHLMSSA-N 449.647 4.097 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@H](C)C1 1729229656 CWEFWIWMAGXCMX-OJXHOQKUSA-N 439.629 4.213 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1Cc1ccsc1 1729405270 VIYBUFWYNNPXBU-UHFFFAOYSA-N 439.629 4.450 10 10 IICE CC(C)c1nnc(N2CCC(Cl)=C(Cl)C2)n1Cc1ccc(N2CCOCC2)cc1 1741352554 XGCGFNZUHCMASR-UHFFFAOYSA-N 436.387 4.186 10 10 IICE CCN(c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1)C1CCCC1 1745982285 DYPVUMJBFVUCSN-UHFFFAOYSA-N 429.584 4.270 10 10 IICE CCc1ccc(-c2nnc(N3CCOC[C@H]3C)n2CCCSc2nccs2)cc1 1762607274 RKINSBIVQICYOT-MRXNPFEDSA-N 429.615 4.372 10 10 IICE Fc1ccc(OCc2nnc(N3CC=CCC3)n2CCCSc2nccs2)cc1 1770719238 BMRBYGZELRMVTH-UHFFFAOYSA-N 431.562 4.401 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@H](C)C1 1770784254 LODFVCXFWTXQPX-MBOZVWFJSA-N 425.552 4.429 10 10 IICE CC(C)Oc1cccc(/C=C2/SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 1858591799 ALQCDHMXHXMVNB-LSCADSNKSA-N 443.546 4.077 10 10 IICE Cc1ccc([N+](=O)[O-])cc1NC(=O)c1c2c(n3ccccc13)C(=O)c1ccccc1C2=O 1873933116 ZZFSOMZPCRGROV-UHFFFAOYSA-N 425.400 4.184 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](NCc1cc(Br)ccc1O)C2 1878848355 GPUMEUHDJGZBDH-QBYUYEEZSA-N 429.330 4.123 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@@H](NCc1ccc(Br)cc1O)C2 2226145298 VSJKWBNERXJKBY-QRTARXTBSA-N 425.367 4.280 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3C)C2=O)ccc1OCCC(=O)O 2314933418 VWKGRVPRYMCGIN-UHFFFAOYSA-N 429.519 4.263 10 10 IICE CSc1ccc(C=C2SC(=S)N(c3ccc4c(c3)OCC(=O)N4C)C2=O)cc1 2321736747 WZIKEOIIVDCCHP-UHFFFAOYSA-N 428.560 4.170 10 10 IICE COc1ccc2c(c1)C(=CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1)CC2 2326006535 XUGXGEVOXGVHFU-SANMLTNESA-N 433.596 4.434 10 10 IICE Cc1cc(I)ccc1N=NN1CCN(C(=O)OC(C)(C)C)CC1 2330234552 SVYKCRPRMOZTOJ-UHFFFAOYSA-N 430.290 4.151 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)OC(C)(C)C)c(O)c1Br 2352947366 HVJYGLWSTYQGHD-XHSDSOJGSA-N 425.367 4.341 10 10 IICE CC[C@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCN(C(=O)OC(C)(C)C)C1 2380747460 UMRMJMNJCRQOJH-FQEVSTJZSA-N 441.366 4.117 10 10 IICE CCCCc1cc([N+](=O)[O-])c2c(c1O)C(=O)c1c([N+](=O)[O-])cc(CCCC)c(O)c1C2=O 13943872 NIOSYKFSAMNQNE-UHFFFAOYSA-N 442.424 4.375 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1ccc(Cl)cc1 20236159 RPQRHHXPDZRNHJ-MEOLDJOHSA-N 437.839 4.018 10 10 IICE CC(C)(C)OC(=O)NCC(F)(F)CNCc1cc(Cl)cc(Br)c1O 708073981 XYOSZQANCGGENN-UHFFFAOYSA-N 429.689 4.058 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](CNCc2ccc(Br)cc2O)C1 717068758 SBBJBZASGOKTKI-CYBMUJFWSA-N 435.309 4.137 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)c3ccc(-c4cccnc4)cc3)CC2)cc1F 753939022 FZUAOQKQUWCDAE-SFHVURJKSA-N 434.515 4.489 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCc1ncc(C2CC2)o1 760484906 GZTSMYMPNIRXIW-DHDCSXOGSA-N 434.564 4.338 10 10 IICE COC(=O)c1ccc([C@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)C(F)(F)F)cc1 775214424 GQBSNJVPQOJISC-IBGZPJMESA-N 431.414 4.309 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1ccccc1C(=O)OC(C)(C)C 783315255 BGDGVTLKIPQQRT-UHFFFAOYSA-N 439.556 4.084 10 10 IICE Cc1nc(COc2ccccc2C(=O)NCc2cc(Br)ccc2O)cs1 804733826 NTHATNHXQQQDAV-UHFFFAOYSA-N 433.327 4.429 10 10 IICE CCCNC(=O)[C@H](C(C)C)N1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1081156940 XUGHMYKZIYLHOF-IPJDOKCGSA-N 441.416 4.201 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc3c(c2)nc(O)n3CC2CC2)cc1 1125893714 URNPZUYYTTWUQH-UHFFFAOYSA-N 446.473 4.423 10 10 IICE COc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc(O)cs3)ccc2Cl)cc1 1135873406 LKGNJKRWEVNZFD-UHFFFAOYSA-N 438.914 4.169 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(Cn2cc(Br)cn2)cc1 1135914285 AVOVNKIKSOULCA-UHFFFAOYSA-N 427.346 4.032 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 1136025213 AMYWBJFLACNRBJ-FQEVSTJZSA-N 429.973 4.402 10 10 IICE Cc1cc(C(=O)N[C@H](C)CCC(=O)OC(C)C)c(C)n1-c1ccc(Br)cn1 1139819542 UAWNOVIJJYFISB-CYBMUJFWSA-N 436.350 4.102 10 10 IICE CCCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H]1CCCC[C@H]1OC 1170290193 GKIQGSOWVUIYIF-DNQXCXABSA-N 448.563 4.460 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C/c1ccc(C)nc1)CCC2 1264933067 GNEMLKCTKMQUJW-ZHACJKMWSA-N 432.476 4.341 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3nnn(-c4ccccc4)c3C(F)F)cc2)CC1 1293144822 KFEMHNQKBFYOHY-UHFFFAOYSA-N 425.483 4.371 10 10 IICE CN(CC1COC(C)(C)OC1)c1nnc(C2CCC2)n1CCCSc1nccs1 1298587542 IQZHPONZIDWVNG-UHFFFAOYSA-N 437.635 4.020 10 10 IICE CN(CC1CCOCC1)c1nnc(Cc2ccsc2)n1CCCSc1nccs1 1314818413 LPUXJCHFIJMLDT-UHFFFAOYSA-N 449.671 4.432 10 10 IICE Cc1ccc2nc(COC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)cc(=O)n2c1 1349916083 FIGJCGNUJDHXFQ-UHFFFAOYSA-N 435.911 4.350 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 1352893339 ZCMZKAFFIWCLNY-WOJBJXKFSA-N 431.439 4.085 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cn(-c3cccc(Cl)c3)nn2)cc1 1358432498 CWBUZYANAIZZJF-UHFFFAOYSA-N 435.915 4.422 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4ccccc4)nc3C)cc2F)CC1 1360091541 WJXVCSUDMGCCEW-UHFFFAOYSA-N 432.543 4.268 10 10 IICE CC[C@@H](CC(F)(F)F)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1435818644 LIOWHHPBGHMKAQ-FYQHACEVSA-N 434.480 4.264 10 10 IICE CCCN(C)C[C@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1444896530 KIVCLTOTIFTATI-QGZVFWFLSA-N 433.394 4.056 10 10 IICE Cc1cc(C(=O)N(CCO)C2CCSCC2)c(C)n1-c1ccc(Br)cc1 1448719705 IRGTUVAEQLEBTJ-UHFFFAOYSA-N 437.403 4.187 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H]2CCCN(Cc3ncon3)C2)cc1 1449359669 UBEXXKLUYXDKQS-GOSISDBHSA-N 447.543 4.193 10 10 IICE CCOC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)N2C(=O)c1ccc(-n2c(C)ccc2C)cc1 1457185969 KMPBGMFSXNAXPY-QGZVFWFLSA-N 431.492 4.258 10 10 IICE CCCCN(CC)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1500438090 CVHPXIVBMGDMPB-NRFANRHFSA-N 443.661 4.400 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2c(F)cccc21 1514722602 VUEQUHFJMSKIIT-PDGQHHTCSA-N 430.501 4.145 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)C[C@H]2CCCOC2)cc1 1515530507 CJMMRGDCEQZPNY-FYYLOGMGSA-N 441.620 4.277 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1516370783 BVDQKTIRJZGWAP-GOTSBHOMSA-N 448.615 4.403 10 10 IICE CC(C)c1c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cnn1-c1ccccc1 1527864295 MWVTVULXYJWSCP-UHFFFAOYSA-N 440.494 4.041 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2 1540464641 MGFAJCGUSREEKD-UHFFFAOYSA-N 425.485 4.019 10 10 IICE Cc1cnc([C@H](C)Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)s1 1542836322 OMHDUUWPEZOGSR-MRXNPFEDSA-N 434.569 4.175 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](c3ccc(C)cc3)N3CCOCC3)c2C)cc1 1544878998 ZNGDOGGLRRQQAS-SANMLTNESA-N 447.579 4.214 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)cc1 1557274528 FRTBIISAWUJPOE-UHFFFAOYSA-N 447.417 4.256 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC(Cc2ccoc2)C1 1558704757 BZRQAKUVOJJKSX-LICLKQGHSA-N 432.592 4.024 10 10 IICE Cc1ccccc1C[C@@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1567632358 KHIFHMUPHSQPMR-FQEVSTJZSA-N 441.369 4.498 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@]3(N(C)C)COc4ccccc4C3)cc2Cl)C1 1568142216 PKSHAXZWXKTXKB-BVZFJXPGSA-N 442.003 4.128 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(F)c(NC(=O)OC(C)(C)C)c3)C2)cc1 1584231064 WWBFQEZWFQHLLM-INIZCTEOSA-N 429.492 4.190 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)NCCC(C)C)c(C)n1-c1ccc(Cl)cc1 1585060988 IPBKMLWCBJVGNF-HXUWFJFHSA-N 434.005 4.425 10 10 IICE CCOc1cccc(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1587314634 RSRIOMDIYBORFY-PDGQHHTCSA-N 431.510 4.421 10 10 IICE CN(C)c1ccc(CNc2ncnc3cc(I)sc23)cc1F 1611886627 SRGWIWFTGZLBGM-UHFFFAOYSA-N 428.274 4.113 10 10 IICE CCO[C@@H](CCn1c([C@H]2CCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1616101339 RRGOCAZBNQZYAX-UNMCSNQZSA-N 428.577 4.109 10 10 IICE COCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CCC1 1619768444 QGUGTJJFZLRBSB-VWLOTQADSA-N 437.588 4.129 10 10 IICE Cc1cc(C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)c(C)n1-c1cccc(C(C)C)c1 1624371619 USODYIWRKOKKJF-UHFFFAOYSA-N 430.552 4.406 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C[C@H](C)c2ccccc2)[C@@H](C)CO)C1 1625422266 OFJZSXCYKXKOIL-VXKWHMMOSA-N 447.623 4.421 10 10 IICE CCOc1cc2c(cc1CNC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)O[C@H](C)C2 1627878966 GCZLJGMINKKRBB-GOSISDBHSA-N 446.547 4.488 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H](OCC1CCCC1)c1ccccc1 1634423942 OXUNZMKUBMGZPZ-VWLOTQADSA-N 440.559 4.351 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3ccccc3F)CC2)N(C)C)cc1 1638917586 ISLOPYIRTWYWRO-XMMPIXPASA-N 426.580 4.159 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(C)(C(=O)OC(C)(C)C)CC3)ccc21 1639839223 PRTUECJHTOGSCW-UHFFFAOYSA-N 428.573 4.489 10 10 IICE CCOc1cccc([C@H](C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1653924860 PTOSYXCGKGYEEC-INIZCTEOSA-N 428.488 4.150 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(C)CC(C)(C)C3)cc2F)C[C@H](C)O1 1654194097 LLPROURMLHUIQY-OALUTQOASA-N 433.612 4.204 10 10 IICE COc1ccc(N(Cc2cccs2)C[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1 1657566876 KRBRHEYJIMSEKC-LJQANCHMSA-N 438.549 4.088 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3=O)c2C)c1 1684599988 NMXSKEVPDCUWAI-RUZDIDTESA-N 444.579 4.345 10 10 IICE C[C@@]1(Cc2ccccc2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725695 RUHONMCQSZRABB-DEOSSOPVSA-N 429.511 4.108 10 10 IICE CCCCN(C)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N2CCOCC2)cc1 1709593105 IYLTWSGZCAYUBY-UHFFFAOYSA-N 440.979 4.115 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=CCC1 1728186303 LQMIOXJQWHYOLH-UHFFFAOYSA-N 432.572 4.035 10 10 IICE CO[C@H]1CCC[C@@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1749157395 BZUZXBAHNVKBOL-MJGOQNOKSA-N 427.936 4.151 10 10 IICE CCCOc1ccc(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2ccccc2O)cn1 1764604508 QUXMARLVDRKFKN-UHFFFAOYSA-N 433.512 4.421 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC[C@H](C(F)(F)F)C2)cc1F 1768494469 IKJFSHKDGMYYOR-HNNXBMFYSA-N 436.457 4.305 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CC3CC(C)(C)C3)CC2)cc1F 1768705103 VLYGGZDZTVFUGB-UHFFFAOYSA-N 429.584 4.387 10 10 IICE COC[C@@H](C)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1770739216 PWTBDZVPWOBZOT-UGKGYDQZSA-N 427.593 4.039 10 10 IICE Cc1cc([N+](=O)[O-])ccc1NC(=O)c1c2c(n3ccccc13)C(=O)c1ccccc1C2=O 1873928664 DUOCHJXRTCSJNO-UHFFFAOYSA-N 425.400 4.184 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)[C@H]1C1CC1 1886006838 OOVGPRASMTVRJA-JKSUJKDBSA-N 429.330 4.171 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@@H](CNCc2cc(Cl)ccc2O)C1 2025248548 SWKSQZROUXTIJL-NRFANRHFSA-N 445.991 4.257 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)NCC2(CN=[N+]=[N-])CC2)C1 2060638746 ALKXXEOFVPYHSI-QHCPKHFHSA-N 443.548 4.037 10 10 IICE NCc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)cc1Br 2130170730 SYHRKNOYELUNBY-SFHVURJKSA-N 428.296 4.161 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(CCCC(=O)O)C3=O)o2)cc1 2296509286 CIPFZQHCOCTWKK-UHFFFAOYSA-N 445.518 4.189 10 10 IICE Cc1ccc(NC(=O)COc2ccc(Cl)cc2C=C2SC(=S)NC2=O)c(C)c1 2314487999 VSDXEUQUSSSYEG-UHFFFAOYSA-N 432.954 4.463 10 10 IICE O=C(COc1ccc(Cl)cc1)NN1C(=O)C(=Cc2ccccc2Cl)SC1=S 2314716673 FGCQVEOUNOUYRV-UHFFFAOYSA-N 439.345 4.305 10 10 IICE CCN(CC)Cc1ccc(C=C2SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)cc1 2321576582 NJRVYKTVHRWVKT-UHFFFAOYSA-N 425.579 4.033 10 10 IICE CC[C@@H](NC[C@H]1[C@@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2333093376 YZEGDZOJHWIRRX-VJUNAUMWSA-N 425.367 4.451 10 10 IICE COc1cccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@H]32)c1O 14459684 AFGIGDYJTCHWBK-IXFSTUDKSA-N 440.565 4.402 10 10 IICE CCOC(=O)Cn1cc(/C=C2\C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)c2ccccc21 96585239 AVRBMIYLRDTUCP-UNOMPAQXSA-N 431.448 4.020 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3c(C)nn(CC(C)C)c3Cl)CC2)cc1 108427482 MNEFVHJKMLYJAE-ZHACJKMWSA-N 430.980 4.262 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)C12CCC2 715765321 GGORYCNNTQJLPK-CABCVRRESA-N 429.330 4.219 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CN3CCC(c4nnc5n4CCC5)CC3)c2C)c1 728915513 VKCYNMYBDUEQOY-UHFFFAOYSA-N 449.624 4.416 10 10 IICE Cc1cc(C(=O)COC(=O)CCCc2nc(C3CC3)no2)c(C)n1-c1ccc(F)cc1 740317013 ISICATGUBXFESL-UHFFFAOYSA-N 425.460 4.242 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(Br)c1 746010848 MEBAXRPWGLZGIS-UHFFFAOYSA-N 449.364 4.143 10 10 IICE Cc1ccc([C@H](Cn2ccnc2)NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C)c1 750391978 OWKLOCHOYJMAFH-UPVQGACJSA-N 448.567 4.338 10 10 IICE O=C1NN(c2ccccc2)C(=O)/C1=C\c1cnc(-c2ccc(Br)cc2)s1 751536698 XFITVVWXGVABHK-YBEGLDIGSA-N 426.295 4.034 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(C)c(F)cc3F)n2)cc1OC 753153941 GFVMZBRLCLFWEN-UHFFFAOYSA-N 426.466 4.215 10 10 IICE Cc1ccc(CN[C@H](C)c2ccc(N3CCOCC3)c(F)c2)c(OC[C@@H]2CCOC2)c1 766557804 SFWHUWJARKWWRS-WOJBJXKFSA-N 428.548 4.237 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)/C=C\c1cnc2ccccc2n1 791248377 OCGWVGGDWFTQNC-YFHOEESVSA-N 432.524 4.032 10 10 IICE C[C@@H]1COCC[C@H]1c1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 799672407 YIIAVJBRGKYUPE-LHVWTWQCSA-N 435.596 4.105 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NCc2nccn2C)cc1 1149899876 JLRHYOWATOORAU-UHFFFAOYSA-N 443.345 4.163 10 10 IICE CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1152400871 GEOAINDMBZVSLU-NQIIRXRSSA-N 442.556 4.412 10 10 IICE Cc1cc(C(=O)CSc2n[nH]c(Cc3cccs3)n2)c(C)n1-c1ccc(F)cn1 1165481833 MVAVWWDVDWNLQA-UHFFFAOYSA-N 427.530 4.374 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@H]1CCC2(CC(C(=O)OC(C)(C)C)C2)O1 1248493878 ZPMBNFCQMKTRAI-ABGUIGEDSA-N 446.588 4.373 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCCOc3ccccc3Br)C2)cc1 1278862139 YJWBHUWYXHJROL-INIZCTEOSA-N 433.346 4.012 10 10 IICE CCCn1c(C)c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c2cc(OC)ccc21 1289600966 XETOWOPEKNFDOR-DEOSSOPVSA-N 436.600 4.467 10 10 IICE Cc1ccc(C(=O)NCCNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1F 1290611756 QDEXYCFVBAQRAM-UHFFFAOYSA-N 427.907 4.355 10 10 IICE Cc1nnc(N(C)[C@@H]2CCCN(c3ccccc3)C2)n1CCCSc1nccs1 1290706873 MYPWICVBAYSXCB-LJQANCHMSA-N 428.631 4.331 10 10 IICE CC(C)(C)OC(=O)[C@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H]2CC[C@H]1C2 1291626382 HKRQVZLUJHNBAW-AXHZCLLHSA-N 430.614 4.004 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](C(=O)NCCCSc2nccs2)(c2ccccc2)C1 1292997789 QLAZDNQUPFYQBT-JOCHJYFZSA-N 447.626 4.320 10 10 IICE CCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1299759667 REKOCBGUBBPXHH-XMMPIXPASA-N 449.982 4.380 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cnnn1-c1cccc(Cl)c1Cl 1299788511 RZDDCGRECNKEPL-UHFFFAOYSA-N 430.339 4.494 10 10 IICE CC[C@@](C)(NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(F)cc1 1307992193 XEOQQZVOWUKTBC-AREMUKBSSA-N 430.479 4.455 10 10 IICE NC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c1 1318195290 KFKWKLTWXAORND-UHFFFAOYSA-N 434.351 4.078 10 10 IICE CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1351674689 XNAIUVMJOQGRJW-HXUWFJFHSA-N 434.005 4.415 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3ccc(Br)cc3Cl)CC2)cc1 1359816773 SISKDOOAEYKEDZ-UHFFFAOYSA-N 437.765 4.439 10 10 IICE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1434908136 AXNNIIFNRQJYIJ-GHTZIAJQSA-N 447.620 4.276 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)N2CCN(CC3CC3)c3ccccc32)C1 1445059623 SKRLYJLIQOJJCZ-SYGIOELKSA-N 425.573 4.453 10 10 IICE Cc1c(Br)cccc1C[C@H](CO)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 1478471267 SAIMZIGELKTGCR-SJORKVTESA-N 448.405 4.035 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)CCO1 1514148304 WTPSUELDMVWCRJ-HNNXBMFYSA-N 433.578 4.338 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(Cc4ccccc4)s3)cc2F)C[C@H](C)O1 1526003689 RORGVUINPQTTCY-IRXDYDNUSA-N 439.556 4.417 10 10 IICE CCOc1ccc([C@]2(C(=O)N[C@H]3CCN(c4ccc(OC)cc4)C3)CC2(Cl)Cl)cc1 1531740747 JQDBVZIBQMJIQL-JTSKRJEESA-N 449.378 4.304 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](F)c1ccc(C(F)(F)F)cc1 1535345702 KXUCQOOLCTZZLK-QGZVFWFLSA-N 432.364 4.147 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCOC2(CCCC2)C1 1544589704 CHIUXJQBIXONCZ-NAVNFMRLSA-N 448.585 4.025 10 10 IICE CO[C@]1(C)CCCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)CC1 1554691763 NURBUXZMDAMYSN-AREMUKBSSA-N 448.615 4.082 10 10 IICE C[C@@H](NC(=O)C1(c2ccc(I)cc2)CC1)c1ccc(N(C)C)cc1 1585423615 JLKFOWGEOBTGOS-CQSZACIVSA-N 434.321 4.266 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1csc(-c2cccc(Cl)c2)n1 1585536272 XWKRVBFKSBFKFR-UHFFFAOYSA-N 427.957 4.355 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cccc(NS(C)(=O)=O)c3)c2C)c1 1587829409 DEOHWEJHMFMWPI-UHFFFAOYSA-N 425.554 4.012 10 10 IICE Cc1ccc(C(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1597063699 AAEKOYKUONLEPS-OAHLLOKOSA-N 427.545 4.106 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)COc2cccc(Br)c2)cc1 1598292638 SRCSLFLOPYNXOU-NRFANRHFSA-N 447.373 4.102 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1613206626 IILUOPURVFNDBX-AVRDEDQJSA-N 425.621 4.346 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1)OC 1613614545 VUFWHMYHEJQEQM-JOCHJYFZSA-N 447.587 4.148 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)Cc2cc(C)on2)cc1 1615379470 HZHBNWQWKYJUFD-UHFFFAOYSA-N 431.544 4.167 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)Nc2ccc(F)cc2)cc1F 1616056793 VUDUANPWMRGINA-UHFFFAOYSA-N 425.435 4.301 10 10 IICE CCc1nc(C)c(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)o1 1616572290 FAVNQOACVYPEMH-UHFFFAOYSA-N 426.274 4.270 10 10 IICE COCCN(c1nnc(C(C)C)n1Cc1ccc2c(c1)CCCN2C)[C@H]1CC[C@H](C)C1 1619885346 FURNIJIHZUEHLQ-UGKGYDQZSA-N 425.621 4.474 10 10 IICE COc1ccc(CN2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1F 1624368708 ZDMJONZSANKJCV-UHFFFAOYSA-N 449.526 4.012 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CCO[C@H]2CNC(=O)OC(C)(C)C)cc1)C1CCCCC1 1625904867 DEZDQJNHZCGJIA-YADHBBJMSA-N 445.604 4.002 10 10 IICE Cc1cc(C(=O)N[C@H](Cc2ccc(Cl)cc2)C(N)=O)c(C)n1-c1cccc(Cl)c1 1626982111 WNDKZVJQFWSAAC-HXUWFJFHSA-N 430.335 4.227 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)c1 1627721675 HTQGSHZNCQCPLL-OALUTQOASA-N 443.035 4.378 10 10 IICE CCNC(=O)Nc1cc(F)ccc1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1630670726 AMHBGJKNLYODQQ-UHFFFAOYSA-N 438.503 4.448 10 10 IICE CC(C)(C)OC(=O)c1ccccc1CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631219189 OUWGBHFUCQBYJK-FQEVSTJZSA-N 425.525 4.098 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@H](CC3CCC3)c3ccccc3)cc2)CC1 1633747573 QRBSFZDFZIAOQS-DEOSSOPVSA-N 434.584 4.119 10 10 IICE NC(=O)c1ccc(CSc2ncccc2C(=O)NCc2c(O)ccc3ccccc23)cc1 1635965125 MYNZKAASMZYNSR-UHFFFAOYSA-N 443.528 4.262 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC(=O)NCc1c(O)ccc3c1CCCC3)C2 1637734388 ZONUJUYOBVHSAW-GGPHIMKMSA-N 443.588 4.248 10 10 IICE COC(=O)[C@@H](C[C@@H]1CCCOC1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1643523608 DSFFGWITCSKQQE-HTAPYJJXSA-N 438.528 4.256 10 10 IICE Cc1ccc([C@@H]2[C@H](C)CCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1644683113 ZAKDXRFCDIANNW-IBVKSMDESA-N 439.575 4.060 10 10 IICE CCOC(=O)C[C@@H](SCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)C(=O)OCC 1651961791 SQNXLCNIVZSSFU-HXUWFJFHSA-N 435.517 4.034 10 10 IICE CCN1CCO[C@@H](C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)C1 1654198166 RJFLHCQBBHLJEW-HXUWFJFHSA-N 428.533 4.016 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3cc(OC)c(Br)cn3)ccc21 1654464153 GSVQWILZIXBODE-UHFFFAOYSA-N 432.318 4.323 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCc4ccccc4NC3=O)cc2Cl)C1 1680561318 BVDPTLHDWQIEIP-KKSFZXQISA-N 440.975 4.329 10 10 IICE C[C@@H](NC(=O)NC[C@@](C)(C(=O)OC(C)(C)C)c1ccccc1)c1ccc(N(C)C)cc1 1681778359 ALJCZHBTXVOUBK-IQGLISFBSA-N 425.573 4.412 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1692986068 PZFLRKJFHYRTQB-RTBURBONSA-N 448.615 4.360 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)cn2C)nnc1N1CCCC1 1693005007 UGMBJQSDPIMQJQ-UHFFFAOYSA-N 443.393 4.069 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(C)(C)CN(C)C 1694109282 NUDJJVNEXDLEEB-HXUWFJFHSA-N 442.652 4.105 10 10 IICE CC[C@@]1(C)CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1694447995 RMKYHKPTGRHDAV-SANMLTNESA-N 439.648 4.360 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709218854 WESGHVLGOVGGIC-UGKGYDQZSA-N 439.648 4.457 10 10 IICE C[C@H]1C[C@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1726486900 QHMUSOKFCDGAPZ-DSLXNQLJSA-N 441.576 4.047 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1F 1731142719 WOHIJFRLFYATSM-DYVFJYSZSA-N 432.906 4.041 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(CC)CC)cc2)C1 1766461321 AJJPLOLEBLMXGM-NRFANRHFSA-N 436.604 4.421 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3C[C@@H](C)Cc3cccs3)CC2)cc1F 1770258817 QJOMDFGPXLAEPW-INIZCTEOSA-N 429.565 4.001 10 10 IICE Cc1cc(=O)c(OCc2ccc(Br)cc2F)cn1CCOc1ccc(N)cc1 1857916541 AIVXITUXUZSOTB-UHFFFAOYSA-N 447.304 4.299 10 10 IICE CC[C@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2cccnc2)C1=O 1873168541 YYCWKZPURNTCFE-KRWDZBQOSA-N 428.536 4.157 10 10 IICE O=C(N[C@]1(c2c(O)cccc2F)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952772870 QITJOMIKHDDKDF-UQBPGWFLSA-N 433.435 4.370 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](CF)(NCc2cc(Cl)cc(Br)c2O)C1 2040509321 JFZZRPJXQAMSSI-KRWDZBQOSA-N 437.737 4.247 10 10 IICE CCN[C@@H](c1ccccc1O)c1cc(I)ccc1Br 2090034424 HQJQDIBKKDNBQZ-HNNXBMFYSA-N 432.099 4.458 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc(OC)c(OC)c(OC)c3)SC2=S)c(OC)c1 2296885364 QTZHZBMDGHMJLB-UHFFFAOYSA-N 447.534 4.135 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H]2CC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380761830 JLVNDKYROYUHED-HIFRSBDPSA-N 441.366 4.115 10 10 IICE C[C@]12C(=O)N(c3ccc(Cl)cc3)C(=O)[C@H]1ON(c1ccccc1)[C@@H]2c1ccccc1O 20069332 GDRSKIHXMKXIFJ-PQNGQFLHSA-N 434.879 4.487 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccc(O)cc2O)SC1=S)Nc1ccccc1 210734966 BMHHOSHULFZBPN-CPNJWEJPSA-N 442.562 4.498 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@@H]32)cc1OC 226886095 RDMVAJCVARHDFH-IMWIBFENSA-N 440.565 4.315 10 10 IICE CS(=O)(=O)c1cccc(C(=O)N[C@H](c2ccccc2)c2c(O)ccc3ccccc23)c1 247554366 WVXFCHMJOWUUTJ-XMMPIXPASA-N 431.513 4.468 10 10 IICE CN1CCN(Nc2ncnc(Nc3ccc(N=Nc4ccccc4)cc3)c2[N+](=O)[O-])CC1 256017843 ATCDJMGCXSOHNG-UHFFFAOYSA-N 433.476 4.118 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc3c(cc2Cl)OCO3)C1 435661611 GLULDSWHBSIDKY-UHFFFAOYSA-N 425.916 4.429 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H]1COc2c1ccc(Cl)c2Cl 743683846 MVNMLSKOMNWYTO-QGZVFWFLSA-N 438.380 4.480 10 10 IICE O=C([C@@H]1CC12CCN(Cc1ccc(N3CCCCC3)c([N+](=O)[O-])c1)CC2)N1CCCCC1 779605712 XBUSZYVCUFXTES-NRFANRHFSA-N 440.588 4.200 10 10 IICE C[C@]12CCN(C(=O)CCCN3C(=O)/C(=C\c4cccs4)SC3=S)C[C@H]1C2(F)F 816786836 OOFQLGVYJJAMEG-IUSOGQAPSA-N 442.578 4.233 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnc(-c4ccc(F)c(F)c4)s3)CC2)cc1 1116514559 IRAIQBYBANHTTG-UHFFFAOYSA-N 429.492 4.449 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3cccc(OC(F)(F)F)c3)cc2F)C[C@@H](C)O1 1125188839 VNTIJDINTIONPL-GASCZTMLSA-N 440.437 4.197 10 10 IICE COCC1(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCCC1 1129750249 IOSKTVAVGDEDAV-VBKFSLOCSA-N 438.640 4.053 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(S(=O)(=O)CC2CC2)cc1 1135745674 DORLJTBTQJKLIG-UHFFFAOYSA-N 426.582 4.133 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2 1135746698 XBQXERYISDNMPB-UHFFFAOYSA-N 425.485 4.019 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3c(-c4ccc([N+](=O)[O-])cc4)noc3=O)c2C)c1 1165615274 OHFICUYFSJZPIL-UHFFFAOYSA-N 446.463 4.319 10 10 IICE Cc1ccc(CN(C)c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)o1 1289644598 QTAHOTQCNWAKIV-NRFANRHFSA-N 427.524 4.311 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 1292382171 OHQDFYTTYDPVNO-LJQANCHMSA-N 431.920 4.065 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(C)CCN2CCN(c3ccccc3)CC2)c1C 1293914000 ILBAKKJZTSXEJW-UHFFFAOYSA-N 430.596 4.297 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(N)=O)c2ccccc2)c(C)n1-c1cccc(Br)c1 1298523367 CKYRRPRFLWCPMW-FQEVSTJZSA-N 440.341 4.203 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CC[C@@H](C)C2)CCOC1 1304971747 IWOIDYMHNCWSOI-KHCICDEESA-N 428.577 4.097 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCN1C[C@@H](C)C[C@@H](C)C1 1306078111 IINIWKHLMFTQOE-SZPZYZBQSA-N 438.664 4.445 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](CC)c2noc(C)n2)sc(C)c1-c1ccccc1 1307668959 JMPRAMTUSXEGLV-INIZCTEOSA-N 442.541 4.271 10 10 IICE CCCOc1ccc(C(C)(C)NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1313420066 WUANDJYZQBQXAF-HSZRJFAPSA-N 426.605 4.379 10 10 IICE CC(C)(C)c1ccc(OCCCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1350933740 QHWMIBQDMIDOLN-UHFFFAOYSA-N 428.548 4.435 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc4c(s3)CCCCCC4)CC2)cc1 1352410162 QDYIKXLTDRFHLP-UHFFFAOYSA-N 441.641 4.358 10 10 IICE COC(=O)c1cc(F)c(C)c(OC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1356472237 PJSVGDKPKQNDBB-UHFFFAOYSA-N 425.456 4.368 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)NCc2ccc(N(C)C)c(F)c2)cc1 1357192807 NOCOUJDCOIMIJU-UHFFFAOYSA-N 431.309 4.078 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)COc1ccc2cc(Br)ccc2c1 1360848397 SSLPFXYLSXXLME-UHFFFAOYSA-N 441.325 4.473 10 10 IICE CC1=C(Br)CN(c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)CC1 1360850462 FGHKDCPZXSMDTQ-UHFFFAOYSA-N 448.434 4.067 10 10 IICE COC[C@H](CC(C)(C)C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1437139978 BPSZMQQJYUCSEJ-HNDQUVLASA-N 440.656 4.297 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cn3nc(C(F)(F)F)c4c3CCC4)c2C)c1 1438301406 KKBOORUMKWVILD-UHFFFAOYSA-N 430.474 4.423 10 10 IICE Cc1cc(CN2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)ccc1N1CCCCC1 1473157631 JZAOKOPGAOCSGE-RUZDIDTESA-N 428.020 4.490 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)O1 1479233073 UBFGYESWYYDSBQ-ZFWWWQNUSA-N 439.272 4.186 10 10 IICE Cc1ccc(OCc2nnc(N3CCOC[C@@H]3C)n2CCCSc2nccs2)cc1 1492399880 DKKGWHSIOCJUAL-KRWDZBQOSA-N 445.614 4.030 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCN1CCCC1 1495638982 JEBGJOAIMDXQKF-OAQYLSRUSA-N 440.636 4.003 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCCO[C@H](C)C2)cc1 1515525590 AQYAKYDEDSIOHE-LJQANCHMSA-N 439.629 4.440 10 10 IICE C[C@@H](CCc1ccco1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1524802692 DDGFHROWVCPAHU-RVAQLADHSA-N 432.542 4.148 10 10 IICE O=C(COc1ccc(Cl)c2ccccc12)NCc1cc(F)c(N2CCOCC2)c(F)c1 1527857866 NIHUUHLDMNWYGX-UHFFFAOYSA-N 446.881 4.303 10 10 IICE COc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1OC1CCCC1 1527864045 GXEFFXYUSPVFKX-UHFFFAOYSA-N 446.494 4.061 10 10 IICE CCO[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1528908688 YVLCQQDUDVJDHX-XNMGPUDCSA-N 445.607 4.290 10 10 IICE Cc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nnn1-c1ccc(F)c(F)c1 1534550405 WZLKCSZYUUCWTC-UHFFFAOYSA-N 435.478 4.234 10 10 IICE CN(C)c1ccc([C@@H](CNc2nc(C3CCOCC3)ns2)NC(=O)OC(C)(C)C)cc1 1559184129 WKMBKIZDAXAOHX-GOSISDBHSA-N 447.605 4.176 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]1COC(=O)NC1CCCCC1 1564946962 ZLJKCUGYCUZMAP-CVDCTZTESA-N 444.620 4.225 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cccc(F)c1F 1595778598 DVMHNEHBHSSRLG-MHWRWJLKSA-N 436.480 4.012 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1597774730 OKAHTBOZIQBMTK-ZEQKJWHPSA-N 435.568 4.150 10 10 IICE O=C(CCCOc1ccc(I)cc1)NCc1cccc(Cl)c1O 1606860386 JYJCAZFHSMCXKJ-UHFFFAOYSA-N 445.684 4.126 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1C[C@@H](C)O[C@@H](C(F)(F)F)C1 1611963529 SPUDLGVQZVUEFF-VQIMIIECSA-N 439.526 4.055 10 10 IICE Cc1ccc(C(=O)N2CCC(OCCOC(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1626334898 BUGSZMAHQBSSFU-UHFFFAOYSA-N 426.557 4.261 10 10 IICE CN(c1ccc(CNC(=O)CNC(=O)c2cnc(Cl)c(Cl)c2)cc1)C1CCCCC1 1627005686 CKLQBWBWHKVJIL-UHFFFAOYSA-N 449.382 4.204 10 10 IICE COc1ccc(N2C[C@H](NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2=O)cc1 1632493602 OJIMHNGYAHWXMH-GOSISDBHSA-N 437.927 4.291 10 10 IICE CO[C@@H]1CCC[C@H]([C@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1632687481 HZENRWFIWABNPR-SCWSEQNSSA-N 449.389 4.153 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1c(C)nn(C(C)C)c1C 1634385161 SRSLKXFVIHZFMD-UHFFFAOYSA-N 428.577 4.012 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(CC)c(-c2ccccc2)s1 1638031106 YURJSKDCAMCOEM-SFHVURJKSA-N 439.533 4.293 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnn2c(C(F)F)cc(C3CC3)nc12 1638305505 KREINNCJPPFYTB-UHFFFAOYSA-N 427.238 4.487 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)c1 1638952485 MKKCFKIGGFSSKT-HZPDHXFCSA-N 427.545 4.328 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccc1NC(=O)c1ccc(OC)cc1 1640256608 APGYSVYEDKUTDP-UHFFFAOYSA-N 425.481 4.069 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](CC)O[C@H](C)C2)sc(C)c1-c1ccccc1 1653392637 ZLVDXOBEANSHPO-QAPCUYQASA-N 430.570 4.338 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(C)CC(C)(C)C3)cc2F)C[C@@H](C)O1 1654194096 LLPROURMLHUIQY-KDURUIRLSA-N 433.612 4.204 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)[C@H](C)Cc3ccccc3)nc12 1654300898 NNHDMWCTQGAAFI-LJQANCHMSA-N 444.535 4.245 10 10 IICE COC1CCN(c2ccc(CN[C@](C)(CO)c3cccc(Br)c3)cc2)CC1 1656418109 LOWZMGDBUZOFFS-JOCHJYFZSA-N 433.390 4.062 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)Cc2ccccc21 1686950445 LPLDFHONFOEXCG-QGZVFWFLSA-N 431.920 4.211 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1695624031 JDZWYIIARYMJQN-RDPSFJRHSA-N 448.615 4.020 10 10 IICE C#C[C@H](C)N(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1705505436 KLSVATQHPGNZBN-QTGUNEKASA-N 435.616 4.085 10 10 IICE C=C(C)COCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1705740876 ZLCQAPHNGIECCV-TZIWHRDSSA-N 428.577 4.131 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1708047928 WEODXQZEFQAFLY-BVYCBKJFSA-N 428.577 4.457 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cc(COC(C)(C)C)on1 1752616311 XVUQZZAOYXOGIA-MRXNPFEDSA-N 427.549 4.485 10 10 IICE O=C(CNCc1cc(Cl)cc(Br)c1O)Nc1ccccc1Br 1860721591 QOODKEZWYXIAAV-UHFFFAOYSA-N 448.542 4.299 10 10 IICE CCCCCOc1cn(CC(C)C)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870676522 UMNOZHGJGBDCIM-UHFFFAOYSA-N 441.616 4.404 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)NCCc4ccc(C)cc4)cc3)CC2)cc1 1872883994 GOJSHWQGDQUYQK-UHFFFAOYSA-N 443.591 4.298 10 10 IICE CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179840 RPJSZRVZOGLOEG-UHFFFAOYSA-N 437.455 4.014 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)c1ccc(Br)cc1I 2207264063 ANCHUQYTSITFIP-MRXNPFEDSA-N 445.142 4.429 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]3CCC[C@H]23)c1O 2236050672 JAWQSXRGOLRCQP-DAXOMENPSA-N 441.366 4.041 10 10 IICE CCCCN1C(=O)C(=Cc2c(N(CCC)CCC)nc3ccccn3c2=O)SC1=S 2296545968 DKFZRSRQVNWBNZ-UHFFFAOYSA-N 444.626 4.322 10 10 IICE CCN1C(=O)C(=Cc2ccc(OCCOc3ccc(OC)cc3)c(OC)c2)SC1=S 2297335437 GXKTYCOXXIZACM-UHFFFAOYSA-N 445.562 4.383 10 10 IICE COc1cccc(C(=O)Oc2c(Cl)cc(C=C3SC(=S)N(C)C3=O)cc2OC)c1 2297364252 SDYMLWVXTRVPBW-UHFFFAOYSA-N 449.937 4.407 10 10 IICE COc1cccc2c1O[C@@H](C)C(C=C1SC(=S)N(CCCCCC(=O)O)C1=O)=C2 2314450706 MQRASQFHYMPBRK-ZDUSSCGKSA-N 433.551 4.249 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1OC 2314764683 JPHFUQZDZDQHMN-UHFFFAOYSA-N 442.562 4.339 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380760625 ZBHKSSWNEASSLA-AWEZNQCLSA-N 441.366 4.069 10 10 IICE COC(=O)c1ccc(/C=C2\N=C(c3ccc(OC)cc3)N(c3ccc(F)cc3)C2=O)cc1 6627087 FJRIFFNEUYUWCX-JCMHNJIXSA-N 430.435 4.455 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\NC1=CC=C[C@@H]2C(=O)c3ccccc3C(=O)[C@H]12 101350050 AAUDKFJWTSXTGY-AXTOXEIBSA-N 437.499 4.265 10 10 IICE COc1cc(/C=C/C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1OCC(C)C 109179320 MOTZNVAEJODVPC-VLUHHTHFSA-N 438.568 4.457 10 10 IICE CC[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)ccc1O 390698146 SEPVNHNTRYGWOQ-FPOVZHCZSA-N 433.390 4.487 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](Cn2cccn2)c2ccccc2)C1 683445253 FLEXATHJMRQRAX-DEOSSOPVSA-N 441.579 4.162 10 10 IICE CN1CCCc2cc(CNC(=O)N3CCC[C@@H](c4nc(-c5cccc(F)c5)no4)C3)ccc21 726710094 WHPZWCOVCHTVTB-HXUWFJFHSA-N 449.530 4.347 10 10 IICE Cc1ccc2c(c1C)OC[C@@H]2NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 728309499 NJJWQADBKKFBAF-FQEVSTJZSA-N 431.483 4.307 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1cccc2nccnc12 754429587 VQRRAGSUWIYLST-UHFFFAOYSA-N 437.547 4.247 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cccc2cnncc12 754580686 BBRMITZQXCZYTJ-LICLKQGHSA-N 440.575 4.311 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2cnccc2-c2ccccc2)c(C)n1-c1ccccc1 760188663 HWEKBYUUYJSZCK-UHFFFAOYSA-N 438.531 4.454 10 10 IICE Cc1oc2c(CN3CCO[C@@]4(CCOC4)C3)c(O)ccc2c(=O)c1-c1ccccc1Cl 768905062 GYFMFTVVGKNPRA-DEOSSOPVSA-N 441.911 4.119 10 10 IICE CC1(C)C[C@@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 1129509838 JTALUQKATRZIPM-HNDQUVLASA-N 438.640 4.051 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-n4cccc4)ccc3Cl)CC2)c(OC)c1 1132035654 BYLFWUPABNKAMQ-UHFFFAOYSA-N 425.916 4.110 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N=[S@@](C)(=O)c3ccc(N(C)C)cc3)ccc21 1132067050 XKKZRYKMRKDZCS-PMERELPUSA-N 427.570 4.268 10 10 IICE O=C(Cc1ccc(NC(=O)C(F)(F)F)cc1)N(Cc1ccco1)Cc1ccccc1O 1137343474 RBJZUSPHHXOXDJ-UHFFFAOYSA-N 432.398 4.258 10 10 IICE Cc1nc(CN2CCC(CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)oc1C 1143994045 BVBFINJEFWRSBJ-UHFFFAOYSA-N 448.567 4.153 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CC(c3ccc(Cl)cc3Cl)=NO2)cc1 1144867706 CPMRPNRNEUHDND-FQEVSTJZSA-N 436.339 4.090 10 10 IICE Nc1ccc(C(F)(F)F)cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1148444875 WLNVTNFZDKBXOY-CYBMUJFWSA-N 429.389 4.288 10 10 IICE COC(=O)[C@H](C)[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1149304949 YSIYEYLZVYKZND-IQGLISFBSA-N 432.520 4.116 10 10 IICE CCN(C(=O)CNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)c1ccccc1 1227209448 VABJHKGPFAMARU-SFHVURJKSA-N 442.991 4.429 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](Cc3ccccc3)c3ccccn3)CC2)cc1 1256099382 QFWJOYXMNZEUSE-VWLOTQADSA-N 430.552 4.296 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCn1cc(Cl)cn1 1287363147 CFUBMFBVBIFAGN-UHFFFAOYSA-N 442.011 4.263 10 10 IICE COc1cc(N2CC[C@](CNC(=O)OC(C)(C)C)(C(C)(C)C)C2)c([N+](=O)[O-])cc1OC 1307193442 BFOYWCHSLPVJRA-JOCHJYFZSA-N 437.537 4.379 10 10 IICE C[C@H]1[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1313127545 JFJPKSNCXVAFPS-LLUDDFSJSA-N 430.593 4.071 10 10 IICE CN(Cc1ccco1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1314755287 SKSCJMGIUMFUPQ-UHFFFAOYSA-N 437.588 4.062 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(F)(F)c3c(F)cccc3F)cc2F)C[C@H](C)O1 1350932247 FAEMVAIQLOSNEA-STQMWFEESA-N 428.401 4.126 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(OC)cc1 1355669212 OYZAIKDNSYNTET-XMHGGMMESA-N 444.553 4.479 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCN(C(=O)OC(C)(C)C)C2CC2)cc1 1435074475 IUQIWUQBXFGFFR-UHFFFAOYSA-N 443.510 4.433 10 10 IICE Cc1cc(C(=O)NCCNC(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cc1 1442485195 AJGITPIMIQNCLN-UHFFFAOYSA-N 436.350 4.111 10 10 IICE Cc1oc(-c2ccccc2)nc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445877945 AUKZDZBMZOCYQR-LJQANCHMSA-N 425.916 4.403 10 10 IICE O=C(Cc1csc(-c2ccc(Cl)s2)n1)NCc1ccc(N2CCC(O)CC2)cc1 1453979250 AIDZAHROVXKEKE-UHFFFAOYSA-N 448.013 4.345 10 10 IICE Cc1nc(SC2CCCC2)sc1CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1454008063 VRFARIPGNAAPKV-UHFFFAOYSA-N 445.654 4.306 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CSc3ccc(Br)cc3)C2)cc1 1461076108 HDQLQNQIWMTKFM-OAHLLOKOSA-N 435.387 4.193 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCc1nc(C(F)(F)F)n2c1CCCC2 1479139072 ISCNWTUXTVCJQB-UHFFFAOYSA-N 437.510 4.424 10 10 IICE Cc1nnc(N(Cc2cccs2)C[C@H]2CCCO2)n1CCCSc1nccs1 1492790214 YAVQXYOSGPHYSP-MRXNPFEDSA-N 435.644 4.473 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1Cc1ccnc(OCC2CC2)c1 1503487185 IIIJWWZVSBKAHP-UHFFFAOYSA-N 435.572 4.441 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](CC(N)=O)C3)n2CC(C)C)c(C)n1-c1ccccc1 1510621417 VCHVJRANOKFZQP-HXUWFJFHSA-N 434.588 4.100 10 10 IICE CC/C(=C/C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1)c1cccc(Cl)c1 1524982064 IIIXQQHLRBPTGW-VXPUYCOJSA-N 442.003 4.471 10 10 IICE Cc1ccc(-c2ccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)nn1 1539581884 LNCVIIVRIWUMBS-LJQANCHMSA-N 438.478 4.452 10 10 IICE CCOCc1nnc(N(C)[C@H]2CC[C@H](SCC)C2)n1Cc1ccc(N(C)C)c(F)c1 1548076248 QGNALXKSJGAWHT-ROUUACIJSA-N 435.613 4.178 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCC[C@H]2NS(C)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1556539969 MSURPOQEKIDUBJ-NFBKMPQASA-N 445.629 4.055 10 10 IICE COc1cc(C)cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1O 1597561199 PUQBBBOWPRPHCZ-UHFFFAOYSA-N 445.563 4.326 10 10 IICE Cc1cc(CC(=O)NCC2(NC(=O)OC(C)(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1598135150 LISFUFLEYDCXNJ-UHFFFAOYSA-N 431.964 4.464 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1612934569 YFHTVLKNLJEBAR-FOIQADDNSA-N 425.485 4.493 10 10 IICE COc1ccc(Cn2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)n2)cc1 1617064723 CPABNHGUWDSQCD-UHFFFAOYSA-N 428.492 4.412 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)CCC4CCCC4)CC3)c2C)cc1 1625358230 OJKMPSFWILZVBV-UHFFFAOYSA-N 437.584 4.358 10 10 IICE CCCOc1ncccc1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1625703199 SKHQQWTUDZPRCW-UHFFFAOYSA-N 443.345 4.365 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3CC(=O)N(C)[C@@H]3c3ccc(Cl)c(Cl)c3)ccc21 1626941314 WZNHMKXAUFLRPZ-VGOFRKELSA-N 446.378 4.212 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)CCCC1 1628867474 BXNCRWYEASFYQZ-FQEVSTJZSA-N 443.588 4.194 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(Sc4ccccc4)CCCC3)CC2)cc1 1631443058 SFGSAPDGLNFLNK-UHFFFAOYSA-N 439.625 4.039 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@@H](C)C(=O)c1ccc(Cl)cc1 1632701337 BNMWIVRQSQVQBJ-CYBMUJFWSA-N 438.307 4.110 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)COc1cc(C)ccc1Cl 1635489400 WJZAMIWSEVVBNE-UHFFFAOYSA-N 432.948 4.416 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C)C[C@H]3Cc3ccccc3)c2C)c1 1637578321 UVXMAXSCAROQCA-AREMUKBSSA-N 430.596 4.471 10 10 IICE COCC1(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCCCC1 1641278394 RYEOERKAPDXWAN-DTQAZKPQSA-N 438.640 4.195 10 10 IICE COc1cc(N2CCN(c3ccc(-c4ccc(Cl)s4)nn3)CC2)cc(OC)c1OC 1655357088 PQPDECXZTOCKDJ-UHFFFAOYSA-N 446.960 4.211 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1 1683291857 YXBFRFRBLDQXKE-VQTJNVASSA-N 435.490 4.344 10 10 IICE C[C@H]1CCCC[C@H]1OCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1693651619 SRACJSPJJPVWEB-WMZHIEFXSA-N 435.572 4.201 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708430564 OOFAFOZFBQHDOX-QRVBRYPASA-N 429.634 4.007 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@@H](C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1742119013 HTRAGFDBPHOLGN-PMACEKPBSA-N 437.588 4.129 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H]3CCCS3)CC2)cc1 1748848165 VVLYNTUHJBAJAX-OAQYLSRUSA-N 443.661 4.488 10 10 IICE Cc1cc(-c2nnc(N3CCNC(=O)C3)n2CCCC(C)(C)C)c(C)n1-c1ccccc1 1761678812 LEEUKKAXKASYDF-UHFFFAOYSA-N 434.588 4.115 10 10 IICE O=C(CCNCc1c(F)cccc1Cl)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1860710876 POPYCEWMZWSVBD-UHFFFAOYSA-N 436.870 4.373 10 10 IICE CCCOc1cn(CCC(C)C)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870659984 YESWVCCVCJAKLB-UHFFFAOYSA-N 427.589 4.014 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010392240 YGEQZVDYFDMTFY-UHOSZYNNSA-N 431.537 4.176 10 10 IICE COc1ccc([C@H](n2nc(C(C)C)c(N)c2I)C2(C)CC2)c(O)c1 2080006589 LMSGGXZEMMCZBV-INIZCTEOSA-N 441.313 4.297 10 10 IICE Cc1cc(C)cc(N2C(=O)C(=Cc3ccc(-c4ccc(C(=O)O)cc4)o3)C(=O)NC2=S)c1 2293631457 QACCIOUTGAIGRZ-UHFFFAOYSA-N 446.484 4.093 10 10 IICE CCOC(=O)C1=C(C)N(CCOC)C(=O)C1=Cc1cc(C)n(-c2ccc(C)cc2C)c1C 2294082246 YGEKZOILJUTKIO-UHFFFAOYSA-N 436.552 4.420 10 10 IICE Cc1ccc(CN[C@H](C)[C@@H]2[C@H]3C[C@H]2N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352946238 HWMLRONLEDLISU-SLBVQIDZSA-N 425.367 4.197 10 10 IICE O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)c1 14471730 UBEIWOQSWLPNQS-IPJJNNNSSA-N 425.510 4.206 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccccc3C)C2=O)ccc1O 15045510 LVIPJLYEESTABZ-YQNUULROSA-N 442.562 4.328 10 10 IICE CCCCCN1C(=O)/C(=C\c2c(NCCC)nc3c(C)cccn3c2=O)SC1=S 33468518 WDLXUWRAPXGTOF-DTQAZKPQSA-N 430.599 4.216 10 10 IICE O=C1/C(=C\c2cn(-c3ccccc3)nc2-c2ccncc2)SC(=S)N1C[C@H]1CCCO1 33808707 MZXDEUDHFSWEKN-CVNFFVDQSA-N 448.573 4.315 10 10 IICE CCN(CC)c1ccc(CN(C[C@@H](O)COc2ccccc2OC)c2ccccn2)cc1 54120843 MYHAKPSWOJMINW-HSZRJFAPSA-N 435.568 4.383 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)CCc3ccc(OC(C)C)cc3)CC2)cc1 108408281 ZTDPUKFDZGFCAB-HXUWFJFHSA-N 425.573 4.335 10 10 IICE C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 209938398 HOMUMYYXWQZAEU-JCFIZXFYSA-N 447.579 4.293 10 10 IICE O=C(Nc1cccc(C(=O)N2CCCC2)c1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 586718327 LNQYDEMTECHTEM-UHFFFAOYSA-N 439.471 4.342 10 10 IICE Oc1c(Br)cc(Cl)cc1CNC[C@@H]1CN(Cc2ccccc2)CCCO1 708170058 HCJRUTXATKKDBB-GOSISDBHSA-N 439.781 4.189 10 10 IICE Cc1nn(C)c(C)c1[C@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)C(F)(F)F 757894388 RXPKNJLVWHWSNG-IBGZPJMESA-N 436.434 4.351 10 10 IICE CN(C)CC(C)(C)CN1C(=O)/C(=C\c2ccc(C(=O)OC(C)(C)C)cc2)SC1=S 764884303 FFMFVDLSYHBDCL-SFQUDFHCSA-N 434.627 4.431 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)[C@@H]2CCOC[C@H]2C)sc(C)c1-c1ccccc1 769253758 CEMDXFYLAYWZNR-RHSMWYFYSA-N 445.537 4.055 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3c(C)ccc4cccnc34)n2)cc1OC 778078330 FCEJCOFBFARCKG-UHFFFAOYSA-N 441.534 4.485 10 10 IICE CCOC(=O)[C@@H](NCc1cc(C)cc(Br)c1O)c1ccc(OC)c(F)c1 779186454 PKZGMJJMPBHOCL-KRWDZBQOSA-N 426.282 4.005 10 10 IICE O=C(CCC(=O)Nc1nnc(C2CCCCC2)s1)NCCCSc1nccs1 787350183 ZOWYOJPFERACHB-UHFFFAOYSA-N 439.632 4.060 10 10 IICE O=C(NCCc1cccc2[nH]ccc12)NC1CCN(c2ccc(OC(F)F)cc2)CC1 800704852 NFZZCZLEJUJTMN-UHFFFAOYSA-N 428.483 4.280 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c1C 804204226 SBPZNOHBBPFSPB-GOSISDBHSA-N 435.490 4.323 10 10 IICE O=C(NCc1cc(Br)ccc1O)C1(c2ccc(Br)cc2)CC1 804736952 GFJHJDKPNLXMCX-UHFFFAOYSA-N 425.120 4.265 10 10 IICE CC(C)N(C)Cc1cc(O[C@@H]2CCN(Cc3cc(Br)ccc3O)C2)ccn1 856559359 GBVQGQUUCFHDIW-HXUWFJFHSA-N 434.378 4.043 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(Cc3ccco3)C3CCCC3)cc2F)C[C@H](C)O1 917063640 LORPGNCGEWATNK-OALUTQOASA-N 443.563 4.093 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C2)c1 1136789745 CGEWLKMMKKVYHT-HDICACEKSA-N 439.556 4.377 10 10 IICE O=C(CSc1nccc2ccccc12)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438230 ISNUWJLEVIEFJQ-LJQANCHMSA-N 441.984 4.467 10 10 IICE CC(C)[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)[C@H](C)NC(=O)OC(C)(C)C 1141803450 JFQFMLYTMALZFE-FXAWDEMLSA-N 435.634 4.041 10 10 IICE Cc1cc(C[C@H](C)NC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)n(-c2ccccc2)n1 1224439273 CIMUESGRVJFDOS-UXHICEINSA-N 433.600 4.417 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1c(Cl)oc2ccccc12 1253062053 QPGXTYOCPFOQFW-UHFFFAOYSA-N 427.932 4.294 10 10 IICE Cc1cccc(-c2nnc(N(C)CC3CC(F)(F)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1289923363 RUICVLZQLXCDSB-UHFFFAOYSA-N 444.505 4.383 10 10 IICE Cc1cc(CC(=O)N2CSC[C@@H]2C(=O)N(C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1290359616 VITWJIURDVRSCM-HXUWFJFHSA-N 434.005 4.058 10 10 IICE C[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)(C)c1ccccc1 1292724526 JDVOUAONAWVDAX-OAHLLOKOSA-N 444.578 4.351 10 10 IICE CCCO[C@@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(F)cc1C 1293929390 WFBWDHNJVMMJCS-XMMPIXPASA-N 428.548 4.127 10 10 IICE COc1ccc([C@]2(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)C[C@H](O)C2)cc1 1297010356 NRHCFNWRBVFZLA-FLPMJASOSA-N 442.987 4.294 10 10 IICE C[C@H]1CN(Cc2ccc(CN(C)C(=O)c3cc4cc(O)c(O)cc4s3)cc2)C[C@@H](C)O1 1300163765 ZRTDYVIQTZKNFD-IYBDPMFKSA-N 440.565 4.194 10 10 IICE C[C@H]1Cc2ccccc2N1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1351559119 YHJZILVZRBDIIZ-ITRAFESCSA-N 426.538 4.395 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N(Cc1ccncc1)C1CC1 1353973730 JZZJYAVBAPSZSO-UYRXBGFRSA-N 441.553 4.003 10 10 IICE COc1cc(C(=O)NCc2ccc(N(C)C)cc2C)c([N+](=O)[O-])cc1OCc1ccccc1 1360274308 XSHNZPIPESAJDX-UHFFFAOYSA-N 449.507 4.487 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 1443168377 QGWXUSHNOZNECU-GOSISDBHSA-N 425.876 4.091 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)ccc1N(C)C 1459241039 SRQOJZRZCIEYQZ-HXUWFJFHSA-N 430.520 4.351 10 10 IICE Cc1cc(CC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)c(C)n1-c1ccccc1 1464184349 BIMBAPOPIFDTHU-UHFFFAOYSA-N 433.527 4.197 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C(C)C)C1 1503930392 NSJHVJAXQWEAPS-AUSIDOKSSA-N 437.588 4.249 10 10 IICE CC[C@H](C)c1nnc(N(C)C[C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1512823903 ZREZYQMMUNGUAL-SIKLNZKXSA-N 443.661 4.398 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(OC)CCCC1 1512981813 DMZXBQJRHIHCHB-FQEVSTJZSA-N 441.620 4.476 10 10 IICE Cc1cc(CC(=O)N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)c(C)n1-c1ccccc1 1522403078 VISUIIBPVTTXLN-UHFFFAOYSA-N 435.955 4.161 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3csc(-c4ccc(Cl)s4)n3)C2)cc1 1528317552 LSTALVRLHIQUEH-CYBMUJFWSA-N 433.986 4.471 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1CCN(C(=O)OCc2ccccc2)C1 1539336429 IWRMDUNTTURZPD-QHCPKHFHSA-N 435.568 4.294 10 10 IICE COc1cc2c(cc1OC)CCN(C(=O)c1cccc(-n3c(C)cc(C=O)c3C)c1)CC2 1542282234 QJZSIEAVROJTEK-UHFFFAOYSA-N 432.520 4.165 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)CC(=O)N(C)[C@H](C)c3ccccc3)c2C)cc1 1556316615 FIPCGYGBOYFUEP-LJQANCHMSA-N 433.552 4.394 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccc(OCc3cc(C)no3)c(Br)c2)c1 1557554022 VPVLZWRTXRQOBZ-UHFFFAOYSA-N 431.286 4.269 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 1559832122 LHQJNCQFOCLILX-HSZRJFAPSA-N 449.517 4.145 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1565169459 MFOGFQLUBPNXCT-OAQYLSRUSA-N 444.620 4.464 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)c1 1565808313 DFDWKOYRSDRRTQ-UHFFFAOYSA-N 449.938 4.045 10 10 IICE CC[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)[C@@H](O)c1c(F)cccc1F 1566341272 CWVUJAPNPFWVAI-JTHBVZDNSA-N 426.463 4.427 10 10 IICE Cc1ccc(C(=O)N2CCC(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1584627718 HONHJWVBDHLCAU-UHFFFAOYSA-N 443.547 4.250 10 10 IICE CC[C@H](C)[C@H](C(=O)NCc1cc(C)n(-c2ccccc2)c1C)N1C(=O)c2ccccc2C1=O 1587885920 GQNFDEUFCOOZNZ-BXKMTCNYSA-N 443.547 4.421 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1614506001 ROALNDRVBMWJMN-UHFFFAOYSA-N 432.576 4.156 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c(C)n1-c1ccccc1 1623739216 LWYJQKMUJMNLIH-NRFANRHFSA-N 425.573 4.398 10 10 IICE COC(=O)CC[C@@H](Cc1ccccc1)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1624497394 JJRIEIXYSSQFSX-QHCPKHFHSA-N 432.520 4.201 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)cnc1Br 1625797988 QBSPIODOIJMQGB-UHFFFAOYSA-N 441.167 4.335 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2nn(C3CCOCC3)cc2C)cc1 1628565306 LMUCBZGXTSWZER-UHFFFAOYSA-N 448.567 4.465 10 10 IICE Cc1ccc(C(=O)N2CCC[C@@H](NC(=O)c3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1628672645 NUJHPYSSOSKGTK-XMMPIXPASA-N 443.547 4.250 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1C1CCOCC1 1630262290 JWTIMQDPLHDCTR-FQEVSTJZSA-N 445.991 4.210 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@]3(C)CC(c4cccc(Cl)c4F)=NO3)CC2)cc1 1632044196 GDCMKVMERIZROD-HSZRJFAPSA-N 445.922 4.156 10 10 IICE COC(=O)c1cn([C@@H]2CCCN(C(=O)c3cc(C)n(-c4ccc(C(C)C)cc4)c3C)C2)nn1 1632338275 LMLPIIINJPJPKP-OAQYLSRUSA-N 449.555 4.073 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCSc1ccc(OC)cc1 1637247477 QKPJGPWLFLEASB-UHFFFAOYSA-N 437.945 4.128 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(O)(c3c(F)cccc3F)CC2)c1 1639225768 XHCURAJKIZMVRT-UHFFFAOYSA-N 438.474 4.309 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1639453236 HSPLEUCQSJBOSW-QFIPXVFZSA-N 427.342 4.494 10 10 IICE COC1CCN(c2ccc(CN3CCCC[C@H]3CNC(=O)Nc3ccccc3)cc2)CC1 1642079892 HSPFIDJKHLVXKP-DEOSSOPVSA-N 436.600 4.478 10 10 IICE COc1cc([C@H](C)NC(=O)c2sccc2-n2c(C)ccc2C)ccc1S(C)(=O)=O 1648129008 YMUWYZKNNFQRGS-HNNXBMFYSA-N 432.567 4.059 10 10 IICE CCn1cc(C(=O)C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cn1 1650744338 WJKHHUFBKXNOQS-LJQANCHMSA-N 444.457 4.397 10 10 IICE CN(C)c1ccc([C@H](CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 1651821696 GUDZBFRLGBWSKC-INIZCTEOSA-N 445.476 4.247 10 10 IICE COc1ccc(N(CC(=O)N2CCN(Cc3ccsc3)CC2)Cc2ccccc2)cc1 1653734770 SQDYWQFUOOTSIT-UHFFFAOYSA-N 435.593 4.108 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H](C(F)(F)F)C4(CCOCC4)C3)cc2)CC1 1653845300 NJTQCJUVWKJHNY-OAQYLSRUSA-N 426.523 4.483 10 10 IICE CSc1ncc(I)c(N(Cc2ccc(N(C)C)cc2)C2CC2)n1 1655004647 UWLFGWPRVOWSNY-UHFFFAOYSA-N 440.354 4.038 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3CCCOc4cc(Cl)ccc43)C2)cc1 1670974013 ZNHXSGBFTWIQKP-IERDGZPVSA-N 429.948 4.388 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H]3c3ccc(OC)c(OC)c3)C2)cc1 1673822494 DYAUCKOHKXOETL-AVRDEDQJSA-N 439.556 4.085 10 10 IICE CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)o1 1684280787 QKPVWBFNEWBZNU-FDDCHVKYSA-N 425.573 4.486 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1706325809 PKYSONDEBLWOAJ-QGZVFWFLSA-N 448.662 4.025 10 10 IICE CO[C@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC1(C)C 1712078738 BTSXCAWWNYCNFQ-CVEARBPZSA-N 437.635 4.020 10 10 IICE Cc1ccc(-c2nnc(N(C)CC(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)o1 1724287713 HBXXHMRESZGBNK-UHFFFAOYSA-N 437.588 4.196 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1ccc(C)nc1 1727001688 IIMMLVVJYNAYOG-QGZVFWFLSA-N 438.551 4.018 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)C[C@H]2CCCCO2)cc1 1728382885 QSGKBBPBORATLH-PKTZIBPZSA-N 441.620 4.420 10 10 IICE CC[C@]1(C)CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1744255350 MSOYHVVSASMMNJ-XMMPIXPASA-N 443.661 4.083 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC(Cn3cccn3)CC2)cc1 1746092335 JDKZFPZPQRILDC-UHFFFAOYSA-N 449.647 4.484 10 10 IICE CCN(CC)CCCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1765017287 PYSZMEWSZVTJGY-UHFFFAOYSA-N 440.636 4.003 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCS(C)(=O)=O 1765669730 FGTLVKCJEOYEIK-UHFFFAOYSA-N 443.617 4.024 10 10 IICE Nc1ccc(OC(=O)Nc2ncccc2OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1 1858681635 JNGXFEPQZDXBCL-UHFFFAOYSA-N 446.385 4.311 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)sc2c1CCCC2 1859478980 RTLOHYYMOMQCJZ-DOTOQJQBSA-N 440.565 4.352 10 10 IICE CCC(=O)N1CCC(C(=O)Nc2sc(C)c(-c3ccc(C)cc3)c2C(=O)OC)CC1 1860626121 NLWTWRSSSPTKJO-UHFFFAOYSA-N 428.554 4.406 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccccc4OC)n(CC(C)C)n3)CC2)cc1 1862337940 AYXQBVVDMAPLJF-UHFFFAOYSA-N 448.567 4.186 10 10 IICE CCC[C@]1(NCc2c(Br)ccc(OC)c2O)CCN(C(=O)OC(C)(C)C)C1 2236054205 FZBOYJHSKAYBQH-FQEVSTJZSA-N 443.382 4.433 10 10 IICE O=C1NC(=O)N(c2ccc(O)cc2)C(=O)C1=Cc1ccc(OCc2ccccc2Cl)cc1 2297342104 TUOVSEAFTNPTRV-UHFFFAOYSA-N 448.862 4.291 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)ccc1O 2314827838 NIQGVQMUCLTAGZ-UHFFFAOYSA-N 428.535 4.021 10 10 IICE COc1cc(C=C2C(=O)N(c3ccccc3Cl)N=C2C(F)(F)F)cc(OC)c1O 2332147630 OQVBZQCBXKZKFA-UHFFFAOYSA-N 426.778 4.411 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cccc(Br)c2O)C[C@@H]2CCC[C@@H]21 2335120060 BPLXWEGFQABZPZ-QRTARXTBSA-N 425.367 4.422 10 10 IICE CCOc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCC2)cc1OCC 5098012 FJEIEWPHQBKEMH-JOCHJYFZSA-N 425.573 4.117 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2ccncn2)c(C)n1-c1ccc(OC(F)(F)F)cc1 754925051 QIJRETOCKFKBGD-BAQGIRSFSA-N 445.397 4.222 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3csc(-c4ccccn4)n3)cc2F)C[C@@H](C)O1 757964054 JMIGRJZMABRLNO-GASCZTMLSA-N 441.532 4.280 10 10 IICE CCOC(=O)c1csc(C2CCN(C(=O)NCc3ccc(N(CC)CC)cc3)CC2)n1 758420850 VBZQZFQMZLBJRC-UHFFFAOYSA-N 444.601 4.255 10 10 IICE COC(=O)c1ccc([C@@H](NC(=O)NCc2ccc(N3CCCC3)cc2)C(F)(F)F)cc1 776022684 OAIKNCAYDKRJLO-LJQANCHMSA-N 435.446 4.176 10 10 IICE CN1CCC[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1c1ccc(C(F)(F)F)cc1 779518652 LLMSEOAYRDHLTM-BANVCTIESA-N 434.458 4.329 10 10 IICE Cc1cc(Br)c(O)c(CNc2cccc(C(=O)N3CCCC[C@@H]3CCO)c2)c1 781634456 AIRFESJRBQGVSR-LJQANCHMSA-N 447.373 4.452 10 10 IICE CCN1CC[C@H](NCc2cccc(Br)c2O)[C@H]1c1cc(F)c(F)c(F)c1 782391236 JPEAAMSNYSVFQM-FUHWJXTLSA-N 429.280 4.497 10 10 IICE COC(=O)c1ccc(-c2csc(NS(=O)(=O)c3ccc4nc(C)sc4c3)n2)cc1 794001614 GVMKJWNVDUURGA-UHFFFAOYSA-N 445.547 4.316 10 10 IICE CC[C@H](C)C(=O)Nc1cccc(CNC(=O)NCc2cc(Br)ccc2O)c1 804971617 IMOZWBNXIIALFY-ZDUSSCGKSA-N 434.334 4.139 10 10 IICE CCn1ncnc1-c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1 1125893626 RZGOZUOOWYRBFL-UHFFFAOYSA-N 431.462 4.236 10 10 IICE COCC1(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCCC1 1129750173 IOSKTVAVGDEDAV-FOWTUZBSSA-N 438.640 4.053 10 10 IICE COc1ccc(C)cc1N1C[C@H](C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1131781591 FTIJVESUQJKHGV-JOCHJYFZSA-N 445.563 4.123 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCCCC[C@@H]1C(F)(F)F)c2[N+](=O)[O-] 1133873629 GAVPZZFWZASMCM-MRXNPFEDSA-N 446.381 4.317 10 10 IICE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)Cc1ccc(N2CCOCC2)cc1 1138499741 HBXCYOCNNOQRFO-UHFFFAOYSA-N 425.573 4.050 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@](C)(NC(=O)OC(C)(C)C)c2ccccc2)cc1 1164596919 FKTVOIJKJCBJLI-RUZDIDTESA-N 441.572 4.030 10 10 IICE COC1CCN(c2ccc(CN(C)CC3CCN(C(=O)OC(C)(C)C)CC3)cc2)CC1 1198761968 UHTORYBLMHYYJT-UHFFFAOYSA-N 431.621 4.381 10 10 IICE C[C@H](NC(=O)N1CCN(c2c(F)c(F)c(F)c(F)c2F)CC1)c1ccc(N(C)C)cc1 1226647151 PTAXWVXZKYRJBC-LBPRGKRZSA-N 442.432 4.041 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Br)ccc1Cl 1275224302 BUODMQKZTRRLND-UHFFFAOYSA-N 445.691 4.147 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)cc1)C1CCCCC1 1292257975 NGKVTCMEDXLLPD-FQEVSTJZSA-N 433.618 4.382 10 10 IICE COCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C 1315963130 DHPYBOGWYGSKJM-CJAUYULYSA-N 437.588 4.129 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(C(F)(F)F)c1F 1356422624 UMZFXAIXQGNUOP-UHFFFAOYSA-N 435.465 4.307 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCCOC3)C2)c(C)n1-c1ccccc1Br 1448546464 YTZKTTMFASEBMB-AOMKIAJQSA-N 447.373 4.267 10 10 IICE Cc1cc(CNC(=O)[C@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1454622750 CUVWANBOUPKNPJ-GHTZIAJQSA-N 441.572 4.471 10 10 IICE C/C(=C\C(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)Cc2ccc(F)cc21)c1cnccn1 1458091385 DNWGDNQNHZXMBZ-KMPOOHAWSA-N 426.492 4.191 10 10 IICE COc1cccc2ncnc(NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)c12 1458370084 RTMBGUATBLMZOX-IBGZPJMESA-N 437.544 4.382 10 10 IICE CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1469852958 CYNLXHJLTDXYMD-OWHZGTRUSA-N 437.632 4.459 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](c4cccc(Br)c4)C3)C2)cc1 1470773487 PNYFGUWKCBJJMB-PKOBYXMFSA-N 444.373 4.236 10 10 IICE C[C@H]1C[C@@]2(CC[C@@H](CNC(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)O2)CO1 1478529210 XGSDAWMMONZNQX-XPDMDZMYSA-N 435.996 4.102 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 1499765948 NFRYFZGSSZXRNJ-LPHOPBHVSA-N 443.592 4.188 10 10 IICE Cc1cc(OCCN2CCNC2=O)ccc1NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1523849920 TYMIAHDGVBAJMN-UHFFFAOYSA-N 432.524 4.059 10 10 IICE COc1ccc(C[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1OC 1527057960 OUFMCTAKUWBJDE-OAHLLOKOSA-N 429.472 4.297 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)Cc3ccc4c(c3)OC(F)(F)O4)ccc21 1530096448 SHJTUTYKNZWBIB-UHFFFAOYSA-N 430.451 4.498 10 10 IICE CS(C)(=O)=Nc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1531505278 YLZMFKBWXZRIDY-KRWDZBQOSA-N 437.512 4.046 10 10 IICE COc1ccc(N2CCN(C(=O)CCCOc3ccc(Cl)c(C)c3)CC2)c(OC)c1 1534278185 QJQRXKGKKNIXEH-UHFFFAOYSA-N 432.948 4.173 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Sc3nc4ccccc4s3)CC2)c(OC)c1 1534586602 FSFQSSLPDKMDDT-HNNXBMFYSA-N 443.594 4.143 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccc(F)cc4F)cc3)cc2)CC1 1536524254 PBNYHGDPOATFKF-UHFFFAOYSA-N 437.490 4.439 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCc3ccccc3NC(=O)OC(C)(C)C)C2)cc1 1538748028 XKKJTGRGWYVWFR-LJQANCHMSA-N 439.556 4.370 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1c(F)cc(F)cc1F 1539716391 AUIZQCROKSFFLF-CHHVJCJISA-N 440.443 4.473 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cn(-c2ccc(Br)cc2)cn1 1540729301 REHJLETYZSUISG-UHFFFAOYSA-N 425.330 4.165 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCc2nnc(C(F)F)o2)cc1 1543115144 ISBIGFHNXJKWDF-UHFFFAOYSA-N 430.455 4.248 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1547545942 NLYAVLJTSRFCSM-NRFANRHFSA-N 443.661 4.182 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC[C@H](C[C@H]4CCOC4)C3)nnc2C(C)(C)C)cc1F 1552836760 JLLFSGRDDNSDGN-UYAOXDASSA-N 443.611 4.472 10 10 IICE COCC1(Cn2c(N3CCCN(c4ccc(OC)cc4)CC3)nnc2C(C)(C)C)CCC1 1555306366 SZEAQQZMPSTIIS-UHFFFAOYSA-N 441.620 4.118 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@@H]1C 1557683453 LAJXDSQBBJUNES-SCLBCKFNSA-N 433.346 4.128 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2nc(-c3ccc(Br)cn3)cs2)cc1 1558979621 VIGICMRKXCFTHP-UHFFFAOYSA-N 431.275 4.382 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCCOc2cccc(Br)c2)cc1 1585444710 SAFSKFVOGAPPCB-UHFFFAOYSA-N 435.362 4.212 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](c3cccc(F)c3)N3CCOCC3)c2C)c1 1587880762 HWHWLHFTDBWZIC-RUZDIDTESA-N 435.543 4.231 10 10 IICE COc1cccc([C@H](C)CCCC(=O)N2CCN(c3ccc(OC)cc3OC)CC2)c1 1595996202 CEVSVKQBSRUIRO-LJQANCHMSA-N 426.557 4.335 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1597774728 OKAHTBOZIQBMTK-JYFHCDHNSA-N 435.568 4.150 10 10 IICE Cc1cc(C(=O)CSc2nnc(N(C)C)n2C(C)C)c(C)n1-c1ccc(Cl)cn1 1613539044 XILOUILZXRAQBI-UHFFFAOYSA-N 432.981 4.356 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)[C@H]1Oc1ccccc1 1625824291 YXTAEPGYSFHJAW-ISJGIBHGSA-N 432.520 4.261 10 10 IICE COc1cc(OC)c(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c(OC)c1 1626035487 UHKMFGYQCKGGHN-UHFFFAOYSA-N 436.508 4.171 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc3c(c2)N(C(=O)Cc2ccccc2)CC3)cc1 1628253567 VYZJPFXKOJMXGP-UHFFFAOYSA-N 427.464 4.233 10 10 IICE CCN1CCN(c2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc2)CC1 1628656174 STFOKUUICKEZOA-UHFFFAOYSA-N 430.552 4.301 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)cc2Cl)C1 1634720177 PVGRSEUAGSVIEX-IIBYNOLFSA-N 447.023 4.023 10 10 IICE COc1ccc(OC)c(CN(CCO)C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1637624418 QORNFQBASVEINT-UHFFFAOYSA-N 442.943 4.399 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@H](CC(C)C)C(N)=O)n2)c(C)n1-c1ccc(F)cc1 1638142018 KCDMPHYFOOCYLT-GOSISDBHSA-N 428.533 4.443 10 10 IICE CCOc1ccc(-c2nnc(S)n2CCC(=O)NCc2c(O)ccc3ccccc23)cc1 1639384655 OPZUKJORYKUUDZ-UHFFFAOYSA-N 448.548 4.198 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1C[C@H](OCc2ccccc2)C1(C)C 1686204525 FOMWWLTZTOJPTG-RPWUZVMVSA-N 437.584 4.049 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](c1ccco1)N(C)C 1698263423 BVXPWWPJNFNMNN-NRFANRHFSA-N 434.544 4.246 10 10 IICE C#C[C@]1(C)CCCN1c1nnc(-c2ccc(C#N)cc2)n1CCCSc1nccs1 1705670002 FCENJBVEOKOUNY-JOCHJYFZSA-N 434.594 4.448 10 10 IICE C=CCCCn1c(-c2cccc(C)n2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1705816639 NKRQKOSSALKZLK-UHFFFAOYSA-N 436.535 4.089 10 10 IICE CC1CCN(CCCCn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CC1 1708138940 GLZCOLDRNYXABI-JOCHJYFZSA-N 441.620 4.026 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1708362937 WKUPKQSZVDCASC-PFBKUSTMSA-N 444.620 4.336 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C3CCC2(C)CC3)n1Cc1ccc(N(C)C)cc1C 1708711329 JUMDJJBNLOHVDA-UHFFFAOYSA-N 438.620 4.141 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC)CCS1 1709323183 DUWLCAXALIJODM-FQEVSTJZSA-N 425.602 4.331 10 10 IICE CCC[C@@](C)(O)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727913172 JOLGSXHEGKTHTM-AREMUKBSSA-N 448.615 4.052 10 10 IICE CN(CC(C)(C)C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1729381348 CJKNDBDURHZFDG-UHFFFAOYSA-N 439.629 4.298 10 10 IICE CCc1nnc(N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)n1CCCSc1nccs1 1744523815 VNMRAHMIMBWYOU-MHTXLSKPSA-N 449.671 4.414 10 10 IICE Cc1nnc(N2CC[C@H](COCc3ccccc3)C2)n1CCCSc1nccs1 1751905412 QCEOQMIXIPSTSJ-IBGZPJMESA-N 429.615 4.269 10 10 IICE CC(C)[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCO1 1760967776 MLPYFIRNINZLQC-QFIPXVFZSA-N 425.621 4.159 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C1CC1 1764284286 VGGOVGFFBAPCEP-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC(=O)N1 1765752397 GIYNGTNGPVGXQK-HXUWFJFHSA-N 434.588 4.258 10 10 IICE CCO[C@@H](CCn1c(C2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)C(C)C 1767358688 ITNPJBXDEWXAFT-QHCPKHFHSA-N 441.620 4.332 10 10 IICE CON(C)c1nnc(COc2ccc(Cl)cc2)n1CCCSc1nccs1 1770252242 RNDNENZOECEIOC-UHFFFAOYSA-N 425.967 4.147 10 10 IICE CCCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1-c1ccc(OC)cc1 1862313406 WLYKGQYGHYHJQQ-UHFFFAOYSA-N 448.567 4.195 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C2(C)CC2)c(I)c1CO 2079952143 DNZWYRLBLGZANJ-KRWDZBQOSA-N 440.325 4.254 10 10 IICE CN(C)c1ccc([C@H](O)C2(COCc3ccccc3)CN(C(=O)OC(C)(C)C)C2)cc1 2248461223 RLHPFFJWMFNKRB-QFIPXVFZSA-N 426.557 4.240 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CCC(=O)N(C)Cc3ccccc3)C2=O)cc1 2295934195 DPNCGSYSIUCYJG-UHFFFAOYSA-N 440.590 4.335 10 10 IICE CC1=NN(c2ccc(Br)cc2)C(=O)C1=CNc1ccc(Br)cn1 2297453315 BNDGMTIUPZKOJR-UHFFFAOYSA-N 436.107 4.325 10 10 IICE CC(=O)c1cccc(-c2ccc(C=C3C(=O)NC(=S)N(c4ccccc4F)C3=O)o2)c1 2313559334 WQDDLPLHWIQQKQ-UHFFFAOYSA-N 434.448 4.120 10 10 IICE CCCC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)NCCSCc1[nH]cnc1C 2313681684 KVNRSXBWOWQXHQ-UHFFFAOYSA-N 427.574 4.026 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCCCCC4)C3=O)c2C)cc1F 8658662 WWQONAOCCKYEQL-UHFFFAOYSA-N 425.504 4.369 10 10 IICE O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(S(=O)(=O)N3CCCC3)cc2[C@H]2C=CC[C@H]21 14478044 OTHDFLUDLDVQNY-GSHUGGBRSA-N 425.510 4.206 10 10 IICE CCc1ccc(N2C(=O)/C(=C\c3ccc(OCC(=O)O)c(OC)c3)SC2=S)cc1 16915042 TYIWOAUGRFIKCA-WOJGMQOQSA-N 429.519 4.127 10 10 IICE CCOc1ccc(N2C(=O)/C(=C/c3ccc(OCCC(=O)O)cc3)SC2=S)cc1 210413039 APPYEQOQTZNMLF-AQTBWJFISA-N 429.519 4.345 10 10 IICE CC(C)C(=O)Nc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 435639489 YCVIMUQSSUOENI-UHFFFAOYSA-N 446.595 4.319 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cccs3)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526328698 OSAALSNOMLOACR-HXUWFJFHSA-N 425.462 4.234 10 10 IICE C[C@H]1[C@H](NCc2c(O)cccc2Br)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709436154 KVHYSLMUHGPSFP-NSNWQYSKSA-N 425.367 4.421 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NCc1cc(Br)cc(F)c1O 715812474 KQMAACBNJIRVBR-BLLLJJGKSA-N 431.346 4.467 10 10 IICE O=C(NCCc1ccc2ccccc2n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726612992 BHKFDFJLMKGQIU-UHFFFAOYSA-N 440.494 4.347 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccc(F)c(Cl)c2)cs1 727249553 ATHANUJEMIYQST-UHFFFAOYSA-N 444.893 4.400 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C\c2ccccc2OCC(F)(F)F)SC1=S 742346996 SPMSTXUOHQYEIJ-GXDHUFHOSA-N 433.473 4.474 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)Cc1coc(-c2ccc(S(C)(=O)=O)cc2)n1 761639643 AQPIGXPXVXYPHX-UHFFFAOYSA-N 439.581 4.367 10 10 IICE C[C@@H](NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccc(N2CCOCC2)cc1 764691274 BVMXQXRKVCVSRL-JPYJTQIMSA-N 437.588 4.273 10 10 IICE CC[C@H](NC(=S)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccs1 768297420 ZJKBJTSXLCVLLQ-NRFANRHFSA-N 428.671 4.396 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H](C)c2nc(O)c3ccccc3n2)C1 769665492 SVHRYEZQAVEGID-QGZVFWFLSA-N 444.535 4.361 10 10 IICE COc1cc(C)c(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1C 772613414 UEVKDCXIONGNFN-UHFFFAOYSA-N 437.462 4.489 10 10 IICE Cc1ccnc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(Br)c(C)c3)c2C)n1 795798915 NEPIFANDIDBREV-UHFFFAOYSA-N 442.313 4.303 10 10 IICE Cc1cc(Br)cc(CN[C@@](C)(CO)c2ccc(Br)cc2)c1O 809695267 FKRZOBKZXWWOAL-KRWDZBQOSA-N 429.152 4.223 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C[C@@H]2CCCO2)C(F)(F)F)C1 1130476013 YBPCSGVZBSXALV-HRAATJIYSA-N 437.506 4.024 10 10 IICE CSCC1CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC1 1134664420 VBQCIDPSHIOREB-ATVHPVEESA-N 438.615 4.019 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1135744381 AUDJIRGTFOMDOB-GHTZIAJQSA-N 445.604 4.396 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cccc(OC(F)(F)F)c4)CC3)CC2)cc1F 1137422671 HEBCWZYXBVRDJQ-UHFFFAOYSA-N 438.421 4.113 10 10 IICE CSc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1[N+](=O)[O-] 1137438245 JHNMXVZDYSGGJT-MRXNPFEDSA-N 435.933 4.070 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCNc2ncc(Cl)cc2Cl)c1 1141712581 QVKUQVUOVGSYJO-UHFFFAOYSA-N 431.323 4.450 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2cccc(CN3CCN(C)CC3)c2)c1C 1143650710 KATPUFAFZYBUHU-UHFFFAOYSA-N 430.596 4.080 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCNc1ccc(-c2ccccc2)nn1 1149394422 JIZIYGSAAOHMAK-UHFFFAOYSA-N 439.519 4.206 10 10 IICE COc1ccc(C[C@H]2CCCN(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)C2)cc1 1252117950 ZMIIDBQLJRWVKM-FGZHOGPDSA-N 437.584 4.194 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCO[C@H]2C(C)C)n1 1289919685 RJZIAOZCOFGPSP-OFNKIYASSA-N 435.572 4.442 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cccc(CS(=O)(=O)c2ccccc2)c1 1304089793 LTRWNOQHJZIECE-UHFFFAOYSA-N 431.513 4.449 10 10 IICE Cc1ccccc1Cc1nnc(N(C)[C@H]2CCOC2)n1CCCSc1nccs1 1304547560 PNTLIYRSXFSTEH-SFHVURJKSA-N 429.615 4.041 10 10 IICE COC(=O)[C@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@@H]1CCC[C@H](OC)C1 1307891993 DUKKNMSIBPACRN-FRGLQRNOSA-N 438.528 4.377 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCSC1)C(C)C 1313581877 JOEAWDSOVTXPPG-DEOSSOPVSA-N 439.629 4.455 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CC[C@H](F)C3)CC2)cc1F 1315512133 JGFVWSRBKGNXRE-SJORKVTESA-N 433.547 4.188 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)sc2c1CCCCC2 1354175306 ANJRPAWYLSIWIX-ZDUSSCGKSA-N 446.956 4.449 10 10 IICE CC(C)CCn1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1355738589 WIDZKESVZMMSHK-GHRIWEEISA-N 446.573 4.298 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](O)c2ccc(Cl)c(Cl)c2)cc1 1442617178 PGVFHRWHJSQSFZ-GHTZIAJQSA-N 437.367 4.301 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@H](c2ccccc2)c2ncc[nH]2)cc1 1450370419 CXRLAFJOXCZMLG-RUZDIDTESA-N 426.520 4.420 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(OCc2ccccc2)c(OC)c1 1451899843 FWGVYDAYIYXKHM-UHFFFAOYSA-N 449.503 4.185 10 10 IICE CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1458023942 YYNVLMNEXQXFQK-QGUKFAFCSA-N 441.660 4.312 10 10 IICE CCc1nc(N)nc(SCC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)n1 1459030606 GRPYZRTUALIWJN-UHFFFAOYSA-N 435.475 4.418 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(CC(F)(F)F)CC1 1460084425 BJDKHXJRWXGZQY-AWEZNQCLSA-N 444.453 4.453 10 10 IICE C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460739744 IAHZIORNQJVEPR-GFCCVEGCSA-N 445.293 4.192 10 10 IICE COCc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cnn1-c1ccccc1 1461971449 YOWHOBSWDUILQE-UHFFFAOYSA-N 428.536 4.399 10 10 IICE COc1ccc(C(=O)c2ccccc2C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1469280251 MFWKLBGLRFNKPT-IBGZPJMESA-N 444.531 4.191 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](C2CCCC2)C1 1472378313 ZONSBDZBDKTGTN-INIZCTEOSA-N 434.583 4.297 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@@H]2CC[C@@H](C)C2)c(C)n1-c1ccccc1 1510604259 UCOWPQXDWLUBJB-DBXWQHBBSA-N 448.615 4.489 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H]2C2CCC2)n1Cc1ccc(N(C)C)c(F)c1 1519297118 IQSACFNYOOBYQB-LAUBAEHRSA-N 445.583 4.024 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4ccccc4C)c3C(F)F)C2)cc1 1528318372 UYISNTLKBIEXJF-MRXNPFEDSA-N 426.467 4.136 10 10 IICE Cc1c(Br)cncc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1528583585 NUTDPXSOKKARQY-UHFFFAOYSA-N 440.288 4.153 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)sc2c1CCCCC2 1533785115 ZTNWXNIGQUINQZ-CQSZACIVSA-N 444.528 4.243 10 10 IICE COc1ccc(N2CCN(C(=O)C3(Cc4ccc(OC(F)(F)F)cc4)CC3)CC2)cc1 1534017183 IUYWMBNAWJUPBE-UHFFFAOYSA-N 434.458 4.265 10 10 IICE COC(=O)Nc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(Cl)c1 1534308613 FFXUDJYSFYZNCI-OKILXGFUSA-N 449.910 4.201 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1nc(C2CC2)cs1 1537026590 JIRACYKTDJFMIR-SXGWCWSVSA-N 448.566 4.494 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2nc3ccccc3cc2Br)N(C)C)cc1 1537482981 KIGKMUXVGLFBPH-HXUWFJFHSA-N 441.373 4.096 10 10 IICE Cc1ccc(-c2nnc(S)n2CC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1557887696 LAUWIKUTXLPIGE-UHFFFAOYSA-N 431.565 4.266 10 10 IICE Cc1cnc(C2(NC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CCOCC2)[nH]1 1558565229 GDKCZICHUIYLEB-UHFFFAOYSA-N 426.948 4.144 10 10 IICE CC[C@](C)(CCCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C1OCCO1 1566094805 PRIJOFMRNCMDEK-AREMUKBSSA-N 441.616 4.093 10 10 IICE CCOC(=O)C[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 1584035369 MSKZHRUNVBUEPY-JOCHJYFZSA-N 439.943 4.496 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(C)(C)n2cc(NC(=O)OC(C)(C)C)cn2)cc1F 1585698777 YTQHLROWSONHJV-UHFFFAOYSA-N 447.555 4.267 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1)C1CCCCC1 1597950479 LGSBIRIGPQBXIG-VWLOTQADSA-N 433.596 4.305 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)C(C)(C)N1CCOCC1 1610122719 LRQZQSQBRCONAZ-HXUWFJFHSA-N 449.517 4.409 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N[C@@H]1CCC[C@H](C)[C@H]1C 1613364728 TVJBNTKLBVYZEG-LZLYRXPVSA-N 429.586 4.374 10 10 IICE CCOc1ccc(N2CCN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)CC2)cc1 1623429814 OWMYKDJTIFEFOS-HXUWFJFHSA-N 433.593 4.063 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(C(=O)OC(C)(C)C)CCCO3)c2C)c1 1623964423 OPGABDPNWQHRTF-OAQYLSRUSA-N 441.572 4.158 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](O)COc1ccccc1Br 1629782983 HFSOVYCOJUJMLD-HNNXBMFYSA-N 449.370 4.088 10 10 IICE CC[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc2c(c1)OCCO2 1630760048 OJEJREQFGIOHIL-HSZRJFAPSA-N 432.520 4.488 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)CC3)cc2Cl)C1 1634720585 XQFXKBHTKGIAPY-GOSISDBHSA-N 427.980 4.003 10 10 IICE COc1cccc(Oc2ccc(C(=O)NCc3cccc(Br)c3O)nc2)c1 1635839450 DKWVTHZTWREABQ-UHFFFAOYSA-N 429.270 4.281 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3cccs3)n2)c(C)n1-c1cccc(Br)c1 1643529997 NJTALETZDNNNGR-UHFFFAOYSA-N 442.342 4.455 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)NCc2c(O)cccc2F)C1 1645050518 LGYBAIBKSDULBK-MSOLQXFVSA-N 448.922 4.452 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCCC4)C3)cc2F)C[C@H](C)O1 1653494990 MHDKQSLYHYUYAO-SFTDATJTSA-N 445.623 4.492 10 10 IICE CCOc1cccc([C@H](C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1657984165 AVJQAPGSDDKLQZ-INIZCTEOSA-N 428.488 4.150 10 10 IICE CC(=O)N(c1ccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1)[C@H]1C[C@@H]1C 1670258217 HQDRXIKZLAIPAM-RTFZILSDSA-N 437.540 4.367 10 10 IICE CC(C)(C)OC(=O)NCCC[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccccc1 1681653387 IFPXTJMOKUMTIA-FQEVSTJZSA-N 425.529 4.464 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2Cc2ncn(C)n2)c(C)n1-c1ccccc1 1692981926 ISQRWHBFEVRKNU-UHFFFAOYSA-N 432.576 4.012 10 10 IICE Cc1csc([C@@H](C)Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)n1 1693317304 HKRWHQWQWFKKDV-INIZCTEOSA-N 434.569 4.175 10 10 IICE CCc1nnc(N2CC[C@@]3(C)[C@H](C2)C3(Cl)Cl)n1Cc1ccc(N(C)C)c(F)c1 1694698422 UJKYRHAWCMYYGU-LPHOPBHVSA-N 426.367 4.114 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1Cc1ccnc(C(F)(F)F)c1 1711095726 WGLWLRPIUIIOAN-SFHVURJKSA-N 447.461 4.324 10 10 IICE COc1ccc(-c2nnc(N3CCC[C@@H](OC)C3)n2CCCSc2nccs2)cc1 1730080549 ADAKVEARZHVJJC-GOSISDBHSA-N 445.614 4.208 10 10 IICE COC(=O)[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C1 1769384679 QXRFJLSULVZVIS-FQEVSTJZSA-N 435.572 4.398 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CCc3ccsc3)CC2)cc1F 1770259513 VOJBOFWHDYJMAS-UHFFFAOYSA-N 443.592 4.255 10 10 IICE COc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccccn2)cc1C 1858055556 NHZJLSVRWUSFLR-UHFFFAOYSA-N 430.913 4.392 10 10 IICE O=C(O)[C@@H](Cc1ccc(O)cc1)N1C(=O)/C(=C\c2c(F)cccc2Cl)SC1=S 1858591955 DLPYNADYUZVDAG-INQNZLQJSA-N 437.901 4.082 10 10 IICE Cc1ccc2c(=O)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c2c1C 1866076198 PWNMDFRPERAVEG-XMMPIXPASA-N 446.595 4.168 10 10 IICE CCCCOCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CC2)C1=O 1873169649 DXSLYFNWUMVGGT-UHFFFAOYSA-N 435.568 4.133 10 10 IICE CCCN[C@H](c1ccccc1O)[C@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1942408365 OMNDHDVBWZQNJI-JTHBVZDNSA-N 427.589 4.458 10 10 IICE OCc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(Br)c1 2130156710 HFSACMPKIGIMRQ-GOSISDBHSA-N 429.280 4.195 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3cccc(O[C@H](C)C(=O)O)c3)SC2=S)cc1 2314932223 ULNWWMWAUZZIMB-CYBMUJFWSA-N 427.503 4.147 10 10 IICE CCOC(=O)CCCN1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 2314939421 KANRGDUJTWFWSH-UHFFFAOYSA-N 446.506 4.399 10 10 IICE CCc1ccc(Cc2cnc(NC(=O)CCN3C(=O)[C@@H](CC)SC3=S)s2)cc1 11635825 FECBVLAMHPBFPS-MRXNPFEDSA-N 433.624 4.264 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459461 WYXNXVSMICNEOM-RLSLOFABSA-N 435.568 4.299 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)c3ccc(C)c(C)c3)c3ccco3)CC2)cc1 38598104 BFZKLEQXSAXBLG-XMMPIXPASA-N 433.552 4.198 10 10 IICE CC1(c2ccccc2)OC(=O)C(=Cc2ccccc2OCc2ccc(C(=O)O)cc2)C(=O)O1 58833791 HSNHBKXUJKRCNB-UHFFFAOYSA-N 444.439 4.320 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3cc(Br)ccc3OC)CC2)cc1 108427459 KBKWPJHEAJGSFN-NYYWCZLTSA-N 445.357 4.218 10 10 IICE Oc1ccc(Br)cc1CNC1CCN(c2ccc(C(F)(F)F)cn2)CC1 110245060 FXBXELCUCVRURY-UHFFFAOYSA-N 430.268 4.327 10 10 IICE CC(=O)c1cccc(N2C(=O)/C(=C/c3ccccc3OCCC(=O)O)SC2=S)c1 210438701 ZTCKTPLXWUEXRQ-PDGQHHTCSA-N 427.503 4.149 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccccc3CC)=NC2=O)ccc1OCC(=O)O 210461393 GEHQRPLFDBRQOC-UNOMPAQXSA-N 426.494 4.194 10 10 IICE Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1C(=O)NC(C)C 435857850 YJAIPOABZMMGSD-UHFFFAOYSA-N 446.595 4.493 10 10 IICE CS(=O)(=O)N(Cc1cccc(Cl)c1)c1cccc2c1C(=O)c1ccccc1C2=O 586185703 CPEWFMVLLBQUPJ-UHFFFAOYSA-N 425.893 4.082 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C[C@@H](C)c3cccc(C(F)(F)F)c3)CC2)cc1 737817962 CUWGGHVTOPABQU-GOSISDBHSA-N 449.517 4.146 10 10 IICE O=C(Cn1c(-c2cscn2)nc2ccccc21)N(Cc1ccccc1O)C[C@H]1CCCO1 751294868 RNMXZHPCTVZFLI-GOSISDBHSA-N 448.548 4.073 10 10 IICE COC(=O)c1ccc(-c2nc(COC(=O)c3csc(Cc4ccc(N)cc4)n3)co2)cc1 751931264 OYCVWRPVWFFNDU-UHFFFAOYSA-N 449.488 4.115 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCO[C@@H]2c2c(C)nn(-c3ccccc3)c2C)c1 753205222 ABJHRNVZSYJPTA-CCQPRUGESA-N 435.524 4.158 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cc(C(=O)OC)oc3C)n2)c1C 754692723 BFFCDKNIXWPMIJ-UHFFFAOYSA-N 437.543 4.127 10 10 IICE Cc1nccn1-c1ccc([C@H](C)NC(=O)NCc2cccc(Br)c2O)cc1 765538416 PLAQEVKYRUHMRV-ZDUSSCGKSA-N 429.318 4.209 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@H](C)C(=O)c2c[nH]c3ncccc23)C1 769662367 AKUJTWIXOBDHFJ-QGZVFWFLSA-N 444.535 4.099 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)[C@@H](O)c1ccc(OCc2ccccc2)cc1 773766450 MAYYXSZATXKYGK-BVZFJXPGSA-N 449.547 4.484 10 10 IICE Cc1cc(C(=O)COc2c(Cl)cncc2[N+](=O)[O-])c(C)n1-c1ccc2c(c1)OCO2 795245041 KFFQNQBTLXPKNA-UHFFFAOYSA-N 429.816 4.041 10 10 IICE CC[C@H](CSC)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1127579546 QNZFHRHOUWLXMR-YLQKULKDSA-N 426.604 4.017 10 10 IICE CC(C)(F)c1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)no1 1135374014 URPRXVBANDHJBG-UKTHLTGXSA-N 437.493 4.248 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 1135914801 QMRXUFGZHLJQJK-YGOYIFOWSA-N 433.596 4.495 10 10 IICE CC(C)c1cccc(-n2cc(O)c(C(=O)NCc3cccc(Br)c3O)n2)c1 1139975304 ZWLGKLNOIVUSNM-UHFFFAOYSA-N 430.302 4.099 10 10 IICE Cc1nn(Cc2ccc(C(=O)NCc3c(O)ccc4ccccc34)cc2)c(C)c1[N+](=O)[O-] 1157041957 QZCFWYHCHJXZAJ-UHFFFAOYSA-N 430.464 4.245 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C[C@H]2CCCCO2)sc(C)c1-c1ccccc1 1167137778 GEOVFXNQGSRESU-GOSISDBHSA-N 430.570 4.340 10 10 IICE CC(=O)NCCN(Cc1ccsc1)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1234327792 QRVQWAVQSFTJSG-UHFFFAOYSA-N 438.597 4.312 10 10 IICE CCc1c(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)nnn1-c1ccc(OC(C)C)cc1 1264414231 VMMHBHGTXRYHLI-UHFFFAOYSA-N 447.583 4.488 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC([C@@H]3CCOC3)CC2)nnc1C(C)(C)C 1289427672 WYVAMYXCPHQXLA-OAQYLSRUSA-N 425.621 4.251 10 10 IICE CCCSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1289600902 UQQHJCPVSGCLFM-FQEVSTJZSA-N 430.574 4.196 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC[C@@H](C)N(C)C(=O)OC(C)(C)C)c2C)cc1 1293241579 RRDOXRHWLRPCSP-MRXNPFEDSA-N 429.561 4.478 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](CO)c2ccc(Br)c(F)c2)cc1 1298595264 QDVRMAJISVBJAF-HXUWFJFHSA-N 431.305 4.459 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3ccc(F)cc3F)CC2)c(C)n1-c1ccccc1 1313099487 DLTPKLVVWJHQCT-UHFFFAOYSA-N 438.522 4.447 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2COc3cccc(Br)c3C2)cc1 1313197350 KPBPIGKLZXUGGU-QGZVFWFLSA-N 446.389 4.440 10 10 IICE Cc1ccc(C(=O)N2CC[C@@H](c3ccc(F)cc3)[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1O 1451049201 RBWIKUPEUZXWGO-PKOBYXMFSA-N 444.503 4.068 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4c(Br)cccc4[nH]3)C2)cc1 1452035279 ZDFCFIGJRZEJOT-AWEZNQCLSA-N 428.330 4.195 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)cc(C(=O)OC(C)(C)C)c3)CC2)cc1F 1465930610 YMJMILKTZUIBBB-UHFFFAOYSA-N 428.504 4.060 10 10 IICE C[C@@H]1CN(c2ccc(NC(=O)c3c(F)ccc(O)c3O)cc2C(F)(F)F)C[C@@H](C)O1 1472501775 HDIHABWQSXYHBA-GHMZBOCLSA-N 428.382 4.122 10 10 IICE C[C@H](N1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1)C(F)(F)F 1478527429 CBDWORVLCFXHRV-CVEARBPZSA-N 446.945 4.354 10 10 IICE CCOCc1nnc(N2CCCc3sccc3C2)n1Cc1ccc(N(C)C)c(F)c1 1503088523 HHRHPXUKWPTJDD-UHFFFAOYSA-N 429.565 4.082 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(C(=O)N4CCCC4)n3)cc2Cl)C1 1519552736 ZKVZKESJQADELC-QGZVFWFLSA-N 440.975 4.137 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccccc3C)c2C(F)(F)F)cc1 1527595508 MIYYFXPLBDKKMC-UHFFFAOYSA-N 446.473 4.417 10 10 IICE COc1ccc(-c2nn(CC(=O)N(C)Cc3ccc(N4CCCCC4)cc3)cc2C=O)cc1 1540543526 QSUGSTVOZPCDNN-UHFFFAOYSA-N 446.551 4.020 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCOC1CCOCC1 1541326122 XQKWBVHEYDXODE-UHFFFAOYSA-N 441.620 4.224 10 10 IICE Cc1ccc(C(=O)Nc2cccc(Cn3cccnc3=O)c2)cc1-n1c(C)cc(C=O)c1C 1544657592 CCEPEBAQIZUUQK-UHFFFAOYSA-N 440.503 4.072 10 10 IICE C[C@@H]1CCC[C@@H](N(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1612743093 GNTZWLSSIUTUAC-NVXWUHKLSA-N 431.635 4.332 10 10 IICE COc1ccc(N2CCCN([C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)CC2)cc1 1615219176 CXABPXFUTJFYKQ-NRFANRHFSA-N 434.367 4.320 10 10 IICE Cc1cc(C(=O)N2CC(Oc3ccccc3)C2)c(C)n1-c1ccc(Br)cn1 1615645562 UZKFWTGZQYUTCF-UHFFFAOYSA-N 426.314 4.155 10 10 IICE CN(CCC1CCOCC1)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1618207255 HJRCXHPXHUCEKO-UHFFFAOYSA-N 444.630 4.232 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2c(Cl)nccc2s1 1631533846 IIXNWQOLVCPODG-UHFFFAOYSA-N 425.293 4.124 10 10 IICE CCOC(Cn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cn1)OCC 1635126831 PDQHMHMBNMETPY-QGZVFWFLSA-N 448.995 4.102 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](CC(=O)OC(C)(C)C)C3)ccc21 1635359568 KYSFKUHHQOAKQY-IBGZPJMESA-N 428.573 4.489 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](CC)N(C)C(=O)OC(C)(C)C 1635489461 ZBKYZHMUJBMFRC-FQEVSTJZSA-N 449.592 4.021 10 10 IICE O=C(C[C@@H]1CCc2sccc2C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635945742 AQWGNOCUXBVNBY-YOEHRIQHSA-N 432.973 4.023 10 10 IICE COc1ccccc1O[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 1636262466 HIQKFSLFNJOKBV-DENIHFKCSA-N 425.573 4.254 10 10 IICE Cc1cc(=O)n(CC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)cc1[N+](=O)[O-] 1640999483 SYMSIVMHAQMZMB-UHFFFAOYSA-N 444.285 4.118 10 10 IICE Cc1cc(C(=O)Cn2cc(Cl)cc([N+](=O)[O-])c2=O)c(C)n1-c1ccc(F)c(Cl)c1 1643781055 OASFCTCCZCAAQM-UHFFFAOYSA-N 438.242 4.493 10 10 IICE CSc1ccccc1[C@H](C)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1645429028 SBQKOLOUTVAOFN-HNNXBMFYSA-N 430.529 4.473 10 10 IICE CN(C)[C@@H](CNC(=O)NCc1c(O)ccc2c1CCCC2)c1cccc(C(F)(F)F)c1 1680362105 QHUCPBGNQHZMBM-FQEVSTJZSA-N 435.490 4.392 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1 1696404121 HAOSHXIOFSWIAH-UHFFFAOYSA-N 437.588 4.394 10 10 IICE Cc1ccc(CN(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)s1 1724337092 FRUKWHSCHAILFI-UHFFFAOYSA-N 439.629 4.467 10 10 IICE Cc1ccc(SCc2nnc(N3CCOCC3)n2CCCSc2nccs2)cc1 1724463640 YSXUZATVEWXAQJ-UHFFFAOYSA-N 447.655 4.354 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N(C)CC(F)(F)F)cc1 1728384050 IRVVALHQWYCNAJ-UHFFFAOYSA-N 449.525 4.033 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1750280999 FHINYYXWAPDCII-UNMCSNQZSA-N 443.661 4.317 10 10 IICE CC[C@@]1(C)CC[C@H](Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)O1 1762426334 LRGSUYCNKCPNOA-DVECYGJZSA-N 445.583 4.224 10 10 IICE COc1ccc(-n2ncc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c2C)cc1 1859616359 BUPBAJWIUOQYOK-UHFFFAOYSA-N 437.455 4.217 10 10 IICE COc1cc(C(=O)N(c2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)ccc1[N+](=O)[O-] 1859892020 ULSMCTFIRGBRGT-UHFFFAOYSA-N 444.443 4.434 10 10 IICE COCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccccc2)C1=O 1873165742 SIXCDACCKKHBJZ-UHFFFAOYSA-N 443.547 4.000 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)ccc2O)C[C@@H]1C1CC1 1895873455 GSHPMNVMBFVTHW-DLBZAZTESA-N 425.367 4.422 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2cccc(Br)c2O)C1 1952539164 UBSUCJILWRODLQ-PBHICJAKSA-N 434.286 4.329 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C(C)(C)C)c(C(=O)O)c2I)cc1C 2080011792 FWURYTDCZSCZAZ-LLVKDONJSA-N 442.297 4.415 10 10 IICE O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1cccn1-c1ccc([N+](=O)[O-])cc1 2297320915 CIQUSMISRISDEP-UHFFFAOYSA-N 443.246 4.154 10 10 IICE COc1ccc(C2=CC(=Cc3ccc(OC)c(I)c3)C(=O)O2)cc1 2313510646 ZIACZRBTQCTZBV-UHFFFAOYSA-N 434.229 4.290 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(Cl)c(Cl)c3)N=C2C)ccc1OCC(=O)O 13426989 AZONHSHELNPFGQ-AUWJEWJLSA-N 435.263 4.272 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S 206447260 VIYQNLNOJXCUAC-XMHGGMMESA-N 427.547 4.420 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CCN(c4cccc(OC)c4)C3)ccc21 486221885 ZDTAPZJUGBZUOD-HXUWFJFHSA-N 435.568 4.169 10 10 IICE COc1ccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cc1F 729110652 XHHSLZFBCHFKTA-UHFFFAOYSA-N 432.420 4.484 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 743670709 LIDBQEXSNPYISZ-OAQYLSRUSA-N 426.561 4.160 10 10 IICE O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)N(Cc1ccco1)Cc1ccccc1O 757763120 NFYUYVSCXUGRTJ-QGZVFWFLSA-N 426.904 4.024 10 10 IICE CCOC(=O)c1csc(C2CCN(Cc3cccc(Br)c3O)CC2)n1 763497124 HSSWUVAPYGYXOR-UHFFFAOYSA-N 425.348 4.168 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc(CNC(=O)OC(C)(C)C)cc3)c2)CC1 770151650 ANBVCIXDEBATNX-UHFFFAOYSA-N 438.572 4.106 10 10 IICE CC(C)CN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCCc2cccnc21 776116727 BWPBRAFDNAMVCT-HSZRJFAPSA-N 440.563 4.303 10 10 IICE O=C(Cc1cc(C(F)(F)F)cc(Cl)n1)N(Cc1ccccc1O)C[C@H]1CCCO1 788663888 ZOCJPQMWYWTJMZ-MRXNPFEDSA-N 428.838 4.210 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CCO[C@@H]2c2cnn(Cc3ccccc3)c2)C2CC2)cc1 798377036 IVSASMMISXYLSR-IZZNHLLZSA-N 444.579 4.266 10 10 IICE Cc1nc([C@@H]2CCCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 814679480 GPWLYBFKRDJICR-TZIWHRDSSA-N 443.613 4.233 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1 857433505 FHNBJDNTIRZADO-OAQYLSRUSA-N 436.383 4.091 10 10 IICE CCOc1ccccc1C(=O)NCCCC(=O)NCc1cc(C)n(-c2ccccc2)c1C 1132263168 AFJRTDJHMSNSGV-UHFFFAOYSA-N 433.552 4.319 10 10 IICE CC(C)(NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@H]1CCCCO1 1132742627 ZTWZVIGIXSQHPD-UGEDRFTOSA-N 438.640 4.193 10 10 IICE Cc1cc(C(=O)N2CCOc3cc(F)ccc32)c(C)n1-c1ccc(Br)cn1 1146700136 QOEICFBXGLQELU-UHFFFAOYSA-N 430.277 4.430 10 10 IICE CCCOc1c(OC)cc(CCNC(=O)c2cc3cc(O)c(O)cc3s2)cc1OC 1158295805 VEXFFQVMDVGOHB-UHFFFAOYSA-N 431.510 4.091 10 10 IICE C[C@@H](NC(=O)NCc1ccc(Br)c(Br)c1)c1ccccc1O 1255830968 ZDWFDVSSRZNBCN-SNVBAGLBSA-N 428.124 4.478 10 10 IICE COC(=O)[C@]1(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CCCC(C)(C)C1 1279802788 NNKOAJZJBMQRFO-SANMLTNESA-N 439.600 4.036 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC(C(F)(F)F)CC2)cc1F 1298056973 ZMRZHFXFMTVMNJ-UHFFFAOYSA-N 448.468 4.372 10 10 IICE COCC(C)(C)N1CCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CC1 1299674995 GSYORQHVGCUXOK-UHFFFAOYSA-N 448.405 4.039 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)[C@H](O)c3cc(Cl)cc(Cl)c3)C2)cc1 1300632694 BRVOUWRVBRCYER-YLJYHZDGSA-N 437.367 4.457 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)O[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1302986376 LUNVENXHJWSFBF-OYRHEFFESA-N 425.621 4.375 10 10 IICE CC(C)(C)OC(=O)[C@@H]1CC(C(=O)NCc2c(O)ccc3ccccc23)=NN1c1ccccc1 1304090149 YQIHFGZCTOHVFK-QFIPXVFZSA-N 445.519 4.138 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1305192697 QWELXCMXTXKDFR-GOSISDBHSA-N 436.579 4.390 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@](C)(O)[C@@H](C)CC 1305384744 VEAQXTQSEHTCFY-ZYLNGJIFSA-N 443.636 4.062 10 10 IICE CC[C@H](c1ccccc1OC)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307813332 ZISUYSQXANZFMF-HSZRJFAPSA-N 442.515 4.492 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CCn1cc(Cl)cn1 1314736020 FGOUIGYOPGNNGE-UHFFFAOYSA-N 442.011 4.362 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(C(=O)OC(C)(C)C)cc3)cc2F)C[C@@H](C)O1 1350933503 OCZPFKGDBBGOSO-IAGOWNOFSA-N 442.531 4.325 10 10 IICE Cc1cccc(-c2cccc(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2)c1 1351133431 BVIICLADBDATIB-XMMPIXPASA-N 427.548 4.294 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1 1351163712 RROHRGMNZZAKEC-UHFFFAOYSA-N 438.549 4.126 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1 1354389992 ZWOPLSZGXXEAMH-JOCHJYFZSA-N 431.536 4.037 10 10 IICE CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1359816814 MZYNXPKUFVLZQW-XOBRGWDASA-N 434.005 4.106 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(C(F)F)nc2n1CCCC2 1360045674 QQIVJHGDLUEIEG-UHFFFAOYSA-N 440.441 4.157 10 10 IICE Cc1cccc(CNC(=O)c2ccc(C(=O)NCc3ccc(N4CCCC4)cc3)cc2)c1 1441191165 YUOPFQUXLZVOSR-UHFFFAOYSA-N 427.548 4.455 10 10 IICE CC(C)(C)OC(=O)N[C@](C)(C(=O)NCc1cc(Cl)ccc1O)c1cccc([N+](=O)[O-])c1 1452936799 RWGMXGABENLZPY-NRFANRHFSA-N 449.891 4.010 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCC[C@@H]2N2CCOCC2)c(C)n1-c1cccc(Cl)c1 1455642235 UWJKOAPYBUWDPT-CVDCTZTESA-N 429.992 4.368 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)N4C)cc2Cl)C1 1459584047 OVEOFXKUVAXAOQ-JKSUJKDBSA-N 440.975 4.283 10 10 IICE Cc1cccc(N2CCN(CCCNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1463872253 KJUFNYVMQWEJNY-UHFFFAOYSA-N 444.623 4.274 10 10 IICE Cc1ccc(C(=O)NCCNc2ccc(C(F)(F)F)cn2)cc1-n1c(C)cc(C=O)c1C 1464527454 FSWXAVPTCPPVSI-UHFFFAOYSA-N 444.457 4.471 10 10 IICE CN(c1ccc(CNC(=O)CCNC(=O)N2CCc3ccccc3C2)cc1)C1CCCCC1 1464534551 DLWSFICVSPEATO-UHFFFAOYSA-N 448.611 4.230 10 10 IICE Cc1ccc(C(=O)NCc2ccc(OCCCN(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1464853154 FICPLRZETJBAFF-UHFFFAOYSA-N 447.579 4.476 10 10 IICE COc1ccccc1[C@@H](CO)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1466357046 NDMXCYBZCYXWAJ-HXUWFJFHSA-N 443.341 4.329 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(CCc4ccccc4)CC3)c2C)c1 1479099837 PVSDVCMJZHPVJX-UHFFFAOYSA-N 430.596 4.472 10 10 IICE CC[C@H](C)c1nnc(N2CCC(OC(C)C)CC2)n1Cc1ccc(N2CCOCC2)cc1 1495499334 OBOBCDAKCPDXRT-FQEVSTJZSA-N 441.620 4.070 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)cn2C)n1C[C@H]1CC1(C)C 1503487461 LBCLFKBCFUNGGE-OAHLLOKOSA-N 444.377 4.434 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)O1 1524586164 IKLSGODATJWWQG-DOVSJBTNSA-N 430.932 4.071 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1 1525762974 VMQIFDSONCQKTC-MRXNPFEDSA-N 426.948 4.444 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)c(C)n1-c1ccc(Br)cn1 1545035098 KDUHTOCWWRYXQJ-MOPGFXCFSA-N 445.405 4.339 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCS(=O)(=O)c3ccccc3C2)c1 1556298326 HLNSAGWQZTZFAP-UHFFFAOYSA-N 428.941 4.177 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](CC)Cc1cccc(Br)c1 1557115390 UJOMMEGQGYNFOX-QGZVFWFLSA-N 448.357 4.315 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc4c3[C@H](C)CC4(C)C)CC2)cc1 1558473144 RFEAXCMKJYLIKS-JXOMPUQVSA-N 447.579 4.324 10 10 IICE COc1ccc(N(CCC(C)C)CC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cc1 1559809694 KCUZMVWLSSSITM-UHFFFAOYSA-N 440.512 4.183 10 10 IICE Cc1cccc(C2(NC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CCCC2)c1 1564895562 MOSMMMRFJUBWHK-UHFFFAOYSA-N 429.511 4.379 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(N2C(=O)CCC2=O)cc1 1597566758 AKBNZDDQUXEJKX-GOSISDBHSA-N 428.488 4.449 10 10 IICE Cc1cc2c[nH]nc2cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1611505668 ZISXTAKNDQAJNT-NVMNQCDNSA-N 440.525 4.240 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@@H](COC)O[C@H](C)C2)cc1 1615381555 YMOWOYJVBLJNLO-KNQAVFIVSA-N 443.636 4.001 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)CCN(C(=O)c1ccc(N=NC(N)=O)cc1)CC2 1626059446 ZWOXFTCHBIDGLG-UHFFFAOYSA-N 429.521 4.102 10 10 IICE COC(=O)c1cccc(Cc2cnc(NC(=O)c3cc4cc(O)c(O)cc4s3)s2)c1 1627602450 XSHPVESTNICGLG-UHFFFAOYSA-N 440.502 4.399 10 10 IICE Cc1nc([C@@H](NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)c2cnn(C)c2)no1 1628637354 OJDBHGTYUZYVSL-QFIPXVFZSA-N 432.528 4.162 10 10 IICE Cc1nc(-c2cccs2)c(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)s1 1630288256 UPAWXMLCQQSMGD-UHFFFAOYSA-N 427.595 4.000 10 10 IICE CC[C@H](Cc1cccc(Br)c1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1633790114 XPHFCUQECZNUGI-LJQANCHMSA-N 445.401 4.295 10 10 IICE Cc1ccc(NCCCNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c([N+](=O)[O-])c1 1634046267 CAXKCUMRHYIZPJ-UHFFFAOYSA-N 434.496 4.355 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CO[C@H]1CCCc2ccccc21 1634384647 HJRDXDAHVIAKMA-DEOSSOPVSA-N 438.568 4.469 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCCCN1Cc1ccccc1 1635940748 ILNJASHYBJIORR-GOTSBHOMSA-N 442.003 4.181 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3C(=O)c3ccc(F)cc3)C2)cc1 1639684116 ULEBCFQOYVISCM-GOSISDBHSA-N 432.495 4.322 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCC(O)CC2)cc1 1642976396 BELIQXFFMORUKD-UHFFFAOYSA-N 431.492 4.399 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]2C(F)(F)F)sc(C)c1-c1ccccc1 1658864140 IRXMBJKNQSVZST-CQSZACIVSA-N 426.460 4.475 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(CCN(C)C(=O)OC(C)(C)C)C(C)C 1673745491 UZTZCZCCTJCEMM-LJQANCHMSA-N 434.625 4.279 10 10 IICE CC(C)NC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1680561322 BYPCYEIIIPLXTF-PKOBYXMFSA-N 435.012 4.023 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC2(c3ccc(Br)cc3)CC2)N(C)C)cc1 1684607890 WWZYPDGVTBSKQK-HXUWFJFHSA-N 445.405 4.106 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3c(OC)ccc4ccccc34)CC2)cc1F 1685108901 DFMFJFVHEFYSEO-UHFFFAOYSA-N 437.515 4.070 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(CCc3ccc(C)cc3)C[C@H]3CCCO3)C2)cc1 1687022869 IIJJAWRBWDLVBM-WIOPSUGQSA-N 437.584 4.016 10 10 IICE CC(C)OCCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1692617901 YFHGKQRQNUHBSK-TZIWHRDSSA-N 430.593 4.354 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@](C)(O)c1ccco1 1696685134 WHTATOYXAQBKFN-RUZDIDTESA-N 437.588 4.313 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCCC1 1697979305 FXGGYHBLQWLHGM-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1710026102 XIBPWUSHBCYQKC-AUSIDOKSSA-N 434.588 4.096 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1 1712364094 SOEBIDMTOSPTOD-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3noc4c3COCC4)nnc2N(CC)C(C)C)cc1 1728379963 MMYPHJGWOMEDTO-UHFFFAOYSA-N 438.576 4.135 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1730432074 RAKZSCPPFXYFMN-IBGZPJMESA-N 437.588 4.250 10 10 IICE Cc1cccc(CN(C)c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)c1 1742124430 BPHWFDKOZFQREZ-SFHVURJKSA-N 429.615 4.366 10 10 IICE CCCO[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1 1745837600 OGSAWUCMDUCYKG-QHCPKHFHSA-N 441.620 4.072 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(CCNCc2cc(Br)ccc2O)C1 2140330475 QYNAJBNMKKFTFR-QRWLVFNGSA-N 425.367 4.282 10 10 IICE CC[C@H]1CC[C@H](NCc2c(Br)ccc(OC)c2O)CN1C(=O)OC(C)(C)C 2236056598 XBDSVNKDRBVZMT-KBPBESRZSA-N 443.382 4.431 10 10 IICE CCCCN1C(=O)C(=CC=C2N(C)c3ccc(C(=O)OC)cc3N2CC)SC1=S 2295148753 HPEBQTMWBXBRDE-UHFFFAOYSA-N 431.583 4.135 10 10 IICE CCCCCCOc1ccc(C=C2SC(=S)N(CCC(=O)OC)C2=O)cc1OC 2314729080 UWJCGYYOBSHXIC-UHFFFAOYSA-N 437.583 4.419 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccccc3)C2=O)ccc1O[C@@H](C)C(=O)O 2314934645 JFRZRUWPIKLCCS-AWEZNQCLSA-N 443.546 4.339 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@H](NCc1cc(Br)cc(F)c1O)C2 2358587672 OUCWRXNCLXMEIM-PBFPGSCMSA-N 443.357 4.419 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)ccc1OCCC(=O)O 16919560 BTOOEORROBCTKD-LDADJPATSA-N 447.509 4.484 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C\c2ccccc2OCc2ccccc2)SC1=S 206469729 ZDXMAZUJVVRRHT-XMHGGMMESA-N 427.547 4.420 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc4cnn(C)c4c3)no2)C1 561895466 XMGSZDMJDLRYPR-UHFFFAOYSA-N 426.524 4.393 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@@H](NCc1cccc(Br)c1O)C2 701066795 SQQKKKOJQLQOFH-VDGAXYAQSA-N 445.357 4.434 10 10 IICE O=C(NCCc1coc(-c2ccc(F)cc2)n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 726710932 ZTGLXKDICTXISL-NRFANRHFSA-N 439.487 4.120 10 10 IICE CS(=O)(=O)c1ccc([C@@H](O)CN2CCCc3cc(OCc4ccccc4)ccc32)cc1 734485528 LTXQIVZZLZPJGK-VWLOTQADSA-N 437.561 4.155 10 10 IICE C[C@@H](NC(=O)N[C@H]1COc2c1ccc(Cl)c2Cl)c1ccc(N2CCOCC2)cc1 745779034 MGEWAAJNPXPTKI-ACJLOTCBSA-N 436.339 4.324 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Br)cc1 770993090 SGVRKOCULQRBBD-OAHLLOKOSA-N 449.364 4.359 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc([C@H]2CCCOC2)cc1 780656034 DPVXTQFCOWDVGI-UGKGYDQZSA-N 428.960 4.334 10 10 IICE COc1cc(C)c(S(=O)(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1C(C)C 788598729 JLZWDHOOCRSWBW-GOSISDBHSA-N 432.586 4.003 10 10 IICE Cc1cc(/C=C2/SC(=S)N(CCN3CCOCC3)C2=O)c(C)n1C1CCCCC1 814274482 ORNIZADAZCBPEZ-HMMYKYKNSA-N 433.643 4.144 10 10 IICE COCCn1c(C)c(C)c2cc(-c3nc([C@H]4CCC(=O)N(CC5CCC5)C4)no3)ccc21 856557983 BUVLYGYDLFVHME-FQEVSTJZSA-N 436.556 4.461 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccccc1SCC(=O)NC(C)C 1129815047 RZKMKXHWMZTLEF-GOSISDBHSA-N 427.614 4.039 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1135689326 BUAZCWUIYWYBKZ-HXUWFJFHSA-N 433.499 4.255 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)NCc1ccc(N3CCSCC3)cc1)O2 1141803941 PJAKPSADHKYXBG-VWLOTQADSA-N 440.609 4.271 10 10 IICE O=C(Cc1ccc(OCc2ccncc2)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1151903589 OULKQFDXGAHQCF-DEOSSOPVSA-N 432.520 4.117 10 10 IICE CCOC(=O)c1sc([C@@H]2CCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)C2)nc1C 1153397548 ODMDBDIQXSHAOY-QGZVFWFLSA-N 438.553 4.060 10 10 IICE CN1CCCc2cc(CNc3ncnc4c3c(Br)nn4C(C)(C)C)ccc21 1162285950 MZVJGHVJENIUQL-UHFFFAOYSA-N 429.366 4.338 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cccc(COc4cccc(C=O)c4)c3)C2)cc1 1166215754 KRCDPILYZYSDAB-QFIPXVFZSA-N 430.504 4.095 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(CC(F)(F)F)C3)cc2Cl)C1 1270439128 JRLMPSHQVMNGJK-NVXWUHKLSA-N 431.930 4.467 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)cc1 1278289151 UWWQEFAUIJDYRG-UHFFFAOYSA-N 432.568 4.494 10 10 IICE COCCC1(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2ccccc2O)CCCCC1 1301484187 NRWRGANWODREBV-HXUWFJFHSA-N 428.577 4.111 10 10 IICE CC[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1312994932 PZNUATAPCVFYSI-OALUTQOASA-N 446.389 4.357 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@H](C)C1)OC 1315795316 JVXPZIYXMWKMDO-HMFYCAOWSA-N 437.588 4.106 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc([C@@H](C)C(F)(F)F)cc3)CC2)cc1 1349005917 RVBBPGAFGBRFIJ-GOSISDBHSA-N 449.517 4.303 10 10 IICE CSc1ccc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)CC2=O)cc1 1355635634 JDNZNWVCIMMVIU-LJQANCHMSA-N 425.598 4.265 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CN(Cc4ccccc4)C[C@@H]3C)ccc21 1438328085 NAMYMENANWWMAE-CYFREDJKSA-N 433.596 4.402 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(CN2CCCCC2)o1 1448688111 VGMPGTRIKNBHSQ-UHFFFAOYSA-N 441.572 4.268 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCC2(CNC(=O)OC(C)(C)C)CC2)c1 1452858834 WLJZLOXAGOUHJC-UHFFFAOYSA-N 439.556 4.331 10 10 IICE CCC(CC)(NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 1459662369 FOFFGIVVOXUABO-QHCPKHFHSA-N 446.035 4.137 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1469433886 ISMZSMJNDAOSEF-NSHDSACASA-N 446.693 4.096 10 10 IICE C[C@H]1C[C@H](c2ccccc2F)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786006 FCEDIIOFOAHTNL-YCRPNKLZSA-N 433.474 4.233 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1C[C@H](c2ccccc2)CO1 1478981035 RSYRKDJDDGRZSL-HKUYNNGSSA-N 433.346 4.259 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)[C@@H]1CCSC1 1510671797 GUWNVGJSPTYBQB-LJQANCHMSA-N 443.020 4.358 10 10 IICE CCN(CC)Cc1nc(C2(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)CCCC2)no1 1516612461 SOHZKZGIWSCCPR-UHFFFAOYSA-N 449.599 4.447 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccccc2N=S(C)(C)=O)C1 1521614403 KHKLXFCSSKSMMS-UHFFFAOYSA-N 438.597 4.406 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)sc2c1CCCCC2 1525382004 GDLURXPIGSZRFQ-LBPRGKRZSA-N 448.491 4.073 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1=O 1527594363 AOJXWVMHYILWDP-PMACEKPBSA-N 437.584 4.156 10 10 IICE O=C(CCc1nccs1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1537251047 FHSNZOGZNXOHBN-UHFFFAOYSA-N 428.315 4.187 10 10 IICE CC[C@H](Cc1ccccc1Br)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1538747693 UKPJLKZJZBCTEF-SJLPKXTDSA-N 431.374 4.422 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(Br)c(F)ccc2[nH]1 1539302611 VJYMEFSLYOFBOB-UHFFFAOYSA-N 446.320 4.178 10 10 IICE COc1cc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)ccc1N1CCCC1=O 1539713635 RMYNPNSZLSHUIM-UHFFFAOYSA-N 431.492 4.294 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@@H](N2CCCC2)C1 1542226953 NRWUYCQFPNYEQQ-HSZRJFAPSA-N 438.664 4.354 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(F)(F)F)C2)c(C)n1-c1cccc(Br)c1 1544152738 AYOJGUWYQBYSMM-MRXNPFEDSA-N 431.252 4.260 10 10 IICE CC(=O)Nc1cccc2c1CCCN2C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1544930199 VRAVGTAVCCWRBS-UHFFFAOYSA-N 429.520 4.387 10 10 IICE CCC[C@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1546876851 RKMLNLKYHFPWCW-KRWDZBQOSA-N 441.599 4.266 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)CC(C)C 1558487860 ZRZPPNZBRJBYIY-RUZDIDTESA-N 426.557 4.181 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3nccc(C(F)(F)F)n3)cc2Cl)C1 1564649454 DEBLPAPTHMPAQR-ZDUSSCGKSA-N 441.885 4.385 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1 1565606573 BZKWRUGVVBLWOA-UHFFFAOYSA-N 433.552 4.165 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)Cc3cnn(Cc4ccccc4)c3)ccc21 1587573125 YFPHMDVBGZJVHK-UHFFFAOYSA-N 430.552 4.422 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(N4CCN(C)CC4)c(C)c3)c2C)cc1 1587917752 QZOIYKOHACWYNA-UHFFFAOYSA-N 432.568 4.415 10 10 IICE CN(C(=O)c1cc2cc(O)c(O)cc2s1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1597008466 SWNJENLBYGYLEJ-YIONKMFJSA-N 432.542 4.315 10 10 IICE CN(c1ccc(CNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)cc1)C1CCCCC1 1597949122 AEFWLLJSYUOCCQ-UHFFFAOYSA-N 432.568 4.250 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1603318212 ZEENLXXHLOOIRA-UHFFFAOYSA-N 425.602 4.059 10 10 IICE CC[C@H](C)[C@@H](Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1613137246 BSBQAMWEMDBBBA-WMZHIEFXSA-N 441.620 4.332 10 10 IICE Cc1ccc(C(=O)N2CCC[C@H](c3nncn3C(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1616710141 SYKXHIQKQBQQIV-NRFANRHFSA-N 433.556 4.407 10 10 IICE Cc1ccc(NCCCNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c([N+](=O)[O-])c1 1628380603 NABSTMGJAGGBIP-UHFFFAOYSA-N 448.523 4.284 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC1CCN(CC(F)(F)F)CC1 1629968730 LEDXLRINPQJMOK-UHFFFAOYSA-N 437.300 4.168 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(O)c1 1631434297 ODUAVFITTCBUGE-NRFANRHFSA-N 426.900 4.487 10 10 IICE COc1ccc(N2CCN(CCNC(=O)CCCSc3ccc(Cl)cc3)CC2)cc1 1631443343 YUBNXMOUEIKHFG-UHFFFAOYSA-N 448.032 4.159 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1631845510 RKBFMCXUWJMDRB-JOCHJYFZSA-N 434.515 4.198 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC3(CCOCC3)CO2)c(C)n1-c1cccc(Br)c1 1632325169 XPFIXZZXMXEHEN-LJQANCHMSA-N 447.373 4.172 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2(Cc3ccccc3)CCOCC2)cc1 1635532944 GOEULXMMMXOWQO-UHFFFAOYSA-N 430.548 4.357 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2cccc(C)c2)cn1 1637247468 QGEXDORCXHXXPK-UHFFFAOYSA-N 440.883 4.357 10 10 IICE COC(=O)/C=C/c1ccc(N2CCCC[C@@H]2c2ncc(Br)cn2)c([N+](=O)[O-])c1 1652248684 LGLSPQWLEKGZAC-IQIBNGDESA-N 447.289 4.065 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)cc1C 1696556839 ZTPFZEIMCXQRAH-GOSISDBHSA-N 439.633 4.126 10 10 IICE CCN(CC)[C@@H](C)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1710010594 IZKJNBWUNUNHPM-NRFANRHFSA-N 447.631 4.307 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCCOCC(F)F 1711095308 IERHWAAVKDCCNB-UHFFFAOYSA-N 437.878 4.007 10 10 IICE C[C@@H]1CN(c2nnc(CC3CC3)n2CCCSc2nccs2)C[C@H](C(F)(F)F)O1 1726715027 OGRUBCDCQSCNHN-TZMCWYRMSA-N 447.552 4.026 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1727904702 ZCXJVJIPGDNPKI-CLOONOSVSA-N 437.588 4.129 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1743446317 SLLFDRYPZYJYQH-KOSHJBKYSA-N 439.629 4.455 10 10 IICE CCC(CC)[C@H](Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N(C)C 1743993158 HZIDMZWCHHQLKJ-RBBKRZOGSA-N 429.609 4.228 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)C3CCCCC3)n2Cc2ccc(N(C)C)c(F)c2)n1 1762410124 AEGYXKJJWLNLSI-UHFFFAOYSA-N 439.583 4.162 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCSC(C)C 1763747454 FWCKFOMEOBFEIJ-QGZVFWFLSA-N 435.613 4.408 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCC(=O)N3)nnc2N(C)C2CCC(C)CC2)cc1 1766612002 YWPOCRPMRPOUMK-ZOGYUUGASA-N 438.620 4.139 10 10 IICE CCOC(=O)[C@H](NCCCN=[N+]=[N-])c1scc(Br)c1Br 1912198649 JDNVXVVZKRRPRO-SECBINFHSA-N 426.134 4.167 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C3CCC3)c(CO)c2I)c(O)c1 2079013490 LPLSTHHIVKOPOT-SFHVURJKSA-N 438.309 4.261 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]3CC[C@@H]32)c1O 2236048106 YCDHLAUOJXBAEV-WQVCFCJDSA-N 441.366 4.041 10 10 IICE COc1cc(C=C2SC(NC(C)=O)=NC2=O)cc(Cl)c1OCc1cccc(F)c1 2293497322 XWMZUBFJXUDDHJ-UHFFFAOYSA-N 434.876 4.173 10 10 IICE CCN1C(=O)C(=Cc2c(Sc3ccccc3)nc3ccc(C)cn3c2=O)SC1=S 2296703969 BYKFWOOVYVIDMJ-UHFFFAOYSA-N 439.587 4.375 10 10 IICE CCN1C(=O)C(=Cc2cc(Br)cc(Br)c2OC)SC1=S 2313533031 NYXLQFHNMCEEFM-UHFFFAOYSA-N 437.178 4.441 10 10 IICE CCCC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cc(C(=O)OC)ccc1C(=O)OC 2313681566 ICFQGCHQSVTBER-UHFFFAOYSA-N 435.480 4.149 10 10 IICE O=C(CN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccc(Cl)cc1 2314828109 QLCZOCVSDHNPIC-UHFFFAOYSA-N 433.898 4.088 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccs2)SC1=S)NCc1nc2ccccc2s1 2314913674 SEQRJSODDQDNAX-UHFFFAOYSA-N 445.616 4.266 10 10 IICE CN1CCCc2cc([C@@H](CNC(=O)COc3ccc(Cl)cc3)N3CCCCC3)ccc21 9137377 MHAJJVVCACWGRK-XMMPIXPASA-N 442.003 4.445 10 10 IICE COc1cc(N2CCCC2)c(OC)cc1/C=C1\NC(=O)N(c2cccc(Cl)c2)C1=O 33333174 FCLMQVQZZHAGMW-YVLHZVERSA-N 427.888 4.055 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)c(C)n1-c1ccccc1 62694158 FPUJMFPMSGCMNF-UHFFFAOYSA-N 449.982 4.317 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 226845672 ZWDZWAUVKNZVHK-YVHKJVDXSA-N 443.525 4.157 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(F)c(F)c3)[C@H]2c2ccc(O)c(O)c2)c1 526541474 KYICAJTZERFECP-NRFANRHFSA-N 425.387 4.442 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccc(Cl)s2)cs1 727241924 MITWMEXJVFBZCW-UHFFFAOYSA-N 432.932 4.322 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)c3cc([N+](=O)[O-])cnc3C)c2C)c1 730014627 FJJGWVHFPZMQRT-UHFFFAOYSA-N 439.493 4.467 10 10 IICE C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)NCc1ccc(N2CCSCC2)cc1 746750813 CGYBKPIWHOXCSU-OAQYLSRUSA-N 438.641 4.046 10 10 IICE Cc1c(Cl)cc(S(=O)(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1[N+](=O)[O-] 748862753 URQDBMDSOOAZAW-UHFFFAOYSA-N 437.949 4.368 10 10 IICE Cc1cc([C@@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)ccc1F 752454798 BPHPZGTWDFGHEU-CYBMUJFWSA-N 432.407 4.309 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@@H]2[C@H]2CNC(=O)C2)c(C)n1-c1cccc(C(F)(F)F)c1 764462142 JYVDRRNDXAZNAA-DYESRHJHSA-N 447.501 4.286 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(S(C)(=O)=O)cs2)cc1 767458256 RKFIHQGYLFWEAY-UHFFFAOYSA-N 444.578 4.073 10 10 IICE C[C@@H](c1ccc(Cl)cc1)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 917011263 UXTGLPSSCLFWBB-KURKYZTESA-N 447.982 4.402 10 10 IICE COCc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1128563244 QVICGNBKCOCWLL-PDGQHHTCSA-N 430.526 4.202 10 10 IICE O=C(N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cc2cc(O)c(O)cc2s1 1136803666 HSXWSGBEEQEURK-OAHLLOKOSA-N 436.455 4.336 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCCC23OCCO3)c(C)n1-c1ccc(Br)cc1 1137748364 YHCXWJMVZWLCOB-IBGZPJMESA-N 433.346 4.272 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(COc3cccc(C=O)c3)c2)cc1 1164597317 JUDUXNXOJTWFEW-UHFFFAOYSA-N 432.520 4.295 10 10 IICE Cc1cc(CC(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)c(C)n1-c1ccccc1 1264289027 FGQKFHVTXAUZJJ-QFIPXVFZSA-N 431.536 4.184 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC=CCC1 1299205634 WJEMIXXGTYIAIJ-OAQYLSRUSA-N 446.599 4.281 10 10 IICE CC(C)(C)OC(=O)N1CCc2cc(C(=O)NCc3ccc4cccnc4c3O)sc2C1 1299723995 BAIWEMZUPFBMAN-UHFFFAOYSA-N 439.537 4.225 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1CSC 1316105615 HISMGRBPUGCKKC-HXUWFJFHSA-N 425.602 4.331 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3csc(-c4ccccc4)n3)cc2F)C[C@@H](C)O1 1350934084 XVCXEGALCUAUDL-HZPDHXFCSA-N 425.529 4.493 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cc(S(C)(=O)=O)c(Cl)cc2Cl)C2CC2)cc1 1353228328 HYTMUOFKSHGSQB-UHFFFAOYSA-N 441.380 4.268 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)cc1 1437384260 JXYJNIZBUPKIRJ-UHFFFAOYSA-N 440.975 4.288 10 10 IICE Cc1ccc(C(=O)NC[C@H](O)c2cccc(OC(C)C)c2)cc1-n1c(C)cc(C=O)c1C 1445680255 RHTQUHGMZPGFRG-VWLOTQADSA-N 434.536 4.466 10 10 IICE Cc1cc(N2C[C@@H](C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2=O)ccc1Br 1459185509 NSAKWXYWBNVCCT-WBVHZDCISA-N 444.373 4.054 10 10 IICE C[C@H]1CN(C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)c2cc(Br)ccc2O1 1459595601 XUNOZXIQMYMXRM-WFASDCNBSA-N 437.334 4.177 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCC(=O)Nc2nnc(C3CCCCC3)s2)cc1 1464304304 YSIIBWXETJFASU-UHFFFAOYSA-N 443.617 4.467 10 10 IICE O=C(Cn1nc(C(F)(F)F)c2c1CCCC2)N(Cc1ccco1)Cc1ccccc1O 1465840940 LWFOIEUAMYYSRJ-UHFFFAOYSA-N 433.430 4.308 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(Cc3cccnc3)Cc3ccccc3C)C2)cc1 1470774149 WUADQFXTTPYYAX-HSZRJFAPSA-N 430.552 4.389 10 10 IICE COC1CCN(c2ccc(CN[C@H](CCO)c3ccccc3Br)cc2)CC1 1473375587 SUOHZDHELRQVOZ-JOCHJYFZSA-N 433.390 4.278 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(CC)CCCC1 1516589931 UBKBFYJOCVBRKS-UHFFFAOYSA-N 445.583 4.259 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCOc3ncc(Cl)cc3Cl)ccc21 1518338015 ACENPNSIUSLUBE-UHFFFAOYSA-N 436.339 4.415 10 10 IICE Cc1cc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c(C)n1-c1ccccc1 1523243606 XRWWZJQQLVHJJF-UHFFFAOYSA-N 439.581 4.304 10 10 IICE C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1523638144 AFDPHMUCDZUEIZ-HSALFYBXSA-N 437.584 4.412 10 10 IICE CSc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1525630801 NXAZZMFGGNMUKV-SDNWHVSQSA-N 433.555 4.173 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn(Cc3ccccc3)c2Br)cc1 1527396990 XGAIQCPASYQKJN-UHFFFAOYSA-N 441.373 4.470 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Oc2cccc(F)c2)cn1 1528260945 BEWGEAKNNPYDCP-UHFFFAOYSA-N 443.425 4.058 10 10 IICE CC(C)c1noc2nc(C3CC3)cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c12 1537483280 NXXRLFAMFMIYCT-NRFANRHFSA-N 435.572 4.322 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCCc3ccc(Cl)c(Cl)c3)cc2)CC1 1537840185 VTBAKMQAPINORI-UHFFFAOYSA-N 448.394 4.334 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)c2ccc(OC(F)(F)F)cc2)N(C)C)cc1 1539708045 VRPLTXCMEMATPM-FQEVSTJZSA-N 437.506 4.348 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(F)(F)c1ccccc1Br 1540458324 JIMPAEFOJZYHSQ-UHFFFAOYSA-N 439.300 4.036 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 1543591869 RUHXNKZZGVODIR-OAQYLSRUSA-N 425.529 4.031 10 10 IICE CCOc1ccc(-c2nc(C)c(C(=O)N3CCN(c4ccc(OC)cc4)CC3)s2)cc1 1544746336 VLGDPFVLMRGDLG-UHFFFAOYSA-N 437.565 4.488 10 10 IICE CCOC(=O)C1=C(CSc2ncc(-c3ccccc3)n2C)NC(=O)N[C@H]1c1ccccc1 1559341777 CCMMHKQROVVKED-NRFANRHFSA-N 448.548 4.051 10 10 IICE COC(=O)C[C@@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 1585761244 OWLIMCMNQBRPAO-XMMPIXPASA-N 439.943 4.280 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)OCc1cnc(C2CC2)o1 1596761686 ZTHFWHDAUMQUBM-CXUHLZMHSA-N 432.498 4.026 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NCCc1cccc(Cl)c1Cl 1616180969 SXFUNGCZUSNTGZ-GOSISDBHSA-N 437.367 4.039 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(C(F)(F)F)c3O)cc2F)C[C@H](C)O1 1626159320 VWZJVEMEKWMGBW-STQMWFEESA-N 426.410 4.094 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)cc1 1627158922 KBSXEKYYXLEJAD-HXUWFJFHSA-N 431.536 4.172 10 10 IICE COc1ccc(CCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1OC 1635945962 DMYOVJCNVLUWNN-FQEVSTJZSA-N 446.975 4.166 10 10 IICE CCOC(=O)c1cccc2nc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)[nH]c12 1637114776 RYOFXDZOEGKQGT-UHFFFAOYSA-N 430.464 4.212 10 10 IICE Cc1cc(C(=O)Nc2n[nH]c3nc(O)ccc23)c(C)n1-c1cccc(Br)c1 1637989791 LITOODQYRSDVCL-UHFFFAOYSA-N 426.274 4.086 10 10 IICE Cc1c(I)cccc1NC(=O)c1cc2cc(O)c(O)cc2s1 1638310645 JFVFWWDQUPTAEG-UHFFFAOYSA-N 425.247 4.478 10 10 IICE Cc1cc(C(=O)N2CCOc3cccc(Br)c3C2)c(C)n1-c1ccccn1 1639185684 GBIPMNDVMHESKK-UHFFFAOYSA-N 426.314 4.286 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](OCC1CCCC1)c1ccccc1 1639587991 NQLUTWUDRQFEFP-DEOSSOPVSA-N 425.525 4.232 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1639684272 WNHAIALPMPZYHW-OAQYLSRUSA-N 445.563 4.480 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1csc(-c2ccc(Cl)cc2)n1 1641201094 QDGHBWRMMSYSQO-UHFFFAOYSA-N 427.957 4.355 10 10 IICE C[C@@H](NC(=O)c1ccccc1SCc1nnnn1-c1ccccc1)c1ccccc1O 1642824317 PWBJCEATHLAIIS-MRXNPFEDSA-N 431.521 4.151 10 10 IICE Cc1cccc(-n2nnnc2SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)c1C 1652574544 KTYCGQQUNFPPQA-UHFFFAOYSA-N 436.516 4.196 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCCOc4cc(Cl)ccc43)C2)cc1 1670974014 ZNHXSGBFTWIQKP-IIBYNOLFSA-N 429.948 4.388 10 10 IICE CC[C@]1(C(=O)OC(C)(C)C)CCCN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)C1 1682188066 FMKDOEVXOVTDJY-DFBJGRDBSA-N 445.604 4.065 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1692100443 IBAFOPAKTIJLSP-LJQANCHMSA-N 443.611 4.373 10 10 IICE CCC[C@@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1695163108 PYTYGXVIORRXQJ-XMMPIXPASA-N 448.615 4.164 10 10 IICE CCOC[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1696363915 GGASQGLLDNEWGF-IBGZPJMESA-N 431.600 4.373 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1709480662 OMOYIDDHDDUOKG-LJQANCHMSA-N 449.647 4.443 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2nccs2)cc1 1710028496 ZKAHKMJOUJFTJR-LJQANCHMSA-N 426.590 4.117 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1CCCN(C)C1CCCCC1 1711095127 BLVGHRVRODYESU-UHFFFAOYSA-N 448.615 4.261 10 10 IICE Cc1nc(Cc2nnc(N3CCC(F)(F)CC3)n2Cc2ccc(N(C)C)cc2C)cs1 1742577673 MXETXORSUNGJPU-UHFFFAOYSA-N 446.571 4.292 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1ccc(Cl)s1 1742755088 CHCOSQUUPXZVSC-UHFFFAOYSA-N 431.993 4.017 10 10 IICE CC(C)CN1CCC[C@H](Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1761116837 OQCJRWSUBIBAFF-REWPJTCUSA-N 441.620 4.230 10 10 IICE C[C@@H]1CCCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1762860245 PCKUFEGXUBCSOG-HXUWFJFHSA-N 425.621 4.378 10 10 IICE CCCCN(C)c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1764039241 VVPIPWFACXMDJO-UHFFFAOYSA-N 438.620 4.035 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(COC)CC1 1766576387 INXLZDRBLWVYNQ-UHFFFAOYSA-N 435.572 4.172 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1772858952 XRJCWILNDLUPPJ-QGZVFWFLSA-N 432.576 4.154 10 10 IICE O=C1C(=Cc2cc3ccccc3nc2N2CCOCC2)SC(=S)N1Cc1ccccc1 2040503199 MKWXLAKWKAIETD-UHFFFAOYSA-N 447.585 4.473 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2060619999 UJSPYAYJXPYYHJ-YSIASYRMSA-N 445.564 4.424 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@](C)(CN)COCc1ccccc1 2074326579 WKYZRKOKPTVXLN-AREMUKBSSA-N 439.600 4.398 10 10 IICE COc1cc(Cl)cc(CN[C@@H](CNC(=O)OCc2ccccc2)C(F)(F)F)c1O 2090346566 BFFICYFWVHKQQJ-INIZCTEOSA-N 432.826 4.001 10 10 IICE O=C1NC(=S)SC1=Cc1cc([N+](=O)[O-])ccc1OCCOc1ccccc1Cl 2297335380 BIVIUWZUBISFCC-UHFFFAOYSA-N 436.898 4.195 10 10 IICE CN1C(=O)C(=Cc2cn(Cc3ccc(Cl)cc3Cl)c3ccccc23)C(=O)NC1=S 2313656698 ZWXZWAPJULBEFT-UHFFFAOYSA-N 444.343 4.253 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccccc3OC)SC2=S)cc1 2314831656 PJSCMAGIEQZQQK-UHFFFAOYSA-N 442.562 4.324 10 10 IICE O=C(CCN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)Nc1ccccc1C(=O)O 7016894 WJQXZAFRSDOXCD-KZIJLOKPSA-N 438.530 4.171 10 10 IICE COc1ccc(N2CCN(c3cc(C(=O)NCCC(C)C)c4ccccc4n3)CC2)cc1 23330372 ZFBKYFKHYQHWBI-UHFFFAOYSA-N 432.568 4.346 10 10 IICE CN(C)c1ccc(/C=C2/S[C@]3(C(=O)Nc4ccccc43)N(c3ccc(O)cc3)C2=O)cc1 206590053 JSOFTMXDNWGVIX-WNRWPCNTSA-N 443.528 4.384 10 10 IICE CC(=O)N1CSC[C@H]1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 747369903 IIXUTNUVWQUQIS-IBGZPJMESA-N 444.557 4.217 10 10 IICE O=C(NCCc1cc(F)ccc1F)NC1CCN(c2ccc(OC(F)F)cc2)CC1 747513196 RKGUPAAQWCMLPA-UHFFFAOYSA-N 425.426 4.077 10 10 IICE CN(Cc1ccc(Cl)c(F)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769050734 SFGRUUZCEZMOPG-UHFFFAOYSA-N 444.982 4.353 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](O)c2cc(F)cc(Cl)c2)C1 787815646 FCQZGYLYGWKEEO-HSZRJFAPSA-N 443.950 4.050 10 10 IICE O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)N(Cc1ccccc1O)C[C@H]1CCCO1 788755211 DMNAOLYYDOBTSS-BEFAXECRSA-N 426.410 4.367 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cc(OC(F)F)cc(OC(F)F)c1 804735823 GFOZAAJCYYKNRE-UHFFFAOYSA-N 438.171 4.288 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)NCc3cc(Br)ccc3O)cc2)C[C@H](C)O1 806246203 SZDQDYLNMFANKD-KBPBESRZSA-N 434.334 4.090 10 10 IICE COc1ccc(N2CCCN(Cn3nc(C(C)C)n(Cc4ccco4)c3=S)CC2)cc1 917488006 ZBXPGAFNQNOFAT-UHFFFAOYSA-N 441.601 4.357 10 10 IICE Cc1nn(C)c(C)c1CCNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 918082989 NFCKRKYIZXILJN-UHFFFAOYSA-N 429.362 4.179 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(N2CCCCCC2)cc1 1129549485 MXGUDZKLNIDLSY-UHFFFAOYSA-N 429.511 4.112 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3csc(-c4ccc(Cl)cc4)n3)cc2)CC1 1132898826 GHPBYGBHGOEOMS-UHFFFAOYSA-N 426.973 4.145 10 10 IICE CC1(C)CO[C@@H](CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1 1134542301 PLEQDPBDZTWWHL-AWEZNQCLSA-N 429.318 4.303 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1C[C@]1(C)c1cccc(Br)c1 1135732772 GEMGTHBBCJUKJN-FYYLOGMGSA-N 443.385 4.222 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@@H](O)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1137700519 RQFUXIBDIVUDON-IAGOWNOFSA-N 445.279 4.384 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](CO)Cc1ccccc1Br 1138222681 GFXPXHFJCHQAKN-INIZCTEOSA-N 447.398 4.499 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 1146232982 OPEGMOGADIMQRN-UHFFFAOYSA-N 428.876 4.424 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1cccc(OC2CCCC2)c1 1299700099 XTUZIOMCNIXUBD-UHFFFAOYSA-N 425.525 4.238 10 10 IICE CCOC(=O)[C@@H](CC1CC1)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1303321943 VSSYYPYMQRSQCR-LJQANCHMSA-N 433.346 4.318 10 10 IICE Cc1cccc(N(C)c2nnc(C(=O)NC(C)C)n2CCCSc2nccs2)c1 1304240620 LRMHLTOVYRAAIV-UHFFFAOYSA-N 430.603 4.132 10 10 IICE Cc1cc(N(C)C)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1356338832 DRHCNOXHSBBPLR-CPNJWEJPSA-N 443.569 4.430 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1451666059 HEFDCIMBDFJOET-APWZRJJASA-N 439.547 4.001 10 10 IICE CN(C(=O)OC(C)(C)C)c1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)s1 1453983817 NCAUBLJMXJPUDF-UHFFFAOYSA-N 445.585 4.011 10 10 IICE COC(=O)c1cn(-c2cccc(NC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)c2)nn1 1460010375 YLLUEKGMTBXOBO-UHFFFAOYSA-N 449.898 4.367 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C=C/c3ccccc3OCc3ccccc3)cc2)CC1 1462487957 QGXZYPBLXLLGNW-DTQAZKPQSA-N 441.575 4.347 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H](CO)Cc3ccncc3Cl)c2C)c1 1467677560 PQGXABZLDLPRHS-LJQANCHMSA-N 425.960 4.340 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2ccccc2n1Cc1ccncc1 1467764441 RGXNTPRBXASFLH-UHFFFAOYSA-N 436.309 4.483 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(CN4CCN(C)CC4)cc3)c2C)c1 1471012111 CQMQDFQTYATGTJ-UHFFFAOYSA-N 430.596 4.080 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)C2CC2)cc1 1478832504 ADIAGJQHBYZCTR-RTBURBONSA-N 430.593 4.120 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1504963863 ODXLOQKEQBIJFC-MSOLQXFVSA-N 447.599 4.128 10 10 IICE Cc1cc(-c2nnc(N(C)CCn3cccn3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1510624654 XGDMGRBDCHUGOK-UHFFFAOYSA-N 443.477 4.248 10 10 IICE COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1514852666 GHNTUAMTRHLPPG-IBGZPJMESA-N 447.579 4.398 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)CCCC1 1515298362 RHLSVNOJTMXPGG-NMEJYPJZSA-N 438.593 4.486 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/c3ccc4cc(OC)ccc4c3)CC2)c(OC)c1 1534596458 QUAVYEFNJIBRAU-VZUCSPMQSA-N 432.520 4.228 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@@H](c2ccccc2)C1 1535474863 POMQOCKBRDSHJS-SQVRNEIYSA-N 440.565 4.433 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)c1cccc(OC)c1 1539228431 REIQWWCPUNCKOS-NRFANRHFSA-N 426.900 4.400 10 10 IICE Cc1ccc(Nc2scnc2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1542113210 RIICBGFALXWXJW-UHFFFAOYSA-N 426.517 4.101 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)NCC2(c3ccccc3Cl)CCCCC2)c1 1547459805 HIBWOHYRYUOULT-UHFFFAOYSA-N 436.961 4.049 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](CO)Cc2cccc(Br)c2)cc1 1556182697 ZFSRTLBWJANTRZ-LJQANCHMSA-N 441.369 4.438 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@H](C(=O)NCc4ccccc4)C3)c2C)c1 1557161234 KRONWBUKZYZCPF-QHCPKHFHSA-N 429.564 4.489 10 10 IICE Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)CC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1559337396 HSYFIMJBNNYOSA-UHFFFAOYSA-N 430.457 4.106 10 10 IICE CN(C)c1ccc(CNC(=O)CN(Cc2ccccc2Br)C(C)(C)C)cc1 1559638254 SRPORCIWZDDQLQ-UHFFFAOYSA-N 432.406 4.432 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1565162409 VLEZGJUXAMDNGU-UHFFFAOYSA-N 434.584 4.423 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCC2CCOCC2)NC(=O)OC(C)(C)C)cc1 1565882337 WBIRRFCRXGHULG-OAQYLSRUSA-N 433.593 4.032 10 10 IICE CCN1CCN(C(=O)c2ccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)cc2)CC1 1583937963 WKNJENNEORJVRU-UHFFFAOYSA-N 444.579 4.433 10 10 IICE Cc1sc(Br)c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1C 1596684797 YPNQSGOLDKFLJG-UHFFFAOYSA-N 445.329 4.172 10 10 IICE Cc1ccnc(Nc2cccc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)c2)n1 1596694917 JWQLOMRMKLNTRN-QZTJIDSGSA-N 449.530 4.211 10 10 IICE CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)NCc1cccc(Cl)c1O 1606860096 FIMHDIUGOOZRRC-ZDUSSCGKSA-N 427.975 4.026 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)CCN4C)cc2Cl)C1 1617900150 GKXXOGQMKLQEMC-MRXNPFEDSA-N 440.975 4.285 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)N(C)C)cc1 1618635686 KTKCWQPDGQPQQM-XMMPIXPASA-N 447.539 4.437 10 10 IICE COCCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=CCC1 1620070720 SUZPVCJYKASEIM-UHFFFAOYSA-N 435.572 4.172 10 10 IICE CCCOc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(OC)c1 1626107224 WAJDLVRJKSJGEY-JOCHJYFZSA-N 426.557 4.371 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cccc(O)c1 1626397915 QGEKGVWHECIBMG-FHXOWUIVSA-N 430.526 4.000 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)s1 1626532300 OGFDNSQZBMWIBI-UHFFFAOYSA-N 449.576 4.183 10 10 IICE COC(=O)CCCOc1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1628091745 JJRWVDYZTJEYLS-UHFFFAOYSA-N 448.519 4.169 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C3CC3)c2C)cc1 1629739021 LPEMMAUAWYYWCI-NRFANRHFSA-N 427.545 4.136 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](C[C@@H]2CCCO2)C(F)(F)F)cc1 1631608348 ULWSSILQHSYYDW-UFYCRDLUSA-N 428.495 4.008 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)CC2)cc1 1632044595 PTEPYOASBGTJSI-SANMLTNESA-N 438.568 4.195 10 10 IICE Cc1noc(COc2ccc(C(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)cn2)n1 1632697108 FYKTYJXSKCPCDX-QGZVFWFLSA-N 444.491 4.461 10 10 IICE CNc1cc(Cl)ccc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634162569 MBAPDFVSJLTHKM-HXUWFJFHSA-N 446.979 4.444 10 10 IICE Cc1cc(C(=O)N2C[C@]3(C)CN(C)C[C@@]3(C)C2)c(C)n1-c1ccccc1Br 1634385910 DZHWACFCMJEZET-VXKWHMMOSA-N 430.390 4.270 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](C(=O)NCc2cccc(Br)c2O)c2ccccc21 1634724649 DTQPGLPGSLUVLH-OAHLLOKOSA-N 447.329 4.310 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC(=O)NCc3cc(Cl)cc(Cl)c3O)C[C@H]1C2 1638183085 BYMJYVDQYGBEDJ-TUKIKUTGSA-N 444.359 4.286 10 10 IICE Cc1cc(C(=O)NC[C@]23OCCC[C@H]2C3(F)F)c(C)n1-c1cccc(Br)c1 1640662020 AXSDGPHSESZPJB-MJGOQNOKSA-N 439.300 4.401 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@H](CO)Cc1ccc(F)c(F)c1 1651027373 ORKCGCXMKFYYCU-MRXNPFEDSA-N 426.419 4.367 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@H](c4ccnn4C)C3)cc2Cl)C1 1681828608 VOAAPUXDQINLRH-NRJQMVOHSA-N 445.995 4.029 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC[C@H]2CCO[C@H](C)C2)cs1 1693373652 BGXBOMPHIXZDBN-AEFFLSMTSA-N 441.601 4.181 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1C 1695437111 ULMQWUCTKAVWKX-HKUYNNGSSA-N 434.588 4.114 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(C)(C)c1cccs1 1709035974 MMBFKDPVLMVKJV-UHFFFAOYSA-N 439.629 4.353 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@]3(C)CCCS3)CC2)cc1 1711865083 HRSLCAPOIKAVMO-QHCPKHFHSA-N 429.634 4.413 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1C[C@H](C)CC(C)(C)C1 1724235112 HWJAUVHUGNRNGS-NQIIRXRSSA-N 425.621 4.467 10 10 IICE CC[C@H](C)c1nnc(N2CCOC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1727024229 CDJKJXGBNORBRA-SFHVURJKSA-N 429.634 4.008 10 10 IICE CCN(c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1)C1CC1 1728315458 WRLPVEMLMQGGES-UHFFFAOYSA-N 425.621 4.112 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728936675 YKXYPPIZAJKGIP-FGZHOGPDSA-N 425.621 4.293 10 10 IICE Cc1cc(-c2nnc(N(C)C3CCC(C)CC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1742117878 PVUPCHMVQFRXJD-UHFFFAOYSA-N 448.615 4.456 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746931084 UMNJAZYKBWEBJB-RTWAWAEBSA-N 440.567 4.166 10 10 IICE CC[C@H]1CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(CC)CC)cc2)C1 1763438712 JMBDOQKHEWYJAP-NRFANRHFSA-N 435.620 4.271 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1(N2CCSCC2)CCCC1 1763507547 SLILWTYJACDISL-LJQANCHMSA-N 443.661 4.495 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCO[C@H](C)C1 1763747507 GXXRYURNCYQGEV-IPMKNSEASA-N 445.583 4.081 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1766814627 CSIZHZGVIRQMIW-OAQYLSRUSA-N 429.634 4.008 10 10 IICE CCN1C(=O)CCc2cc(-c3csc(NS(=O)(=O)c4ccc(C)cc4)n3)ccc21 1859570310 BRGUSQGTMHDEHN-UHFFFAOYSA-N 427.551 4.218 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3CCCN(Cc4ccc(F)cc4)C3)cccc21 1861858411 RBPIUTWYMWMYHN-GOSISDBHSA-N 442.490 4.452 10 10 IICE CC(C)(C)OC(=O)N1CCC(C)(C)[C@H](NCc2cc(Br)cc(F)c2O)C1 1965962196 UZKNVESUFKJYFX-OAHLLOKOSA-N 431.346 4.419 10 10 IICE O=C1C(=Cc2ccc(Cl)cc2Cl)SC(=S)N1N1C(=O)[C@H]2CCCC[C@H]2C1=O 2040742037 FBHINWQNCQTZNB-TXEJJXNPSA-N 441.361 4.285 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C(C)C)c(CN)c2I)c(O)c1 2080007118 NFRZDOYGVOLEDD-KRWDZBQOSA-N 443.329 4.029 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(CCNCc2cccc(Br)c2O)C1 2140326525 BJAYPIBNJRQKOA-MGPUTAFESA-N 425.367 4.282 10 10 IICE CC[C@@H](NC1CN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1)c1ccccc1O 2259425764 HGWDBKSHOWFPEE-LJQANCHMSA-N 449.592 4.289 10 10 IICE O=C(CN1C(=O)C(=Cc2ccccc2F)SC1=S)Nc1nc2ccccc2s1 2296880032 RIKBFBCCSLJUHN-UHFFFAOYSA-N 429.523 4.275 10 10 IICE COc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(C)cc3)c2C)C1=O 2296929629 QZEZLPRTRNUMPL-UHFFFAOYSA-N 429.476 4.078 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1cc(C)cc(C)c1 2297347648 QNTPFCYFVTWVNB-UHFFFAOYSA-N 447.491 4.220 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(OC)c1OC 2313609305 HBTLVRIHKSUOKS-UHFFFAOYSA-N 432.479 4.026 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CNCc2cc(Br)cc(F)c2O)C2(CC2)C1 2336286868 HDYDNNMNELKMTO-CYBMUJFWSA-N 429.330 4.031 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(CCCCCC(=O)OC)C2=O)cc1OCC 40927974 MXPLSKIXLIIUCY-JXAWBTAJSA-N 437.583 4.419 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1c[nH]c3ccccc13)N2 226883133 BMMHOFXNJOFTPA-KNCJIILYSA-N 449.576 4.452 10 10 IICE CC(=O)Nc1cc(F)c(F)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435719358 LPJQRPMXHOIWJB-UHFFFAOYSA-N 440.494 4.283 10 10 IICE Cc1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)nn1-c1ccccc1 731742981 OUZWAJJZCDRGFL-UHFFFAOYSA-N 432.455 4.162 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)cc1 735606902 CMHZPZGNSVILFO-UHFFFAOYSA-N 442.440 4.416 10 10 IICE CC[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1c(C)noc1C 742749519 HSKMRJMYNCOZMV-PMACEKPBSA-N 444.576 4.233 10 10 IICE CCN1CCN(c2ccc(CNC(=O)NCc3cccc(-c4ccccn4)c3)cc2F)CC1 749192799 GRHKRKZHLVDJAC-UHFFFAOYSA-N 447.558 4.029 10 10 IICE Cc1nccn1-c1ccc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 754913177 BNBRDBBCCXXVOW-RBUKOAKNSA-N 433.556 4.139 10 10 IICE C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C)c1ccc(N2CCOCC2)cc1Cl 762642233 KYCIFXOESDTJGZ-FIKGOQFSSA-N 438.012 4.473 10 10 IICE O=C1/C(=C\c2cncc3ccccc23)SC(=S)N1CCc1ccc2c(c1)OCCO2 772802756 UIGSLGGYEUBSED-CIAFOILYSA-N 434.542 4.450 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F 776015788 XJRZWZYLGQKNMP-LJQANCHMSA-N 443.416 4.246 10 10 IICE O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 778927894 VTQVVMJOVWCIOZ-MZYLBHOOSA-N 444.531 4.341 10 10 IICE COc1ccc(CNC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)c(O)c1 794389045 HRZXCJRMEJXEEB-UHFFFAOYSA-N 431.414 4.413 10 10 IICE Cn1ncc(Br)c1/C=C1/SC(=S)N(CCCCC(F)(F)F)C1=O 794862708 QWFDOXBETJEJJK-UXBLZVDNSA-N 428.299 4.116 10 10 IICE CN(C)c1ccc(CNC(=O)NCc2ccccc2-c2ccc(Cn3cncn3)cc2)cc1 919896800 QWNJJUKUFLRIFI-UHFFFAOYSA-N 440.551 4.059 10 10 IICE CCCCCn1nc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c2ccccc2c1=O 1124547837 UKEILBVJPGNBAM-UHFFFAOYSA-N 432.568 4.459 10 10 IICE COc1ccc(OC)c(CCCNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1127698403 IKHPGMYIYQKLGX-UHFFFAOYSA-N 449.595 4.174 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CC[C@@H]2[C@H](C1)C2(F)F 1131084698 APQSKENCMKXGPR-KRWINMAOSA-N 442.578 4.280 10 10 IICE Cc1nn(-c2ccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cc2)c(C)c1Cl 1134881716 FPMNPSHVJMHRKS-QFIPXVFZSA-N 439.991 4.241 10 10 IICE Cc1cc(C(=O)N[C@H](Cn2ccnc2)C(C)(C)C)c(C)n1-c1ccc(Br)cn1 1136395036 YPBBFUOLUKYWGJ-GOSISDBHSA-N 444.377 4.293 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3[C@H]2O)c(C)n1-c1ccccc1Br 1141668195 AFWSASCIFNTKCA-WIYYLYMNSA-N 441.325 4.081 10 10 IICE CO[C@](C)(CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)COCc1ccccc1 1165972606 JJQBNARIOUWFGO-AREMUKBSSA-N 434.536 4.258 10 10 IICE C[C@@H](c1cc2ccccc2o1)N(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1251105893 XNHILAHULIGVLR-KRWDZBQOSA-N 434.540 4.037 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3ccccc3-c3ccccc3)CC2)c(OC)c1 1287479100 YYLLXHRKUILFII-UHFFFAOYSA-N 446.547 4.489 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)CC2CC(F)(F)C2)cc1F 1298056172 MCFFQTCIRFADOS-IBGZPJMESA-N 437.510 4.255 10 10 IICE COCC1(CCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCCC1 1301116515 OFSAQOLVUWWARB-OAQYLSRUSA-N 428.577 4.459 10 10 IICE Cc1cc(C(=O)N[C@@H]2CS(=O)(=O)Cc3ccccc32)c(C)n1-c1cccc(Cl)c1 1301277663 FGEDSPKYNKJWBE-OAQYLSRUSA-N 428.941 4.147 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H]1CCCCN(C(=O)OC(C)(C)C)C1 1307538643 CGCPYZDRMSPSRF-INIZCTEOSA-N 440.968 4.058 10 10 IICE CN(CC(=O)NCCOc1ccc(C(F)(F)F)cc1)c1ccc(-c2nccs2)cc1 1307828603 KMLTUFDKHZGXHB-UHFFFAOYSA-N 435.471 4.460 10 10 IICE COc1ccc(N2CCN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])CC2)cc1F 1458259850 KCRLVTLBYXGWFI-UHFFFAOYSA-N 435.455 4.300 10 10 IICE C[C@@H]1CN(C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)c2cc(Br)ccc2O1 1459595598 XUNOZXIQMYMXRM-DOMZBBRYSA-N 437.334 4.177 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1CC(O)(c2cccc(Cl)c2)C1 1465950878 FGFXRWPOOGRJBL-UKAYHFCDSA-N 449.378 4.077 10 10 IICE Cc1cccc(CN2CCO[C@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)c1 1471037949 WIVYQRCFTDAZHG-AREMUKBSSA-N 446.595 4.103 10 10 IICE Cc1noc(C)c1[C@@H](C)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1511923008 NSPOXYJETLRUCU-YWZLYKJASA-N 425.533 4.270 10 10 IICE CN(C)c1cc(Br)cc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1 1515045444 ZWPAWXIQYNZLMY-UHFFFAOYSA-N 436.313 4.477 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1CCCSc1nccs1 1517143169 XFFKQTVEUBNSRF-UHFFFAOYSA-N 426.571 4.254 10 10 IICE COCC[C@@H](Cc1cccc(Br)c1)C(=O)Nc1c(Cl)ccc2nonc12 1520358418 BYMQUVKEGIFCRP-LBPRGKRZSA-N 438.709 4.473 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2cc(F)ccc21 1530400448 SCXWLIAEQQMWCZ-WOJGMQOQSA-N 430.501 4.145 10 10 IICE Cc1cc(I)cc(C(=O)N2CCOc3cc(N(C)C)ccc32)c1C 1532654699 ADSJVMPDDWJLBE-UHFFFAOYSA-N 436.293 4.013 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1 1536549148 BMEUMNQHBVQDOC-BGVYSJOJSA-N 433.596 4.060 10 10 IICE COCCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1 1543327285 ZNIDGJOWSIWZAJ-CYVLTUHYSA-N 444.553 4.097 10 10 IICE CO[C@@]1(C)CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1554692702 ZHHUQNWPXAZVPK-QPPBQGQZSA-N 445.583 4.169 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(C)CCN2CCN(Cc3ccccc3)CC2)c1C 1556558469 ZNRMLCYBZXNTPL-UHFFFAOYSA-N 444.623 4.292 10 10 IICE CCc1cc(OCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1Cl 1566356807 OJIUJFXUHQEDCC-SFHVURJKSA-N 437.367 4.421 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ncoc1-c1cccc(C(F)(F)F)c1 1585536038 NUFAYISIFKTIOV-UHFFFAOYSA-N 445.441 4.252 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccc(F)cc1 1617459306 BILYRVAAGYILML-JOCHJYFZSA-N 433.527 4.197 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CNCc2cc(Br)cc(F)c2O)CC1 1621105704 XZVIIVVJSAGGRG-ZDUSSCGKSA-N 431.346 4.421 10 10 IICE Cc1cc(C(=O)N(C)C[C@@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1627022702 PKIYDRNQMZXJFO-JOCHJYFZSA-N 442.357 4.231 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@@H](C)[S@]1=O 1627248492 AXUAHTFDMJAJLF-LNMHWPHBSA-N 437.403 4.228 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](CO)Cc3cc(F)c(F)c(F)c3)c2C)c1 1634296401 ABGIEJFGUXOVIV-SFHVURJKSA-N 430.470 4.401 10 10 IICE O=C(NCc1cc(Cl)ccc1O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O 1635018887 CXIREXJLGIYZTH-HNNXBMFYSA-N 442.730 4.347 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1nc2ccccc2o1 1637987013 YJRNDQWEKCAYMJ-LFIBNONCSA-N 443.575 4.187 10 10 IICE Cc1cc(C(=O)N[C@H](CO)CC2CCCCC2)c(C)n1-c1ccc(Br)cn1 1639541579 UJYSAJHVBBOYRR-SFHVURJKSA-N 434.378 4.313 10 10 IICE CCCCOc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(O)c1 1650720462 VHLNZTBVVGUTLY-IRXDYDNUSA-N 430.520 4.254 10 10 IICE COC(=O)c1ccc(S[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1652595543 NKSJKCFVIDXDRO-AWEZNQCLSA-N 445.496 4.368 10 10 IICE O=C(Nc1cccc(NC(=O)c2cccc(O)c2O)c1)c1ccc(Br)cc1 1653005927 UPLWRTGMBKPUDQ-UHFFFAOYSA-N 427.254 4.365 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N[C@H](C)c2ccccc2O)sc2c1CC[C@H](C)C2 1655349816 UJTKOMOQWSCXNV-ZNMIVQPWSA-N 430.570 4.433 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2Cc1nnc(-c2cccc(O)c2)o1 1657292676 DMDURQSDXJDJFX-UHFFFAOYSA-N 436.512 4.420 10 10 IICE CCOc1ccc(N2CCN([C@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)CC2)cc1 1657875960 KLLWNMCUEMJWHZ-QFIPXVFZSA-N 445.510 4.004 10 10 IICE C[C@H](NC(=O)N[C@H]1Cc2ccccc2N(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671851991 OBHZNELRDCWWKX-PXNSSMCTSA-N 438.572 4.479 10 10 IICE CC[C@@H](C)N(CCc1ccccc1F)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675580549 PYOOJCVFPMYIQY-HXUWFJFHSA-N 426.580 4.130 10 10 IICE Cc1cccc(C[C@@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1682025048 ZNELMNMGKSYYDW-NQIIRXRSSA-N 429.992 4.288 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)[C@@H]1C 1691376620 ZJTXMRGNRUIVJM-NRFANRHFSA-N 446.599 4.376 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)NC(C)C)nnc1N1CC=C(C(C)(C)C)CC1 1707304233 PDPWCKGWCMQAHZ-UHFFFAOYSA-N 438.620 4.022 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN(C)CC(F)(F)F 1709913239 VNVWIZQJKKSSBA-UHFFFAOYSA-N 434.510 4.303 10 10 IICE CCOCc1nnc(N(CC)CC2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1710657795 WOQXBYIXCIUXJX-UHFFFAOYSA-N 429.634 4.043 10 10 IICE Cc1nccnc1CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1725769120 KUDUKEGTUXHGMV-UHFFFAOYSA-N 447.631 4.444 10 10 IICE CCOCc1nnc(N2CCS[C@@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1729090826 ZLFLGBPSIZLIEV-IBGZPJMESA-N 429.634 4.041 10 10 IICE CCC(C)(C)Cn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 1743436219 BQKXCNZWOFUALC-UHFFFAOYSA-N 427.574 4.048 10 10 IICE CCOC(C)(C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1746609010 XZJIUVQXKUSESP-UHFFFAOYSA-N 443.636 4.155 10 10 IICE CC(C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1750630706 WNVZAOWURHIOFU-MRXNPFEDSA-N 430.603 4.093 10 10 IICE C[C@@H]1CCC[C@](Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752093908 XGWYNLZPPDZRNG-IBVKSMDESA-N 448.615 4.116 10 10 IICE CC[C@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)CCO1 1763572772 VQRVHEXDLYPOJH-IBGZPJMESA-N 443.642 4.317 10 10 IICE CCOCCC1(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCC1 1768054557 BMGCMVVDVPPWNH-HXUWFJFHSA-N 428.577 4.111 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CC[C@@H](F)C3)CC2)cc1F 1768704584 KCKSNADEJJUOFZ-ZWKOTPCHSA-N 433.547 4.089 10 10 IICE COCC[C@@H]1CCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1769627524 SZVPJMMBELHHPP-IRXDYDNUSA-N 437.635 4.021 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CCCCN2)sc(C)c1-c1ccc(Br)cc1 1866039124 SCICRIWCQYXXSH-AWEZNQCLSA-N 437.359 4.353 10 10 IICE CC(C)[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1Cc2ccccc2C1=O 1874179052 KLUVVYFLOYSMMP-QHCPKHFHSA-N 438.483 4.081 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](NCc1c(O)cccc1Br)C2 1878874449 IVIAUTWDKGZDHT-SIUGBPQLSA-N 429.330 4.123 10 10 IICE COC(=O)c1c(C2(C)CC2)nn([C@H](c2ccc(OC)cc2O)C(C)C)c1Br 2080041683 CYDBLQMRPLVAFL-INIZCTEOSA-N 437.334 4.443 10 10 IICE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cc(I)ccc2Br)CC1 2155566017 ZFOXZIBCTMEEFB-JTQLQIEISA-N 449.090 4.359 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c1O 2236051496 UHEPAXRVWRPFPB-KGLIPLIRSA-N 443.382 4.336 10 10 IICE CCCCN1C(=O)C(=Cc2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 2296846496 REWOWSXLIHQCNJ-UHFFFAOYSA-N 430.599 4.072 10 10 IICE Cc1ccc(CNC(=O)CC[C@@H](C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2380748620 GMNQOHVMENJGBD-CYBMUJFWSA-N 443.382 4.410 10 10 IICE Cc1ccc(CN(C)c2ccc(I)cc2N)c(O)c1Br 2381128843 AIGRZJUKNWYMMO-UHFFFAOYSA-N 447.114 4.286 10 10 IICE O=C(O)CC/C(=C\c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 9662649 NXNSXGNQXJUFFN-DTQAZKPQSA-N 439.493 4.447 10 10 IICE CCOC(=O)c1ccc(N2N=C(C(F)(F)F)/C(=C\c3ccc(N(C)C)cc3)C2=O)cc1 33780533 ALOWJGUVGIUFQV-QGOAFFKASA-N 431.414 4.278 10 10 IICE COc1ccc(C2=C/C(=C/c3ccc(OC)c(I)c3)C(=O)O2)cc1 59425916 ZIACZRBTQCTZBV-ZROIWOOFSA-N 434.229 4.290 10 10 IICE Cc1cc(N2Cc3ccccc3C2)ccc1/C=C1\C(=O)NC(=O)N(C2CCCCC2)C1=O 96237520 MDGANJBJWVBNMS-OEAKJJBVSA-N 429.520 4.310 10 10 IICE COc1ccc(N2CCCN(C(=O)COc3ccc(Cl)c4cccnc34)CC2)cc1 108433468 YALPEUXBOGGGMO-UHFFFAOYSA-N 425.916 4.015 10 10 IICE CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 248236446 DWVYAXLPGTXOLS-UHFFFAOYSA-N 425.479 4.151 10 10 IICE COc1ccc2c(c1)OCC[C@H]2NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 683445418 IIKPGCGRZQGAMF-JOCHJYFZSA-N 433.552 4.056 10 10 IICE Cc1cc(N)c(O)c([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1 687755057 DIFVQTVPZZCHBJ-JOCHJYFZSA-N 432.476 4.337 10 10 IICE Nc1ccc(Nc2cc(I)cc(I)c2)cc1 709842477 WWPRFXIOMBWCKX-UHFFFAOYSA-N 436.034 4.222 10 10 IICE Cc1ccc(-n2cnnn2)cc1NC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 725857145 YJRWAUWKMUREFQ-SFHVURJKSA-N 428.496 4.472 10 10 IICE COc1ccc(OC)c(CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C2CC2)c1 727600822 YCEKPTURSMEGAC-UHFFFAOYSA-N 441.597 4.131 10 10 IICE Cc1cccc2[nH]cc(CCNC(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)c12 728596971 LCSQGSDKXRLQLZ-ROUUACIJSA-N 438.547 4.271 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccc(F)c(N2CCCS2(=O)=O)c1 731649102 VRHDLGKJKXEEFK-UHFFFAOYSA-N 433.530 4.087 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCOc1ccc(F)cc1F 745807727 BXIKDMOAVFWIAZ-UHFFFAOYSA-N 429.261 4.043 10 10 IICE COc1ccc(F)cc1-c1csc(NS(=O)(=O)c2ccccc2Cn2ccnc2)n1 759481847 FARXHQWQQJEJET-UHFFFAOYSA-N 444.513 4.003 10 10 IICE COc1cc(Cl)cc(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1O 761216916 ZQUOXFQVUWUQCE-CYBMUJFWSA-N 436.261 4.490 10 10 IICE Cc1cc(N2CCC[C@H](N[C@H](C)c3cc(Br)cc(Cl)c3O)C2)n(C)n1 774469031 QOFGXFPZWORFMI-OCCSQVGLSA-N 427.774 4.170 10 10 IICE COC(=O)c1ccc(-c2csc(NS(=O)(=O)c3ccc4ncsc4c3)n2)cc1 775139269 ABWMLTPKAZQBCY-UHFFFAOYSA-N 431.520 4.007 10 10 IICE COc1cc(O)c(CN[C@@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)cc1OC 814178233 IJOODWMQWWWKJT-UQBPGWFLSA-N 439.483 4.089 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(-c4cc(OC)ccc4Cl)no3)CC2)cc1 1125816611 OGHDYIAGULTWOJ-UHFFFAOYSA-N 441.915 4.411 10 10 IICE COc1cc(C[C@H](CO)CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc(OC)c1 1137498722 FDRGGIDNKVBULO-NRFANRHFSA-N 436.552 4.001 10 10 IICE Cc1cc(CC(=O)N2CCN(c3cccc(F)c3)C(=O)C2)c(C)n1-c1ccc(Cl)cc1 1138066466 YVVUZERVPAXZOR-UHFFFAOYSA-N 439.918 4.305 10 10 IICE Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)NCCCSc2nccs2)cc1 1144322583 WTGZNMHEOAZEBR-CQSZACIVSA-N 439.404 4.037 10 10 IICE CCc1cc(N2CCC[C@H](NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2)ncn1 1144650471 IIEMIJIHBDQXII-QFIPXVFZSA-N 431.584 4.462 10 10 IICE C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 1154668781 LYAKDELDEYXIKR-VLIAUNLRSA-N 433.499 4.474 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(Cc4ccccc4)C3=O)cc2Cl)C1 1155727405 RBDUPZGMQZCUJR-WIYYLYMNSA-N 439.987 4.241 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)C2(CNC(=O)OC(C)(C)C)CCC2)c1 1158918425 APEAWXYNUGDFTQ-UHFFFAOYSA-N 439.556 4.426 10 10 IICE Cc1cc(C(=O)[C@@H](C)SCCN2CCOCC2)c(C)n1-c1ccc(OC(F)F)cc1 1165462469 AGHULVWQPCFZHS-QGZVFWFLSA-N 438.540 4.332 10 10 IICE COc1ccc(N(C)CCN(C)[C@H](C)C(=O)Nc2ccc(Br)c(C)c2)cc1 1171728745 CDTRDZLGAOSPLA-MRXNPFEDSA-N 434.378 4.161 10 10 IICE CCOC(=O)CCC(=O)CSc1ncc(-c2ccc(Br)cc2)n1CC 1188407313 CFBKEJMIDKHBDV-UHFFFAOYSA-N 425.348 4.337 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCNC(=O)[C@@H]3c3cccs3)cc2Cl)C1 1227207233 FACSRQKZKPQBPX-QRWLVFNGSA-N 447.004 4.021 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1COc2cccc(Br)c2C1 1254584838 NJYIFFKOUPWJOE-KRWDZBQOSA-N 444.373 4.194 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ncccc2Br)CCCC1 1289785395 UMDIEXHXRLLCKK-UHFFFAOYSA-N 428.330 4.003 10 10 IICE Cc1cc(CC(=O)N[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1299438921 RGRYONXDUILWFO-FPOVZHCZSA-N 425.573 4.446 10 10 IICE CSC[C@H]1CCCN1c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1302705841 DDSQQVKPUMHOGF-JOCHJYFZSA-N 436.629 4.018 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O 1312518583 KJTGRLLLWCIEKR-LJQANCHMSA-N 448.489 4.108 10 10 IICE CN(CCn1cccn1)c1nnc(-c2ccccc2F)n1CCCSc1nccs1 1314868585 NOMULYZXYQVUME-UHFFFAOYSA-N 443.577 4.056 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N(Cc1ccccn1)C1CC1 1351596542 MBFQDYPGSKPKQP-CPNJWEJPSA-N 441.553 4.003 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3c(-c4cccc(F)c4)noc3C)cc2F)CC1 1435077345 VWEUDVUPRYQUHE-UHFFFAOYSA-N 440.494 4.000 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)C2)cc1 1452036464 YEULQFFEFHICSA-SIBVEZHUSA-N 438.568 4.052 10 10 IICE Cc1[nH]nc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1Cl 1452605664 IXWFXWQMQSUZIO-FLIBITNWSA-N 426.976 4.053 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)c1 1465375382 XJFNWBCHSFNIFI-JOCHJYFZSA-N 449.938 4.485 10 10 IICE Cc1cc(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(C)n1-c1ccc(Cl)cc1 1465381052 HHNYUBBUNARQPK-KRWDZBQOSA-N 439.903 4.377 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1 1471013853 ZGUUKQBDBQRCCG-CVEARBPZSA-N 435.565 4.187 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)[C@@H]4CCCS4(=O)=O)n3)c2C)cc1 1523935768 BBCSHPPFKKZCPM-IBGZPJMESA-N 429.567 4.042 10 10 IICE CC[C@H](Cc1cccc(Br)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1533682276 CRBACWDCJBABPP-HXUWFJFHSA-N 444.417 4.086 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H](C)N3CCC(Cc4ccccc4)CC3)CC2)cc1 1544891538 FIRYSQDVKJRDGW-QFIPXVFZSA-N 435.612 4.077 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1555627575 GSSXESKSQQNARK-CTNGQTDRSA-N 443.636 4.297 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2C[C@@H](C(=O)OC(C)(C)C)c3ccccc32)c1 1565007494 PLPCKTIHERAGQE-VHKYSDTDSA-N 426.513 4.331 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2c(Cl)ccc(I)c2F)c1 1566374271 BEJWMMSWXCSVSC-QMMMGPOBSA-N 449.647 4.289 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(-c4cccc(Cl)c4F)no3)CC2)cc1 1566562085 BPSVKWLWOZGSLM-UHFFFAOYSA-N 429.879 4.495 10 10 IICE COc1cc2oc(=O)cc(C)c2cc1CCC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1584096234 VRBMCVJDAAUBMU-GOSISDBHSA-N 436.552 4.164 10 10 IICE Cc1ccc(C(=O)c2ccccc2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1603554532 GCBHOFRSYDEMJS-RUZDIDTESA-N 429.564 4.325 10 10 IICE CC(C)c1cncnc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1617062538 RBDZPKGEOSUZJP-DHDCSXOGSA-N 432.596 4.282 10 10 IICE CN(c1nnc(-c2ccccc2Cl)n1CCCSc1nccs1)[C@@H]1CCOC1 1617733752 PFRLZTOWMVPJON-CQSZACIVSA-N 436.006 4.463 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(C)(C)Oc1ccc(C(F)(F)F)cc1 1623451694 NJJKGYQSIXFKLA-UHFFFAOYSA-N 436.474 4.358 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Oc3ccccc3)c3ccccc3)CC2)c(OC)c1 1623760162 SATWXNMWOGKNCS-VWLOTQADSA-N 432.520 4.173 10 10 IICE Cc1csc(NCCNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 1626049483 ULFGMELNJXEZGC-UHFFFAOYSA-N 433.375 4.463 10 10 IICE Cc1cc(C(=O)N2CCC[C@@]2(CO)CC(C)C)c(C)n1-c1ccc(Br)cn1 1626763475 XROSDRYMBFCTSO-NRFANRHFSA-N 434.378 4.265 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)cn4ccnc34)cc2)CC1 1627467441 IOLCGCJKKZKIRU-UHFFFAOYSA-N 427.346 4.263 10 10 IICE Cc1cc(CCNC(=O)[C@H](CC2CC2)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1634866919 QRXKQQLYTKRULH-QFIPXVFZSA-N 425.573 4.446 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nc(CNC(=O)OC(C)(C)C)sc1C 1639340746 DQCIWWYTAAHQBP-OAHLLOKOSA-N 446.617 4.212 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)N[C@H](C)c1ccccc1O 1642824305 PLSPLJSOVHXRRZ-OAHLLOKOSA-N 428.485 4.132 10 10 IICE Cc1cc(CN(C)CCCOc2ccc(S(C)(=O)=O)cc2)ccc1N1CCCCC1 1653219060 XKSAFUVJYSHFIL-UHFFFAOYSA-N 430.614 4.290 10 10 IICE CCS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)s1 1655447762 NYSXNIWOWHSHDU-UHFFFAOYSA-N 430.507 4.293 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc(-c2nc(C)no2)cc1 1671443625 BBWUIJLJRMTWFW-UHFFFAOYSA-N 445.317 4.245 10 10 IICE Cc1cccc(OC[C@H](O)CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1672133537 WDXKJVOCOPZDLL-UYAOXDASSA-N 445.991 4.124 10 10 IICE CCCCCN(Cc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1675580187 JRPUMDAXQSEIDO-UHFFFAOYSA-N 426.580 4.480 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H]1CCCC[C@@H]1c1ccccc1 1676126820 XUYKQHRYPLNZET-RPBOFIJWSA-N 448.611 4.256 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@@H](c4ccc(F)cc4Cl)C3)C2)cc1 1683339857 IATWEZAYSQLTSM-OPAMFIHVSA-N 447.938 4.097 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC=C(c4ccc(Cl)nc4)CC3)C2)cc1 1683340297 RQXQIFYJMSLYAG-KRWDZBQOSA-N 426.948 4.069 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccc(Br)cc4)CC3)C2)cc1 1683944575 HOVDKEQLPCKXKF-KRWDZBQOSA-N 430.346 4.025 10 10 IICE C=C(Cl)Cn1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1705760982 XICDISSGFZXXLV-KRWDZBQOSA-N 447.967 4.445 10 10 IICE CN(CC(C)(C)C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1711060250 XZXMWCGZONVMTB-NRFANRHFSA-N 445.583 4.026 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc(C)o4)n3C[C@H](C)SC)CC2)cc1 1748846852 CXVADSKLXGCHBP-SFHVURJKSA-N 441.601 4.323 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765021373 NXLQMKBRILBKJI-CVDCTZTESA-N 425.621 4.283 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCOC1 1768137518 CLXVCCWRRGXJNC-NRFANRHFSA-N 437.588 4.252 10 10 IICE COCCCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1769667461 JHLQWIJZYGMDQG-JOCHJYFZSA-N 427.593 4.183 10 10 IICE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2cc(I)ccc2Br)C1 1912147227 HPVILHOICBIAFR-VIFPVBQESA-N 449.090 4.216 10 10 IICE C[C@@H](NCc1cc(Br)ccc1O)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116250708 IXVNJISBPXSNJM-SJKOYZFVSA-N 425.323 4.492 10 10 IICE CN(Cc1ccc(I)cc1)c1ccc(CN)cc1Br 2265539368 JLLDUVRPFVRAHW-UHFFFAOYSA-N 431.115 4.149 10 10 IICE COc1ccc(C=C2SC(=S)N(CCC(=O)Nc3cc(Cl)ccc3O)C2=O)cc1 2293034944 FGQJPFZWWLIGRA-UHFFFAOYSA-N 448.953 4.284 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3cccc(OCC)c3O)SC2=S)cc1 2321569820 KOTCRNXXEHCWJM-UHFFFAOYSA-N 429.519 4.373 10 10 IICE Cc1ccc(CN[C@@H]2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)c(O)c1Br 2352680339 PZJSPPFUSCEJCC-ARFHVFGLSA-N 425.367 4.198 10 10 IICE Cc1ccc(CN(C)C(=O)C2(NC(=O)OC(C)(C)C)CCCC2)c(O)c1Br 2381134778 HWOJTIYQTMDAKW-UHFFFAOYSA-N 441.366 4.259 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14460111 PJQPMXCRGSUPTR-AXHZCLLHSA-N 435.568 4.299 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccccc3)SC2=S)cc1 15047041 ABGLVOYEBQBVLI-VVTMIQRTSA-N 440.546 4.092 10 10 IICE COc1ccccc1N1C(=O)/C(=C/c2ccc(-c3cccc(C(=O)O)c3)o2)C(O)=NC1=S 33286902 RIWKIDNYOWDHJH-FOWTUZBSSA-N 448.456 4.325 10 10 IICE CCN(CC)c1ccc(CN(Cc2ccco2)C(=O)C2CCC2)c(OS(=O)(=O)CC)c1 37403552 GNDZTQUVPUQEBD-UHFFFAOYSA-N 448.585 4.183 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(C(=O)N[C@H](C)C(C)C)CC3)c2C)cc1 748775741 WTWNXXOXYUWLLW-GOSISDBHSA-N 425.573 4.116 10 10 IICE CCc1sc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C(N)=O)c1C 766828466 DGIUTTVCDUTWJL-UHFFFAOYSA-N 438.597 4.078 10 10 IICE CC(C)Oc1cccc([C@@H](O)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 768039398 YUPMDQWZORDKIO-SANMLTNESA-N 449.595 4.045 10 10 IICE C[C@H](NCc1ncn(Cc2cccc(F)c2)n1)c1cc(Br)cc(Cl)c1O 783312210 DBNGDTPFJAQFQX-NSHDSACASA-N 439.716 4.438 10 10 IICE CCn1c(CNC(=O)NCc2ccc(N(C)C)c(F)c2)nc2cc(Br)ccc21 790262198 PYHCGNLNCZWRCO-UHFFFAOYSA-N 448.340 4.023 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](N3CCC3)[C@H](F)C2)c(C)n1-c1cccc(Br)c1 791256572 DTXTUIKISWQBQJ-WOJBJXKFSA-N 434.353 4.115 10 10 IICE Cc1cc(C(=O)COC(=O)c2ncsc2Br)c(C)n1-c1ccc(F)cc1 805708212 OORHTCSGCYAAKS-UHFFFAOYSA-N 437.290 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 1135946170 IESSECFRSBUPNJ-UHFFFAOYSA-N 431.536 4.015 10 10 IICE Cc1cc(C(=O)NC[C@@]2(N3CCOCC3)CCSC2)c(C)n1-c1cccc(C(C)C)c1 1136393040 BEXRGRMHANLNOW-VWLOTQADSA-N 441.641 4.155 10 10 IICE COC(=O)C[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C1CCCC1 1155562771 YDLHLYVDNCZYAC-GOSISDBHSA-N 448.361 4.103 10 10 IICE COC1CCN(c2ccc(CN[C@@H]3CN(CC(F)(F)F)C[C@H]3c3ccccc3)cc2)CC1 1171097678 FYZQEJFRFAJLNF-BJKOFHAPSA-N 447.545 4.422 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2csnn2)sc(C)c1-c1ccccc1 1195241841 OMKOFLXJGDAJLB-LBPRGKRZSA-N 430.555 4.041 10 10 IICE C[C@@H](N[C@@H](CF)c1ccc(F)cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1197135209 IMJMKPNTDOSCSB-PEBXRYMYSA-N 434.442 4.229 10 10 IICE COc1ccc(CN(CCO)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1227208186 LRYBQYBDWOEDDA-GOSISDBHSA-N 445.991 4.289 10 10 IICE COc1ccc(F)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1265896642 ZDGDEGYTWDIYIB-LICLKQGHSA-N 434.489 4.203 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H]1COCc2ccccc21 1276417838 GFZBXIRBKUQTNV-SZLZGVTBSA-N 444.603 4.117 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCO[C@@H]2C(C)C)n1 1289919681 RJZIAOZCOFGPSP-NFBKMPQASA-N 435.572 4.442 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290415569 TWQRSDLQFQDRKU-CABCVRRESA-N 428.581 4.122 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1Cc1nc(C(C)(C)C)cs1 1298363970 QBTIDMZPYYXQNZ-UHFFFAOYSA-N 434.569 4.484 10 10 IICE CC[C@H]1CCCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1306331045 SMMHZWYWMWNQNB-UXHICEINSA-N 429.609 4.051 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1313121147 VRURGYCQHNVSLM-PXDATVDWSA-N 435.616 4.168 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CC[C@H](C)C2 1349305238 VCMQORUTIANCHC-YZUHTNEWSA-N 446.613 4.415 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3CC(C)(C)Oc4ccccc43)cc2F)C[C@@H](C)O1 1355131210 ULEBRRAOKZUIDU-HLIPFELVSA-N 426.532 4.400 10 10 IICE O=C(/C=C/c1ccccc1OC(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436624947 VKFDSLDZWYJQGN-AATRIKPKSA-N 442.384 4.030 10 10 IICE O=C(Cc1ccccc1F)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1439869549 AEBGGPVHRSYNKE-UHFFFAOYSA-N 425.261 4.479 10 10 IICE Cc1cc(C(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c(C)n1-c1ccc(C(C)C)cc1 1449710470 XTBLLJBARAMOJB-XMMPIXPASA-N 428.598 4.258 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(F)cc(Br)cc3[nH]2)N(C)C)cc1 1456930554 HYCPQMZGJKTCFE-HXUWFJFHSA-N 447.352 4.168 10 10 IICE Cc1cc(C(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c(C)n1-c1ccc(F)cc1 1458997876 OKHNHONUMGAJFF-GJZGRUSLSA-N 425.504 4.163 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C/C=C\c2ccc(Br)cc2)N(C)C)cc1 1463279698 JNWULSCEAHBIFO-RMUOZIPVSA-N 430.390 4.338 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(CCc1ccc(Cl)cc1)CC1CC1 1470904000 BTFZYQARJIXHNN-UHFFFAOYSA-N 442.003 4.465 10 10 IICE C[C@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)C[C@@H](C)O1 1512499408 DVUYQPWQIKLBIZ-HDICACEKSA-N 443.642 4.316 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1513372408 FRINVBSWDLNDNU-SFHVURJKSA-N 440.636 4.246 10 10 IICE CCC(O)(CC)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1513521419 LTXYECYILOBZDE-JOCHJYFZSA-N 441.620 4.307 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1514120351 GVSQVNMVFKOKGB-GHTZIAJQSA-N 429.634 4.008 10 10 IICE Cc1ccccc1[C@@H]1C[C@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1527705083 OCCKRICURITEBC-YFHHABKASA-N 440.565 4.398 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cnccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1541428902 NRUJVUNCXPNIKM-UHFFFAOYSA-N 433.604 4.188 10 10 IICE CCN(CC)CCC[C@H](C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1543407141 XWIJKSHWUPSJDZ-HNNXBMFYSA-N 435.410 4.492 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1ccc([N+](=O)[O-])cc1 1546150752 WZQNINVWRDCHOU-UHFFFAOYSA-N 430.508 4.212 10 10 IICE C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)[C@@H](C)NC(=O)OC(C)(C)C 1564800806 BXKCFHGOOJFDSQ-ZWKOTPCHSA-N 444.576 4.359 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)cc1 1585449052 DWGPQUXZWZLADN-UHFFFAOYSA-N 430.346 4.076 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(Br)cnc1OCC1CC1 1595612451 GSIPZPLODVXBQB-UHFFFAOYSA-N 431.330 4.147 10 10 IICE Cc1ccccc1Nc1scnc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1596695258 OQDRBCLXPXQPTL-UHFFFAOYSA-N 426.517 4.101 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(-n4ccc(C(F)(F)F)n4)c3)C2)cc1 1598364349 QSRZRUHCJKCMNK-MRXNPFEDSA-N 444.457 4.156 10 10 IICE Cc1nc(-c2ccco2)cc([C@H]2CN3CC[C@H]2C[C@H]3CNCc2ccc(N(C)C)cc2)n1 1616154082 MLYXHGNGICMIJC-PMVMPFDFSA-N 431.584 4.079 10 10 IICE CCN(C[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)c1ccc(OC)c(OC)c1 1616266236 SOZBMKBFSHEYFE-LJQANCHMSA-N 434.577 4.336 10 10 IICE CC[C@@](C)(CCCNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)C1OCCO1 1620442498 SLFCHLHCBQRPFO-VWLOTQADSA-N 428.573 4.214 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@]1(C)CCCN1C(=O)OC(C)(C)C 1622328093 LNUFGUNGRXNTQW-FQEVSTJZSA-N 441.366 4.293 10 10 IICE Cc1ccc(-c2ocnc2C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1622634975 NLZUTFMOKVVJOL-IBGZPJMESA-N 425.916 4.403 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3cc4ccccc4[nH]3)cc2Cl)C1 1626168781 FRFKSZHVODYMCD-INIZCTEOSA-N 438.959 4.104 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@@]3(CCCOC3)C2)c(C)n1-c1cccc(Br)c1 1626294826 YTIWJZSDFWFXCH-ZHRRBRCNSA-N 447.373 4.267 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)c1nc(Cc2ccccc2)no1 1630824684 GTXFOQFJRCMNIB-QGZVFWFLSA-N 428.492 4.371 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](F)CN(Cc1ccccc1)Cc1ccccc1 1633818423 HVRWJUHHAJVDLB-CVDCTZTESA-N 436.527 4.186 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3CCN([C@H]4CCSC4)CC3)cc2Cl)C1 1634023203 WWPITSXIQQNQBT-PXNSSMCTSA-N 436.065 4.410 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCN(CC(F)F)C2)c(C)n1-c1ccc(Br)cc1 1636563745 KFISXZKPUWIJJW-OAHLLOKOSA-N 440.332 4.173 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c1 1636715112 ALOVHAMJTJGHGM-VXKWHMMOSA-N 444.453 4.171 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(Cl)ccc1Br 1639587698 BSDAEJFOEIXSRE-UHFFFAOYSA-N 426.694 4.014 10 10 IICE COc1cccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1C 1641060698 ORBYWHXAPQOQDZ-UHFFFAOYSA-N 428.330 4.499 10 10 IICE CC(C)C[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1641822575 LMERFTOOMNSTKF-ONTIZHBOSA-N 433.612 4.346 10 10 IICE CCOc1ccc([C@H](C)NC(=O)CN2CCCc3cc(OC(F)F)ccc32)cc1OC 1644806674 UBPXQBXQWKCWIW-HNNXBMFYSA-N 434.483 4.325 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@@H](c2ccc(OC(F)F)cc2)C1 1673744940 PXLMMLUAIKODQS-HTAPYJJXSA-N 447.526 4.377 10 10 IICE CCOC(=O)CC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 1681827260 DODRUTOGSYKBPO-QGZVFWFLSA-N 435.996 4.451 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCC[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1 1685758433 LEDOWKPUAWANJF-IRXDYDNUSA-N 435.565 4.188 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCCCCN(Cc4ccccc4)C3)C2)cc1 1687025576 RYZRILCRKBKCPP-PKTZIBPZSA-N 436.600 4.018 10 10 IICE CCCCN(CC)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1728050960 ODAMBCWOYSBKAS-HXUWFJFHSA-N 429.634 4.010 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@@H](C(=O)OC)C2)cc1 1728383278 VGPDOELAXQJBDQ-HXUWFJFHSA-N 441.620 4.151 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CCCNc1ccc(C(F)(F)F)cn1 1729419576 VIEHWGQAVYHTSL-UHFFFAOYSA-N 446.477 4.414 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1)OC 1745267137 SAFMFHGKOOKTMW-SIKLNZKXSA-N 437.588 4.393 10 10 IICE Cc1cccc(-c2nnc(N(C)CC(F)(F)F)n2Cc2ccc3c(c2)CCCN3C)n1 1761910300 GEKSURDUKOZZBO-UHFFFAOYSA-N 430.478 4.078 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1765288215 QYZMOIXWFIWTGN-HYBUGGRVSA-N 448.615 4.162 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(C)C2CCC(C)CC2)cc1 1766612001 YWPOCRPMRPOUMK-ZNIKRAEXSA-N 438.620 4.139 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N([C@H](C)c3ccccc3)C2)sc2c1CCCC2 1859478983 RTLOHYYMOMQCJZ-WBVHZDCISA-N 440.565 4.352 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(Cc5ccc(C)cc5)[nH]c4c3)CC2)cc1 1872798522 ZQLFXZLKBZQBDN-UHFFFAOYSA-N 440.547 4.433 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC(C)C)C(=O)N(CCCCN3CCCC3)C2=O)cc1 1873166618 DQXMDFLJRZIPKN-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CN[C@@H](c1ccc2c(c1)CCN2C)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 1999536559 LRRFWMDPESTKLS-GMAHTHKFSA-N 425.573 4.050 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CNCc2cc(Br)ccc2O)CC12CCC2 2116698956 PSDIWKNBHPTDFQ-CQSZACIVSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cc(Br)cc(F)c3O)C[C@]2(C)C1 2172909935 QZNOVLDYDSZTNA-ZQGRQUNCSA-N 443.357 4.419 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2ccccc2C)c1C 2294037472 INQNZARQXDIEEM-NRFANRHFSA-N 434.536 4.254 10 10 IICE Cc1cccc(OCC2=NN3C(=N)C(=Cc4c(C)[nH]c5ccccc45)C(=O)N=C3S2)c1 2297364988 LLXGXCKBBYWBIY-UHFFFAOYSA-N 429.505 4.483 10 10 IICE CC(C)(C)c1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1 2313559792 TWMPJUIZSULVNT-UHFFFAOYSA-N 427.298 4.413 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3ccccc3Cl)nc3ccccn3c2=O)SC1=S 2314504373 JUUKUWOEXRZNBA-UHFFFAOYSA-N 443.937 4.361 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccc(O)cc3)SC2=S)cc1 2314832035 YHYPBORGOOYFBP-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CS(=O)(=O)Oc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1Cl 2824076 YOZNTNKZCSCEKG-MHWRWJLKSA-N 439.967 4.080 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475852 ZWDZWAUVKNZVHK-HYFFOGBASA-N 443.525 4.157 10 10 IICE CCCCCCN1C(=O)/C(=C\c2c(NCCC)nc3ccccn3c2=O)SC1=S 33474138 LRVBIEOTDURATN-JQIJEIRASA-N 430.599 4.298 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(O)c1/C=C1\C(=O)N(c2cccc(Cl)c2)C(=O)N=C1O 34222076 NITQKHUIYMWORG-YVLHZVERSA-N 440.818 4.186 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc(OC)c1O 59397702 GXERRFZRYFRWJX-PXNMLYILSA-N 432.479 4.032 10 10 IICE Nc1nnc(CCCN(/N=N/c2cccc([N+](=O)[O-])c2)c2cccc([N+](=O)[O-])c2)s1 59465016 QLMXJSFQFKDXGI-ZBJSNUHESA-N 428.434 4.075 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccc(OC)c(OC)c3)sc2C)cc1C 170550927 WSECKFUWDLHXKP-UHFFFAOYSA-N 434.539 4.254 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3cccc(C)c3)[C@H]2c2ccc(O)c(O)c2)c1 526230162 VYRIEFZHCKRIFH-HSZRJFAPSA-N 433.460 4.481 10 10 IICE COc1cccc(CNC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)c1O 729859177 KXYXYPLXMIZEQN-UHFFFAOYSA-N 431.414 4.413 10 10 IICE C[C@H](NC1CCN(C(=O)CCc2ccccc2)CC1)c1ccc(Br)cc1O 756477226 YDVRXVARBWPNDF-INIZCTEOSA-N 431.374 4.429 10 10 IICE CC[C@H](C)n1ncc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1C1CC1 763112384 PHOMDMWTXFSVAU-KRWDZBQOSA-N 447.583 4.436 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccc(N2CCOCC2)cc1 764691276 BVMXQXRKVCVSRL-MBSDFSHPSA-N 437.588 4.273 10 10 IICE C[C@@H]1CN(c2ccc(CNC3CCN(CCc4ccccc4)CC3)cc2F)C[C@@H](C)O1 765117456 FAADCPHQPUKDPX-NHCUHLMSSA-N 425.592 4.236 10 10 IICE CC(=O)Nc1sc(NS(=O)(=O)c2c(F)cccc2Cl)nc1-c1ccccc1 780730658 DSYNKSVJXQTYHU-UHFFFAOYSA-N 425.894 4.362 10 10 IICE CC1=C(c2ccco2)CN(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 800999377 XAFNEKHWHOMIEO-QZTJIDSGSA-N 427.520 4.421 10 10 IICE CC(C)(C)OC(=O)Nc1cccc(CC(=O)NCc2cc(Br)ccc2O)c1 804739725 QIESMCIZTSABRO-UHFFFAOYSA-N 435.318 4.361 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cc(F)cc(F)c4)CCCC3)CC2)c(OC)c1 1131806299 FGSSMGNFIVNJOY-UHFFFAOYSA-N 430.495 4.143 10 10 IICE CSCC1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 1134441853 JJIVCMSNOGKLQH-FOWTUZBSSA-N 440.681 4.331 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4cccc(Cl)c4)[nH]n3)cc2F)C[C@@H](C)O1 1136311196 IMDCVPZBZVIQGF-GASCZTMLSA-N 442.922 4.413 10 10 IICE COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc2cc(O)c(O)cc2s1 1138094962 GTQRFHURXUGKOZ-YOEHRIQHSA-N 425.506 4.094 10 10 IICE Cc1cc(C(=O)Nc2cccc(-c3nc[nH]n3)c2)c(C)n1-c1ccc(Br)cn1 1146791123 JEPQUAWSOYJNAG-UHFFFAOYSA-N 437.301 4.289 10 10 IICE C[C@H](NC(=O)c1cc(I)c(F)cc1F)c1ccc(N(C)C)cc1 1269587273 DPTHDPCNIFCGHE-JTQLQIEISA-N 430.236 4.126 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCO[C@H]2C(C)C)cs1 1290392770 QQTKQVFHWJYDBT-AVRDEDQJSA-N 441.601 4.037 10 10 IICE C[C@@H](NC(=O)c1nccnc1SCc1ccccc1)c1ccc(N2CCOCC2)cc1 1292236641 ZBXORJBCIGNOEH-GOSISDBHSA-N 434.565 4.097 10 10 IICE Cc1cc(CNC(=O)NCc2ccc(N3CCCNC3=O)cc2)c(C)n1-c1ccccc1 1313078579 GDIORQIIUATTOV-UHFFFAOYSA-N 431.540 4.013 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCCCC1 1313545633 CKLQYEBNXMJMOZ-UHFFFAOYSA-N 434.588 4.211 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(C4SCCCS4)cc3)cc2)CC1 1438888420 UPRPXYVKRQDCPT-UHFFFAOYSA-N 427.639 4.237 10 10 IICE COC(=O)[C@H](C)N(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CCC1 1447684053 IAHLZUFTHWXOKU-HNNXBMFYSA-N 433.346 4.413 10 10 IICE CCc1c(C(=O)NCc2cc(Cl)ccc2O)cnn1-c1ccc(Br)cc1 1452939887 AUHXXGWUOBEUII-UHFFFAOYSA-N 434.721 4.486 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)CC2)cc1 1455927365 DATAOSLDRBSAHD-NRFANRHFSA-N 445.604 4.206 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@@H](C(=O)OC(C)(C)C)CC[C@@H]2C)CCCC1 1461021430 FTLJBPZVXDCXFM-ROUUACIJSA-N 440.584 4.498 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(Cc3ccc(OC(F)(F)F)cc3)CC2)N(C)C)cc1 1463278757 GRFJWYFKCGJPCQ-OAQYLSRUSA-N 449.517 4.393 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc([C@H](C)OCC)s1 1467631634 OIRGIWMHECPHMZ-HNNXBMFYSA-N 433.574 4.243 10 10 IICE CCCNC(=O)OC[C@H]1CCCCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1467823166 XTZGNTGTAGMYPS-JOCHJYFZSA-N 425.529 4.038 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1 1470090802 SCEVXTIVSDJAAY-UHFFFAOYSA-N 427.545 4.282 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3CC3CCCCC3)cc2F)C[C@@H](C)O1 1473131585 GTHZHVGIQPZHJI-ZRCGQRJVSA-N 445.623 4.490 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N(Cc3ccccc3)c3ccccc3)CC2)cc1 1473295091 BMSCKTGUOVCWQV-UHFFFAOYSA-N 429.564 4.441 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)[C@@H](OC)c3ccccc3Cl)C2)cc1 1478466435 ITPHTRFWRHRKAX-DRSNIGMVSA-N 431.964 4.250 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(N(C)C(C)=O)CC2)n1Cc1ccc(N(CC)CC)cc1 1495454885 PENNXYUMTGRUPM-LJQANCHMSA-N 440.636 4.133 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CC[C@@H](C)C(C)(C)C2)cc1 1501830019 FQANHISRBICVKY-LJQANCHMSA-N 440.636 4.183 10 10 IICE CCSc1ccc(Cl)cc1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 1524982739 YQHMNEXWMUJVPN-UHFFFAOYSA-N 448.032 4.403 10 10 IICE CC(C)C[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1526259695 KZEKFGRMUQALGG-REWPJTCUSA-N 442.003 4.488 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CCc3cccc(OC(F)F)c3)cc2F)C[C@@H](C)O1 1527482576 ZFMVCNZQPBOPNA-HZPDHXFCSA-N 436.474 4.290 10 10 IICE Cc1cc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)ccc1F 1533210291 MHOYJYPJCPAPRW-FQEVSTJZSA-N 449.526 4.375 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN1CCC[C@@H]1C 1545504123 PCPJILMQHZSTPZ-SFTDATJTSA-N 440.636 4.001 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCCC[C@H]2C(=O)Nc2ccc3c(c2)CCO3)c1O 1559600045 KFRYVXNYGLKWPC-FQEVSTJZSA-N 428.916 4.176 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 1559832123 LHQJNCQFOCLILX-QHCPKHFHSA-N 449.517 4.145 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(=O)cc[nH]c4c3)cc2Cl)C1 1564649318 AQOGQVBEQYWTCH-MRXNPFEDSA-N 438.959 4.417 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1567998931 DBFYRUFUMOCPHH-HSZRJFAPSA-N 445.519 4.147 10 10 IICE CC/C(=C/C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(Cl)c1 1598009196 KQXCXZALKDLPEO-SDXDJHTJSA-N 425.960 4.152 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1603393810 UCYVDAVUOVBBTE-NHCUHLMSSA-N 439.648 4.358 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCN(CCC(C)(C)C)CC1 1611962795 BDVDHZGPMQXWEW-UHFFFAOYSA-N 449.647 4.254 10 10 IICE C[C@@H]1CCC[C@@]1(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1612751326 JYOUEHZEILKANV-PFBKUSTMSA-N 442.604 4.090 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N2CCN(CC)[C@H](C)C2)cc1 1615382004 JWRQJFFSOWJMKK-OAQYLSRUSA-N 438.664 4.436 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnc(CNC(=O)OC(C)(C)C)s1 1624630371 NQICRARCMMNFOU-UHFFFAOYSA-N 430.574 4.040 10 10 IICE Nc1cn(Cc2ccc(C(=O)NCc3ccc(N4CCCC4)cc3)cc2)nc1C(F)(F)F 1625377107 KCCGDQSZCCQHMJ-UHFFFAOYSA-N 443.473 4.063 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@H]2C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1627209351 CQFSVAKDYDFCAQ-SQJMNOBHSA-N 427.589 4.330 10 10 IICE CNC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)cc1 1628565034 DVLDIOOBHQUNKD-UHFFFAOYSA-N 432.524 4.360 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)[C@@H]2CCCCO2)NC(=O)OC(C)(C)C)cc1 1629678515 BNYKIMYILXZAQL-UXHICEINSA-N 433.593 4.030 10 10 IICE CCN(CCNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)C(=O)OC(C)(C)C 1632361137 DGDSEULCUZPHOB-UHFFFAOYSA-N 427.545 4.202 10 10 IICE CCCc1c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nnn1-c1ccc(C(C)(C)C)cc1 1632681870 WLJBKGUPJSISID-MRXNPFEDSA-N 436.556 4.290 10 10 IICE CCN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H](C)c1cc2ccccc2o1 1638478972 KLYNBVMFASPJFY-GOSISDBHSA-N 448.567 4.427 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)Cc1cnc2ccccc2n1 1639827283 NUHRJPAQXQEQNG-GOSISDBHSA-N 448.567 4.197 10 10 IICE CCO[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1642127757 ZOQRFQKAUADLQB-DHIUTWEWSA-N 448.563 4.316 10 10 IICE CC(C)N(C)c1ccc(NC(=O)CCN(Cc2ccccc2O)C[C@H]2CCCO2)cc1F 1642199395 DYOMICXUUCLICY-OAQYLSRUSA-N 443.563 4.386 10 10 IICE O=C(CN[C@@H](C(F)F)C1CCCCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1643888536 GRQNXUBZQUTJJE-OAQYLSRUSA-N 426.463 4.204 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3cnc(C)c(Br)c3=O)c2C)c1 1652265818 FQQZUVMAFIMICN-UHFFFAOYSA-N 446.370 4.327 10 10 IICE CN(CC(=O)NCc1ccc(N2CCCC2=O)cc1)c1ccc(OCc2ccccc2)cc1 1658280288 YPJMXZDSAOYUSQ-UHFFFAOYSA-N 443.547 4.145 10 10 IICE CC1(C)[C@@H](CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)[C@@H]1c1ccccc1 1681850226 UGIGZHTVMLAYBY-RXVVDRJESA-N 429.511 4.040 10 10 IICE C[C@H](NC(=O)N1CCOC[C@@H]1c1ccc(Br)cc1)c1ccc(N(C)C)cc1 1686173062 AANSYJIZDRORMT-MGPUTAFESA-N 432.362 4.359 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2ncc(Br)s2)cc1 1687397311 FSXGMGCPVRQSSW-UHFFFAOYSA-N 449.374 4.477 10 10 IICE Cc1ccc(-c2nnc(N3CCCN(C(C)C)CC3)n2Cc2ccc(N(C)C)cc2C)o1 1693066544 XNILRQAVWZBFOL-UHFFFAOYSA-N 436.604 4.190 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCC(COC)CC2)cc1 1746092047 BWXBTEBZCBILTR-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(CC)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1764273608 SXOKGMHXNBGSOL-QHCPKHFHSA-N 438.664 4.293 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](COC)C1 1765769457 IMGTYLDVSAVJBG-UGKGYDQZSA-N 437.588 4.393 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CCCO[C@H]1CCOC1 1767080818 PCXUMSHSFZDMMD-QFIPXVFZSA-N 441.620 4.008 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1770211177 ZYOIOOIENRNPNX-HARLFGEKSA-N 441.620 4.051 10 10 IICE COc1ccc(N2CCN(C(=O)CCSc3cccc(OC(F)(F)F)c3)CC2)cc1 1860347671 DPASHCXXMUGTFN-UHFFFAOYSA-N 440.487 4.425 10 10 IICE CN1CCc2cc([C@@H](O)C[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999508877 LXLXWIFYTYJDIG-GMAHTHKFSA-N 426.557 4.213 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1C(=O)O 2079945796 MBSOHJXLBFHIKE-MRXNPFEDSA-N 442.297 4.316 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)C2=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 2332144816 QEACBDZPZROVNX-UHFFFAOYSA-N 447.422 4.278 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCC(=O)O 16915667 ZLAZUYIZUPNRDN-RQZCQDPDSA-N 433.482 4.094 10 10 IICE O=C(O)c1cc(N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)ccc1O 16929478 GQSZRVXOSXODDW-AUWJEWJLSA-N 436.308 4.259 10 10 IICE COc1ccccc1OCCn1cc(/C=C2\C(=N)N3OC(C)=CC3=NC2=O)c2ccccc21 33535357 LTTUMBHRUSZXSD-CLYJROEGSA-N 442.475 4.179 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)NCc4cc(C)ccc4C)cs3)CC2)cc1 65211557 BHVZBYXMMNFXFT-UHFFFAOYSA-N 436.581 4.025 10 10 IICE CCN(C)c1cccc(NC(=O)c2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2)c1 109698261 MYKFTPUNVCHQPF-UHFFFAOYSA-N 427.501 4.335 10 10 IICE CC1CCN(C(=O)CN2C(=O)/C(=C\c3ccc(-c4ccccc4)o3)SC2=S)CC1 211951029 ALLTZFJXPIHADO-CPNJWEJPSA-N 426.563 4.406 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cccc4cccnc34)n2)cc1OC 735916532 WFNGZLUEKUTCHJ-UHFFFAOYSA-N 427.507 4.176 10 10 IICE Cc1cc(Br)cc([C@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)c1O 779019637 XZUXTMANCBGHBB-OLZOCXBDSA-N 427.364 4.246 10 10 IICE CC(=O)NCc1ccc(-c2csc(NS(=O)(=O)c3c(F)cccc3Cl)n2)s1 780702546 ATAUIQJSOMCBBU-UHFFFAOYSA-N 445.950 4.101 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC(C)(C)OC3(CCCC3)C2)c([N+](=O)[O-])c1Br 785847079 HKTZGQJSTJYKRI-UHFFFAOYSA-N 444.282 4.202 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCO[C@@H]1c1cnn(-c2ccccc2F)c1 792784834 MIOHRYKLUUONAM-XUZZJYLKSA-N 434.515 4.006 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1cc(F)ccc1Br 804937893 LIXFJOMISQEQEO-UHFFFAOYSA-N 432.087 4.056 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccccc1CCN(C)C(=O)OC(C)(C)C 1126082204 JABRMSUEYGJCGY-UHFFFAOYSA-N 425.573 4.400 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@@H]1c1ccccc1 1128473920 OISOHLFWRSNWSQ-BLSACVOKSA-N 426.538 4.089 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)CCCC1 1136272569 NRRZWILFQCPSFH-UHFFFAOYSA-N 441.572 4.044 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)Cc4ccccc4F)CC3)c2C)c1 1136482118 SADMLLUJEOHXPH-UHFFFAOYSA-N 433.527 4.069 10 10 IICE Cc1ccccc1NCCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1136903315 BKICRGWNZNVCBS-JOCHJYFZSA-N 440.588 4.245 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccc3c(c2)ncn3Cc2ccccc2OC)c1 1137473368 HKHUTULSWRMWSV-INIZCTEOSA-N 431.492 4.298 10 10 IICE COCC1(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCCC1 1147508936 XLULUMIPWLWQJC-FQEVSTJZSA-N 433.593 4.032 10 10 IICE C[C@H](NC(=O)NCc1c(O)ccc2c1CCCC2)C1CCN(C(=O)OC(C)(C)C)CC1 1235179523 ADSXWJMRMPAJGP-INIZCTEOSA-N 431.577 4.106 10 10 IICE Cc1nc(Br)sc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1265564091 BLMPIFGSRBREDJ-NSHDSACASA-N 446.317 4.214 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3c(F)cc(C(=O)OC)cc3F)ccc21 1289066295 LEXCNMVHLXJCMF-UHFFFAOYSA-N 431.435 4.326 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(C)CCOCC1 1291562188 DXPXZKWZUAMKSQ-HXUWFJFHSA-N 441.620 4.334 10 10 IICE Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 1296647819 DGINQBROHPEPPX-HNAYVOBHSA-N 429.362 4.226 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCN(c4ccc(C)c(C)c4)C[C@H]3C)C2)cc1 1312902846 QIQYBVFURRQCAZ-YADHBBJMSA-N 436.600 4.059 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)Cc2cnn(CC)c2)cc1 1313677028 IUQWOMFHVHZOGJ-UHFFFAOYSA-N 446.603 4.031 10 10 IICE CCS[C@@H](C)c1noc(CN(C)c2nnc(CC)n2Cc2ccc(N(C)C)cc2C)n1 1314582160 ITFHWZMACQBKDU-INIZCTEOSA-N 443.621 4.097 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@H]3CCCC[C@@H]32)sc2c1CC[C@@H](C)C2 1353908379 VPLWLFKXICIVQT-SRABZTEZSA-N 432.586 4.072 10 10 IICE COc1ccc2c(C)c(CCC(=O)N(C)Cc3ccc(N4CCCC4)cc3)c(=O)oc2c1 1353911259 PGBDOKZCEBPFLG-UHFFFAOYSA-N 434.536 4.301 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2C[C@@]23CCCN(C(=O)OC(C)(C)C)C3)C2CC2)cc1 1354141216 HHJYCNJRGINSPP-SQJMNOBHSA-N 427.589 4.281 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3oc(COc4ccc(C=O)cc4)cc3C)C2)cc1 1452026493 JRXYRBDQFBUHMX-HXUWFJFHSA-N 448.519 4.244 10 10 IICE COc1cc(C(=O)NCc2cc(O)ccc2O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 1455347341 LCSXLBRHCBNWHF-UHFFFAOYSA-N 444.827 4.390 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@@H](CO)Cc1ccncc1Cl 1458463751 LXXYVUUYYBTBEK-HNNXBMFYSA-N 425.872 4.137 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCC1(c2c(F)cccc2F)CCC1 1470524920 CZJCEWLJLSYJNC-UHFFFAOYSA-N 443.538 4.095 10 10 IICE CCCCN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H](C)c1ccccc1 1471369522 LJULVEAFEURDSY-FQEVSTJZSA-N 436.600 4.461 10 10 IICE COC(=O)C[C@@H]1CC[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1472271243 OYYNYQSECQNFIM-WBVHZDCISA-N 433.346 4.318 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)[C@@H](C)c3ccc(Cl)cc3)cc2F)C[C@H](C)O1 1473725789 UXTGLPSSCLFWBB-BZSNNMDCSA-N 447.982 4.402 10 10 IICE CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1478471043 MRQSYWQFTLIMOB-SJLPKXTDSA-N 442.526 4.036 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(=O)N(C)C 1515653222 XAZWVKIXSNGFAM-UHFFFAOYSA-N 448.615 4.457 10 10 IICE C[C@H](C1CC1)n1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1524167091 FBVABDMZVVKNQE-HVOBPNNYSA-N 444.557 4.223 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccc(C)cc4)cn3)cc2F)CC1 1530376640 KBWHNQJTYZHPKX-UHFFFAOYSA-N 448.542 4.393 10 10 IICE CS[C@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C(C)(C)C 1538396761 ZEBJOUGCOINYKN-RBFDBLARSA-N 440.631 4.311 10 10 IICE CN(C)c1ccc(CNC(=O)CCNC(=O)OCC2c3ccccc3-c3ccccc32)cc1 1539049160 ATEPKPPADZCCDZ-UHFFFAOYSA-N 443.547 4.298 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1547821980 PCJUEVBBIGJXRN-UHFFFAOYSA-N 437.588 4.393 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCOc2cc(Br)ccc2C1 1564946164 KYSFBGODPKSEEL-MRXNPFEDSA-N 446.389 4.359 10 10 IICE CSc1cc(C)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)o1 1565881316 AMJQGMGXLLUQFY-KRWDZBQOSA-N 433.574 4.372 10 10 IICE COc1cc(C)c([S@](C)=O)cc1OC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1570510604 MIUPSWHOMYGAHQ-PMERELPUSA-N 425.506 4.180 10 10 IICE CCO[C@H]1COCC[C@@H]1CC(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1 1585492790 MUVWFQCGFYTCJL-YKSBVNFPSA-N 426.557 4.126 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3ccccc3S(=O)(=O)C(F)F)c2C)c1 1587880792 ISEICFZIGWLGLJ-UHFFFAOYSA-N 446.519 4.258 10 10 IICE O=C(Cc1coc2c(F)c(F)ccc12)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595584085 LPHBEPHIYOVVJO-MRXNPFEDSA-N 434.870 4.393 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(C(=O)N(C)Cc2ccccc2)CC1 1596458192 BHJLPGDGMXEYBO-UHFFFAOYSA-N 436.581 4.165 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)CCCC1 1611030380 ONNWRTZKSSQTKQ-SFHVURJKSA-N 426.557 4.109 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1F 1616924277 IEZARHCTCBDOMN-AOMKIAJQSA-N 449.929 4.300 10 10 IICE CN(C)c1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)ccc1Cl 1617183536 SJFJFSHLRXBLER-UHFFFAOYSA-N 449.850 4.342 10 10 IICE Cc1cc(C(=O)NCC2(CN(C)C)CCCC2)c(C)n1-c1ccc(Br)cn1 1624828514 JPDLJLIOLXDEMU-UHFFFAOYSA-N 433.394 4.103 10 10 IICE C/C=C/[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1625689067 PUCXWTFEHVEWHJ-OBLPCYNLSA-N 429.344 4.374 10 10 IICE C[C@H](NC(=O)[C@]1(C)CC(c2cccc(Cl)c2F)=NO1)c1ccc(N2CCOCC2)cc1 1625882092 CPLXWZPHQKQBEW-WNSKOXEYSA-N 445.922 4.076 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3csc(Nc4cc(F)cc(F)c4)n3)C2)cc1 1627154378 OIZKHWIBIXFWPS-CQSZACIVSA-N 444.507 4.430 10 10 IICE Cc1ccc(C(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1628575332 OHPMIUGXLAWWTA-QHCPKHFHSA-N 429.520 4.093 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1csc(-c2ccc(Cl)s2)n1 1633789110 BRFGNLYBEPFRRK-UHFFFAOYSA-N 433.986 4.416 10 10 IICE CN(C(=O)/C(=C/c1cccnc1)NC(=O)c1ccccc1)c1ccc(Br)cc1 1638972676 OMLVIEFKCBQBIY-ZHZULCJRSA-N 436.309 4.278 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(NC(=O)NC(C)(C)C)ccc2Cl)cc1 1640771483 LTUMVGWYYHNEEK-UHFFFAOYSA-N 446.979 4.477 10 10 IICE CCOc1ccc(N(CC(=O)NCC(=O)Nc2cccc(Cl)c2C)CC2CC2)cc1 1648030769 VIDJPKFFWBNTPA-UHFFFAOYSA-N 429.948 4.018 10 10 IICE COC(=O)/C=C/c1ccc(N2CCCC[C@H]2c2ncc(Br)cn2)c([N+](=O)[O-])c1 1652248682 LGLSPQWLEKGZAC-BVBGJJFLSA-N 447.289 4.065 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H](c1ccsc1)N(C)C 1694635435 WJKMLLQZKUJNIB-QFIPXVFZSA-N 438.645 4.442 10 10 IICE CCCN(CC)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1709712586 PATIGLFIKATVAW-UHFFFAOYSA-N 429.584 4.271 10 10 IICE Cc1ccc(Cn2c(N(C)Cc3ccccc3O)nnc2[C@]2(OC(C)C)CCOC2)s1 1724370689 LVUZVDHOQNQJPD-QHCPKHFHSA-N 442.585 4.079 10 10 IICE CCC[C@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1727989409 AUVPHDGJWXNXRC-XZOQPEGZSA-N 441.620 4.420 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccn2)cc1 1728381665 WWQRSVANQNSLRZ-UHFFFAOYSA-N 429.572 4.210 10 10 IICE COCCN(c1nnc(CC(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@H](C)C1 1730742074 NEEKCYROZNKLKV-AZUAARDMSA-N 431.600 4.371 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3Cc3ccc(C)s3)CC2)cc1F 1748849698 VTMNGAJLOROXRF-UHFFFAOYSA-N 443.592 4.468 10 10 IICE C[C@H]1CCCN(CCCCn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1752173578 JGXGFOSCJFSFLC-NRFANRHFSA-N 448.615 4.118 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCNC(=O)OC(C)(C)C)o1 1761738136 PZTXQQUSQWDDKC-UHFFFAOYSA-N 441.532 4.103 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N(C)CC2COC(C)(C)OC2)cc1 1764931001 MQVJXZRNLUVYHN-UHFFFAOYSA-N 429.609 4.131 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CCO[C@H](C)C3)CC2)cc1 1768704491 GRXYGPVJAQQOPI-NHCUHLMSSA-N 441.620 4.017 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1769399474 IAICWCLFSHYVKI-IBGZPJMESA-N 441.551 4.353 10 10 IICE O=C1/C(=C\c2cc(Cl)cc(Br)c2O)SC(=S)N1CCCCCO 1858589944 QFBLXJJBPKVYAE-KPKJPENVSA-N 436.780 4.172 10 10 IICE CN1CCc2cc([C@H](N)C[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536535 LLTAWPQMMLZRFE-FCHUYYIVSA-N 425.573 4.179 10 10 IICE Oc1ccc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156277328 JIIUPOJCJFUWRQ-UNMCSNQZSA-N 431.374 4.068 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C(C)C)c1O 2236054346 HMDWVFBXBNEYRS-DOTOQJQBSA-N 443.382 4.287 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S)Nc1ccccc1 2296885091 BSHZYJGYBGYUJJ-UHFFFAOYSA-N 426.519 4.035 10 10 IICE CN1C(=O)C(=Cc2cn(Cc3cccc4ccccc34)c3ccccc23)C(=O)NC1=S 2313656623 NARUHDACOSMAPM-UHFFFAOYSA-N 425.513 4.099 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]2C[C@@H]1CNCc1c(O)cccc1Br 2335115772 OPIJJOWCZLNPJK-VBQJREDUSA-N 425.367 4.422 10 10 IICE Cc1ccc(CN[C@@H]2[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@H]2C)c(O)c1Br 2352948329 ZNFDDUOTBWODNN-HALDLXJZSA-N 427.383 4.444 10 10 IICE Cc1ccc(S(=O)(=O)Nc2cc(C)c3c(c2C)-c2ccccc2S(=O)(=O)N3)cc1 15773021 CVOJMTOWWSETIY-UHFFFAOYSA-N 428.535 4.194 10 10 IICE C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726567314 GWOTXCRUVGURKX-YCRPNKLZSA-N 443.494 4.281 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccn(-c3ccccc3N)n2)c(C)n1-c1ccc(F)cc1 745059833 GNEYEOSKHKFKAV-UHFFFAOYSA-N 432.455 4.041 10 10 IICE O=C(NC1CCN(c2ccccc2)CC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745738091 SQRGNVSSRMHPBK-LJQANCHMSA-N 444.526 4.225 10 10 IICE CCC1(CC)CN(C(=O)c2ccccc2SCc2csc(C)n2)CCS1(=O)=O 779361868 URSQTFUKNSMLSE-UHFFFAOYSA-N 438.640 4.173 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3ccccc3CCc3ccccc3)cc2)CC1 786660419 FPHVPTCJKTVMOF-UHFFFAOYSA-N 441.575 4.070 10 10 IICE CNC(=O)c1cccc(CCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 800049586 RBDVKHPDCVQCII-KRWDZBQOSA-N 427.976 4.185 10 10 IICE CC(C)(C)OC(=O)N1CCC(=CC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 815796816 NOZDTARDUVWMIE-UHFFFAOYSA-N 426.513 4.471 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COC3(CCCC3)O2)c(C)n1-c1ccc(Br)cc1 1137839345 BRJNMPPPDZFRMO-GOSISDBHSA-N 433.346 4.272 10 10 IICE CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1138534601 BZENOANPUQPJGW-INIZCTEOSA-N 433.268 4.242 10 10 IICE O=C(CN(Cc1ccccc1O)C1CCCC1)NCCOc1cccc(C(F)(F)F)c1 1167354073 XUTJRAOTOGLFDP-UHFFFAOYSA-N 436.474 4.351 10 10 IICE Cc1c(Br)cccc1CNC(=O)NCc1cccc(Br)c1O 1230419662 HAEAHOQIMOKLTD-UHFFFAOYSA-N 428.124 4.225 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN2C[C@@H](C)C[C@@H](C)C2)n1 1289918433 DLTLCKSQAIIKJC-BGYRXZFFSA-N 448.615 4.359 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C[C@@H]1C 1291257289 IOBFTVNNYUOMBS-PMACEKPBSA-N 439.648 4.216 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3c(F)cccc3F)cc2F)C[C@@H](C)O1 1291756314 OMLJJGMHWBWGDN-ZIAGYGMSSA-N 444.457 4.038 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC3(CCCC3)C2)cc1 1295411608 VKGMWCRLXMKTGF-UHFFFAOYSA-N 438.620 4.081 10 10 IICE COc1cc(N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)ccc1F 1296977399 PQHBWNUBBLLYAX-UHFFFAOYSA-N 425.479 4.343 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc[nH]4)n3CCSC(C)C)CC2)cc1 1300246429 ATGNNMYTZFQPBV-UHFFFAOYSA-N 440.617 4.140 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCCn1ccnc1C 1302331445 BGRYKIXMDVMYSP-UHFFFAOYSA-N 433.560 4.336 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)SC)C1 1302390793 RWVRDAOKODLSEY-XLIONFOSSA-N 425.602 4.329 10 10 IICE Cc1cc(-c2nnc(N3CCOC(C)(C)[C@@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1304195724 GAUZESJZGJRWSN-IBGZPJMESA-N 437.588 4.127 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCC(F)(F)C1 1314305105 IHYMOJLMPPPBPI-IBGZPJMESA-N 433.547 4.487 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](COC)C1 1315773057 DFJDRLKGDDDLHW-WIYYLYMNSA-N 437.588 4.108 10 10 IICE COc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1OC(C)C 1359864597 AKPZLGQBBZKDGF-UHFFFAOYSA-N 434.483 4.483 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)ccc3OC(F)F)cc2F)CC1 1435072863 DEAOWZMMUATSPR-UHFFFAOYSA-N 441.881 4.152 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CSCCS2)c(C)n1-c1cccc(Br)c1 1445294545 RHMPIXVVCIMYFK-MRXNPFEDSA-N 425.417 4.435 10 10 IICE CCN(CC)C(=O)[C@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1455977087 IFJDATRECJAKQK-HXUWFJFHSA-N 434.005 4.060 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc4c(c3)NC(=O)[C@@H](C)N4C)cc2Cl)C1 1459584033 OVEOFXKUVAXAOQ-HZPDHXFCSA-N 440.975 4.283 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccco2)N(C)C)c(C)n1-c1ccccc1Br 1463649600 IPQAPPUJPAOINN-LJQANCHMSA-N 430.346 4.482 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)c3c(F)cccc3F)CC2)c1 1464736737 DQNYVFBCBIEINV-UHFFFAOYSA-N 437.490 4.279 10 10 IICE COc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c(C(=O)NC2CC2)c1 1464983179 BYYYEXDWXHBFRT-UHFFFAOYSA-N 445.519 4.368 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1O 1465851476 VIKHMHUSMDODQK-UHFFFAOYSA-N 429.654 4.084 10 10 IICE CCOC(=O)C[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1466622824 QHSJORJCMFBOPI-XMMPIXPASA-N 432.520 4.260 10 10 IICE Cc1cc(CC(=O)N2CCn3c(nnc3C(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1470391808 GRIPQGYUNOUVGN-UHFFFAOYSA-N 425.964 4.221 10 10 IICE COc1ccc([C@@H](NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c2ccco2)cc1 1470541334 NCJTUHRPVQXDJC-XMMPIXPASA-N 435.524 4.056 10 10 IICE Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471912673 TVBKMLMROAYKOE-IBGZPJMESA-N 436.600 4.083 10 10 IICE COC(=O)CN(CCCN1CCC(Cc2ccccc2)CC1)Cc1cc(Cl)ccc1O 1473234696 WPSJOJDSGHQSNL-UHFFFAOYSA-N 445.003 4.365 10 10 IICE COC1CCN(c2ccc(CN3CCC(C(=O)Nc4ccc(Cl)cn4)CC3)cc2)CC1 1473268387 PTMFGFLNBAMLPG-UHFFFAOYSA-N 442.991 4.201 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC[C@@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1479535044 RVWYZOLORRZBMN-BVAGGSTKSA-N 445.611 4.076 10 10 IICE CCc1noc(C)c1Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1499261814 YFUPSLPOGNJWGK-UHFFFAOYSA-N 438.576 4.034 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)OC 1503185601 MBMCXFJCZNKZQE-UHFFFAOYSA-N 425.577 4.250 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512878442 ZDIRQSNQPXITRB-AZUAARDMSA-N 429.584 4.298 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3c(Br)cnn3C)cc2Cl)C1 1530425133 OJGNTPVMPNXNNQ-GFCCVEGCSA-N 425.758 4.002 10 10 IICE Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1538975320 CBVPYYMJONHOFP-MOPGFXCFSA-N 443.613 4.115 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H](CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1546651839 PXJVIQWUNANFNB-QGZVFWFLSA-N 444.599 4.076 10 10 IICE CCN(CCn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1547584757 HGXCXGURRFMSAZ-UHFFFAOYSA-N 435.620 4.240 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(OCC(F)(F)F)o1 1556426391 KZXIVSLPYWTRIV-UHFFFAOYSA-N 442.434 4.223 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3c(Cl)cccc3Br)C2)cc1 1584444001 BUSNHSMBGVKPFN-CQSZACIVSA-N 437.765 4.296 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(NC(=O)c3ccccc3)cc2)N(C)C)cc1 1586054886 PYPBAPYPTDGANY-XMMPIXPASA-N 430.552 4.038 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(O)c(Cl)c1 1596820483 WRGDCWTUKWTDFL-CXUHLZMHSA-N 436.917 4.415 10 10 IICE CC1(C)CO[C@@H](CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1597742062 CFKDAGHWQGLRAJ-HNDQUVLASA-N 438.640 4.051 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC[C@H](C)C1 1615090279 BFQHIJCQZYQRFI-IBGZPJMESA-N 448.615 4.457 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)C1 1625057051 ADEBDMXEQVZCEV-QZTJIDSGSA-N 443.548 4.348 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ncc(Br)s2)C1 1625306631 CXKOHKOMFLZDIJ-UHFFFAOYSA-N 433.375 4.266 10 10 IICE CCO[C@@H]1C[C@@](NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)(C(=O)OC)C1(C)C 1625393111 KWFPWGOEPSHNIR-PXDATVDWSA-N 426.557 4.188 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nc(C)c(Br)s1 1629972917 YTRSCHBDPMLLKE-UHFFFAOYSA-N 434.153 4.344 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2c2ncccn2)c(C)n1-c1ccc(Br)cn1 1633624372 VGAIZPFWRCXXEY-SFHVURJKSA-N 440.345 4.409 10 10 IICE COC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1634720247 RWNPAQPCVAEKPQ-MRXNPFEDSA-N 429.948 4.362 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cnn(Cc4ccccc4)c3N)cc2Cl)C1 1639533185 DQDWNIASDZTIBB-KRWDZBQOSA-N 437.975 4.333 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4ccc(C(F)(F)F)cc4nc3O)C2)cc1 1639686582 DDXSWUNTTCFNME-CQSZACIVSA-N 445.441 4.224 10 10 IICE Cc1cc(CNC(=O)c2c(Br)nc3n2CCCC3)c(C)n1-c1ccccc1 1648611685 MECZOCVQAXABDA-UHFFFAOYSA-N 427.346 4.319 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3cccc(C4CC4)c3)cc2F)C[C@@H](C)O1 1653716441 LKSJTHRMNOPOLQ-CEXWTWQISA-N 439.575 4.284 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 1683255041 XFFSDGMMPSLUBO-GOSISDBHSA-N 440.563 4.191 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCSC[C@@H]3c3ccc(Cl)cc3)C2)cc1 1683945824 WVBUMFDDTWZLBQ-WIYYLYMNSA-N 431.989 4.427 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@@H](C)C3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1692981469 GUIPDWOCPCASIB-KDURUIRLSA-N 448.615 4.217 10 10 IICE CCS[C@@H]1CC[C@H](N(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1696546759 VQZLVIZDGPQDNJ-BAGYTPMASA-N 443.661 4.315 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@](C)(CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1708721030 BPFSAUNIUMYHPA-XMMPIXPASA-N 444.599 4.076 10 10 IICE Cc1cccc(-c2nnc(N3CCOC(C)(C)[C@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1724507672 ZQQNCFWNPTWSCP-LJQANCHMSA-N 434.588 4.075 10 10 IICE CC1=CCCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1742470056 INXNLEQSEDKALX-UHFFFAOYSA-N 426.927 4.403 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCC[C@@H]2CSC)cc1 1764939961 ZKRZGOYQUDXMMB-IFMALSPDSA-N 443.661 4.398 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CCOc3ccc(OC)cc3)C2=O)cc1OC 1858587121 OBINWMGDNBAAMI-XSFVSMFZSA-N 445.562 4.383 10 10 IICE Oc1ccc(Br)cc1CN[C@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1878709449 GTGVAUBNVLJYDN-SJORKVTESA-N 429.280 4.307 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)C12CCC2 2175027983 WFFZIEZDFIFPLB-CZUORRHYSA-N 443.357 4.467 10 10 IICE CC[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1c(Br)ccc(OC)c1O 2236056994 YNMYNAPPKSWYPR-XJKSGUPXSA-N 443.382 4.289 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cccc(OCc2ccc(F)cc2)c1 2294118636 HNGMYNYTFIAHGQ-UHFFFAOYSA-N 434.398 4.210 10 10 IICE C/C(NCc1ccc2c(c1)OCO2)=C1\C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 17096428 DBBREAIAJNSIAJ-XQNSMLJCSA-N 429.451 4.369 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)CCCc3ccccc3)c3ccco3)CC2)cc1 38598114 BFWWKLFEDXDDPG-RUZDIDTESA-N 447.579 4.291 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526400807 PXQMLXHWUCHYOX-HSZRJFAPSA-N 433.460 4.481 10 10 IICE Cc1cc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nc(-c2ccccn2)n1 731662258 HLUQSMIMLRXMRW-UHFFFAOYSA-N 429.446 4.315 10 10 IICE CN1CC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@@H]1c1ccc(F)c(F)c1 764510010 CIPLBRRUPYANDF-GGAORHGYSA-N 441.478 4.421 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCOc2c(Cl)cccc21 775778156 PQHZCNPLYDVWOS-QFIPXVFZSA-N 443.975 4.262 10 10 IICE COc1ccc(F)cc1-c1csc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)n1 782261914 SGTQTNBOTFAKFK-UHFFFAOYSA-N 433.408 4.172 10 10 IICE CCN1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@H]1c1cc(F)c(F)c(F)c1 782518773 AUUUUTQPJBOTOX-JTHBVZDNSA-N 444.501 4.115 10 10 IICE COc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc(Cl)c1O 785599049 ZTIVSGPHOYHSCV-ZDUSSCGKSA-N 426.847 4.054 10 10 IICE CN(CCC(F)(F)F)[C@H](CNCc1cc2c(cc1O)OCO2)c1ccc(Cl)cc1 790602411 VQEPBQNIIQJYGX-MRXNPFEDSA-N 430.854 4.489 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1c(Cl)cccc1Br 800925952 YNXVLRKKEOVGMG-UHFFFAOYSA-N 430.736 4.422 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cccc(C(=O)Nc2ccccc2)c1 804736867 CHEOOEILWDURNA-UHFFFAOYSA-N 425.282 4.337 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1Br 1125257116 TUEHHXPFSBLSGM-GJZGRUSLSA-N 435.337 4.440 10 10 IICE COC(=O)COc1cccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1125404851 UKPKACLIFCAPCX-UHFFFAOYSA-N 426.900 4.481 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1c(F)ccc(I)c1Cl 1126081877 GVGOPFKXCUNXPZ-UHFFFAOYSA-N 446.691 4.388 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(Cl)c(Cl)c4)n3)CC2)cc1 1127190408 QWNAHPFZXMXFEL-UHFFFAOYSA-N 445.350 4.459 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)nnn1-c1ccc(F)c(F)c1 1144773420 OFTMLWJSOJILAS-UHFFFAOYSA-N 425.483 4.020 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cc(Br)c(Br)[nH]1 1162806192 QTQCZULXWJEGEQ-UHFFFAOYSA-N 441.167 4.460 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@@]3(C)Cc3cccc(Cl)c3)cc2)CC1 1246301920 IUTICGSFXZGPHF-VWLOTQADSA-N 441.019 4.399 10 10 IICE O=C(NCc1cccc(Br)c1O)NC[C@H](Cc1ccccc1)c1ccccn1 1251639539 DUDWKPYOQASANL-SFHVURJKSA-N 440.341 4.375 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@@H](c4c(F)cccc4Cl)C3)C2)cc1 1252116123 PGAWNJPIWOKENS-HRAATJIYSA-N 447.938 4.097 10 10 IICE CCCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccc(F)cc1 1276831814 FLDKGTJXZRWXPJ-SFHVURJKSA-N 436.531 4.229 10 10 IICE CC(C)[C@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1287288823 TYUHISWIJZMZFJ-IAGOWNOFSA-N 437.635 4.020 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 1294859086 HYDOUWJJXLLAEM-IKGGRYGDSA-N 438.877 4.347 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3[C@@H]2O)c(C)n1-c1cccc(Br)c1 1298767512 QGKPOEHTEDWWBS-CTNGQTDRSA-N 441.325 4.081 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCCO4)n3CCC=C(C)C)CC2)cc1 1300248044 VZXXOQBRDDBGOW-JOCHJYFZSA-N 425.577 4.211 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3cccnc3)n2CCCSc2nccs2)o1 1361257551 CNAPUXKNORGFMO-UHFFFAOYSA-N 440.598 4.441 10 10 IICE O=C(Cn1ccc2ccc(Cl)cc21)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445886252 SQJOXNIZNNOVPZ-LJQANCHMSA-N 432.351 4.435 10 10 IICE CC[C@H]1NC(=O)N(c2cccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)c2)C1=O 1448868057 VHBDUSDNNJJEHO-OAQYLSRUSA-N 430.508 4.490 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2n[nH]c3nc(C(F)(F)F)ccc23)c1 1457228141 PGXZAPITNGJULD-UHFFFAOYSA-N 427.386 4.449 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)Cn3ncc4ccc([N+](=O)[O-])cc43)cc2Cl)C1 1459579292 MEBDPWWXTOIZPK-OAHLLOKOSA-N 441.919 4.151 10 10 IICE C[C@@H](C(=O)NCCCSc1nccs1)c1ccc(I)cc1 1464899803 IZECGOAMJFQFDM-LLVKDONJSA-N 432.352 4.150 10 10 IICE CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc2cc(O)c(O)cc2s1 1466159282 IXGOHWPXXPVMEF-KRWDZBQOSA-N 426.538 4.145 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(C)ccc(Br)c3[nH]2)cc1 1469805500 MTOXIVIMUZXTHQ-UHFFFAOYSA-N 430.346 4.456 10 10 IICE C[C@H](NC(=O)NCc1cccc(Br)c1O)c1ccc(-n2cccn2)c(F)c1 1470301747 WWSANVYGPSQTRB-LBPRGKRZSA-N 433.281 4.040 10 10 IICE CC(C)(C)OC(=O)N1CCC(Cc2ncc(C(=O)NCc3c(O)cccc3F)s2)CC1 1471975838 JFXMMFOTFQWDBA-UHFFFAOYSA-N 449.548 4.107 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1CCC(F)(F)CC1 1499154768 XIDWNXVZJPPCIB-UHFFFAOYSA-N 437.510 4.140 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)CCO1 1499753041 ZHHGLMBCFMLCAJ-KRWDZBQOSA-N 447.605 4.262 10 10 IICE Cc1ccc(N=Nc2cc(C)ccc2NC(=O)c2c3c(nn2C)CCS(=O)(=O)C3)cc1 1523258429 XPQGWYJOPLYSDT-UHFFFAOYSA-N 437.525 4.176 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3coc(-c4c(F)cccc4F)n3)cc2F)C[C@@H](C)O1 1527481948 SKOAZSTZSXLDMI-ZIAGYGMSSA-N 445.441 4.303 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3nccc4c(Br)cccc34)C2)cc1 1532106013 PNDJHIBOTCGXTE-CQSZACIVSA-N 426.314 4.015 10 10 IICE CCCc1cnc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1537163707 QQZDMGFRBBFTGA-GDNBJRDFSA-N 435.571 4.465 10 10 IICE CC(C)CCCn1c(CN2CCCC2=O)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1541504068 XNMWUHPMXRCGER-UHFFFAOYSA-N 438.620 4.073 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)cc2)cc1 1545813535 JHTVQPCNXGCOAF-AZGAKELHSA-N 433.527 4.150 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2C[C@H](C)S[C@@H](C)C2)cc1 1547447084 OAWCFLXQUVVOIW-CMKODMSKSA-N 429.634 4.007 10 10 IICE FC(F)(F)C1=CCN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)CC1 1555966742 HWCLDHVMGWGJAH-ZDUSSCGKSA-N 445.536 4.120 10 10 IICE Cc1ccc(C(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cc1-n1c(C)cc(C=O)c1C 1556639519 GYDNRMJLPQEIDH-RBUKOAKNSA-N 443.547 4.311 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@]34CCCN(C(=O)OC(C)(C)C)C4)cc2)CC1 1559746245 RVQDYFQSTOBTKR-RUZDIDTESA-N 429.605 4.277 10 10 IICE COc1cc(CN(C)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)ccc1OC(F)F 1564946011 WVZDQUZRKSDRQM-MRXNPFEDSA-N 435.515 4.444 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NCc2ccc(C)cc2)cc1F 1616055837 GUWZCQUNQZCFEJ-UHFFFAOYSA-N 435.499 4.148 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C3(C)OCCO3)C2)c(C)n1-c1ccccc1Br 1623726613 GOJDHHGTILFRSX-QGZVFWFLSA-N 447.373 4.472 10 10 IICE CCCCCCn1nc(C(=O)NCc2ccc3c(c2)CCCN3C)c2ccccc2c1=O 1625848152 WWTLFIDJAIESKJ-UHFFFAOYSA-N 432.568 4.289 10 10 IICE CC(C)(C)OC(=O)N1CCOc2ccccc2[C@@H]1C(=O)NCCCSc1nccs1 1627198749 IWXJITKWMLHCCY-QGZVFWFLSA-N 449.598 4.112 10 10 IICE CCOc1ccc(-c2nc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cs2)cc1 1627464457 NJTRCTXWORNROG-JOCHJYFZSA-N 438.597 4.308 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)c2C)cc1 1627730700 SHOXDTOWEOMZCQ-SJLPKXTDSA-N 431.536 4.199 10 10 IICE C[C@@H](CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCc2ccccc21 1629055435 JHOJDPXBBVTBAB-HKUYNNGSSA-N 429.511 4.214 10 10 IICE COCCN(Cc1c(C)nn(C)c1C)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1629329233 LKDZSIJFWSFRRZ-UHFFFAOYSA-N 428.964 4.387 10 10 IICE Cc1cc(C(=O)NCc2ccc3nc(O)[nH]c3c2)c(C)n1-c1cccc(Br)c1 1631397472 UOAZLMQSKSAYCK-UHFFFAOYSA-N 439.313 4.369 10 10 IICE COC(=O)CCC1(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CCCCC1 1635739899 XDTQJXQESYNCBO-UHFFFAOYSA-N 439.600 4.180 10 10 IICE CCOC(=O)[C@@H](CC1(OC)CCC1)NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1640785762 FGLLBZSWXQAYLA-OAQYLSRUSA-N 446.975 4.297 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)c(C)n1-c1ccc(Cl)cc1 1641923754 NKVMXZOUQVURBZ-GOSISDBHSA-N 427.898 4.433 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)N(Cc3ccccc3O)C3CCCCC3)C2)cc1 1681946240 VMCAWKPVLAEEEE-JOCHJYFZSA-N 437.540 4.438 10 10 IICE CCc1ccc(CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C2CC2)cc1 1683014059 BYAYRFHPTDFJQW-UHFFFAOYSA-N 429.511 4.238 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CC[C@H](CSc2ccccc2)C1 1683195508 DNTXUCGWIOMTCG-KRWDZBQOSA-N 447.551 4.125 10 10 IICE Cc1cc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1Br 1683200350 WKGFTTKRDYDOHN-SFHVURJKSA-N 433.346 4.354 10 10 IICE Cc1cc(CNC(=O)N2CCC(OC[C@H]3CCCCO3)CC2)c(C)n1-c1ccccc1 1684604647 RXKZGYPPYURTAU-XMMPIXPASA-N 425.573 4.354 10 10 IICE Cc1cc([C@H]2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)C2)c(O)cc1Cl 1685686635 NWMIASYWBXJMKF-AVRDEDQJSA-N 445.007 4.222 10 10 IICE Cc1nc(Cc2nnc(N3C[C@@H](C)[C@@H](F)C3)n2CCCSc2nccs2)cs1 1707764295 QTHLTMJKRSKKTM-DOMZBBRYSA-N 438.623 4.067 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1710773424 LWADENWPJORXFN-PZJWPPBQSA-N 437.588 4.250 10 10 IICE C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C[C@@H]1C 1743166575 NPFVLHBSJGWWBL-UXHICEINSA-N 425.621 4.234 10 10 IICE CN(CC1COC(C)(C)OC1)c1nnc(C(C)(C)C)n1CCCSc1nccs1 1768820293 PCPPWUNNIFWNGW-UHFFFAOYSA-N 439.651 4.050 10 10 IICE CC(C)c1ccc(/C=C2/SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 1858590417 ORQZSCSYOWHNHK-LSCADSNKSA-N 427.547 4.413 10 10 IICE COc1cc(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)cc(OC)c1OC 1860087583 HWXBAWBNSVTSRF-LZYBPNLTSA-N 432.479 4.026 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(C)C)c(C(=O)O)c2I)c(O)c1 2079138070 SXXWKVMDTCPLQN-MRXNPFEDSA-N 440.281 4.323 10 10 IICE CN[C@H]1C(=O)Nc2cc(N(Cc3ccccc3)CC(F)(F)F)c(Br)cc21 2095861386 GQLLPVQWNDGDKG-MRXNPFEDSA-N 428.252 4.231 10 10 IICE CC[C@H](NC[C@@H]1C[C@@H](OC)CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2172450424 XBLMRKUICOITMV-UXLLHSPISA-N 443.382 4.220 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@]2(NCc2cc(Br)cc(F)c2O)C1 2182446911 DBUQZYXXHHWKSD-OALUTQOASA-N 447.320 4.265 10 10 IICE CCC[C@@]1(NCc2c(Br)ccc(OC)c2O)CCN(C(=O)OC(C)(C)C)C1 2236054206 FZBOYJHSKAYBQH-HXUWFJFHSA-N 443.382 4.433 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)C(F)(F)C1 2264438288 ZTIJPVOQXHLTPQ-ZDUSSCGKSA-N 439.272 4.028 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@@H](N)c3ccnn3Cc3ccccc3)cc2)CC1 2270550823 JPVSKQLRNNOBTQ-XMMPIXPASA-N 447.583 4.037 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)cc1 2296398131 VTVILJKIRYYLAQ-UHFFFAOYSA-N 431.404 4.084 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(C)c3C)C2=O)ccc1OCC(=O)O 2314933075 SFMGPBWJFULMTK-UHFFFAOYSA-N 429.519 4.181 10 10 IICE COc1ccc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)cc1[N+](=O)[O-] 2321629618 MFSFDRPZXPFOLJ-UHFFFAOYSA-N 446.535 4.335 10 10 IICE COc1ccc(C2=NN(c3ccccn3)C(=O)C2=Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 2332134667 WNLSZQBBLJJWMU-UHFFFAOYSA-N 434.839 4.486 10 10 IICE CCOC(=O)COc1c(/C=C2/SC(=S)N(c3ccccc3C)C2=O)cccc1OC 3002259 CFDBYWWFZFLLHE-LDADJPATSA-N 443.546 4.351 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478077 OSCRUMCLLZLPJU-WHSLLNHNSA-N 427.526 4.498 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3ccc(C)c(C)c3)C2=O)c(C(=O)O)c1OC 16906147 WDRJETCKKUGJSJ-MHWRWJLKSA-N 429.519 4.425 10 10 IICE CC1=NN(c2cccc3ccccc23)C(=O)/C1=C/Nc1ccc(C(=O)N2CCOCC2)cc1 101128654 CDWRTJHRIIVSQR-HAVVHWLPSA-N 440.503 4.031 10 10 IICE CCC(C)(CC)NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 733111305 RJPILMYRUXMQRR-GXDHUFHOSA-N 441.416 4.345 10 10 IICE CCC1(NC(=O)CN2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)CCC1 752373916 LWVDPNRSQYHPLL-GXDHUFHOSA-N 439.400 4.099 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1 778826926 NSWNKWBVTSHTFS-UPNLOYSTSA-N 433.499 4.263 10 10 IICE COc1ccc(NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C(F)(F)F)n1 801721460 WBTNLDNRWMTVMV-CQSZACIVSA-N 425.407 4.028 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ncc(C(F)(F)F)s1 801755550 QGHFEIZPQYIQLP-UHFFFAOYSA-N 439.507 4.016 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCc4[nH]c5ccccc5c4C3)cc2F)C[C@@H](C)O1 918223366 ZZZHJGDKNRQUFL-CALCHBBNSA-N 436.531 4.189 10 10 IICE CCOc1cc(N(CC)CC)ccc1/C=C1\C(=O)NC(=O)N(c2cccc(C)c2C)C1=O 1084590076 AUDCFYRBUGDYEK-XSFVSMFZSA-N 435.524 4.215 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3nc4ccccc4cc3Cl)cc2F)CC1 1125976226 QUHNCPWPVTVGIY-UHFFFAOYSA-N 426.923 4.099 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1cccc(F)c1 1137423067 TWIDGUALJNJVGL-UHFFFAOYSA-N 440.494 4.074 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](CO)Cc1ccc(Br)cc1 1138197838 IPSOOLQYSAASQP-KRWDZBQOSA-N 447.398 4.499 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1 1141723590 WSDOTZDWEKDVTF-QGZVFWFLSA-N 435.528 4.372 10 10 IICE CCSc1cccc(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1160651913 DROWZCVZWNPKLG-UHFFFAOYSA-N 448.591 4.297 10 10 IICE COc1ccc([N+](=O)[O-])c(OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)c1 1166399451 HDABAUTTWLKVMI-UHFFFAOYSA-N 438.436 4.044 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(C)c(F)c1 1192880858 KBCAEAOWRZVADU-BSRJHKFKSA-N 445.554 4.244 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)cc1 1195789347 LSEONZOOELFLHQ-UHFFFAOYSA-N 439.556 4.134 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1C 1290116125 QCBDQVOQRKYAMM-UHFFFAOYSA-N 431.945 4.216 10 10 IICE C[C@H]1COCC[C@@H]1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1291300015 HPSCJGBMWJBSCX-PZJWPPBQSA-N 425.621 4.485 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 1312883990 GAPCTJIJFUIEQU-PXNSSMCTSA-N 441.538 4.383 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)sc2c1CCCC2 1349327931 XHUZJDGCUJSDTG-LBPRGKRZSA-N 448.491 4.073 10 10 IICE COCCNC(=O)c1ccccc1NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1349523423 FSEOEHKXGUZPCI-UHFFFAOYSA-N 439.943 4.305 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccnc(-c4ccccc4)c3[N+](=O)[O-])CC2)cc1 1359816856 UKUOWJQQFPQLJX-UHFFFAOYSA-N 432.480 4.064 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)Cc1scnc1C 1361097894 KVVOSMPHSHZRJA-UHFFFAOYSA-N 447.612 4.088 10 10 IICE Cc1cc(CC(=O)NCCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccc(Cl)cc1 1459889122 LAAQUFVZIIAKAG-UHFFFAOYSA-N 449.938 4.093 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1461754259 KTROGDVRQUTJNG-NVXWUHKLSA-N 447.270 4.446 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(Cc4cccs4)CCCCC3)cc2)CC1 1462810540 XEBYWGUYGHLTCE-UHFFFAOYSA-N 439.625 4.259 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)NC3CCCCC3)CC2)c(C)n1-c1ccc(F)cc1 1463533886 CNAWISNHDIFUHV-UHFFFAOYSA-N 426.536 4.033 10 10 IICE C[C@@H](c1ccccc1)[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C(N)=O 1469960134 OLXJNVQQICVHAO-JLHGSKIFSA-N 442.991 4.033 10 10 IICE CCc1ccc(CN2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)s1 1470555362 DPXCBKGVWZKONA-LJQANCHMSA-N 428.646 4.143 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)CCOc3ccc(C(F)(F)F)cc3)C2)cc1 1470773537 QGWLQEZGUMYFAY-KRWDZBQOSA-N 437.462 4.013 10 10 IICE CCO[C@@H]1C[C@@](NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1522685940 GXNLMAQVNGILEL-HYBUGGRVSA-N 446.975 4.153 10 10 IICE C/C(=C/C(=O)N(Cc1ccncc1)c1ccc(F)c(Br)c1)c1cnccn1 1530039773 JNQDSIGWCAFVBQ-UVTDQMKNSA-N 427.277 4.410 10 10 IICE CCN1CCN(Cc2ccc(CNC(=O)c3cc(C)n(-c4ccccc4C)c3C)cc2)CC1 1540809534 BBJSYSZWXAYUBB-UHFFFAOYSA-N 444.623 4.470 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(Oc4ccc(F)cc4)cc3)CC2)cc1 1544316457 ZCLAFPYFBRBDFP-UHFFFAOYSA-N 449.526 4.179 10 10 IICE CC[C@H](C)[C@H](Cn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1545295947 CFRWEKFSGCOKSZ-AVRDEDQJSA-N 447.599 4.012 10 10 IICE CCc1nc2ccc(Cl)cn2c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632456 MKLQFOCYMWPEOE-KRWDZBQOSA-N 447.366 4.304 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cccc2c1OC(F)(F)O2 1565138944 VGGAUYSYQRNQDP-UHFFFAOYSA-N 443.244 4.208 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1Br 1566304221 XKFOVUJSSGIJTD-GOSISDBHSA-N 449.345 4.379 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc(C)c1OCC(=O)N1CCCCC1 1585424885 TWVLPQXALZIMCY-HXUWFJFHSA-N 437.584 4.252 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCOC[C@@H]1C 1613295982 TWCILCXKWXNUKH-ACRUOGEOSA-N 441.620 4.190 10 10 IICE Cc1cc(=O)n(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cc1[N+](=O)[O-] 1613627496 LDYUYBNSWHJYII-UHFFFAOYSA-N 444.285 4.118 10 10 IICE COc1ccccc1-c1nnc(N(C)Cc2ccon2)n1CCCSc1nccs1 1619384188 IZFNFAFRYBXWLL-UHFFFAOYSA-N 442.570 4.217 10 10 IICE CO[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC[C@@H]1C 1619525958 OBNDJECUIVQPCJ-AVRDEDQJSA-N 425.621 4.159 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1oc2ccc(CCC(C)=O)cc2c1C 1627013553 FMTWINKFYCXGQC-UHFFFAOYSA-N 437.492 4.174 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Oc2cccc(F)c2)cn1 1628687517 RSSLUUOPQYFWQW-UHFFFAOYSA-N 435.499 4.152 10 10 IICE C[C@@H](NC(=O)c1ccc2[nH]cc(I)c2c1)c1ccc(N(C)C)cc1 1633315772 WQRNKJXZHOXGBY-GFCCVEGCSA-N 433.293 4.330 10 10 IICE Cc1ccccc1-c1nc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)no1 1635809287 BAKGXPXUVLHYIN-UHFFFAOYSA-N 428.492 4.124 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 1636234141 RYHZGCYLNPVRFB-PMACEKPBSA-N 430.593 4.122 10 10 IICE CCCCNC(=O)OC[C@@H]1CCCCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1636350431 IFZUEZYSWLVTHA-QHCPKHFHSA-N 439.556 4.428 10 10 IICE Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1638918007 POGNAMQDHRNPQW-FGZHOGPDSA-N 426.609 4.022 10 10 IICE COc1ccc(Cn2nnnc2SCC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc1 1640805835 OVMWCDHRDIBTPE-UHFFFAOYSA-N 447.564 4.421 10 10 IICE CC(C)(C)OC(=O)N1CCOc2cc(NC(=O)c3ccc(N=NC(N)=O)cc3)ccc2C1 1643332427 ZMTNEYDOBQIOQJ-UHFFFAOYSA-N 439.472 4.231 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H](C)Oc3ccc(C(C)C)cc3)C2)cc1 1680998294 VMNSMRMQXBPVTA-WOJBJXKFSA-N 425.573 4.412 10 10 IICE CSC(C)(C)Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1698327272 QZZVCKSJUARZTF-LJQANCHMSA-N 429.634 4.160 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1706528456 MXLOMEBRWABPHN-FQEVSTJZSA-N 429.584 4.440 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](CNC(C)=O)C2)n1Cc1ccc(N(CC)CC)cc1 1708491074 FPXWMYKUPDLOON-KNQAVFIVSA-N 440.636 4.039 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709443306 DJYGVWOFYXZCQT-RUZDIDTESA-N 436.604 4.071 10 10 IICE CCC[C@](C)(O)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709446576 MUEIPGIVSLDLQM-DHLKQENFSA-N 441.620 4.307 10 10 IICE CCCN(CCC)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1709733750 YWDTUNBENPKAIZ-HXUWFJFHSA-N 429.634 4.010 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CC1(O)CCCC1 1729405195 RPSICFJNJYLVQI-UHFFFAOYSA-N 425.621 4.408 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1occc1C 1761878907 RJBVPUDCVFBMKY-INIZCTEOSA-N 427.524 4.216 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1763257151 UTSQVKQZOCNBPN-UZUQRXQVSA-N 435.620 4.187 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](c3ccc4c(c3)OCCO4)C3CCCC3)CC2)cc1 1858119810 MJRXFQJHEXJYBX-RUZDIDTESA-N 436.552 4.089 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3ccccc3OC)SC2=S)N(C)C)cc1 1858594242 QFSPLZGHVWCWBB-ACRNLXFHSA-N 428.579 4.208 10 10 IICE Cc1cc(C)c2c(=O)cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)[nH]c2c1 1866486916 BPNICYUDLQTALI-DEOSSOPVSA-N 446.595 4.168 10 10 IICE CCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2[C@@H](C)COC[C@H]2C)n1 1868274252 AOFMBTRCYPWVKU-IYBDPMFKSA-N 442.519 4.172 10 10 IICE COCCCN1C(=O)C(Nc2ccc(F)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420573 QJCMABHHAJWOQO-UHFFFAOYSA-N 447.510 4.462 10 10 IICE Cc1nn(C)c2nc(C(C)(C)C)cc(C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)c12 1891335200 GSKZGMHPLBWGCA-ICSRJNTNSA-N 431.584 4.493 10 10 IICE C[C@@](Cc1cccc(O)c1O)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1951724679 OGVXQNFROLBEAT-VWLOTQADSA-N 433.460 4.022 10 10 IICE CC(C)(C)OC(=O)N[C@]1(C)CCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2044741803 BIZAOYWFHCEUKJ-XMMPIXPASA-N 446.592 4.056 10 10 IICE CC(C)CNCc1ccc(N(CC(=O)N(C)C)Cc2ccccc2)cc1Br 2152239661 HHUJPFRKCRWGPP-UHFFFAOYSA-N 432.406 4.290 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)NN(c4cccc(Cl)c4)C3=O)o2)cc1 2295225570 SJTRQCCBFHHSKL-UHFFFAOYSA-N 436.851 4.238 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCO3)SC(=S)N1CNc1cccc(Br)c1 2313501947 PRZAIWUHFSNCRV-UHFFFAOYSA-N 449.351 4.449 10 10 IICE CC1CCC(Nc2nc3ccccn3c(=O)c2C=C2SC(=S)N(C(C)C)C2=O)CC1 2314414990 SZLFAEVOVXSQPH-UHFFFAOYSA-N 442.610 4.295 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(NC(=O)c2ccc([N+](=O)[O-])cc2)C1=O 1452151 IHPZFENKKAZOAP-RTNVFWHRSA-N 425.491 4.087 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)c2C)cc1 14266262 PPALNAQYOZOXGS-SANMLTNESA-N 445.519 4.143 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(N4CCOc5ccccc54)s3)CC2)cc1 15735037 XHBLLVPVIGVGPA-UHFFFAOYSA-N 435.549 4.250 10 10 IICE CC[C@H](NCC1(NC(=O)OC(C)(C)C)CCOCC1)c1cc(Br)ccc1O 697002232 ZSZAWIGNCIGKKE-INIZCTEOSA-N 443.382 4.269 10 10 IICE O=C(Cc1coc(-c2ccc(F)cc2)n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742801929 UQDFIPAPPSIXPW-QGZVFWFLSA-N 445.441 4.410 10 10 IICE Cc1cccc2c1OCC[C@H]2NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 749438357 SZIWNIMIJHWIEL-HXUWFJFHSA-N 449.473 4.173 10 10 IICE CN(c1ccc(CNC(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)cc1)C1CCCCC1 756684837 NFRVYTVHIYLQMQ-GOTSBHOMSA-N 441.572 4.083 10 10 IICE Cc1cc(C)nc(-n2nc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)cc2C)n1 763631237 NASJGXULHFGVSW-UHFFFAOYSA-N 444.539 4.089 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC[C@@H](CC(F)(F)F)C2)c([N+](=O)[O-])c1Br 764914487 NPLFQZPHICFYKK-ZETCQYMHSA-N 428.161 4.053 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(F)cc1F 769281409 ALABGPVIJLEERJ-JHVJFLLYSA-N 428.479 4.102 10 10 IICE CCN(C(=O)/C=C\c1cc2cnn(C(C)C)c2[nH]c1=O)c1cccc(Br)c1 914758834 QNLQBKIZNZWODQ-HJWRWDBZSA-N 429.318 4.134 10 10 IICE COc1ccc(C)cc1N1C[C@@H](C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1=O 1135744559 IAHWSHRGHAIUCT-NRFANRHFSA-N 435.568 4.005 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(Cl)c(Br)cc1F 1135946002 ALMTWZDNZGBKCN-UHFFFAOYSA-N 441.728 4.350 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)[C@H](CO)c2ccc(Cl)cc2)C1 1141299516 INSDMQCUHHBINA-XMMPIXPASA-N 439.987 4.253 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1141737870 KYILLXLQGJVNIF-LBPRGKRZSA-N 439.286 4.208 10 10 IICE COCCN(Cc1cc(Br)cs1)C(=O)c1cc2cc(O)c(O)cc2s1 1156983709 AGAIUWDEQBCJDL-UHFFFAOYSA-N 442.356 4.425 10 10 IICE COc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1F 1269952518 AMCAFINAGMNNML-LFIBNONCSA-N 434.489 4.203 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3[C@H]2O)c(C)n1-c1cccc(Br)c1 1298767515 QGKPOEHTEDWWBS-TZIWHRDSSA-N 441.325 4.081 10 10 IICE Cc1cc(CC(=O)N2CC3(CCCC3)OC[C@@H]2CN(C)C)c(C)n1-c1ccc(Cl)cc1 1437768443 INDACMAAUHKFLY-QHCPKHFHSA-N 444.019 4.392 10 10 IICE Cc1cc(N2C[C@@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)ccc1F 1438178606 NUYIPGNFAHJJLK-NRFANRHFSA-N 433.527 4.253 10 10 IICE CCCN(CCC)CCCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1443290330 KDVFNEUAAHMCMY-UHFFFAOYSA-N 435.410 4.494 10 10 IICE Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NCc2cc(Cl)ccc2O)cc1 1452944262 JVTNGWJJNYYOFY-UHFFFAOYSA-N 430.913 4.085 10 10 IICE Cc1cc(C(=O)CSCCN2CCOCC2)c(C)n1-c1ccc(Br)cc1 1458904057 ZJOGQWBPBZLMDL-UHFFFAOYSA-N 437.403 4.105 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccn(-c3ccccc3C(F)(F)F)n2)cc1 1461336032 GPJOIMVGHWXWSG-UHFFFAOYSA-N 432.446 4.108 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCC[C@H]3CCC(=O)OC(C)(C)C)C2)cc1 1470594983 YHTLBSARFUMHFV-CTNGQTDRSA-N 445.604 4.208 10 10 IICE CC1=CCN(c2nnc([C@@]3(OC(C)C)CCOC3)n2CCCSc2nccs2)CC1 1492615129 AVYMFFKZHRGQDV-OAQYLSRUSA-N 449.646 4.114 10 10 IICE C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(N2CCOCC2)cc1 1535557825 DDFKQXOSXBEZQZ-GQWLDOHISA-N 429.358 4.267 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCOc2ccc(Br)cc21 1536550095 OGVMHBLJPPNOTK-HNAYVOBHSA-N 431.374 4.437 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](Cc2ccccn2)NC(=O)OC(C)(C)C)cc1 1539308241 PTFKXDSPHNQJIS-JOCHJYFZSA-N 440.588 4.022 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCCOC1CCCC1 1541326146 YCMXQXZOIJJHRV-UHFFFAOYSA-N 441.620 4.224 10 10 IICE Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)n1 1543244905 FQQJLOIJQZHETO-NRFANRHFSA-N 444.535 4.101 10 10 IICE CO[C@@H]1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1(C)C 1543807835 JFPYACJCEISASV-ASNKMWSDSA-N 438.640 4.003 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(I)cn3)c2C)c1 1544081102 RFNDNDRUUCXIAO-UHFFFAOYSA-N 445.304 4.332 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(Br)cc1 1545503080 MCTDYKTWYQAAGD-GOSISDBHSA-N 449.345 4.379 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](C)C(=O)Nc3ccccc3)cc2Cl)C1 1564649434 CNKRYICESYPXKB-IRXDYDNUSA-N 428.964 4.403 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4cccc(Br)c4)CC3)C2)cc1 1584438251 AWPPBVHPOCABOC-INIZCTEOSA-N 429.358 4.132 10 10 IICE C[C@H](NC(=O)[C@@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1585423739 KUGZYPKYQIRAHN-JTSKRJEESA-N 439.556 4.301 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(Br)cc4)CCC3)CC2)cc1F 1595482049 JXXWJLDMOCZEKB-UHFFFAOYSA-N 447.348 4.367 10 10 IICE Cc1cc(C(=O)NC(C)(C)COc2ccc(C(F)(F)F)cn2)c(C)n1-c1ccccn1 1596934439 OJBAYHRAOKGQOZ-UHFFFAOYSA-N 432.446 4.490 10 10 IICE Cc1cc(C(=O)NCc2ccc3nc(O)[nH]c3c2)c(C)n1-c1ccccc1Br 1597323733 DSIAMQNSIBGWBZ-UHFFFAOYSA-N 439.313 4.369 10 10 IICE Cc1cc(C(=O)NCCC(=O)N2CCCCCC2)c(C)n1-c1ccc(Br)cc1 1598059890 NHTXDYCQLFHTRH-UHFFFAOYSA-N 446.389 4.379 10 10 IICE Cc1cc(C(=O)N2CCc3cc(O)ccc3C2)c(C)n1-c1ccc(Br)cn1 1607928976 AHFUYKZJZCUOLB-UHFFFAOYSA-N 426.314 4.156 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)COC 1619863621 OGLXWLIPWSSEGQ-UHFFFAOYSA-N 425.577 4.108 10 10 IICE COc1cccc(Oc2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)nc2)c1 1624892633 MISYKIORSFIWDU-UHFFFAOYSA-N 435.549 4.366 10 10 IICE COc1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1OC(F)F 1625428096 CEWVYYFHWPDFNW-UHFFFAOYSA-N 428.435 4.447 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](NC(=O)c2ccc(OC)cc2)c2ccccc2)cc1 1626085757 PTJQIDZAUGZBOV-RUZDIDTESA-N 445.563 4.329 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1CCc2cc(Br)ccc21 1626822376 OETCUIACJNBICT-CQSZACIVSA-N 425.120 4.263 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3[nH]c(-c4cccc(C(F)(F)F)c4)nc3C)C2)cc1 1629084846 VEPIMJAHCJXESQ-QGZVFWFLSA-N 444.457 4.421 10 10 IICE Cc1cc(C(=O)NC[C@@]2(O)CCc3ccccc32)c(C)n1-c1ccc(Br)cc1 1631214643 RTADOSDWRCCGHS-QHCPKHFHSA-N 439.353 4.420 10 10 IICE O=C(CSc1ccccc1Br)N(Cc1ccccc1O)C[C@H]1CCCO1 1631218996 KKZDIFKLKVIKPK-MRXNPFEDSA-N 436.371 4.455 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1ccc(Cl)cc1[N+](=O)[O-] 1631665636 SWVMMDCISAYGNP-UHFFFAOYSA-N 425.872 4.441 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc2ccc(Br)cc2c1 1641203409 DKWPDEOQRPGYEK-UHFFFAOYSA-N 439.353 4.493 10 10 IICE Cc1ccc(C(=O)N2CCN(C)C[C@H]2Cc2ccccc2)cc1-n1c(C)cc(C=O)c1C 1644443479 SGGBPQYLWXKHCP-RUZDIDTESA-N 429.564 4.214 10 10 IICE O=C(CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)NOCc1ccccc1 1653580786 CBLJYFGUCAPATF-GHXNOFRVSA-N 430.504 4.226 10 10 IICE COc1nccc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1654253567 VFISGPOFDPEQBW-QGZVFWFLSA-N 430.430 4.411 10 10 IICE CCOC(=O)N1CCC([C@H](C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 1672005438 CDKKMDUPBOLHPB-IBGZPJMESA-N 440.588 4.193 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cc(Cl)cc2c1OCC2 1679961203 GMGMSIUREYVOID-UHFFFAOYSA-N 439.737 4.475 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)c3c(F)cccc3F)cc2Cl)C1 1680561294 BGURJWSLVAUAJM-XOBRGWDASA-N 437.918 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1cc(-c2ccc(F)cc2F)on1 1686826238 DSDJXXAIPLKXPT-OAHLLOKOSA-N 428.483 4.425 10 10 IICE CC(C)[C@H](Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1691596523 JMHGGUYYQUZOTR-QHCPKHFHSA-N 442.567 4.441 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCO[C@@H](c2ccc(Cl)s2)C1 1693004490 QXAVFHBITXTXGU-GOSISDBHSA-N 431.993 4.302 10 10 IICE CCC[C@@H](C)N(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1695089253 YEEHSNMTSIYMSM-LJQANCHMSA-N 435.620 4.195 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1695292631 MSKYKLSDBBNIHQ-UNMCSNQZSA-N 438.664 4.390 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(=O)N(C)C)C(C)C 1695532078 BPTITFABFCXFII-UHFFFAOYSA-N 436.604 4.456 10 10 IICE Cc1ccoc1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)CC(N)=O 1707021044 ZYSGURCAUATDGW-KRWDZBQOSA-N 446.555 4.002 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CCSC(C)C)CC2)cc1F 1711865951 LHHRCQWQJGPDPE-UHFFFAOYSA-N 449.640 4.483 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@@H]3CCC[C@@H]32)cc1 1728379309 QEYIQKFSKOTVBI-UNMCSNQZSA-N 438.620 4.080 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1ccc(Cl)s1 1744546808 HGBZNWWCKGEFTO-UHFFFAOYSA-N 446.020 4.271 10 10 IICE CCSc1cc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)ccn1 1747476413 IIPZSYMCICFJAJ-IBGZPJMESA-N 439.585 4.069 10 10 IICE CC1=C(C)CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)CC1 1761598235 LXXBQKWIYIFQOV-UHFFFAOYSA-N 426.615 4.449 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2nnc(C(C)(C)C)s2)o1 1761737564 JYVILPPGMZNERJ-UHFFFAOYSA-N 438.557 4.386 10 10 IICE CC[C@H](C)[C@@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)OC 1763443565 IVCHQKXRIYLHCH-HNAYVOBHSA-N 429.952 4.397 10 10 IICE COc1ccc(C2=NN(Cc3ccc(C)cc3)C(=O)/C2=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 1865678155 WZVMWQCEZZRWEX-FYJGNVAPSA-N 443.459 4.448 10 10 IICE COc1cccc2sc(N(C)CC(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)nc12 1891528406 RUPUGRCEIOKCER-HKUYNNGSSA-N 436.581 4.046 10 10 IICE CCN1CCc2cc([C@@H](O)[C@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044721161 ZPOYPJSTSPWEKD-LADGPHEKSA-N 439.600 4.128 10 10 IICE COc1ccc(Cn2nc(C3CCC3)c(C(F)F)c2I)c(O)c1 2079744114 VBELDYPDETUFDD-UHFFFAOYSA-N 434.224 4.455 10 10 IICE CN(CCN(Cc1ccccc1)C(=O)c1ccn(-c2ccc(N)cc2)n1)Cc1ccccc1 2095883682 QCYWAQLTTHTXAQ-UHFFFAOYSA-N 439.563 4.229 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@H](C)C(C)(C)O)cc1Br 2169926488 LVFWZSPIVRSHHB-QGZVFWFLSA-N 435.406 4.351 10 10 IICE CCCOc1ccc(Br)cc1C=C1SC(=S)N(CCCC(=O)O)C1=O 2314761230 QHKMEXZBKRRANW-UHFFFAOYSA-N 444.372 4.304 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3C)C2=O)ccc1O[C@H](C)C(=O)O 2314932311 MBGCVCLUYMCQMA-CYBMUJFWSA-N 429.519 4.261 10 10 IICE Cc1ccc(C(=O)O)c(NC(=O)CN2C(=O)C(=CC=Cc3ccccc3)SC2=S)c1 2314935558 QDFVOGKJWJBKSX-UHFFFAOYSA-N 438.530 4.089 10 10 IICE COC(=O)c1cccc(N2C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c1 2321718230 KLDXVGSXBLAAKH-UHFFFAOYSA-N 434.882 4.441 10 10 IICE CC[C@@H](N[C@]12CO[C@H](C1)[C@@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2359243387 IWCCMSNPVTUPKI-MJEZEWASSA-N 441.366 4.020 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2380786152 HSQQQGHNXCMCLJ-OAHLLOKOSA-N 443.382 4.361 10 10 IICE Cc1ccc(CNC(=O)c2ncccc2NC(=O)OC(C)(C)C)c(O)c1Br 2381132941 HXURAWDYRAYMFT-UHFFFAOYSA-N 436.306 4.135 10 10 IICE CC(=O)OCCNc1cc(N2C[C@@H](C)C[C@@H](C)C2)c2noc3c2c1C(=O)c1ccccc1-3 9641353 AJBURZRJCQBHAX-GASCZTMLSA-N 433.508 4.497 10 10 IICE Cc1ccc(C)c(N2C(=O)/C(=C\c3ccc(O)c(Br)c3)C(O)=NC2=S)c1 33927158 HJISYJCFRAFSOX-JYRVWZFOSA-N 431.311 4.443 10 10 IICE CCn1cnnc1-c1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435570000 UTDDWVQMZQINLE-UHFFFAOYSA-N 442.567 4.325 10 10 IICE O=C1c2ccccc2C(=O)c2c1cccc2N(CCF)S(=O)(=O)c1ccc(Cl)cc1 586216124 LTCCLXNMGKOTOX-UHFFFAOYSA-N 443.883 4.280 10 10 IICE CC(C)(C)OC(=O)NC[C@H](NCc1cc(Cl)cc(Br)c1O)C(F)(F)F 708092091 ZWBYXSQNCSWLJT-NSHDSACASA-N 447.679 4.353 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1O 738148012 FKPGXZACKISYSO-UHFFFAOYSA-N 436.483 4.322 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@@H]3CCCN(C)[C@@H]3c3cccs3)CC2)cc1 745847380 JKHNVGGGOBTOOI-CVDCTZTESA-N 442.629 4.062 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N(C[C@@H]3CCCO3)C3CCCC3)cc2F)C[C@@H](C)O1 749553610 JFYCIUKYUDPMBB-UEXGIBASSA-N 433.568 4.073 10 10 IICE O=C(c1c[nH]c2cccc(Br)c12)N(Cc1ccccc1O)C[C@H]1CCCO1 764196927 LGBIWSDOMTVESS-OAHLLOKOSA-N 429.314 4.457 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC2([C@@H](O)c3ccccc3)CC2)C1 768096654 CZNVHJHUZDDATL-SANMLTNESA-N 431.580 4.038 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(C)c(C(=O)N4CCOCC4)c3)c2C)cc1 787644520 JZYDKRYKXXPFOF-UHFFFAOYSA-N 447.535 4.136 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccnc(-n4ccnc4)c3)cc2Cl)C1 800702121 AOOHNDLFRVTDGO-KRWDZBQOSA-N 438.963 4.156 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc([C@H]2COCCO2)n1Cc1ccccc1 802140749 RDXJMUXPKRTYBQ-XMMPIXPASA-N 447.583 4.041 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCC[C@@H](CNC(=O)CC(F)(F)F)C3)c2C)c1 804200746 CQTAFKOWYYKEAH-SFHVURJKSA-N 435.490 4.323 10 10 IICE Cc1ccc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)n1 806944406 FSUQSKZZQXAVOM-IBGZPJMESA-N 446.979 4.034 10 10 IICE COc1ccccc1SCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCO1 812261880 UAORWQWCRQDQBF-SFHVURJKSA-N 440.569 4.100 10 10 IICE CCN(C(=O)/C=C/c1cc2cnn(C(C)C)c2[nH]c1=O)c1cccc(Br)c1 914758831 QNLQBKIZNZWODQ-CMDGGOBGSA-N 429.318 4.134 10 10 IICE O=C1C[C@@H](Nc2ccc3nc(O)[nH]c3c2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 917633361 BAHAXVAORRAUBL-HXUWFJFHSA-N 426.436 4.428 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CCCC2 1125019284 PRGPSGXLUWEHGI-OAHLLOKOSA-N 426.538 4.184 10 10 IICE CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1141882149 FOZMAJNZRGSBIN-UHFFFAOYSA-N 439.537 4.229 10 10 IICE Cc1cc(C(=O)N(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)c(C)n1-c1ccc(F)cc1 1151918944 XQXMYUGXDUSMNS-HXUWFJFHSA-N 446.931 4.487 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1cc(Br)c(O)c(Br)c1 1159034038 PMMIDOUKMUHUTB-UHFFFAOYSA-N 435.499 4.206 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3c(C)cc(C)cc3Cl)CC2)c(OC)c1 1175512049 GGNIXCBXQQLLIS-KRWDZBQOSA-N 431.964 4.123 10 10 IICE Cc1cc(C(=O)Nc2ccccc2C(=O)N2CCC[C@@H](O)C2)c(C)n1-c1ccc(F)cc1 1177367464 LFYADSUYODTLDH-HXUWFJFHSA-N 435.499 4.082 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)N1CCO[C@H](c2ccc(F)cc2)C1 1191712185 SIAJIMJWICEXMG-FQEVSTJZSA-N 438.421 4.077 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1 1230200329 IIGADZKSXGEGLC-QFBILLFUSA-N 432.971 4.363 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCNC(=O)[C@H]2c2ccccc2F)c1 1266558493 OHTDLTWVGOJYAZ-OAQYLSRUSA-N 425.891 4.200 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@](C)(O)c2ccc(F)c(Br)c2)cc1F 1293225613 YOBVJQNRVLQTML-HXUWFJFHSA-N 441.316 4.097 10 10 IICE CCOC(=O)C1=CC[C@@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1300804969 YDJSYWKZUJZGAV-QGZVFWFLSA-N 431.330 4.238 10 10 IICE CCOc1ccc(C(C)(C)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1OCC 1301350087 LPAPLAHZKGPYIT-UHFFFAOYSA-N 440.584 4.039 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cc(C)ccc1C 1307535756 QANGFUOLJJPNRE-WOJBJXKFSA-N 427.564 4.199 10 10 IICE Cc1ccccc1CCN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307794652 PPLQHKOJGGRPMI-SFHVURJKSA-N 426.516 4.272 10 10 IICE C[C@H](NC(=O)CCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccccc1 1435334698 WEISPFDOHPEKLY-PKOBYXMFSA-N 445.510 4.031 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(c2ccc(Cl)cc2)CCCCC1 1447348684 QIANZTABGVZJOI-IBGZPJMESA-N 445.943 4.244 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCOc1ncccc1Cl 1503486731 BZPAUOAAUYKGDN-UHFFFAOYSA-N 427.936 4.405 10 10 IICE CN(C[C@@H]1CCCOC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1503546052 KOTUSFSOGYDSDS-FQEVSTJZSA-N 443.661 4.040 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1513117679 UPHYRUXXKOMHCM-IBGZPJMESA-N 436.604 4.013 10 10 IICE Cc1cc(CCNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)c(C)n1-c1ccccc1 1534542389 GXJPGLPHCLNESO-UHFFFAOYSA-N 448.567 4.486 10 10 IICE Cc1ccc(CCCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(C)c1 1539112954 WBEMENZOCCLCTP-UHFFFAOYSA-N 444.578 4.234 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2nnn(-c3ccc(OC(C)C)cc3)c2C)cc1 1539308307 QOEHYKAEZCOJDP-UHFFFAOYSA-N 435.572 4.481 10 10 IICE COc1ccccc1N1C[C@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 1542412337 WUCZMFFPDNLNOD-HXUWFJFHSA-N 435.568 4.133 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 1542431975 NIFVYVBDKLFYAB-YADHBBJMSA-N 448.394 4.044 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)n1cc(NC(=O)OC(C)(C)C)cn1 1544093961 IYHODGHTGIFCCU-UHFFFAOYSA-N 429.565 4.080 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](C(=O)OCc1ccccc1)c1ccccc1 1564586445 OUIIJPUMKMGPBL-RUZDIDTESA-N 445.563 4.421 10 10 IICE Cc1cc(C(=O)N(CCO)Cc2cnn(Cc3ccccc3)c2)c(C)n1-c1ccc(F)cc1 1566485202 JOEVTJZQEUXUBM-UHFFFAOYSA-N 446.526 4.113 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccnc(C(F)(F)F)c2)C1 1583140798 BSTFWARBBSKSLG-UHFFFAOYSA-N 430.474 4.138 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1584515258 MYMGEMXJFXVQOW-UHFFFAOYSA-N 440.494 4.041 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCc4cc(C(C)C)ccc43)CC2)cc1 1624985575 SUCBKEGDDOYHIM-OUKQBFOZSA-N 447.579 4.003 10 10 IICE CCOC(=O)CN(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CCC1 1632501956 IOOQKYJKOCWCPZ-UHFFFAOYSA-N 433.346 4.414 10 10 IICE CCc1cccc2c(CC(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c[nH]c12 1635941868 XZSMVZXNRODWKC-HXUWFJFHSA-N 425.960 4.413 10 10 IICE CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635997072 XGCKPNOJCNBOJX-LJQANCHMSA-N 447.501 4.418 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1csc(NC(=O)c2ccccc2)n1 1639340658 AYGWHUDEYBHBBA-KRWDZBQOSA-N 436.581 4.060 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1641201062 PBNINZWZRVQQJG-XFXZXTDPSA-N 445.563 4.314 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@H](c3ccc(F)cc3)C3CCCC3)CC2)cc1F 1642235605 IOHVMZXNLGHDCI-VWLOTQADSA-N 443.538 4.143 10 10 IICE COc1ccc(N(CCC(C)C)C[C@@H]2CC3(CN(C(=O)OC(C)(C)C)C3)C(=O)O2)cc1 1642979792 JTKGGLVCCIBDTM-FQEVSTJZSA-N 432.561 4.100 10 10 IICE CC(C)c1cccc(N(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1644398870 PUWGLGBATNYATI-RTBURBONSA-N 427.564 4.315 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C4CCCCC4)C3)cc2F)C[C@@H](C)O1 1647853272 BUPQKNNGJJULLB-TXTKFYIRSA-N 445.623 4.348 10 10 IICE COc1cc2c(cc1OC)CN(CC(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)CC2 1648611560 GVGXVFHFCZASQT-UHFFFAOYSA-N 447.579 4.094 10 10 IICE COC(=O)c1ccc(OC)c2c1CCN(C(=O)c1cc(C)n(-c3ccc(F)cc3)c1C)C2 1651287157 BXPXDAIJJNWAAN-UHFFFAOYSA-N 436.483 4.227 10 10 IICE CCN(CC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1)c1ccc(OC)c(OC)c1 1653749132 BXZPYOYEUYFBNZ-CQSZACIVSA-N 426.435 4.306 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC(C)(C)Cc3ccc(Br)cc3)C2)cc1 1674326161 HRPZTCAOMBVKEA-GOSISDBHSA-N 446.389 4.357 10 10 IICE O=C(NCCCCCc1ccc(F)cc1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1680336286 SBSXYVMZWLHLRS-UHFFFAOYSA-N 435.490 4.153 10 10 IICE CCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 1683944870 LORKDODGZUSYPA-FJIJXJHWSA-N 436.600 4.141 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)cc2Cl)C1 1686268240 ANDRLJYGWHABIH-RDTXWAMCSA-N 433.902 4.439 10 10 IICE CC(C)(C)OC(=O)NC[C@H](NC(=O)NCc1c(O)ccc2c1CCCC2)C1CCCC1 1686301522 KIRJRSXUMWHZPR-FQEVSTJZSA-N 431.577 4.154 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@@H](Cc3ccccc3)c3ccccn3)CC2)cc1F 1687863011 ADMXXIWWPZIUQS-OAQYLSRUSA-N 448.542 4.087 10 10 IICE C[C@H]1C[C@H](C)CN(CCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1693572887 QUIXZLADTBCNBV-PMACEKPBSA-N 434.588 4.050 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(=O)NC)C1 1695226172 NNCAGEYBHRWSJJ-FQEVSTJZSA-N 434.588 4.115 10 10 IICE CN(c1nnc(C(C)(C)C)n1CCCSc1nccs1)[C@@H]1CCCc2c1cnn2C 1711023473 CPWCMWKVMQPJGM-MRXNPFEDSA-N 445.662 4.462 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CCO1 1727828377 CWPVWWCUXPEJLX-MRXNPFEDSA-N 435.644 4.185 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC(OC(C)(C)C)CC2)cc1F 1729329455 YTYBBEXCEYOCFI-UHFFFAOYSA-N 440.567 4.311 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3Cc3ccsc3)CC2)cc1F 1730180338 MMFMRPQZWZTHND-UHFFFAOYSA-N 429.565 4.061 10 10 IICE C[C@@H]1CCCCN1CCCCn1c(-c2ccccn2)nnc1N(C)Cc1ccccc1O 1743057862 VLWCNAOOXQMHLZ-HXUWFJFHSA-N 434.588 4.337 10 10 IICE CCC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1744928628 IISZFAKDQONEAY-UHFFFAOYSA-N 439.648 4.459 10 10 IICE Cc1cnn([C@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)c1 1751721757 BVVCMXJPMCHDGR-KRWDZBQOSA-N 431.635 4.387 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1 1766611337 BTGAACGOLOORDK-HSZRJFAPSA-N 448.615 4.486 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)CCc2cccs2)cc1F 1766909831 UDFQDNRCFCDHPO-UHFFFAOYSA-N 438.576 4.277 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@@H](C(F)F)C2)cc1F 1768495207 YJXVDQIGWJSAKK-APWZRJJASA-N 437.510 4.255 10 10 IICE COCCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C 1770143406 MMYDTWZGIBXNHG-IBGZPJMESA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(Cc5cccs5)[nH]c4c3)CC2)cc1 1872798308 UMEPRLVGUWRAAM-UHFFFAOYSA-N 432.549 4.186 10 10 IICE COC(=O)c1c(C2CCC2)nn([C@@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080012211 LYZSADUARUFPJB-GOSISDBHSA-N 435.318 4.413 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1cccn1Cc1ccc(Cl)cc1Cl 2293117036 CUJQUXGKFAFTPQ-UHFFFAOYSA-N 444.274 4.098 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cc(C)ccn4)c3C)C2=O)c1 2294118602 DAYTWUWGEJWQPA-UHFFFAOYSA-N 428.492 4.081 10 10 IICE CN1C(=O)C(=C2C(=O)N(Cc3ccccc3)c3ccc(Br)cc32)SC1=S 2296538566 YPSZUDNHYHUVOF-UHFFFAOYSA-N 445.363 4.197 10 10 IICE CN(C[C@@]1(O)CCCN(c2ccc(OCc3ccccc3)cc2)C1)C(=O)OC(C)(C)C 2299512986 SADNHBHWEUFVCN-VWLOTQADSA-N 426.557 4.464 10 10 IICE COc1ccc(N2N=C(c3ccccc3)C(=C(C)NCc3ccc4c(c3)OCO4)C2=O)cc1 2313682938 ODJBWKUCVFPCBW-UHFFFAOYSA-N 441.487 4.239 10 10 IICE O=C(CN1C(=O)C(=Cc2cccc(O)c2)SC1=S)Nc1cccc(C(F)(F)F)c1 2314829241 ZWDXXTRUYZQCOL-UHFFFAOYSA-N 438.452 4.251 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2cc(OC)c(O)c([N+](=O)[O-])c2)SC1=S 2321635290 HTSZUZOHWPBTBZ-UHFFFAOYSA-N 432.479 4.114 10 10 IICE Cc1ccc(CNC(=O)[C@H](C)CN(C(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380749420 OQVPHTXFMCWMSN-CYBMUJFWSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2381135463 QSJCSSAULOIMAV-GJZGRUSLSA-N 441.366 4.115 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14473543 USBAQQJDZNTAJR-CKJXQJPGSA-N 427.888 4.451 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2cn(Cc3ccccc3)c3ccccc23)SC1=S 40938012 XMTVJLGPSRESIY-MOSHPQCFSA-N 436.558 4.454 10 10 IICE C[C@@H]1[C@@H](NCc2ccc(Br)cc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709310387 RFHYNZKXUPRKFY-VDNDLQMASA-N 425.367 4.421 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726567838 QRZKLIBPSLTKTQ-QVKFZJNVSA-N 443.494 4.281 10 10 IICE COc1ccc(C[C@H](C)NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1OC 731121265 UCHYBAHLGQWRMX-IBGZPJMESA-N 425.573 4.371 10 10 IICE O=C(CN(Cc1ccco1)Cc1ccccc1O)N1CCC(OCc2ccccc2)CC1 732202603 YOYXOUMPSFIFLX-UHFFFAOYSA-N 434.536 4.195 10 10 IICE COc1ccc(-c2cnc(CCC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)o2)cc1 735518318 STBZFCGMFASQKX-NRFANRHFSA-N 436.508 4.196 10 10 IICE O=C(CCc1cncc2ccccc12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 765091673 LHZCXEDEBLMUCX-UHFFFAOYSA-N 428.580 4.016 10 10 IICE Oc1c(Br)cc(Br)cc1CNc1cccc2c1OCC[C@@H]2O 768529425 NELJOEDEJUBXRQ-AWEZNQCLSA-N 429.108 4.345 10 10 IICE C[C@H](NC(=O)N1CC=C(c2ccc(Cl)nc2)CC1)c1ccc(N2CCOCC2)cc1 773505879 MRKKOGIVBVZIQS-KRWDZBQOSA-N 426.948 4.132 10 10 IICE CN(C)c1ccc([C@@H](CNCc2ccc(-c3cc[nH]n3)o2)NC(=O)OC(C)(C)C)cc1 788524081 UNGJASRGKLUTKY-HXUWFJFHSA-N 425.533 4.091 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N[C@@H]1CCOc2c(Br)cccc21 799884660 RCGQJSRTPFARIL-LJQANCHMSA-N 430.346 4.372 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c1ccccc1F 800047864 RZXBWWHNOKXJJP-UHFFFAOYSA-N 442.299 4.206 10 10 IICE Cc1nc(COc2cccc(C(=O)NCc3cc(Br)ccc3O)c2)cs1 804738731 BXLJLGJGSHYZEB-UHFFFAOYSA-N 433.327 4.429 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)c3ccnc(C(F)(F)F)c3)ccc21 808513817 MGTXFZMPGSGPGY-UHFFFAOYSA-N 434.414 4.358 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccn2cc(C(F)(F)F)nc2c1 1137350219 GCAUGRSVBIWGPM-UHFFFAOYSA-N 442.235 4.484 10 10 IICE Cc1ccc(C2=NO[C@H](CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1138988207 ZWKVJXAXLLCADS-QHCPKHFHSA-N 429.520 4.446 10 10 IICE CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H](C)c1cccc(O)c1 1167526394 XUGYNVYSXVQWBZ-MRXNPFEDSA-N 428.488 4.189 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)c(F)c1 1168757271 AIVPHDRXYHVSMP-UONOGXRCSA-N 434.442 4.418 10 10 IICE CCOC(=O)CN(Cc1nnc(-c2ccc(Cl)cc2Cl)o1)Cc1ccccc1O 1171390264 JCURFDQMOUWSSO-UHFFFAOYSA-N 436.295 4.314 10 10 IICE COC(=O)c1cc2c(cc1NC(=O)c1cccc(-n3c(C)cc(C=O)c3C)c1)OCCCO2 1171552057 UWZUUPAOLDTBIL-UHFFFAOYSA-N 448.475 4.107 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@@H]3c3noc(C(C)C)n3)c2C)c1 1254074339 OZZDNQGOYAPFGB-OAQYLSRUSA-N 437.544 4.192 10 10 IICE CCOC(=O)c1c(NC(=O)COc2c(C)occc2=O)sc(C)c1-c1ccc(F)cc1 1264290592 OHISYWXYACLADU-UHFFFAOYSA-N 445.468 4.318 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CCO1 1292355464 HWPAKPKWVDHZNC-NRFANRHFSA-N 444.630 4.293 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2cc(Br)cc(C(=O)N3CCCC3)c2)cc1 1297424800 BYCSIWFXXCTLNF-UHFFFAOYSA-N 444.289 4.100 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H](C)CC3)n2Cc2ccc(N(C)C)c(F)c2)n1 1304756805 UFAMXOLVSFVPRC-QGZVFWFLSA-N 439.583 4.020 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N2CCC[C@@H](C(F)F)C2)cc1 1313681465 SCSYWDLJXXHTMC-GOSISDBHSA-N 441.530 4.111 10 10 IICE CO[C@@H](C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1)[C@@H]1CCOC1 1353908918 VNWWHYJMKSZXGS-FOIQADDNSA-N 429.517 4.347 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H]2c2cnn(C)c2)n1CCCSc1nccs1 1359838636 FWXKWHVNKQKLRK-KRWDZBQOSA-N 431.635 4.191 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@H](C)C3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1361052043 KOJYHKVTWSPLTQ-RBUKOAKNSA-N 438.645 4.244 10 10 IICE O=C(/C=C\c1cc(Cl)cc(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436625328 YXTSEMCWDBCRER-UPHRSURJSA-N 427.278 4.438 10 10 IICE CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1452180870 GIHNQJKNWAUDGF-UHFFFAOYSA-N 444.289 4.454 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]3[C@H]2CCCN3C)sc(C)c1-c1ccccc1 1460731263 QUHSMZRCXHXHJE-RBUKOAKNSA-N 441.597 4.007 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c(OC)c1 1466396571 PRZWBQNPLKNFOK-UHFFFAOYSA-N 445.563 4.321 10 10 IICE CCn1nnnc1SCC(=O)c1cc(C)n(-c2ccc(Br)c(C)c2)c1C 1472963888 ACXRYXRKYAVKIC-UHFFFAOYSA-N 434.363 4.146 10 10 IICE C[C@@H](NC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(N(C)C)cc1 1478325275 WNLPNGOMHZVGLC-YJYMSZOUSA-N 435.355 4.225 10 10 IICE Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1520855901 OIYIPZDPYRFLDT-HSZRJFAPSA-N 433.577 4.485 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(C(=O)N(C)c4ccccc4)cc3)C2)cc1 1537108785 DXQJQAWPNKFRQF-FQEVSTJZSA-N 443.547 4.228 10 10 IICE CCN(CC)[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccccc1 1539581343 DFCNBMUEVBDEPY-KNQAVFIVSA-N 431.527 4.456 10 10 IICE CC[C@@H](C)[C@H](Cn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1545295948 CFRWEKFSGCOKSZ-GCJKJVERSA-N 447.599 4.012 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1545410180 GDAZKRWOIWWVOC-BBTUJRGHSA-N 429.584 4.440 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H]3CC[C@H](F)C3)CC2)cc1F 1554960124 AQPAZSIRVWARGK-ROUUACIJSA-N 447.574 4.479 10 10 IICE COc1cccc(CN(C)c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)c1 1555023004 RJKVYNPYYOQOGF-QGZVFWFLSA-N 445.614 4.066 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4cnn(C)c4c3)cc2Cl)C1 1564649681 JQYNJHDFYKTEET-MRXNPFEDSA-N 425.964 4.462 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F 1564946235 LPTDYKJWTGEPKO-QFIXIFRTSA-N 435.490 4.226 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](CC(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1566563200 WMRFBZLMPHUCMI-NRFANRHFSA-N 433.593 4.016 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](C)Cc3ccc(Br)cc3)C2)cc1 1598363875 JZUYNIRLTLDRAM-WMZOPIPTSA-N 431.374 4.279 10 10 IICE CC(C)[C@H]1OCC[C@@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1603137099 MMKDNTIZPJEMNV-WIYYLYMNSA-N 441.963 4.397 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)c(C)c4)c3C)C2=O)o1 1613523551 JIDVRIZDUWGABF-VWLOTQADSA-N 433.508 4.262 10 10 IICE Cn1nccc1[C@@H](O)C1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 1620444336 ABWMWTXEGSIGJJ-DEOSSOPVSA-N 432.528 4.220 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](CN1CCCC1)c1ccccc1 1629055401 IWNCBAIMUPOIOR-REWPJTCUSA-N 443.538 4.253 10 10 IICE CN(C)[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1630257159 PWFQJBBTYLXZPB-TZIWHRDSSA-N 436.383 4.083 10 10 IICE CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1641996829 BSJZORAUZYCQHM-CQSZACIVSA-N 435.760 4.485 10 10 IICE CC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(F)ccc1OC 1644586559 OKBBPISGRKHYPP-HXUWFJFHSA-N 446.478 4.289 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC(C)(C)c3ccccc3Br)C2)cc1 1682646591 UJFKZJFTZSJFSQ-HNNXBMFYSA-N 432.362 4.271 10 10 IICE COc1cccc(C=C2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CC2)c1 1684606598 HCIYXPHQAULHBC-VWLOTQADSA-N 436.600 4.253 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1685557969 UIFJDIZCVQWVQW-NJYVYQBISA-N 430.593 4.213 10 10 IICE C[C@@H](NC(=O)NCc1cc(Cl)cc(I)c1)c1ccccc1O 1686857948 UGNCMSPOSJPHFH-SNVBAGLBSA-N 430.673 4.211 10 10 IICE CC[C@@H](C)[C@H](Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1693965787 NRPDZICTGBCCNY-KNQAVFIVSA-N 429.609 4.188 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C1 1696373341 PNMJTBMNBWNJPB-KRWDZBQOSA-N 429.615 4.447 10 10 IICE Cc1ccc(OCc2nnc(N3CCO[C@@H](C)C3)n2CCCSc2nccs2)cc1 1724439063 NLSSRZTXPQMUJV-KRWDZBQOSA-N 445.614 4.030 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC[C@@H]3CCO[C@H](C)C3)CC2)cc1 1748847992 OKIJYSOEEQOFJL-NHCUHLMSSA-N 441.620 4.332 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1C[C@H](C1CCCCC1)N(C)C 1767112058 OHXJQTAIPZHQJU-JOCHJYFZSA-N 436.604 4.136 10 10 IICE Cc1ccccc1-n1nc(C(=O)Nc2ccc(Oc3ccc(N)cc3)cc2)c(=O)cc1C 1866283595 QSCQGNUMUPERBX-UHFFFAOYSA-N 426.476 4.476 10 10 IICE COc1ccc(Cn2nc(C3CC3)c(C(F)(F)F)c2I)c(O)c1 2079836715 IYNXEBMGBAMFHG-UHFFFAOYSA-N 438.187 4.146 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@@]21CNCc1ccc(Br)cc1O 2089363625 VRUXHRNBFICGKS-MGPUTAFESA-N 425.367 4.424 10 10 IICE C[C@@H](O)c1ccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)cc1Br 2093155241 JQDJRIRQYLPNAV-OAHLLOKOSA-N 425.317 4.460 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C12CCC2 2175027981 WFFZIEZDFIFPLB-BBRMVZONSA-N 443.357 4.467 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)c1O 2227748805 QOVYYJVCDQBLPG-IUODEOHRSA-N 429.355 4.041 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2ccc(F)cc2)c1C 2294037504 LVPSZOMDFNQDOC-OAQYLSRUSA-N 438.499 4.085 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c(C)c1 2297352601 FUQMGVSSAVHVNB-UHFFFAOYSA-N 446.580 4.383 10 10 IICE CCCCOC(=O)CN1C(=O)C(=Cc2ccc(OCCCC)c(OC)c2)SC1=S 2314741005 RMKPOXCFBXWMIK-UHFFFAOYSA-N 437.583 4.419 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(CCc3ccc(O)cc3)C2=O)cc1)C(=O)O 2314928685 AETRCFIWMHTDET-SFHVURJKSA-N 443.546 4.078 10 10 IICE O=C1/C(=C/c2ccc3c(c2)OCO3)SC(=S)N1CNc1ccc(Br)cc1 3067870 XPGASFBUSVAVKO-PXNMLYILSA-N 449.351 4.449 10 10 IICE N=C1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)C(=O)N=C2SC(c3ccccc3)=NN12 33316134 KDLXIVDOPBICPN-HGPWHKJCSA-N 442.456 4.312 10 10 IICE CCCCCCN1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(C)c2N(CC)CC)SC1=S 33453542 DJDBZEHBIIJZMZ-QGOAFFKASA-N 446.642 4.193 10 10 IICE O=C(Nc1ccc(F)cc1)c1ccc(N2CC[C@H](NCc3cc(Cl)ccc3O)C2)nc1 65257011 GHVUCPTTZVEEJU-FQEVSTJZSA-N 440.906 4.201 10 10 IICE CC(=O)N1CCCc2ccc(S(=O)(=O)Nc3nc4c(s3)CCc3ccccc3-4)cc21 737380392 HZYXNEDZKRIKBG-UHFFFAOYSA-N 439.562 4.009 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc(CC(F)(F)F)cc2)c(C)n1-c1ccccc1 743882472 XWCVMRBKWVAFLZ-UHFFFAOYSA-N 443.469 4.496 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3CCCN(c4ncccc4C(F)(F)F)C3)ccc21 746813534 VLQCNTBIHSWFPB-GOSISDBHSA-N 432.490 4.016 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cccc4c(=O)c5ccccc5[nH]c34)CC2)cc1 770261530 ZXJKIWARJGXOOV-UHFFFAOYSA-N 427.504 4.042 10 10 IICE O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 772495019 PRFCVVGWMOZCPC-WOIUINJBSA-N 445.510 4.334 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H](c3ccccc3)c3cccc([N+](=O)[O-])c3)cc2)C1 779021496 ZMZBVVLBAFRINX-RDGATRHJSA-N 444.535 4.176 10 10 IICE Cn1c(=O)ccc2ccc(NCc3cc(Br)cc(Br)c3O)cc21 787297450 WMMZYXQFVCBJHU-UHFFFAOYSA-N 438.119 4.381 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2coc(C3CCCC3)n2)NC(=O)OC(C)(C)C)cc1 802553050 XHNVVHFTJUZGHY-IBGZPJMESA-N 442.560 4.394 10 10 IICE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1134881688 DOESURHSZYEFSU-BWKNWUBXSA-N 448.652 4.049 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1OC 1135550253 BHHSKZFGAAKOCZ-UHFFFAOYSA-N 444.329 4.199 10 10 IICE CC(=O)c1ccc(N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c(F)c1 1135915387 JRPPRTZTSRRXQC-UHFFFAOYSA-N 447.510 4.211 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C4CCN(C(C)C)CC4)CC3)c2C)c1 1137646545 NSVNEUDDNCOLID-UHFFFAOYSA-N 436.644 4.342 10 10 IICE COC(=O)[C@@H]1CCCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1138138415 WWDZCLFTVGBBHH-IBGZPJMESA-N 433.346 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)OC(C)(C)C 1142419987 YFXQHHVKKBYKSP-HYTALWEGSA-N 429.605 4.048 10 10 IICE O=C(N(Cc1ccco1)Cc1ccccc1O)C(F)(F)c1ncccc1Br 1149857298 JPIQXABYQZVLEE-UHFFFAOYSA-N 437.240 4.464 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N(C)Cc1c(C)nn(C)c1C 1289422693 CEBMZYFWLXNYNM-UHFFFAOYSA-N 449.647 4.420 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cnccc1OC 1291442651 IYOLZNXPJIAQNP-IBGZPJMESA-N 434.588 4.480 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(CCOc2ccccc2Cl)C1 1297004898 CEYNNRIGFRCJEN-LJQANCHMSA-N 444.959 4.102 10 10 IICE CCSCCCn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1297925324 ASOGZWKPCJOWNQ-UHFFFAOYSA-N 435.613 4.094 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1Cc1ccnc(OCC(F)(F)F)c1 1298363621 IIZUZQNJHYNQMR-UHFFFAOYSA-N 447.461 4.272 10 10 IICE Cc1cc(CNC(=O)NCCCNC(=O)/C=C\c2ccccc2)c(C)n1-c1ccccc1 1312584933 VPVVCAOVQUXBDG-PFONDFGASA-N 430.552 4.113 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H]3c3ccc(OC)c(F)c3)C2)cc1 1312903364 XYWCGPCIZCTQDE-VGOFRKELSA-N 427.520 4.216 10 10 IICE C[C@@H](CNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)c1ccc(S(C)(=O)=O)cc1 1313171960 BDCXCYNGEJDZJQ-IBGZPJMESA-N 443.613 4.026 10 10 IICE COCC1=CCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)CC1 1315865998 LVHYIBHOIXQSQK-UHFFFAOYSA-N 433.647 4.433 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cnnn3-c3cccc(F)c3)cc2Cl)C1 1436048830 SAJJQHUCGZICOQ-HNNXBMFYSA-N 427.911 4.226 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)c(C)n1-c1cccc(Cl)c1 1450259611 PMLBWOXPLWKWMM-QGZVFWFLSA-N 425.891 4.422 10 10 IICE COC1CCN(c2ccc(CN3CCCC[C@@H]3COC(=O)NC3CCCC3)cc2)CC1 1460193311 CTITZQQEPCWNAV-HSZRJFAPSA-N 429.605 4.325 10 10 IICE Cc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)cc1-n1c(C)cc(C=O)c1C 1465029457 KQWPVDCUZSRLKT-NRFANRHFSA-N 441.572 4.494 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3sc(C)c(Br)c3OC)C2)cc1 1469280849 RULOMMLTQTZOEZ-CYBMUJFWSA-N 439.375 4.093 10 10 IICE CCc1nc(CN(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1498412776 DAVLSYRYQIRHFO-LJQANCHMSA-N 444.580 4.038 10 10 IICE CC[C@H]1CN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1514120374 GVSQVNMVFKOKGB-RXVVDRJESA-N 429.634 4.008 10 10 IICE COC[C@H](OC)C(=O)Nc1sc(C)c(-c2ccc(Cl)cc2Cl)c1C(=O)OC 1524953711 YSGGHPDYYHTGOZ-ZDUSSCGKSA-N 432.325 4.417 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(Cc4cccc(F)c4)CCC3)cc2F)CC1 1530375803 DFFLUYWNPSTZOT-UHFFFAOYSA-N 427.539 4.136 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CSCc2coc(-c3ccccc3)n2)N(C)C)cc1 1539705836 HWOKYUZIYWUGRG-JOCHJYFZSA-N 438.597 4.060 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)CC(C)C)CC2)c(C)n1-c1cccc(Br)c1 1544469395 FHAHYZALIJALNS-UHFFFAOYSA-N 446.389 4.187 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]2C2CCC2)n1Cc1ccc(N(C)C)cc1C 1555652654 AGKGKWTYRWPFPV-XXBNENTESA-N 441.620 4.194 10 10 IICE CCCNC(=O)OC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1556508375 WJIZKAVHSDNOKB-HXUWFJFHSA-N 427.545 4.234 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](CC(=O)O[C@H]1CCOC1)CC(C)C 1557239567 CVBZHDMLNCVHTB-OALUTQOASA-N 432.586 4.270 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H]2CCOC2)c(C)n1-c1cccc(Br)c1 1558606340 RYTCOHJYUMZTPV-YLJYHZDGSA-N 447.373 4.124 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H]2CCCO2)c(C)n1-c1cccc(Br)c1 1558606724 DHFRAUFUIRAAMP-UXHICEINSA-N 447.373 4.267 10 10 IICE CCOC(=O)C[C@H](O)CSc1ncc(-c2ccc(Br)cc2)n1CC(C)C 1559339232 ASLILGMOGIEPDW-INIZCTEOSA-N 441.391 4.375 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc2c(c1)OC(F)(F)O2 1564967046 MDISRGVXLHTMBF-UHFFFAOYSA-N 443.244 4.208 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)cc1 1583224857 NYDWCJAHLLNRSP-OAQYLSRUSA-N 433.527 4.231 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-c2cccc(Cl)c2)no1 1583379594 WLQGZZMMADNHJB-UHFFFAOYSA-N 433.842 4.040 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCN3CCN(c4ccccc4)CC3)c2C)c1 1587021510 LQUHZTLCFJRQFU-UHFFFAOYSA-N 430.596 4.231 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc2cc(O)c(O)cc2s1 1620752843 BZYOQTMLBJCHBY-ZDUSSCGKSA-N 434.464 4.313 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1cccc(Br)c1 1624819484 OLVNXCCHBSHAPT-IRXDYDNUSA-N 448.405 4.086 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCCOC3)C2)c(C)n1-c1cccc(Br)c1 1626294824 YTIWJZSDFWFXCH-KSFYIVLOSA-N 447.373 4.267 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(C(=O)N4CCN(C)CC4)cc3)c2C)c1 1626756860 WWCPSDNKGNHILX-UHFFFAOYSA-N 444.579 4.351 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)c1 1630992102 GRPHFIVYASLELE-UHFFFAOYSA-N 431.920 4.270 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4cc(Br)sc4[nH]3)CC2)cc1 1632045189 ZJSRVVQMKFSKNO-UHFFFAOYSA-N 434.359 4.399 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(F)cc3NC(=O)OC(C)(C)C)C2)cc1 1643347153 UMECOEXCYQKSDF-INIZCTEOSA-N 443.519 4.438 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N(c4ccc(C)cc4C)C3=O)c2C)c1 1643633219 JIKQHUKNKZDTMS-UHFFFAOYSA-N 443.503 4.198 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(c3ccccc3)[C@H](C)C3CC3)cc2F)C[C@@H](C)O1 1644153393 FKDPKOIMHNQVOB-HSALFYBXSA-N 439.575 4.361 10 10 IICE CCOc1ccc(CN(CC(=O)N2CCOC(C)(C)C2)c2ccc(OC)c(Cl)c2)cc1 1657745349 CVNOHYHSBDNWRO-UHFFFAOYSA-N 446.975 4.391 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC/C=C/c3ccc(Br)cc3)C2)cc1 1673024857 JEPUUEAIZWKKKL-ZMUQKWFASA-N 444.373 4.297 10 10 IICE Cc1cc(CCNC(=O)NCC[C@H]2CCC3(CCOCC3)CO2)c(C)n1-c1ccccc1 1687218946 NXRBCBUAAWHJPV-XMMPIXPASA-N 439.600 4.302 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC[C@@H]2CCO[C@H](C)C2)cs1 1693373656 BGXBOMPHIXZDBN-SJLPKXTDSA-N 441.601 4.181 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCCC1(F)F 1694332075 QOQJIOYFKPGCKJ-QGZVFWFLSA-N 449.546 4.364 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CC[C@H](F)C1 1708396091 AYCMAIBEICBLSX-JBACZVJFSA-N 429.584 4.403 10 10 IICE CCCN(C)c1nnc(-c2cc(Br)cn2C)n1Cc1ccc(N(C)C)c(F)c1 1709682998 VIUOPFUUMRVRKA-UHFFFAOYSA-N 449.372 4.146 10 10 IICE CCOCc1nnc(N2CCOC(C)(C)[C@@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1710745968 MSJLDBDSWFLQOD-FQEVSTJZSA-N 441.620 4.103 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(OC)CCCCC1 1747029818 KKJJMNFGXZHJRP-UHFFFAOYSA-N 441.620 4.401 10 10 IICE Cn1nccc1[C@H]1CCCN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C1 1748067388 LTXXBCMFQCQOLL-INIZCTEOSA-N 445.662 4.332 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCS1 1752609995 SHJXZDNACSPXEM-NQIIRXRSSA-N 429.634 4.160 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCO[C@@](C)(C(C)(C)C)C1 1761698348 VSQWACYEVXKQGL-AREMUKBSSA-N 448.615 4.404 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)C[C@@H]3CC=CCC3)n2Cc2ccc(N(C)C)cc2C)n1 1762422846 VCTGXJNFSSAKDJ-JOCHJYFZSA-N 447.631 4.355 10 10 IICE COCCN(c1nnc(C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@H](C)C1 1769799919 FYSXKXOIXPIPBC-PKOBYXMFSA-N 431.600 4.470 10 10 IICE COc1ccc2nc(N3CC(C(=O)NCc4ccc(N5C[C@H]6CC[C@H]5C6)cc4)C3)sc2c1 1891608125 CCKGNJCCXJZKRT-PXNSSMCTSA-N 448.592 4.046 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCNCc1cccc(Br)c1O)C(F)(F)F 1913260109 IDTCGFYEDOAPPS-LBPRGKRZSA-N 427.261 4.090 10 10 IICE COc1cc(C=C2SC(=S)N([C@H](C)C(=O)O)C2=O)ccc1OCc1ccc(C)cc1 2293202139 HZWOAPJQURMERP-CQSZACIVSA-N 443.546 4.257 10 10 IICE CCOc1cccc(C=C2SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)c1O 2321734556 YQCFBQRJMPWYNX-UHFFFAOYSA-N 442.562 4.033 10 10 IICE COC(=O)COc1ccc(/C=C2/SC(=S)N(CCC3CCCC3)C2=O)cc1OC 33448566 KNUWLFARLNJDOM-LDADJPATSA-N 435.567 4.029 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 62694679 YUDXWSWHNHXAFK-UHFFFAOYSA-N 449.526 4.370 10 10 IICE Cc1cc(C(=O)NC[C@H](c2cccc(F)c2)N(C)C)c(C)n1-c1ccc2c(c1)OCCO2 106098620 XAAOHBVSTMMLLT-JOCHJYFZSA-N 437.515 4.037 10 10 IICE Cc1cc2c(n1-c1ccc(I)cc1Br)CCC[C@H]2N 388652997 NXDUCLSZKAUXDH-CYBMUJFWSA-N 431.115 4.489 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cnn(-c4ccc(C(F)(F)F)cc4)c3)CC2)cc1 746147582 IFTIHIGBXMAMBN-UHFFFAOYSA-N 445.445 4.254 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cc(O)nc2ccccc12 754379454 XZFUSLFXANTKDN-UHFFFAOYSA-N 430.302 4.140 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(Br)ccc1Br 797611813 BRCCMIZIVLKILG-VIFPVBQESA-N 444.123 4.376 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(N3C(=O)N[C@H](C)C3=O)c2C)c1 813853061 ZMPZUWVZFMGNFI-GOSISDBHSA-N 430.508 4.408 10 10 IICE C[C@H](N[C@H](C)c1ncc(Br)cn1)c1ccc(N2CCOCC2)cc1Cl 815634385 JTZJHJKWXYWELD-QWHCGFSZSA-N 425.758 4.141 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc(NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1 864016114 RMIFXXDVFPESBF-UHFFFAOYSA-N 446.573 4.274 10 10 IICE Cc1cccnc1Oc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 1126310190 QQYANWLLYCEXHS-UHFFFAOYSA-N 430.508 4.136 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2ccccc21 1130678800 PAKBPEDCHVJMSI-UIMCMNAESA-N 426.538 4.221 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)c1C 1137978911 RTDHROFKSCLHFC-NRFANRHFSA-N 445.563 4.499 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc2c(Br)cccc2cn1 1141804322 VVVJTWLYGASJMR-UHFFFAOYSA-N 442.382 4.481 10 10 IICE C[C@H](NC(=O)NCc1ccc(Cl)cc1I)c1ccccc1O 1246512173 YUEBPQUJTPFRQI-JTQLQIEISA-N 430.673 4.211 10 10 IICE Cc1cc(CCNC(=O)N2CCN([C@H](C)c3nccs3)CC2)c(C)n1-c1ccccc1 1253808002 LUHYRHDDAPNKBM-HXUWFJFHSA-N 437.613 4.182 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccoc1C 1289422625 BPXOBYSKCOFRSP-UHFFFAOYSA-N 430.556 4.224 10 10 IICE C[C@H]1C[C@H](CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCO1 1291018490 GUEAUSNQPVIRML-ZWKOTPCHSA-N 426.586 4.478 10 10 IICE CCCN(CCC)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1294551360 SENFWCANQLZBSA-UHFFFAOYSA-N 440.636 4.327 10 10 IICE CCOC(=O)[C@H](CC1CC1)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1303321942 VSSYYPYMQRSQCR-IBGZPJMESA-N 433.346 4.318 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(C(=O)c4ccc(C)cc4C)CC3)C2)cc1 1312901775 HWMHKNSQXZBCLP-NRFANRHFSA-N 449.595 4.443 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@H](Cc3ccccc3)c3ccccn3)CC2)cc1 1313423134 CADPBAFQBGCEQP-QHCPKHFHSA-N 444.579 4.338 10 10 IICE CCOc1ccccc1C(=O)N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 1354724013 VITLXPVIEIRBDT-UHFFFAOYSA-N 431.536 4.091 10 10 IICE Cc1nc(C)c(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)s1 1443743734 MFCMGOMDKQZVGZ-UHFFFAOYSA-N 433.375 4.297 10 10 IICE COc1ccc(/C=C(\C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1F 1445887971 WKIBBNHKHSYGLU-XATQLNLPSA-N 432.923 4.377 10 10 IICE Cc1cc(C(=O)NCCN2Cc3ccccc3OCC2=O)c(C)n1-c1cccc(C(C)C)c1 1455645795 UARILVDZQAASRF-UHFFFAOYSA-N 445.563 4.369 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1457193862 JWCWHVMWKCIPIU-AWEZNQCLSA-N 434.558 4.470 10 10 IICE CCOC(=O)c1c(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)n[nH]c1C 1458912806 RCCLISGXMXODME-QGZVFWFLSA-N 426.542 4.230 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(C(=O)c4ccc(C)cc4C)CC3)C2)cc1 1478956349 FGZPYRLINYOUSI-OAQYLSRUSA-N 435.568 4.195 10 10 IICE CCN(CC)[C@H](C)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1501799856 ZINJVAKAPIADCT-HXUWFJFHSA-N 435.620 4.240 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCCNC(=O)[C@H]2Cc2ccccc2)c1 1523714421 SIFYGAKUGKATEB-HSZRJFAPSA-N 435.955 4.321 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccc(C(C)(C)C)cc3)cc2F)C[C@@H](C)O1 1527481387 KYTKHLOJBRNCGO-HDICACEKSA-N 428.548 4.432 10 10 IICE CC(C)Oc1ncccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1534002282 GSTINZRRGCDIRC-ATVHPVEESA-N 445.541 4.238 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2cccs2)N(C)C)c(C)n1-c1ccc(Br)cn1 1540342383 YCNLZEHHRMJGGF-KRWDZBQOSA-N 447.402 4.346 10 10 IICE CC(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N2CCSCC2)cc1 1543098663 FWQVPRMZGCPKSV-HXUWFJFHSA-N 435.634 4.186 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 1544845127 KBPWYTBDTDUGHH-NRFANRHFSA-N 448.498 4.082 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(COC)CCC1 1545332908 QOQCFMOPVHRTIE-FQEVSTJZSA-N 441.620 4.081 10 10 IICE CC[C@H](C)CN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1545627871 BRWLHFXNOHHBCS-SFHVURJKSA-N 429.584 4.442 10 10 IICE CCCC[C@@H]1NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1=O 1559416943 CBJWOGNGOCIVBK-SFHVURJKSA-N 446.345 4.150 10 10 IICE COc1ccc([C@H]2CCCCCN2C(=O)CN(C)CCN(C)c2ccc(OC)cc2)cc1 1559966498 BVEWKCYJWVXWCE-RUZDIDTESA-N 439.600 4.216 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cncc(-c4ccc(OC)cc4C)c3)C2)cc1 1584444705 XQUHBBFNYGDIBU-LJQANCHMSA-N 431.536 4.331 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccc(Cl)cc2)[nH]n1 1595571659 HCPFAMLLVBKXCE-SFHVURJKSA-N 445.350 4.484 10 10 IICE CCOC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)cc1 1613303771 UNTKBYQNUWHSLD-UHFFFAOYSA-N 435.476 4.304 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc2c(c1)CCCN2C 1620002461 SWXRSEBPOQZGAA-LJQANCHMSA-N 441.620 4.059 10 10 IICE Cc1cc(CNC(=O)c2nn(CC(C)C)c(=O)c3ccccc23)c(C)n1-c1ccccc1 1624075442 OMTZQXCTUHMYSV-UHFFFAOYSA-N 428.536 4.390 10 10 IICE CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1625747116 CAPLZJFLRITHHI-SFHVURJKSA-N 433.508 4.061 10 10 IICE CCO/C=C/[C@@](O)(CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)C(F)(F)F 1628621706 AFTDWKUEACEUJS-CSHXORCISA-N 430.854 4.321 10 10 IICE Cc1ccc2c(c1)[C@H](NC(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CO2 1631105299 IVQWNFWNHFELBZ-GOSISDBHSA-N 426.314 4.424 10 10 IICE Cc1ccc(C(=O)NCCc2nc3cc(F)ccc3n2C)cc1-n1c(C)cc(C=O)c1C 1633128163 WIEAWTMQMPLHGX-UHFFFAOYSA-N 432.499 4.213 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC(C)(C)CCCNC(=O)OC(C)(C)C 1636263644 SOGAMMATNBDZFP-GOSISDBHSA-N 434.625 4.375 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)C(=O)N(c4ccc(C)cc4C)C3=O)c2C)cc1 1651754770 UAJAVLUMNLHIJR-UHFFFAOYSA-N 443.503 4.198 10 10 IICE Cc1cc(CCNC(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c(C)n1-c1ccccc1 1683148853 DWGIWTMCKIZDJQ-DENIHFKCSA-N 437.506 4.419 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](COC(=N)O)Cc2ccccc2)c(C)n1-c1ccccc1 1684444257 LJZMCAYBKGNGEL-JOCHJYFZSA-N 434.540 4.057 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(CCc2ccccc2)Cc2ccncc2)N(C)C)cc1 1684606745 IKPDMZMXZYVUOA-SANMLTNESA-N 445.611 4.205 10 10 IICE C[C@@H]1CC[C@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CN1C(=O)OC(C)(C)C 1687248880 ONKCJQXTXBUPRR-QUCCMNQESA-N 430.593 4.216 10 10 IICE COc1ccccc1CN(C)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1697595588 ROUPLHWZWJKYFH-KRWDZBQOSA-N 445.614 4.066 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1O 1728075373 ZHGYTPFVUTYZBB-JOCHJYFZSA-N 434.588 4.337 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CCO1 1745341703 CDDBCKZFQSGHBN-QGZVFWFLSA-N 444.630 4.293 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1760896615 MBEINAXBZWRREU-SFHVURJKSA-N 443.592 4.391 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CC[C@H](F)C3)CC2)cc1F 1768704583 KCKSNADEJJUOFZ-ROUUACIJSA-N 433.547 4.089 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)/C2=C/c2cccc(OC)c2O)cc1 1865658849 UKTZLBRFFDQDJR-KGENOOAVSA-N 432.451 4.379 10 10 IICE CCCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C[C@@H]2CCCO2)C1=O 1873164899 XPYRMUXWRIKUGL-QFIPXVFZSA-N 435.568 4.133 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CC3)C(=O)N(CCc3cccs3)C2=O)cc1 1873166800 HSAXKBCKTYMJBY-UHFFFAOYSA-N 431.561 4.230 10 10 IICE CCN1C(=O)C(Nc2ccc(NC(C)=O)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422971 YUGYWFJYMWPDPV-UHFFFAOYSA-N 442.519 4.264 10 10 IICE COc1ccccc1-n1c(C)cc(C(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1C 1873836571 NRGQMDVOKAFVHJ-UHFFFAOYSA-N 427.545 4.232 10 10 IICE CC(C)(C)OC(=O)NCC1CC2(C1)CC(NCc1cc(Br)ccc1O)C2 2108260059 ZQJFFHDMYXIDSB-UHFFFAOYSA-N 425.367 4.328 10 10 IICE CN1CCc2cc([C@@H](O)c3cc(I)ccc3Br)ccc21 2163078086 ZGJLVPHUCKMYJT-MRXNPFEDSA-N 444.110 4.128 10 10 IICE C[C@@H](NS(=O)(=O)c1cc(Br)sc1Br)c1ccccc1O 2192624222 JBTLDIOMZQUXFK-SSDOTTSWSA-N 441.166 4.018 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](NCc3cc(Br)cc(F)c3O)[C@H]1CC2 2229835682 HYKDVYMRHKWYJP-NUEKZKHPSA-N 429.330 4.314 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)C1(COCc2ccccc2)CN(C(=O)OC(C)(C)C)C1 2256696237 JIDAFLWDDMKWBW-HSZRJFAPSA-N 439.600 4.467 10 10 IICE CC[C@@H](N[C@@]12CO[C@@H](C1)[C@@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2281189064 IWCCMSNPVTUPKI-TXDAXLQXSA-N 441.366 4.020 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccc(Cl)cc1 2314828168 QZIUICDSHOHZFQ-UHFFFAOYSA-N 433.898 4.088 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2352644029 VSYGBQRKLDWFQF-LBPRGKRZSA-N 429.355 4.020 10 10 IICE Nc1ccc(CC[C@H](O)Cc2ccc(I)c(Br)c2)cc1 2377263712 MVNDALCAJYNFPD-AWEZNQCLSA-N 446.126 4.172 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459058 RXQBFGRONAKLEI-STSQHVNTSA-N 428.554 4.258 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551048 IPQSQFWUYLXWDV-DQVRNGEASA-N 427.526 4.498 10 10 IICE C[C@H](C(=O)NCc1ccc(N(C)C)cc1)C1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 35561954 ZVOQIRRCYORLHY-SFHVURJKSA-N 432.568 4.039 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)cc1)C1CCCCC1 109300372 TXZWPGMMHVWHQC-HSZRJFAPSA-N 439.625 4.367 10 10 IICE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NCc1c(O)ccc2c1CCCC2 743719375 ZRLQNBMKFKAUQI-UHFFFAOYSA-N 432.549 4.369 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1Cl 749738889 ZEMYARHFMXFDNW-UHFFFAOYSA-N 444.868 4.329 10 10 IICE CC(C)N(Cc1ccccc1)C(=O)[C@H](C)OC(=O)c1csc(Cc2ccc(N)cc2)n1 751935723 CIVKOWXTUMGOSM-KRWDZBQOSA-N 437.565 4.299 10 10 IICE Cc1cnccc1N1CCC(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 754548911 SHALHSMFVQVHBU-UHFFFAOYSA-N 425.488 4.021 10 10 IICE CCOC(=O)[C@@H](Cc1ccccn1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 759481387 JXIOHASTLTWTKI-HSZRJFAPSA-N 445.523 4.467 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(N2CCCC2=O)cc1 773147606 TZWMIOQJVMKRND-NRFANRHFSA-N 432.612 4.196 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nc3ccc(Cl)nc3[nH]2)C1 802215000 XIVPPQFIDPXYFY-UHFFFAOYSA-N 437.931 4.076 10 10 IICE Cc1ccc(OCc2cccc(C(=O)NCc3cc(Br)ccc3O)c2)cn1 804739195 AAYSBXMCWNFTAC-UHFFFAOYSA-N 427.298 4.367 10 10 IICE COc1cccc(N2C(=O)/C(=C/c3ccc(I)o3)SC2=S)c1 917643264 YGEUBXAWYLCUDK-WQLSENKSSA-N 443.287 4.299 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cnc(-c3c(F)cccc3F)s2)N(C)C)cc1 1134686218 CURFIBGUTCPAKU-SFHVURJKSA-N 430.524 4.187 10 10 IICE Cc1cc(C(=O)N(C)CCOc2ccccc2)c(C)n1-c1ccc(Br)cn1 1135238522 DKNBZDBAZJCSOX-UHFFFAOYSA-N 428.330 4.403 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1 1136283750 MOIBOMOFNBLNNJ-UHFFFAOYSA-N 430.552 4.301 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C(F)(F)F)c(C)n1-c1cccc(Br)c1 1147390496 LQSPBSZFQGSLGJ-INIZCTEOSA-N 431.252 4.260 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@H]3CCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1148054855 DCZQULNTINKMBP-IBGZPJMESA-N 427.545 4.184 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@@H]3C[C@@H]3CCCO3)cc2Cl)C1 1235832007 BWRPTYACZCQAKC-HOJAQTOUSA-N 435.996 4.056 10 10 IICE CC[C@@H](C)c1nnc(N(C)OC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291460144 PKYBWWQTBBBZPC-QGZVFWFLSA-N 431.556 4.126 10 10 IICE CCOC(=O)c1c[nH]nc1[C@@H]1CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1 1301587186 VJYDPPARGZYBPO-MRXNPFEDSA-N 440.931 4.277 10 10 IICE COC1(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CCCC1 1315274870 OFARLJDURIGHDK-UHFFFAOYSA-N 427.936 4.295 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(Br)cc2)C1 1358278122 VQTIEDVKTJGJHW-UHFFFAOYSA-N 440.385 4.487 10 10 IICE O=C(/C=C\c1cncc(F)c1)N(CCc1ccccn1)c1ccc(Br)cn1 1436990644 SFBVZUARRCYRIH-DAXSKMNVSA-N 427.277 4.062 10 10 IICE COc1ccc(OC)c(CN2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)c1 1441018345 OLCWIYQLEICFOJ-UHFFFAOYSA-N 447.579 4.378 10 10 IICE C/C(=C/C(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)Cc2ccc(F)cc21)c1cnccn1 1458091381 DNWGDNQNHZXMBZ-IZNAZMGOSA-N 426.492 4.191 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@@H](O)C(F)(F)F 1466536731 OUCLQDCRPVOXJS-GDBMZVCRSA-N 433.268 4.288 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc1 1471070020 DQGLDKRWYFKIAC-RTWAWAEBSA-N 435.927 4.096 10 10 IICE Cc1cccc(-c2nnc(N3CCC(CCCO)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1492511624 DRAHXTHZVDPOSP-UHFFFAOYSA-N 448.615 4.060 10 10 IICE CCC[C@](C)(O)Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1514260872 BZWGRZPHEOOIEV-VWLOTQADSA-N 441.620 4.212 10 10 IICE C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1531196620 QNQOPAGPHIMWAW-CUUNMWDPSA-N 446.491 4.216 10 10 IICE CC(C)c1ccc(OCCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1535562199 ZEBZQQHXJDKNSS-UHFFFAOYSA-N 435.612 4.427 10 10 IICE C[C@H](NC(=O)c1ccccc1OCCN(C)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1538977198 XCTBDSOGVRYENI-SFHVURJKSA-N 441.572 4.489 10 10 IICE CC(C)=CCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1541254470 AQTOWEYFTPEQRL-QHCPKHFHSA-N 439.604 4.349 10 10 IICE CCCN(C)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N2CCSCC2)cc1 1547092810 JFUDSUXSVRTXFX-UHFFFAOYSA-N 442.658 4.082 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)OCc1ccccc1C 1556426621 UUWBQBYMXOCSNG-IBGZPJMESA-N 426.557 4.289 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCNC(=O)c3cc4ccccc4[nH]3)c2C)c1 1596481840 HMIWBJQIWRPESR-UHFFFAOYSA-N 428.536 4.320 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(C)n1-c1ccc(F)cc1 1597895259 XCQWVXMPEOOLIA-UHFFFAOYSA-N 436.487 4.099 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc([C@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1614108830 LCKAFKCJSWFHFJ-HFSMHLIXSA-N 429.609 4.050 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1C[C@@H](OC(C)(C)C)C1(C)C 1616690424 WCUCHYIKUFUYAH-UYAOXDASSA-N 430.593 4.386 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1C 1618502174 YOHANQZTKPTHGO-HKUYNNGSSA-N 448.615 4.360 10 10 IICE COc1cccc(CNC(=O)c2cc(Oc3cccc(Br)c3)ccn2)c1O 1622772768 GGWSBJMTKWBKGI-UHFFFAOYSA-N 429.270 4.281 10 10 IICE Cc1cc(CC(=O)N2CCCC[C@H]2COC(=O)N(C)C)c(C)n1-c1ccc(Cl)cc1 1627097402 XMSSNAFHTVDBNM-NRFANRHFSA-N 431.964 4.369 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c(C)n1-c1ccccc1 1628627324 SDGTTYGAAXGACZ-HTAPYJJXSA-N 425.573 4.398 10 10 IICE Cc1ccc(OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)c1 1629679076 KGPXOELBYBKEBD-OAQYLSRUSA-N 441.572 4.130 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 1631157146 MZTIBVSYNGJKNQ-RUZDIDTESA-N 436.939 4.228 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1c(C)c2cc(Br)ccc2oc1=O 1633341439 UHDZHFWOKFQEQW-UHFFFAOYSA-N 429.314 4.168 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)C1 1633402158 UCHLJLXMIIWLRZ-XLNAKTSKSA-N 429.517 4.467 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)CC2)cc1 1636706809 HNSWVBFKWBDMKX-AREMUKBSSA-N 438.568 4.149 10 10 IICE C[C@H]1CCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC12CCC2 1637328091 KSIHVIYOVSBLKZ-VUODPORTSA-N 432.586 4.456 10 10 IICE COC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1638369654 VPSLVGJDLVDEDJ-OAQYLSRUSA-N 428.891 4.401 10 10 IICE C[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1cc(Cl)cc2c1OCC2 1638652390 ZRWHWIGRFHWGBI-QVKFZJNVSA-N 430.980 4.004 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(C)C[C@@]3(O)CCN(Cc4ccccc4)C3)c2C)c1 1642593585 GAFUAAHEXKIRDH-MHZLTWQESA-N 431.580 4.112 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)c([N+](=O)[O-])c1 1643550707 SKXWIWJCEDJWRV-UHFFFAOYSA-N 440.427 4.498 10 10 IICE COC(=O)[C@H](Cc1cc2ccccc2o1)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1651633594 ATRZLUHXTWIWPC-QHCPKHFHSA-N 444.487 4.167 10 10 IICE COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1655103421 DCEASWSJPQCGGQ-MRXNPFEDSA-N 433.892 4.125 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](C)c3ccc(OC(F)(F)F)cc3)C2)cc1 1672385580 BRIUMTGPKHJRKC-HOTGVXAUSA-N 437.462 4.481 10 10 IICE C[C@]1(Cc2ccccc2F)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725773 VZNRIYCCMRQYFY-XMMPIXPASA-N 447.501 4.247 10 10 IICE CC[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 1694970040 VVWZXDNURJMLHT-PXNSSMCTSA-N 429.584 4.268 10 10 IICE C[C@H](C#N)CN(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1706080067 XOEYICANCGBVMO-HGHGUNKESA-N 442.583 4.046 10 10 IICE CCOc1ncccc1Cn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1710572811 KGKVQQTXBVNVIN-UHFFFAOYSA-N 434.588 4.480 10 10 IICE CCC[C@H](C)CN(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1745223610 RJZASYTVZAIWHE-NRFANRHFSA-N 448.615 4.021 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(C3CCC3)C[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1761886045 LDFCDRJNDNSZCX-RBUKOAKNSA-N 442.627 4.356 10 10 IICE CN(C[C@H]1CCCCO1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1767223230 CQJCGZZCNCWIHH-SJORKVTESA-N 437.635 4.164 10 10 IICE COC(=O)c1c(NC(=O)C(=O)N[C@@H]2CCCC[C@H]2C)sc(C)c1-c1ccc(C)cc1 1860760990 LQWSMSJCOTYESC-RHSMWYFYSA-N 428.554 4.452 10 10 IICE CCOC(=O)c1c(NC(=O)c2cn(C)nn2)sc(C)c1-c1ccc(Br)cc1 1866162241 QFSKTJWFUFBPCR-UHFFFAOYSA-N 449.330 4.044 10 10 IICE CCCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C[C@H]2CCCO2)C1=O 1873164898 XPYRMUXWRIKUGL-JOCHJYFZSA-N 435.568 4.133 10 10 IICE CC[C@H](NC[C@@H]1[C@@H]2C[C@@H]2CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 1906022756 DUSZTTAQKKNCFD-QIJZBDPFSA-N 425.367 4.451 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2(C)CC2)c(CN)c1I 2079023279 SZOIUESNCTYHTA-CQSZACIVSA-N 425.314 4.011 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](CNCc2cccc(Br)c2O)(C2CC2)C1 2093192868 LZEHBQNXGQWQPX-HXUWFJFHSA-N 425.367 4.282 10 10 IICE CC[C@H](NC[C@H]1[C@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2138291869 YZEGDZOJHWIRRX-OSMBCOQSSA-N 425.367 4.451 10 10 IICE Cc1cc(-n2c(C)cc(C=C3SC(=N)NC3=O)c2C)ccc1I 2297506005 SDUGRSUDXSDORH-UHFFFAOYSA-N 437.306 4.146 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)cc3)C2=O)cc1 2313549542 YYIFZFYCLPDZMV-UHFFFAOYSA-N 442.471 4.331 10 10 IICE CCN1C(=O)C(=Cc2c(NC3CCC(C)CC3)nc3ccc(C)cn3c2=O)SC1=S 2314414892 PYVZFJPPTWTPRD-UHFFFAOYSA-N 442.610 4.215 10 10 IICE O=C1NN(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C/c1cccn1-c1cccc([N+](=O)[O-])c1 1129508 VVLKQUKOAQFNMK-WOJGMQOQSA-N 443.246 4.154 10 10 IICE O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1O)N2 13639982 QTLAHGOYFLVJGI-OHUGHZGNSA-N 448.544 4.403 10 10 IICE O=C1N=C(Nc2cc(C(=O)O)cc(C(=O)O)c2)S/C1=C\C(Cl)=C\c1ccccc1 16928448 AWPYOZVRHVRVIY-WAOMKOKCSA-N 428.853 4.288 10 10 IICE Cc1cc(C(=O)Nc2cccc(Cn3cccn3)c2)c(C)n1-c1ccc2c(c1)OCCO2 32469885 PTKOEYFNFIZNDR-UHFFFAOYSA-N 428.492 4.362 10 10 IICE CC(C)c1ccc(/C=C2/SC(=S)N(CCC(=O)N3CCCC[C@H]3CCO)C2=O)cc1 33583221 QEUNXIXALCYEBK-AZGFIHASSA-N 446.638 4.165 10 10 IICE COc1ccc(-c2ccc(/C=C3/C(=O)N(c4cccc(C(=O)O)c4)N=C3C)o2)c([N+](=O)[O-])c1 100316450 YIZVJJCNRKYIRZ-YBFXNURJSA-N 447.403 4.368 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc3c(cc2Cl)OCCO3)C1 435566072 MURRZWFPQVBMMC-UHFFFAOYSA-N 439.943 4.471 10 10 IICE Cc1nc(CN2CCC(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2)cs1 731599757 ACVNEGPXHGQJCN-UHFFFAOYSA-N 436.625 4.430 10 10 IICE CC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)c1ccccc1 800048513 DBZFYGSNJIQMFI-HTAPYJJXSA-N 427.976 4.460 10 10 IICE Cc1nc(C(F)(F)F)ccc1NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 801847510 YYMPBLNGLJIIHX-CHWSQXEVSA-N 440.441 4.483 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 804732955 GMTDXUPGZBICOG-OAHLLOKOSA-N 432.362 4.278 10 10 IICE O=C1/C(=C\c2ccc(-c3ccc(F)cc3)s2)SC(=S)N1CCN1CCOCC1 839448482 TZPYFXHGXGJFOR-QGOAFFKASA-N 434.583 4.088 10 10 IICE CCN(CC)c1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)N[C@@H](C)C(N)=O)cc1 914718458 ONFMPGWCMWEXGA-PJCCXHTNSA-N 442.563 4.171 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc(OC)c1OC 1084041464 BVPVUTXGBWJHIK-RQZCQDPDSA-N 446.506 4.335 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CC(=O)N(C(C)C)[C@H]1c1ccc(Cl)c(F)c1 1126079542 DALQMHUQSNRXOT-XXBNENTESA-N 445.966 4.468 10 10 IICE CCc1sc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(C(N)=O)c1C 1127071927 LBUJBRTVGJKLFZ-UHFFFAOYSA-N 425.554 4.199 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)O2)C1 1133272678 KDKLOQWNQYLWSY-IERDGZPVSA-N 437.506 4.024 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1 1136590702 BCDIOEACZQVZMT-IBGZPJMESA-N 439.581 4.144 10 10 IICE COc1ccc(N2CCN(C(=O)C(F)(F)c3ccc(Br)cc3)CC2)cc1F 1137422854 LDDGPRZDWRLNSO-UHFFFAOYSA-N 443.263 4.037 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 1142419387 QARZABRPSULROS-RDPSFJRHSA-N 439.600 4.449 10 10 IICE CC[C@]1(C(C)C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)C1=O 1165650151 SLMNUBPTWJUEQB-JOCHJYFZSA-N 433.911 4.426 10 10 IICE Cc1cc(CNC(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c(C)n1-c1ccccc1 1254078685 DKMGWLLPFQTZRF-LJQANCHMSA-N 436.600 4.274 10 10 IICE C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1264610746 MLPNZANKMDBYPQ-ZDUSSCGKSA-N 432.457 4.490 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCOc3ccccc3-c3ccccc3)cc2)CC1 1288331418 ZXRRHZMTYPEFFV-UHFFFAOYSA-N 429.564 4.191 10 10 IICE Cc1cccc(-c2nnc(N3CCSC[C@H]3C)n2CCCSc2nccs2)n1 1289993577 LXBYRVYQVADOHH-OAHLLOKOSA-N 432.644 4.229 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(=O)NC1CC1 1294418092 CDONNSZCXUPNHM-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(-c2ccccc2OC)s1 1299700129 ZBNQXYWFCHGCGN-UHFFFAOYSA-N 425.506 4.335 10 10 IICE Cc1nc(Cc2nnc(N3CCCC3(C)C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1304672946 XCAPVZZRERSFHY-UHFFFAOYSA-N 428.581 4.266 10 10 IICE CCO[C@H](CCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1314061143 VAJIRFLFHFROKI-FYYLOGMGSA-N 442.604 4.500 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@@H]2CCCS(=O)(=O)C2)sc(C)c1-c1ccc(C)cc1 1348914719 OBLUFARBZMULGV-INIZCTEOSA-N 449.594 4.362 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl 1353246939 WUYIKZIPBVBBJN-UHFFFAOYSA-N 437.853 4.244 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(I)c(Cl)c1 1435286620 MLFGWXYVHQOWGW-UHFFFAOYSA-N 442.684 4.050 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1 1449126048 VJDOPEFOJBHHBD-UHFFFAOYSA-N 425.510 4.117 10 10 IICE COC(=O)c1c(F)cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1F 1459529578 LDFWSDQWYFEGKP-UHFFFAOYSA-N 428.435 4.232 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(CCN(C)C)Cc2ccccc2F)cc1 1464509278 YNZLXPDGJYJDOA-UHFFFAOYSA-N 435.543 4.179 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H](c3ccccc3F)C(C)C)CC2)cc(OC)c1OC 1478939248 WMXRGXPMKPLWEV-QFIPXVFZSA-N 445.535 4.080 10 10 IICE CCNC(=O)OC[C@@H]1CCCCN1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1479099847 QKNYTBMUSHSNCC-QFIPXVFZSA-N 426.561 4.213 10 10 IICE COC(=O)CCN(Cc1ccccc1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1524087811 PUGIQOKLEANLCN-UHFFFAOYSA-N 434.536 4.121 10 10 IICE O=C(CC[C@H]1CC1(Cl)Cl)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245411 LVGXPHYLSFYUIA-ZDUSSCGKSA-N 425.278 4.132 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C3(c4ccc(Br)cc4)CCC3)C2)cc1 1528317502 KYCSPAGOQHSRDA-GOSISDBHSA-N 429.358 4.275 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COc3ccccc3O2)c(C)n1-c1cccc(Br)c1 1540683978 JEAQHRZXWLMALW-GOSISDBHSA-N 441.325 4.426 10 10 IICE FC(F)(F)C1=CCN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)CC1 1555966741 HWCLDHVMGWGJAH-CYBMUJFWSA-N 445.536 4.120 10 10 IICE Cc1cc(C(=O)Nc2cccc(C[S@](C)=O)c2)c(C)n1-c1ccc(Br)cn1 1565753276 PAFHXANQQDIYIL-MHZLTWQESA-N 446.370 4.382 10 10 IICE Cc1ccc(-c2nc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cs2)n1C 1566356300 BAQOXQJZIVDBNT-QGZVFWFLSA-N 444.988 4.210 10 10 IICE Nc1ccc(I)cc1C(=O)N(Cc1ccco1)Cc1ccccc1O 1588146486 ZALSTCGCOMTFKS-UHFFFAOYSA-N 448.260 4.015 10 10 IICE Cc1ncc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1596446812 KOJQNTLJZVQMQK-BTAWCLGRSA-N 435.571 4.059 10 10 IICE CCN(CCCS(=O)(=O)c1ccc(C)cc1)Cc1cc(Br)ccc1O 1615673980 CAXMTJKSAJWUIH-UHFFFAOYSA-N 426.376 4.149 10 10 IICE CCOC(=O)C[C@@H]1CCN(C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)c2ccccc21 1616616654 UWSQDSZUMHPDKP-WMZOPIPTSA-N 428.529 4.074 10 10 IICE COC[C@@H](F)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1619624662 LFYHXSHCNVRMDR-NRFANRHFSA-N 429.584 4.232 10 10 IICE Cc1ccc(C(=O)N[C@@H]2c3sccc3OC(C)(C)[C@H]2O)cc1-n1c(C)cc(C=O)c1C 1629632044 WDBOZZVYKJBSBC-IRLDBZIGSA-N 438.549 4.280 10 10 IICE CCCCNc1nc(CC(=O)N(CC)Cc2cc(Br)ccc2O)cs1 1629972842 YFCVTRJGVONSQB-UHFFFAOYSA-N 426.380 4.414 10 10 IICE C[C@@]1(c2cccc(Br)c2)C[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1630287895 NKIFRRDSHIQEBS-GMAHTHKFSA-N 443.385 4.004 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cccc(Nc4nccs4)c3)cc2F)CC1 1632994734 VCUYPFQPURPZQQ-UHFFFAOYSA-N 439.560 4.098 10 10 IICE C[C@H](NC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)c1ccccc1O 1635799071 NSVJDDOBHKXUGT-AWEZNQCLSA-N 430.913 4.337 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)c1 1636401751 MIOLDBXZISZKKA-UHFFFAOYSA-N 444.535 4.248 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1ccc(C(N)=O)cn1 1638241578 QUGMAWQTABCUKX-GOSISDBHSA-N 442.441 4.106 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)c1ncnc(CC(C)C)c1I 1639614210 BZCHLHODYRLKSF-UHFFFAOYSA-N 438.357 4.372 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCCCN2C(=O)OC(C)(C)C)CCCC1 1639691648 WHXLJEPGNXNKSI-UHFFFAOYSA-N 427.545 4.303 10 10 IICE Cc1ccc(C[C@H](C)N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1657368764 HCOYDZGLGOFPBK-SFHVURJKSA-N 426.516 4.272 10 10 IICE Cc1ccc(N2CCN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1674922554 AXLJDTWLAWUFMU-UHFFFAOYSA-N 430.552 4.003 10 10 IICE Cc1cc(CNC(=O)N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1684603709 AWESBXCMGUAVPS-AFARHQOCSA-N 431.536 4.415 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(N)=O)C1 1694979955 LPOCAODYIPDDRX-ZYJSVEMRSA-N 432.572 4.021 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1695070431 AWYYEOGDDJXLBD-CPJSRVTESA-N 443.636 4.366 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccoc2)n1Cc1ccc(N2CCSCC2)cc1 1706380278 VGEOMSPDXGUKQE-UHFFFAOYSA-N 425.602 4.308 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC(C)(COC)CC2)cc1 1746095301 NDIGFSOYQKVASL-JOCHJYFZSA-N 441.620 4.277 10 10 IICE CC(=O)N[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C1 1749928404 XBFOERAPJUIQCP-OAQYLSRUSA-N 434.588 4.114 10 10 IICE Cc1nn(C)c(C)c1CN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1751818189 GNOOICNZIXFQAE-UHFFFAOYSA-N 441.599 4.107 10 10 IICE Cc1nnc(N(C)C[C@@H]2CCN(Cc3ccccc3)C2)n1CCCSc1nccs1 1751885879 VKWZNXVZVSYZPA-FQEVSTJZSA-N 442.658 4.184 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763825312 BLAPTCBBCJZPMS-AZUAARDMSA-N 429.634 4.008 10 10 IICE Cc1oc2c(C)c3oc(=O)c(CCC(=O)NCCc4ccc(O)c(O)c4)c(C)c3cc2c1C 1860281267 AHFMCQVUPCGNDT-UHFFFAOYSA-N 449.503 4.476 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1c(O)cccc1O 1952825542 LRNVROMKKHHBOG-NTKDMRAZSA-N 445.471 4.495 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=Cc1c[nH]c2ccc(Br)cc12 2294137466 FQOAHXQPWNUSGQ-UHFFFAOYSA-N 444.672 4.250 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(Cl)cc3)C2=O)ccc1OCC(=O)O 2314931858 IIXQPXHNXHLMJU-UHFFFAOYSA-N 435.910 4.218 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459463 WYXNXVSMICNEOM-DFIYOIEZSA-N 435.568 4.299 10 10 IICE COc1cc(OC)c(/C=C2\C(=O)N(c3cc(C)cc(C)c3)C(=S)N=C2O)c(OC)c1 16269105 UVHQDRFFIXBUTB-BOPFTXTBSA-N 426.494 4.001 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC(C)(C)C)N2CCN(c3ccc(F)cc3)CC2)cc1 22665590 LLRILCHBSARCNO-DEOSSOPVSA-N 440.607 4.307 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccccc1NC(=O)c1ccccc1 28318316 JHBDAVYCHLVJKI-UHFFFAOYSA-N 429.520 4.048 10 10 IICE Cc1cc(C(=O)NCc2ccccc2Cn2cccn2)c(C)n1-c1ccc2c(c1)OCCO2 28503417 FBCIJJFPQNCQMD-UHFFFAOYSA-N 442.519 4.040 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(O)c1/C=C1\C(=O)N(c2ccc(Cl)cc2)C(=O)N=C1O 34221890 YVLOEEGQIJPPOY-YVLHZVERSA-N 440.818 4.186 10 10 IICE NC(=O)c1ccccc1NC1=NC(=O)/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)S1 39869845 IBOOATYFQHCIMU-WOJGMQOQSA-N 434.433 4.036 10 10 IICE CCOc1ccccc1/C=C/C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 71933442 JSHGGGSMDVLNJR-CSKARUKUSA-N 434.458 4.270 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccccc3O)SC2=S)cc1 210721258 CPVYOZBUJVCWIE-XMHGGMMESA-N 442.562 4.411 10 10 IICE O=C(Nc1ccc(C(=O)N2CCCC2)cc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 586710296 WMDCMYWOMUWHEY-UHFFFAOYSA-N 439.471 4.342 10 10 IICE CCCN(CCc1ccccn1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745903402 FSAVUEDDSISTML-IBGZPJMESA-N 432.515 4.316 10 10 IICE C[C@H](Nc1cccc2c1CCN2S(C)(=O)=O)c1cc(Br)cc(Cl)c1O 757695315 DEOXRUOLRKOFRJ-JTQLQIEISA-N 445.766 4.303 10 10 IICE O=c1c(Cl)c(N2CC=C(c3ccc(Cl)nc3)CC2)cnn1-c1nc2ccccc2[nH]1 773255656 RAPUXOBWVWVTDX-UHFFFAOYSA-N 439.306 4.104 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)c1O 777743308 FIQVJWATKFQEHW-UHFFFAOYSA-N 441.421 4.202 10 10 IICE Oc1ccc(Br)cc1CNCc1cn(-c2ccc(Cl)c(Cl)c2)nn1 809713695 XYJFROSHJCNZEH-UHFFFAOYSA-N 428.117 4.332 10 10 IICE C[C@@H]1CN(c2ccc(CNS(=O)(=O)/C=C\c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917918456 PFHANCNTECTUKM-SBKIPFDTSA-N 438.952 4.183 10 10 IICE COc1ccc(NC(=O)CSCC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1132047999 FFUNFWSWAJLEBW-UHFFFAOYSA-N 437.565 4.091 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(O)cnc2c(F)cccc12 1136546455 JECAVEDYVIZMEC-UHFFFAOYSA-N 431.414 4.080 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 1142526850 YHYDSABFFCJCLR-WIYYLYMNSA-N 439.556 4.424 10 10 IICE Cc1cc(C(=O)NC2CCC(C)(N(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1152150365 CDQQQLOFZRMAHT-UHFFFAOYSA-N 433.394 4.244 10 10 IICE O=C(NCc1cccc(Br)c1O)C1(c2cccc(OC(F)(F)F)c2)CC1 1156790199 FLBLLRNLENUAGF-UHFFFAOYSA-N 430.220 4.401 10 10 IICE C[C@@H](C1CC1)N(C(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21)C1CC1 1190933075 BLWFGDSRIQCBMY-KRWDZBQOSA-N 427.589 4.253 10 10 IICE CCc1ccccc1[C@H](CNC(=O)NCc1cccc(OC)c1O)NC(=O)OC(C)(C)C 1229525555 XXDNCJBOWAJUQH-IBGZPJMESA-N 443.544 4.028 10 10 IICE CCOC(=O)N1CCC([C@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1235345317 ZMNZHRONBCQJRO-IBGZPJMESA-N 440.588 4.459 10 10 IICE CCN(CC)CCCC1CCN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 1252114682 FSCIKUOWKPYZPI-QFIPXVFZSA-N 430.637 4.065 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(OCc4ccccc4)c3)cc2F)C[C@@H](C)O1 1291755267 CBBPQZYZPDMNST-KDURUIRLSA-N 449.526 4.343 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C[C@@H](C)O1 1293579280 QJMDTQHDBHYUJE-KNQAVFIVSA-N 434.588 4.075 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(O)cc(Br)c1 1297228608 PXDRZTWJQGXMTE-UHFFFAOYSA-N 449.345 4.157 10 10 IICE Cc1cnc([C@H](C)Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)s1 1304610338 NTIBTMQNPBKRIN-QAPCUYQASA-N 427.574 4.083 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)c1ccc2nc(O)oc2c1 1313091645 IWNWAZBOOOBGKL-LLVKDONJSA-N 434.290 4.294 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)N(C)C)cc1 1313410028 DAJFSMTVIOLOHF-RUZDIDTESA-N 433.600 4.426 10 10 IICE CCCNC(=O)c1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1350608959 MUWFMDDVLLMAAQ-UHFFFAOYSA-N 432.568 4.186 10 10 IICE Cc1c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)nnn1-c1ccc(OC(F)F)cc1 1352615327 MXAZJFSWWKQGSI-UHFFFAOYSA-N 441.482 4.050 10 10 IICE CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357641660 WEDMBDAVVLFZDY-HFJWLAOPSA-N 437.559 4.439 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccncc2)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1437141052 XVBZDYVRSSUTQX-QHCPKHFHSA-N 433.552 4.101 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)[C@@H]1CCC[C@@H](OC)C1 1452752536 DMZZCNDAPFEWHK-OZOXKJRCSA-N 432.948 4.224 10 10 IICE Cc1cc(C(=O)Cn2cc([N+](=O)[O-])cc(F)c2=O)c(C)n1-c1cc(Cl)cc(Cl)c1 1459144315 XDTUDFLDUHHLTF-UHFFFAOYSA-N 438.242 4.493 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H](C)[C@@H]3CNC(=O)OC(C)(C)C)cc2)CC1 1459604869 BLSPCOJUGASNAU-XXBNENTESA-N 431.621 4.427 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)N(CC)Cc3cc(Br)ccc3O)cc2C1 1465850291 FHEJWTNLFIYLTI-ZDUSSCGKSA-N 433.346 4.433 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)CC1CCN(C(=O)OC(C)(C)C)CC1 1470556475 WBUUFPTURGFUJX-IBGZPJMESA-N 446.636 4.281 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2c(C(F)(F)F)cnn2C)cc1 1470926949 DKVBUBBHNMFCOW-UHFFFAOYSA-N 435.450 4.010 10 10 IICE CCc1nnc(N2CC[C@H](OCC(C)C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1498992742 DDYMVQCHJSHMHV-QHCPKHFHSA-N 425.621 4.376 10 10 IICE Cc1ccccc1C[C@@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1527450646 SIDQKMYFJMIONF-ZGPWBKFBSA-N 442.581 4.473 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(F)c(Br)cc3F)CC2)cc1 1529804443 PLDWCXHRPUNVCV-UHFFFAOYSA-N 425.273 4.135 10 10 IICE C[C@H](SCc1nc(O)c2ccccc2n1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1531692828 DXOJOUCHCJJFLQ-KRWDZBQOSA-N 436.581 4.216 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Cl)cccc3OCC3CC3)CC2)c(OC)c1 1534596244 PEAZQFOPGIRVCW-UHFFFAOYSA-N 430.932 4.108 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F 1536551337 ZFWKSTLAIKOIHJ-HNNXBMFYSA-N 431.462 4.022 10 10 IICE COc1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)ccc1Br 1542285356 LSWVIHMNIUKQIZ-UHFFFAOYSA-N 444.373 4.242 10 10 IICE CCCCc1ccc(NS(=O)(=O)c2cccc(C(=O)NCc3ccccc3O)c2)cc1 1545681833 FOMLRWMMYCCMIA-UHFFFAOYSA-N 438.549 4.466 10 10 IICE CCC[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1546955562 YFXWXIIDBYWWQR-JTHBVZDNSA-N 441.620 4.072 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCCC1(F)F 1555615736 UBNMVPMGDGRSAM-FUHWJXTLSA-N 438.519 4.170 10 10 IICE CCOC(=O)N1CCCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)CC1 1583906992 NRGQDQJIQYVSRM-UHFFFAOYSA-N 448.361 4.161 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1595435980 OBDWRCDGMBFTJV-MRXNPFEDSA-N 432.351 4.263 10 10 IICE COc1cccc2c1CC[C@@]2(NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Cl)c1O 1606868442 OEWBBISXPAWWPA-QHCPKHFHSA-N 446.931 4.037 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CSCc3cccc(C(N)=O)n3)c2C)c1 1613702814 GLAGDVQVQSSTKL-UHFFFAOYSA-N 425.579 4.426 10 10 IICE CC[C@@H]1CCCN(c2nnc([C@H]3OCC[C@H]3COC)n2Cc2ccc(N(C)C)cc2C)C1 1614157896 PXHLGEJHTBLSTH-NWSQWKLXSA-N 441.620 4.051 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1616437156 RKDHBYBJGORZFX-HHHXNRCGSA-N 446.547 4.086 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3nc(C(C)C)ncc3OCc3ccccc3)C2)cc1 1617262246 CHAVYPKKYWWKRM-FQEVSTJZSA-N 446.551 4.196 10 10 IICE COC1CCN(c2ccc(CN3CCC(NC(=O)OCc4ccccc4)CC3)cc2)CC1 1620510145 OPSYXANXIKJHNC-UHFFFAOYSA-N 437.584 4.193 10 10 IICE Cc1cccc(C[C@H](CO)NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1625246952 HGDXVAKICUEFJK-LJQANCHMSA-N 441.369 4.498 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](C)[C@H]2C(=O)OC(C)(C)C)cc1 1626995295 OBZGMVFIVSWTPC-XDHUDOTRSA-N 438.568 4.418 10 10 IICE Cc1nc(O[C@@H](C)C(F)(F)F)ccc1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1631219150 OGKMHCDURPPGCD-DOTOQJQBSA-N 438.446 4.247 10 10 IICE C[C@@H](CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)c1cccc(F)c1 1631425753 NJHQNTIWNLZDSJ-YWZLYKJASA-N 432.923 4.174 10 10 IICE CCOC(=O)[C@]1(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CCc2ccccc21 1633894362 RJZKVWQQNLNTHX-SANMLTNESA-N 432.520 4.237 10 10 IICE CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1634338558 GTHLGDZDYQZTCS-NHCUHLMSSA-N 428.621 4.183 10 10 IICE COc1ccc(N2CCN(CCNc3cc(C)c(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 1639363713 INISJWHGSOLPAV-UHFFFAOYSA-N 438.450 4.165 10 10 IICE CC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)cc1F 1645071856 BUMCSMQBYMKDIB-HXUWFJFHSA-N 434.442 4.420 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nc(O)cc(C(F)F)n3)c2C)cc1 1652024623 QSWJMHWQYPUPIN-UHFFFAOYSA-N 447.463 4.289 10 10 IICE CCN(C)c1ccc(CN[C@@]2(C(=O)OC)CCc3cc(Br)ccc3C2)cc1 1659482152 YQALDLAPPGIISR-QFIPXVFZSA-N 431.374 4.096 10 10 IICE CCOC(=O)CC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 1681827259 DODRUTOGSYKBPO-KRWDZBQOSA-N 435.996 4.451 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1 1683046827 URZNGKKVNQPLNE-NJDAHSKKSA-N 444.620 4.320 10 10 IICE C[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1cccc(OC(F)(F)F)c1 1685090942 OJJJDEUVTQEVCO-FOIQADDNSA-N 438.494 4.314 10 10 IICE C[C@H](NC(=O)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccc(N(C)C)cc1 1686173134 CCUITRPNQJHPIJ-KRWDZBQOSA-N 434.506 4.360 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@]2(C)COc3ccccc3O2)cc1 1687165603 HXQKWFMOFKRPCQ-VWLOTQADSA-N 435.524 4.288 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCO[C@](C)(C(C)(C)C)C2)cc1F 1696609409 ADWDPJWPDDRUKD-DEOSSOPVSA-N 429.584 4.125 10 10 IICE Cc1cc(-c2nnc(Nc3ccn(C)n3)n2CCCCCCO)c(C)n1-c1ccccc1 1751412090 PCBZGEGUSFKTCB-UHFFFAOYSA-N 433.560 4.382 10 10 IICE Cc1cccc(NC(=O)CCn2c3c(c4ccccc42)CCn2c-3nc3ccccc3c2=O)n1 1860345278 ZHVLDPOESKJXCX-UHFFFAOYSA-N 449.514 4.307 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CNC(=O)/C=C/c3cccc([N+](=O)[O-])c3)cc2)c1 1860908449 GTBQPQDALKTLHR-SDNWHVSQSA-N 444.491 4.243 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)/C2=C/c2ccc(O)c(OC)c2)cc1 1865675398 FXSXIFAVGBCHEE-FYJGNVAPSA-N 432.451 4.379 10 10 IICE COC(=O)c1ccc(/C=C2/C(=O)N(c3ccc(OC)cc3)N=C2c2ccc(OC)cc2)cc1 1865675593 PVEBTCRODGBNEI-XQNSMLJCSA-N 442.471 4.325 10 10 IICE COC(=O)c1c(NC(=O)c2cc(OC)c(OC)cc2N)sc(C)c1-c1ccccc1 1866018593 GMLAGDIBUSDRDR-UHFFFAOYSA-N 426.494 4.362 10 10 IICE CN1CCCc2cc([C@H](N)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044755721 BLICWUWNRBSIIC-HSZRJFAPSA-N 438.616 4.096 10 10 IICE CNCc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)cc1Br 2186724126 ZRXYXKHLWGEASB-IBGZPJMESA-N 442.323 4.422 10 10 IICE COc1ccc(NCc2ccc(Br)cc2O)cc1I 2265720719 QLZZZIWSMUJBTO-UHFFFAOYSA-N 434.071 4.380 10 10 IICE O=C(CN1C(=O)C(=Cc2cccc(Cl)c2Cl)SC1=S)Nc1nccs1 2314827520 GVNUYLIUFQFUJE-UHFFFAOYSA-N 430.363 4.290 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccccc3)C2=O)ccc1O 2314836818 KPEQJKPFYQBLRI-CYBMUJFWSA-N 428.535 4.019 10 10 IICE O=C1C(=Cc2ccc(O)cc2)SC(=S)N1c1ccc(I)cc1 2321616852 LMDLAPKOJZWJFX-UHFFFAOYSA-N 439.299 4.403 10 10 IICE COc1ccc(N(CC(=O)N2c3ccccc3NC(=O)C2(C)C)Cc2ccccc2)cc1 14845687 YDPRNWFTRWWWQS-UHFFFAOYSA-N 429.520 4.466 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)/C(=C/c2cccc(Br)c2)SC1=S 40851534 NKNLWBFKVIEDAS-GDNBJRDFSA-N 433.352 4.304 10 10 IICE CCOc1cccc(CN2CCC[C@@H](COc3ccccc3C(=O)N3CCCC3)C2)c1O 169765159 ZAFOFPGPWWRQES-HXUWFJFHSA-N 438.568 4.318 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C\c3ccc(OCc4ccccn4)cc3)CC2)cc1 209668873 GANUYDJFYSPNGN-NVNXTCNLSA-N 443.547 4.421 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)C1 444017546 FZWYZVCPPPAHKX-FQEVSTJZSA-N 448.586 4.190 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccccc3C)[C@H]2c2ccc(O)c(O)c2)c1OC 526496124 MNSUPLPHZCHEDQ-QFIPXVFZSA-N 433.460 4.481 10 10 IICE O=C1c2ccccc2C(=O)c2c(NS(=O)(=O)c3ccc(Br)cc3)cccc21 586187139 PHHWHMHOLZUTOG-UHFFFAOYSA-N 442.290 4.025 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc(-c2ccncc2)s1 742801060 XOFVPEXOQFGIRE-HNNXBMFYSA-N 430.480 4.205 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H]1COc2c1ccc(Cl)c2Cl 743683844 MVNMLSKOMNWYTO-KRWDZBQOSA-N 438.380 4.480 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2CCC(F)(F)C2)NC(=O)OC(C)(C)C)cc1 797892402 FVRHONHYFNXXSD-YJBOKZPZSA-N 425.520 4.260 10 10 IICE O=C(c1ccccc1)c1ccc(O)c(CN2CCC[C@@H](c3ncc4n3CCCC4)C2)c1O 799942061 JJUTZXBILCBQNP-LJQANCHMSA-N 431.536 4.241 10 10 IICE COc1ncccc1CCN[C@@H](C)c1cc(Br)cc(Br)c1O 810260821 QQBPVVWSMYEMGS-JTQLQIEISA-N 430.140 4.214 10 10 IICE COC(=O)c1ccccc1CC1CCN(C(=O)NCc2ccc(N3CC=CC3)cc2)CC1 813654522 RYJUKTMWCVWTQG-UHFFFAOYSA-N 433.552 4.014 10 10 IICE Cc1nc2ccccn2c(=O)c1CCSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1 814738427 YVFVVADRRGINKB-FQEVSTJZSA-N 446.576 4.380 10 10 IICE CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1128490706 YERBIEWVBOKSHL-MWTRTKDXSA-N 425.960 4.170 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3sc4ccccc4c3Br)cc2)CC1 1133123381 JJTUQGAKLHHEOP-UHFFFAOYSA-N 444.398 4.346 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1nc2ccc(Br)cn2c1F 1136335747 LNEPALLVQBPCPM-UHFFFAOYSA-N 433.325 4.353 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cccc(-c4cccc(C)c4)c3)CC2)cc1 1136454858 NAHWYKRWRMTZIX-UHFFFAOYSA-N 429.564 4.223 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc(F)c2ccccc12 1137818008 RPCKQGHJHJTFAJ-UHFFFAOYSA-N 429.875 4.472 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cnn(-c2ccccc2F)c1C(F)(F)F 1142728072 LWWSFCMGVVVBMW-UHFFFAOYSA-N 430.361 4.214 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCc4cc(Cl)c(Cl)cc4[C@H]3C)nc12 1168448911 UPKZCVYWPOALET-LLVKDONJSA-N 435.311 4.038 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 1230982973 LRGUCIXBOZIEIC-NRFANRHFSA-N 444.938 4.026 10 10 IICE Cc1cc(CNC(=O)N[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1234335213 AXCRELDJYGYHRW-FGZHOGPDSA-N 445.485 4.428 10 10 IICE CC[C@H](C)c1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291506057 SXHDGZIRCLGQHE-INIZCTEOSA-N 437.510 4.051 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)c1 1291929733 UGNVNTUVHAAZJY-DEOSSOPVSA-N 430.552 4.105 10 10 IICE O=C(Cc1noc2ccc(Br)cc12)NCc1cc(Cl)cc(Cl)c1O 1298842332 URYKLXROAKHRKT-UHFFFAOYSA-N 430.085 4.462 10 10 IICE COC(=O)CCc1ccc(O)c(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1303571562 PDQCHODMFNEYFU-UHFFFAOYSA-N 434.492 4.279 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCc3ncc(Br)n3C2)c1C 1305281334 SPKGKWRVVOXUQD-MRXNPFEDSA-N 427.346 4.106 10 10 IICE CCc1csc(CC2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CC2)n1 1313410865 GPLZBKWNAJZZPY-QFIPXVFZSA-N 443.661 4.039 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCCC1CCOCC1 1314753631 TWUVMYDNMZPQET-UHFFFAOYSA-N 426.586 4.479 10 10 IICE CCCc1ccc(N2C[C@@H](C(=O)Nc3sc4c(c3C(=O)OC)CCCC4)CC2=O)cc1 1353964817 OIQIVKIJCCAVBG-INIZCTEOSA-N 440.565 4.358 10 10 IICE COc1ccc(CNC(=O)[C@H]2CCCCC23CCN(C(=O)OC(C)(C)C)CC3)c(O)c1 1448385221 UJJNYIPIUSZGBJ-LJQANCHMSA-N 432.561 4.225 10 10 IICE Cc1csc(C(C)(C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1456263040 HTGVJUJCKSVTKN-XNTDXEJSSA-N 449.598 4.233 10 10 IICE CCCCNC(=O)[C@H]1CC[C@H](C)N(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1514491969 GPTXHVAAISGOMI-UGKGYDQZSA-N 440.636 4.002 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1516370785 BVDQKTIRJZGWAP-XZOQPEGZSA-N 448.615 4.403 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3ccc(Cl)cc3C)cc2F)CC1 1521009744 KMWIMIBWFGFOKN-QGZVFWFLSA-N 433.955 4.013 10 10 IICE COc1ncc(/C=C\C(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)cn1 1530686289 KEVORWGJBXZTKH-CVNCVQKXSA-N 429.476 4.016 10 10 IICE Cc1cc(-c2csc(NC(=O)Cn3ncnn3)n2)c(C)n1-c1ccc(Cl)c(Cl)c1 1531947087 RJVWJLMERXCFMR-UHFFFAOYSA-N 448.339 4.150 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)[C@@H]1c1ccc(OC)cc1 1538976888 TXBLFNMIXOMPGX-WYRQLCSISA-N 437.584 4.328 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3occc3NC(=O)OC(C)(C)C)cc2F)C[C@@H](C)O1 1542113196 QWDXICFONXGHFR-HUUCEWRRSA-N 447.507 4.309 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N(Cc1cccnc1)C1CC1 1542587193 YCQFOFKGPAFEPX-XDHOZWIPSA-N 441.553 4.003 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)Cc1ccncc1 1543020248 YPCUGWNXWSEBHX-JOCHJYFZSA-N 433.552 4.374 10 10 IICE COc1ccc(N2CCCN(C(=O)C3(N(C(=O)OC(C)(C)C)C4CC4)CCC3)CC2)cc1 1544891402 BKCRDCKMDGJJCW-UHFFFAOYSA-N 443.588 4.056 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](CC(N)=O)c3ccc(Cl)cc3)c2C)c1 1565192888 IUKGAPSSKXIJJN-JOCHJYFZSA-N 438.959 4.472 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCC(=O)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1565882003 NCMDIJJMORKHIX-NRFANRHFSA-N 439.556 4.098 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCO[C@H](c3cnn(C)c3)C2)c(C)n1-c1ccc(Cl)cc1 1569688111 HCUQDGFARROOET-IRLDBZIGSA-N 426.948 4.060 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CS[C@@H](C)C(=O)Nc3cc(C)on3)c2C)c1 1596471082 ATDQTKSWFNQWNB-SFHVURJKSA-N 440.569 4.076 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CCC1CCN(CC(F)(F)F)CC1 1598420407 TULCFXZRYSLBHK-UHFFFAOYSA-N 439.526 4.408 10 10 IICE Cc1nc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)c(=O)[nH]c1C 1610124087 UZWVBXBXQQRICL-SFHVURJKSA-N 444.457 4.312 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC(c3ccccc3)(N3CCCC3)CC2)c([N+](=O)[O-])c1 1612994211 OMVZIMMHNCDVPB-BENRWUELSA-N 435.524 4.373 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1614226813 AOKLKCQKVMPLFV-KNQAVFIVSA-N 436.604 4.182 10 10 IICE CN(Cc1ccccc1O)c1nnc(CNC(=O)c2cccs2)n1CC1(C)CCCC1 1617941687 VEMUCISZTXPNAD-UHFFFAOYSA-N 439.585 4.192 10 10 IICE CCCCCc1ccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1618172867 GESPEQIQXLIUBR-NXVVXOECSA-N 435.568 4.271 10 10 IICE CCCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1cccc(F)c1 1618642607 HJMQEJOJNPTWJK-DEOSSOPVSA-N 437.563 4.063 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(Br)ncc1Br 1622319542 PCCYDHVTTGPKNC-UHFFFAOYSA-N 428.124 4.365 10 10 IICE CC(=O)Nc1cccc2c1CCCN2C(=O)/C=C/[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1625273199 FQTCZEWBHXRPOE-HHNLSAEISA-N 427.545 4.128 10 10 IICE CC(C)(C)OC(=O)N[C@@]1(C)CCCC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1625970015 OORTVBVWBPPRTR-YKSBVNFPSA-N 447.645 4.330 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)[C@H]1c1ccc(Cl)c(Cl)c1 1630273300 MPLXPKDTMMYNDI-OPAMFIHVSA-N 447.362 4.414 10 10 IICE CCN1CCN(c2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc2F)CC1 1632838308 LZXBIVJWANPNRR-UHFFFAOYSA-N 448.542 4.440 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@@]3(CCCOC3)C2)c(C)n1-c1ccc(Br)cc1 1634157256 ZXXXXYQCRSFQGX-ZHRRBRCNSA-N 447.373 4.267 10 10 IICE C[C@@H](NC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1)c1ccccc1O 1635793664 BWLVZPJENXZNGX-MRXNPFEDSA-N 431.521 4.004 10 10 IICE COCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1ccc(-n2c(C)ccc2C)cc1 1637096038 BWTRPYBHUXNGLK-QFIPXVFZSA-N 441.572 4.192 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2ccc3cccnc3c2O)[C@@H]1c1ccc(Cl)c(Cl)c1 1638573408 VVBWRMNTPIIMRY-YWZLYKJASA-N 444.318 4.083 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](Cc3ccncc3)C(=O)OC(C)(C)C)c2C)cc1 1639111899 ZCEKHXOTYNVLIY-HSZRJFAPSA-N 449.551 4.181 10 10 IICE CCCCOc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1OCC 1641200704 LFVMGIJRWBDIDM-UHFFFAOYSA-N 426.557 4.155 10 10 IICE CC(C)N(CCc1ccccc1)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1641606491 KJKYJWQXMDWPHZ-UHFFFAOYSA-N 426.516 4.354 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@@]2(CCN(C(=O)OC(C)(C)C)C2)C1 1683252973 BQICDRIZZPOULG-KBMIEXCESA-N 444.620 4.035 10 10 IICE COc1cccc2c1OCCC[C@@H]2NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1683779254 VQHQORAJROYOKE-QUCCMNQESA-N 426.513 4.005 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCCc2cc(Br)ccc2SC)c1 1685540077 IZRXLAWMOPERRQ-LBPRGKRZSA-N 439.375 4.488 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3c(ccc(Cl)c3Cl)C2)N(C)C)cc1 1687806787 KAPGQSMRQVYVLA-HXUWFJFHSA-N 435.399 4.430 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694803831 IYXNGEUSYILQRW-WIYYLYMNSA-N 429.584 4.125 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCSC[C@@H]2C)cc1 1695624273 KFXKZXJGYFQSGC-IBGZPJMESA-N 436.629 4.100 10 10 IICE CC(C)N1CCC[C@H](Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1706568567 DCARIBHBQYYPEK-FQEVSTJZSA-N 439.629 4.393 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1C[C@H](C)S[C@H](C)C1 1707305112 QJHRRCUMULFBPC-KDURUIRLSA-N 436.629 4.017 10 10 IICE CCCC(=O)NC1CCN(c2nnc(C3CCC3)n2CCCSc2nccs2)CC1 1709425355 KYQBAVGTSUXGHN-UHFFFAOYSA-N 448.662 4.070 10 10 IICE CCSc1cc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)ccn1 1710928722 PMZQYAAMENJYHS-UHFFFAOYSA-N 446.580 4.161 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCOC(C)(C)C 1712407983 NILJHBBXFZTWKB-UHFFFAOYSA-N 425.577 4.250 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCSC3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1742118233 XIALBCCDDKTJEY-LJQANCHMSA-N 425.602 4.065 10 10 IICE Cc1cccc(-c2nnc(N(C)CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)n1 1761911759 VPPZFZGSLSWRGD-UHFFFAOYSA-N 436.629 4.342 10 10 IICE C[C@@H]1COCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763208319 HYOAIZILOHEXFG-WBVHZDCISA-N 427.936 4.008 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763246302 DCXSWEBVKYKFTM-GBXCKJPGSA-N 439.648 4.358 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@@H](OCC(C)C)C2)cc1 1766612000 YTMKGJFBNNJMQW-XMMPIXPASA-N 448.615 4.486 10 10 IICE COc1cc(OC)cc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)c1 1860087731 QJLZUVGRNPYVBA-LZYBPNLTSA-N 431.564 4.436 10 10 IICE O=[N+]([O-])c1ccc(Cn2ncc(C3CCCCC3)c2I)c(O)c1 2070308901 DJJSSLMFGLRHMZ-UHFFFAOYSA-N 427.242 4.198 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(CCNCc2cc(Br)cc(F)c2O)C1 2205241130 LWFDDKJSSLFSNH-VLIAUNLRSA-N 443.357 4.421 10 10 IICE O=C(NN1C(=O)C(=Cc2cccc(F)c2)SC1=S)c1ccc(Br)cc1 2296025089 JJTHCCFVEHZALY-UHFFFAOYSA-N 437.315 4.134 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccc(Br)cc3)C2=O)c(C)n1C1CC1 2297560273 JXBVCJCQLHWCLT-UHFFFAOYSA-N 444.354 4.034 10 10 IICE Cc1ccc(CN2CCC[C@@H](NC(=O)OCc3ccccc3)C2)c(O)c1Br 2307565015 HKKSCCNEDMZVRU-GOSISDBHSA-N 433.346 4.354 10 10 IICE CCC1=NN(Cc2ccccc2F)C(=O)C1=Cc1cc(Br)c(O)c(OC)c1 2332107481 IISNDONFVGTSKQ-UHFFFAOYSA-N 433.277 4.494 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@@H](Cc1ccccc1Br)NC(=O)OC(C)(C)C 2362990057 PQSHAGLQDSQQPR-OAHLLOKOSA-N 440.342 4.044 10 10 IICE CCC(CC)(CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2380745483 JFYWKKLVDGMRRY-UHFFFAOYSA-N 443.382 4.410 10 10 IICE Cc1ccc(CNC(=O)[C@@H](C)CN(C(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380749421 OQVPHTXFMCWMSN-ZDUSSCGKSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380759033 KXVMNGCQPJKEJU-HNNXBMFYSA-N 443.382 4.361 10 10 IICE O=C(O)CCOc1cccc(/C=C2/SC(Nc3ccccc3Br)=NC2=O)c1 16908351 PYVFFVOQLGZUIL-LFIBNONCSA-N 447.310 4.385 10 10 IICE CCC1=NN2C(=N)/C(=C\c3ccc(OC(=O)c4cccs4)c(OC)c3)C(=O)N=C2S1 34760337 AEXNOXCRJFNNPU-ADAOELNFSA-N 440.506 4.005 10 10 IICE CCCCOc1ccc(Nc2ncnc(N3CCN(c4ccc(OC)cc4)CC3)c2N)cc1 40727683 HTOPJYNEHWQZSV-UHFFFAOYSA-N 448.571 4.317 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)/C=C/c2c(Cl)nc3sccn23)cc1 98080337 FXFYNGRDTIIPNM-BQYQJAHWSA-N 426.933 4.012 10 10 IICE Cc1cc(C(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)c(C)n1-c1ccccc1F 106281531 XMOXEAYDWNIART-KRWDZBQOSA-N 425.548 4.344 10 10 IICE C[C@@H](C1CC1)n1[nH]ccc1=NC(=O)CSc1ncc(-c2ccccc2)n1CC(F)(F)F 748034662 UJZAEDQXSJEWQQ-AWEZNQCLSA-N 449.502 4.433 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@H]3CCc3ccccc3)cc2)C1 760821440 QPSOUNBAXPKKFX-NOZRDPDXSA-N 448.611 4.085 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)c(O)c1 794378565 YPZZFRWGABERLI-DQLDELGASA-N 442.943 4.144 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](C)(CNC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 798948410 JXIWBRCXJADOHR-QHCPKHFHSA-N 439.547 4.494 10 10 IICE CO[C@@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)n1 799995568 OODLGMUAUVGJST-GJZGRUSLSA-N 435.956 4.008 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)C[C@H]1c1ccccc1 800538732 AHBJVSOYDYTQFK-BJKOFHAPSA-N 437.584 4.016 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C2C[C@@H]3CCC[C@H](C2)C3NC(=O)OC(C)(C)C)c1 802781936 JGUOACUBZKJTSG-IOYSXMCPSA-N 432.561 4.298 10 10 IICE CCN1CCN(c2ccccc2NC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 916671016 BAINDKVJTXOFCL-UHFFFAOYSA-N 434.540 4.361 10 10 IICE CN(C)c1ccccc1N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1127296194 FGLLCTQYWYHMKK-RGEXLXHISA-N 443.569 4.146 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3nc4ccccc4cc3Br)C2)cc1 1131029978 JCEPXUNVZLZEEP-HNNXBMFYSA-N 426.314 4.015 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCC(C)(C)C[C@H]1c1ccccc1 1153663510 MVEHGLSIQYATRT-ACRUOGEOSA-N 439.552 4.298 10 10 IICE CCOC(=O)CN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CCC1 1153833667 YCHBTIYZPXOPCU-UHFFFAOYSA-N 433.346 4.414 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N[C@@H](C)c2ccccc2O)sc2c1CC[C@H](C)C2 1175419249 UJTKOMOQWSCXNV-KKUMJFAQSA-N 430.570 4.433 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccccc1 1235454516 FMMYGPXQJKZBTR-XMMPIXPASA-N 444.579 4.127 10 10 IICE COC(=O)c1cc(Br)cc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 1264413950 JPQOWNHGVIUIIZ-UHFFFAOYSA-N 431.330 4.107 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(C)cc2OCCN(C)C)CCCC1 1293912883 WDFFRYBHRLVZAF-UHFFFAOYSA-N 435.568 4.416 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(O)c(O)c2)[C@@H](c2ccccc2Cl)C1 1296954993 KQCCQDDYPDGTEX-GOSISDBHSA-N 446.931 4.114 10 10 IICE CC(C)[C@@H]1CN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CCS1 1302772265 AEKUBPOUTRVGCQ-INIZCTEOSA-N 434.660 4.490 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC(C)(C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1305551777 HRQPMUDJPJIUOD-MOPGFXCFSA-N 443.661 4.397 10 10 IICE CCc1noc(C)c1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCOC 1306233062 PGHIOUOIPKKWNK-UHFFFAOYSA-N 448.571 4.342 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@H](C)c3ccc(C(F)(F)F)cc3)CC2)cc1F 1312513800 CLQPCESZZSCEMF-HNNXBMFYSA-N 439.453 4.488 10 10 IICE CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 1351110880 KVTBEIGISSXLMK-NHCUHLMSSA-N 449.595 4.301 10 10 IICE Cc1ccc(-c2ccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2)nn1 1352891971 MNDVFUWQBPGJHV-UHFFFAOYSA-N 438.478 4.452 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1 1353424101 AGYYMFWIQIKIGV-UHFFFAOYSA-N 425.464 4.036 10 10 IICE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1353910601 LCEUFRWULCEAMD-CPJSRVTESA-N 433.596 4.245 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1csc(N2CCCCC2)n1 1435335035 XQIZXCCLDJYGEL-HNNXBMFYSA-N 436.528 4.134 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@H](c1cccc(Br)c1)N1CCCC1 1451956957 QNOQMMAYZAKJDW-FQEVSTJZSA-N 440.341 4.156 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N(Cc3ccccc3)C3CCCCC3)cc2)CC1 1471368608 BCPCHYGHOIULTM-UHFFFAOYSA-N 448.611 4.433 10 10 IICE Cc1cc(C)c2[nH]cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)c(=O)c2c1 1472483552 FEVVODNCZYORFS-OAQYLSRUSA-N 433.552 4.032 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCc3c[nH]c4cc(F)c(Cl)cc34)CC2)cc1 1479067306 LBCAIJIYCPGLFI-UHFFFAOYSA-N 444.938 4.433 10 10 IICE Cc1cccc(-c2nnc(N(C)CC3CCOCC3)n2CCCSc2nccs2)n1 1492502265 PWMUGOGDAZMKKG-UHFFFAOYSA-N 444.630 4.150 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC3)n2CCCNC(=O)C(C)C)c(C)n1-c1ccccc1 1510605038 JVTVMRUDFBXZNY-UHFFFAOYSA-N 448.615 4.361 10 10 IICE Cc1ncc(CN(C)c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)s1 1511593492 LXJKQOSMMJPBAX-OAHLLOKOSA-N 436.632 4.170 10 10 IICE C[C@@H]1CCN(c2nnc(-c3cc(Br)c[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1 1512289585 TYYRANBUBUMTIP-CYBMUJFWSA-N 447.356 4.135 10 10 IICE CN(C)CC(C)(C)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1517007501 CGMRAZDIBBGOFQ-UHFFFAOYSA-N 435.620 4.098 10 10 IICE CS(C)(=O)=Nc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1531505279 YLZMFKBWXZRIDY-QGZVFWFLSA-N 437.512 4.046 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CSCc3ccc(Br)cc3)C2)cc1 1538747967 WBOGHPWCAWSIEP-QGZVFWFLSA-N 435.387 4.086 10 10 IICE CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1539911727 CGCLAOHXCIVOPT-SVMVAKDDSA-N 449.039 4.413 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(c3ccc(SC)cc3)C2)cc1 1540459542 LZKUJXJZDKQREE-IBGZPJMESA-N 425.598 4.266 10 10 IICE Cc1cc(CCNC(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)c(C)n1-c1ccccc1 1543592975 CNVWHZQQEMBFDB-UHFFFAOYSA-N 429.480 4.161 10 10 IICE Cc1cc(CC(=O)N[C@@H](CO)c2ccc(Br)c(F)c2)c(C)n1-c1ccccc1 1556799588 OSTDVKPACJUDDJ-NRFANRHFSA-N 445.332 4.388 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)[C@H](C)c3cccc(S(N)(=O)=O)c3)c2C)c1 1565574693 OMYKBOOTJLUBIA-GOSISDBHSA-N 439.581 4.192 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(OCCN(C)C)c(F)c2)CCCC1 1570231378 WETNMHZDTLSYBL-UHFFFAOYSA-N 439.531 4.247 10 10 IICE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1587885779 DIWQYDFWVCXCSX-DEOSSOPVSA-N 431.536 4.024 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1cccc(NC(=O)c2ccc(Br)cc2)c1 1598424294 ARALTZATFNBODJ-UHFFFAOYSA-N 441.281 4.294 10 10 IICE COCC[C@@H](Cc1cccc(Br)c1)C(=O)NCc1ccc2cccnc2c1O 1627072647 CTAZJRIVZDDICS-KRWDZBQOSA-N 443.341 4.215 10 10 IICE CCOC(=O)C1(C(F)(F)F)CCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1627201448 INEWQWNCOMNCOU-UHFFFAOYSA-N 436.474 4.371 10 10 IICE O=C(/C=C\C1CCOCC1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1627272038 QIMMDRMABZIHHR-DAXSKMNVSA-N 427.302 4.080 10 10 IICE COc1ccc(CN(CCO)C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c(OC)c1 1631965693 MCWVMOLUUFDJIZ-UHFFFAOYSA-N 436.552 4.363 10 10 IICE Cc1cc(C(=O)NCCc2cccc([N+](=O)[O-])c2)c(C)n1-c1ccc(Br)cn1 1632144526 UJMNJEYGBZTXOZ-UHFFFAOYSA-N 443.301 4.132 10 10 IICE COC[C@@H]1CC[C@@H]([C@H]2COCCN2C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)O1 1635549808 RLMFKILLZCGFPU-CAOCKLPOSA-N 440.584 4.253 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H](N(C)C)CC2)sc(C)c1-c1ccccc1 1645278024 FMPZFJXDSCSHSB-IBGZPJMESA-N 443.613 4.255 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CCC2)[C@@H]2CCOC2)c(C)n1-c1ccc(Br)cn1 1648998449 GTQVTDBNGVLCJH-UZLBHIALSA-N 432.362 4.187 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)cc1 1685737373 KXLJBQCFGZKULL-IBGZPJMESA-N 441.478 4.339 10 10 IICE C[C@@H]1CCCN1c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1693693430 SSRMFLWJMCHKCV-HGHGUNKESA-N 429.584 4.439 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)[C@@H](C)S(C)(=O)=O 1695341446 GGZNEYZQGNVQRK-PKOBYXMFSA-N 443.617 4.020 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCO[C@H]1C)C(C)C 1695536054 PNEOGIVYRNLPKB-NBGIEHNGSA-N 437.588 4.127 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@H](C)N(CC)C[C@H]2C)cc1 1710026139 YVEMDGRQSZPIIO-LEWJYISDSA-N 447.631 4.154 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)C[C@@H]2CC=CCC2)cc1 1728379040 FPQLGGKUVRKPOX-HXUWFJFHSA-N 433.604 4.366 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cscn1 1729152418 QLSLEZLBPGCWIA-UHFFFAOYSA-N 436.585 4.482 10 10 IICE COC1(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)CCCCC1 1729951251 AORGNNGWTNZGKO-UHFFFAOYSA-N 441.601 4.325 10 10 IICE Cc1cc(-c2nnc(Nc3ccn(C)n3)n2CCN(C)C(C)C)c(C)n1-c1ccccc1 1761677219 KZMFGARCXMZXFU-UHFFFAOYSA-N 432.576 4.170 10 10 IICE CC[C@H](C)c1nnc(N2CCC(COC)CC2)n1Cc1ccc(N2CCSCC2)cc1 1763620347 CAXJDSFJCPVZLG-IBGZPJMESA-N 443.661 4.256 10 10 IICE COC(=O)C1CCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)CC1 1767914052 ABNWEBTVKZFELD-UHFFFAOYSA-N 449.646 4.039 10 10 IICE Cc1nc2scc(C)n2c1/C=C1/SC(=S)N(Cc2cccc(C(=O)O)c2)C1=O 1860824978 GLMRCHJUCNQWLQ-VIZOYTHASA-N 429.548 4.112 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(F)(F)F)c(CO)c1I 2079048169 RKCVNZMHEBVUFF-NSHDSACASA-N 440.203 4.012 10 10 IICE CCN[C@@H](c1ccccc1O)c1cc(Br)ccc1I 2090035542 SGWHGCBDUIMCMR-HNNXBMFYSA-N 432.099 4.458 10 10 IICE Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCCC3)cc2F)C1=O 2294092637 BDYJMCAZZVILHX-UHFFFAOYSA-N 441.890 4.444 10 10 IICE Cc1ccc(CNC[C@H]2C[C@@](F)(CNC(=O)OC(C)(C)C)C2)c(O)c1Br 2352676749 SHLNAJBJHCXVNR-HJGJAMNPSA-N 431.346 4.196 10 10 IICE CCN(CCCC(=O)NCc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2352949285 BNUCZGMEKPJLNR-UHFFFAOYSA-N 429.355 4.117 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2C[C@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380756402 KVXGVNREBFIGCR-KBPBESRZSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](CNC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2381135864 XFMWAEZOQKUOOK-OAHLLOKOSA-N 443.382 4.218 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3nc4cc(Cl)ccc4s3)CC2)cc1 36823278 PQRUVJZGJWKWEH-UHFFFAOYSA-N 433.986 4.399 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(-c4cc5ccccc5n4C)n3)CC2)cc1 38910081 LBPFLPCIWSQEIL-UHFFFAOYSA-N 432.549 4.273 10 10 IICE CC[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)ccc1O 390698150 SEPVNHNTRYGWOQ-TZIWHRDSSA-N 433.390 4.487 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)cc1OC 526401503 WKALVWOMQHDSNV-QHCPKHFHSA-N 433.460 4.481 10 10 IICE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NCc1ccc2c(c1)CCCN2C 742597159 OSPJTJPWEJCPOC-UHFFFAOYSA-N 431.565 4.167 10 10 IICE CO[C@H](C)c1nc(C)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 749402918 RRFWSXQVPPWNHF-ZIAGYGMSSA-N 425.501 4.159 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)OCc1nc3cc(F)ccc3o1)c2[N+](=O)[O-] 757023339 KNPPEBFDYGAUNP-UHFFFAOYSA-N 446.346 4.008 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@H]1CCCc2cn(C3CCCC3)nc21 765539037 XBURNBVWWJKBFX-KRWDZBQOSA-N 433.350 4.343 10 10 IICE CC(C)N1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1ccc(F)c(F)c1 778673857 GUESULVOCFQJFA-ZEQRLZLVSA-N 440.538 4.364 10 10 IICE C[C@](CO)(NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 796472306 WVNVOWZMZKLPJU-OAQYLSRUSA-N 448.361 4.345 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1 801628296 DHWNUWUOEGKYJI-FQEVSTJZSA-N 446.569 4.179 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(-c2cccnc2)n1C[C@@H]1CCCO1 802694410 HOKWLWSLIOJRBW-QHCPKHFHSA-N 432.572 4.146 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC([C@H]3C(=O)Nc4ccccc43)CC2)c1O 1115955735 LJGGRAJQSBZNSU-HSZRJFAPSA-N 430.504 4.280 10 10 IICE C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126658583 TVLNYZOPZIBNCN-APWZRJJASA-N 430.495 4.329 10 10 IICE COc1cc(CN2CC[C@@H](NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)cc(OC)c1 1149777587 YCHNTEHFRAEYNP-JOCHJYFZSA-N 447.579 4.424 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOc1ccc(Cl)c(Cl)c1 1152401010 ILUARRMLJYHAKK-UHFFFAOYSA-N 446.714 4.323 10 10 IICE O=C(NCc1cccc(O)c1O)c1ccccc1OCc1cccc(Br)c1 1153792602 UWOVHDSBABQRKH-UHFFFAOYSA-N 428.282 4.369 10 10 IICE Cc1cc(C(=O)N2CC(OC(=O)Nc3cccc(F)c3)C2)c(C)n1-c1ccc(F)cc1 1154423067 DEXSCBHWGZAWOJ-UHFFFAOYSA-N 425.435 4.445 10 10 IICE Cc1ccc(NCCNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)nc1 1178603916 ZTPMHTKGZXVRNR-UHFFFAOYSA-N 427.346 4.402 10 10 IICE Cc1ccccc1N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)C 1191997937 MVYDIHYUDFGIHN-BGYRXZFFSA-N 427.564 4.279 10 10 IICE CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@H]1CCN(c3ccc(OC)cc3)C1)CCC2 1252114483 CLOANBYASMHARK-UZLBHIALSA-N 428.602 4.259 10 10 IICE CCN(CC)CCNC(=O)c1ccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1264359971 DMQLQCFCADQFDB-UHFFFAOYSA-N 432.568 4.418 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCC1CCC(F)(F)CC1)c2[N+](=O)[O-] 1289667440 QWERIIGIJDELFG-UHFFFAOYSA-N 442.418 4.316 10 10 IICE Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)NCc2cc(Cl)ccc2O)ccc1F 1300401243 RTPLRKHIHLVGCB-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1313681648 UXBLVXSCKRRORH-FGZHOGPDSA-N 441.620 4.275 10 10 IICE COc1ccc(-c2nnc(N3CC[C@H](C)C3)n2CCCSc2nccs2)c(OC)c1 1315403904 UFFVRBSGVJCAOR-HNNXBMFYSA-N 445.614 4.447 10 10 IICE CCOC(=O)c1c(NC(=O)CCCN(C)C(=O)OC)sc(C)c1-c1ccc(F)cc1 1351733794 ZIXIFKNGESBUAD-UHFFFAOYSA-N 436.505 4.456 10 10 IICE C[C@H]1[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 1352925813 HDWJTRABWBNAFE-MAUKXSAKSA-N 443.510 4.289 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cnc(F)c(Br)c1 1354113644 KAMYQOIFEWNFGV-UHFFFAOYSA-N 425.213 4.011 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Oc1ccccc1 1435184229 JOWINGGAMKGVCH-DQPIFXJKSA-N 444.553 4.001 10 10 IICE O=C(Cc1ccc(Cl)cc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1435571296 CWYKJYTXAFFXMD-UHFFFAOYSA-N 432.395 4.384 10 10 IICE Cc1cc(CC(=O)NCc2ncc(Br)cn2)c(C)n1-c1ccc(Cl)cc1 1439899167 LUIZJUXCFIKDKY-UHFFFAOYSA-N 433.737 4.159 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)c4nccn4c3)cc2)CC1 1464983634 NFOOKALCVICEEW-UHFFFAOYSA-N 427.346 4.263 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC[C@H](C)N(C)C(=O)OC(C)(C)C)c1 1465025435 YOSJIBSRQUBXTH-INIZCTEOSA-N 427.545 4.282 10 10 IICE CCc1ccccc1CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324445 DZBAINJEKLXGIE-JOCHJYFZSA-N 425.573 4.240 10 10 IICE O=C(c1nc(Br)c2ccccn12)N(Cc1ccco1)Cc1ccccc1O 1465840680 HBBHPQMERUYDLN-UHFFFAOYSA-N 426.270 4.238 10 10 IICE CC1(C)CN(C(=O)OCc2ccccc2)[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1469301697 BYCZSENNUFCWRM-QHCPKHFHSA-N 435.568 4.340 10 10 IICE CCN(CC(F)(F)F)C(=O)CN(Cc1ccc(C)s1)c1ccc2c(c1)OCCO2 1473236831 HDACQUDIFXMRTA-UHFFFAOYSA-N 428.476 4.245 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1497418659 IHFRAJMKNGYCAG-NRFANRHFSA-N 437.588 4.129 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnccn2)nnc1N1CC=C(C(C)(C)C)CC1 1510670986 BGPGUWJPEUFUMX-UHFFFAOYSA-N 431.588 4.340 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)CCS1 1514160048 AHBJHBFUWVPHHL-JKSUJKDBSA-N 439.676 4.143 10 10 IICE CCOC(=O)C[C@@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)c1ccc(F)cc1 1526962287 FQASNPPTHRVPIO-JOCHJYFZSA-N 440.515 4.468 10 10 IICE C[C@H](Cc1cccc(F)c1)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1528421592 WNXHAAICCDOPSE-CQSZACIVSA-N 446.434 4.213 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C1CCC(F)CC1 1533764862 VKHILAYGQFFYIZ-UMWQKIITSA-N 438.565 4.450 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 1536549294 CXJHLGUJDBZEJD-IGCHPXFFSA-N 445.966 4.120 10 10 IICE CC(=O)Nc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1538689706 ZZKYDERACUZJRB-UHFFFAOYSA-N 427.302 4.462 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C3(c4cc(F)cc(Br)c4)CC3)C2)cc1 1538747036 NUIDLMTXNZUYCL-QGZVFWFLSA-N 433.321 4.024 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCN(C(=O)c4ccccc4)C3)cc2Cl)C1 1539911871 DCVYQPPDRAWRJA-NQIIRXRSSA-N 439.987 4.355 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@]2(C)CC2(Br)Br)cc1F 1543251431 OEAGBMZNENIBTG-OAHLLOKOSA-N 436.163 4.184 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1coc(-c2ccccc2Cl)n1 1546151860 JVDPLVONLNMTMS-UHFFFAOYSA-N 435.263 4.169 10 10 IICE CCN(CC)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N2CCSCC2)cc1 1547454550 OYEWIPJCDVKOKW-UHFFFAOYSA-N 443.020 4.441 10 10 IICE CCOc1nc(NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)ncc1Cl 1559184047 SLHYPBBNZSISCW-KRWDZBQOSA-N 435.956 4.273 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCSC[C@@H]1c1ccccc1 1565127359 OEILXYDFTQHTEO-HSZRJFAPSA-N 425.598 4.038 10 10 IICE Cc1cccc2c1C[C@H](C(=O)NCc1ccc3c(c1)CCCN3C)N2C(=O)OC(C)(C)C 1583628583 ZGQWSFAQECTCOB-HSZRJFAPSA-N 435.568 4.360 10 10 IICE CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1584007621 FYHSZLHQHZMZCN-GCJKJVERSA-N 437.584 4.372 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3Cl)CC2)c(OC)c1 1595989930 MJSJXFNMZSRKLO-ROUUACIJSA-N 435.351 4.463 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)cn1 1615380552 CKGPXJZJCZBVKX-UHFFFAOYSA-N 436.604 4.498 10 10 IICE C[C@H](OCc1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1618253671 PTYLCTYAKCCSTL-PGRDOPGGSA-N 441.572 4.040 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc3cccnc3c2)NC(=O)OC(C)(C)C)cc1 1618254064 WHBUOAGWFYHJSS-JOCHJYFZSA-N 434.540 4.297 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2cccn2C)n1Cc1ccc(N(C)C)c(F)c1 1620262304 FJENZXHMSOICMK-MRXNPFEDSA-N 430.597 4.115 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@H]1CC(Br)=NN1c1ccc(C)cc1 1622319786 ZNPKLIXDQNQQRT-GOSISDBHSA-N 430.346 4.427 10 10 IICE CN1CCN(Cc2ccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)s2)CC1 1627005817 GPAPHPWIFDJDLZ-UHFFFAOYSA-N 440.657 4.194 10 10 IICE COc1ccc([C@@H](NC(=O)Cc2ccc(O)c(O)c2)c2ccccc2Cl)c(OC)c1 1628928975 YARCSQDWNHAMTB-QHCPKHFHSA-N 427.884 4.217 10 10 IICE COc1ccccc1Nc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1630287644 ITNUECNARYWOPX-UHFFFAOYSA-N 431.536 4.330 10 10 IICE COc1cc(CN2CC[C@@H](NC(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)cc(OC)c1 1631099587 GXLNDSLMFZNUQW-JOCHJYFZSA-N 433.552 4.116 10 10 IICE CCc1ccc2c(c1)[C@H](CCNC(=O)c1cccc(-n3c(C)cc(C=O)c3C)c1)C(=O)N2 1633793058 AZZVCICYEBFIAF-QFIPXVFZSA-N 429.520 4.325 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)C2CC2)cc1 1634218900 LJCWGJXUWNERDV-RSXGOPAZSA-N 439.575 4.340 10 10 IICE Cc1cc(CCNC(=O)CC(F)(F)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1634866868 OWGQDLCIVJODQP-UHFFFAOYSA-N 435.515 4.303 10 10 IICE COc1cc(CN2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)cc(OC)c1 1635326612 FJQOQJFMUJKXGG-UHFFFAOYSA-N 447.579 4.378 10 10 IICE COc1cccc(CNC(=O)c2ccc([C@H]3CCCCN3C(=O)OC(C)(C)C)n2C)c1O 1636061362 NXDHKSCNNBLIPX-GOSISDBHSA-N 443.544 4.131 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1 1636262483 HKQQSNWORCCEOL-MAUKXSAKSA-N 435.494 4.348 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(N(C)C(=O)OC(C)(C)C)s2)N(C)C)cc1 1637004956 XBYAKRXROHHOAV-GOSISDBHSA-N 446.617 4.218 10 10 IICE COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCN(c2ccc(OC)cc2OC)CC1 1648084436 TZPSJFLSOLHKBW-FQEVSTJZSA-N 439.339 4.047 10 10 IICE C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)NC(=O)N(Cc1ccco1)Cc1ccccc1O 1672776729 JHPUVMRBNPGXPA-ZWKOTPCHSA-N 433.508 4.063 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCC3(c4ccc(F)cc4F)CCCC3)cc2)CC1 1680310349 XZYJFLVHYXMEEG-UHFFFAOYSA-N 442.554 4.028 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](C[C@@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1692175139 GLLTUQQXNOMDND-FPOVZHCZSA-N 443.611 4.373 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCSCC2)cc1 1694185759 ZLJWYPQSMCAVRU-IBGZPJMESA-N 438.645 4.367 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(O)CCC1 1696411083 OCFGTUSCCLHCDJ-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCn1cc(Cl)cn1 1706279815 WBQUTNZQEGOKCJ-UHFFFAOYSA-N 427.984 4.188 10 10 IICE CN(OC1CCCC1)c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1711242355 VSBHPVBUEDMNHM-UHFFFAOYSA-N 430.603 4.213 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)OC(C)(C)C1 1748379969 HSIMJFJUISXDJF-RBUKOAKNSA-N 437.588 4.391 10 10 IICE CCOCc1nnc(N2CCC=C(Br)C2)n1Cc1ccc(N(CC)CC)cc1 1766342869 PDSPMMUATKWQST-UHFFFAOYSA-N 448.409 4.198 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)cn2C)n1CCC1CC1 1767112223 URRHQIGXRZXDGM-UHFFFAOYSA-N 430.350 4.188 10 10 IICE CO[C@H](Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1768095793 XRRYTNNBDYKUBZ-HSZRJFAPSA-N 434.588 4.248 10 10 IICE COC[C@H](C)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1770739213 PWTBDZVPWOBZOT-DENIHFKCSA-N 427.593 4.039 10 10 IICE O=C(CNCc1cc(Cl)cc(Br)c1O)Nc1ccc(N2CCCC2)cc1 1860720949 CWZINOHFUARSLB-UHFFFAOYSA-N 438.753 4.137 10 10 IICE Cc1cc2c(NCCC(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)ncnc2s1 1865782215 FORMSAYYGWXWFA-UHFFFAOYSA-N 442.500 4.216 10 10 IICE COC(=O)c1c(NC(=O)CCc2cnc(OC)nc2)sc(C)c1-c1ccc(C)cc1 1866151182 LRFARJWDWAMDDF-UHFFFAOYSA-N 425.510 4.188 10 10 IICE CCN1CCc2cc([C@@H](N)[C@@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044751772 FEDWSEHPXJLNJL-ISKFKSNPSA-N 438.616 4.094 10 10 IICE CC1(c2nn(Cc3cc(F)ccc3O)c(I)c2C(F)(F)F)CC1 2079715064 WXTKWHZZVZBQNG-UHFFFAOYSA-N 440.178 4.451 10 10 IICE CN(Cc1ccc(I)cc1)c1cc(Br)c(CN)cc1F 2280325127 MCBPEDIOFUYJRE-UHFFFAOYSA-N 449.105 4.288 10 10 IICE CCCSc1nnc(-c2ccccc2NC=C2C(=O)N(c3ccccc3)N=C2C)c(O)n1 2297313305 YMBOGHSYUNKTCU-UHFFFAOYSA-N 446.536 4.465 10 10 IICE Cc1cc(C=C2NC(=O)N(Cc3ccccc3F)C2=O)c(C)n1-c1ccc2c(c1)OCO2 2297316441 WMMNNKNNLIODNG-UHFFFAOYSA-N 433.439 4.055 10 10 IICE CC1=CC2=NC(=O)C(=Cc3cn(CCOc4ccccc4C)c4ccccc34)C(=N)N2O1 2297347403 CHXAUDRYORUSKR-UHFFFAOYSA-N 426.476 4.479 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2ccccc2C)c1C 1101767 INQNZARQXDIEEM-PIUNUONSSA-N 434.536 4.254 10 10 IICE COc1cc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)ccc1OC(C)C 40940514 HXIIBTLMQUTBRT-UNOMPAQXSA-N 442.562 4.337 10 10 IICE COc1ccc(CNc2ccc(I)c(Br)c2)c(O)c1 311538021 IJWAMKCZMWATPT-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1 471298579 QUWRIFXXLJKOFO-QHCPKHFHSA-N 444.623 4.046 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)NC1CC(c2ccccc2)C1 728303618 BFLYIMVGSZFDOF-UHFFFAOYSA-N 433.474 4.287 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1csc(-c2ccccc2)n1 734660460 QDOAYQZFADGJCZ-UHFFFAOYSA-N 436.581 4.018 10 10 IICE Cc1cnccc1N1CCC(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CC1 752309030 FJKXLDARWBLCPY-UHFFFAOYSA-N 434.506 4.264 10 10 IICE Cc1ccc(-c2ncco2)cc1NC(=O)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 758959402 JBYRZNIVUULDSS-UHFFFAOYSA-N 442.519 4.355 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1 769279878 FXONQHGUALTPTH-WMQCIHAUSA-N 426.944 4.478 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)c1C 804137417 ARKMQGMYRANJBS-UHFFFAOYSA-N 434.540 4.253 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cccc(NC(=O)c2ccoc2)c1 806245458 YOQPBBLQFJZVIW-UHFFFAOYSA-N 430.258 4.322 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(C)c(N2C(=O)/C(=C/c3ccccc3)SC2=S)c1 814289038 HYXCWWUHDSYWND-UYRXBGFRSA-N 446.619 4.431 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C3=NN(Cc4ccccc4)C(=O)CC3)c2C)c1 1132043865 NTIQJCJYUUGKFM-UHFFFAOYSA-N 428.536 4.197 10 10 IICE COc1ccc(-c2nc(C)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)s2)cc1 1134681572 APDXYWHXEOXWCL-OAQYLSRUSA-N 438.597 4.226 10 10 IICE Cc1ccc(NC2CC2)c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1136285209 UWKJWLGTPYMWME-UHFFFAOYSA-N 433.474 4.355 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1sc2cccc(F)c2c1Cl 1138054755 GZJPINMHKCORGB-LBPRGKRZSA-N 437.876 4.009 10 10 IICE C[C@@H](NC(=O)c1cc(Br)cc(Br)c1N)c1ccc(N(C)C)cc1 1138363616 PBGRNNBQNXOOJN-SNVBAGLBSA-N 441.167 4.351 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)c(O)c3)cc2F)C[C@@H](C)O1 1141901351 GFCHRAYBIILTCX-BETUJISGSA-N 426.410 4.094 10 10 IICE Cc1cc(C(=O)N2CCC(Cn3cnnc3)CC2)c(C)n1-c1cccc(Br)c1 1145093840 FTFMIWANOJOKCV-UHFFFAOYSA-N 442.361 4.001 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCN(Cc4ccccc4)C3=O)cc2Cl)C1 1155727403 RBDUPZGMQZCUJR-NQIIRXRSSA-N 439.987 4.241 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(Nc3ccn(C)n3)cc2)cc1 1292382789 VUYRMCRCOMAWJL-HSZRJFAPSA-N 433.556 4.051 10 10 IICE O=C(Cc1csc(-c2ccccc2Cl)n1)NCc1ccc(N2CCC(O)CC2)cc1 1301348958 CICLPUUXZNIWCU-UHFFFAOYSA-N 441.984 4.284 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCn3c(cc4ccc(Cl)cc43)C2)N(C)C)cc1 1313419059 RWXKWEREKMJHHY-HSZRJFAPSA-N 439.991 4.189 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1CCOC1CCCCCC1 1314752632 CHWZHAGEHFMZHQ-FQEVSTJZSA-N 428.577 4.254 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3nc(C)sc3-c3ccccc3)cc2F)CC1 1352969474 KPDMYFALBFYYOI-UHFFFAOYSA-N 438.572 4.330 10 10 IICE CCOC(=O)c1c(NC(=O)c2nc3ncc(C)cn3n2)sc(C)c1-c1ccc(F)cc1 1356321809 OANRQHVJBQNHGA-UHFFFAOYSA-N 439.472 4.038 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CCC(NC(=O)OC(C)(C)C)CC1 1444407569 YMNUIITZWRWIJY-UHFFFAOYSA-N 439.556 4.472 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cn2cc(CNC(=O)OC(C)(C)C)ccc2n1 1445649906 ABDJMPREQREYLF-UHFFFAOYSA-N 438.528 4.117 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCc2cccc(O)c21 1447111113 NLWZTVYARVYNNR-AQTBWJFISA-N 442.537 4.102 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1 1449114947 APKYTQCXUKCGRY-IBGZPJMESA-N 447.531 4.118 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@@H](C)[S@@]1=O 1449309686 NXVMYUCJYKXLAE-UZPXWBGZSA-N 437.403 4.228 10 10 IICE COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 1459178915 RBPCCGHTAKTGCP-VGSWGCGISA-N 441.572 4.074 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cccc(F)c4)CCCCC3)CC2)c(OC)c1 1461979849 HJDYPOBCJSVJFJ-UHFFFAOYSA-N 426.532 4.394 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H](Cc1cccc(OC)c1)NC(=O)OC(C)(C)C 1465845786 HRWUXBNHDVOUIU-OAQYLSRUSA-N 442.556 4.275 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3Cc4ccc(C)c(Br)c4C3)C2)cc1 1478957703 RFLLYYZYLRTNOW-INIZCTEOSA-N 430.346 4.070 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@H]32)sc2c1CCCC2 1522411123 PVIWKUGSIPOFPW-NUEKZKHPSA-N 432.586 4.216 10 10 IICE C[C@]1(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC1(Cl)Cl 1525997216 HSRGGIYSNYLQPU-KMGMULKOSA-N 447.384 4.117 10 10 IICE COc1ccc([C@@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCCC2)cc1 1538454416 OXNCITHGQXWRJH-AREMUKBSSA-N 445.563 4.482 10 10 IICE O=C(NCc1ccc(OCCOc2ccccc2)nc1)c1cc2cc(O)c(O)cc2s1 1542107924 MVFGMOKLMLPSRM-UHFFFAOYSA-N 436.489 4.095 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)cc1 1542923987 NYMVATHUSONTSV-VWLOTQADSA-N 431.536 4.052 10 10 IICE CCOCC(C)(C)Cn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1548064630 DRTVFUPVVLYRTG-UHFFFAOYSA-N 447.599 4.014 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3ccc(C(=O)OC(C)C)cc3=O)c2C)cc1 1559389276 VASGZYSFVUQWME-UHFFFAOYSA-N 436.508 4.103 10 10 IICE CC[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccc1F 1616427649 IXCGSWNDAQFAAF-IBGZPJMESA-N 432.407 4.390 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 1626885533 BRYZVPMAKMVBFZ-LJQANCHMSA-N 447.501 4.169 10 10 IICE Cc1nnc(COc2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc2)o1 1632899470 UHDKLXAZIYGJMR-UHFFFAOYSA-N 430.464 4.429 10 10 IICE Cc1cc(C(=O)N(C)Cc2cnc(C(C)C)nc2)c(C)n1-c1ccc(Br)cn1 1633656370 KJWZDAISYWNIHT-UHFFFAOYSA-N 442.361 4.437 10 10 IICE CNC(=O)CC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1636028002 SMFYDJQSQCDTIX-KRWDZBQOSA-N 446.389 4.378 10 10 IICE Cc1cc(C(=O)NCCCN2CCCO[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1638478537 RDDLLAADHUSUFI-QGZVFWFLSA-N 448.405 4.087 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)c2nc(-c3ccc(Cl)cc3)no2)cc1 1638659744 MTDLPABQQRVXJU-OAHLLOKOSA-N 443.935 4.237 10 10 IICE COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1639535232 YNTSIUVMVTUHFF-BCOMRZATSA-N 434.989 4.009 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(F)(F)c1cccc(Cl)c1Cl 1641203819 LHSZFHFBZQSGFD-UHFFFAOYSA-N 429.294 4.363 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@H](c2ccncc2)C1 1641886587 RXRSVGNGIYESBW-HZGBGQKMSA-N 443.619 4.141 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2[C@H](O)CC)sc(C)c1-c1ccccc1 1644679200 QNQGKCHZBJJVNU-RTBURBONSA-N 444.597 4.464 10 10 IICE CCCCO[C@H]1C[C@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(C)C 1644890698 MGJCBGAVEFQXIX-VXKWHMMOSA-N 448.563 4.316 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](CC)(C(C)C)C3=O)c2C)cc1 1656276038 DZJOPKHPGYJCKA-DEOSSOPVSA-N 425.529 4.032 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)[C@@H]1CCN(c2ccccc2Cl)C1=O 1673743531 FRQXPVYTDQWXRY-VGOFRKELSA-N 442.991 4.092 10 10 IICE O=C(NCc1cc(Cl)ccc1O)N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1682724529 AESQCTUBRBWVKH-HNNXBMFYSA-N 432.858 4.002 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@@H](CCc1ccccc1)C(F)F 1682987030 VHOXPXWBHIOKFS-QFIPXVFZSA-N 431.527 4.056 10 10 IICE C[C@@H]1CCC[C@](Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1693632424 ZROBWIDVCZFLEI-IBVKSMDESA-N 448.615 4.116 10 10 IICE COCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1697922560 BVVJCZIADTTYDT-AREMUKBSSA-N 449.599 4.297 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)CNC(=O)OC(C)(C)C 1708398694 AVKHFRWPCRFGCS-DLBZAZTESA-N 431.581 4.294 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1710026104 XIBPWUSHBCYQKC-WMZHIEFXSA-N 434.588 4.096 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1712776587 BIZCOHLVKOMFEE-NQIIRXRSSA-N 447.624 4.495 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCc3scnc3C)CC2)cc1 1730181883 UMHOFNPQHGFAJE-UHFFFAOYSA-N 440.617 4.134 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCCN(C(C)C)CC2)cc1 1746092878 NKXZXTJBRDOTNO-UHFFFAOYSA-N 426.653 4.292 10 10 IICE CCc1nnc(N2CCC[C@H](Oc3ncccc3F)C2)n1CCCSc1nccs1 1763053310 MTVIOMMBXVJDNQ-HNNXBMFYSA-N 448.593 4.061 10 10 IICE CCO[C@H](CCn1c(C2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)C(C)C 1767358687 ITNPJBXDEWXAFT-HSZRJFAPSA-N 441.620 4.332 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@@H]1OC 1771066142 MLRNFSVFLRCHPJ-REWPJTCUSA-N 437.588 4.250 10 10 IICE COc1ccccc1N1CCN(Cc2ccc(C(=O)Nc3cccc(N(C)C)c3)cc2)CC1 1872883092 ZECVGESCODMBRY-UHFFFAOYSA-N 444.579 4.336 10 10 IICE CCCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCCOCC)C1=O 1873164532 GQGCRPMDGBCALB-UHFFFAOYSA-N 437.584 4.380 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@@H](CO)C(C)C)cc1Br 1915284320 KBUFNANSMMBFBS-QFIPXVFZSA-N 435.406 4.209 10 10 IICE O=C(O)C[C@H](NC(=O)OCc1ccccc1)c1cc(Cl)cc(Br)c1O 1951383707 QMXHWFZFLKWUGV-AWEZNQCLSA-N 428.666 4.250 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@H](c2ccc(Br)cc2O)C1 1952455917 IRYQXXLMEHQQAL-PBHICJAKSA-N 434.286 4.329 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1c(O)cccc1O 1952825540 LRNVROMKKHHBOG-CYFREDJKSA-N 445.471 4.495 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@@H]1CNCc1cccc(Br)c1O 2095169621 AYJGGGPUDNJEBQ-OAHLLOKOSA-N 425.367 4.424 10 10 IICE N=C1SC(=Cc2ccc(-c3cccc(C(=O)O)c3)o2)C(=O)N1c1ccc2c(c1)OCO2 2295170684 ARXKWYLPICNGDP-UHFFFAOYSA-N 434.429 4.429 10 10 IICE COc1ccccc1OCCn1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)c2ccccc21 2296767292 LTTUMBHRUSZXSD-UHFFFAOYSA-N 442.475 4.179 10 10 IICE CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2cccc(C)c2C)C1=O 2313548547 YANWPJCHQPZPEP-UHFFFAOYSA-N 443.297 4.131 10 10 IICE CCOC(=O)N1CCC(N2C(=O)C(=Cc3c(F)cccc3Cl)SC2=S)CC1 2323858442 XFZUIMATZKELPV-UHFFFAOYSA-N 428.938 4.301 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccccc3C)C2=O)ccc1OCCC(=O)O 16911869 VWKGRVPRYMCGIN-LDADJPATSA-N 429.519 4.263 10 10 IICE COc1ccc(Br)cc1/C=C1\C(=O)N(c2ccc(C)cc2)C(=S)N=C1O 33319763 BXBQUIFYMKOGMH-GDNBJRDFSA-N 431.311 4.438 10 10 IICE COCCOC(=O)c1ccc(N[C@H](c2cccnc2)c2ccc3cccnc3c2O)cc1 54620241 ZSQDCTLGYARMOY-JOCHJYFZSA-N 429.476 4.340 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3ccc(CNC(C)=O)s3)c(C)s2)s1 727249527 ZTVNLESNWCESPX-UHFFFAOYSA-N 441.625 4.241 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CC=C(c2ccc(Cl)nc2)CC1 773506023 PPXWIASPIYNWFU-UHFFFAOYSA-N 428.989 4.287 10 10 IICE COC(=O)c1cnccc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)c(Cl)c2)c1C 800229039 XGDUFLNYAGBQQT-UHFFFAOYSA-N 444.846 4.108 10 10 IICE Cc1nc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2c3c(sc2n1)C[C@@H](C)CC3 917391487 VYQIJOCPHXOOBA-YJBOKZPZSA-N 449.624 4.438 10 10 IICE O=C(CN(Cc1ccccc1)C1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 917405414 PYDOMZGZNNHCHY-UHFFFAOYSA-N 439.575 4.113 10 10 IICE O=C(NCc1cc(F)cc(Br)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 918131452 ZLIZJCPXTUCSQW-SFHVURJKSA-N 437.309 4.185 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)c2c1 1125188215 NQKTUJZMIWMMLS-GJZGRUSLSA-N 441.478 4.071 10 10 IICE C/C=C\COc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1125256955 QWQJJVLGGJERGF-SNHAVAMSSA-N 426.532 4.253 10 10 IICE C[C@H](NC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F)c1ccc(N2CCOCC2)cc1 1136443173 SQPBZMWNDAOCPB-YCRPNKLZSA-N 432.442 4.107 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O 1162115304 SIZAGUFUMVEDMP-HNNXBMFYSA-N 446.473 4.332 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](N4CCCC4=O)CC3)cc2Cl)C1 1227208518 NOUXDKSDEHTCEK-QUCCMNQESA-N 447.023 4.263 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCc3cccc(Br)c3C)C2)cc1 1252115952 NURDCXMGAPGOCF-QGZVFWFLSA-N 446.389 4.134 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2csc(Cc3ccc(F)cc3)n2)cc1 1278288421 KPDRPUMDHLVWHS-UHFFFAOYSA-N 427.545 4.019 10 10 IICE CC(C)(C)Cc1nnc(N2CCC[C@@H](C(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1287028303 DZKRXUBWQZABQF-LJQANCHMSA-N 447.574 4.233 10 10 IICE CC(C)(C)OC(=O)[C@@]1(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC=CCC1 1294858248 BWRVMVUFZDWGHE-CYFREDJKSA-N 448.991 4.194 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(COC)CCOCC1 1295091202 AWJQJVBDUDAEBP-UHFFFAOYSA-N 437.588 4.252 10 10 IICE COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1296006344 LPKQHKRUOXGXKK-XMMPIXPASA-N 429.520 4.398 10 10 IICE CN(Cc1ccoc1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1298416110 HOALWKUBDXPXOT-UHFFFAOYSA-N 425.602 4.407 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3ccc([N+](=O)[O-])cc3F)c2C)cc1 1307291502 RMZGZQCVUNOHLG-UHFFFAOYSA-N 426.400 4.190 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](c3cccc(C)c3)C(C)(C)C)CC2)cc1 1442056034 ULFXXFOUGZCPQB-JKCKFMQZSA-N 449.595 4.112 10 10 IICE CC(C)[C@@H]1N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC12CCCC2 1451387914 MXZUICAZIWENBN-IBGZPJMESA-N 434.583 4.295 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(Cl)c1 1462803658 GUFGZAOISUUBHT-JOCHJYFZSA-N 427.976 4.242 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1463785145 MDDDJXMFTDSECH-FSSWDIPSSA-N 427.589 4.423 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C 1465224344 PHTPFUIPKVPIKW-MRXNPFEDSA-N 427.545 4.139 10 10 IICE COc1cc(C)c([S@](C)=O)cc1OC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1469226108 FITKQIXSZBKHGY-HKBQPEDESA-N 439.533 4.489 10 10 IICE CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3ccccc23)cc1 1472086205 PWXXXZXBTODWJB-UHFFFAOYSA-N 440.565 4.286 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN[C@H](C)c1ccc(N2CCOCC2)cc1 1473340225 RVRFPXNBKFBSFT-LJQANCHMSA-N 447.583 4.005 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1499338264 UEVBQEIDTTVEOR-YLJYHZDGSA-N 429.584 4.224 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)Cc1cccs1 1510675846 VJWNHPKPUDBLKT-UHFFFAOYSA-N 432.597 4.385 10 10 IICE C[C@@H]1SCCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)[C@H]1C 1512599052 WWZUUMDLGGZEIO-HOTGVXAUSA-N 446.671 4.233 10 10 IICE Cc1oc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)nc1C1CC1 1527309194 IPZCBUXPQIGJOX-XNTDXEJSSA-N 431.514 4.230 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1547444191 LKMRDGFBBWSCJO-XXBNENTESA-N 436.604 4.039 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(Nc4ccccc4Cl)CC3)C2)cc1 1565055504 DRDUIXBGVCXTKQ-GOSISDBHSA-N 428.964 4.213 10 10 IICE CN(C)C(=O)C[C@@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)c2ccc(Cl)cc21 1565874676 AHKFRAZLMNHYQE-GFCCVEGCSA-N 430.913 4.188 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1ccccc1C(F)(F)F 1566155134 NZRDPWFEHIYUAJ-SCLBCKFNSA-N 444.400 4.125 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1 1594939005 RUOCCMKBPMZDEZ-QHCPKHFHSA-N 431.492 4.276 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@@H](C)C3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1611935370 PGZHGOBCGUWOLN-KDURUIRLSA-N 448.615 4.360 10 10 IICE Cc1cc(C(=O)Nc2cccc(CN3CCNC(=O)C3)c2)c(C)n1-c1ccc(C(C)C)cc1 1624992100 FJVGMYIZHQCEHH-UHFFFAOYSA-N 444.579 4.402 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H](c3ccncc3)C3CCCC3)cc2F)C[C@@H](C)O1 1625089690 DSOLHYZRKFDWJA-QZTZHPFYSA-N 425.548 4.425 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3csc(NC4CCCCC4)n3)cc2F)CC1 1627360371 FVHGKLPPXUZPLR-UHFFFAOYSA-N 445.608 4.099 10 10 IICE Cc1nnc(COc2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc2)o1 1628405649 QWGXMUXFFHKFQO-UHFFFAOYSA-N 430.464 4.429 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@H](c2nccs2)C1 1633225749 LAPGXFXDNSEFPA-WZMONFQBSA-N 449.648 4.202 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3CCN([C@H]4CCSC4)CC3)cc2Cl)C1 1634023205 WWPITSXIQQNQBT-XLIONFOSSA-N 436.065 4.410 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(C)(NC(=O)OC(C)(C)C)CC1 1636262965 KRBQJLXXJFKTHC-SFHVURJKSA-N 432.609 4.081 10 10 IICE CCO/C=C/[C@](O)(CNC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1637578317 UUMYGPBSBZAWST-GLCJEOIMSA-N 439.478 4.045 10 10 IICE COCCN(CCNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(=O)OC(C)(C)C 1637841883 SKVSFOOPDORZKB-UHFFFAOYSA-N 449.979 4.361 10 10 IICE Cn1ncc(Br)c1CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1644585288 ZUOLPLGPKRFNJP-UHFFFAOYSA-N 435.366 4.160 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]3COCC[C@H]32)sc(C)c1-c1ccccc1 1644947170 QLJSVCWTRYMDIH-RBUKOAKNSA-N 442.581 4.340 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3ncccn3)C2)c(C)n1-c1cccc(Br)c1 1645329460 FYERMFNQQYSWET-MRXNPFEDSA-N 425.330 4.276 10 10 IICE COc1ccc(N(CC(=O)NCCc2cnn(-c3ccccc3)c2)Cc2cccs2)cc1 1657566847 JIYGSCCELUCEAQ-UHFFFAOYSA-N 446.576 4.308 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3cn(C)c4cc(Cl)ccc34)C2)cc1 1671688181 QFDYXQRLUXGYGM-KRWDZBQOSA-N 440.975 4.209 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(CCc3ccccc3)Cc3cccnc3)C2)cc1 1673823635 XNAPJNIFFLACDY-XMMPIXPASA-N 444.579 4.371 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)Cc3ccccc3F)cc2Cl)C1 1682024095 OLZLDYQHDWTSEL-QFBILLFUSA-N 433.955 4.118 10 10 IICE COC(=O)c1cnc([C@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)s1 1683479617 NNRQXSGRDNZOLD-HNNXBMFYSA-N 426.542 4.206 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nn(C)c4ccccc34)cc2Cl)C1 1686062279 OBFVNIMTGKWFKJ-MRXNPFEDSA-N 425.964 4.462 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1)OC 1695114730 OMXYDILBWHDLFU-FCHUYYIVSA-N 437.588 4.393 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710767707 VBRSKSYYCNPOEZ-KNQAVFIVSA-N 445.583 4.026 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3OCCC3(C)C)CC2)cc1 1711865317 QPWHMZFJGNGEOB-JOCHJYFZSA-N 441.620 4.017 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)CC1CC(F)(F)C1 1724236576 WJLWZSDTECPENF-UHFFFAOYSA-N 440.542 4.168 10 10 IICE CCCC(O)(CCC)Cn1c(C(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1727958541 CSYWISMFVALNLQ-UHFFFAOYSA-N 447.599 4.207 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCCc1ccccn1 1730767403 VFYJGBZVRHREJX-UHFFFAOYSA-N 444.583 4.463 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@H](C)C1 1749800224 YUVJBTVHFFBDSO-CDNPAEQRSA-N 441.620 4.194 10 10 IICE Cc1nnc(N2CCC(CCN3CCCC[C@@H]3C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1751903492 PFSVASSBLPKSTE-IBGZPJMESA-N 442.627 4.321 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1752696596 QAUOPSKSZBJCQZ-ICSRJNTNSA-N 430.616 4.213 10 10 IICE COCC(C)(C)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1770720769 JYSIJOPEOCCXJF-UYAOXDASSA-N 430.593 4.211 10 10 IICE CCCN(CC)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCSCC2)cc1 1772873933 UAFVOWKCLGPUPQ-UHFFFAOYSA-N 436.629 4.102 10 10 IICE COc1cc(N2C(=O)/C(=C\c3cc(Cl)ccc3O)SC2=S)cc(OC)c1OC 1860087556 GIGWHYYACPKGDX-FRKPEAEDSA-N 437.926 4.477 10 10 IICE CC(C)CN1C(=O)/C(=C\c2ccc(OCC(=O)Nc3nccs3)cc2)SC1=S 1871287885 YXCIHLXEKHRLBD-OQLLNIDSSA-N 433.580 4.018 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010406572 WFFNKBFNXXTYDA-RTBURBONSA-N 431.537 4.178 10 10 IICE COCCNC=C1C(=O)N(c2nc3ccccc3s2)N=C1CSc1ccc(C)cc1 2293467609 MRTAMKYVLFQVNN-UHFFFAOYSA-N 438.578 4.220 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)C=Cc2ccc(Br)cc2)c2nccn2C)cc1 2329604522 XNVTWUVYHAFDBR-OAQYLSRUSA-N 439.357 4.168 10 10 IICE Cc1ccc(CNC(=O)CC[C@H](C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2380748621 GMNQOHVMENJGBD-ZDUSSCGKSA-N 443.382 4.410 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2381136114 AVSFAIGMDSLOAT-HIFRSBDPSA-N 441.366 4.163 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(OC)cc3)SC2=S)cc1 13305909 GRLNPXATFVLLDR-XMHGGMMESA-N 442.562 4.324 10 10 IICE CN(C)c1ccc(C2c3ccc(N(C)C)cc3S(=O)(=O)c3cc(N(C)C)ccc32)cc1 15776318 BSDHXWHYGHEHAL-UHFFFAOYSA-N 435.593 4.211 10 10 IICE O=C(NN1C(=O)/C(=C/c2c(Cl)cccc2Cl)SC1=S)c1cccc(O)c1 16929636 WIIYFHFXTZFDQF-ZSOIEALJSA-N 425.318 4.245 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 210722980 OAPXFMPYRQALMK-SFQUDFHCSA-N 445.497 4.354 10 10 IICE C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)/C=C\c2ccc(N3CCOCC3)cc2)C1 221658780 HOMUMYYXWQZAEU-NHNJRYNSSA-N 447.579 4.293 10 10 IICE CC1CCN(c2ccc(CNc3ncc(C(=O)N4CCOCC4)cc3Cl)cc2)CC1 301180028 AVCOWKFFGAMWGT-UHFFFAOYSA-N 428.964 4.056 10 10 IICE Cc1cc(C(=O)NC(C)C)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435494107 USWMJYLTFKOOGI-UHFFFAOYSA-N 446.595 4.493 10 10 IICE CC(C)Cn1ncc2cc(C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)cnc21 728837355 QSWYNZDCRMPABG-UHFFFAOYSA-N 433.478 4.358 10 10 IICE CCN(C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@H](C)Cc1ccc(OC)cc1 731406160 QKRXRWSSGGLHEQ-LJQANCHMSA-N 425.573 4.335 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@H](c2cccs2)C1 761769995 CNDIKLLNOUQLOK-QAPCUYQASA-N 437.512 4.101 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c(C)n1-c1ccc(F)cc1 780403500 MVHMLIBRPVULMQ-HXUWFJFHSA-N 447.489 4.376 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)c([N+](=O)[O-])c1 782381274 ZQZZYBOGLWLBFX-FOTOIKQHSA-N 436.386 4.378 10 10 IICE CS(=O)(=O)CC[C@H]1CCCCN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 794754406 TWYUOYJKEMWJRC-OAQYLSRUSA-N 428.558 4.330 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2C[C@@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1 813633876 VWYXRXRRPZBMGT-NHCUHLMSSA-N 443.547 4.052 10 10 IICE CCOc1cc2c(cc1OCC)CN(c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])CC2 917016649 FLIKQMIREGROKX-CLFYSBASSA-N 426.469 4.141 10 10 IICE CSc1ccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 920015159 QEKSVOMYYVMQON-UHFFFAOYSA-N 432.457 4.022 10 10 IICE Nc1c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccnc1-c1ccccc1 1143190931 KEWLHAFUFGJIGA-UHFFFAOYSA-N 438.478 4.331 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccnc3Nc3ccccc3OC)CC2)cc1 1151503344 QIHAGGKEDKNCIT-UHFFFAOYSA-N 432.524 4.195 10 10 IICE C[C@@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1223424253 WUQUZMLWZOXNDO-QRWLVFNGSA-N 433.394 4.178 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)C2)cc1 1252922041 CWQCDOVUQXOZCT-MCIONIFRSA-N 439.400 4.046 10 10 IICE CC[C@H](C)[C@H](Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1291419622 NSYDCRQRGYUIQH-RRPUWOKSSA-N 441.620 4.080 10 10 IICE CCO[C@@H]1C[C@@](CO)(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1296496709 QATYROVLMJONFZ-KNQAVFIVSA-N 449.389 4.153 10 10 IICE CC(C)(C)N1CCCN(c2nnc(CC3CC3)n2CCCSc2nccs2)CC1 1302200328 LRMPWMWMUJRWIW-UHFFFAOYSA-N 434.679 4.180 10 10 IICE CC(C)CC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@]2(OC(C)C)CCOC2)CC1 1302829601 OQXKJMRMITXAHJ-VWLOTQADSA-N 442.604 4.487 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H]2C[C@@H](OCc3ccccc3)C2(C)C)N(C)C)cc1 1312555705 KYZJOBMBANDSAF-KMDXXIMOSA-N 438.616 4.038 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Cc2cc(F)cc(F)c2)CC1 1313064205 JSEJIZZSGYWHQD-UHFFFAOYSA-N 443.538 4.090 10 10 IICE CC1(C)CC[C@@H](CNC(=O)NCc2cc(Cl)ccc2O)N(C(=O)OC(C)(C)C)C1 1313146260 INARWYHGTKRRGK-INIZCTEOSA-N 425.957 4.271 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCO[C@H]1C(C)C 1314304480 CMTVTMCUFBMYLJ-QPPBQGQZSA-N 441.620 4.112 10 10 IICE CN(C[C@@H]1CCOC1)c1nnc(Cc2ccsc2)n1CCCSc1nccs1 1314813825 ONFKPAOOPICLGS-INIZCTEOSA-N 435.644 4.042 10 10 IICE Cc1cc(Br)c2oc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2c1 1355123433 JMJPXSYVDRUTRX-UHFFFAOYSA-N 447.304 4.409 10 10 IICE COc1cccc(C(=O)NCCNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)c1 1358389990 DFJHFTXJAYYCPS-UHFFFAOYSA-N 445.523 4.336 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3c(O)cccc3O)[C@H]2c2cccs2)cc1 1456235794 OHDLEHYTWOQMMJ-HXOBKFHXSA-N 436.533 4.268 10 10 IICE CCOC(=O)C[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1457818341 JHWLLBQNBBSAPU-QHCPKHFHSA-N 447.579 4.219 10 10 IICE Cc1cc(C(=O)N(C)CCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccc(Cl)cc1 1466608542 AJROMGWMGRNCSX-UHFFFAOYSA-N 435.911 4.116 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccncc2OCC(F)(F)F)cc1 1467489534 NNFXXZGBILRVGL-UHFFFAOYSA-N 445.441 4.102 10 10 IICE CC(C)Oc1cccc(CN(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1473346554 NHVDWSKNPXYVAJ-UHFFFAOYSA-N 442.515 4.320 10 10 IICE CCOCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCC1 1503197339 NPUXFIGDUDWQIW-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CC1(N2CCSCC2)CCCC1 1503486956 IIAHDMJAPKAPFD-UHFFFAOYSA-N 443.661 4.279 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)CCS1 1514160040 AHBJHBFUWVPHHL-HOTGVXAUSA-N 439.676 4.143 10 10 IICE C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1537839444 MYLYVXVMKXDKSX-HNNXBMFYSA-N 448.394 4.190 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COc3ccccc3O2)c(C)n1-c1ccccc1Br 1540603445 IGHMNNGRXGTXHB-MRXNPFEDSA-N 441.325 4.426 10 10 IICE COc1ccc(-n2cc(O)c(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)n2)cc1 1542412058 LMQRLALDMISFHM-UHFFFAOYSA-N 434.540 4.285 10 10 IICE CC(C)c1ncc(Br)c(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)n1 1543448020 WSCQBYWALWBCDS-UHFFFAOYSA-N 437.301 4.325 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(CCCN4CCOCC4)CC3)c2C)cc1 1546111638 NTRPLXRKTGEVBY-UHFFFAOYSA-N 439.600 4.067 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c1 1556447287 HVAXITAGKSJBSQ-ROUUACIJSA-N 432.524 4.168 10 10 IICE CCN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCC(C)CC3)cc2)[C@H]1c1cccc(C)c1 1585545420 RLJFOMGCILSRLG-AZGAKELHSA-N 433.596 4.457 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(Br)c(C)cc3OC)C2)cc1 1598362630 ARULIXPHFRKVOM-OAHLLOKOSA-N 433.346 4.031 10 10 IICE CC(C)CCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1606876446 VZMKJSHBSQKMFV-UHFFFAOYSA-N 448.615 4.173 10 10 IICE CC(C)CCN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1)C1CC1 1606930550 NDAXIITZLXPEGX-UHFFFAOYSA-N 425.621 4.475 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(-c2ccc(Br)cc2)n1C 1611431288 MJNBQRCSAYWORO-ZDUSSCGKSA-N 429.314 4.227 10 10 IICE CC[C@@H](C)c1nnc(N(CC)C[C@@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1613191309 ONCMKLFTOJWPLE-KNQAVFIVSA-N 443.661 4.398 10 10 IICE Cc1nnnn1-c1ccc(C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)c(F)c1 1623926338 YIYLBTMBXVQOBH-INIZCTEOSA-N 431.471 4.219 10 10 IICE CC(C)(C)OC(=O)Nc1ncc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 1632399321 QQQVFTLJIYIPRP-OAHLLOKOSA-N 433.530 4.017 10 10 IICE C/C=C/C[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C(=O)OCC 1632607449 LZWCJNNWHQWUNF-XZXOBPBMSA-N 433.346 4.484 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C(F)(F)c1c(F)cccc1F 1634381684 UEVIWZLCIKUHOW-UHFFFAOYSA-N 440.437 4.445 10 10 IICE Cc1ccc(C(=O)N2CCN(C)[C@H](Cc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1636103698 OCJYAVBEWLDYFO-RUZDIDTESA-N 429.564 4.214 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](c2cccs2)C(C)(C)CO)C1 1639152913 WVRFRHJNDTYVDZ-DEOSSOPVSA-N 439.625 4.345 10 10 IICE CCCc1ccc(-c2cc(NC(=O)c3cc4cc(O)c(O)cc4s3)n(CCO)n2)cc1 1641236925 VGHSYBHHNQEARC-UHFFFAOYSA-N 437.521 4.373 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1643394868 ZHGHNPHTGPOLTP-CVDCTZTESA-N 443.950 4.305 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](CO)c2ccc(Cl)cc2)CCCC1 1644849473 ILBRSXNHZDMZKY-QGZVFWFLSA-N 426.944 4.074 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cc(I)c(F)cc1F 1652708770 MARGFVTYBBRPBP-UHFFFAOYSA-N 439.199 4.358 10 10 IICE C[C@@H](NCCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccc(N2CCOCC2)cc1 1653132676 FINJOCBXMCDXQB-OAQYLSRUSA-N 443.035 4.040 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@H]2C[C@@](CNC(=O)OC(C)(C)C)(c3ccccc3)C2)c1 1676298159 CLAFCMKALAZDTL-IHRKKFBRSA-N 439.556 4.125 10 10 IICE COC[C@H](NC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)c1cccc(Br)c1 1682102212 YKWCQAZGMDLCOF-KKSFZXQISA-N 448.405 4.441 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1687650471 XWIPEAZHIMNOLR-WIYYLYMNSA-N 430.593 4.074 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1692984117 BWBHPGULDWKSKO-UHFFFAOYSA-N 436.604 4.313 10 10 IICE CC[C@H]1CCCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709280968 VAGFPVOKYNPFSV-QFIPXVFZSA-N 425.621 4.112 10 10 IICE CN(C)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2cccs2)cc1F 1729329575 HQAWIXWVMHCMSO-UHFFFAOYSA-N 436.560 4.215 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1744179213 OEWHWINZVNNGOL-UHFFFAOYSA-N 437.588 4.129 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@@H]3C)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1761676344 GMBZWSULRNPUHZ-ICSRJNTNSA-N 448.615 4.360 10 10 IICE CCC[C@@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1763985266 YPRIMRZFQWGWBF-FGZHOGPDSA-N 427.593 4.029 10 10 IICE COCC(C)(C)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1769187654 AHEOLMVXNWOIOJ-UHFFFAOYSA-N 448.615 4.173 10 10 IICE C[C@](CCc1ccc(O)c(O)c1)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1951742442 YQNYAYQKEYMJMO-AREMUKBSSA-N 447.487 4.412 10 10 IICE CN(C)c1ccc([C@H](N)c2cc(Br)ccc2I)cc1 2106805751 QAOXAXJJDNSAOP-HNNXBMFYSA-N 431.115 4.168 10 10 IICE COc1ccc(Br)c(CNC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C(C)C)c1O 2236054369 HPPXQFHYCOBGHV-CZUORRHYSA-N 445.398 4.438 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c1O 2238190837 CMIDLUGMNGMOPR-APHBMKBZSA-N 441.366 4.183 10 10 IICE COc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCCOCCOc1ccccc1 2297306568 DGUQLDRATCQVNF-UHFFFAOYSA-N 445.562 4.001 10 10 IICE O=C(O)CCN1C(=O)/C(=C\c2cn(-c3ccccc3)nc2-c2ccccc2)SC1=S 2346318 ZAUCUBQEDCQPEH-QGOAFFKASA-N 435.530 4.215 10 10 IICE CCCN1C(=O)/C(=C\c2c(N(CCC)CCC)nc3c(C)cccn3c2=O)SC1=S 102688383 DXHZYFKQDDWUJN-SAPNQHFASA-N 444.626 4.241 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccccc3C(C)=O)[C@@H]2c2ccc(O)c(O)c2)c1 526612840 XGHGEBYLJZPJAG-HSZRJFAPSA-N 431.444 4.366 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2nccn2CC(F)(F)F)cc1 727944780 HVOGFTNSCRUCFK-UHFFFAOYSA-N 435.450 4.016 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3ccc(Cl)s3)n2)cc1 731058981 KNLDURJTOIHEOB-UHFFFAOYSA-N 441.987 4.004 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2coc(-c3ccc(F)cc3)n2)cc1 733257545 SPUOGTXOLHKLMA-QHCPKHFHSA-N 437.515 4.297 10 10 IICE COC(=O)[C@@H]1CC12CCN([C@H]1CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C1=O)CC2 733797715 FAEKPIGVMHGBLG-SFTDATJTSA-N 446.507 4.009 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3sc4cc(F)ccc4c3Cl)CC2)cc1 742927076 HHBHRCMOHQBADU-UHFFFAOYSA-N 447.963 4.254 10 10 IICE O=C(NCc1cccc(Br)c1O)Nc1ccc(-c2noc(C(F)F)n2)cc1 765275459 HEVXFANJLQLRKI-UHFFFAOYSA-N 439.216 4.464 10 10 IICE C[C@@H]1CN(c2ccc(CN3C(=O)[C@@H]4CC[C@@H](c5ccccc5)N4C3=O)cc2F)C[C@@H](C)O1 797133616 BRSZCHGJSMRVJJ-RVLCIERPSA-N 437.515 4.107 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc(-c4cnn(C)c4)s3)cc2Cl)C1 800048770 BXFZVYJITHJTJD-CQSZACIVSA-N 429.977 4.363 10 10 IICE COc1cc2c(cc1F)CC[C@@H]2NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 800997793 CCRYWVIEFMGLMI-GXZWQRSESA-N 445.510 4.074 10 10 IICE CN1CC[C@H](NC(=O)NCc2cc(Br)ccc2O)[C@@H]1c1ccc(Cl)cc1 805239747 PDCMDAUECQRUQG-WMZOPIPTSA-N 438.753 4.053 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(C(=O)N2CCCCCC2)cc1 806220435 DAJCMROPTXXCRQ-UHFFFAOYSA-N 446.345 4.493 10 10 IICE CC(C)=CCOc1cccc(CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1127267964 NPXGRLIXIJGSHU-UHFFFAOYSA-N 447.623 4.423 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Cl)cccc4nc3C)CC2)c(OC)c1 1132035828 FSAFRBKWIPBTNE-UHFFFAOYSA-N 425.916 4.176 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)N(C)C)cc1 1134681987 PKYIIJJNKZRGDE-NRFANRHFSA-N 446.382 4.278 10 10 IICE COc1ccc(-c2nnc(SCC(=O)N(C)Cc3ccc(N4CCCC4)cc3)o2)cc1 1135800750 OVZWVGZMNFDAPG-UHFFFAOYSA-N 438.553 4.096 10 10 IICE Cc1cc(C(=O)N2CC[C@](CO)(C(F)(F)F)C2)c(C)n1-c1ccc(Br)cc1 1154488765 XXJWHIMRJPZCAR-SFHVURJKSA-N 445.279 4.244 10 10 IICE O=C(COc1ccccc1-c1ccccc1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1275224279 AYXOFTPJIDYXQM-UHFFFAOYSA-N 438.474 4.164 10 10 IICE CC(C)Cc1nnc(N(C)C2CCCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1287353669 WAUURCXQOTZHOU-UHFFFAOYSA-N 429.584 4.270 10 10 IICE CC[C@H]1CCCCN1CCn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccccc1O 1293374123 TXWZTSYCZDBXDX-NRFANRHFSA-N 434.588 4.255 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2c2cccn2C)c(C)n1-c1ccccc1Br 1296210213 PDNQTKMADRMBRT-NRFANRHFSA-N 442.357 4.409 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSc1nccn1C(C)(C)C 1297228441 ILJJHORRERKUNZ-UHFFFAOYSA-N 446.617 4.119 10 10 IICE CN(C[C@H]1CCCOC1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1298560345 YCJBUUZSFNOHPP-IAGOWNOFSA-N 437.635 4.021 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CC4)n3CC(C)(C)C(F)(F)F)CC2)cc1F 1300247508 NLJFFWJGFIKCNA-UHFFFAOYSA-N 441.473 4.218 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@@H](NCc2ccc(N(C)C)cc2)c2ccccc2)c(C)c1 1307626752 MXOSGXSFZHMVJB-XMMPIXPASA-N 437.609 4.179 10 10 IICE CC(=O)c1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1350546405 RXRFZAPIJBODEJ-WQRHYEAKSA-N 428.510 4.258 10 10 IICE CC(C)Cc1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359830442 JVJNFILWZUPQHJ-UHFFFAOYSA-N 439.648 4.360 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2[C@H]2C[C@H]2C)c(C)n1-c1ccccc1 1361045277 SCWMNKVQTNCVJG-IERDGZPVSA-N 434.588 4.284 10 10 IICE CCOC(=O)[C@H](CCCC(C)C)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1439195578 WYQJVNCLWYHDKG-NRFANRHFSA-N 428.573 4.403 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2C1 1444983388 DAUFXWMOKZIFDV-WBVHZDCISA-N 445.510 4.302 10 10 IICE COc1ccc(N2CCN(C(=O)c3ncsc3Nc3ccc(C)cc3)CC2)cc1F 1445837886 AMZIFXFWZFUZHB-UHFFFAOYSA-N 426.517 4.305 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc2n(n1)CCC[C@H]2NC(=O)OC(C)(C)C 1448439714 QUNSHZASIWIQKI-GOSISDBHSA-N 442.560 4.391 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)CN2CCc3ccccc3C2)c(C)n1-c1ccc(C(C)C)cc1 1450064981 PFYARNUKMXZDCK-AREMUKBSSA-N 445.607 4.367 10 10 IICE COc1ccc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1463621417 NXPJLFMKOJPYAA-UHFFFAOYSA-N 428.330 4.233 10 10 IICE COc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(OC2CCCC2)c1 1465930294 LUUZASAGWLTAGV-UHFFFAOYSA-N 428.504 4.127 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCN3CC(F)(F)F)cc2Cl)C1 1469959665 LXCOPJSMGGWZLK-DOTOQJQBSA-N 446.945 4.402 10 10 IICE CN(Cc1nccs1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1517187570 SSQHSCFIGNBGRU-AWEZNQCLSA-N 436.632 4.252 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cncc(-c4ccc(C)cc4)c3)CC2)cc1 1531525604 XHSUHYOYGCQAQD-UHFFFAOYSA-N 444.579 4.008 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1532655550 MKFDKKAGNIIHKP-QVKFZJNVSA-N 448.350 4.004 10 10 IICE Cc1cc(C(=O)NCCCN(C)CC(F)(F)F)c(C)n1-c1ccc(Br)cc1 1543980538 OBMPINAJKNBOPX-UHFFFAOYSA-N 446.311 4.471 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CC[C@@H](Nc2ccccn2)CC1 1545632264 GWVIULAEQWYFNE-WMQCIHAUSA-N 442.991 4.192 10 10 IICE CCCN(CCC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1547135502 WJPMRFWBFFEHSS-QFIPXVFZSA-N 445.583 4.170 10 10 IICE CO[C@@H](Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1554658194 GNNGLIQXFFNRIC-DEOSSOPVSA-N 448.615 4.172 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC[C@]2(C)CC)sc(C)c1-c1ccccc1 1559713418 OYGBIFAGBXQFHN-QHCPKHFHSA-N 430.570 4.340 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1c(Cl)ccc(I)c1F 1583820777 LLFRLLWQBUBXLA-UHFFFAOYSA-N 440.039 4.373 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@]3(C)c3cccc(Br)c3)C2)cc1 1584444639 VERPQSYCTQFFOL-XORNHQRDSA-N 443.385 4.378 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCc3nnc(-c4cccc(C)c4)n3C2)cc1F 1585698640 UEDPUAXMFFPUQZ-FQEVSTJZSA-N 435.547 4.118 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@](C)(CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1613347440 FMBIWGXWQWNQHI-YADARESESA-N 443.661 4.398 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CNC(=O)c2ccc(C)c(C)c2)cc1 1616620251 PHQBGTIXZSIVRN-UHFFFAOYSA-N 445.563 4.341 10 10 IICE Cc1cc(C(=O)NC[C@H]2OCCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1617100259 VUXJRINOLNNKHL-HXUWFJFHSA-N 440.341 4.295 10 10 IICE Cc1cc(C(=O)N[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c(C)n1-c1ccc(Br)cn1 1620754533 WMAXIBSACNLEDX-LZQZEXGQSA-N 432.362 4.185 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)ccc21 1625847717 DEUAEWLCGQWQHB-HSZRJFAPSA-N 432.486 4.353 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(OCc2nccn2C)cc1 1625991296 NOBVWRDWRPTWJM-UHFFFAOYSA-N 428.492 4.471 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(C(=O)c3ccccc3)c[nH]2)cc1 1627205382 PWOGJSGILZUCHE-HSZRJFAPSA-N 431.536 4.133 10 10 IICE CCCCNC(=O)[C@H]1CCCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1627292879 XOMDCNIMSDOLFL-IBGZPJMESA-N 429.992 4.445 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1 1631328594 KQCPKVQZMPZSOW-UHFFFAOYSA-N 425.529 4.084 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@H](C(=O)NCc1cc(Cl)ccc1O)C2 1632228734 RFFOBEHUJFGZKG-SFHVURJKSA-N 434.895 4.476 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@H]4C[C@H](N(C)C)CC[C@H]4C3)cc2Cl)C1 1634720128 OOINAAVYYSLACE-GFOJFJKKSA-N 433.040 4.448 10 10 IICE O=C(NCc1cccc(Br)c1O)C1=Cc2ccccc2O[C@H]1C(F)(F)F 1635840815 XNGDLYFAPBNWDS-MRXNPFEDSA-N 428.204 4.178 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H]3COc4c(F)cc(F)cc4C3)c2C)c1 1637577896 JSTPASHCRXOXBR-FQEVSTJZSA-N 425.479 4.484 10 10 IICE Oc1c(Br)cccc1CNc1ncnc(C(F)(F)F)c1Br 1639874926 VAXKDXFBGPVXBU-UHFFFAOYSA-N 427.018 4.338 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] 1644815271 IPADWXDJPFPXJO-UHFFFAOYSA-N 433.675 4.436 10 10 IICE O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN(Cc2ccccc2O)C[C@@H]2CCCO2)o1 1644895115 GERXFJDFFJLFCE-INIZCTEOSA-N 444.875 4.185 10 10 IICE COC1CCN(c2ccc(CN3CCOc4cccc(Br)c4C3)cc2)CC1 1646456659 ZQSNUPJEUHOXQH-UHFFFAOYSA-N 431.374 4.459 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1ccc(C(N)=O)nc1 1648493218 AYUASLMBAVJDFD-GOSISDBHSA-N 442.441 4.106 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCC1(O)CCN(Cc2ccccc2)CC1 1651951719 QTJBSCNEKGLCSZ-UHFFFAOYSA-N 445.519 4.265 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)CC1CCCCC1 1652332736 CVMUOPMTUZVDSE-WOJBJXKFSA-N 433.612 4.348 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C(=O)OC)[C@@H](C)CC)sc(C)c1-c1ccccc1 1658133315 FLYCBCBTORPUOB-XOBRGWDASA-N 446.569 4.016 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@]2(CCN(C(=O)OC(C)(C)C)C2)C1 1683252974 BQICDRIZZPOULG-UQBPGWFLSA-N 444.620 4.035 10 10 IICE Cc1cc(CNC(=O)N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1683307808 POCZHMDKRIPHKA-JOCHJYFZSA-N 449.530 4.339 10 10 IICE Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2=O)cc1 1686340242 YMTKWNNDKZVYKB-RUZDIDTESA-N 444.579 4.045 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1708574990 OQBTZDGXXMXXTD-CLOONOSVSA-N 443.636 4.224 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCCC[C@@H](SC)C2)cc1 1710026564 LBGLXKQAGOSMHW-IFMALSPDSA-N 443.661 4.398 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCO[C@](C)(CC)C2)cc1 1728378673 CVHCDIVPHMFDEY-RUZDIDTESA-N 436.604 4.183 10 10 IICE CN(C)c1ccc(Cn2c(-c3cc(Br)c[nH]3)nnc2N(C)C2CCC2)cc1F 1766909077 OKYFPNJSNYCTQH-UHFFFAOYSA-N 447.356 4.278 10 10 IICE COc1ccc(N2CCCCC2)cc1NC(=O)[C@H](CC(C)C)N1C(=O)c2ccccc2C1=O 1858033548 RBAYXUHWMOPPHQ-QFIPXVFZSA-N 449.551 4.335 10 10 IICE O=C(NC1CC(NCc2cc(Cl)cc(Br)c2O)C1)OCc1ccccc1 1977128788 BPDGLFZQJAVBEH-UHFFFAOYSA-N 439.737 4.355 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C(F)(F)F)c(C(=O)OC)c1Br 2079848595 KECRTPWXKDRYQH-SNVBAGLBSA-N 437.212 4.165 10 10 IICE COC(=O)c1c(C2CC2)nn([C@@H](c2ccc(OC)cc2O)C2CCC2)c1Br 2080005147 CPPNNBQSGGKRGR-GOSISDBHSA-N 435.318 4.413 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)c1O 2236053870 BDCYXMRTSKBBHP-CQSZACIVSA-N 443.382 4.290 10 10 IICE CC1=NN(c2ccccc2)C(=O)C1=Cc1cn(C[C@@H](O)CN2CCCCC2)c2ccccc12 2296673569 WAJAAXUKXQAYFT-QHCPKHFHSA-N 442.563 4.294 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)Nc1ccccc1C(=O)O 2296881325 AQDMNHOXKAVQIH-UHFFFAOYSA-N 446.937 4.268 10 10 IICE CCc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)c(C)c3C)C2=O)cc1 2313548179 OBWBVVXHSAVZJJ-UHFFFAOYSA-N 427.298 4.295 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)cc1OC 2318753354 JCYPPTAWQLNHRG-UHFFFAOYSA-N 439.562 4.414 10 10 IICE CCOC(=O)N1CCN(C(=O)C=Cc2cc(C)n(-c3ccc(C(F)(F)F)cc3)c2C)CC1 2324534964 UGUMTZZVELWMBM-UHFFFAOYSA-N 449.473 4.427 10 10 IICE COc1ccc(C2=NN(CC(C)C)C(=O)C2=Cc2cc(Br)ccc2O)cc1 2332125523 LKOLUUMOIHQDFI-UHFFFAOYSA-N 429.314 4.449 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380753056 BOSWBKJTMGMKQU-UKRRQHHQSA-N 441.366 4.163 10 10 IICE CCn1c(=O)c2cc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)sc2c2ccccc21 9611108 FKHRFPIASGFWCS-UHFFFAOYSA-N 447.560 4.207 10 10 IICE C[C@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3ccc(Cl)cc3Cl)s2)C1=O 11635477 FCBVCRIDFRGOMM-MRVPVSSYSA-N 446.406 4.228 10 10 IICE O=[N+]([O-])c1ccccc1[C@H]1Nc2ccc(S(=O)(=O)N3CCCC3)cc2[C@H]2C=CC[C@@H]21 14478045 OTHDFLUDLDVQNY-HOIFWPIMSA-N 425.510 4.206 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(\C)NCc2ccccc2)cc1 19635858 CNSLSJUFKRMVAJ-HAVVHWLPSA-N 442.475 4.418 10 10 IICE CCC(/C=C1/Sc2ccc(OC)cc2N1CC)=C1\SC(=S)N(CC(=O)O)C1=O 33721440 ZIJWUKZCGLJFHC-IOTOLQBXSA-N 436.580 4.078 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1nc2ccc(F)cc2s1 208740393 NFQAWZITZKRGOJ-VIZOYTHASA-N 447.513 4.414 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)cc1 210501941 BTJRHFFXLRHKSG-CAOOACKPSA-N 443.502 4.278 10 10 IICE CCCCCSc1nc(O)c2[n+](n1)[C@@H](c1ccccc1O)N(C(C)=O)c1ccccc1-2 261365537 SZKKYTRLDWWYJV-QFIPXVFZSA-O 437.545 4.038 10 10 IICE C[C@H](C1CC1)n1[nH]ccc1=NC(=O)CSc1ncc(-c2ccccc2)n1CC(F)(F)F 748034665 UJZAEDQXSJEWQQ-CQSZACIVSA-N 449.502 4.433 10 10 IICE CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NCc1c(O)ccc2c1CCCC2 761971670 AOUOYFVUQNCPFC-UHFFFAOYSA-N 446.551 4.144 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC(c2cccnc2)CC1 768701287 CWFDBZFSMJKRAU-UHFFFAOYSA-N 448.489 4.026 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3cccc(OCc4ccccc4)c3)nc12 769901816 VKCZBNQUIQOGFO-QGZVFWFLSA-N 446.507 4.041 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC4(CC3)C[C@H]4C(=O)N3CCCCC3)c2C)cc1 771409900 PQNNJVLYUUMATC-DEOSSOPVSA-N 449.595 4.358 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[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)cc1 787682355 FUSBWYKLCYWCQP-NXYGLHLHSA-N 442.563 4.407 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCOC3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802683046 CTECZVJJODPXAS-UNMCSNQZSA-N 435.572 4.004 10 10 IICE O=C1N[C@H](Cc2cccc(Cl)c2)C(=O)N1C1CCN(c2ccc(OC(F)F)cc2)CC1 804148502 KCNXPJUJBDZEFG-LJQANCHMSA-N 449.885 4.073 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)nc3)c2C)c1 918576161 QAKGGFDTZPZIEY-BGYRXZFFSA-N 432.568 4.341 10 10 IICE Cc1cc(C(=O)NCC2CCN(C3CCOCC3)CC2)c(C)n1-c1cccc(Cl)c1 1146928875 JJIRAUSTSNJJHC-UHFFFAOYSA-N 429.992 4.368 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3nn(-c4ccccc4)cc3OCC(C)C)CC2)cc1 1151503102 KLQAUISITCXFOL-UHFFFAOYSA-N 448.567 4.268 10 10 IICE COc1cccc(Nc2ccccc2C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 1153442875 DDXHWLRTUCVNSC-UHFFFAOYSA-N 430.552 4.121 10 10 IICE Cc1cc(C(=O)NCCS(=O)(=O)CCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1155537962 BACJVSUPDOMWNJ-UHFFFAOYSA-N 444.984 4.135 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c1 1292166398 MMWCVZVKYAXDNW-QHCPKHFHSA-N 445.563 4.241 10 10 IICE CC[C@@H]1CCc2nc(O)c(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)cc2C1 1292382880 WMDCAFHFWGQIQW-GCJKJVERSA-N 437.584 4.190 10 10 IICE CCOc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1297009154 CGCQVEVEVARNLU-KRWDZBQOSA-N 443.975 4.021 10 10 IICE COC(=O)/C=C\c1ccc(OCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)c(OC)c1 1307289045 JUAMQZNUCLVMSA-POHAHGRESA-N 438.455 4.085 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H](CCC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1351112134 YJTGJVWXXAKEJB-OAQYLSRUSA-N 433.593 4.063 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC(F)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1361045822 LGXKUWPCFVPYMH-UHFFFAOYSA-N 425.552 4.308 10 10 IICE CN1CCN([C@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c2ccccc2)CC1 1442444890 FXFCHINZWPEOLD-SANMLTNESA-N 434.628 4.060 10 10 IICE CN(c1ccc(CNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1)C1CCCCC1 1442454419 YBORRRURXQIDLJ-UHFFFAOYSA-N 433.512 4.479 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(CN3CCOCC3)o2)cc1 1443630452 HKRKUUVUQAMLFF-UHFFFAOYSA-N 449.551 4.033 10 10 IICE Cc1cc(C(=O)NCC(=O)N(C)C2CCCCC2)c(C)n1-c1cccc(Br)c1 1446145047 SOELRKFTKJWIIH-UHFFFAOYSA-N 446.389 4.378 10 10 IICE CCOc1ccc(C(=O)c2ccccc2C(=O)NCc2cccc(O)c2O)cc1OCC 1455317567 LWKSIEFJDSRVOW-UHFFFAOYSA-N 435.476 4.056 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1c(F)cccc1F 1464076261 DTZZTSKMQKDJIM-NRFANRHFSA-N 445.510 4.447 10 10 IICE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc2c(c1)CCCN2C 1464517895 GVTMEPMBWASDBP-NRFANRHFSA-N 427.976 4.183 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)OC(C)(C)C)C(C)(C)C3)ccc21 1469054079 ASUKAMLWKGFTHQ-UHFFFAOYSA-N 443.588 4.376 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(Nc4ccc(OC)cc4OC)cc3)C2)cc1 1470019389 GZXPMYJNECEKDP-HXUWFJFHSA-N 447.535 4.465 10 10 IICE CC(C)(C)Cc1nc(-c2cccc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)c2)no1 1470446916 XUWBTLNMDBXCHG-UHFFFAOYSA-N 448.567 4.216 10 10 IICE COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1470594462 TZDWBZQXBCROTQ-HTAPYJJXSA-N 431.964 4.204 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(Cc4ccc(C(F)(F)F)cc4)C3)C2)cc1 1478859983 KBCRXVCXXJNZED-SFHVURJKSA-N 447.501 4.424 10 10 IICE COc1cc([C@@H](C)NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc2ccccc12 1479185779 UAMPIRWPMLLUET-LJQANCHMSA-N 432.568 4.161 10 10 IICE Cc1cc(C(=O)N(CCO)Cc2ccccc2)c(C)n1-c1ccccc1Br 1540691327 LDFRZOACNDAZLW-UHFFFAOYSA-N 427.342 4.491 10 10 IICE CCc1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N(C)Cc2ccccc2O)s1 1546260150 LUINMUXTUPJYSB-UWJYYQICSA-N 442.585 4.016 10 10 IICE Cc1cc(C(=O)N2C[C@@H](O)Cc3ccccc32)c(C)n1-c1cccc(Br)c1 1556414309 LVKJLBMOCULPOK-IBGZPJMESA-N 425.326 4.420 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 1559967021 RJCNTNMEBQDZJW-UHFFFAOYSA-N 429.870 4.374 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(C)CCCN2C(=O)c3ccccc3C2=O)c1C 1570560698 WHMLRIOFQIGZOH-UHFFFAOYSA-N 429.520 4.161 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CC(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cn1 1585191834 LSGZAHLGIAOVMF-LBPRGKRZSA-N 436.350 4.102 10 10 IICE COc1ccc2c(C)c(CCC(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)c(=O)oc2c1 1585263295 ARAMUUARQVQVEB-KRWDZBQOSA-N 436.552 4.164 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@](C)(CO)Cc3ccc(Cl)cc3)ccc21 1587649564 KGEXLFCSXQULSL-DEOSSOPVSA-N 428.960 4.281 10 10 IICE Cc1cc(C(=O)N2CCN(C)C[C@@H]2CC(C)C)c(C)n1-c1ccc(Br)cn1 1597372274 QNSZKJBKOZDQBQ-SFHVURJKSA-N 433.394 4.054 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3c(Br)cccc3[N+](=O)[O-])c2)CC1 1610960052 DJAACTTZRPAQOL-UHFFFAOYSA-N 447.333 4.140 10 10 IICE Cc1ccc(C(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)cc1-n1c(C)cc(C=O)c1C 1616470642 HECNHPHMBCVYIN-KNQAVFIVSA-N 436.474 4.428 10 10 IICE CC(=O)Nc1cccc2c1CCCN2C(=O)/C=C\[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1625273202 FQTCZEWBHXRPOE-SQVRQVGWSA-N 427.545 4.128 10 10 IICE COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1628531807 UVLIEMXAEDCNJG-MHZLTWQESA-N 444.531 4.172 10 10 IICE Cc1ccc(C(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1632108512 SVPDIKWGWYOWDN-JOCHJYFZSA-N 428.891 4.471 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1633194428 FYGGEMPLTSOVFJ-JTHBVZDNSA-N 430.470 4.287 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@]3(CCCOC3)C2)c(C)n1-c1ccc(Br)cc1 1634157255 ZXXXXYQCRSFQGX-OPAMFIHVSA-N 447.373 4.267 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CSC(c4ccccc4O)=N3)cc2Cl)C1 1635125826 HUQDKFHGIYRUAM-HNAYVOBHSA-N 444.000 4.460 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3N(C)C(=O)c3cccs3)C2)cc1 1638647010 YBOGJUIZULDNFJ-SFHVURJKSA-N 449.576 4.290 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4c(cnn4C(C)(C)C)c3=O)c2C)cc1F 1643757351 HTKWEZURVROZEE-UHFFFAOYSA-N 435.503 4.086 10 10 IICE COc1cc(N2C[C@H]3CCCC[C@]3(CNC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC 1652337277 VKXKRHILJXVSGJ-QRQCRPRQSA-N 435.521 4.133 10 10 IICE COc1ccc(C[C@@H]2CCCCN2C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1673822420 AYWLGABCTPNUNQ-GGAORHGYSA-N 437.584 4.337 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC/C=C/c3ccc(Br)cc3)C2)cc1 1682626894 LDXVBHPYLLPYAB-ZMUQKWFASA-N 430.346 4.049 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3cc(Cl)cc(Cl)c3F)CC2)cc1F 1684605037 VDTVNPUJGLZVSP-UHFFFAOYSA-N 430.282 4.312 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C(C)C)C1 1729150350 AJAAGNXRYSOYIF-HSZRJFAPSA-N 437.588 4.250 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@@H](C)CCSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1743546094 HBBZPRFFDMIWAU-MSOLQXFVSA-N 449.640 4.393 10 10 IICE CC(C)[C@H]1OCCC[C@@H]1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1750692079 CBHCCKVWGKXIQH-ZJSXRUAMSA-N 435.572 4.057 10 10 IICE Cc1nc(Cc2nnc(N(C)CC(F)(F)F)n2CCCSc2nccs2)cs1 1762263501 XNOCJAKNHZALBI-UHFFFAOYSA-N 448.565 4.271 10 10 IICE CCC[C@H](Cn1c([C@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1763859478 XFSTXCGYHBRMSC-DENIHFKCSA-N 429.609 4.332 10 10 IICE CCCO[C@H]1CCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)CC1 1766319055 KQZDHRFCVDWDHP-QFIPXVFZSA-N 436.604 4.481 10 10 IICE COc1ccc(OCCCOc2cn(CCCOc3ccc(N)cc3)c(C)cc2=O)cc1 1857916496 XQCUYKHPOULXEG-UHFFFAOYSA-N 438.524 4.065 10 10 IICE CC[C@@H](C)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858596646 YDAVXLYUGDVGAD-HNXWREMNSA-N 432.336 4.289 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(CCNCc2cc(Br)cc(F)c2O)C1 2205241129 LWFDDKJSSLFSNH-VBKZILBWSA-N 443.357 4.421 10 10 IICE O=C(CN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2296883531 XPPAJYDJRLFZIW-UHFFFAOYSA-N 433.898 4.088 10 10 IICE COc1ccc2c(c1)c(C=C1SC(=S)N(c3ccc(CC(=O)O)cc3)C1=O)cn2C 2321585753 CHIPBYGAUXPJIZ-UHFFFAOYSA-N 438.530 4.220 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](CC2CC2)NC(=O)OC(C)(C)C)c(O)c1Br 2381135638 UEUQZPIFVUNFHB-OAHLLOKOSA-N 441.366 4.115 10 10 IICE CS(=O)(=O)Nc1cccc(C(=O)N[C@H](c2ccccc2)c2c(O)ccc3ccccc23)c1 10914222 UFHMNNIQRMBSSZ-XMMPIXPASA-N 446.528 4.436 10 10 IICE O=C1/C(=C/c2cc(Br)ccc2O)SC(=S)N1c1ccccc1[N+](=O)[O-] 20495241 AYIURXKZWSHCEQ-ZSOIEALJSA-N 437.296 4.469 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccccc3Oc3ccccc3)CC2)cc1 49512211 BYJIIEAGBGROPC-UHFFFAOYSA-N 431.536 4.040 10 10 IICE O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(O)cc1O)N2 226798545 QTLAHGOYFLVJGI-RNHFSVANSA-N 448.544 4.403 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)[C@@H]2CCCN(C3CCC3)C2)C1 436026700 KBYRJOHCBPFQTA-NHCUHLMSSA-N 436.644 4.177 10 10 IICE CC(C)OC(=O)N1CCC(NC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1 732995025 JYPSPZHCSNXXCU-UHFFFAOYSA-N 430.593 4.264 10 10 IICE C[C@H](NC(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1)c1ccc(N2CCOCC2)cc1 743564748 PDYMEJXURBYTMK-GREBRCKQSA-N 442.629 4.028 10 10 IICE O=C1C[C@@H](N2CCO[C@@H](c3ccco3)C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 753976815 AYINAQMLBQXWMX-IFMALSPDSA-N 430.464 4.400 10 10 IICE COc1ccc(S(=O)(=O)Nc2cccc(CN[C@H](C)c3cc(F)cc(F)c3O)c2)cc1 756582359 HQLVXKACCQHDPF-CQSZACIVSA-N 448.491 4.331 10 10 IICE C[C@H](NCCOc1ncccc1F)c1cc(Br)cc(Br)c1O 756759051 HUGTWXOMWGUMTC-VIFPVBQESA-N 434.103 4.181 10 10 IICE Cc1cc(CCNC(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)c(C)n1-c1ccccc1 759516894 JXIVDMPKTVDORA-UHFFFAOYSA-N 443.544 4.142 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cc(-c2ccccc2)nn1CC(C)C 761882853 ZIGSBIKHZGOAKV-UHFFFAOYSA-N 447.583 4.259 10 10 IICE COc1c(NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cccc1C(N)=O 800555891 BZNIXQNDBWVIAS-CQSZACIVSA-N 430.936 4.006 10 10 IICE NC(=O)c1ccc(NCc2ccc(OCc3ccccc3)cc2O)c(OCC(F)F)c1 811515619 AUAURBRBTNRRNH-UHFFFAOYSA-N 428.435 4.326 10 10 IICE COc1ccc(N(C)C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cc1 1130571766 OWNJIXHGPLTSGV-GHRIWEEISA-N 432.592 4.401 10 10 IICE COc1ccc([C@H](CC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)NC(C)=O)cc1 1132264166 KNOAEAMVUCUQBZ-VWLOTQADSA-N 433.552 4.295 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1 1135800448 GMPSZHTULCYCQI-MOHJPFBDSA-N 429.520 4.309 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 1155133667 BNUYVSJYVRCKCC-HSZRJFAPSA-N 425.916 4.351 10 10 IICE Cc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1-n1c(C)cc(C=O)c1C 1158717794 RKLZEUURXCCSRQ-SANMLTNESA-N 446.595 4.314 10 10 IICE Cc1cc(C(=O)Nc2ccccc2-n2cncn2)c(C)n1-c1ccc(Br)cn1 1290680000 FEYILNOCNBMWRV-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)C1 1302669495 RKFWQSNDPSBANY-NRFANRHFSA-N 438.645 4.428 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H]3C(C)C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1304196627 ULZILMVRVNLKAW-QHCPKHFHSA-N 448.615 4.456 10 10 IICE CC1CCN(c2ccc(Cn3c(N4C[C@@H](C)O[C@H](C)C4)nnc3C(C)(C)C)cc2)CC1 1305065202 GQUYUMVFHVQGSY-WOJBJXKFSA-N 425.621 4.474 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1306270282 AAFLMDZMEWKICH-IIBYNOLFSA-N 439.583 4.018 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)c1ccco1 1313685470 RJWJPGKEJUBHDS-UHFFFAOYSA-N 446.555 4.222 10 10 IICE CC(C)Cc1nnc(N(C)[C@@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1359777252 FHSVDDYVAKCUSJ-NZQKXSOJSA-N 425.621 4.376 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(-c3cnc[nH]3)cc2)NC(=O)OC(C)(C)C)cc1 1444512005 RIJPJJIVNLMDNR-QFIPXVFZSA-N 449.555 4.139 10 10 IICE CC[C@@]1(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)CCNC1=O 1457573933 INPXRWGGUHVIGS-XMSQKQJNSA-N 433.474 4.214 10 10 IICE Cc1cc(C(=O)NCC(C)(C)c2ccccn2)c(C)n1-c1ccc(Br)cn1 1468172681 SFRJIPVVPMQFCV-UHFFFAOYSA-N 427.346 4.354 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1 1478841171 QKLVXJAFTHALAZ-VQIMIIECSA-N 437.510 4.254 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(Cc2ccncc2)Cc2cccs2)N(C)C)cc1 1479535678 YLFVYTWYCLINQD-QHCPKHFHSA-N 437.613 4.224 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CC(C)(C)CN1CCCC1 1503488938 HQCDRBQILHZVJD-UHFFFAOYSA-N 425.621 4.475 10 10 IICE COc1ccc(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(Cl)c1OC 1515925226 KCUCXJHCFZGCPN-UHFFFAOYSA-N 435.863 4.314 10 10 IICE C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1531196622 QNQOPAGPHIMWAW-KKYPHGRXSA-N 446.491 4.216 10 10 IICE Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1539707407 RMRXAFSSBUTBKT-JOCHJYFZSA-N 440.588 4.441 10 10 IICE Cc1cc(C(=O)Nc2cnn(-c3ccncc3)c2)c(C)n1-c1ccc(Br)cn1 1542798790 LIHFTOKHFUXOMX-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CC[C@H](Nc3ncccn3)CC2)cc1 1543541210 PWLPZZXHZCRSQV-MEMLXQNLSA-N 433.556 4.335 10 10 IICE COc1ccc(OC)c([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1566331672 MYBJNJPDPFZZEG-OAQYLSRUSA-N 428.916 4.228 10 10 IICE Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NCc2cc(Cl)ccc2O)c1 1583816078 BXFMCFGKPKJHRG-UHFFFAOYSA-N 444.940 4.393 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(O)c(Cl)c1 1596820485 WRGDCWTUKWTDFL-SXGWCWSVSA-N 436.917 4.415 10 10 IICE CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1598277622 UFZGYNHLCDDRLH-FQEVSTJZSA-N 433.518 4.342 10 10 IICE C[C@H](N[C@@H](C)c1ccc(F)cc1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1616806682 CGXYISIVVYKEJS-KBPBESRZSA-N 434.442 4.418 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccsc2)cc1F 1617667068 ITDZOCPFFCFNAA-UHFFFAOYSA-N 436.560 4.215 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C3CC3)C3CN(C(=O)OC(C)(C)C)C3)ccc21 1631415514 JXNJVNPBCOVQRT-UHFFFAOYSA-N 441.572 4.128 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(F)c(N3CCCNC3=O)c2)cc1 1638306334 WSZLAOCZGWYELH-UHFFFAOYSA-N 448.498 4.147 10 10 IICE C[C@@H](CCO)n1c(C(F)(F)F)nc2cc(NC(=O)/C=C/c3ccc(O)c(O)c3)ccc21 1641011074 JGMZNHXISYIZLY-QBODLPLBSA-N 435.402 4.062 10 10 IICE Cc1cccc2c1C[C@@H](NC(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CO2 1641114869 ULSYFJOWEDIJPJ-QGZVFWFLSA-N 440.341 4.294 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(OC(F)(F)F)c(Cl)c1 1641203609 HVJNDMWYIFQECZ-UHFFFAOYSA-N 428.838 4.130 10 10 IICE CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1c(O)ccc2ccccc12 1647788583 JTHOHQYHXRCPES-QHCPKHFHSA-N 429.520 4.026 10 10 IICE CC(=O)N[C@H](CC(=O)NCc1c(O)ccc2ccccc12)c1ccc(Br)cc1 1647788594 KLSGIUKCERVXBN-HXUWFJFHSA-N 441.325 4.192 10 10 IICE CCOCCN(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1649664437 WSNYETSEZWGQLX-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CN(C)c1ccc(CN2CCN(C(=O)c3ccc(OCc4ccccc4)cc3)CC2)cc1 1652370047 RMQOWUHORIQLLX-UHFFFAOYSA-N 429.564 4.290 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC[C@H]([C@H](O)c3ccc(Br)cc3)C2)c1O 1654609285 SIHQREIZQIHTML-MGPUTAFESA-N 436.321 4.442 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCc2ccccc2SC(F)(F)F)N(C)C)cc1 1676653607 SLUUUPMCBKZVKQ-GOSISDBHSA-N 440.535 4.467 10 10 IICE C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1684168846 GQEBBULUSUHMTK-NTKDMRAZSA-N 434.584 4.071 10 10 IICE Cc1cc(CNC(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c(C)n1-c1ccccc1 1686491378 CBHKSPGYZCOAFP-OALUTQOASA-N 430.552 4.260 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CC[C@@H](SCC)C2)n1Cc1ccc(N(C)C)cc1C 1696241875 MUGHMXDHXRDIHE-NHCUHLMSSA-N 431.650 4.348 10 10 IICE CCc1nnc(N2CCC(CCCO)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1709083937 JQXSOSDNIXKZLZ-UHFFFAOYSA-N 425.621 4.114 10 10 IICE CCOCc1nnc(N2CCO[C@@H](c3ccccc3)C2)n1CCCSc1nccs1 1710750302 ZVZAGACGQDDAKS-GOSISDBHSA-N 445.614 4.031 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CC[C@H]1CCN(C(=O)OC(C)(C)C)C1 1767111944 KYSCRCXUTYUSOB-QGZVFWFLSA-N 441.576 4.145 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3c[nH]c4c(Cl)cccc4c3=O)cccc21 1866071408 FCEVFSSGQLMEJY-UHFFFAOYSA-N 428.831 4.209 10 10 IICE CCc1cccc2c(=O)cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)[nH]c12 1866488288 PPJVYIVFHILJRC-DEOSSOPVSA-N 446.595 4.114 10 10 IICE CC[C@H](C)NCc1ccc(N(C)C[C@H](O)COCc2ccccc2)c(Br)c1 2239998885 IIYVCRKNQZDOTM-PXNSSMCTSA-N 435.406 4.351 10 10 IICE O=C(NN1C(=O)C(=Cc2c(Cl)cccc2Cl)SC1=S)c1ccccc1O 2297320147 VYULSCJENNCUES-UHFFFAOYSA-N 425.318 4.245 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(SC4CCCCC4)o3)C2=O)cc1 2297348269 ZXIOUTOODJHVMF-UHFFFAOYSA-N 426.494 4.379 10 10 IICE Cc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)C3(CC3)C2)c(O)c1Br 2352688303 UDDRUKADATVWED-HNNXBMFYSA-N 425.367 4.485 10 10 IICE COc1ccc2nc3cc(Cl)ccc3c(NCCCn3cnc4c(N)ncnc43)c2c1 31458401 GHRJAYKJSUGEHG-UHFFFAOYSA-N 433.903 4.274 10 10 IICE Cc1ccc(C)c(NC2=NC(=O)/C(=C3/C(=O)Nc4ccc(Br)cc43)S2)c1 39556022 LNMCRXSSZDCDJN-NXVVXOECSA-N 428.311 4.471 10 10 IICE Cc1ccc(C(=O)NN2C(=O)/C(=C\c3ccc(O)c(Br)c3)SC2=S)cc1 40940492 CEPBZXJUMJHFMD-OQLLNIDSSA-N 449.351 4.009 10 10 IICE C[C@@H](SCC(=O)Nc1ccnn1Cc1ccc(N(C)C)cc1)c1nc2ccccc2[nH]1 98080430 DWCWLYOOMLQDNK-MRXNPFEDSA-N 434.569 4.307 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccc(C)cc3C)=NC2=O)ccc1OCC(=O)O 210461242 HCPSGOAEKBROPW-ODLFYWEKSA-N 426.494 4.248 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(N(C)C)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526362316 BMNVTDYQSNLULF-HSZRJFAPSA-N 432.476 4.230 10 10 IICE COc1cccc(CNC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)c1O 727761253 QBIALAZTQKBBLT-QGZVFWFLSA-N 439.339 4.169 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)Cc1c(C)nn(-c2ccc(C(F)(F)F)cn2)c1C 734405819 LXZULJCQAHKWRC-UHFFFAOYSA-N 445.489 4.136 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc(-c2ccncc2)s1 742801061 XOFVPEXOQFGIRE-OAHLLOKOSA-N 430.480 4.205 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H]1C[C@@H]1C1CCCCC1 743554428 DTPGPBIDZQYNNA-UYAOXDASSA-N 425.495 4.310 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c([N+](=O)[O-])c1 747621047 SCQGPHVMFLTYBI-ZLQZBKBYSA-N 436.386 4.378 10 10 IICE COC(=O)[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)c1c(F)cccc1Cl 751931141 MMLTXBCJRWRHOL-SFHVURJKSA-N 434.876 4.180 10 10 IICE C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754643898 YVAILXYCFZCKTN-INIZCTEOSA-N 433.499 4.235 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC2([C@H](O)c3ccccc3)CC2)C1 768096653 CZNVHJHUZDDATL-AREMUKBSSA-N 431.580 4.038 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCOc2c(Cl)cccc21)c1ccc(N2CCOCC2)cc1 775729245 SLRWEIDAPANYHA-HRAATJIYSA-N 429.948 4.451 10 10 IICE COc1ccc(-c2nc3c(s2)[C@H](NC(=O)NCc2ccc(OC)cc2O)CCC3)cc1 793001738 QHIUCWKPAKMFJV-LJQANCHMSA-N 439.537 4.410 10 10 IICE CS(=O)(=O)CC[C@@H]1CCCCN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 794754405 TWYUOYJKEMWJRC-NRFANRHFSA-N 428.558 4.330 10 10 IICE CC(C)c1noc2ncc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)cc12 917715749 UMAVFQHDQMHBBO-HUUCEWRRSA-N 426.492 4.029 10 10 IICE C[C@H](CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)n1cc(Br)cn1 1125089786 HVJNZCIBTCSDEO-GFCCVEGCSA-N 438.281 4.011 10 10 IICE CCOC(=O)[C@](C)(NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)c1cccnc1 1128828014 CBRVZMHZSOCTSH-HSZRJFAPSA-N 425.916 4.351 10 10 IICE C[C@H](C(=O)NCc1cccc(Br)c1O)N1CCC(Cc2ccccc2)CC1 1156793545 ZDJVXRKQLSPGRY-MRXNPFEDSA-N 431.374 4.114 10 10 IICE Cc1cc(CC(=O)N2CC(O)(c3ccc(Br)cc3)C2)c(C)n1-c1ccccc1 1167030075 GPNZCSRWEKCMAR-UHFFFAOYSA-N 439.353 4.129 10 10 IICE COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1233603431 DKVPKCBAOPKBIL-DVECYGJZSA-N 437.584 4.339 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(NCc4ccsc4)cc3)CC2)cc1F 1294825202 UFWPLZCXMXEFDW-UHFFFAOYSA-N 425.529 4.470 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)CCC(C)C)nnc1[C@]1(OC(C)C)CCOC1 1304240315 JSMAOPIQPLHQMA-VWLOTQADSA-N 443.636 4.224 10 10 IICE C[C@@H]1CCCN(c2cc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)ccn2)C1 1355130904 PWKNMYJJBGHXGC-GUDVDZBRSA-N 440.563 4.001 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1C[C@@]12CCCN(C(=O)OC(C)(C)C)C2 1356267720 RVDLTMDRAFAHND-SQJMNOBHSA-N 427.589 4.282 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)CCCC1 1357203936 HYGGKCQHFXHHEU-UHFFFAOYSA-N 448.567 4.058 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1noc2ccccc12 1439195599 RFVKAEDQMKWECE-BOPFTXTBSA-N 443.575 4.187 10 10 IICE C[C@@H]1CCc2ccccc2N1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1440658056 IOUMTTKHXGICCW-CQSZACIVSA-N 428.535 4.236 10 10 IICE CCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1469961891 YFIVCBDLHKCMBR-UYAOXDASSA-N 449.039 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 1470555089 AYCRVZXZZGMKOM-NQIIRXRSSA-N 425.548 4.436 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC3(c4cccc(Br)c4)CCC3)C2)cc1 1470772343 JUPLVKSIXGYYAC-SFHVURJKSA-N 444.373 4.415 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1ncccc1C 1495641920 WCPVUAURJJOGLE-IBGZPJMESA-N 434.588 4.269 10 10 IICE CC[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CCS1 1514155003 HERUBHKBSRTDCA-SFTDATJTSA-N 429.634 4.274 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@@H]1COCCO1)C(C)C 1515380137 FJDDKDYGPCMNIB-JOCHJYFZSA-N 437.588 4.393 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1C)OC 1518718370 DPKLQFCCURHNCJ-LZNRXBQRSA-N 437.588 4.249 10 10 IICE Cc1cc(CC(=O)NC[C@H]2CSCCN2Cc2ccccc2)c(C)n1-c1ccccc1 1522487716 HZWOJENTAOIORT-VWLOTQADSA-N 433.621 4.370 10 10 IICE COc1ccc2sc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)c(C)c2c1 1524851134 FHOCHQRHEVGYBQ-UHFFFAOYSA-N 432.492 4.263 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](O)c1ccc(C(F)(F)F)cc1 1542704301 YARNDSDUWYPORT-GOSISDBHSA-N 444.400 4.125 10 10 IICE Cc1ncc(CN(C)c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)s1 1542955352 HCUMFUDWJZFBPL-UHFFFAOYSA-N 435.601 4.108 10 10 IICE C[C@H](CC(N)=O)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CCC2 1543524554 DQJDSUUINTULHK-KAKMCVKYSA-N 442.563 4.171 10 10 IICE CNC(=O)C[C@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 1543571770 KHHSTICTDFNHOS-PJCCXHTNSA-N 442.563 4.042 10 10 IICE CC(C)c1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cn1 1544269030 OVQRDJSXQPRQNQ-NRFANRHFSA-N 426.561 4.267 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]1C 1544412786 VZSUWJCWPGACAW-VQTJNVASSA-N 439.648 4.358 10 10 IICE CCC[C@@H](Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1546910790 ACOJQYBIIRDLRH-QHCPKHFHSA-N 441.620 4.476 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCOc1ccccc1Cl 1556426405 LNJWBRPIGIOZNV-UHFFFAOYSA-N 432.948 4.498 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCSCc1nc(O)c2ccccc2n1 1557063202 IEZLEYMXWXUCFQ-QGZVFWFLSA-N 438.597 4.081 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H](O)COc2ccc(F)cc2)cc1 1566333225 CHUGEIWDROOUJB-HXUWFJFHSA-N 436.487 4.477 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(Nc2ccccc2)nc1C(F)(F)F 1567467206 DQCCOGPYMRHRTF-LBPRGKRZSA-N 432.402 4.011 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1c(Cl)cccc1Br 1587456020 APKBHMDHCXRMKS-UHFFFAOYSA-N 437.765 4.140 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2 1588227669 ADMBLCLIQHFMDU-KRWDZBQOSA-N 432.929 4.044 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCC[C@H](O)C1 1603303955 XFEZSQKBLOCHCJ-GGAORHGYSA-N 425.621 4.264 10 10 IICE COc1cc(N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)c([N+](=O)[O-])cc1OC 1611933150 XBERNPWFADHWHQ-HXUWFJFHSA-N 431.876 4.218 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3sc4ccccc4c3C)CC2)cc1 1617031193 QUWDVAIYURPSEZ-TZIWHRDSSA-N 439.625 4.052 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1 1617522088 SIWWGAJJCCTJHR-INIZCTEOSA-N 430.597 4.495 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1624819483 OLVNXCCHBSHAPT-IAGOWNOFSA-N 448.405 4.086 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)C[C@H]3CN(c4ccccc4)C(=O)O3)ccc21 1625614434 YTWJLTQMIBMWOH-NRFANRHFSA-N 435.524 4.002 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@@H]2C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1627209350 CQFSVAKDYDFCAQ-PXDATVDWSA-N 427.589 4.330 10 10 IICE Cc1cc(C(=O)N[C@H](CCO)c2cccc(OC(F)(F)F)c2)c(C)n1-c1ccccn1 1630871732 VMCYFPJWABCMPH-LJQANCHMSA-N 433.430 4.241 10 10 IICE Cc1ccc(C(=O)N[C@@H](c2ccccc2)c2cnn(C)c2)cc1-n1c(C)cc(C=O)c1C 1632777935 AMURPJPEMSCPDD-VWLOTQADSA-N 426.520 4.468 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(N4C[C@H](C)O[C@H](C)C4)nc3)c2C)cc1 1634526124 NLTKSHLTKOHRTA-HDICACEKSA-N 434.540 4.364 10 10 IICE COc1ncc(Br)cc1CNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1640652633 HIGHSZQERLDHJD-UHFFFAOYSA-N 428.330 4.499 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnc4sc(C)c(C)c4c3=O)c2C)cc1 1641016769 PFAHTSOSINKFJB-UHFFFAOYSA-N 436.537 4.159 10 10 IICE Cc1ccc(C(=O)NC[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1642844269 MTNQDEHHZURGJD-RVWIWJKTSA-N 439.556 4.248 10 10 IICE CN(C(=O)c1ccc(Br)o1)c1ccccc1C(=O)N1Cc2cccc(O)c2C1 1644088420 UHMMRYVXEJKTEQ-UHFFFAOYSA-N 441.281 4.180 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H](c4ccc([N+](=O)[O-])cc4)C3)C2)cc1 1682188667 XXKYGJAYFIGPHK-UYAOXDASSA-N 438.528 4.019 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(CCc3ccccc3F)C3CCCC3)cc2)CC1 1683702174 YHYIYICMBDDHHJ-UHFFFAOYSA-N 438.591 4.274 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@H]1COC(=O)N1CCCCC1 1686826378 GZINCSPCNFMNOW-REWPJTCUSA-N 444.620 4.179 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H]([C@@H]3CCCO3)C2)n1Cc1ccc(N(CC)CC)cc1 1708559983 RCMLGSUGLCIBRR-AJSBUHFISA-N 441.620 4.070 10 10 IICE CC[C@@H](C)c1nnc(N(C)OC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726891537 HNZKIJRRIAZXNE-LJQANCHMSA-N 441.620 4.359 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1728381511 HRKZFYFTMNKLFH-KNQAVFIVSA-N 441.620 4.418 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1730853572 BYILYPALTIPHDR-LEWJYISDSA-N 441.620 4.275 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@](C)=O)CC1 1764944615 HJLQGJSXPGQWDS-PMERELPUSA-N 425.602 4.110 10 10 IICE COC1(C)CN(c2nnc(-c3ccc(Cl)cc3)n2CCCSc2nccs2)C1 1769737549 HOIYDGSADMCWNM-UHFFFAOYSA-N 436.006 4.463 10 10 IICE COc1cc(N2CCN(C(=O)c3cccc(-c4ccccc4)c3)CC2)cc(OC)c1OC 1857945049 PWXPTFUVWRKYCX-UHFFFAOYSA-N 432.520 4.342 10 10 IICE CC(C)C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858592308 MSUMLZKUNSXYGU-FIKOHSHLSA-N 432.336 4.289 10 10 IICE COc1cc(N2C(=O)/C(=C\c3c(C)nc4ccccn34)SC2=S)cc(OC)c1OC 1860087860 WYNXRDLBNCQYNY-GZTJUZNOSA-N 441.534 4.074 10 10 IICE CCCOc1cn(CCOCCO)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1871108710 YAMQKTGEHLFKSG-UHFFFAOYSA-N 437.540 4.002 10 10 IICE Cc1cccc(CNC(=O)Cn2c3c(c4ccccc42)CCn2c-3nc3ccccc3c2=O)c1 1873875021 QIDQOFTYSICSEN-UHFFFAOYSA-N 448.526 4.199 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(-c2ccc3c(c2)CCO3)[nH]n1 1874179231 UTFZOMVAOOLHBW-UHFFFAOYSA-N 435.439 4.039 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2CCC2)c(C(=O)O)c1I 2079003359 AKGFTQHIMOKLQX-ZDUSSCGKSA-N 440.281 4.467 10 10 IICE COC(=O)c1c(C(C)(C)C)nn([C@@H](C)c2ccc(C)cc2O)c1I 2079034881 UTEGLIPDQARREX-NSHDSACASA-N 442.297 4.195 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(NCc2cc(Br)ccc2O)C[C@H]2CC[C@H]1C2 2131762160 ZNZGELWXWGHENZ-ZQGRQUNCSA-N 425.367 4.328 10 10 IICE O=C1NC(=S)SC1=Cc1cc(Cl)ccc1OCCOCCOc1ccccc1 2297306594 WIJBWPRJKXYKCZ-UHFFFAOYSA-N 435.954 4.303 10 10 IICE COc1ccc(/C=C2\C(=N)N3C(SCc4ccccc4)=NSC3=NC2=O)cc1OC 4642051 HRUKXBQILQUJLR-BXODQFHZSA-N 438.534 4.214 10 10 IICE CCN(CCO)CCNc1cc(N2CCC[C@@H](C)C2)c2noc3c2c1C(=O)c1ccccc1-3 20322093 SZMZKEKREKRMBX-QGZVFWFLSA-N 448.567 4.002 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc4ncccc4c3)n2)cc1OC 747852441 DTXKODNOISDANB-UHFFFAOYSA-N 427.507 4.176 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccccc2OCC(=O)Nc2cccnc2)c1 767193126 FMOJOQPIOZAHHR-UHFFFAOYSA-N 442.313 4.488 10 10 IICE COc1ccc2c(CC(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)coc2c1 768915878 NUZNPDGHKIAOND-GOSISDBHSA-N 428.916 4.124 10 10 IICE C[C@@H](NCc1ccc2c(c1)CCN2Cc1ccccc1)c1cccc(NS(C)(=O)=O)c1 796283000 ONLYSIVLYINEHI-LJQANCHMSA-N 435.593 4.472 10 10 IICE CN(C(=O)c1ccc(C(=O)NCc2cc(Br)ccc2O)cc1)c1ccccc1 804735978 IZLQCSQFJUEAKD-UHFFFAOYSA-N 439.309 4.361 10 10 IICE Cc1cc2cc(CNC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)ccc2[nH]1 807063737 ZIYIANSMPKYUPK-UHFFFAOYSA-N 431.584 4.008 10 10 IICE O=C(COC(=O)Cn1c(O)nc2ccccc21)Nc1ccc(N=Nc2ccccc2)cc1 919356642 FWYXLSRYVVBNRP-UHFFFAOYSA-N 429.436 4.339 10 10 IICE Cc1ccc(-c2nc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cs2)n1C 1126580482 ACZJJJQQLGVRMW-OAHLLOKOSA-N 446.523 4.457 10 10 IICE Cc1c(Cl)cncc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1129452279 JZVDCMPGNXIZSA-PXNMLYILSA-N 435.933 4.413 10 10 IICE Cc1cc2c(N3CCC[C@H]3C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)ncnc2s1 1129820042 QJHKPXJFHCWALP-KKSFZXQISA-N 437.613 4.090 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1134682142 WWYZZVGVTPMJJA-HXUWFJFHSA-N 443.954 4.072 10 10 IICE COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)C1 1136418342 FIYXOSDNNADCFR-PGRDOPGGSA-N 439.600 4.221 10 10 IICE CCCN(CCNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)C(=O)OC(C)(C)C 1137929140 DDHNTGCJFJBRQS-UHFFFAOYSA-N 427.545 4.284 10 10 IICE CCCNC(=O)CN(CCC)C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1141971066 ZRWUJPXHMGZVHV-UHFFFAOYSA-N 434.378 4.235 10 10 IICE O=C(NCc1cc(Cl)ccc1O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1 1146233558 WAIXMCPVLJZERR-LDADJPATSA-N 437.912 4.075 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CCCN(C(=O)NC4CCCC4)C3)c2C)c1 1151152841 FYIKCWFIDGWDQO-OAQYLSRUSA-N 436.600 4.383 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)s1 1157071481 JYQBVKJLGLQBOL-ZIAGYGMSSA-N 443.548 4.040 10 10 IICE COc1ccc(N(C)CCN(C)Cc2nnc(-c3cc4ccccc4cc3OC)o2)cc1 1171730499 WTUDRLVTZALVDL-UHFFFAOYSA-N 432.524 4.475 10 10 IICE CC(C)(NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1F 1229782887 ZRRACQJPAMUWSA-UHFFFAOYSA-N 441.881 4.328 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC(=O)c4ccccc4O3)cc2Cl)C1 1235835837 WZHBLCISQYKUEZ-AEFFLSMTSA-N 441.959 4.410 10 10 IICE C[C@@H](CCc1ccc(I)cc1)NC(=O)N[C@H](C)c1ccccc1O 1248383906 GEVSIEFPRJOIMB-UONOGXRCSA-N 438.309 4.378 10 10 IICE Cc1cc(CCNC(=O)N2CCN([C@@H](C)c3nccs3)CC2)c(C)n1-c1ccccc1 1253808001 LUHYRHDDAPNKBM-FQEVSTJZSA-N 437.613 4.182 10 10 IICE CC(C)(C)OC(=O)N1CCCCC[C@@H]1CNC(=O)NCc1c(O)ccc2c1CCCC2 1256162842 WOESEFYELXDHLO-GOSISDBHSA-N 431.577 4.250 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cn(-c4ccc(Cl)c(Cl)c4)cn3)C2)cc1 1278861864 PSWLMLKYDKKALA-CQSZACIVSA-N 431.323 4.196 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291492282 UPACNOLUHSGYIW-HXUWFJFHSA-N 425.621 4.285 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@@H](C(F)(F)F)C1 1304071867 FYSARWMZWMYGHC-VSXLWIIGSA-N 434.530 4.140 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](COC(C)C)C1 1307014999 PHVZVHZJCARNKV-QFIPXVFZSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2C[C@H](C)O[C@H](C)C2)cc1 1313680740 OJYKDJQPRXSJDJ-BGYRXZFFSA-N 434.588 4.157 10 10 IICE CCC1(CC)[C@@H](N(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)C[C@H]1OC 1357356064 LCVFGMDEVDWHBD-BJKOFHAPSA-N 425.617 4.460 10 10 IICE Cc1cc(CC(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1360214568 MKQBYMVDQNKDJI-HXUWFJFHSA-N 425.573 4.400 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCSC2(CCOCC2)C1 1361097590 DQHANNHIGXPPRX-UHFFFAOYSA-N 443.661 4.002 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)c(I)cc1Cl 1434914958 MSMMNPUHIWGPLF-UHFFFAOYSA-N 446.691 4.388 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(c3ccc(Cl)cc3F)C2=O)c(C)n1-c1ccccc1 1438303775 MWLFFGASYUIJJD-NRFANRHFSA-N 439.918 4.351 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(C(F)F)nc1 1440239343 SQNCVXWUDFBNHY-OQLLNIDSSA-N 437.468 4.388 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN[C@@H](c3ccc(Cl)cc3)C2)cc1 1454267350 QQPXPPDPVJCYKS-XMMPIXPASA-N 435.955 4.276 10 10 IICE CCO[C@@H](CCn1c(-c2cnccn2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1516104661 FSMVZGXMTMPZHK-QFIPXVFZSA-N 436.560 4.063 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H](OC)C1 1516727017 ITFFRVHNRXJHGG-FDDCHVKYSA-N 437.588 4.250 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccnc(OCC(F)(F)F)c2)C1 1520345464 CKGKYXDLKWIMJB-UHFFFAOYSA-N 446.473 4.383 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(CC(C)C)C2)sc(C)c1-c1ccc(F)cc1 1525141568 SJIVHSDTHLTDIT-INIZCTEOSA-N 446.544 4.482 10 10 IICE Cc1sc(Br)nc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1530287991 OBLWIRJUZJROBN-UHFFFAOYSA-N 446.317 4.214 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CC(C)(C)NC(=O)OCc1ccccc1 1536550752 UJANUKBEBOUTFQ-IBGZPJMESA-N 425.573 4.203 10 10 IICE CC(=O)CCc1ccc2oc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c(C)c2c1 1537477555 CYRIINGMVPCRHR-HSZRJFAPSA-N 435.568 4.362 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)N(C)C)cc1 1537482978 KGOLXVCAKKYIHN-GOSISDBHSA-N 429.433 4.439 10 10 IICE CCN(CC)C(=O)COc1cccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1540817394 SEEYACJQKWHIES-UHFFFAOYSA-N 447.535 4.406 10 10 IICE CC[C@@H](C)c1nnc(N2CCC([C@H]3CCCO3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545416098 WDBVRFBFMUZRJL-VGOFRKELSA-N 429.584 4.440 10 10 IICE CN(CCc1ccccc1C(=O)NCc1ccc2cccnc2c1O)C(=O)OC(C)(C)C 1557123994 SFPFUGMVXUNVEU-UHFFFAOYSA-N 435.524 4.280 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1564555643 WZKANWHFGCUGBF-LNXUECGXSA-N 441.591 4.204 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCCCC[C@H]1NC(=O)OC(C)(C)C 1568737662 IAISXSKUCDUYOY-DLBZAZTESA-N 425.566 4.358 10 10 IICE COc1cccc(C)c1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1586274325 NLDCVISQJRYAPD-SFQUDFHCSA-N 430.526 4.373 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1ccc(Cl)c(Cl)c1 1595436045 QVUHTQLWSLWVBA-PGRDOPGGSA-N 446.378 4.429 10 10 IICE C[C@H](NC(=O)c1cc2cc(Br)sc2[nH]1)c1ccc(N2CCOCC2)cc1 1597908074 LKNVQGHGPLOHDF-LBPRGKRZSA-N 434.359 4.320 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3OCCN(C4CC4)[C@@H]3c3ccccc3)cc2)CC1 1614600709 JETWQEAODWZQGS-FTJBHMTQSA-N 433.596 4.144 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccc4)nc3)cc2F)C[C@@H](C)O1 1625090766 YAOJPPYTGAOMII-RTBURBONSA-N 449.526 4.343 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCCO[C@H](CNC(=O)OC(C)(C)C)C2)c1C 1626015071 QEYHGKIYJRJDPO-HXUWFJFHSA-N 441.572 4.158 10 10 IICE Cc1cncc(/C=C/C(=O)N2C[C@@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)c1 1626448347 QYJMUZYOLADFJM-KRZKXXONSA-N 425.504 4.273 10 10 IICE CC(C)(C)OC(=O)N[C@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1629136994 SFZQJRRXAUAYBT-QMMBQJITSA-N 429.344 4.255 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1oc2ccc(Br)cc2c1C 1630481735 ZHUGCPQPUCLFAP-UHFFFAOYSA-N 446.297 4.415 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)c(C)n1-c1ccc(C(C)C)cc1 1632946091 LIOFBNPKDIGCHI-UHFFFAOYSA-N 429.524 4.354 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1640569521 BQJFVDBULJXWGC-WZONZLPQSA-N 434.536 4.253 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCc1ccccc1F 1641713946 CZRFXLMXAGNQAS-INIZCTEOSA-N 430.479 4.103 10 10 IICE COC(=O)[C@H](CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C1CCCCCC1 1646224866 XWUJMKOMSUTXGA-XMMPIXPASA-N 438.568 4.325 10 10 IICE CCCN(Cc1ccccc1O)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1653476307 UUOFXFRFANSEGG-KRWDZBQOSA-N 442.515 4.407 10 10 IICE C[C@H](N[C@@H](CF)c1ccc(F)cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1655389544 MJWZDFJXWYQCES-QKKBWIMNSA-N 434.442 4.229 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CS[C@H](C)C(=O)NCC(=O)OC(C)C)c2C)c1 1656632196 FRYVULRMNFPBFI-LJQANCHMSA-N 444.597 4.083 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@@]3(C)C3CCCCC3)cc2F)C[C@@H](C)O1 1659918959 UDCFRSPRVNIMBM-RRQZXNHTSA-N 431.596 4.100 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCC1 1680665633 LIKHQTKIODJTCJ-OAQYLSRUSA-N 432.609 4.368 10 10 IICE CCC1(CC)CN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)CCS1 1708872885 OZTAXMZQHWHLNL-HXUWFJFHSA-N 443.661 4.317 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@](C)(O)c2cc(C)oc2C)n1 1724477659 BVQQDKXMKNZFDR-VWLOTQADSA-N 447.539 4.108 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@H](OCC(C)C)C2)cc1 1728380147 OOHNGCWPTYSASP-QHCPKHFHSA-N 448.615 4.486 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@](C)(OC)C1 1748382354 YTMYHMWWEYSMEF-DFBJGRDBSA-N 437.588 4.393 10 10 IICE C[C@H]1COC(C)(C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1750355346 LGFZEANBQCDYGG-SFHVURJKSA-N 443.661 4.181 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@@H]3C)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1751408808 OFWLYBQZGOEAER-HKUYNNGSSA-N 434.588 4.112 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)[C@H](C)C1 1760822974 ORYLVHKNCFMILF-HXUWFJFHSA-N 446.599 4.376 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1763290153 JOQPCWTUHMOWMT-JKSUJKDBSA-N 446.671 4.233 10 10 IICE CCc1c(OCCOc2ccc(N)cc2)c(=O)ccn1C1CCN(Cc2ccccc2)CC1 1857913325 DJCLLQPQKQTZPR-UHFFFAOYSA-N 447.579 4.288 10 10 IICE CCOc1cccc([C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c1O 1951403763 VKLYXMOCVSQJRO-JOCHJYFZSA-N 433.460 4.455 10 10 IICE CCN1CCc2cc([C@H](O)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999501442 AZNVCPJMWFXVGJ-GMAHTHKFSA-N 426.557 4.213 10 10 IICE COc1ccc(NCc2cc(Br)ccc2O)cc1I 2265712857 KYEPOIQLPLOFJU-UHFFFAOYSA-N 434.071 4.380 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352683306 GPVRGWGQPLIABY-JONQDZQNSA-N 425.367 4.245 10 10 IICE Cc1ccc(CN(C)[C@@]2(C(=O)O)CC[C@@H]2OCc2ccccc2)c(O)c1Br 2381129526 LHWIYRLATLGCPB-UWJYYQICSA-N 434.330 4.098 10 10 IICE CCOC(=O)COc1ccccc1/C=C1/SC(=S)N(CCCc2ccccc2)C1=O 33448843 DNBRADFYALKYBG-HMMYKYKNSA-N 441.574 4.463 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCC(=O)Nc3ccc(F)cc3)C2=O)ccc1O 210693957 LWPYIKNNLVXPRT-LDADJPATSA-N 446.525 4.160 10 10 IICE CCCNC(=O)c1ccc(NC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 586692346 LLYWLJLSOKEOLA-UHFFFAOYSA-N 427.460 4.246 10 10 IICE CC(C)CNC(=O)c1ccc(NC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 586693391 PPZUZGCHZCSIOF-UHFFFAOYSA-N 441.487 4.492 10 10 IICE O=C(O)/C=C\c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)cc1Br 705929747 IEAMOZGPYMJVRV-BDNAOYLZSA-N 427.342 4.115 10 10 IICE C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726567842 QRZKLIBPSLTKTQ-YCRPNKLZSA-N 443.494 4.281 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)c1cc(OC)ccc1OC 745340360 XIJDCRCTJYBPBT-ZDUSSCGKSA-N 437.334 4.465 10 10 IICE COc1ccc(CC2CCN(C(=O)NCc3ccc(N4CCSCC4)cc3)CC2)cc1 749933042 LKMHUPNHKCFJQL-UHFFFAOYSA-N 439.625 4.413 10 10 IICE O=C(Nc1ccnn1C1CCCCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769755250 VMNHHLMPEYKILA-UHFFFAOYSA-N 446.554 4.209 10 10 IICE Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 772402923 DIVCSTPDMQYNKQ-MRXNPFEDSA-N 438.311 4.310 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)cc1 772688119 NZFWPFDYVKCNGI-QHCPKHFHSA-N 448.615 4.410 10 10 IICE CC[C@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1cc(Br)ccc1O 775497142 NDURYDJVAKYJLB-SJCJKPOMSA-N 427.364 4.328 10 10 IICE C[C@@H]1C[C@H](COC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 782676818 LRRXRPMXMFVJFR-FWEMMINBSA-N 425.597 4.088 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)no1 802692032 GOZMYDVJJNBILA-JOCHJYFZSA-N 446.555 4.464 10 10 IICE CCc1ccc([C@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 822074030 RZQHQQGRCWRVOY-AWEZNQCLSA-N 428.444 4.424 10 10 IICE Cc1cc(CNC(=O)C2CCN(C(=O)COc3ccccc3)CC2)c(C)n1-c1ccccc1 1132048086 IMQQVXYSTMXABY-UHFFFAOYSA-N 445.563 4.028 10 10 IICE CCN1CCN(c2ccc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)cc2)CC1 1135777893 UZLZPSKJGLBICU-UHFFFAOYSA-N 432.568 4.497 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4c(Br)cccc4[nH]3)CC2)cc1 1151502932 DNCAGNPEJIHANB-UHFFFAOYSA-N 428.330 4.292 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H]3CCC[C@H](C(C)C)CC3)CC2)cc(OC)c1OC 1235062332 XYPZEYNBPOIPPR-RBUKOAKNSA-N 433.593 4.149 10 10 IICE C[C@@H](NC(=O)[C@@H]1CCOc2ccc(Br)cc21)c1ccc(N2CCOCC2)cc1 1264822323 NJLVDXAQMCUTMJ-DNVCBOLYSA-N 445.357 4.029 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC[C@@H]1CCCS1 1287354386 LGOFVMXZMNEVBW-UESPBHMZSA-N 426.654 4.131 10 10 IICE Cc1cc(CCNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)c(C)n1-c1ccccc1 1287468311 FCDPPWPODPJMDJ-UHFFFAOYSA-N 447.470 4.300 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(C(C)C)c(C)c3)CC2)c(OC)c1 1287478361 QUIVIKXDUWPPLT-IBGZPJMESA-N 426.557 4.252 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2CC2(O)CCC2)c(C)n1-c1ccccc1 1289353201 MHDQWXFRXLHRAE-UHFFFAOYSA-N 433.478 4.266 10 10 IICE CCOc1ccccc1N1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CC1 1290102362 JLXBTYLGJSDSKY-UHFFFAOYSA-N 445.563 4.197 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1297371857 OCCWZUFGBJBYFE-JOCHJYFZSA-N 448.615 4.488 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1)OC 1305806292 FLIZDSKDEGJLFJ-FGZHOGPDSA-N 437.588 4.393 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccc(N(C)C)cc1 1312530546 DQEDSXKJWHYELM-CRAIPNDOSA-N 439.510 4.270 10 10 IICE Cc1cn2c(=O)cc(CN3CCCc4cc(CNC(=O)OC(C)(C)C)ccc43)nc2s1 1459463177 HWUXBIQSMWJIHP-UHFFFAOYSA-N 440.569 4.042 10 10 IICE CCOC(=O)c1sc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)nc1C 1465639274 OSPMEGXXCDZPDG-UHFFFAOYSA-N 439.537 4.087 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC[C@H]3CN3C[C@H](C)O[C@H](C)C3)c2C)c1 1471036774 ZKKGWRAUHJUIML-BKSPAHHJSA-N 438.616 4.186 10 10 IICE CCCN1CCC(N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1500963892 IHFDHNXNRNYAKP-UHFFFAOYSA-N 430.616 4.140 10 10 IICE Cc1ccc(-c2nnc(N3CCO[C@@H](C(F)(F)F)C3)n2Cc2ccc(N(C)C)cc2C)o1 1510826485 QTTNUQSMMYODNR-LJQANCHMSA-N 449.477 4.037 10 10 IICE Cc1cc(CCNC(=O)c2cc(F)c(N3CCOCC3)c(F)c2)c(C)n1-c1ccccc1 1534247491 LFLMDMIXDWSGGK-UHFFFAOYSA-N 439.506 4.181 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)nc1C 1540166862 QDLOKQSOYFEGBO-VBKFSLOCSA-N 447.607 4.470 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nn4c(c3Br)CCC4)c2C)c1 1544080325 MJMZVALSBJSPJO-UHFFFAOYSA-N 427.346 4.238 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(Br)ccc1C1CC1 1544538903 WDQNGDXOXMFFRK-UHFFFAOYSA-N 443.385 4.465 10 10 IICE CCN1C[C@@H](C)N(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1547644211 DWNBOZRFNNEXRC-QZTJIDSGSA-N 428.600 4.108 10 10 IICE CCOc1ccc(Nc2ncccc2C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1557133725 VHAPAQYPLOCYBW-IBGZPJMESA-N 446.551 4.489 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1cc(C(F)(F)F)c(C(=O)OC)cn1 1559135244 BNGKWBSZCCGXOA-UHFFFAOYSA-N 433.224 4.382 10 10 IICE CCC(CC)n1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1565881753 HUNGAVOLOYVKGO-OAQYLSRUSA-N 443.592 4.306 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(-c4ccccc4)c3C(F)F)C2)cc1 1584444776 ZQBBXWPQIQJXKK-MRXNPFEDSA-N 426.467 4.075 10 10 IICE COc1cc(N2CCN(C(=O)c3ccc(C)c(C(F)(F)F)c3)CC2)cc(OC)c1OC 1584525689 GSWBBTONTQQQSR-UHFFFAOYSA-N 438.446 4.002 10 10 IICE CC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCNC(=O)C(C)C)CC1 1612330490 BUPZBXCVZYTBLT-UHFFFAOYSA-N 446.599 4.281 10 10 IICE COc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 1613111055 ASHBQVPNXZKALS-SANMLTNESA-N 445.519 4.061 10 10 IICE COc1ccccc1-c1nnc(N(C)C[C@@H]2CCOC2)n1CCCSc1nccs1 1619384099 GUJYKZUYEZWCGJ-INIZCTEOSA-N 445.614 4.065 10 10 IICE COCC1(C)CCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CC1 1619632575 XEYMRSLRBIVMLF-UHFFFAOYSA-N 444.630 4.232 10 10 IICE Cc1ccnc(OC2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)c1 1623743027 FCUGIJWEDYBCNM-UHFFFAOYSA-N 431.536 4.223 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2ccc(Br)o2)cc1 1625555678 XHLZVQKQPMOLLD-UHFFFAOYSA-N 429.314 4.463 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)cc1F 1627604335 DQEGSVXCXCZYTO-RTBURBONSA-N 427.564 4.211 10 10 IICE Cc1ccc(C(=O)N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)cc1-n1c(C)cc(C=O)c1C 1628760490 VXRUCOFQCRWEKC-BVAGGSTKSA-N 434.511 4.155 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(Br)ccc1Cl 1630480981 LAHOPUQNSAMPBG-UHFFFAOYSA-N 426.694 4.014 10 10 IICE CC(C)n1cc(C(C)(C)NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nn1 1634720185 QCFGDAICEPEQOF-INIZCTEOSA-N 433.000 4.483 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(N(C)C)nc2ccccc12 1635672832 DMCIUAJFFJUOGN-UHFFFAOYSA-N 428.330 4.431 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1 1636262649 IURGXBYXXGIMKX-HOYKHHGWSA-N 427.564 4.286 10 10 IICE CCCN(CCNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)C(=O)OC(C)(C)C 1637606140 DMTOXGUVEJKFTC-UHFFFAOYSA-N 429.561 4.480 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](O)[C@@H]2CCc2ccccc2)cc1 1640093221 ULOOCKNTPAGRNZ-RRPNLBNLSA-N 444.575 4.434 10 10 IICE C[C@H]1CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c2ccccc21 1645224452 VDXCJPDIDAFTKG-XUVXKRRUSA-N 439.575 4.459 10 10 IICE CCOC(=O)c1[nH]nc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1C 1652746557 UBOUUJKDRJOCDD-UHFFFAOYSA-N 445.317 4.317 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC4(CCCCC4)CC3)cc2F)C[C@@H](C)O1 1659344716 SWNMIKRHYHDFLF-BGYRXZFFSA-N 431.596 4.102 10 10 IICE C[C@H]1CN(c2ccncc2)CCN1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1682023194 BLXNMTKBSKZNIY-MOPGFXCFSA-N 442.007 4.392 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1 1683424676 HURGXATVXNYJFB-LJQANCHMSA-N 444.620 4.035 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H](c3ccccc3)c3cccc(F)c3)cc2)CC1 1687441088 ADVQRQLRESSJEH-RUZDIDTESA-N 432.543 4.166 10 10 IICE CC(C)[C@H]1CCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1691927413 OWHHSNWMNYQURJ-VQTJNVASSA-N 429.584 4.298 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C2CC2)O1 1726704936 RSAHTCRNPACPKX-KKSFZXQISA-N 429.584 4.124 10 10 IICE COC[C@H]1CCCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1730547513 UIIYKIBCILDONV-REWPJTCUSA-N 441.620 4.195 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cscn1 1730694592 GPQVGKOSGQTFDM-UHFFFAOYSA-N 436.585 4.482 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1752696597 QAUOPSKSZBJCQZ-QUCCMNQESA-N 430.616 4.213 10 10 IICE COC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1770902176 VNUSNDWXZFKAKF-TZIWHRDSSA-N 437.588 4.250 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1771430736 IYHZIVBNGKFRLA-HNNXBMFYSA-N 447.659 4.096 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])SC2=S)N(C)C)cc1 1858593859 ANTJXZCSOPUGEH-LPGQDOADSA-N 443.550 4.108 10 10 IICE Cc1ccc(C)c2c(=O)cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)[nH]c12 1866491478 KVXLCHCJEUKAQC-QHCPKHFHSA-N 446.595 4.168 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@@H](CNC(=O)OC(C)(C)C)C2(C)C)c1O 2236054036 DITALSJWQHHVQT-LRDDRELGSA-N 443.382 4.192 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)cc1OC 2321629619 MGXJPFKVTPDNGY-UHFFFAOYSA-N 432.479 4.026 10 10 IICE Cc1ccc(CNC[C@@H](NC(=O)OC(C)(C)C)c2ccco2)c(O)c1Br 2352674969 AYYFVIVNJNFKPI-CQSZACIVSA-N 425.323 4.412 10 10 IICE Cc1ccc(CNC(=O)[C@H]2[C@H](C)CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380747961 ZAJFUECQOTVGKR-CZUORRHYSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)CC2(N(C)C(=O)OC(C)(C)C)CC2)c(O)c1Br 2381130545 ALGBDJXAYODBKA-UHFFFAOYSA-N 441.366 4.211 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2381135467 QTAOMXRGYQLOIL-UONOGXRCSA-N 441.366 4.019 10 10 IICE CCCCOc1ccc(Br)cc1/C=C1\SC(=S)N(CCC(=O)O)C1=O 33458005 FCZLKGMTVPNUSR-UVTDQMKNSA-N 444.372 4.304 10 10 IICE CCCCN1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33467336 IMBBTEDFPOKXOI-VKAVYKQESA-N 442.610 4.440 10 10 IICE Cc1cccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(-c4ccc(C)c(C)c4)c3O)C2=O)c1 38163158 IGSWWDOSWRMUFW-NDENLUEZSA-N 430.464 4.318 10 10 IICE CCC(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccc(N(CC)CC)cc1 59074308 ZGSFBMBCMXTFMP-XMMPIXPASA-N 443.613 4.173 10 10 IICE CCn1cc(/C=C2/C(=O)N(CN3CCN(C)CC3)c3cc(Cl)ccc32)c2ccccc21 97513739 RGAXKZNIFZHADQ-HYARGMPZSA-N 434.971 4.407 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccccc3Br)n2)cc1 325137398 UTOHVCHJVCZCQW-UHFFFAOYSA-N 425.329 4.382 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(O[C@@H]3CCOC3)cc2)C1 435874151 ZHUAWUBCCOGHIK-OAQYLSRUSA-N 433.552 4.214 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(NC(C)=O)c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526392380 MIVGIPXUSCEKFZ-HSZRJFAPSA-N 446.459 4.122 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc3c(c2)OCCO3)nc1-c1c(F)cc(F)cc1F 729110598 PIFPRRNPWNNSJJ-UHFFFAOYSA-N 442.440 4.108 10 10 IICE O=C1COc2ccccc2N1CCCNC(=O)N(Cc1ccccc1O)C1CCCCC1 745856246 FGUVVMOJYSHTKQ-UHFFFAOYSA-N 437.540 4.052 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3c(F)cc(F)cc3Br)CC2)cc1 753059145 DMCQWHLRRRXJGQ-UHFFFAOYSA-N 426.261 4.090 10 10 IICE C[C@H](NC(=O)c1c[nH]c2cccc(Br)c12)c1ccc(N2CCOCC2)cc1 763997261 KHZTUWWCTQIJGE-AWEZNQCLSA-N 428.330 4.258 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1[nH]c2ccc(F)cc2c1Cl 768911905 SXAPKCUTMUJWPP-UHFFFAOYSA-N 440.950 4.422 10 10 IICE Cc1onc(-c2ccccc2)c1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768913697 PPCKDEYXFZSRBZ-UHFFFAOYSA-N 430.552 4.112 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCOc2c(Cl)cccc21 775778155 PQHZCNPLYDVWOS-JOCHJYFZSA-N 443.975 4.262 10 10 IICE C[C@H]1CC[C@]2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)C2)C1 781796497 KXXSAVREYMHPFQ-KKSFZXQISA-N 425.495 4.264 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)Nc1ncc(C(F)(F)F)s1)c2[N+](=O)[O-] 789680477 KKLDWDUUFHGCQN-UHFFFAOYSA-N 447.350 4.098 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCOC3)n2C[C@@H]2CCCCO2)c(C)n1-c1ccccc1 812440494 CWCLWJTVXUTTTL-YADHBBJMSA-N 435.572 4.147 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(F)(F)Oc2ccccc2)n1C[C@@H]1CCCCO1 812444073 WXGUTHAJLWXSGG-IBGZPJMESA-N 444.482 4.318 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H](c2ccc(Br)cc2)N2CCCC2)cc1F 1125534797 NBSHDFXMZVZMPU-HXUWFJFHSA-N 434.353 4.108 10 10 IICE Cc1cc(C(=O)NCCNc2nccc(C(F)(F)F)n2)c(C)n1-c1ccc(Cl)cc1 1136865014 CUESQCFFMASAMU-UHFFFAOYSA-N 437.853 4.398 10 10 IICE CCCc1c(C(=O)N[C@@H](C)c2ccccc2O)nnn1Cc1cccc(Br)c1 1151892196 KYRFOYRIRBFAND-AWEZNQCLSA-N 443.345 4.238 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cccc(OCC(F)(F)F)n1 1156880348 HPQSCMDYRCCFQA-UHFFFAOYSA-N 431.414 4.173 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3cccc(C(=O)OC(C)(C)C)c3)CC2)cc1 1224983329 RWJCHSRUJQMYEB-UHFFFAOYSA-N 439.556 4.072 10 10 IICE C[C@H](OC(=O)CC1(C(F)(F)F)CC1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1258296345 DMRNFPYBUVHEEB-LBPRGKRZSA-N 445.393 4.065 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(-c2ccc(F)cc2F)n1 1265564691 SDERKOWGSSIOHK-OAHLLOKOSA-N 448.420 4.151 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1c(C)noc1C 1266353794 COLZQCVLQLPVCY-PCJMVEANSA-N 447.557 4.289 10 10 IICE CC[C@H]1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCO1 1289510804 LYDKTZHCKXINIW-ZFWWWQNUSA-N 429.318 4.303 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc(OCc2ccccc2)ccc1O 1297440796 QKTPDRUIULMERJ-UHFFFAOYSA-N 428.282 4.369 10 10 IICE O=C(NCc1c(O)cccc1O)[C@@H](Oc1cccc(Br)c1)c1ccccc1 1304050056 HOKGRBRSRNCIRG-FQEVSTJZSA-N 428.282 4.297 10 10 IICE CS[C@@H](Cn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1316393860 GDWXBVFNNLLHFB-FQEVSTJZSA-N 442.633 4.259 10 10 IICE Cc1ccc(-n2nc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2C)cc1 1354754767 LPVHTRMTDKDGEW-SFHVURJKSA-N 440.494 4.489 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc3c(s2)CN(C(=O)OC(C)(C)C)CC3)c1 1445966840 JFVZVMHHRHGXSF-CYBMUJFWSA-N 432.542 4.247 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cn(C)nc2-c2ccccc2)cc1 1447584521 DJFHMXYWTDCVIU-UHFFFAOYSA-N 426.520 4.166 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(C)n(-c3cc(C)cc(C)c3)c1C)C[C@H]2O 1464040168 GHTJQEVWDFABGY-JOCHJYFZSA-N 434.536 4.418 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC[C@H]3CCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1464977355 HAXLSNVCTFRLNX-IBGZPJMESA-N 441.572 4.480 10 10 IICE O=C(NCc1ccc(Br)c(Br)c1)N1Cc2cccc(O)c2C1 1471442801 SNDFYODBKLODPE-UHFFFAOYSA-N 426.108 4.143 10 10 IICE O=C(NCc1cccc(Cl)c1O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1 1472315670 CDGLEPFIVJQKER-PDGQHHTCSA-N 437.912 4.075 10 10 IICE COCCN(Cc1ccc(C)o1)c1nnc(C(C)C)n1Cc1ccc2c(c1)CCCN2C 1504876994 VZGUQPANHKBHGB-UHFFFAOYSA-N 437.588 4.387 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1514015122 LCBUDKPXDSZEKF-GHTZIAJQSA-N 448.615 4.456 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2c(F)ccc(F)c2Cl)c1 1521076384 ZWIQNMCYEFJKNK-UHFFFAOYSA-N 429.854 4.362 10 10 IICE Cc1oc(Br)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1526003850 UCXGRELXQZLIQD-TXEJJXNPSA-N 425.298 4.033 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](c3c(F)cccc3F)N(C)C)c2C)cc1 1543905164 ICVMNMDUXYVFTA-QFIPXVFZSA-N 427.495 4.414 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccnc(OCC(F)(F)F)c2)c1 1544078529 IBRSLSBEZURNGK-UHFFFAOYSA-N 431.414 4.173 10 10 IICE Cc1ccc(C(=O)NCCOc2cccc(C(F)(F)F)n2)cc1-n1c(C)cc(C=O)c1C 1556088391 XSHBSCGJJDADIS-UHFFFAOYSA-N 445.441 4.438 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C(C)(C)C1 1556879525 QPRZZLADXUMRSE-MRXNPFEDSA-N 435.528 4.228 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@H]21 1565256059 KWRVONVLQOLPJU-PWRODBHTSA-N 428.374 4.385 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1c(C(F)(F)F)nc2n1CCCC2 1566306435 KSXNMTAXYFARMN-UHFFFAOYSA-N 446.267 4.369 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)c(Cl)c3F)CC2)cc1F 1566346657 HHRMAQJWPSYKOQ-UHFFFAOYSA-N 445.691 4.352 10 10 IICE COc1cc(OC)c(C[C@H](C)NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c(OC)c1 1583066200 ZNRJYXMXDXVVRP-KRWDZBQOSA-N 436.552 4.410 10 10 IICE CC[C@H](CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)N1CCc2ccccc2C1 1595542593 VHXMJTJLSOKEMO-XMMPIXPASA-N 433.596 4.471 10 10 IICE Cc1ccc(/C=C/C(=O)N2C[C@@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)cn1 1617132968 MAPBRNPZTPIXEV-RUJXFNLJSA-N 425.504 4.273 10 10 IICE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)N(Cc1ccco1)Cc1ccccc1O 1622309374 JFIQIFOURJZFPH-MRXNPFEDSA-N 449.532 4.485 10 10 IICE CN(c1ccc(CNC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cc1)C1CCCCC1 1625904836 CJBRAYWFWBSEFR-UHFFFAOYSA-N 434.506 4.476 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)C[C@H]1c1ccc(O)cc1 1628279547 JFWOJLWZXHAVDH-BJKOFHAPSA-N 432.520 4.137 10 10 IICE Cc1c(O)nc2ccccc2c1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1630280931 TZVFEULQEHUTIG-OAHLLOKOSA-N 427.451 4.249 10 10 IICE Cc1cc(C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)c(C)n1-c1cccc(Br)c1 1634343894 COVAARVUWQXUGI-HNNXBMFYSA-N 434.378 4.232 10 10 IICE Cc1ccc(C(=O)N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)CC3)CC2)c(O)c1O 1645977886 NXHMJDDNNDDAHN-KRWDZBQOSA-N 432.561 4.296 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 1646430888 CSZPVMJNFUCYPD-UHFFFAOYSA-N 445.350 4.070 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CCCC1 1649072600 LCPHVHNMMSDBKN-RUZDIDTESA-N 440.971 4.292 10 10 IICE CCC1(NC(=O)OC(C)(C)C)CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 1651105188 FLANUUSRKAKFOP-UHFFFAOYSA-N 426.561 4.399 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@@]2(C)Cc2ccccc2C(F)(F)F)cc1 1655134119 MEZIQCXPGZPSNV-QHCPKHFHSA-N 433.518 4.485 10 10 IICE CCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1672133021 MZVZDMPDCCRUOF-HKUYNNGSSA-N 435.012 4.024 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1684603717 BDZBCTPKESXPQP-IIBYNOLFSA-N 426.561 4.149 10 10 IICE CCC(CC)c1cc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)on1 1694290756 KTLVWNNCELSAAM-IBGZPJMESA-N 439.560 4.454 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1709471663 DKNIIIFHEBVFHX-FQEVSTJZSA-N 434.588 4.097 10 10 IICE C[C@@H]1CCN(c2nnc(COc3ccc(F)cc3)n2CCCSc2nccs2)C1 1726626807 DIWMDZWSWAMREN-OAHLLOKOSA-N 433.578 4.481 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C)C(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742697606 QTUNLDBPXZDKPP-IBGZPJMESA-N 449.647 4.435 10 10 IICE CO[C@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1748426737 FSYPKCIFOALQEL-HSZRJFAPSA-N 436.604 4.191 10 10 IICE COC[C@H]1CCCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1749477284 JOLWJRUUKSNQPJ-IBGZPJMESA-N 431.600 4.373 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1[C@@H](C)CCN1C(=O)OC(C)(C)C 1750611052 JUUDFDOKXFWUGI-PKOBYXMFSA-N 443.592 4.389 10 10 IICE CC[C@H](C)[C@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)OC 1763443567 IVCHQKXRIYLHCH-KXBFYZLASA-N 429.952 4.397 10 10 IICE O=C(O)[C@H](c1ccccc1)N1C(=O)/C(=C\c2ccccc2Br)SC1=S 1858591258 HDTCWNSAWCDJOD-IPJDOKCGSA-N 434.336 4.476 10 10 IICE CCN[C@@H](c1ccccc1O)c1ccc(Br)cc1I 2142279956 WZXXBLYYHCDRKJ-OAHLLOKOSA-N 432.099 4.458 10 10 IICE O=C1C(=Cc2cc(Cl)ccc2O)SC(=S)N1c1ccc(N2CCOCC2)cc1 2321734703 ZBECJGFYVUVELP-UHFFFAOYSA-N 432.954 4.288 10 10 IICE Cc1ccc(CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(O)c1Br 2352954050 XFFXORAWGBFMTH-MQVJKMGUSA-N 425.367 4.483 10 10 IICE COCCN1C(=O)/C(=C\c2cn(-c3ccccc3)nc2-c2cccs2)SC1=S 34722396 YNLWSEKCHJQYSW-SFQUDFHCSA-N 427.576 4.448 10 10 IICE Cc1cc(C(=O)COC(=O)c2csc(-c3ncccn3)n2)c(C)n1-c1cccc(F)c1 109132467 LFFWHFCGKZYKHK-UHFFFAOYSA-N 436.468 4.186 10 10 IICE Cc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccc(O)cc3O)SC2=S)cc1 210713727 PLEGDTAHYFGHES-WOJGMQOQSA-N 428.535 4.026 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](NCc1cc(Br)cc(F)c1O)C1CCCC1 715814924 UXCHNDBCWBXKNJ-MRXNPFEDSA-N 431.346 4.467 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@H](c2ccc(Cl)cc2)C1 732449785 NTJZGVWFMCELJU-SFHVURJKSA-N 431.939 4.139 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccccc2CC(F)(F)F)c(C)n1-c1ccccc1 743882135 KAAKJJRPOYIFFQ-UHFFFAOYSA-N 443.469 4.496 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C/c2ccnc(Cl)c2)NC(=O)OC(C)(C)C)cc1 761776680 SZAOLEJDFYVQQH-SSGOSMAHSA-N 444.963 4.196 10 10 IICE C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 792034359 YOSALVKNWKGTCN-WFASDCNBSA-N 439.400 4.024 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccc(F)cc3)C2=O)cc(OC)c1OC(C)=O 915850032 MDZSJEWSMZYWSZ-LICLKQGHSA-N 433.482 4.174 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)OCC(=O)NC2CCN(C3CC3)CC2)cc1 921448768 UQFAVZVSEUVBFO-UHFFFAOYSA-N 449.555 4.068 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)s2)cc1 1133629767 GTRJJMJHVYVNLU-UHFFFAOYSA-N 448.592 4.059 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)c(Cl)c1 1136282685 UXWKAVJXRMQMPY-UHFFFAOYSA-N 433.961 4.392 10 10 IICE COc1ccc(CCCNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1136411562 REUZLPSHJBLTJU-UHFFFAOYSA-N 434.536 4.215 10 10 IICE COCCOc1ccccc1N1CCN(C(=O)c2sccc2-n2c(C)ccc2C)CC1 1137274742 DVCNFVAODBVEDM-UHFFFAOYSA-N 439.581 4.143 10 10 IICE Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CCCN3C)C2)c(C)n1-c1ccc(Br)cc1 1137305144 AVYBZTXJGHROCG-LAUBAEHRSA-N 430.390 4.413 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Cl)nc(C(C)(C)C)c1 1152401399 MBHHJHPMOJEDIP-UHFFFAOYSA-N 425.312 4.207 10 10 IICE CC(C)N(CCS(=O)(=O)c1cccc(Br)c1)Cc1ccc(N(C)C)cc1 1190436165 ARXSHJVYEPMUFB-UHFFFAOYSA-N 439.419 4.199 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@@H](Oc4ccc(Cl)cc4)C3)C2)cc1 1252117896 YTEIULQXKSKIRN-HTAPYJJXSA-N 429.948 4.038 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1291516519 FJQNVOVDCBMBRT-MJGOQNOKSA-N 438.551 4.098 10 10 IICE CO[C@@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1Br 1295404822 BZBBCNDTXJQEAG-OXQOHEQNSA-N 434.330 4.050 10 10 IICE CCOCc1nnc(N2CCS[C@H](C)[C@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1297345859 ZOUWDEMOCLENCN-WOJBJXKFSA-N 443.661 4.429 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CC[C@@H](C)N2CCCCC2)n1 1304455104 CJCGJBOELPWHAV-HXUWFJFHSA-N 434.588 4.255 10 10 IICE CCN(CC(C)C)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1313632098 VZQUNZFKZQITAD-UHFFFAOYSA-N 425.621 4.285 10 10 IICE CCOCc1nnc(N2CCC[C@@]3(CC=CCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1314377731 MIZGGGCQNWLYDF-DEOSSOPVSA-N 427.568 4.395 10 10 IICE Cc1cc(C(=O)N[C@]2(C(=O)O)CCCN(Cc3ccccc3)C2)c(C)n1-c1ccc(F)cc1 1345728998 GNKWQGMXKPNNMS-AREMUKBSSA-N 449.526 4.082 10 10 IICE COC[C@]1(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCCCN1C(=O)OC(C)(C)C 1352744686 QGZVFCBUCHJJLM-VWLOTQADSA-N 445.604 4.050 10 10 IICE COC(=O)CCN(Cc1ccncc1)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1356046357 KCDAOJGVDHFVQZ-UHFFFAOYSA-N 439.943 4.277 10 10 IICE CC(C)=CCC[C@@H](C)CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1357232238 YZMYHVLABMFVKZ-HXUWFJFHSA-N 439.579 4.331 10 10 IICE O=C(NCc1ccc(O)c(O)c1)c1cccc(Sc2cccc(Br)c2)n1 1465953295 DXJIJAJUAQUNAB-UHFFFAOYSA-N 431.311 4.337 10 10 IICE CCO[C@@H](CCn1c(C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)C1CCCC1 1502582382 SVTMWBANGVUVCZ-QFIPXVFZSA-N 445.583 4.046 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(Cl)s1 1504943629 NEVJUFPQQZQJLV-AWEZNQCLSA-N 436.965 4.107 10 10 IICE CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1517498535 IZZDAPLLZDQXSL-KRWDZBQOSA-N 439.581 4.352 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1 1528924127 JMAFVVAERGWVGP-IEBWSBKVSA-N 437.613 4.030 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1 1528925496 ZPQUOKBZEAAOKT-GBXCKJPGSA-N 437.584 4.300 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc4ccc(Cl)cc34)CC2)c(OC)c1 1530968511 QBGWZFYCQSDEMY-UHFFFAOYSA-N 430.957 4.463 10 10 IICE COc1ccc(N2CCN(C(=O)C/C=C/c3ccc(Br)cc3)CC2)c(OC)c1 1530968793 YXNBSEHRJJAQJY-ONEGZZNKSA-N 445.357 4.218 10 10 IICE CCOC(=O)CN(C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1F 1534549181 ZLZBHNJENJKQDF-UHFFFAOYSA-N 438.499 4.264 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCNC(=O)c3ccc(F)cc3)cc2Cl)C1 1539912713 LMMWBFWZSIVJRB-MRXNPFEDSA-N 431.939 4.152 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCN1CCOCC1 1546780957 RTQGPXKHZXOUNL-POHAHGRESA-N 448.615 4.087 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CC[C@H](OCC(C)C)C2)cc1 1547449151 UASPQHIINZWYNZ-XZOQPEGZSA-N 441.620 4.275 10 10 IICE CN(CC1CC(F)(F)C1)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1554208123 IDVKCYFCODDHCA-UHFFFAOYSA-N 436.557 4.461 10 10 IICE C[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1560132440 YISHASSTZOWSIH-CABCVRRESA-N 443.459 4.048 10 10 IICE C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N(C)Cc1ccccc1O 1566304227 XSLLHKLKYJBUJH-QGZVFWFLSA-N 430.504 4.278 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC/C=C\c1ccccc1 1583747207 NITWXFCHRANZKH-GOXBMCCXSA-N 426.538 4.247 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2c[nH]c3cnc(Cl)cc23)cc1 1583918593 JIYIGLZJIREESD-IBGZPJMESA-N 426.948 4.033 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CS[C@@H]3CCOc4ccccc43)cc2F)C[C@@H](C)O1 1613617000 DKRDVZCOPUUVLE-SAHWJRBASA-N 444.572 4.313 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cc(Cl)ccn1 1627272251 YRGWRIYKNOKWRA-UHFFFAOYSA-N 428.677 4.460 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C1 1628627152 OJDOMALTCORHSB-KKSFZXQISA-N 439.556 4.282 10 10 IICE CC(C)(C)OC(=O)[C@H]1c2ccccc2CCN1C(=O)c1cc2cc(O)c(O)cc2s1 1633389333 VZBZVAZSTAXVQD-HXUWFJFHSA-N 425.506 4.394 10 10 IICE CCOCCN(C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)[C@@H]1CCc2ccccc21 1636353825 KOWUVCRITWSFKK-CJFMBICVSA-N 437.584 4.257 10 10 IICE Cc1cc(C(=O)NC[C@H]2COc3ccccc32)c(C)n1-c1ccc(Br)cn1 1637177448 CEMMEASASCAZBH-HNNXBMFYSA-N 426.314 4.158 10 10 IICE Cc1cc(C(=O)Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)n1-c1ccc(Cl)c(Cl)c1 1641155881 UMBSYZLOAGBZPU-UHFFFAOYSA-N 438.227 4.297 10 10 IICE Cc1cc(C(=O)NC[C@@H]2OCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1648042648 SCURJTBZCLADEM-IBGZPJMESA-N 426.314 4.253 10 10 IICE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1cc(Cl)cc2c1OCC2 1684345150 LNSXKLPVPWUNIP-MRXNPFEDSA-N 429.948 4.014 10 10 IICE CN(C)CC[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cccnc1 1685324876 NIHHXAJVFRQDGW-DEOSSOPVSA-N 435.572 4.145 10 10 IICE CC(C)C[C@@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)N(C)C 1692054828 LFRHMQWOZJQFQX-FQEVSTJZSA-N 427.618 4.249 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1696373921 WRVFEHADSMBQMR-DLBZAZTESA-N 437.635 4.021 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2C[C@@H](C(F)(F)F)O[C@H](C)C2)nnc1C(C)(C)C 1707305897 PSVCSCVURLCQRQ-QAPCUYQASA-N 439.526 4.154 10 10 IICE C[C@H]1C[C@H](C)CN(C(C)(C)Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)C1 1707959700 OACFVEBSBUQBPQ-OALUTQOASA-N 436.604 4.372 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(N3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1708461870 IAZTXLFNQJFONK-LJQANCHMSA-N 442.627 4.500 10 10 IICE CC(C)CCCn1c(C(=O)N2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1723371635 BPBKZZYOAYYICN-UHFFFAOYSA-N 438.620 4.187 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)cc2C)o1 1742218914 IJBIAHRBJJTLIM-UHFFFAOYSA-N 430.556 4.224 10 10 IICE CC[C@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)C)C1 1744225593 RCVSMDQMANLEKU-RUZDIDTESA-N 434.588 4.067 10 10 IICE CCS[C@@H]1CCCCN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1747498987 JCQGBRAJYUZEAI-RBBKRZOGSA-N 443.661 4.317 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1771433579 LYWBKNDUVPDSBA-OALUTQOASA-N 447.624 4.147 10 10 IICE CCc1sc(NC(=O)CCCN)c(C(=O)OC)c1-c1ccc(Br)cc1 1865915504 ITPJCYQKHNVCOB-UHFFFAOYSA-N 425.348 4.204 10 10 IICE CC1(C)C[C@H](NCc2cc(Br)cc(F)c2O)CN(C(=O)OC(C)(C)C)C1 1923178810 UJCOHJDMOCHIEE-AWEZNQCLSA-N 431.346 4.419 10 10 IICE Cc1nn(Cc2cc(Br)ccc2O)c(I)c1C1CC1 2079620608 MNGLYCFYCWJYNV-UHFFFAOYSA-N 433.087 4.190 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2ccc(Br)cc2O)[nH]1 2082935332 DKLWIPAMYMTABG-JTQLQIEISA-N 428.352 4.231 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@@]21CNCc1cc(Br)ccc1O 2089360469 XPTPOBMWCWDEEY-MGPUTAFESA-N 425.367 4.424 10 10 IICE CCN(CC)c1ccc(N2C(=O)C(=Cc3ccccc3OCC(=O)O)SC2=S)cc1 2314931647 QEQGYYXXUZOARV-UHFFFAOYSA-N 442.562 4.402 10 10 IICE CC(C)(C)OC(=O)N(CCCC(=O)N1CCc2cc(O)c(O)cc2C1)Cc1ccccc1 2318653744 GPYOAFPDIXAINT-UHFFFAOYSA-N 440.540 4.200 10 10 IICE COC(=O)c1ccc(N2C(=O)C(=Cc3cn(C)c4ccc(OC)cc34)SC2=S)cc1 2321699208 QGPHTRPPLNQODM-UHFFFAOYSA-N 438.530 4.379 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)C2=Cc2ccc3c(c2)OCCO3)cc1 2332127240 BIQCUJWVUMJYHN-UHFFFAOYSA-N 444.462 4.436 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccccc2[N+](=O)[O-])cc1 2332144834 ROGFSCNWHHHGPH-UHFFFAOYSA-N 429.432 4.447 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c(O)c1Br 2380782702 SSYUSPHPSACGED-MRXNPFEDSA-N 441.366 4.067 10 10 IICE CCCCC(=O)N[C@H](c1ccc(OC)c(OC)c1)c1cc([N+](=O)[O-])c2cccnc2c1O 6146607 WTQHTBSVJVIQLZ-OAQYLSRUSA-N 439.468 4.262 10 10 IICE COc1cccc(CN2C(=O)CN(C3CCCCC3)C(=O)[C@@H]2c2ccc(N(C)C)cc2)c1 9490834 CPYPHJFDDQVVSS-VWLOTQADSA-N 435.568 4.006 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 33377971 FHQMQAPSRMUBLR-CPNJWEJPSA-N 443.546 4.039 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3cccc(C)c3C)nc3ccccn3c2=O)SC1=S 39835778 DUULDOZWDFVYMB-SFQUDFHCSA-N 437.546 4.325 10 10 IICE CCOc1ccc(Br)cc1/C=C1\C(=O)N(c2ccc(OC)cc2)C(=O)N=C1O 59860529 QPWAELFARXUWTR-WJDWOHSUSA-N 445.269 4.363 10 10 IICE CCN(Cc1ccccc1)C(=O)c1csc(N2CCN(c3ccc(OC)cc3)CC2)n1 96386300 VXXLSTQNMGERRZ-UHFFFAOYSA-N 436.581 4.141 10 10 IICE O=C(NN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S)c1ccncc1 206213250 JYNHJKZWTINCFT-XSFVSMFZSA-N 447.541 4.207 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@H](C(=O)Nc4cccc(OC)c4)[C@H]3C2)cc1 245279496 GGUIXYXQANMOBO-AZGAKELHSA-N 443.547 4.210 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)cc1OC 526380798 AZRIXYSICDPDCZ-JOCHJYFZSA-N 437.423 4.311 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)c(C(C)C)s2)cc1 733732022 RSHZJCNCNMLBDT-UHFFFAOYSA-N 430.551 4.450 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C1 751302703 PUXUKNAJIJGILG-DLBZAZTESA-N 435.528 4.418 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 752924136 FNJCAGQWMSAZOU-RDPSFJRHSA-N 436.531 4.088 10 10 IICE C[C@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1cc(Br)c(F)cc1O 756494458 MCTJVXPEBGEFJP-MNOVXSKESA-N 431.327 4.077 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(C)[C@@H]3c3ccc(Cl)cc3)CC2)cc1 760368198 DJNMHCGILOZRIY-XZOQPEGZSA-N 442.991 4.062 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(Cc1ccco1)C1CCCC1 769045198 IFEIVEMLMJPPJF-UHFFFAOYSA-N 436.600 4.466 10 10 IICE CCOC(=O)C[C@@H]1C[C@@H](OC)CN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 775971943 AYJJWAMWIKVEFD-VQTJNVASSA-N 438.528 4.351 10 10 IICE COc1cccc([C@@H]2[C@@H](NC(=O)NCc3ccc(N4CCCC4)cc3)CCN2C2CC2)c1 778620551 NNSDMYKUCXZFFY-LOSJGSFVSA-N 434.584 4.073 10 10 IICE C[C@@H]1C[C@H](COC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 782676819 LRRXRPMXMFVJFR-JKSCSLPYSA-N 425.597 4.088 10 10 IICE Cc1cc(C(=O)CN2CCC[C@H](CNC(=O)CC(F)(F)F)C2)c(C)n1-c1ccccc1 796152042 QWWAITLCGQNGGX-GOSISDBHSA-N 435.490 4.057 10 10 IICE O=C1/C(=C\c2cc(Br)ccc2O)SC(=S)N1c1cccc([N+](=O)[O-])c1 1084541887 UWISJTBTBXIMJQ-VGOFMYFVSA-N 437.296 4.469 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(OCC4CC4)c(Cl)c3)cc2F)C[C@H](C)O1 1125259225 XVKPAMZHEJMIKF-GJZGRUSLSA-N 447.938 4.207 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(-c4ccccc4)c3C(F)(F)F)C2)cc1 1130185594 MLZHXSFVMNOARY-INIZCTEOSA-N 444.457 4.156 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@H]1CCCCO1 1130494075 AZHSBDYDZLGACO-YUFKHZPFSA-N 438.640 4.193 10 10 IICE CN1CCN(c2ccc(CNC(=O)C3(c4ccc(C(F)(F)F)cc4)CCC3)cc2)CC1 1132902332 JSFYNWCFBUCTKG-UHFFFAOYSA-N 431.502 4.195 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CCCC1 1134881667 CVJJXWPSIJSCCB-SANMLTNESA-N 448.611 4.014 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CCCCN1Cc1ccccc1 1148444221 PSFRLMLGBFLLDD-REWPJTCUSA-N 443.538 4.428 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(F)F)CC2)c(C)n1-c1cccc(Br)c1 1170816597 YDWADZDJHNILQF-QGZVFWFLSA-N 427.289 4.353 10 10 IICE CC(C)N(C)c1ccc(NC(=O)CCN[C@H](C)c2ccc(N3CCOCC3)cc2)cc1F 1192891472 UWZXFXGZRWZAFY-LJQANCHMSA-N 442.579 4.186 10 10 IICE Brc1cc(CNC2CCN(C[C@@H]3CCCO3)CC2)ccc1N1CCCCC1 1200376415 BVSMUJJKIIFHCO-FQEVSTJZSA-N 436.438 4.172 10 10 IICE COc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(OC2CCCC2)c1 1275224669 TVRPYZYYGWWYPF-UHFFFAOYSA-N 446.494 4.061 10 10 IICE Cc1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)nn1C(C)C 1276348912 OGIVFILPMJDCFC-RVDMUPIBSA-N 434.612 4.454 10 10 IICE COc1ccc(C(=O)N2CCC(C(=O)N[C@H](C)c3ccccc3O)CC2)c2ccccc12 1302530723 XMEYRSIUJIRBDX-QGZVFWFLSA-N 432.520 4.284 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@H](C)O[C@H](C)[C@@H]2C)sc(C)c1-c1ccccc1 1307996543 JYBPRDZIGLUMBT-FQEHYLHMSA-N 430.570 4.240 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1C 1313548843 ZZDOSGBMGJIERM-IEBWSBKVSA-N 434.588 4.066 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C\c3ccc(C(C)(C)C)cc3)CC2)cc1 1351469877 KAQSWUKRZWTYGX-NVNXTCNLSA-N 435.612 4.334 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nc(C)cs1 1353069891 XPLPLUXWVQTUTO-CCAPLTMGSA-N 449.598 4.449 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H](C(=O)OC(C)(C)C)C3CCCC3)cc2F)C[C@@H](C)O1 1354659206 UNYSLTHJUAAZEK-HYFFOGBASA-N 448.579 4.204 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cnn1-c1ccccc1 1435076914 SMOYOLRPEDXJFJ-UHFFFAOYSA-N 449.574 4.036 10 10 IICE CC(C)(C)c1ccccc1OCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1435573019 MVSVPDTTZSKUDR-UHFFFAOYSA-N 435.612 4.211 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)Nc1ncc(C(F)(F)F)cc1I 1458310271 NNMJRGUNGFNIEA-QMMMGPOBSA-N 438.187 4.159 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C/C=C\c4ccccc4)CC3)ccc21 1465010140 IGVFIDGLEBQTOQ-YFHOEESVSA-N 431.580 4.376 10 10 IICE CC(C)(C)CC[C@H](CO)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1467486692 SHLPJCCSCZZZJT-IZCBMXNHSA-N 440.656 4.033 10 10 IICE C=Cc1ccc(CCNC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 1477354286 DDGOHKGKYCYVCS-UHFFFAOYSA-N 433.474 4.227 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC(=O)N(C(C)(C)C)C3)cc2Cl)C1 1478528494 OYYYRBMIYUPLSI-FUHWJXTLSA-N 435.012 4.023 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)C[C@@H]2CCCCO2)cc1F 1503393796 LOQAERGZFDIMDT-FQEVSTJZSA-N 429.584 4.270 10 10 IICE COC(=O)[C@@H](CC1CCCCC1)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1516032263 MRGAYYODWBXHKZ-JOCHJYFZSA-N 439.600 4.036 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1c2ccc(Br)cc2nn1C 1523560780 UULWDIDENOKQDV-UHFFFAOYSA-N 427.346 4.208 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)N(C)C)CC1 1555315898 CVHCGYDNDKUCPV-HXUWFJFHSA-N 448.615 4.086 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2nn(-c3ccccc3)cc2O)cc1 1565656027 LOEMYHNWYNCENJ-UHFFFAOYSA-N 442.519 4.500 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(S(=O)(=O)NCC4CC4)cc3)c2C)c1 1565734548 ITTJBHWWZHMMFR-UHFFFAOYSA-N 437.565 4.343 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C3)ccc21 1584862110 ICJKEGXIMYNWAV-OXJNMPFZSA-N 428.573 4.344 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)c3cccc(C(=O)c4ccccc4)c3)C2)cc1 1585988139 KAONAAVOYQSLAT-XXBNENTESA-N 428.532 4.425 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCOC[C@@H]3CC(=O)c3ccccc3)c2C)cc1 1588015564 WVAPNFSYNDXRNO-QFIPXVFZSA-N 432.520 4.217 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1c(F)c(C)cc([N+](=O)[O-])c1F 1588192963 GYOUENMLLCOMBN-UHFFFAOYSA-N 429.217 4.312 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](CO)c1ccccc1C(F)(F)F 1597333246 PGTYOYWZPFMAGG-HXUWFJFHSA-N 430.426 4.389 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccnc(Oc2ccccc2)c1 1597567861 ZJSHSRXJPMXJHJ-UHFFFAOYSA-N 426.856 4.048 10 10 IICE C[C@@H]1CCCCN1CCCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1612770705 HAIJRWTVFHEOGG-OAQYLSRUSA-N 448.615 4.261 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CS[C@@H]3CCOc4ccccc43)cc2F)C[C@@H](C)O1 1613617002 DKRDVZCOPUUVLE-SEPYTNNBSA-N 444.572 4.313 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)c1 1618160058 XIHDAXBEAURMKP-UHFFFAOYSA-N 439.556 4.472 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(C)C)C1 1618786176 NHESWZMNIVHXSZ-NRFANRHFSA-N 448.615 4.361 10 10 IICE CO[C@]1(C)CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1619027836 VIBNBQOVHBLMAP-RCZVLFRGSA-N 441.620 4.338 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)Nc3ccc(O)cc3)CC2)c1 1622319233 AKAOOAZJFXPDGC-UHFFFAOYSA-N 445.519 4.103 10 10 IICE COC(=O)CN(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CCCC1 1622703855 NULGRSRXVHOKMR-UHFFFAOYSA-N 433.346 4.414 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1625068478 PGFNVUXOPRBQLF-NZQKXSOJSA-N 437.584 4.495 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@](C)(CNC(=O)OC(C)(C)C)C2CC2)c1 1628330864 OYVOSCKPDVYBLT-RUZDIDTESA-N 439.556 4.330 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccn(-c2ccc(F)cc2C)n1 1629968264 CSPHYTUPDWPERB-UHFFFAOYSA-N 432.293 4.450 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(Br)cc2cccnc12 1630351491 SAUFVCSNEDXQNG-UHFFFAOYSA-N 442.382 4.481 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(Br)cc1O 1635489238 PQMPVNQCPINUBV-UHFFFAOYSA-N 449.345 4.157 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)CC2CCCCC2)c(C)n1-c1ccc(Br)cn1 1639541578 UJYSAJHVBBOYRR-GOSISDBHSA-N 434.378 4.313 10 10 IICE NC(=O)C1CCN(c2ccc(CNc3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)cc2)CC1 1640418008 BRYMXCUHJXONBL-UHFFFAOYSA-N 449.486 4.110 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccc(F)cc1 1641617646 UKYNNAFBDTYXBY-UHFFFAOYSA-N 430.479 4.452 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C[C@H](NC(=O)OC(C)(C)C)C2CC2)cc1 1644031482 VRNPQLBKVOPMGT-SFHVURJKSA-N 443.510 4.337 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC[C@@H](O)c2ccc(C(C)(C)C)cc2)N(C)C)cc1 1648477805 FEOVLHJBHIFGKY-DNQXCXABSA-N 425.617 4.283 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2CN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1652097225 ZVYFIDVZAAZZGZ-IBGZPJMESA-N 426.561 4.351 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1679613630 HZDANTNYKZJURH-QGZVFWFLSA-N 428.577 4.239 10 10 IICE CN1CC[C@H](CNC(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(Cl)c(F)c1 1681171547 ZQQAOXHLXUIDAH-FZKQIMNGSA-N 426.319 4.330 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)CC2(C)C)C2CC2)cc1 1684496101 WYDFUUWYPYNCMP-NRFANRHFSA-N 444.620 4.462 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCCCCN(Cc4ccccc4)C3)C2)cc1 1687025577 RYZRILCRKBKCPP-XZOQPEGZSA-N 436.600 4.018 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2CC2(C)CCC2)c(C)n1-c1ccccc1 1724206115 TZBYYBBHXGSLSE-KRWDZBQOSA-N 434.588 4.243 10 10 IICE Cc1ccc(-c2nnc(N(C)CCC3CCOCC3)n2Cc2ccc(N(C)C)c(F)c2)o1 1724295752 HWNOZEATAWFORJ-UHFFFAOYSA-N 441.551 4.353 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CCc1nc2c(s1)CCCC2 1747750324 PFBYZZWTFOFZEG-UHFFFAOYSA-N 425.602 4.496 10 10 IICE CC(C)c1nnc(N2CCCN(c3nccs3)CC2)n1CCCSc1nccs1 1750641862 QQOLGPDXNVQVKE-UHFFFAOYSA-N 449.675 4.214 10 10 IICE CC(C)CN(c1nnc(CC2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1750823527 TZZIZKOHSYHOPA-UHFFFAOYSA-N 429.584 4.125 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCCNC(=O)OC(C)(C)C 1751880515 SGVOTIAKWOFHDG-UHFFFAOYSA-N 442.608 4.128 10 10 IICE C[C@@H]1C[C@@H](C)CN(C(C)(C)Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)C1 1751996317 XSYSYLIEUQVFKO-WOIUINJBSA-N 441.620 4.228 10 10 IICE C[C@@H]1CC[C@@H](Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)C1 1752074580 NVBPGTLWJCXIGL-TZIWHRDSSA-N 425.621 4.485 10 10 IICE CCC[C@H](Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1763878674 YQWRJTOJYIHIDG-JOCHJYFZSA-N 427.593 4.086 10 10 IICE CS[C@H](C)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1771392895 VGZHFDHWHOLRDK-LJQANCHMSA-N 436.629 4.252 10 10 IICE CCCC(=O)NCc1ccc(OC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1858892407 VYPNWMYLOYTGMI-UHFFFAOYSA-N 442.471 4.489 10 10 IICE O=C(CNCc1cccc(Cl)c1Cl)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1860718590 ACZGHBVRDZJALP-UHFFFAOYSA-N 439.298 4.497 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2c(F)c(F)c(F)c(F)c2F)N2CCCCC2)cc1 1866171819 PTEIZJDHHAGPLL-OAHLLOKOSA-N 441.444 4.405 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(O)c4cc(Cl)cc(Cl)c4n3)CC2)cc1 1866538777 AQRFEQVVEAFFNG-UHFFFAOYSA-N 432.307 4.218 10 10 IICE CCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2[C@@H](C)COC[C@@H]2C)n1 1868274247 AOFMBTRCYPWVKU-HOTGVXAUSA-N 442.519 4.172 10 10 IICE CCCCCN1C(=O)C(NCCOC(C)C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165403 MXGRTEOYBJGIGL-UHFFFAOYSA-N 437.584 4.379 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C(F)F 1878709861 JUIBLRAMYVIULV-DOTOQJQBSA-N 429.280 4.149 10 10 IICE C[C@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(-c2ccccc2)c1I 2070262312 QKNIKJDGZVZHGT-LLVKDONJSA-N 435.221 4.378 10 10 IICE Cc1cc(O)c([C@@H](n2nc(C)c(CO)c2I)C(C)(C)C)cc1C 2079933747 IZZMLGACFCWDER-MRXNPFEDSA-N 428.314 4.246 10 10 IICE COC(=O)c1c(C(C)(C)C)nn([C@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080051933 GKWVIAHNSUAADW-INIZCTEOSA-N 437.334 4.443 10 10 IICE CC[C@@H](NC[C@@H](CCOC)NC(=O)OC(C)(C)C)c1cc(Br)ccc1O 2225569034 LLYFUQUPJJLNRE-GDBMZVCRSA-N 431.371 4.125 10 10 IICE CC(C)CN1C(=O)C(=Cc2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 2314414637 HCYUTKNMVUCFOR-UHFFFAOYSA-N 442.610 4.296 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)ccc1O 2321629579 BQJDBHQCJKWUNU-UHFFFAOYSA-N 432.479 4.114 10 10 IICE Cc1ccc(CN[C@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)c(O)c1Br 2352691475 GASRIXIQHDPCBS-YWZLYKJASA-N 425.367 4.485 10 10 IICE COc1ccc(N2C(=O)/C(=C3\C(=O)Nc4ccc(Br)cc43)SC2=S)cc1 1750218 HFKLKBRDAIRWDK-CCEZHUSRSA-N 447.335 4.186 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccc(Br)cc1 35640523 LQKUEPCTPIUZMP-UVTDQMKNSA-N 437.340 4.272 10 10 IICE Cc1cccc2cc(/C=C3\SC(=S)N(CC(C)C)C3=O)c(N3CCOCC3)nc12 38732225 UAMVZTCZEGUREV-PDGQHHTCSA-N 427.595 4.237 10 10 IICE CN(C)CCOc1ccccc1-c1csc(NS(=O)(=O)c2ccc(Cl)cc2)n1 71556399 BONRRZFKVVJQOO-UHFFFAOYSA-N 437.974 4.205 10 10 IICE O=C(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 226837812 HJGRQAURCQFWEW-FXKZBUDASA-N 435.480 4.036 10 10 IICE CCN(C(=O)c1cc(I)ccc1Br)c1ccc(N)cc1 233449313 MHQIHYHYISLTJB-UHFFFAOYSA-N 445.098 4.303 10 10 IICE CNC(=O)c1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1Cl 435558962 HBGNWQRFTUELIX-UHFFFAOYSA-N 438.959 4.060 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N(C)C)CC2)c(C)n1-c1cc(Cl)cc(Cl)c1 727237592 MLBLHBIIWOEQAK-UHFFFAOYSA-N 436.383 4.384 10 10 IICE COc1cc(N(C)CC(=O)N[C@@H](C)c2ccc(Cl)c(Cl)c2)cc(OC)c1OC 741795209 HOXOTGMGRBAXFX-LBPRGKRZSA-N 427.328 4.333 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cc(C(=O)N(C)C)ccc3Cl)n2)cc1 747751245 JVHIWEIVQXGBDN-UHFFFAOYSA-N 435.958 4.275 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(CN2CCCC2)c1 768914572 FNMZTIPHLWTXQI-JOCHJYFZSA-N 427.976 4.036 10 10 IICE Cc1cc(Cl)cc(CN2CCC(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)CC2)c1O 775679229 RKDSWMUVUYIAJW-CQSZACIVSA-N 428.916 4.168 10 10 IICE C[C@H](NC(=O)C1(c2ccccc2Br)CC1)c1ccc(N2CCOCC2)cc1 788832016 MGMMZRNLRXMWHE-INIZCTEOSA-N 429.358 4.195 10 10 IICE COC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802683860 BKXAACMKEVQRTN-GMAHTHKFSA-N 449.599 4.394 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c1O 856600024 PRHXAUNPJQDIML-NRFANRHFSA-N 431.964 4.137 10 10 IICE CCOC(=O)[C@@H](C(C)C)N1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1081156839 KWMCGNCXTRKJAY-KADHNRKRSA-N 428.373 4.238 10 10 IICE Cc1cc2c(cc1NC(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)OCO2 1127885679 YULDIGQLVSWZIY-NVMNQCDNSA-N 444.509 4.093 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1cccc(C(=O)c2ccccc2)c1 1133123662 VIWKIPXNBDXTKM-OAQYLSRUSA-N 441.575 4.089 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CN3CCOCC3)c3ccc(C)cc3)c2C)cc1 1135768258 FZWBFUQHFWQVBF-AREMUKBSSA-N 447.579 4.214 10 10 IICE CSc1ccc(N2C[C@H](C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)CC2=O)cc1 1135964485 CJYVIMKMZUXXIE-HXUWFJFHSA-N 437.609 4.410 10 10 IICE Cc1cc(CC(=O)NCc2nc3ccc([N+](=O)[O-])cc3[nH]2)c(C)n1-c1ccc(Cl)cc1 1139346023 LSOACANRWYZHOV-UHFFFAOYSA-N 437.887 4.391 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccn1 1141867814 GTINDSCHYUFDGQ-HZGBGQKMSA-N 429.542 4.080 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(Cl)cc(F)c1Br 1148705430 HZLHLQGWRNEXMZ-UHFFFAOYSA-N 441.728 4.133 10 10 IICE Cc1ccc(-c2n[nH]c(NC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)n2)o1 1160949359 XINXAIRYHKVAEX-UHFFFAOYSA-N 441.289 4.190 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)CN(c4ccccc4)C3=O)c2C)cc1 1188641456 ADRUNJFHXICBOZ-UHFFFAOYSA-N 431.492 4.144 10 10 IICE C[C@H](CCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N1CCCCC1 1288567431 VCHRHRAGFVCLAD-KNQAVFIVSA-N 427.593 4.126 10 10 IICE C[C@@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)N(C)C(=O)OC(C)(C)C 1288636498 ALFZINVGDOWQEQ-INIZCTEOSA-N 429.565 4.143 10 10 IICE COc1ccc(CNC(=O)c2cc(Nc3nccc(C(F)(F)F)n3)ccc2C)c(O)c1 1296967428 CASQQGAMLHUZCO-UHFFFAOYSA-N 432.402 4.192 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCC1(c2cccc(Cl)c2)CCC1 1313169466 XRGKXQHTUNBOJT-UHFFFAOYSA-N 427.976 4.440 10 10 IICE CC(=O)c1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1354539520 OCVDDVRHPORPOF-PDGQHHTCSA-N 428.510 4.258 10 10 IICE COc1ccc2c(c1)c(C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)c(C)n2C 1360045525 KMCUXGZVQKKXCF-UHFFFAOYSA-N 443.494 4.496 10 10 IICE Cc1ncccc1[C@@H](C)OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1461686720 CMZKRKPOBPCBCU-CRRKTRLDSA-N 430.526 4.425 10 10 IICE O=C(CCCc1ccc2c(c1)OCCCO2)NCc1ccc(N2CCSCC2)cc1 1464258206 HFHLCQDEVVBPFI-UHFFFAOYSA-N 426.582 4.040 10 10 IICE COC(=O)C1CCN(CCCNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CC1 1464882992 XRVDKDKIVNPGDX-UHFFFAOYSA-N 439.600 4.222 10 10 IICE O=C(N[C@H]1CCN(c2ccc(Cl)cc2F)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1471005149 QYGYFZYWJHSHLJ-OALUTQOASA-N 447.938 4.154 10 10 IICE CN1CCN(C(=O)CSc2ncc(-c3ccc(Cl)cc3)n2Cc2ccccc2)CC1 1472928715 BSQVWEIVKAELIB-UHFFFAOYSA-N 441.000 4.118 10 10 IICE C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786230 LNWNSASKSIRDPC-VGSWGCGISA-N 429.511 4.484 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(COC)CC1 1503202745 SMZCYPGQOZNIFO-UHFFFAOYSA-N 437.588 4.252 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C(C)C)C1 1503930423 NSJHVJAXQWEAPS-WMZHIEFXSA-N 437.588 4.249 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](C(C)C)N3C(=O)c4ccccc4C3=O)c2C)c1 1531612580 SXNSICIHGZBBID-XMMPIXPASA-N 443.547 4.340 10 10 IICE C[C@@H]1CCc2sc(-c3nnc(N(C)Cc4ccccc4O)n3C[C@@H](C)N(C)C)cc2C1 1543868692 SWJJLDZGIVLMCE-IAGOWNOFSA-N 439.629 4.424 10 10 IICE COc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(C)c1 1543978528 FNLALBQCUJCEDT-UNOMPAQXSA-N 444.553 4.050 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3ccc(Br)c(C)c3)CC2)cc1F 1545606271 JTMCHOVCMHGHRA-UHFFFAOYSA-N 435.337 4.187 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CCCSC1 1554159602 JBBPIVKNZCUXMT-FQEVSTJZSA-N 443.661 4.192 10 10 IICE Cc1ncc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(Cl)c1Cl 1558949142 MBZXHRYTCFEDLG-CQSZACIVSA-N 428.747 4.450 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(CCCO)CC2)sc(C)c1-c1ccccc1 1559672962 YJZGCDLGWKXRJY-UHFFFAOYSA-N 444.597 4.323 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC2(CC1)OCCc1ccsc12 1564946185 ZGORFYNFWLGVNB-GOSISDBHSA-N 427.614 4.327 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)cc1 1584698296 ROJWNUYICGXKDN-OAQYLSRUSA-N 441.453 4.426 10 10 IICE Cc1cccc2c1CCC[C@@H]2NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1585582264 UXLDMYJZOADSIP-IBGZPJMESA-N 442.562 4.370 10 10 IICE Cc1cccc(NC(=O)CSCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 1587461613 RKXQVYGLUMXLAR-UHFFFAOYSA-N 435.593 4.433 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OC(F)F)cc1F 1595582049 BHCIJCKXBFIVNJ-AWEZNQCLSA-N 428.838 4.181 10 10 IICE O=C(NCc1c(O)cccc1F)c1nn(-c2cc(Cl)c(Cl)cc2Cl)cc1O 1611667031 LUIMLSFPLNJPGV-UHFFFAOYSA-N 430.650 4.313 10 10 IICE C[C@@H]1CC[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1612716620 HQTKTXGMDXMNRF-WOJBJXKFSA-N 425.621 4.376 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CO)CC1 1620192406 YQQVZVBUSXGKPE-GOSISDBHSA-N 439.629 4.313 10 10 IICE Brc1cc(CNCc2ncn(-c3ccccc3)n2)ccc1N1CCCCC1 1620951096 YUBLZNKQOLAPDX-UHFFFAOYSA-N 426.362 4.310 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3sc(SCC(C)C)nc3C)CC2)cc1F 1622578819 IHVXQUQCKIRCII-UHFFFAOYSA-N 437.606 4.239 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1c(Cl)ccc(I)c1F 1623387319 XNAWIZDKGIYGNK-UHFFFAOYSA-N 446.691 4.422 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)Cc2ccco2)c(C)n1-c1ccc(Br)cn1 1629803471 DJTZCTOVUJQQQG-UHFFFAOYSA-N 445.361 4.049 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)C1CCCC1 1637561209 ICTLTGNHONSGPU-ICSRJNTNSA-N 446.588 4.353 10 10 IICE CCOc1ccc(OC(=O)CSc2ncc(-c3ccc4c(c3)OCCO4)n2CC)cc1 1640759454 WDPKVJXQVDXGGN-UHFFFAOYSA-N 440.521 4.438 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCOCCCNC(=O)OC(C)(C)C)c1C 1643212064 YFWBUUOCFFXAKE-UHFFFAOYSA-N 429.561 4.064 10 10 IICE COc1cccc2[nH]cc(CCNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)c12 1651625729 UXTQFTZNWMCOTR-UHFFFAOYSA-N 429.520 4.298 10 10 IICE Cc1cc(C(=O)Cn2nc3ccccn3c2=O)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1 1651759670 HVVDVOHBIDLBPL-UHFFFAOYSA-N 448.832 4.459 10 10 IICE CN(CC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(OCc2ccccc2)cc1 1653310123 FXUBPUVKUBGYOC-VWLOTQADSA-N 434.511 4.441 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2nccnc2C)sc(C)c1-c1ccccc1 1654711281 CXJAEPWNYZHYAG-HNNXBMFYSA-N 438.553 4.288 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4cccc(F)c4F)CC3)C2)cc1 1673823422 SKEKZWGRTBLCHZ-IBGZPJMESA-N 443.538 4.464 10 10 IICE C[C@H](NC(=O)N1CCC[C@@H]2CC[C@@]21CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1680281235 WMWABZQEHVDKGU-RGZWJVDOSA-N 430.593 4.293 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Oc4cc(C)ccc4C)CC3)C2)cc1 1683336783 LCKUGGDUPPBUBC-NRFANRHFSA-N 437.584 4.391 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H](O)c3ccc(-c4ccccc4)cc3)C2)cc1 1683504152 LWYWXZQFKQMXLX-RXFWQSSRSA-N 445.563 4.221 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(CCc1ccc(F)cc1)C1CCCC1 1684141260 GLRBQPIBQNBQAX-UHFFFAOYSA-N 439.575 4.484 10 10 IICE CCc1noc([C@H]2CC[C@@H](NC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)n1 1684438042 ZRTWVVRYCMRKKC-RBUKOAKNSA-N 437.544 4.339 10 10 IICE COc1ccc(C[C@H]2CCCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)C2)cc1 1684606307 DXJGXFWPBPQCGS-BWKNWUBXSA-N 438.616 4.028 10 10 IICE C#C[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@H](O)C1 1705478512 CRDHPJQKYXOTJN-HARLFGEKSA-N 431.584 4.362 10 10 IICE Cc1ccc(-c2nnc(N3CCS[C@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1724327329 SVKWSDPOLZUGDE-JKSUJKDBSA-N 429.565 4.430 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1727699636 SKZIGEIGWKCBQR-JDLLUZBXSA-N 441.620 4.050 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@]3(CCCOC3)C2)cc1 1746087587 ZWSTUZHNYRFBMG-NBGIEHNGSA-N 441.620 4.070 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1746091685 FGKYZUDYTGASBI-QHCPKHFHSA-N 448.615 4.020 10 10 IICE CO[C@]1(C)CCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1748472896 JZOOPQUASKEYGX-OXQOHEQNSA-N 437.635 4.164 10 10 IICE Cc1cc(-c2nnc(N(C)CCc3cnccn3)n2CC(C)C)c(C)n1-c1ccccc1 1751409325 YRTHMJSVZBJVMV-UHFFFAOYSA-N 429.572 4.478 10 10 IICE CCc1nc(CN(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)cs1 1764639993 UIXLQOAISLOKGW-UHFFFAOYSA-N 447.612 4.418 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1770784532 QASWUFPAUUCOKK-MJGOQNOKSA-N 443.592 4.279 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3c(C)nn(-c4cccc(Cl)c4)c3C)CC2)cc1 1869931080 RLJBVBLFTSNMST-UHFFFAOYSA-N 438.959 4.042 10 10 IICE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2ccc(I)c(Br)c2)C1 1912198332 FNLKHXYDOAOECX-VIFPVBQESA-N 449.090 4.216 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)C[C@]2(C)C1 2172909934 QZNOVLDYDSZTNA-XBHMSOGKSA-N 443.357 4.419 10 10 IICE COc1ccc(Br)c(CN[C@@]23CCCN(C(=O)OC(C)(C)C)C[C@@H]2C3)c1O 2236056533 WFZWOFPJXYSIES-RNODOKPDSA-N 441.366 4.043 10 10 IICE CSc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)cc1 2294130906 NYYOLJMVBBWTJA-UHFFFAOYSA-N 431.311 4.146 10 10 IICE CSC1=NSC2=NC(=O)C(=Cc3ccc(OC(=O)c4cccc(C)c4)cc3)C(=N)N12 2297333723 JNCFNFKPXOHTLB-UHFFFAOYSA-N 436.518 4.154 10 10 IICE N=C1C(=Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C(=O)N=C2SC(C(F)(F)F)=NN12 2297337971 PWJRNYQGCCMJTH-UHFFFAOYSA-N 435.343 4.036 10 10 IICE O=C1C(=Cc2cc(Cl)cc(Br)c2O)SC(=S)N1C[C@H]1CCCO1 2323745192 KZHAXKNWAJYXTK-SNVBAGLBSA-N 434.764 4.188 10 10 IICE COc1cc(C=C2SC(=S)N(C34CC5CC(CC(C5)C3)C4)C2=O)cc([N+](=O)[O-])c1O 2323854275 DECMKZFCFYNSIY-UHFFFAOYSA-N 446.550 4.479 10 10 IICE Cc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC[C@@H]4CCCO4)cc3[C@@H]3C=CC[C@H]32)s1 20689728 CCSWNPMIFJLQGP-VXCZRNDOSA-N 430.595 4.340 10 10 IICE COc1ccc(N2CCN(c3ncnc(Oc4ccc(C)c(C)c4)c3[N+](=O)[O-])CC2)cc1 40611291 JLJLVTYTUBKNMX-UHFFFAOYSA-N 435.484 4.129 10 10 IICE Cc1noc(COCC(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)n1 97572014 ZSBHVCQVJKHFPV-UHFFFAOYSA-N 441.488 4.203 10 10 IICE CCCCCN1C(=O)/C(=C\c2cc3ccccc3nc2N2CCOCC2)SC1=S 208277991 DAEMXTRGAZMLIY-XDJHFCHBSA-N 427.595 4.463 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 226740840 MGYCDGRZADLPHE-WHSLLNHNSA-N 427.888 4.451 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1 304087406 WPYOZXGHSNSZSG-MOPGFXCFSA-N 434.458 4.218 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ncc(-c3ccccc3)o2)C1 573884602 IBKPQDNAIIUOFW-UHFFFAOYSA-N 428.536 4.379 10 10 IICE Cn1c(=O)oc2ccc(N[C@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)cc21 726603955 CUEXZUPDIXMELU-IBGZPJMESA-N 441.447 4.291 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2cnccn2)c(C)n1-c1cccc(C(F)(F)F)c1 735937929 WESMHQYZALFCEC-VOTSOKGWSA-N 429.398 4.342 10 10 IICE O=C(NCc1cc(O)nc2ccccc12)NC1CCN(c2ccc(OC(F)F)cc2)CC1 754369862 YQKSKXGOGSDSOT-UHFFFAOYSA-N 442.466 4.010 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCCCSc1nccs1)O[C@H](C)C2 759581297 SMFHKEKCGWMFBE-UKPHBRMFSA-N 433.599 4.203 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)N2C(=O)CN(Cc3cc(Cl)ccc3O)C2=O)c(C)c1 761889960 HMJGMLLKFKRDKQ-HXUWFJFHSA-N 438.915 4.065 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1cc(F)c(C(F)(F)F)cc1F 806053751 BDCVRXGADVDYLJ-UHFFFAOYSA-N 439.178 4.451 10 10 IICE Oc1ccc(Br)cc1CNCc1cn(-c2cccc(Cl)c2Cl)nn1 809712817 FQJUJFNYFHMJPT-UHFFFAOYSA-N 428.117 4.332 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@H](CC)C2 1124312960 DQOBZMCWAHALHP-JKSUJKDBSA-N 440.565 4.431 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1Br 1125257117 TUEHHXPFSBLSGM-HUUCEWRRSA-N 435.337 4.440 10 10 IICE CC(=O)c1cccc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1127657776 GBGBFLDWTNTIHS-UNOMPAQXSA-N 443.521 4.363 10 10 IICE CCOC(=O)C1([C@@H](C)NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)CCOCC1 1134595525 VNLMXOFBIIDZMY-QGZVFWFLSA-N 432.948 4.226 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1=Cc2ccccc2O[C@H]1C(F)F 1137440440 VRNVOWYOKSHXKA-DYESRHJHSA-N 448.897 4.236 10 10 IICE CC(=O)N1CCN(Cc2ccc(NC(=O)c3cc(C)n(-c4ccccc4C)c3C)cc2)CC1 1137858906 ZMJYTVALNVKKFJ-UHFFFAOYSA-N 444.579 4.319 10 10 IICE CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1148818231 OUVADLPWTWPXRU-UHFFFAOYSA-N 433.508 4.259 10 10 IICE COc1cc(I)ccc1NC(=O)c1cc(C)n(-c2ccccn2)c1C 1159345616 NUOHCDKEMGNHJP-UHFFFAOYSA-N 447.276 4.355 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2c3sccc3OC(C)(C)[C@H]2O)c(C)n1-c1ccccc1 1233973017 HOOYUSBAUYYUGK-IRLDBZIGSA-N 439.581 4.271 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@H]2c2ccc(Br)cc2)N(C)C)cc1 1251501395 QMGJRJLZTNZPAW-SFTDATJTSA-N 445.405 4.274 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@]2(C)Cc2ccc(F)c(F)c2)N(C)C)cc1 1256237232 VFFWZYXXXDKIIM-ILBGXUMGSA-N 444.570 4.440 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1 1290071750 SPMONUDULDOLRZ-UHFFFAOYSA-N 435.955 4.451 10 10 IICE CC1CCN(c2ccc(Cn3c([C@@H]4CCOC4)nnc3N(C)CC(F)(F)F)cc2)CC1 1291145342 GFQYPPNFLBNNPY-GOSISDBHSA-N 437.510 4.065 10 10 IICE CN(c1ccc(CNC(=O)CCCNC(=O)NC2CCCCC2)cc1)C1CCCCC1 1292258080 PFBSRVJIGXPDNI-UHFFFAOYSA-N 428.621 4.484 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(N(C)C(=O)OC(C)(C)C)s2)cc1 1300280582 OFYWUNSUWJVUOK-UHFFFAOYSA-N 433.574 4.336 10 10 IICE CS[C@@H](Cn1c(C2CC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 1302579973 KUEPUBKDXJYKSG-NRFANRHFSA-N 443.661 4.406 10 10 IICE CCSCCCn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C 1314622677 XQAOQFURBQAGSB-UHFFFAOYSA-N 435.613 4.193 10 10 IICE CC[C@@](C)(NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nccs1 1353971783 NJJXWJVUMAZBIA-IZLCOFNUSA-N 449.598 4.315 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCCOc3ccc4c(c3)CCC4)cc2F)C[C@@H](C)O1 1354656774 FWJVGPYOEAENCX-KDURUIRLSA-N 440.559 4.403 10 10 IICE COc1ccc2c(c1)[C@@H](C(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)CCC2 1357836116 NNZXBOXSYQGDHL-FVJLSDCUSA-N 426.532 4.184 10 10 IICE CC1(C)Cc2cc(C(=O)Nc3cccc(N(CC(N)=O)Cc4ccccc4)c3)ccc2O1 1360125054 XDHRUZJKHXHLJC-UHFFFAOYSA-N 429.520 4.144 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CCCCN3C(=O)OC(C)(C)C)ccc21 1434929458 YBCDEYPDABTTIN-HXUWFJFHSA-N 443.588 4.424 10 10 IICE Cc1cc(CCNC(=O)c2c(Cl)cccc2S(C)(=O)=O)c(C)n1-c1ccccc1 1438180068 UTUXGCRZGNDUSD-UHFFFAOYSA-N 430.957 4.124 10 10 IICE Cc1cc(C(=O)Nc2nnc(C(F)F)s2)c(C)n1-c1ccc(Br)cn1 1442112932 HLLWCOWSAHQYQI-UHFFFAOYSA-N 428.262 4.293 10 10 IICE O=C(NCCCSc1nccs1)[C@@H](c1cccc(Br)c1)N1CCCC1 1443487258 GSOVWQKWGRADCF-MRXNPFEDSA-N 440.432 4.341 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@H]21 1446660195 SNEQBICBCIULJQ-BPLDGKMQSA-N 432.542 4.078 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(CCc2ccc(Cl)cc2)C[C@H](O)C(F)(F)F)cc1 1450631603 ZPLUFHZLUBBBJU-INIZCTEOSA-N 442.825 4.111 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3cn(C)nn3)C2)c(C)n1-c1cccc(Br)c1 1457191675 VMUSLSOKBPZHTE-MRXNPFEDSA-N 442.361 4.005 10 10 IICE CCN(C)C(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C(C)C 1468243937 WWFKCRQHTNTLDD-IBGZPJMESA-N 434.378 4.089 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@H]2CCC[C@H]2O)c(C)n1-c1ccc(Br)cn1 1468281097 QYYQXDVQZSDVNY-BHIYHBOVSA-N 432.362 4.017 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C 1471935064 SFYCBQIPFKBZRK-OXQOHEQNSA-N 439.556 4.139 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ncc(Br)s1 1479163996 NANVLDNEHSEAJW-UHFFFAOYSA-N 449.168 4.105 10 10 IICE C[C@H]1CCC[C@@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1512115598 YBDCJHQCHFFPOW-SIKLNZKXSA-N 425.621 4.475 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@@](C)(O)C1CCCCC1 1517149893 WEFLWBNAIMVUQR-ZJSXRUAMSA-N 428.577 4.193 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CCCC4)n3CCCSC)CC2)cc1 1518306809 ARRCXEVFAQVZOX-UHFFFAOYSA-N 443.661 4.489 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)ccc21 1526200168 LDIPFIKPCHTWMP-AEFFLSMTSA-N 433.552 4.001 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C1CCC(F)CC1 1533764861 VKHILAYGQFFYIZ-QMZWLLKNSA-N 438.565 4.450 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)cc1 1541050109 UUQMBLDOKZCPBJ-UHFFFAOYSA-N 443.503 4.131 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCNc2ccc(C(F)(F)F)cn2)c1 1544209737 ROPLCGSTMVEBNM-UHFFFAOYSA-N 430.430 4.162 10 10 IICE CCOC(=O)[C@@H]1C[C@H]1C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1558919674 XVTXBIYSVVULHU-LMMKCTJWSA-N 434.458 4.497 10 10 IICE CNC(=O)COc1cccc(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)c1 1568722807 UGGZPRQYMIXXBJ-UHFFFAOYSA-N 433.552 4.272 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCC[C@H]1CC1(Cl)Cl)c2[N+](=O)[O-] 1585166080 MVCBEVCHFLYYBG-NSHDSACASA-N 447.274 4.074 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1596056287 BLFNVYHHVLNWKB-LJQANCHMSA-N 431.964 4.416 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1csc(-c2ccccc2C)n1 1597567556 RMCMXHUIJFXGMN-UHFFFAOYSA-N 430.913 4.293 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)n(-c2cccc(Cl)c2)n1 1632701582 JERCXNQBKNKITN-UHFFFAOYSA-N 448.306 4.009 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)OC2CCCC2)c(C)n1-c1cccc(Br)c1 1634951078 LIDWHELCRHAPDR-AWEZNQCLSA-N 433.346 4.461 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)c1 1636397404 UASXLAMDPAUCPH-UHFFFAOYSA-N 431.005 4.387 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(OCc2cccc(C)c2)c1 1638529408 ORXWNCVQMNKFNV-UHFFFAOYSA-N 433.504 4.485 10 10 IICE CCN(CCc1cccs1)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1641602946 KBIKTROODVURNJ-INIZCTEOSA-N 432.545 4.415 10 10 IICE COCCN(CC(=O)Nc1nc(-c2ccc(C)cc2)cs1)c1ccc(OC)c(OC)c1 1642040703 AEVCMUHCPIAKAP-UHFFFAOYSA-N 441.553 4.227 10 10 IICE CCCCC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1647827417 BWSMVALBNIMFIK-RZUBCFFCSA-N 433.612 4.490 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)C1(c2ccccc2)CCCC1 1681478926 JCIAFQUBKIQYFG-FQEVSTJZSA-N 448.611 4.088 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)c2C)c1 1684479064 RILSUDCSGHEHOQ-GOSISDBHSA-N 428.577 4.457 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(C)C)C1 1695499909 WYAXMXWOPIWOSZ-NRFANRHFSA-N 448.615 4.313 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCC(OC(C)(C)C)CC1 1707305474 ASGWSRRIPPZCJJ-UHFFFAOYSA-N 425.621 4.437 10 10 IICE CN(C)c1ccc(Cn2c(-c3cc(Br)c[nH]3)nnc2N2CC=CCC2)cc1F 1711003512 GNXVZLMLSWZXFU-UHFFFAOYSA-N 445.340 4.055 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2COC(C)(C)OC2)n1CCCSc1nccs1 1726889201 ORYHWPLIOQWQCI-HNNXBMFYSA-N 439.651 4.266 10 10 IICE CCSCCCn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1747513568 JDYCWBQWJKXHKI-UHFFFAOYSA-N 429.634 4.162 10 10 IICE CCc1nnc(N(C)Cc2ccc(Br)o2)n1CCCSc1nccs1 1764716342 UJIPSRHOUBCUMG-UHFFFAOYSA-N 442.408 4.471 10 10 IICE CCC[C@](C)(O)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1765462555 XYFSHDSNMVTTRS-SANMLTNESA-N 448.615 4.052 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCN(C(C)=O)CC1 1765769273 BKOPMEXKPXBIFA-UHFFFAOYSA-N 434.588 4.211 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCCO2)n1CCOC(C)(C)C 1767080328 FARTXOWLJOXPBW-OAQYLSRUSA-N 427.593 4.181 10 10 IICE COC(=O)c1c(NC(=O)C(=O)NCc2ccccc2F)sc(C)c1-c1ccc(C)cc1 1860761340 RHEBGQZZRPHRDJ-UHFFFAOYSA-N 440.496 4.213 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010406570 WFFNKBFNXXTYDA-OALUTQOASA-N 431.537 4.178 10 10 IICE CC(C)(C)OC(=O)NC1(c2csc(=NCc3c(O)cccc3Br)[nH]2)CC1 2224310084 FSLOQVPLSSFZEB-UHFFFAOYSA-N 440.363 4.159 10 10 IICE Cc1cccc(-n2c(C)cc(C=C3C(=N)N4N=C(c5cccnc5)SC4=NC3=O)c2C)c1 2297469214 BVDDWNPRFNPZJM-UHFFFAOYSA-N 440.532 4.465 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)c1 2318757375 ZIKXVSUKBOHMOW-UHFFFAOYSA-N 434.882 4.441 10 10 IICE Cc1ccc(CNC[C@H](CC(F)(F)F)NC(=O)OC(C)(C)C)c(O)c1Br 2352941042 LONHFEKKWIWACJ-LBPRGKRZSA-N 441.288 4.398 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3CC[C@H]([C@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2380801708 AHCNGDHBGVHAQJ-MPTYRVRUSA-N 443.357 4.431 10 10 IICE CCCCCN1C(=O)/C(=C2/SC(=S)N(CCC(=O)OCCC)C2=O)c2ccccc21 206844894 UHWGEBBOZDPZNK-VHEBQXMUSA-N 446.594 4.138 10 10 IICE CCOC(=O)[C@H](NCCCN=[N+]=[N-])c1cc(Br)c(Br)s1 227903056 CBSIIAOBRPGDFG-SECBINFHSA-N 426.134 4.167 10 10 IICE CCn1nc(C)c(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)c1C 743046751 PVSPMRWVJWVNBG-UHFFFAOYSA-N 447.405 4.268 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 743808568 XPWMELAGOLBWLA-SCLBCKFNSA-N 431.330 4.412 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H](c2cnn(C)c2)C(F)(F)F)cc1 772789347 BTYTZVFTFIWNGF-LJQANCHMSA-N 435.450 4.095 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCC(c2ccsc2)CC1 777252496 CZVHVZFKAUXKHX-UHFFFAOYSA-N 438.641 4.369 10 10 IICE COc1cccc([C@H]2[C@@H](NC(=O)NCc3ccc(N4CCCC4)cc3)CCN2C2CC2)c1 778620548 NNSDMYKUCXZFFY-DQEYMECFSA-N 434.584 4.073 10 10 IICE COc1ccc(Cl)cc1N1C(=O)/C(=C/c2c(Br)cnn2C)SC1=S 779221212 RBXUPPVJZSDBIM-MLPAPPSSSA-N 444.763 4.250 10 10 IICE Cc1cc(C)c(N2CC[C@H](N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)c(C)c1 788983947 PMCFIIWKFCQGCF-KNQAVFIVSA-N 425.548 4.044 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F 791246603 OYFYVSQQTVCTNW-ICSRJNTNSA-N 430.495 4.457 10 10 IICE O=C1N[C@H](Cc2cccc(Cl)c2)C(=O)N1[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804174529 GLFKBORFZXCWHY-IEBWSBKVSA-N 449.885 4.073 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1CCc1ccccc1 917641871 BYQOCDSNSJTLJT-RAXLEYEMSA-N 441.315 4.328 10 10 IICE CC(C)[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(Cl)c1 1133626384 JEZLMPADPKXSIY-JOCHJYFZSA-N 427.976 4.098 10 10 IICE Cc1cc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1136379364 XVBGXLIVROBBEI-OWCLPIDISA-N 447.421 4.348 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)Nc2c(F)cccc2F)sc2c1CCCC2 1138288534 MELIWXMPSWFFPA-UHFFFAOYSA-N 436.480 4.439 10 10 IICE CC(C)(C)OC(=O)NCCCCCCC(=O)NCc1ccc(N2CCSCC2)cc1 1141803140 FQLITNBTPHANSF-UHFFFAOYSA-N 435.634 4.331 10 10 IICE O=C(CSc1ccccc1Br)NCc1ccc(N2CCSCC2)cc1 1141804333 WLRZFLHVOPAYMK-UHFFFAOYSA-N 437.428 4.411 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@]2(C)CC2(Br)Br)cc1 1290324419 QECOPEAHIGMMOY-MRXNPFEDSA-N 432.200 4.387 10 10 IICE Cc1noc(C)c1CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1290928555 BSBHEVPFNJKNFH-OAQYLSRUSA-N 442.539 4.014 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC[C@H](C)N(C)C(=O)OC(C)(C)C)c2C)cc1 1293241578 RRDOXRHWLRPCSP-INIZCTEOSA-N 429.561 4.478 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1ccc(S(=O)(=O)NCC(C)C)cc1 1295852286 NNBJKZCALCEGTD-UHFFFAOYSA-N 445.610 4.020 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)c(OC)c1 1308014677 UMASPTPDNKPFFN-UHFFFAOYSA-N 447.535 4.257 10 10 IICE Nc1c(Cl)cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1445887605 VGHSKRNZFMUPDT-CQSZACIVSA-N 428.747 4.329 10 10 IICE COC(=O)C[C@@H]1CCC[C@H]1NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1457349446 XMHOYXFAVRSLNA-MAUKXSAKSA-N 433.346 4.318 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)ccc(C)c4[nH]3)CC2)cc1 1465890097 UWAHEBLLCUZFHJ-UHFFFAOYSA-N 428.330 4.210 10 10 IICE C[C@H]1CC[C@H](c2nc(CC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cs2)CC1 1526004032 WEPSDDRYMSIWEU-SAABIXHNSA-N 431.577 4.271 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2C[C@@H]2CC2(C)C)c(C)n1-c1ccccc1 1542179773 OVZAIMMJZVQQGO-LPHOPBHVSA-N 434.588 4.099 10 10 IICE Cc1ccc(C(=O)N2CCC(NC(=O)c3ccoc3C)CC2)cc1-n1c(C)cc(C=O)c1C 1546254822 SZUZCCYSKHGMMH-UHFFFAOYSA-N 447.535 4.151 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1C[C@@]1(C)OCCc2sccc21 1554175441 XTGFTPHIJNJGIA-HSZRJFAPSA-N 426.586 4.467 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]3CCC[C@@H]32)n1Cc1ccc(N(C)C)cc1C 1555658025 ZEYGEGBOOOLGAB-VIZSFHNOSA-N 441.620 4.194 10 10 IICE COC(=O)[C@H](C)Oc1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1F 1557528172 NKBPLFZFXYMGPU-INIZCTEOSA-N 438.455 4.238 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F 1564946234 LPTDYKJWTGEPKO-NYSBEXSLSA-N 435.490 4.226 10 10 IICE COc1ccc2ccccc2c1CCNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1565329684 YMARYYDVBZQFFN-DEOSSOPVSA-N 434.584 4.059 10 10 IICE Cc1ccc(N2CC[C@@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1565783984 KMVOWIMPTPUXNB-HSZRJFAPSA-N 429.520 4.059 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)COC(c3ccccc3)c3ccccc3)C2)cc1 1585665898 WQQXTKUETIXCFY-NRFANRHFSA-N 430.548 4.444 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)CCS1 1614227793 RNFLJNIGDBYJOX-OAHLLOKOSA-N 434.660 4.254 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(=O)N(C)C)C1CC1 1615201325 DCLWWOARKMTGBC-UHFFFAOYSA-N 434.588 4.210 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CCC(C(C)C)CC2)cc1 1615379009 ANDHYAJJSWKTKW-UHFFFAOYSA-N 435.620 4.446 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1CCCC2(CCC2)O1 1616245300 LLGGKRBZTWPABX-NAVNFMRLSA-N 448.585 4.025 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC[C@@H](C)N(C)C(=O)OC(C)(C)C)CCCC1 1616953582 LCABZTZAUVDVGY-QGZVFWFLSA-N 443.588 4.290 10 10 IICE COc1cc(N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)ccc1F 1617787182 VOYLBNHEGOFAAT-UHFFFAOYSA-N 435.499 4.017 10 10 IICE COc1cc(OC)cc(C2(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CCCC2)c1 1618642767 IKSXGQKCJVMWCE-DEOSSOPVSA-N 439.600 4.001 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC)C(C)(C)C(=O)OC)sc(C)c1-c1ccccc1 1620606646 XIBWNSPAXCJSTJ-UHFFFAOYSA-N 446.569 4.112 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccc(O)cc3)CC2)c(C)n1-c1ccc(Cl)cc1 1629948832 BTVZZPHUUAOJFL-UHFFFAOYSA-N 437.927 4.051 10 10 IICE CCCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1631211078 CKROANCZMVERKL-OALUTQOASA-N 439.600 4.072 10 10 IICE O=C(NCCc1cc2ccccc2s1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635723848 UXKYITYFSCHEKV-UHFFFAOYSA-N 431.508 4.058 10 10 IICE CCOC(=O)c1ncc(Br)c(N(C)Cc2ccc(N3CCCCC3)cc2)n1 1642001902 JTAZDKGUEQVTFB-UHFFFAOYSA-N 433.350 4.043 10 10 IICE CCCn1nccc1NC(=O)CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1 1651739506 KHLBAANTEVSHMF-SFHVURJKSA-N 425.558 4.066 10 10 IICE COc1ccc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(F)c(Cl)c4)c3C)cnc2c1 1652738226 PDVFEPXHYOGWKL-UHFFFAOYSA-N 439.874 4.488 10 10 IICE COc1ccccc1NC(=O)c1ccc(NC(=O)[C@H](C)N[C@H](C)c2ccccc2O)cc1 1655349023 AFDHRCQRYDWBHO-SJORKVTESA-N 433.508 4.331 10 10 IICE Cc1cc(CNC(=O)NCc2ccncc2OCC(F)(F)F)c(C)n1-c1ccccc1 1681815837 XJLJSEGOGLSEBU-UHFFFAOYSA-N 432.446 4.430 10 10 IICE CN(Cc1ccccc1CNC(=O)NCc1cc(Cl)ccc1O)C(=O)OC(C)(C)C 1683780539 BWEKFHHIRZZEJU-UHFFFAOYSA-N 433.936 4.412 10 10 IICE Cc1c(Br)cccc1CCNC(=O)NCc1cccc(Br)c1O 1684006394 XWRUNLVJFDJMEW-UHFFFAOYSA-N 442.151 4.268 10 10 IICE CC(C)(C)c1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1691070731 OQDOHUUSAOJYAY-UHFFFAOYSA-N 447.574 4.068 10 10 IICE CCc1nnc(N2CC[C@H](COc3ccccc3)C2)n1CCCSc1nccs1 1709088151 ROHNEWBRTJRGNU-KRWDZBQOSA-N 429.615 4.385 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1710026247 BIFLEMAOGRVWCA-WIOPSUGQSA-N 441.620 4.420 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1724196536 RZLNVYVZXCKSMC-IEBWSBKVSA-N 434.588 4.066 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1)OC 1727243604 ZKJWJYPYDONZJG-NRFANRHFSA-N 434.544 4.402 10 10 IICE COCCO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C1 1750064407 VEQSUFOBNMIFMK-JOCHJYFZSA-N 437.588 4.250 10 10 IICE CCN(CC)C1CCN(c2nnc(C3CCC3)n2CCCSc2nccs2)CC1 1766643271 BYIXNSYOUBQFOP-UHFFFAOYSA-N 434.679 4.495 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3ccc(C)cc3)N=C2C(F)(F)F)cc(OC)c1OC 1865668014 ASBSXLJPLLUMFV-SXGWCWSVSA-N 434.414 4.365 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C(C)C)C2)sc(C)c1-c1ccc(C)c(C)c1 1865926768 LIQHMTVPKYWKGC-KRWDZBQOSA-N 428.554 4.322 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(COc4ccccc4OC)cc3)CC2)cc1 1872873683 FZJVMDILJSODTP-UHFFFAOYSA-N 432.520 4.245 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3ccc(NC(=O)c4cccs4)cc3)CC2)cc1 1874752841 ISSQKXDUCCUHLJ-UHFFFAOYSA-N 449.576 4.404 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)ccc2O)C[C@@H]1C1CC1 1895873456 GSHPMNVMBFVTHW-IAGOWNOFSA-N 425.367 4.422 10 10 IICE CC1=NN(c2ccccc2)C(=O)C1=CNc1ncc(Br)cc1Br 2296975667 WQDXMPSRBIRFRH-UHFFFAOYSA-N 436.107 4.325 10 10 IICE O=C(Oc1ccc(C=C2SC(=S)N(C[C@@H]3CCCO3)C2=O)cc1)c1cccs1 2297497544 PPJKERXDELZNHS-HNNXBMFYSA-N 431.560 4.348 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1cc(Br)ccc1O)[C@@H]2F 2333284371 GPUMEUHDJGZBDH-AIANPOQGSA-N 429.330 4.123 10 10 IICE CC[C@H](C(=O)N(C)Cc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2352658323 XNYXIGPITCIRFR-CQSZACIVSA-N 429.355 4.067 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 15040172 OAPXFMPYRQALMK-ATVHPVEESA-N 445.497 4.354 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(C2CCCC2)C1=O 33781123 DPTROKCGMCEWTK-VKAVYKQESA-N 442.610 4.440 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(C)c(C)c3)C(=O)N=C2O)c(Br)cc1O 34234903 YFVXDIVODWQEOF-AUWJEWJLSA-N 445.269 4.287 10 10 IICE COc1cc(/C=C2/SC(=S)N(CNc3ccc(F)cc3)C2=O)cc(OC)c1OC 59382345 AZEQDJICNRHKHW-LICLKQGHSA-N 434.514 4.122 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cn3cnc4ccccc43)no2)C1 563650350 OQKABWYKWHXORV-UHFFFAOYSA-N 426.524 4.237 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4ccc(F)cc4OC)CC3)ccc21 604253403 DGZINXFSOXPPAI-UHFFFAOYSA-N 439.531 4.015 10 10 IICE O=C(CN(Cc1cccs1)c1ccc2c(c1)OCCO2)N1CCC[C@H](C(F)(F)F)C1 727141529 AYVITGREJJILGP-HNNXBMFYSA-N 440.487 4.327 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](C)[C@H]2c2cccc(F)c2)c1 747460874 CMHLLRVKSCUDRX-OSPHWJPCSA-N 426.532 4.149 10 10 IICE Cc1nc(C(F)(F)F)ccc1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 801847509 YYMPBLNGLJIIHX-BETUJISGSA-N 440.441 4.483 10 10 IICE COc1ccc([C@@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1F 823310168 JEGKUXFXLSQHCF-GFCCVEGCSA-N 448.406 4.009 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)cc1 915680252 CRDQFRTZSYFUCH-NMNUPHIUSA-N 439.987 4.496 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CSc1ncc(-c2ccccc2)n1C 917192922 AMWCTDJZCZAKON-UHFFFAOYSA-N 431.565 4.298 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(Br)c(C)n(C)c3=O)c2C)c1 1132044513 SZTJPVCLSDAUGS-UHFFFAOYSA-N 442.357 4.102 10 10 IICE Cc1cc(CC(=O)Nc2ccccc2CN2CCNC2=O)c(C)n1-c1ccc(Cl)cc1 1137878991 NZMNDWSTAYCRCV-UHFFFAOYSA-N 436.943 4.454 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1 1139740232 TWQPOUQJVWOVHN-KDURUIRLSA-N 446.551 4.096 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1ccc(C(=O)NC2CC2)cc1 1141427798 HNKJAGCYYUBDFF-UHFFFAOYSA-N 429.520 4.071 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)c1 1141692357 WPEOFSNATNLDLY-HSZRJFAPSA-N 430.596 4.343 10 10 IICE CCO/C=C/[C@](O)(CNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)C(F)(F)F 1159754015 VYLWGMOWYONVMH-YXBWYFRISA-N 430.854 4.321 10 10 IICE COC(=O)[C@@H]1CC[C@@H]1C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1160646139 MYHHHWBNMZJPBL-YQVWRLOYSA-N 434.458 4.497 10 10 IICE Cc1cc(C(=O)Nc2cc(Cl)c(=O)n(C)c2)c(C)n1-c1ccccc1Br 1182911940 ZVLKHRPMDZWLLW-UHFFFAOYSA-N 434.721 4.461 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCCc1cccc(Cl)c1)c2[N+](=O)[O-] 1271089831 CBFVBRVMANPFEB-UHFFFAOYSA-N 448.862 4.386 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(OCC(F)(F)F)c3ccccc3n2)cc1 1278288070 FCWPCAQHBFMYPQ-UHFFFAOYSA-N 447.457 4.393 10 10 IICE Cc1cccc(-c2nnc(N(C)CCOC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)n1 1289931342 IRENDXPOJDUPME-UHFFFAOYSA-N 436.604 4.323 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CC1 1298830001 OGZALCZLYHASBR-QAQDUYKDSA-N 435.528 4.418 10 10 IICE CC(C)c1nnc(N2CCC=C(Br)C2)n1Cc1ccc2c(c1)CCCN2C 1302649375 QFDBECAJEZKHMP-UHFFFAOYSA-N 430.394 4.321 10 10 IICE CCCN(Cc1ccccc1O)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307502516 XIIDNZWZMNJQJY-QGZVFWFLSA-N 442.515 4.407 10 10 IICE CC1(C)[C@@H](c2ccccc2F)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065643 UDJWNCQLHFJKKH-JOCHJYFZSA-N 425.548 4.265 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@H]32)sc2c1CC[C@@H](C)C2 1353908384 VPLWLFKXICIVQT-YALNPMBYSA-N 432.586 4.072 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)CC1CC1 1361098112 ODFPYJNRBJLALC-FGZHOGPDSA-N 425.621 4.466 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)Nc1ncc(C(F)(F)F)cc1I 1458310270 NNMJRGUNGFNIEA-MRVPVSSYSA-N 438.187 4.159 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCc3nc(O)ccc32)c(C)n1-c1ccc(Br)cn1 1463895633 SVMNEODXBCXHDL-GOSISDBHSA-N 441.329 4.160 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)N(C)C)cc1 1471542475 BJXSZLVUXZICTO-VWLOTQADSA-N 433.600 4.426 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC(F)(F)CO1 1512804237 JFJNCPDADHUZEA-XLIONFOSSA-N 433.547 4.452 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)C[C@H]1C 1514402229 OODIMPKQUVFJEF-LJQANCHMSA-N 434.588 4.210 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1c(F)ccc(F)c1Cl 1516255126 AIDYCGPHRZWXEU-UHFFFAOYSA-N 434.792 4.404 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@]23CCC(=O)N2c2cc(Cl)ccc2S3)cc1 1516599637 OVNWSKOIOIHMMS-QFIPXVFZSA-N 429.973 4.431 10 10 IICE CCS[C@H]1CC[C@@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1516888686 KPYUYKXJPWHKGY-YADHBBJMSA-N 443.661 4.397 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2cccc(F)c2C1 1520752520 BYQUUXKRCCOFAX-UNOMPAQXSA-N 444.528 4.141 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(OC4CCCCC4)c3)cc2F)C[C@@H](C)O1 1526002961 KBXIQLRPSRPSHE-HDICACEKSA-N 441.547 4.476 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc(N2CCCC2)c1 1527245737 MZBBHCLSNGNAAL-UHFFFAOYSA-N 433.474 4.072 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCOc3ccc4ccccc4c3)cc2F)CC1 1528693523 RGMCVWYDBFPOIL-UHFFFAOYSA-N 435.543 4.206 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@@H](C)Cc3ccc(Cl)cc3)CC2)cc1 1531524518 MVTHIBPMLWVEHA-FQEVSTJZSA-N 444.019 4.246 10 10 IICE CC[C@@H](Oc1cccc(C)c1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1534123148 FVBWRZLGXJULPI-OAQYLSRUSA-N 436.474 4.324 10 10 IICE Cc1nc(C2CC2)ccc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1544267651 GOPQHRNYTOSQBO-QFIPXVFZSA-N 438.572 4.329 10 10 IICE C[C@H](O)c1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1F 1556525225 KLSABNFOJONMCE-XACIZNRCSA-N 448.516 4.248 10 10 IICE CSc1ccc([C@@H](C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559781358 DCMUHKRBZADEHH-OAHLLOKOSA-N 430.529 4.473 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccn(-c4cccc(C(F)(F)F)c4)n3)C2)cc1 1584444599 TZFSCEJFCZWGEU-INIZCTEOSA-N 444.457 4.156 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cccc(C)c4nc3Cl)CC2)c(OC)c1 1595997594 XYOMXSNEDBRBAB-UHFFFAOYSA-N 425.916 4.176 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(Cn2cc(Br)cn2)s1 1597780873 KMLFJLOEEXMZMP-UHFFFAOYSA-N 447.402 4.484 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1598028338 JLJXIBXDHDKREF-QMMLZNLJSA-N 437.559 4.292 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(OC)cc1 1606860832 VSJQKGQDERAASK-UGKGYDQZSA-N 444.959 4.450 10 10 IICE COC1CCN(c2ccc(CN3CCC(C(=O)NCc4ccc(C)cc4)CC3)cc2)CC1 1615740860 VNXKEFAMFOIUJM-UHFFFAOYSA-N 435.612 4.139 10 10 IICE COc1ccc(N2CCCN(C(=O)C3=Cc4ccccc4O[C@H]3C(F)(F)F)CC2)cc1 1626318928 NGKNHGPEJBXCHG-OAQYLSRUSA-N 432.442 4.141 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)C[C@H](C)NC(=O)OC(C)(C)C 1627448070 JYYCIASWBPOHRY-HOTGVXAUSA-N 427.545 4.328 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](c2ccccc2)C(C)(C)CO)C1 1635891664 DUTDNGKCRAWGJN-AREMUKBSSA-N 433.596 4.284 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1638573037 GTLZWYQHESQYAE-YDTSGJJXSA-N 449.938 4.305 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2c(Br)ccc(C)c2[nH]1 1639588233 YYPHTTDVFHJDTM-UHFFFAOYSA-N 445.313 4.150 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnnc3CCc3ccccc3)c2C)cc1 1643697349 SCOXPIMRQSHWDN-UHFFFAOYSA-N 429.524 4.147 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(c3ccccc3)[C@@H](C)C3CC3)cc2F)C[C@@H](C)O1 1644153395 FKDPKOIMHNQVOB-ZCNNSNEGSA-N 439.575 4.361 10 10 IICE COC(=O)[C@@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)c1ccc2c(c1)CCO2 1658584798 KTNZZNZNJLFCST-DEOSSOPVSA-N 444.491 4.479 10 10 IICE Cc1cc(CNC(=O)NC(C)(C)c2cn(-c3ccccc3)nn2)c(C)n1-c1ccccc1 1675116042 XOZVWCMYVUPTRZ-UHFFFAOYSA-N 428.540 4.409 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1)OC 1694369468 PHIXYKPREVGGTF-FQEVSTJZSA-N 425.602 4.331 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)[C@@H]2CCOC2)cc1 1695625113 PDZNOPRAEBLCRG-OAQYLSRUSA-N 425.602 4.050 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1727024228 CDJKJXGBNORBRA-GOSISDBHSA-N 429.634 4.008 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCS[C@H](C)C2)cc1 1728379961 MKCRCIPOZWVZBH-LJQANCHMSA-N 436.629 4.485 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)CCOC(C)(C)C)cc1 1728383636 QSVCAXIUPPJQNH-OAQYLSRUSA-N 429.609 4.275 10 10 IICE CCOCc1nnc(N2CCc3ccc(OC)cc3C2)n1CCCSc1nccs1 1729033959 MZJCXFIVZIEPBA-UHFFFAOYSA-N 445.614 4.025 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)cc1C 1762281779 XKQQSFITKPQIFN-UHFFFAOYSA-N 440.636 4.390 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1764209045 VCCLUWDJIMLYRX-UHFFFAOYSA-N 437.588 4.396 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@H](C(F)F)C2)cc1F 1768495201 YIEJCIJNHWMGHX-KRWDZBQOSA-N 430.478 4.075 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H]3CCCOC3)CC2)cc1 1768704843 POEFMNMIHGSHDB-HXUWFJFHSA-N 441.620 4.019 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCCO1 1769559855 CHZUXLXSNISJGC-DENIHFKCSA-N 437.588 4.393 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4)cs2)c(C)c1 1859572348 AWINKNTVVDOFEZ-UHFFFAOYSA-N 427.551 4.457 10 10 IICE O=C1/C(=C\c2ccc(O)c(O)c2)C(C(F)(F)F)=NN1c1ccc(Br)cc1 1865649937 MRLSWCQWAWPMKO-GHXNOFRVSA-N 427.176 4.209 10 10 IICE CC[C@@](C)(O)CN(Cc1ccccc1)c1ccc(CNCCOC)cc1Br 1915199331 WKESSNCVAWDNMP-JOCHJYFZSA-N 435.406 4.353 10 10 IICE Oc1c(Br)cc(Cl)cc1CN[C@@H]1CCOC[C@H]1OCc1ccccc1 1965931097 CMQXWHNMUDLALF-QZTJIDSGSA-N 426.738 4.272 10 10 IICE O=C1NN(c2ccc(Cl)cc2)C(=O)C1=Cc1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1 2296412418 SPQXOQXFQCQUBV-UHFFFAOYSA-N 443.242 4.413 10 10 IICE CCCN1C(=O)C(=Cc2c(Oc3ccccc3C)nc3ccccn3c2=O)SC1=S 2314508724 QDIXGQWWRKUDPX-UHFFFAOYSA-N 437.546 4.406 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2)SC1=S)NCc1nc2ccccc2s1 2314913698 ZXFMMKVGMMBZBU-UHFFFAOYSA-N 439.587 4.204 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccccc3)SC2=S)cc1 15047043 ABGLVOYEBQBVLI-RVAQLADHSA-N 440.546 4.092 10 10 IICE CCN(CC)c1ccc(/C=C2/SC(=O)N(CC(=O)Nc3ccccc3F)C2=O)cc1 33431760 OMKADZKFXQXGOX-CPNJWEJPSA-N 427.501 4.347 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2CCN(C(=O)c3ccccc3)CC2)cc1 741900441 VSDVNXPLKDXLQF-UHFFFAOYSA-N 445.563 4.427 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3cc(C)c(F)c(C)c3)n2)cc1 743046028 LJNOIPCHEYCELB-UHFFFAOYSA-N 447.557 4.045 10 10 IICE Cc1nc(-c2ccc(CN3C(=O)CN(Cc4cc(Cl)ccc4O)C3=O)cc2)cs1 761186828 UYEYJLQFHQEMOD-UHFFFAOYSA-N 427.913 4.442 10 10 IICE COc1cccc(CNC(=O)NCc2ccc(Br)cc2C(F)(F)F)c1O 764534644 ZFXKKNQVBPUYHI-UHFFFAOYSA-N 433.224 4.182 10 10 IICE O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)N(Cc1ccccc1O)C[C@@H]1CCCO1 788755220 DMNAOLYYDOBTSS-KXBFYZLASA-N 426.410 4.367 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1coc2cc(OC)ccc12 791245700 DZSRILZYWFIIII-UHFFFAOYSA-N 438.524 4.373 10 10 IICE COC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802683896 CHGYUKJTRMOOKU-RBBKRZOGSA-N 435.572 4.004 10 10 IICE Cc1cc(C(=O)NC2CCN(CC(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1136623108 CDODSGJLOMXTJT-UHFFFAOYSA-N 433.394 4.102 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1F 1136729469 CBLQZTVYLOVTAL-HXUWFJFHSA-N 449.979 4.157 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)NCc2c(O)ccc3c2CCCC3)C1 1137443549 TZMHRBAYRLZPOG-UHFFFAOYSA-N 436.552 4.494 10 10 IICE CC(C)n1cc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)n1 1142713200 RFBBWUJQYMJUJR-GOSISDBHSA-N 449.393 4.114 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(Cc4cccnc4)C3)cc2Cl)C1 1155726271 FGCWZIMHRXMSDK-SIKLNZKXSA-N 441.019 4.500 10 10 IICE COc1cccc2ncn(CC(=O)c3cc(C)n(-c4ccc(F)c(Cl)c4)c3C)c(=O)c12 1189626286 HOWBOJRMJAASRE-UHFFFAOYSA-N 439.874 4.488 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](C)c3nc(-c4cc(C)ccn4)n[nH]3)c2C)c1 1254074492 QWVLXYPSCJCDRU-SFHVURJKSA-N 443.555 4.451 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(Cl)c(S(C)(=O)=O)c3)c2C)c1 1287660464 OLGWTLXBNOWLFQ-UHFFFAOYSA-N 430.957 4.389 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc2[nH]cc(I)c2c1 1290778558 SMBPKJLXMSTNAG-UHFFFAOYSA-N 445.304 4.303 10 10 IICE Cc1cc(C(=O)N2CC[C@H](CN(C)CC3CC3)C2)c(C)n1-c1ccc(Br)cn1 1294386154 URUWKLNKBSRYET-GOSISDBHSA-N 445.405 4.056 10 10 IICE CCOCc1nnc(N2CCS[C@H](C)[C@@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1297345857 ZOUWDEMOCLENCN-VQTJNVASSA-N 443.661 4.429 10 10 IICE CC(C)(C)OC(=O)NCC1([C@@H]2CCCCN2C(=O)/C=C\c2ccc(O)c(O)c2)CCC1 1304180616 RUXUYRVABNFMMD-XADARROHSA-N 430.545 4.187 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](Cc2ccccc2)N2Cc3ccccc3C2=O)cc1 1354541649 UCRGADLSGKFDQD-AREMUKBSSA-N 441.575 4.416 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354755495 UDPBIJZNSFAMNL-KRWDZBQOSA-N 444.457 4.320 10 10 IICE C[C@H](NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CCCC1(C)C)c1ccc(N2CCOCC2)cc1 1357128138 KJCSRWVETIRSQA-GHTZIAJQSA-N 445.604 4.126 10 10 IICE CC1=C(C)CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)CC1 1360889612 MNZKBLUKQJPYLM-UHFFFAOYSA-N 426.615 4.449 10 10 IICE CC(C)n1cc(Br)c(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)n1 1435414512 DCDVPSSBBSNQKR-UHFFFAOYSA-N 425.290 4.189 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3nn(-c4ccccc4)cc3OCC(C)C)C2)cc1 1436971405 NTJAGCIBSXIIIV-HXUWFJFHSA-N 448.567 4.172 10 10 IICE COC[C@@H](CC(C)(C)C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1437139976 BPSZMQQJYUCSEJ-DSQDWWTGSA-N 440.656 4.297 10 10 IICE C[C@@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(Cl)c(Cl)c1Cl 1443711283 LTVAVMJWDHGZPN-MRVPVSSYSA-N 437.732 4.215 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2c2ccco2)c(C)n1-c1ccc(Br)cn1 1444114868 BCSZPJUTXJAWNU-KRWDZBQOSA-N 430.302 4.058 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)c1 1444240099 LYIJDWNVIWLYAO-INIZCTEOSA-N 427.545 4.139 10 10 IICE CCN(C[C@H](O)c1ccc(C)cc1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1445162492 PINBZQYEDXFCMM-SANMLTNESA-N 433.596 4.298 10 10 IICE CCO[C@H]1C[C@](NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)(C(=O)OC)C1(C)C 1447836864 XNSAFCJYSFGHLO-CVDCTZTESA-N 432.948 4.224 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)NCc2cccc(Br)c2O)CCCCCC1 1448961293 NSCAQRAVAYKHTK-UHFFFAOYSA-N 426.351 4.453 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl 1451668363 MBXUTEKMMNYMDO-HUUCEWRRSA-N 436.383 4.234 10 10 IICE CCc1cc(N2CCN(c3ccc(OC)c(F)c3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 1458262541 OMTFMCPZVXJMMR-UHFFFAOYSA-N 437.475 4.089 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC(c4ccccc4C(F)(F)F)CC3)nc12 1459765194 UVODGKPCEKLYQL-UHFFFAOYSA-N 448.445 4.010 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccc(NC(=O)C(F)(F)F)nc3)c2C)c1 1468829780 ZACZMZFPRQSXCL-UHFFFAOYSA-N 430.430 4.228 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCCCC[C@@H]3c3ccccc3)cc2)CC1 1471370537 VSQKECYPRORDKK-XMMPIXPASA-N 434.584 4.215 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1 1478840856 JMFSOVGUQAOAHJ-GOSISDBHSA-N 446.998 4.312 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC[C@H]1CCCCO1 1495756370 YIBMIHLOEODNJZ-UYAOXDASSA-N 445.583 4.225 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3C[C@@H](C)SC)CC2)cc1 1518308989 NWJOGHUQWGVTCL-GOSISDBHSA-N 429.634 4.413 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(OC(F)F)c(Br)c2)cc1 1530905958 NOUJXGSDKHVFFO-UHFFFAOYSA-N 443.288 4.268 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc2cc(Br)sc2[nH]1 1541081119 SVUZJDKAKOTZFA-UHFFFAOYSA-N 436.400 4.475 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3Cl)CC2)cc1 1544314891 IISATSHLKFGSKF-RTWAWAEBSA-N 448.394 4.044 10 10 IICE CC[C@H](C)c1ncc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1585946366 YXEKVMJQXHOYDR-NWRYFCBHSA-N 444.557 4.359 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)C[C@@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1611935465 RSNXFPXDTOJGPI-KDURUIRLSA-N 448.615 4.313 10 10 IICE C[C@H]1CC(=O)CC[C@@H]1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616573197 QVJNDWUQAFISEG-WFASDCNBSA-N 427.302 4.103 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2nc3cc(Cl)ccc3s2)N(C)C)cc1 1618635988 RCUHVTBAFARATO-LJQANCHMSA-N 431.005 4.367 10 10 IICE Cc1cc(C)cc(C[C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1620500914 QNWSZHUSXHFQDH-INIZCTEOSA-N 444.578 4.232 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CCSCCCNC(=O)OC(C)(C)C 1624630470 RGGAVSRPEVBOCV-UHFFFAOYSA-N 435.634 4.283 10 10 IICE CCOc1cccc(CN(CCO)C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1626523350 LABVESHXAIYLLB-UHFFFAOYSA-N 434.536 4.248 10 10 IICE Cc1c(Br)ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1N 1627205354 ODYYVSSZCKYMFI-SFHVURJKSA-N 446.389 4.227 10 10 IICE CCOc1cc2c(cc1CNC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)O[C@@H](C)C2 1627878967 GCZLJGMINKKRBB-SFHVURJKSA-N 446.547 4.488 10 10 IICE Cc1cc(C(=O)Nc2ccn(-c3ccncc3)n2)c(C)n1-c1ccc(Br)cn1 1628163266 IBYKBYJOBREJBL-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CC(C)CNC1(CO)CCN(C(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CC1 1630569984 BVULUJLOOIOILY-UHFFFAOYSA-N 437.588 4.381 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CC(=O)N(c2ccc(C)c(F)c2)C1 1631167795 ZRXIXXUUBZAUJG-HNNXBMFYSA-N 449.320 4.004 10 10 IICE C[C@H](NC(=O)c1ccc2[nH]cc(I)c2c1)c1ccc(N(C)C)cc1 1633315773 WQRNKJXZHOXGBY-LBPRGKRZSA-N 433.293 4.330 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](C(=O)NCc2ccc3cccnc3c2O)(c2ccccc2)C1 1638572926 AZLBNTMVAAMXEN-AREMUKBSSA-N 447.535 4.135 10 10 IICE COc1ccc(C2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)nc1 1639813927 CJRRLLMVIGCIOW-UHFFFAOYSA-N 431.536 4.259 10 10 IICE CC[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1OC 1644242894 HEIBQSCIPXBCAV-QFIPXVFZSA-N 428.488 4.150 10 10 IICE C[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])c1ccc(N(C)C)cc1 1651762944 HAVCINCEFHRNIX-MRXNPFEDSA-N 432.546 4.009 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C2CC2)C2(CO)CCC2)sc(C)c1-c1ccccc1 1653825022 YLFAQHITKJGTLB-UHFFFAOYSA-N 442.581 4.218 10 10 IICE COc1nccc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1654253566 VFISGPOFDPEQBW-KRWDZBQOSA-N 430.430 4.411 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccc(C)o4)C3=O)c2C)cc1 1656255741 HQQRCLCSSNCZJP-RUZDIDTESA-N 449.507 4.044 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCCCc4cc(OC)c(OC)cc43)C2)cc1 1674325769 DDBNUFBQAVJHSR-AVRDEDQJSA-N 439.556 4.058 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 1683253592 IUOJCNDCBOIENS-VGSWGCGISA-N 447.526 4.377 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCN1CCCCC1=O 1695511914 AKMPOPWZVPCTPG-UHFFFAOYSA-N 434.588 4.211 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCCS2)cs1 1725247976 AMRIAJJXTYDVJQ-SFHVURJKSA-N 429.615 4.262 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(CC(C)C)CC2)CCOC1 1728764205 BYEUEWAOHHINAE-DEOSSOPVSA-N 428.577 4.099 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C(C)C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1742118842 LURUJKUETVSTFX-NRFANRHFSA-N 448.615 4.313 10 10 IICE CCOCc1nnc(N2CCC[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1747143453 OQUOKSZIGVWHQR-GOSISDBHSA-N 439.526 4.488 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1CC[C@H]1C[C@H](F)C1 1747721602 YLTPLIAZZKGBAB-MEMLXQNLSA-N 443.611 4.478 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2CCCSc2nccs2)C[C@@H]1F 1750342274 SSEGNWIJLLPILB-OCCSQVGLSA-N 438.985 4.427 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ncccc1N(C)C 1760896019 ZMNCOPVSLVYPRH-UHFFFAOYSA-N 433.604 4.147 10 10 IICE CCC[C@@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765503424 GAANDIMROHYNTF-LJQANCHMSA-N 427.637 4.457 10 10 IICE CCCN1CCC(N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)CC1 1766104395 YSFNUHDEEVPHFM-UHFFFAOYSA-N 435.620 4.007 10 10 IICE O=C(O)[C@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 1858591410 KMTFPOHDLIZCQG-HNRFISLBSA-N 434.882 4.275 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3ccc(F)c(F)c3)SC2=S)N(C)C)cc1 1858594068 JSUDTCJEPHCMEG-HDAJJNEKSA-N 434.533 4.478 10 10 IICE CCCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1-c1ccc(C)cc1 1862313330 SPWMXLLPVQUGRO-UHFFFAOYSA-N 432.568 4.494 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])N2CCCCC2)cc1 1865972418 WRJAYGRMKBNCCD-NRFANRHFSA-N 430.936 4.271 10 10 IICE CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1865972589 HWYCLOWNSJRYSN-IBGZPJMESA-N 436.508 4.340 10 10 IICE [N-]=[N+]=NCC1CCN(C(=O)c2cc(Br)ccc2I)CC1 1912187967 KUOGQFCQSZBLDN-UHFFFAOYSA-N 449.090 4.216 10 10 IICE COc1ccc([C@H](n2nc(C3(C)CC3)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2080041672 CTUUXABDPRUOBL-INIZCTEOSA-N 436.350 4.146 10 10 IICE CSc1ncc(Cn2c(S)nc3cc(I)c(F)cc32)s1 2284688002 JAZYPNRQVOVIQL-UHFFFAOYSA-N 437.328 4.295 10 10 IICE CC[C@@H](C)N1C(=O)C(=Cc2cc3cc(C)ccc3nc2N2CCOCC2)SC1=S 2314647601 FCWKYZIWHVLXCT-OAHLLOKOSA-N 427.595 4.380 10 10 IICE Cc1ccc(CNC2[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@@H]2C)c(O)c1Br 2352948332 ZNFDDUOTBWODNN-KBPBESRZSA-N 427.383 4.444 10 10 IICE CCCCCN1C(=O)/C(=C\c2c(NCCC)nc3ccc(C)cn3c2=O)SC1=S 33468522 LRALOXDXXLXZFF-FOWTUZBSSA-N 430.599 4.216 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2ccccc2OCc2ccc(C)cc2)SC1=S 40937995 ZJFPXZFDOMASNY-CPNJWEJPSA-N 427.547 4.338 10 10 IICE Cc1ccc(-n2c(C)cc(CC(=O)Nc3ccc(CN4C(=O)CCC4=O)cc3)c2C)cc1 97121282 ISJUCBYRNXRGSN-UHFFFAOYSA-N 429.520 4.233 10 10 IICE CCOc1cc(/C=C/C(=O)N2CCCN(c3ccc(OC)cc3)CC2)ccc1OC(F)F 108432770 ZQOFPYUSXRFGKN-WUXMJOGZSA-N 446.494 4.447 10 10 IICE CCOC(=O)c1cnc2c(c(C)nn2C)c1N1CC=C(c2c[nH]c3cc(F)ccc23)CC1 302097980 JZUIFKRVXUCHPT-UHFFFAOYSA-N 433.487 4.368 10 10 IICE Cc1cc(C(=O)CSc2nncn2CCc2ccccn2)c(C)n1-c1ccc(F)cc1 303471134 NDQOLWUJBIZJJO-UHFFFAOYSA-N 435.528 4.437 10 10 IICE Nc1ccc(NC(=O)Nc2cc(Br)ccc2I)cc1 388260303 AQWLSTIRAQNUSW-UHFFFAOYSA-N 432.059 4.280 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2ccc([S@@](C)=O)cc2)C1 435917199 LOAZIMGHPQRXHJ-WTPASJBYSA-N 437.609 4.023 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CSC[C@H]3C(=O)Nc3ccccc3)ccc21 484754397 JZVCARDVYOKCFZ-QFIPXVFZSA-N 437.565 4.058 10 10 IICE CC(C)CN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1ccc(F)cc1 586203077 AQUYODSUGILNFE-UHFFFAOYSA-N 437.492 4.452 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(OCC(F)(F)F)n1 742804780 BKBJWEZPWAYOQR-CYBMUJFWSA-N 445.388 4.023 10 10 IICE C[C@H](NCC1(O)Cc2ccccc2C1)c1cc(Br)cc(Br)c1O 756594330 MPEYVUZTSVDXDE-NSHDSACASA-N 441.163 4.098 10 10 IICE O=C(/C=C\c1ccnc2ccccc12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768542041 DKPQHWDEMCHTLS-XFXZXTDPSA-N 426.564 4.096 10 10 IICE C[C@@H](NCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(N(C)C)cc1 775834345 RUSZSSVQQQHYAQ-CQSZACIVSA-N 425.514 4.074 10 10 IICE O=C([C@@H]1CC[C@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1)N1CCCCC1 798120144 WTLSKNIAUPKCJU-CTNGQTDRSA-N 427.589 4.418 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCc1cc(Cl)ccc1N1CCOCC1 802313614 SFRWEPLGVIYZSX-UHFFFAOYSA-N 431.964 4.394 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc(OC)c1OC 1084096864 KBMMPAJGLUFOQG-RQZCQDPDSA-N 446.506 4.335 10 10 IICE Cc1cc(CC(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)c(C)n1-c1ccccc1 1126539269 HNGHTDJDUUPSLT-UHFFFAOYSA-N 430.596 4.488 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc2ccc(O)cc2c1O 1136546584 NLTREGIMNVJYBD-UHFFFAOYSA-N 428.435 4.251 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)CCc1c(NC(=O)OC(C)(C)C)cnn1C 1139123771 JHAQQMQFYZHNBK-UHFFFAOYSA-N 430.549 4.234 10 10 IICE Cc1[nH]nc(Br)c1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1139138642 LFMKUOSNTNVLDD-LLVKDONJSA-N 425.758 4.300 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2COC3=O)c(C)n1-c1ccc(Br)cn1 1160604144 CHJPMBFMPPNFFL-UHFFFAOYSA-N 426.270 4.174 10 10 IICE CN(Cc1ccccc1)Cc1cccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1167762061 FCHUAVUEHFSQSD-UHFFFAOYSA-N 443.591 4.210 10 10 IICE CCCCN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1294194447 JIFKFFUCTWBOTH-HSZRJFAPSA-N 441.620 4.013 10 10 IICE CS[C@H](C)Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1302551977 BJMPUWOONZEJBY-UYAOXDASSA-N 429.634 4.160 10 10 IICE CCOC(=O)c1nn(CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c2ccccc2c1=O 1307300739 SGDUISFFXSOPQZ-UHFFFAOYSA-N 447.466 4.003 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3c(Cl)oc4ccccc34)CC2)c(OC)c1 1313011699 HRCAFGZEYNXNML-UHFFFAOYSA-N 429.904 4.135 10 10 IICE COc1ccc(F)cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1356409022 HCCTYWGFQUUJCG-YVLHZVERSA-N 434.489 4.203 10 10 IICE Cc1cc(CC(=O)Nc2nc(-c3cnn(C)c3)ns2)c(C)n1-c1ccc(Cl)cc1 1439952009 SLYJPLWUBZQPIW-UHFFFAOYSA-N 426.933 4.181 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1c[nH]cc1-c1cc(Cl)c2c(c1)OCCO2 1443823674 RICXZLRZHMFXQH-UHFFFAOYSA-N 425.916 4.411 10 10 IICE Cc1cc(N2C[C@@H](C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2=O)ccc1Br 1459185498 NSAKWXYWBNVCCT-RDJZCZTQSA-N 444.373 4.054 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(NC(=O)Nc2ccccc2)CC1 1464441567 FDQNZDNRFQCZEV-UHFFFAOYSA-N 444.535 4.333 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C(F)(F)c3ccc(C(C)(C)C)cc3)CC2)cc1 1464536632 AAKJDAVUWHJHSH-UHFFFAOYSA-N 445.554 4.023 10 10 IICE Cc1cc(C(=O)NCc2cccnc2N2CCN(C)CC2)c(C)n1-c1cccc(C(C)C)c1 1464576623 MQHYZDZAWCKPGY-UHFFFAOYSA-N 445.611 4.294 10 10 IICE COc1cc(NC(=O)CN(C)C(=O)c2cc(C)n(-c3ccccc3C)c2C)cc(OC)c1 1468657124 NPQPQNIKSAFYQD-UHFFFAOYSA-N 435.524 4.130 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)C2)cc1 1470774173 XARNHIKSHOVTMS-FQEVSTJZSA-N 441.959 4.232 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1493610959 NMWWXNUDTCWTKR-XXBNENTESA-N 435.572 4.201 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@@H]2CCSC2)n1Cc1ccc(N2CCSCC2)cc1 1495071635 ILJWAVSEDHYNSI-FXAWDEMLSA-N 431.675 4.335 10 10 IICE COc1cccc(C(F)(F)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 1520922496 NOENBBLTOWINPF-UHFFFAOYSA-N 426.410 4.174 10 10 IICE C[C@@H](NC(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1)c1ccc(N(C)C)cc1 1523638896 HMQGCPDJPTWSRL-GOSISDBHSA-N 443.613 4.197 10 10 IICE CC(C)C[C@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)N(C)C 1541414102 VOKAPXHCHJQZFA-LJQANCHMSA-N 442.995 4.312 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1547448674 PHFQMLYCDDINBT-FQEVSTJZSA-N 448.615 4.162 10 10 IICE Cn1nc(C(C)(C)C)cc1NC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1559599622 QTLQDKKXQWBCTB-UHFFFAOYSA-N 440.569 4.196 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2c2cc[nH]n2)c(C)n1-c1ccc(Br)cn1 1568900454 CNIKCUJUHKQCSF-SFHVURJKSA-N 428.334 4.342 10 10 IICE Cc1ccccc1COc1ccccc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1598277821 ZPNQLMTWWHWXBD-UHFFFAOYSA-N 429.564 4.256 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)c2)CC1 1617051369 SNXCVGPLCPOJSV-UHFFFAOYSA-N 432.568 4.497 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCC[C@H]2COC(=O)NC(C)C)c1 1627003150 WRIUZDZSTYJJEZ-QFIPXVFZSA-N 425.529 4.036 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)cc1 1631200573 PISYCZAPKDDWOX-RUZDIDTESA-N 434.536 4.086 10 10 IICE CC[C@](C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1633755182 LVDJQZCWTBLXQK-NRFANRHFSA-N 430.551 4.310 10 10 IICE O=C(N[C@H]1c2ccccc2CC[C@H]1F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1636613440 OUHKWSQOVBTPNQ-XLIONFOSSA-N 446.525 4.010 10 10 IICE C[C@@H](Cc1ccccc1)n1cccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1637549583 HBZRXJBLGWCJEI-SFHVURJKSA-N 439.506 4.337 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)C2)cc1 1639332185 NPPZSFMDJIDPHU-QFIPXVFZSA-N 433.508 4.034 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)Cc1ccc(OC)cc1 1639827026 BOZRINGIYLZJCL-GOSISDBHSA-N 426.557 4.262 10 10 IICE CN(Cc1nnc(C(=O)NCc2ccc(F)cc2)s1)c1ccc(-c2nccs2)cc1 1646084672 DLRKVFGCUASXQS-UHFFFAOYSA-N 439.541 4.367 10 10 IICE CN(CC(=O)N(C)[C@@]1(c2ccccc2Cl)CCCCC1=O)c1ccc2c(c1)OCO2 1657830280 QUQLIHWSKMTJCA-HSZRJFAPSA-N 428.916 4.002 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(OC(F)(F)F)cc1 1682100250 MJRSLPYNNOWQIB-OAHLLOKOSA-N 437.462 4.107 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(Cc4ccc(Cl)cc4)CC3)cc2)CC1 1687441367 KUXJXBBFAUAAMJ-UHFFFAOYSA-N 441.019 4.256 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1696223804 JBQPNPBSSPRMHF-JOCHJYFZSA-N 434.588 4.077 10 10 IICE C=CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(N)=O)C1 1705786284 KNALYQCGHMTORB-FQEVSTJZSA-N 446.599 4.267 10 10 IICE CCO[C@@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1710619104 XUUUKPDXYUXQSU-JOCHJYFZSA-N 443.661 4.083 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1CCOC1CCCCCC1 1711096465 JAAIPQWHJPLQNZ-UHFFFAOYSA-N 435.572 4.345 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H]2C)n1Cc1ccc(N(CC)CC)cc1 1744071494 CKFZEKVGQQJNNP-SFHVURJKSA-N 426.609 4.080 10 10 IICE CC[C@H]1CCCN1c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N(CC)CC)cc1 1763362420 RVUGPLIOSPJIKX-FQEVSTJZSA-N 447.587 4.199 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCC[C@H]2CSC)cc1 1764939964 ZKRZGOYQUDXMMB-UNMCSNQZSA-N 443.661 4.398 10 10 IICE COc1ccc(-c2nnc(N3CCCO[C@H](C)C3)n2CCCSc2nccs2)cc1 1770074414 MGLWSDKOFYIZAC-MRXNPFEDSA-N 445.614 4.208 10 10 IICE CC(C)CC(=O)Nc1cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccn1 1860503162 ICLMAFLXHDWFCT-UHFFFAOYSA-N 427.460 4.094 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@]1(C)CNCc1c(O)cccc1Br 2102785352 IZHIMUWNJYQQQK-KRWDZBQOSA-N 435.309 4.279 10 10 IICE COCCC1(NCc2cc(Br)ccc2O)CCN(C(=O)OC(C)(C)C)CC1 2157603545 YWMARUBEGVILQQ-UHFFFAOYSA-N 443.382 4.051 10 10 IICE CN1CCc2cc([C@H](O)c3cc(Br)ccc3I)ccc21 2163076376 NHKOSPUKXOJCCV-INIZCTEOSA-N 444.110 4.128 10 10 IICE NCc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(F)c1Br 2186715613 NTZMFLDUPRQTTA-INIZCTEOSA-N 446.286 4.300 10 10 IICE COc1ccccc1OCCCOc1c(C=C2SC(=S)N(C)C2=O)cccc1OC 2293556303 RHALNUIEDVAXCN-UHFFFAOYSA-N 445.562 4.383 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)C1=CNC1=CC=C[C@@H]2C(=O)c3ccccc3C(=O)[C@@H]12 2297511513 AAUDKFJWTSXTGY-XUZZJYLKSA-N 437.499 4.265 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@@H]32)cc1O 14457117 BYWVLKLBRPAYHT-JXQFQVJHSA-N 440.565 4.402 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551125 FCGBWFYRUSJTSC-DPLHUUCSSA-N 434.540 4.493 10 10 IICE CCOc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1cccc(C)c1 20236615 XMGZEMTWEMXHLT-GUOILJMFSA-N 431.448 4.063 10 10 IICE CCOc1cc(/C=C2\C(=O)NN(c3ccccc3)C2=O)ccc1OCCc1ccccc1 33311517 ISBOEWNGAKERGD-OQKWZONESA-N 428.488 4.168 10 10 IICE CCN1C(=O)/C(=C\c2c(Sc3ccccc3)nc3ccccn3c2=O)SC1=S 33342536 DNYFXWFJGXUMEQ-NTCAYCPXSA-N 425.560 4.067 10 10 IICE CCN(c1ccc(N)cc1)S(=O)(=O)c1cc(Br)ccc1Br 63114508 MYPSWFQJLMTOLR-UHFFFAOYSA-N 434.153 4.009 10 10 IICE Cc1noc(C)c1COc1cccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 109179305 GQIDGJRUYDRLCS-KRWDZBQOSA-N 435.524 4.198 10 10 IICE CCOc1cc(/C=C2\SC(Nc3cc(C)ccc3O)=NC2=O)ccc1OCCC(=O)O 210469682 OKHMBLJLOLLAOR-UNOMPAQXSA-N 442.493 4.035 10 10 IICE O=S(=O)(c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@H]32)cc1)N1CCOCC1 245380066 PZYXUOKZHZFZJV-KNKQGSTJSA-N 430.957 4.187 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)Cc2cnn(-c3ccccc3)c2)C1 435674374 YPBFRSREXXSTEN-UHFFFAOYSA-N 441.579 4.252 10 10 IICE CN1CCN(C(=O)CC2CCN(Cc3cc(C(C)(C)C)cc(C(C)(C)C)c3O)CC2)CC1 731355943 KEJFLTUAEXBBJF-UHFFFAOYSA-N 443.676 4.363 10 10 IICE O=C(NCCCSc1nccs1)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 733973110 VAATURBEAWJSHK-ZDUSSCGKSA-N 430.521 4.072 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3nccn3C(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 743960641 ZFLALJAMGWRVNC-UHFFFAOYSA-N 447.917 4.297 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1 756753583 HVVPJZUKVGJTSZ-AWEZNQCLSA-N 444.333 4.028 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]4CCCC[C@H]4N3c3ncccn3)cc2)CC1 764099707 SSMFMSVYRXYZGS-JRFVFWCSSA-N 433.600 4.167 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc2c(c1)C(=O)CCC2 768903437 MBVDAWMTQQDPFP-UHFFFAOYSA-N 432.568 4.059 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nnc(-c3cccc(F)c3)o2)C1 769662407 BWERKYCXIVQSAJ-UHFFFAOYSA-N 448.498 4.340 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 783524663 JBAFWTWRJDSZTN-HSZRJFAPSA-N 442.648 4.098 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCCN2Cc2ccc(N3CCOCC3)cc2)C1 816658545 OOFLJVKVBUJMIK-GMAHTHKFSA-N 429.605 4.135 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3ccc(Br)c(C)c3)C2)cc1 1129993553 WHZSZDWCSKNAEG-GOSISDBHSA-N 431.374 4.341 10 10 IICE Cc1cc(CC(=O)NC2(C(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccc(Cl)cc1 1131423657 VDNMCHPVNRETGN-UHFFFAOYSA-N 446.975 4.297 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H](c1ccccn1)C1CC1 1133947818 ZCBTYRIHRIBMAP-UMEYKSNOSA-N 443.619 4.392 10 10 IICE CN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C1(C(F)(F)F)CC1 1133977503 WGUMDWFXVZVMES-ZRDIBKRKSA-N 434.530 4.283 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CSC[C@@H]3C(=O)Nc3ccccc3)c2C)cc1 1136158764 JOZNIWWTKFSTDH-JOCHJYFZSA-N 435.549 4.257 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)c2ccc(N3CCOC3=O)cc2)c1 1136424630 GTSJSIQNYFTGRW-QGZVFWFLSA-N 431.492 4.354 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC(NCc3cc(Br)ccc3O)C[C@H](C2)C1 1257841924 BIWNALQNHGRCAN-KBPBESRZSA-N 425.367 4.280 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC(OC(C)(C)C)CC1 1289424514 WTOVYAYSPYCZEN-UHFFFAOYSA-N 436.604 4.480 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(NC(=O)OC)cc1C 1297229072 ZUIWEGXMXXOKMM-UHFFFAOYSA-N 441.528 4.176 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)CC(=O)NC(C)(C)C)cc1 1313680837 WXEWBLTXJLYJNY-UHFFFAOYSA-N 442.652 4.112 10 10 IICE Cc1cc(Br)cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1357835975 LRVAMIQVFUXDBC-GJZGRUSLSA-N 435.337 4.440 10 10 IICE Cc1cc(CNC(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1438295677 CWKCNYCXYDGDDU-GHTZIAJQSA-N 429.536 4.305 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)[C@H]([C@@H]2CCCO2)C1 1439569219 MZNNQXGOOYDLEW-WTNAPCKOSA-N 444.959 4.320 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O2 1442408222 GHUYMJUOUUPTSK-NIYFSFCBSA-N 438.568 4.115 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc([C@H]4CC[C@H](C)CC4)n3)CC2)c(OC)c1 1461977171 JHGKUICJZIOGOK-IYARVYRRSA-N 443.613 4.345 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@]3(C)Cc3cc(F)c(F)c(F)c3)C2)cc1 1470771340 DGUQNTVDNGKDCS-MZNJEOGPSA-N 447.501 4.498 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC[C@@]3(Cc4ccccc4)C=CCCC3)cc2)CC1 1479104263 GZIFMIVDRLHGRR-MHZLTWQESA-N 432.612 4.207 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1502975938 IYRVSYJOTCOFJO-HSZRJFAPSA-N 434.588 4.240 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1517146863 FNXSWCHAWAHBFE-QGZVFWFLSA-N 431.587 4.111 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1 1519586598 OWIGMRYDUKIALK-RBBKRZOGSA-N 429.358 4.084 10 10 IICE COc1ccc(OC(C)(C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1520922000 BWEKCLAPFYLHDI-UHFFFAOYSA-N 434.483 4.239 10 10 IICE CCCc1cnc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1537163710 QQZDMGFRBBFTGA-XNTDXEJSSA-N 435.571 4.465 10 10 IICE CC1CCN(c2ccc(CNC(=O)C3(C(=O)OC(C)(C)C)CCSCC3)cc2)CC1 1543145758 CGNAPJHPDSSGGU-UHFFFAOYSA-N 432.630 4.394 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C1CC1 1546990977 RGAVQNAINILTOI-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)C2CC2)cc1 1564590601 WSRMHYQFDPNUFO-RBUKOAKNSA-N 430.593 4.263 10 10 IICE CC(C)c1nc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nn1-c1c(Cl)cccc1Cl 1611432140 WSIIGJAHKNKHHO-LBPRGKRZSA-N 449.338 4.470 10 10 IICE Cc1ncsc1CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1611867414 FPJKRCSNLKEESW-LJQANCHMSA-N 444.580 4.174 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NCCCSc1nccs1 1616242124 VCUGVFNTVUHRRJ-KRWDZBQOSA-N 433.599 4.276 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1CCc1ccc(Cl)s1 1617940881 SOUKTPHHVXIJCA-UHFFFAOYSA-N 426.933 4.035 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)cc1 1624286104 HIQBKRJTSNQLSE-KRWDZBQOSA-N 432.520 4.315 10 10 IICE CCOC(=O)[C@]1(COC)CCCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1 1625851064 CQLNBTKUBISVIL-RUZDIDTESA-N 426.557 4.143 10 10 IICE CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1628102479 UNURWQRNRVUYSD-INIZCTEOSA-N 434.964 4.425 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC3CN(C(=O)OCc4ccccc4)C3)c2C)c1 1629738073 HELUGZYMKSEGJZ-UHFFFAOYSA-N 431.536 4.462 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)cc1 1631675526 OYHDVGAEDCOPHW-OFVILXPXSA-N 443.591 4.476 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3cccc(O)c3O)[C@H]2c2cccs2)cc1 1633507382 HGAWLHSIBCPUFF-GCJKJVERSA-N 436.533 4.268 10 10 IICE CC(C)Oc1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1641164888 OMPMUCNTYMYFPL-UHFFFAOYSA-N 432.523 4.294 10 10 IICE COc1ccc(N(C)CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1Cl 1644867308 UEDXBCVYFHNDRW-UHFFFAOYSA-N 432.889 4.455 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cccc(Cl)c1O)c1ccc(F)cc1F 1648609169 SJQLSOFSWWXXNN-MRXNPFEDSA-N 426.847 4.206 10 10 IICE C[C@@H](Sc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652832999 FLLFXXTWXRBRPD-CYBMUJFWSA-N 432.457 4.490 10 10 IICE COc1ccc(N(CC(=O)NCCc2c(F)cccc2F)Cc2ccccc2)cc1OC 1655148001 IKRCCTALINUXHQ-UHFFFAOYSA-N 440.490 4.348 10 10 IICE CC(=O)N(C)c1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cn1 1672991641 QLAOJMQFDUFWJM-OAHLLOKOSA-N 429.952 4.276 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC(=O)N(Cc4ccccc4)C3)cc2Cl)C1 1681828291 RLCLOLNSAXJKTM-SFHVURJKSA-N 440.975 4.088 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H]2NC(=O)NCc1cc(Cl)cc(Cl)c1O 1684542595 LLYCRHKEMDIOMA-YUELXQCFSA-N 430.332 4.039 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3nc(-c4ccccc4)sc3C2)N(C)C)cc1 1685610029 SVCVFLDOKBBHIX-JOCHJYFZSA-N 449.624 4.247 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2cccs2)cc1 1695624932 LNKPYCYPIBIPKW-LJQANCHMSA-N 425.602 4.374 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)cc1C 1752742326 KCFLZYSPNDDUIG-NQIIRXRSSA-N 435.620 4.332 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCCn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)C1 1762725862 WIQFTHKITZWUMI-WOJBJXKFSA-N 436.604 4.373 10 10 IICE Cc1cc(C)cc(OCCNC(=O)c2c3c(n4ccccc24)C(=O)c2ccccc2C3=O)c1 1873955798 PNWHAAYCZVOXKX-UHFFFAOYSA-N 438.483 4.140 10 10 IICE Cc1ccc([C@@H](C2CCC2)n2nc(C(F)F)c(CO)c2I)c(O)c1 2079052009 PCHHJJYIINBOQJ-OAHLLOKOSA-N 448.251 4.321 10 10 IICE COc1ccc([C@H](C2CC2)n2nc(C(F)(F)F)c(C(=O)O)c2Br)c(O)c1 2079846042 XIRFYLLPASAKEN-LBPRGKRZSA-N 435.196 4.076 10 10 IICE Oc1c(Br)cccc1CN[C@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156286473 ZIGRCWMSOSLXDM-LJQANCHMSA-N 431.374 4.068 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccccc3Cl)C2=O)c(C(=O)O)c1OC 2314929896 UHDBXTSGFJBTSZ-UHFFFAOYSA-N 435.910 4.461 10 10 IICE O=C(Cn1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)c2ccccc21)Nc1ccccc1 1409228 WOMGYWSOSSIHPA-UHFFFAOYSA-N 444.487 4.424 10 10 IICE CN(C)c1ccc(CNC[C@H]2C[C@@H]3CCN2C[C@@H]3c2cc(-c3cccs3)nn2C)cc1 20503732 ZNFGDKGEPAAEEW-NNWRFLSQSA-N 435.641 4.182 10 10 IICE biogenic CCCCCN1C(=O)/C(=C\c2c(NCC(C)C)nc3ccccn3c2=O)SC1=S 33351514 YEBVJVOVZLAXGJ-FOWTUZBSSA-N 430.599 4.154 10 10 IICE O=C(CCN1C(=O)/C(=C\c2cccc(Cl)c2)SC1=S)Nc1cccc2nonc12 33585830 DHOFMBOZCNBJBN-XNTDXEJSSA-N 444.925 4.106 10 10 IICE CCCN1C(=O)/C(=C\c2c(Oc3ccccc3)nc3c(C)cccn3c2=O)SC1=S 33635681 HHJOIGMYQVFLLH-GHRIWEEISA-N 437.546 4.406 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1)N2)N1CCOCC1 250120892 RUTXHTQTSSBPOE-DXIQSLLYSA-N 430.957 4.187 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 251301690 BPZKKQIBBYQNHW-VJESKBHDSA-N 443.525 4.204 10 10 IICE CN(Cc1ccccc1)C(=O)N1CCC(C(=O)NCc2ccc(N3CCCCC3)cc2)CC1 727375613 IPKMZCNQFVXSHD-UHFFFAOYSA-N 448.611 4.257 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(-c2cccnc2)cc1 747578356 CXJHYCDQWBCSBA-GOSISDBHSA-N 448.542 4.409 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cccc(OCC(F)(F)F)n1 754549996 FXBZMMWVBSPJCA-UHFFFAOYSA-N 426.350 4.050 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cc(F)cc3c2OCOC3)C1 769665927 YIEVJKKNNJSUCT-UHFFFAOYSA-N 438.499 4.157 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3cccc(Cl)c3)cs2)c(OC)c1 777666849 KHNOVXYOAVMGHB-UHFFFAOYSA-N 440.930 4.290 10 10 IICE CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3c(F)cccc3Cl)n2)cc1 780703333 CZHRMGXARBOZBL-UHFFFAOYSA-N 425.894 4.362 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cnn(-c4ccncc4)c3C(F)F)cc2)CC1 787332644 SWJSMGXRTSBZBG-UHFFFAOYSA-N 425.483 4.371 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccc(C(=O)Nc2ccccc2)cc1 804736650 WXNAPRIJZCBESL-UHFFFAOYSA-N 425.282 4.337 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CC(=O)O)C2=O)ccc1OCc1cccc(C)c1 1084528770 GUYZQJOJNIRUJG-ODLFYWEKSA-N 443.546 4.259 10 10 IICE CCc1ccc(N2NC(=O)/C(=C/c3ccc(-c4ccc(Cl)c(C(=O)O)c4)o3)C2=O)cc1 1088703123 FHHAQUYXIIWJLE-PDGQHHTCSA-N 436.851 4.322 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCOc3ccc(C)c(C)c3)cc2F)CC1 1125906768 AKDRYUXWLAAZCR-UHFFFAOYSA-N 427.564 4.060 10 10 IICE C[C@H](Sc1ccccc1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661144 HLOMADJQZJGNEQ-ZDUSSCGKSA-N 426.916 4.252 10 10 IICE COCC1(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCCC1 1147508937 XLULUMIPWLWQJC-HXUWFJFHSA-N 433.593 4.032 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cnn1-c1ccc(C)cc1 1287485596 VDGLJUBOOJQJPY-UHFFFAOYSA-N 448.567 4.113 10 10 IICE Cc1cc(-c2nnc(N(C)CCC3CC3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1289356342 QJDFMUFCXGFULE-UHFFFAOYSA-N 448.615 4.457 10 10 IICE COc1ccc([C@H](CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)N2CCOCC2)cc1 1290393509 YGSBSRGGDRRRBM-SANMLTNESA-N 447.579 4.214 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)C[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291472980 XNILCZKKMXTLQY-QRVBRYPASA-N 429.584 4.298 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCOCC2)cc1 1291735382 BNWPRCSSHQWOSY-HXUWFJFHSA-N 436.604 4.041 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1296752749 VWFNZJUNJULGRY-VWLOTQADSA-N 446.547 4.461 10 10 IICE Cc1cc(C(=O)N2CC[C@@]3(CCCN(C)C3)C2)c(C)n1-c1ccccc1Br 1298519429 SQCAKLCHUINQJF-JOCHJYFZSA-N 430.390 4.415 10 10 IICE Cc1ccc(C)n1-c1sccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1299099831 NKYGYDVSURNEJI-UHFFFAOYSA-N 431.508 4.200 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CCc4ncc(Br)n4C3)c2C)c1 1305281694 YNWKELCIMDRFKG-KRWDZBQOSA-N 441.373 4.415 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2cc(OC)ccc2O)sc2c1CC[C@H](C)C2 1307628322 HTQPFNWIWYTAAY-KBPBESRZSA-N 446.569 4.053 10 10 IICE CCOCc1nnc(N2CCO[C@](C)(C(C)(C)C)C2)n1Cc1ccc(N(CC)CC)cc1 1314407423 YGBXFAUSJKOHOF-VWLOTQADSA-N 443.636 4.351 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](COC)c1ccc(F)cc1 1351535824 IUPWZMIGCCSPRH-QGZVFWFLSA-N 425.298 4.213 10 10 IICE Brc1c[nH]c(-c2nnc(N3CCCC3)n2CCCSc2nccs2)c1 1358869212 CZSQYJFERIDNSN-UHFFFAOYSA-N 439.408 4.275 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)C3)n2CCNC(=O)C(C)(C)C)c(C)n1-c1ccccc1 1361049144 UYVCSPKTIFPYHN-SFHVURJKSA-N 448.615 4.361 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1 1467702698 PUWKEJWRSYGYPJ-JXFKEZNVSA-N 439.556 4.424 10 10 IICE C[C@@H]1CN(c2nnc(C3CCC3)n2CCCSc2nccs2)C[C@H](C(F)(F)F)O1 1494323965 TWIVINWSITTWGV-TZMCWYRMSA-N 447.552 4.341 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC2CC2)n1CCCC(F)(F)F 1517125937 XDDXCSFLLVVNBN-UHFFFAOYSA-N 437.510 4.046 10 10 IICE Cn1nccc1CN(c1nnc(C(C)(C)C)n1CCCSc1nccs1)C1CC1 1517425600 FHPRIZUTBADWAM-UHFFFAOYSA-N 431.635 4.117 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccccn1 1518750380 YWVSJCYJPUVAQI-FQEVSTJZSA-N 448.546 4.369 10 10 IICE C[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccncc1)c1ccc(N(C)C)cc1 1523639057 JCSLAQNTSKIZRA-RFLWCCGPSA-N 428.580 4.241 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@H]3C[C@H](C)c4c(C)cccc43)CC2)cc1 1531524593 NYCAPEOUVCDDPR-FCHUYYIVSA-N 435.612 4.313 10 10 IICE CC(C)(C)n1cc(Br)c(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)n1 1532273623 YOIDTLHYGHAPHS-UHFFFAOYSA-N 439.317 4.363 10 10 IICE Cc1cc(CCNC(=O)c2cccc(S(=O)(=O)C(F)F)c2)c(C)n1-c1ccccc1 1534548918 IQDXFGYBEHVIEY-UHFFFAOYSA-N 432.492 4.063 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)cc1-n1c(C)cc(C=O)c1C 1545025719 KCUSJFFMIGQYJD-UHFFFAOYSA-N 449.595 4.470 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H]2C2CCC2)n1Cc1ccc(N(C)C)cc1C 1555652652 AGKGKWTYRWPFPV-CVDCTZTESA-N 441.620 4.194 10 10 IICE O=C(N[C@H](C(F)F)C1CCCCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1557558630 HSPBGDGVZMZLGP-KRWDZBQOSA-N 444.525 4.198 10 10 IICE CON(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccccc1Cl 1559883145 GXGNMMTVQWTSJI-UHFFFAOYSA-N 434.879 4.118 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)c1 1566298300 DZUDXWZZFPCAEL-SFHVURJKSA-N 426.900 4.455 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)c1 1586213318 SZCXGJCMVPZELV-NRFANRHFSA-N 435.911 4.095 10 10 IICE COC1CCN(c2ccc(CN3CC[C@H](Oc4cncc(Br)c4)C3)cc2)CC1 1618958438 FDRCXADSVHCENJ-NRFANRHFSA-N 446.389 4.113 10 10 IICE COCC[C@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1619805885 VCHHPUGLSZOIEO-LJQANCHMSA-N 429.584 4.127 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CCCO1 1619827652 SUKVVBDUOBZVMT-RUZDIDTESA-N 437.588 4.394 10 10 IICE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)NCCc2ccc(O)c(O)c2)c(O)n1 1622753432 WAOMYUGQZFYCFA-UHFFFAOYSA-N 433.508 4.102 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CS(=O)(=O)c3ccccc32)c(C)n1-c1ccc(Cl)cc1 1628284656 MWAAVHLYDOASBL-MRXNPFEDSA-N 428.941 4.048 10 10 IICE Nc1cc(Br)c(F)cc1C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1629107849 PXIDZPCARLFTGV-UHFFFAOYSA-N 426.249 4.132 10 10 IICE COc1ccc(C(=O)CC(C)(C)CC(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1630619057 RKAXUSPUXCPADH-LJQANCHMSA-N 438.568 4.336 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(S(C)(=O)=O)ncc1Cl 1631531569 VTGRISNAHHGIOG-HNNXBMFYSA-N 444.940 4.248 10 10 IICE COc1ccc(-c2cncc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c2)c(C)c1 1634424408 YHBALVIEZSSUDR-UHFFFAOYSA-N 449.526 4.096 10 10 IICE COc1ccccc1Oc1ccc(C(=O)NCc2cccc(Br)c2O)nc1 1635840795 XFTXXRXUWJWWDN-UHFFFAOYSA-N 429.270 4.281 10 10 IICE Cc1cc(C(=O)N[C@@H]2COCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1639413163 ZQTOLPGRGKINOB-LJQANCHMSA-N 426.314 4.253 10 10 IICE O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)NCc1ccc(O)cc1O 1639441327 PYTQFSSHPXUKSO-UHFFFAOYSA-N 433.895 4.463 10 10 IICE CC(=O)c1ccc2c(c1)CN(C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)C2 1678351943 CVBVZGBZPFZZHA-UHFFFAOYSA-N 429.467 4.185 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](C)Cc3cn(C)c4ccc(F)cc34)C2)cc1 1681963969 MQJSMNFQUMOHBS-ROUUACIJSA-N 438.547 4.083 10 10 IICE C[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(F)cc1OC(F)F 1685993910 ISDGJGKZMQERLF-IFXJQAMLSA-N 438.494 4.156 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cc2ccccc2s1 1686131151 NAKDRAJKBCZDKB-INIZCTEOSA-N 436.581 4.163 10 10 IICE CC(C)Cc1nnc(N2CCC=C(Br)C2)n1Cc1ccc(N(C)C)c(F)c1 1692167856 JXYMFOOCMAVFEH-UHFFFAOYSA-N 436.373 4.219 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCCC[C@H](COC)C2)cc1 1710025539 DNHMALNPRILINP-NRFANRHFSA-N 436.604 4.421 10 10 IICE CC[C@H](C)c1nnc(N2CCC(C)(COC)CC2)n1Cc1ccc2c(c1)CCCN2C 1726925400 MDPJQZUWUQPPBG-IBGZPJMESA-N 425.621 4.475 10 10 IICE CCN(CC)c1ccc(Cn2c(CN3CCCC3=O)nnc2N(CC)C2CCCC2)cc1 1728383426 ACDGCJISRYNKAA-UHFFFAOYSA-N 438.620 4.064 10 10 IICE CC[C@H](C)[C@H](Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1743533641 YWJODWXTPWRVMV-REWPJTCUSA-N 443.636 4.263 10 10 IICE Cc1cc(-c2nnc(N3CCCCCC3)n2CCOCCCO)c(C)n1-c1ccccc1 1761679137 WEZDOBVVWRSZDR-UHFFFAOYSA-N 437.588 4.132 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC(c2ccnn2C)CC1 1761698058 JZJCXTIPCVTBPY-UHFFFAOYSA-N 449.647 4.407 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCCC[C@H](COC)C2)cc1 1764942110 NJAAKEZKKMOJAI-JTHBVZDNSA-N 441.620 4.277 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1766661770 XSYHYPXFCPYFFB-HXUWFJFHSA-N 426.653 4.166 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@H]1C 1768007048 KFNWEUZUSFWGPM-UYAOXDASSA-N 437.588 4.391 10 10 IICE CC(C)c1ccc(S(=O)(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1858074116 DYQQOZBJKWAMLJ-DEOSSOPVSA-N 429.630 4.382 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C(C)(C)C)c(C(N)=O)c2Br)c(O)c1 2080056162 PLWBDLXWLLUYFQ-INIZCTEOSA-N 436.350 4.146 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1O 2227747970 HWZLXLAAUUAAAL-HNNXBMFYSA-N 429.355 4.041 10 10 IICE O=C1C(=Cc2ccccc2)SC(=S)N1CCC(=O)N1CCCC[C@H]1c1cccnc1 2297474091 HOLVBYSBRGUJTL-IBGZPJMESA-N 437.590 4.427 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380744197 CIAMSLWEYGGCJJ-CABCVRRESA-N 441.366 4.163 10 10 IICE Cc1cc(C)c(S(=O)(=O)Nc2nc(-c3ccc4c(c3)NC(=O)CO4)c(C)s2)c(C)c1 11857573 TYMOAYJSLRJVTQ-UHFFFAOYSA-N 443.550 4.175 10 10 IICE COc1ccccc1OCCCOc1c(/C=C2/SC(=S)N(C)C2=O)cccc1OC 33766042 RHALNUIEDVAXCN-XMHGGMMESA-N 445.562 4.383 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCCO[C@@H]2C(C)(C)C)C1 435876948 MAZHXDNKUZEJTR-DFBJGRDBSA-N 425.617 4.365 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)N1CCOc2cc(N(C)C)ccc21 441075921 CFZLILPQUIVRIC-OFVILXPXSA-N 446.551 4.058 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NCc1cc(Br)cc(F)c1O 715812486 KQMAACBNJIRVBR-MLGOLLRUSA-N 431.346 4.467 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2c(c1)OCO2 743521032 OJIKMEPYPJTZLU-GDBMZVCRSA-N 433.455 4.046 10 10 IICE CCCN(C[C@H]1CCCCO1)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905378 NOJIHGCRTWGDPI-YLJYHZDGSA-N 425.520 4.248 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3ccc(Br)c(F)c3)SC2=S)cn1 763105399 COXGCWGNTQQHRP-NTUHNPAUSA-N 425.304 4.398 10 10 IICE C[C@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cc(Br)cc(Cl)c1O 790745591 CHUWSSDVNITBAF-APPDUMDISA-N 441.728 4.399 10 10 IICE CCOC(=O)c1ccc(N2N=C(C)/C(=C\Nc3c(C)nn(-c4ccccc4)c3C)C2=O)cc1 1084446342 OHYMPUFLQZNKKG-PXLXIMEGSA-N 443.507 4.384 10 10 IICE CC1(C)C[C@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 1129509837 JTALUQKATRZIPM-DSQDWWTGSA-N 438.640 4.051 10 10 IICE COc1cccc([C@@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCCC2)c1 1135457919 BMVBOMHUINCQMV-AREMUKBSSA-N 445.563 4.482 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4cccc(Cl)c4)[nH]n3)cc2F)C[C@H](C)O1 1136311197 IMDCVPZBZVIQGF-GJZGRUSLSA-N 442.922 4.413 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2ccc(O)cc2c1O 1150355636 ZSCNVRHBPDDAJD-QGZVFWFLSA-N 426.900 4.004 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(C(=O)OC(C)(C)C)n[nH]3)cc2Cl)C1 1155727920 XITBNPXHWVRCDX-AWEZNQCLSA-N 432.952 4.185 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Cl)cc2NCC(F)(F)F)N(C)C)cc1 1158716954 JHGUKPSLCFXRHN-IBGZPJMESA-N 442.913 4.413 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccccc1OC 1159033390 HQUIYPYWVPURHJ-GCJKJVERSA-N 444.959 4.450 10 10 IICE COc1ccc(N(CCc2c(C)nc3sccn3c2=O)Cc2ccccc2)cc1OC 1177021768 FUOSJGHDRHTHRD-UHFFFAOYSA-N 435.549 4.331 10 10 IICE Cc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2ccc(N3CCCCC3)c(C)c2)CC1 1190994314 IRAHFNREQJIBRP-HSZRJFAPSA-N 435.612 4.405 10 10 IICE C[C@@H]1CCCC[C@H]1OCCNC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1191581694 IHTYYGAIUJMVIL-WIYYLYMNSA-N 444.597 4.237 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)NCc3cccc(Cl)c3O)cc2C1 1226317297 KMNOIRCIGOTWTD-UHFFFAOYSA-N 431.920 4.296 10 10 IICE C[C@@H](NC(=O)N[C@@H](CCO)c1cccc(OC(F)(F)F)c1)c1ccc(N(C)C)cc1 1226646581 CAFXOMMYBHALFB-KUHUBIRLSA-N 425.451 4.135 10 10 IICE CC(C)(CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1234386854 LIARAYZMVZBYIU-UHFFFAOYSA-N 449.517 4.444 10 10 IICE COc1ccccc1[C@@H](CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)OC(C)C 1235033773 VXISWMLXPIBFAU-YADARESESA-N 427.589 4.466 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCC[C@@H]2Cc2cnn(C)c2)cc1 1253222430 WWKJWTJTRZBFQG-ZJSXRUAMSA-N 435.572 4.202 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)CC[C@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1289360013 YPHWAIRGVOCXAE-RBUKOAKNSA-N 448.615 4.456 10 10 IICE CC1(C)C[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c2ccccc21 1294742703 TYSQHDYMHJUDKN-GOSISDBHSA-N 442.562 4.407 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2csc(NC(=O)OC(C)(C)C)n2)C2CC2)cc1 1313393318 WDTRNPCWLCAIKV-UHFFFAOYSA-N 445.589 4.430 10 10 IICE CCOC(C)(C)Cn1c([C@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1314045656 RUTSPCNPCJCJNO-QGZVFWFLSA-N 433.572 4.081 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](COC)C1 1316033270 FMICFRSERWVRID-NRFANRHFSA-N 437.588 4.252 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc(Cl)cc(Cl)c3F)CC2)cc1 1350975533 AOPZSOJBFPORDM-UHFFFAOYSA-N 440.346 4.083 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)N[C@@H](C)c2ccccc2)sc2c1CCCC2 1351557692 JRGDGSJPNGDPRG-HNNXBMFYSA-N 428.554 4.400 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1c(F)ccc(SCC2CC2)c1F 1354659092 SLYJTJLFLDMRAQ-UHFFFAOYSA-N 436.499 4.373 10 10 IICE Cc1nn(-c2ccc(C(=O)NCc3ccc(N(C)C)c(F)c3)cc2)c(C)c1Br 1356250254 CTWCKRZCAORIHU-UHFFFAOYSA-N 445.336 4.387 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(OCC(F)(F)F)nc2)CCCC1 1356478129 SDGKOAXYZSTWRA-UHFFFAOYSA-N 447.457 4.181 10 10 IICE C[C@H](c1ccccn1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1356590407 PEMZKNXFPCSUHV-QFGUUYLXSA-N 429.542 4.032 10 10 IICE Cc1cccc(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1434983104 GWNZKTLFUIJDCE-XMHGGMMESA-N 428.554 4.084 10 10 IICE CCN(CC)CCNC(=O)c1ccc(OC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1435128243 NILPCCLJEROJLF-UHFFFAOYSA-N 447.579 4.314 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccc(Cl)cc4)C3)cc2)CC1 1464963785 ZKTWJMBRLIMVFU-IBGZPJMESA-N 425.960 4.246 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(C)(C)n2ccc(NC(=O)OC(C)(C)C)n2)cc1F 1465006559 ORGJKMJANGCKQV-UHFFFAOYSA-N 447.555 4.267 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2Br)cc1F 1465008523 YMQVRRMCYBSPGR-UHFFFAOYSA-N 438.297 4.202 10 10 IICE CC[C@@H](C)Oc1ccccc1/C=C\C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1466398936 VAEAPKMKGPBYIP-HMWXGYMHSA-N 431.916 4.438 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2c2ccccc2Cl)c(O)c1O 1467452176 NCUUFNQCISHQRW-SFHVURJKSA-N 446.931 4.494 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC[C@@H]3CN3C[C@H](C)O[C@@H](C)C3)c2C)c1 1471036780 ZKKGWRAUHJUIML-STWLZBDKSA-N 438.616 4.186 10 10 IICE Cc1cccc(NCCNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1 1472012598 IGUZKRWXXBRPNR-UHFFFAOYSA-N 427.346 4.402 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](OC)C(C)(C)C1 1517763663 KTFRXUQRHVGQSO-AVRDEDQJSA-N 437.588 4.249 10 10 IICE CSc1cc(Br)ccc1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1526967900 KZGQDUGKBCYWJC-CQSZACIVSA-N 435.387 4.499 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@H](C)Cc3ccc(Cl)cc3)CC2)cc1 1531524519 MVTHIBPMLWVEHA-HXUWFJFHSA-N 444.019 4.246 10 10 IICE CCOc1ccccc1N1C[C@H](C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1531612327 PRNBJSDALKPEOV-OAQYLSRUSA-N 431.536 4.162 10 10 IICE C/C=C\COc1cccc(CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1535561611 PZPIENITZWTLOE-IHWYPQMZSA-N 433.596 4.032 10 10 IICE CC[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1nnc2n1CCCCC2 1544932278 TVDQXOBLSZZISD-OAQYLSRUSA-N 433.556 4.414 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCS1 1545538236 XXFQMEJVHSPKBE-SJLPKXTDSA-N 433.597 4.162 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)C[C@H]2CC=CCC2)cc1F 1552833332 PHCXHEFQUOMMLH-ICSRJNTNSA-N 427.568 4.218 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCc2ccnc(Oc3ccccc3)c2)N(C)C)cc1 1565028981 YMNSNWIKUSWTGY-QHCPKHFHSA-N 433.556 4.042 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](c1ccncc1)C1CCCCC1 1566023620 YJKGBELBJCIZGA-DEOSSOPVSA-N 425.548 4.162 10 10 IICE C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1584514850 DLBUIQVFXLNMKD-LBPRGKRZSA-N 445.293 4.192 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(Cn3nc([N+](=O)[O-])cc3C)c2)cc1F 1585698037 HPQUQAAWZQZIGE-UHFFFAOYSA-N 439.491 4.063 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1nn(-c2ccc(F)cc2)ccc1=O 1597566967 DJRXDBIULYLJRK-GOSISDBHSA-N 443.478 4.481 10 10 IICE CCc1nnc(N2CCN(Cc3cccc(C)c3)CC2)n1CCCSc1nccs1 1614034262 HPZVEEHIZXGKDB-UHFFFAOYSA-N 442.658 4.110 10 10 IICE Cc1cc(C(=O)N2CC(=O)N(C(C)C)C(C)(C)C2)c(C)n1-c1cccc(Br)c1 1620689301 MLFOXDZGKUSQGO-UHFFFAOYSA-N 446.389 4.328 10 10 IICE Brc1ccc(-c2n[nH]cc2CNCc2ccc(N3CCOCC3)cc2)s1 1620746588 SFKCFORRUSBFOC-UHFFFAOYSA-N 433.375 4.027 10 10 IICE COc1ccccc1OCCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1623875776 TXQDHGYODYOPIY-UHFFFAOYSA-N 444.329 4.069 10 10 IICE CN(c1ccc(CNC(=O)CNC(=O)NCc2ccc(Cl)cc2)cc1)C1CCCCC1 1625905131 IQPSJWUJGYBLCK-UHFFFAOYSA-N 442.991 4.225 10 10 IICE CCCCC[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1627934044 SMYXQXOJHCWEJI-AQLJSXSMSA-N 449.595 4.338 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1-n1c(C)cc(C=O)c1C 1628149295 PRAUBQHCPKUDGU-UHFFFAOYSA-N 430.552 4.219 10 10 IICE COC(=O)[C@@H](C)CN(Cc1ccccc1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1628915779 HZTGVUZJNSLOTK-SFHVURJKSA-N 432.520 4.358 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC(Cc2ccco2)C1 1632870954 JQGYPRXJYLZJMP-GZTJUZNOSA-N 432.592 4.024 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC(c3nc(N(C)C)n[nH]3)CC2)cc1 1636431717 WFQKHNZPWQPAFM-UHFFFAOYSA-N 446.559 4.372 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@H](c3cccc(F)c3)C2(C)C)N(C)C)cc1 1638918446 VHOPJRUBFWQUOB-PKTZIBPZSA-N 426.580 4.472 10 10 IICE CCCCN(Cc1cc(C)n(-c2ccc(OC)cc2)c1C)c1cc(C(N)=O)nc(Cl)n1 1639593901 MCZOHPUHVWLHKD-UHFFFAOYSA-N 441.963 4.452 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2ncc(Cc3cccc(C)c3)s2)cc1 1643685091 RUMLGVHWSJEOOZ-UHFFFAOYSA-N 438.597 4.058 10 10 IICE CCC[C@H](O)CCCS[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1644147595 PZOPFADIRLSRJZ-RDJZCZTQSA-N 425.550 4.463 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cc(C)ccc1C 1648030261 JFIGEVCZIXUWKZ-SKPFHBQLSA-N 441.591 4.413 10 10 IICE C[C@H](S[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(=O)OC(C)(C)C 1652801234 SDQURUJZVUXNOW-KGLIPLIRSA-N 439.533 4.252 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCCOCc3ccc(Cl)cc3Cl)C2)cc1 1680936023 OOFBIDCVHJHTJG-KRWDZBQOSA-N 438.355 4.097 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1(c2cccc(Cl)c2)CCC1 1682986331 BDTRQGRXZGQQAJ-UHFFFAOYSA-N 427.976 4.222 10 10 IICE CCC[C@@](C)(O)Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695046304 HGHFEOFOBJYIQR-RUZDIDTESA-N 443.636 4.143 10 10 IICE C[C@H]1C[C@@H](C)CN(C(C)(C)Cn2c(CC3CC3)nnc2N(C)Cc2ccccc2O)C1 1707962270 UYTAHFDBRMKGSY-KDURUIRLSA-N 425.621 4.329 10 10 IICE CC(C)c1nnc(N2CCC[C@H](C[C@@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1723171233 CNTJPRCKAVXMOW-QUCCMNQESA-N 429.584 4.298 10 10 IICE CC(C)Cc1nnc(N2CCN(C3CCC3)C[C@@H](C)C2)n1CCCSc1nccs1 1723336941 AHCKOYZALKQURG-GOSISDBHSA-N 448.706 4.426 10 10 IICE CC(C)Cc1nnc(N2CCSC[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1741487387 DBJLGJAUIWMDNX-GOSISDBHSA-N 431.675 4.020 10 10 IICE CC[C@H](C)[C@@H](Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O)OC 1743537822 ISGCHQGJBFDCQF-MGPUTAFESA-N 429.590 4.037 10 10 IICE CCc1ccc([C@@H]2CN(c3nnc(C)n3CCCSc3nccs3)CCO2)cc1 1744354529 NEZHBOCJUQFJQR-IBGZPJMESA-N 429.615 4.366 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)CC2CC(F)C2)cc1 1746093763 OEWQXCDBPJZYBW-UHFFFAOYSA-N 436.579 4.343 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1CCOC(C)(C)C 1747749992 HDWFWSFUFYFJGY-UHFFFAOYSA-N 448.365 4.193 10 10 IICE C[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)O1 1752381188 PMZLGCJIGOEPIU-QGZVFWFLSA-N 429.584 4.268 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@H](CCOC)C2)cc1 1764936010 VPJSPSOKSHQXHQ-JOCHJYFZSA-N 448.615 4.406 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CC(=O)N(C)C1CCCCC1 1767113128 JPVRBHDDFDRAHL-UHFFFAOYSA-N 439.604 4.144 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)ccc1OC 1858589370 XSLWMBVLTQVKSI-VXLYETTFSA-N 429.519 4.224 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(NC(=O)CCc4ccccc4)c3)CC2)cc1 1892065502 ODNUDDRRKCIQSO-UHFFFAOYSA-N 443.547 4.229 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1C[C@H]2NCc1cc(Cl)cc(Br)c1O 2037301454 ZSMVQOXCPBSBDN-YUELXQCFSA-N 431.758 4.296 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)[C@H](C)c1ccccc1O 2060114828 GZOUKNYHEFYYBB-FGSXEWAUSA-N 442.556 4.410 10 10 IICE Cc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(N(C)C)cc3)c2C)C1=O 2294280049 UNJARVPFGBMJBX-UHFFFAOYSA-N 442.519 4.135 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12 2296397990 LMZNFBQQYGTXBX-UHFFFAOYSA-N 439.446 4.495 10 10 IICE O=C1C(=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)SC(=S)N1N1CCOCC1 2314487747 JWGVNXXTARZINK-UHFFFAOYSA-N 440.468 4.414 10 10 IICE COc1ccc(C=C2SC(=S)N([C@@H](C)c3ccccc3)C2=O)c(C(=O)O)c1OC 2314929469 MXHCUPKQUMRYQM-LBPRGKRZSA-N 429.519 4.364 10 10 IICE COc1cc(C=C2SC(=S)N(Cc3ccccc3Cl)C2=O)cc([N+](=O)[O-])c1O 2323865107 HHCZZOLQUCHDDW-UHFFFAOYSA-N 436.898 4.364 10 10 IICE CC[C@@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2380756524 LXKRRRVTPJBCNX-DOMZBBRYSA-N 443.382 4.409 10 10 IICE CC[C@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380764274 BXOIAODYDQEPPL-VBKZILBWSA-N 441.366 4.115 10 10 IICE Nc1ccc(-n2nnc(S(=O)(=O)c3cccc(Cl)c3)c2-c2ccc(F)cc2)cc1 11730691 KGMFCOSUOWLIGO-UHFFFAOYSA-N 428.876 4.142 10 10 IICE Cc1cc(C(=O)NCCCc2nc3ccccc3[nH]2)c(C)n1-c1ccc2c(c1)OCCO2 28505646 CLRFGHNYDSAJIR-UHFFFAOYSA-N 430.508 4.104 10 10 IICE CCCCN1C(=O)/C(=C/C=C2/N(C)c3ccc(C(=O)OC)cc3N2CC)SC1=S 35190076 HPEBQTMWBXBRDE-IWSCKCOWSA-N 431.583 4.135 10 10 IICE COc1ccc(-c2c3c(nc4sc(C(=O)OC(C)C)c(N)c24)CCN(C)C3)cc1OC 40570154 MWISUTWAYNRTEO-UHFFFAOYSA-N 441.553 4.116 10 10 IICE Cc1ccc(C)c(OCCOc2cccc(/C=C3/C(=O)NN(c4ccccc4)C3=O)c2)c1 96544402 UHYMHJQQALIRLR-QJOMJCCJSA-N 428.488 4.223 10 10 IICE Cc1ccc(C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cc1NC(=O)c1ccco1 98080287 FABAVFRQIGQOKC-UHFFFAOYSA-N 443.507 4.403 10 10 IICE C[C@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 109190154 LFRQIABDDOTOHE-IBGZPJMESA-N 429.520 4.267 10 10 IICE COCCN(Cc1nnc(-c2cccs2)o1)C(=O)c1ccc(-n2c(C)ccc2C)cc1 115067104 JDJGORCNEUUEGB-UHFFFAOYSA-N 436.537 4.494 10 10 IICE Cc1nn(CC(=O)N[C@H](c2ccccc2)c2c(O)ccc3ccccc23)c(=O)c2ccccc12 248050207 WXOSZLUMZNWWKD-HHHXNRCGSA-N 449.510 4.470 10 10 IICE Nc1cc(F)c(O)c([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1 687735904 JJJBSMXMIWQAJE-NRFANRHFSA-N 436.439 4.168 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@@H]3CCCCN3C2=O)c(C)n1-c1cccc(C(F)(F)F)c1 761206623 LZXZKEYZQSOFJC-SFHVURJKSA-N 433.430 4.112 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)c2)c1C 766473670 YUWCZFHCKXJEES-UHFFFAOYSA-N 445.567 4.006 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc([C@H]4CCCOC4)cc3)cc2F)C[C@@H](C)O1 779857987 STPXDFOICMBCFB-SVMVAKDDSA-N 426.532 4.263 10 10 IICE CCOc1ccc(O)c(CN[C@H](CO)c2ccc(Br)cc2C(F)(F)F)c1 793369473 IEUYRZFVAQZHRX-MRXNPFEDSA-N 434.252 4.395 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)c(F)cc1Cl 795543012 ACQAMPREZXLBQU-UHFFFAOYSA-N 444.868 4.329 10 10 IICE C[C@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(Br)cc1O 798935512 QAERYCFFHRGPOR-ZDUSSCGKSA-N 425.754 4.496 10 10 IICE CSc1nc(-c2ccco2)nc(C)c1C(=O)NCc1cc(Br)ccc1O 804737987 YBHGQYUBXRWPLK-UHFFFAOYSA-N 434.315 4.165 10 10 IICE O=c1ccccn1Cc1ccc(CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1 920181521 UAQMMUSCKNNZKY-UHFFFAOYSA-N 432.524 4.085 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1128581284 VFYDBUMZEVVAEF-QGZVFWFLSA-N 443.588 4.290 10 10 IICE CCN(Cc1occc1C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1129805944 YNODTZJGEVYIQG-LDADJPATSA-N 432.542 4.367 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cn2nc(C(F)(F)F)c3c2CCCC3)cc1F 1136730115 CHASSTUCSBUCTL-UHFFFAOYSA-N 426.458 4.082 10 10 IICE Cc1cc(C(=O)NCC2(OCCO)CCC(F)(F)CC2)c(C)n1-c1cccc(Cl)c1 1167265648 PICHDVLWFADUAV-UHFFFAOYSA-N 440.918 4.434 10 10 IICE Cc1nn(Cc2cccc(Br)c2)c(C)c1C(=O)NCc1c(O)cccc1F 1178413546 UHYNRHKFVZQCIL-UHFFFAOYSA-N 432.293 4.085 10 10 IICE CC[C@@H](CN(C)CC(=O)NCc1ccc(N(C)C)cc1)Oc1ccc(Cl)c(Cl)c1 1193485104 NNMQKORJKHHBOI-SFHVURJKSA-N 438.399 4.465 10 10 IICE CCCCN(CC(=O)NC1(c2ccc3c(c2)OCCO3)CCCC1)Cc1ccccc1O 1193838158 GNQMBQGAKBPCJQ-UHFFFAOYSA-N 438.568 4.351 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCOc2cccc(Cl)c2)C1 1264567331 CNYBKBOSRJNVSJ-UHFFFAOYSA-N 425.960 4.256 10 10 IICE C[C@@H]1CCC[C@H](N(C)c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1291074264 MKJUGOSADVTGRF-RLLQIKCJSA-N 429.584 4.440 10 10 IICE Cc1ccc(C(=O)N2CCc3cc(Br)c(Br)cc3C2)c(O)c1O 1301402090 RIRXQBOIAJRRNZ-UHFFFAOYSA-N 441.119 4.130 10 10 IICE CSc1cc(Cn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)ccn1 1302640174 AGOPGSDGCDOUGX-UHFFFAOYSA-N 432.553 4.156 10 10 IICE CC[C@H](Cn1c(CC(C)C)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1305835884 MUYFTNIKBXINFI-GOSISDBHSA-N 431.581 4.122 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1CC1CCN(Cc2cccs2)CC1 1306081092 VFDHBVPLAKTOGN-UHFFFAOYSA-N 425.602 4.156 10 10 IICE Cc1cc(C(=O)Nc2nc(-c3cccs3)n[nH]2)c(C)n1-c1ccc(Br)cn1 1306353835 HKLQMUJVNXBITL-UHFFFAOYSA-N 443.330 4.351 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCN(C(C)(C)C)CC2)cc1 1313676811 DVTQITRLUNZLCJ-UHFFFAOYSA-N 447.631 4.155 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H](C[C@H]1COCCO1)C(F)(F)F 1446799436 FHMVEUOKRQEDEG-UXPWSPDFSA-N 437.458 4.466 10 10 IICE COc1ccccc1[C@@H]1CN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CCO1 1454720974 DFLYLZLGGYLUPP-VWLOTQADSA-N 432.520 4.437 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1459588889 SZLLSOJMJUYCHF-PKOBYXMFSA-N 425.960 4.246 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)cc1 1464435511 LAAOMDQIEYEXGJ-GOSISDBHSA-N 443.463 4.177 10 10 IICE Cc1cc(CC(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1466619209 SJLDUTCVHKPNQZ-HNNXBMFYSA-N 427.898 4.385 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1471095105 LLWOZUYKVGFRPI-SAABIXHNSA-N 429.517 4.000 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccc(C)c1C 1473232017 WBSPAUQGKYZQEL-RTBURBONSA-N 427.564 4.199 10 10 IICE CC(C)(C)OC(=O)NCC1(CCNC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 1478923959 MCIHLYVTVXFANR-UHFFFAOYSA-N 432.348 4.193 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(N(C)C)CCC1 1495639081 KNTRWGWBFIZHRF-HXUWFJFHSA-N 440.636 4.001 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCO[C@H]3C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1F 1505277638 ISCRZVZBRQKBFW-QSRMWPQZSA-N 447.574 4.244 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H]3C)n2CCSCCCO)c(C)n1-c1ccccc1 1510616449 BIGFUSNMZFIWKX-GOSISDBHSA-N 439.629 4.457 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1516888680 KPYUYKXJPWHKGY-FGZHOGPDSA-N 443.661 4.397 10 10 IICE O=C(Cc1cccc(Cl)c1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015200 IDMXDJPCAFKKHC-UHFFFAOYSA-N 432.395 4.384 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)c(Cl)c1 1535156538 IYLLCDKFJCDLSU-CQSZACIVSA-N 434.367 4.115 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CN(C)c3ccccc3[N+](=O)[O-])cc2Cl)C1 1539911903 FDAUAVMPXGTMPI-MRXNPFEDSA-N 430.936 4.237 10 10 IICE O=C(Cc1c[nH]c2cnc(Cl)cc12)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1542704193 SVASVJIAYGHRQM-UHFFFAOYSA-N 434.874 4.145 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc([N+](=O)[O-])ccc1SC 1545509027 XBRJZZTUQCTVDO-UHFFFAOYSA-N 425.304 4.447 10 10 IICE COc1ccc(N2CCCN(CC(=O)Nc3nc(-c4ccc(C)cc4)cs3)CC2)cc1 1559492173 HGBLVNLRFATFPO-UHFFFAOYSA-N 436.581 4.278 10 10 IICE COc1ccc2c(C)c(CCC(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)c(=O)oc2c1 1585263296 ARAMUUARQVQVEB-QGZVFWFLSA-N 436.552 4.164 10 10 IICE Cc1cc(C(=O)Nc2cccc([S@@](C)=O)c2)c(C)n1-c1ccc(Br)cn1 1585433392 CJYSSMVTWABSDE-AREMUKBSSA-N 432.343 4.241 10 10 IICE C[C@H](Cc1ccc(Br)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1586054451 ISSPTSZTQANQMX-IERDGZPVSA-N 432.406 4.113 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-c2ccc(Cl)s2)on1 1597567701 UQHXSQWSESYZCV-UHFFFAOYSA-N 441.292 4.231 10 10 IICE COc1ccc2nc([C@@H](C)NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)[nH]c2c1 1617178386 LCXAFDGJXWSTAA-MRXNPFEDSA-N 430.508 4.211 10 10 IICE COc1ccc(CNC(=O)c2ccc3c(c2)[C@@H](CNC(=O)OC(C)(C)C)CCC3)c(O)c1 1626079765 MPJGXPOEZLJZMB-GOSISDBHSA-N 440.540 4.275 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1Cc2ccc(C)cc2S1 1626511093 HUCLTXPDKMYOCF-QHCPKHFHSA-N 426.582 4.400 10 10 IICE Cc1cc(C(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1629689801 HXRNCTWXWLMIST-LJQANCHMSA-N 434.559 4.174 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1 1629775580 ZHKVUDKGGTZLOC-JWQCQUIFSA-N 443.547 4.378 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(I)c(Cl)c1 1634939418 NXNVKVTZNNEHNX-UHFFFAOYSA-N 436.673 4.066 10 10 IICE COc1ccc(CCNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c(Cl)c1OC 1635579284 OWLMMWULAAZUFG-UHFFFAOYSA-N 431.964 4.340 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 1635673429 OOKFLZHWAQCASM-UHFFFAOYSA-N 445.273 4.115 10 10 IICE CCCN(CCN1CCCC1)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1640399252 HHDQIBZMDVXVQT-UHFFFAOYSA-N 433.394 4.200 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(I)c[nH]3)c2C)c1 1643366895 VMWFNMURQHMLPL-UHFFFAOYSA-N 433.293 4.265 10 10 IICE C[C@@H](Sc1ncc(Cl)s1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 1644118849 NUMPUAXPIBSMEZ-GFCCVEGCSA-N 446.019 4.090 10 10 IICE CC(C)(C)c1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 1653303835 GIMKJXFVHPZTER-UHFFFAOYSA-N 431.539 4.199 10 10 IICE CC1CCN(c2ccc(NC(=O)CCC(=O)NCc3cccc(Cl)c3O)cc2)CC1 1653567064 IRGBPYASMUOOFE-UHFFFAOYSA-N 429.948 4.317 10 10 IICE CC(C)[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1F 1654166644 ATXCWSBGGUNRKS-FUMQJTLXSA-N 445.554 4.182 10 10 IICE O=C(Cc1ccccc1)N1CCC[C@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1 1680451562 DVBZIZFSIVNBES-QHCPKHFHSA-N 449.595 4.470 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1 1683424557 FIODHMUAKSEKHM-SFHVURJKSA-N 425.548 4.436 10 10 IICE CCCCOc1ncccc1Cn1c(-c2ccccn2)nnc1N(C)Cc1ccccc1O 1695261985 CNENRTPOBKAWFB-UHFFFAOYSA-N 444.539 4.304 10 10 IICE Cc1cc(-c2nnc(N3CCCOCC3)n2CCCOC(F)F)c(C)n1-c1ccccc1 1707273383 PFOOEFAYIRPIIU-UHFFFAOYSA-N 445.514 4.209 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1C[C@@H]1CCCCC(F)(F)C1 1711095793 YKWGCQIERYMQMI-MRXNPFEDSA-N 430.503 4.236 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C(C)C)N1CCCC1 1730964725 MJRKWRXOJHALOL-HSZRJFAPSA-N 436.604 4.471 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1csc(C)n1 1766233538 CEAAUOXQNKNNSL-UHFFFAOYSA-N 440.617 4.059 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCSC[C@@H]2C)cc1 1766614677 OJONLEXZTYVIQQ-IBGZPJMESA-N 436.629 4.100 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1767706184 WZFKOWYYKVIHAV-SIKLNZKXSA-N 437.588 4.393 10 10 IICE Cc1c(OCCCOc2ccc(Cl)cc2)c(=O)ccn1CCOc1ccc(N)cc1 1857919647 QOCYICKSWBJDJJ-UHFFFAOYSA-N 428.916 4.319 10 10 IICE COc1cc([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)cc(O)c1O 1951417020 BZQLIRSWVYQFCX-HXUWFJFHSA-N 449.459 4.161 10 10 IICE COc1ccc(Cn2nc(C3(C)CC3)c(C(C)C)c2I)c(O)c1 2079762982 AKEUVADPQNJFQL-UHFFFAOYSA-N 426.298 4.425 10 10 IICE COc1ccc(C=C2SC(=S)N(CCc3ccc(OC)c(OC)c3)C2=O)cc1OC 2296664668 VZJNQUOZSKJUQC-UHFFFAOYSA-N 445.562 4.165 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)c1O 14459697 LVGUFMFPNVUCGP-GSHUGGBRSA-N 426.538 4.012 10 10 IICE CCCN(CCC)c1ccc([C@H]2N=C(N)Nc3nc4cc5c(cc4n32)OCCCO5)cc1 27866027 CBUIWTLQZHRMRJ-QFIPXVFZSA-N 434.544 4.111 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccccc2)SC1=S)NCc1nc2ccccc2s1 40324148 ZXFMMKVGMMBZBU-ATVHPVEESA-N 439.587 4.204 10 10 IICE O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1NC(=O)C12CC3CC(CC(C3)C1)C2 110422611 HQWHXZGCBZOOMW-IUXPMGMMSA-N 443.550 4.044 10 10 IICE CC(C)(C)c1ccc(C(=O)NN2C(=O)/C(=C/c3ccccc3C(=O)O)SC2=S)cc1 210395850 CHRYHTZZXDHWHY-ATVHPVEESA-N 440.546 4.229 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 229096094 ZNMLODLLBXMMFJ-HVCNVCAESA-N 431.580 4.377 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN(C)c2ccc(Cl)cn2)cc1 732115133 SQDMPOCUYKHNTJ-UHFFFAOYSA-N 438.959 4.479 10 10 IICE CC[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1nccs1 737670854 OODUWJKTROURPT-KECPUOCWSA-N 437.637 4.454 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)NC(=O)OC(C)(C)C)cc1 742752230 FLGGGOWRZZVUMY-FKBYEOEOSA-N 441.547 4.377 10 10 IICE COc1ccc(Cn2nc(C)c(CN(C)Cc3ccc(N4CCOCC4)cc3)c2C)cc1 768505266 OWZVPFSYYBZQBM-UHFFFAOYSA-N 434.584 4.025 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc([C@H]2CCCOC2)cc1 780656031 DPVXTQFCOWDVGI-SIKLNZKXSA-N 428.960 4.334 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3ccc(=O)c4ccccc43)c2C)cc1 920263719 LILIMQOWNTXYQI-UHFFFAOYSA-N 428.488 4.144 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@@H](CC)C2 1124312957 DQOBZMCWAHALHP-CVEARBPZSA-N 440.565 4.431 10 10 IICE CC(C)(C)c1cnc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1127622539 WEKLVYXELSMJLG-GDNBJRDFSA-N 448.541 4.446 10 10 IICE O=C(/C=C\c1csc(C(F)(F)F)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129660430 RCJWQBBWJHTQHY-UPHRSURJSA-N 432.414 4.211 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(C[C@@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)cc1 1137032469 PNZPZWZSRCILHO-QGZVFWFLSA-N 447.461 4.376 10 10 IICE NC(=O)[C@]1(c2ccccc2)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1171180410 WEQUYDYCMQDWMJ-RUZDIDTESA-N 427.508 4.170 10 10 IICE COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)CC2 1230199252 ALBMXJIVKNPPQX-ZWKOTPCHSA-N 425.573 4.338 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H]3CCC[C@H](C(C)C)CC3)CC2)cc(OC)c1OC 1235062327 XYPZEYNBPOIPPR-OALUTQOASA-N 433.593 4.149 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@H](c4c(F)cccc4Cl)C3)C2)cc1 1252116128 PGAWNJPIWOKENS-KKSFZXQISA-N 447.938 4.097 10 10 IICE COc1ccc(N2CCCN(C(=O)C3(c4cc(OC)cc(OC)c4)CCCC3)CC2)cc1 1264732619 DCEUWZCGSYGIQE-UHFFFAOYSA-N 438.568 4.263 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)CCCCc3ccc(Cl)cc3)cc2)C1 1264736977 JSJZYOXGHOLKFE-HXUWFJFHSA-N 427.976 4.071 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCOC12CCCCC2 1289485786 MTLOXNZVDIKQDE-UMADGWCESA-N 448.585 4.025 10 10 IICE Cc1ccc(O)c(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1 1301046498 CWDQUNDNKUPNBB-GZTJUZNOSA-N 432.592 4.060 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(F)(F)F 1316486629 DLYUBVBGVVPZRW-UKRRQHHQSA-N 436.457 4.161 10 10 IICE C1=CCN(c2nnc(CCOc3ccccc3)n2CCCSc2nccs2)CC1 1359075543 WIPKPVVMWVTDLO-UHFFFAOYSA-N 427.599 4.305 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)NC(=O)CCc3ccccc3)cc2Cl)C1 1436047846 MLJRBEBIFZCEIR-RTBURBONSA-N 442.003 4.330 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)N3CCCCc4ccc([N+](=O)[O-])cc43)ccnc21 1453751016 NHLPBEHRMAWKGI-UHFFFAOYSA-N 438.484 4.271 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cnc(Cl)c4ccccc34)cc2F)CC1 1456130667 QDKFMRNFOQMSOL-UHFFFAOYSA-N 426.923 4.099 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cncc2c1CCCC2 1470093360 KWOPUWCNGZBUMC-YBFXNURJSA-N 441.553 4.330 10 10 IICE CC(C)CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CCCC1 1473127279 CVGIIHHFWDBKDX-WOJBJXKFSA-N 433.612 4.346 10 10 IICE CCc1nc(CN(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1498407155 NGHXVTKLRRKPSE-UHFFFAOYSA-N 428.581 4.139 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(F)cn1 1503489434 VCRFHOFLRBRRGT-TZIWHRDSSA-N 439.535 4.121 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCC3CCOCC3)CC2)cc1 1504292631 PDJNJXUCPYVPJT-UHFFFAOYSA-N 441.620 4.334 10 10 IICE CC1=C(Br)CN(c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1510367493 XRTMBHXKHMMNSG-UHFFFAOYSA-N 448.384 4.363 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)C[C@H]2CCCO2)cc1 1515524502 FIXIIJWFSHTXNT-JOCHJYFZSA-N 434.588 4.158 10 10 IICE COc1ccc(N(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1F 1516759493 ANWDMXTZSOYYKZ-WOJGMQOQSA-N 448.516 4.228 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N2CCc3c2ccc([N+](=O)[O-])c3F)C1 1522473575 JAXFSBQCSSWLEF-UHFFFAOYSA-N 441.459 4.230 10 10 IICE COc1ccccc1O[C@@H](C)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1533141874 JZTVVQIYUCQNOU-IBGZPJMESA-N 435.568 4.000 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C(F)(F)c3cccc(Cl)c3)cc2F)CC1 1537534692 GEFIPWDGTYRBHA-UHFFFAOYSA-N 425.882 4.029 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](N3CCCCC3)C2)n1CCCSc1nccs1 1541449660 DBCQZWRSTUTYLP-GOSISDBHSA-N 434.679 4.180 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@H](N2CCCC2)C1 1542226954 NRWUYCQFPNYEQQ-QHCPKHFHSA-N 438.664 4.354 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc4c(Cl)cccc4s3)CC2)cc1 1542431720 FJZIWRSHLLIPST-UHFFFAOYSA-N 429.973 4.115 10 10 IICE Nc1cc(C(F)(F)F)ccc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1545040472 GCPXCIRZXQPGEA-CYBMUJFWSA-N 429.389 4.288 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)Cc2ccc(Br)c(Br)c2)c1 1545683994 GYPJKVGIRNVXLE-JTQLQIEISA-N 443.135 4.346 10 10 IICE CN(c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCCSc1nccs1)C1CCC1 1552902215 RLIIYARPPVGWFX-UHFFFAOYSA-N 430.559 4.481 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1555901825 UMNGACVIWRDFPK-GOSISDBHSA-N 431.650 4.038 10 10 IICE Cc1cc(C(=O)N2CCCN(CC(F)F)CC2)c(C)n1-c1ccc(Br)cc1 1566463958 AGSMVQSZUOYIJY-UHFFFAOYSA-N 440.332 4.270 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2[C@H]3Cc4ccccc4[C@H]32)NC(=O)OC(C)(C)C)cc1 1586620241 UUBYHFOZARKVCR-MYDTUXCISA-N 435.568 4.021 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CC(C)(C)CC(=O)c3ccccc3)cc2F)CC1 1616496181 MNCQLOGQBQQJME-UHFFFAOYSA-N 439.575 4.273 10 10 IICE COc1ccc(C2(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CCCC2)cc1OC 1616858460 MVASLOALPHHTJI-JOCHJYFZSA-N 439.600 4.001 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)c2)CC1 1617050782 JYSWIFDTNPYDOP-UHFFFAOYSA-N 430.552 4.301 10 10 IICE ClC1=C(Cl)CN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)CC1 1620326497 VGXBWHZTWCVOPZ-LBPRGKRZSA-N 446.429 4.320 10 10 IICE COC(=O)[C@H](C)CN(Cc1ccccc1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1624593330 JZFOLWKPRFCRBZ-LJQANCHMSA-N 446.547 4.287 10 10 IICE Cc1cc(CNC(=O)OC(C)(C)C)oc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1624630227 MDGFFIVUIUKECA-UHFFFAOYSA-N 427.545 4.485 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C(=O)/C=C\c2ccc(Cl)nc2)C1 1624671160 SYOJLLIKTFIXOL-FPISAVPCSA-N 427.932 4.478 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1625068477 PGFNVUXOPRBQLF-NFBKMPQASA-N 437.584 4.495 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3c(Br)nc4n3CCCC4)cc2)CC1 1627467324 FFBSILKVLZHTJM-UHFFFAOYSA-N 431.378 4.148 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccnc(O[C@@H]3CCOC3)c2)cc1 1628565300 LCWSZGDRCKMHNG-XMMPIXPASA-N 447.535 4.171 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)Cc2ccc3c(c2)N(C(=O)OC(C)(C)C)CC3)c1 1631543272 SJQIJSHHMNLDRJ-HNNXBMFYSA-N 426.513 4.118 10 10 IICE Cc1cc(C(=O)N[C@H](CCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1631657748 UHUHWRLYDUXIQO-LJQANCHMSA-N 428.330 4.105 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](CS(C)(=O)=O)c1ccccc1 1632697024 DAGRUDHBUAVJHE-XXBNENTESA-N 437.561 4.310 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)C2CCCC2)c(C)n1-c1ccc(Br)cn1 1632730338 XXJYACPQJREHML-UHFFFAOYSA-N 433.394 4.198 10 10 IICE Cc1cc(C)cc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1633052191 DXMOHZHNHBIQKT-HNNXBMFYSA-N 430.551 4.362 10 10 IICE CC(C)c1nc(C(=O)NCc2cccc(Br)c2O)nn1-c1ccccc1Cl 1635840482 UBCRBUSSMRFWLL-UHFFFAOYSA-N 449.736 4.442 10 10 IICE C[C@H]1Cc2cnccc2N1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1643138316 KGZVITROXRMBPB-HNEYUBDGSA-N 429.592 4.102 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@H](C(F)(F)F)[C@@H](NC(=O)OC(C)(C)C)C2)c1O 1648351334 IRIXJEOFSQTCGL-HOTGVXAUSA-N 434.430 4.011 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N(C)CCOCCNC(=O)OC(C)(C)C)c1 1648580173 QTVBMNGEWJDAMA-UHFFFAOYSA-N 429.561 4.016 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)CC4(O)CCOCC4)n3)c2C)cc1 1649393030 BAOGXIPUKQGGFF-UHFFFAOYSA-N 425.554 4.396 10 10 IICE Cn1c(-c2ccccc2)cnc1SCC(=O)NCCOc1cccc(C(F)(F)F)c1 1656126814 CDPVZFJYMGFORG-UHFFFAOYSA-N 435.471 4.393 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCSC[C@@H]3c3ccccc3)C2)cc1 1682188165 ILIWDYBTJAQZJM-WMZHIEFXSA-N 425.598 4.411 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)cc2)CC1 1684874702 SJTOLQVQKBJKKD-FQEVSTJZSA-N 446.517 4.156 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1 1685915779 UVDUIRSUORJFAM-NRFANRHFSA-N 446.954 4.272 10 10 IICE COc1ccc(CCc2nnc(N3CC=CCC3)n2CCCSc2nccs2)cc1 1697401946 IGAQNFCHXIKTRJ-UHFFFAOYSA-N 441.626 4.477 10 10 IICE C#CCN1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC=C(C)C)CC1 1705635437 YUVMHMCFOCZCHE-UHFFFAOYSA-N 442.611 4.464 10 10 IICE CC(C)[C@H]1OCCC[C@H]1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1706361957 MBGFZHFQDFRNEC-XUZZJYLKSA-N 435.572 4.057 10 10 IICE CCN(CC(C)C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1728338676 SOTMNKMQZHWJLN-UHFFFAOYSA-N 436.604 4.013 10 10 IICE Cc1ccccc1CN(C)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1742437541 JZDBKCKHPUTECX-GOSISDBHSA-N 429.615 4.366 10 10 IICE COc1ccc(O)c([C@@](C)(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c1 1951726730 CISHYOMVQTUPOY-RUZDIDTESA-N 433.460 4.239 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2060619998 UJSPYAYJXPYYHJ-DFQSSKMNSA-N 445.564 4.424 10 10 IICE COc1cccc(Cn2nc(C3(C)CC3)c(C(C)C)c2I)c1O 2079769594 WPIYHMVWFQAUFP-UHFFFAOYSA-N 426.298 4.425 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(NCc3ccc(Br)cc3O)CCC[C@@]2(F)C1 2126045737 GJMOXUNVQAAFTO-MOPGFXCFSA-N 429.330 4.126 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC=C[C@H]21 14473352 ZALBRIVEQAUVNA-ZJTDPSCFSA-N 427.888 4.451 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S)Nc1ccc(O)cc1 15039885 WUSSABWPYNPHBQ-UNOMPAQXSA-N 437.546 4.494 10 10 IICE O=C(NN1C(=O)/C(=C\c2cccnc2)SC1=S)c1ccc(OCc2ccccc2)cc1 33532392 KVBMTSZKODBZKZ-DEDYPNTBSA-N 447.541 4.207 10 10 IICE Cc1ccc(-c2nnc(CCC(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)o2)cc1 105038838 KVWRUFKDIOXOSD-HSZRJFAPSA-N 448.567 4.251 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(C(N)=O)c(-c4ccccc4)n3)c2C)cc1 116731492 SWWLUFYIVPXFMF-UHFFFAOYSA-N 442.519 4.338 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 226830176 AQVIQLTVKYNCGI-YVHKJVDXSA-N 427.526 4.452 10 10 IICE COc1cccc(N2CCC[C@H](NC(=O)N(C)Cc3ccc(N4CCCCC4)cc3)C2)c1 735383524 DFMMFRDEXORZMN-QFIPXVFZSA-N 436.600 4.496 10 10 IICE C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cc(Br)cc(F)c1O 756592386 HVKJBAYVQBGRKL-CQSZACIVSA-N 435.337 4.497 10 10 IICE CC(C)(c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1)C(F)(F)F 764795856 BPSNMXRYSQCXSU-GOSISDBHSA-N 447.501 4.158 10 10 IICE COc1ccc(C(=O)CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(Cl)c1 780496723 UBDQNKNVBPEYBE-SFHVURJKSA-N 431.916 4.225 10 10 IICE CCCc1c(NC(=O)N(C)Cc2ccccc2O)cnn1-c1cc(F)c(OC)cc1F 797682984 APBNNIXQEDVNKF-UHFFFAOYSA-N 430.455 4.481 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cc(Br)cnc2O)CCCC1 1125485837 UGJKXRHQPFQMIO-UHFFFAOYSA-N 430.302 4.031 10 10 IICE CSc1ncc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)n1-c1ccc(F)cc1 1129814457 GWEZPQMZKBPPPV-INIZCTEOSA-N 426.561 4.469 10 10 IICE CC(=O)c1c(C)cc(OC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1C 1133239914 UAOSENCJWXPJRW-UHFFFAOYSA-N 443.411 4.409 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccnn2C2CN(C(=O)OC(C)(C)C)C2)cc1 1134598962 MGCRSMFOHCUGPV-UHFFFAOYSA-N 435.528 4.335 10 10 IICE CC(C)n1ncc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1Br 1136480126 CNKYHFSABYPJLT-GOSISDBHSA-N 449.393 4.114 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(C)(C)C)cn2)NC(=O)OC(C)(C)C)cc1 1136903865 NSHVGIDIFDHAFT-OAQYLSRUSA-N 440.588 4.441 10 10 IICE COc1cccc(CCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1136904553 WEDXWTCSXBHALI-QFIPXVFZSA-N 441.572 4.076 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Br)cc1F 1150347153 GJNNNRNEHDBSSI-HNNXBMFYSA-N 441.728 4.342 10 10 IICE Cc1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c(O[C@H]2CCOC2)c1 1150689014 VGWJTFUVFAFOOB-DEOSSOPVSA-N 432.520 4.313 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)NCc1cccc(Br)c1O)O2 1156792483 NZRUIVYSOGNZTF-OAQYLSRUSA-N 434.330 4.186 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(NCc2ccsc2)cc1 1161179995 BXZMQHMVDMCSQX-UHFFFAOYSA-N 443.519 4.405 10 10 IICE COCCn1cc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cn1 1182483527 WMHIUSBCWXQPJK-FQEVSTJZSA-N 446.473 4.455 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCn3ccc(C(F)(F)F)n3)cc2Cl)C1 1227206833 ABNKTZINSUMXOM-CQSZACIVSA-N 443.901 4.291 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(c2cccc(F)c2)CCCCC1 1275224328 DCBPICZRTWJIOO-UHFFFAOYSA-N 432.486 4.459 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3OCc3csc(C)n3)C2)cc1 1276831692 BPUWHDUQSDNSAH-GOSISDBHSA-N 437.565 4.295 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cccs2)n1Cc1ccc(N2CCOCC2)cc1 1287365708 VAJVMEGBKSJALN-UHFFFAOYSA-N 425.602 4.059 10 10 IICE Cc1cc(C(=O)NCCS(=O)(=O)CCc2ccccc2)c(C)n1-c1cccc(Cl)c1 1296962125 ZXPRBTFABWFCPO-UHFFFAOYSA-N 444.984 4.135 10 10 IICE COC(=O)[C@H]1CCCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)C1 1299348687 OQEJKIWSJBJTDR-KRWDZBQOSA-N 449.646 4.039 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)CCOCCNC(=O)OC(C)(C)C)c1 1302236721 MLTRVRPCRVPMBP-UHFFFAOYSA-N 449.979 4.361 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1cn(C)ccc1=O 1306453506 ZWLPEVJYDBFAKN-LJQANCHMSA-N 429.442 4.311 10 10 IICE CCCN(CC1CC1)c1nnc([C@@H](C)CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1306810481 HXPOBTCXBXXSGH-SFHVURJKSA-N 429.584 4.442 10 10 IICE C[C@H](Cc1ccsc1)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1357156281 BZEGHRZQIBDZKT-VVBXCHJUSA-N 434.583 4.226 10 10 IICE Cc1ccc(Br)cc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1357836178 PHJAHFGXZFHOQY-IYBDPMFKSA-N 449.364 4.369 10 10 IICE C[C@@H](NC(=O)c1cc(Br)cnc1C1CC1)c1ccc(N2CCOCC2)cc1 1434913421 ZBAMRUHWVUPKHY-CQSZACIVSA-N 430.346 4.049 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CC[C@H](Cc2ccccc2)O1 1435331990 HWUAEBISDAGKGE-BWAGFHJFSA-N 430.495 4.163 10 10 IICE C[C@H](NC(=O)c1ccc(Cn2cc(N)c(C(F)(F)F)n2)cc1)c1ccc(N(C)C)cc1 1447971899 OPWWMGIVTKBXSX-AWEZNQCLSA-N 431.462 4.089 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C3(c4cccc(OC(F)(F)F)c4)CCC3)C2)cc1 1461496173 OSCBTZGVJNBJGM-KRWDZBQOSA-N 434.458 4.411 10 10 IICE CCOc1cc(C(=O)OC)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1462819284 VPOROPVEVPJFII-UHFFFAOYSA-N 449.551 4.232 10 10 IICE Cc1ccc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CC2)cc1-n1c(C)cc(C=O)c1C 1465343693 HYILDEMNEYRYDT-OAQYLSRUSA-N 439.556 4.248 10 10 IICE COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1468448084 QISQZJXSRSQJFL-SANMLTNESA-N 432.520 4.060 10 10 IICE Cc1cc(-n2cccn2)ccc1CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1472355163 ZKOXSHBLOHXSGL-UHFFFAOYSA-N 426.520 4.260 10 10 IICE CCN(c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1)C1CCCCC1 1501584486 VPFDZLOZWFECHL-UHFFFAOYSA-N 425.556 4.091 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1CCC1CC1 1517147009 JGGAXTPNDAUTSP-IBGZPJMESA-N 441.576 4.492 10 10 IICE Cc1cc(CC(=O)NC2CCC(CS(C)(=O)=O)CC2)c(C)n1-c1ccc(Cl)cc1 1526951566 VRCDMNLLYCQNER-UHFFFAOYSA-N 437.005 4.010 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@]2(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C2)cc1 1527393158 KRXAJASRZCWZPR-OAQYLSRUSA-N 443.510 4.339 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3cc(Cl)c4c(c3)OCCO4)ccc21 1528431446 QYANHHDYBZYNLC-UHFFFAOYSA-N 428.916 4.259 10 10 IICE COc1cccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1C 1529591458 DBOPVZNZQXWDPJ-XDHOZWIPSA-N 444.553 4.050 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cccc(C(C)(C)C)c3)CC2)c(OC)c1 1534277885 DXNOGVARRWFJQA-SFHVURJKSA-N 426.557 4.117 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@H]21 1536550935 VLFHOTJCNBPEBN-GZPVHCRCSA-N 427.386 4.457 10 10 IICE O=C(C[C@H](c1ccc(O)cc1)C1CC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1543114447 VRVNSZYJQYAJCC-NRFANRHFSA-N 448.485 4.448 10 10 IICE Cc1cc(CCNC(=O)c2cn3ccc(Br)cc3n2)c(C)n1-c1ccccc1 1543594053 NUWIFDSJYAZAIQ-UHFFFAOYSA-N 437.341 4.477 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc3scnc23)NC(=O)OC(C)(C)C)cc1 1544269114 PVQWCOBZMFWTIW-GOSISDBHSA-N 440.569 4.358 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Cc1ccccc1OC 1546009225 JAGKBPWQPFWVMT-JOCHJYFZSA-N 448.563 4.481 10 10 IICE COc1ccc(CNC(=O)c2ccc([C@@H]3CCCCN3C(=O)OC(C)(C)C)n2C)c(O)c1 1568097313 DYOOSQWKQQMZKA-IBGZPJMESA-N 443.544 4.131 10 10 IICE CCc1cc(N2CCC[C@@H](NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)C2)ncn1 1585441822 XMABFILEYZRDPI-HXUWFJFHSA-N 437.975 4.499 10 10 IICE CC(C)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1586060258 DQNPGASAWOBSSP-SFTDATJTSA-N 448.652 4.047 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CN3C(=O)COc4ccc(Cl)cc43)c2C)c1 1596472475 QCMQVTFEHDNRNP-UHFFFAOYSA-N 437.927 4.098 10 10 IICE Cc1cc(N2CCC(Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)CC2)nc(C)n1 1612047443 PTSTWKGGSFRFJD-UHFFFAOYSA-N 431.496 4.314 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)C[C@@H](C)C1 1614973714 SSGIOVTXUHVNSP-RTBURBONSA-N 448.615 4.361 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3CC3CCC3)cc2F)C[C@@H](C)O1 1620441090 DCZJMXJYEKPPSQ-KNKQGSTJSA-N 431.596 4.100 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2cc(Cl)ccc2OC)CCCC1 1627484219 XBNWSCBVYGBSJK-QFIPXVFZSA-N 442.943 4.041 10 10 IICE C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)NCc2ccc3cccnc3c2O)cc1 1630526013 ASPVZFJYUQEYKK-ROUUACIJSA-N 447.535 4.039 10 10 IICE C[C@@H](CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)c1cccc(F)c1 1631425751 NJHQNTIWNLZDSJ-MGPUTAFESA-N 432.923 4.174 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](c3ccc(Cl)c(F)c3)c3nn[nH]n3)c2C)c1 1632492844 WAYHBCDYLYKKKA-HXUWFJFHSA-N 438.894 4.228 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2ccc3cccnc3c2O)[C@H]1c1ccc(Cl)c(Cl)c1 1638573405 VVBWRMNTPIIMRY-FOIQADDNSA-N 444.318 4.083 10 10 IICE CCOC(=O)c1n[nH]c([C@H](CC(C)C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)n1 1639735498 CMCINGRLZGUCGP-FQEVSTJZSA-N 437.544 4.215 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCCC(=O)c3ccc(Br)cc3)C2)cc1 1641228485 VHRIVRGWYIONCU-GOSISDBHSA-N 445.357 4.206 10 10 IICE CCOC(=O)c1sc2nc(CN(C)C)nc(N[C@@H](C)c3ccc(N(C)C)cc3)c2c1C 1650986893 WJEGAVBLKQZZQM-HNNXBMFYSA-N 441.601 4.477 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3nc(C(C)C)nc4ccccc34)CC2)cc1 1651950227 KHZAGYVMUGDZBZ-UHFFFAOYSA-N 436.581 4.203 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3cc(Cl)ccc3Cl)CC2)cc1F 1653749549 RPCVNSMHBUQJMN-CYBMUJFWSA-N 426.319 4.290 10 10 IICE C[C@@H](NC(=O)NC[C@@]1(C(F)(F)F)CCCN1C(=O)OC(C)(C)C)c1ccccc1O 1684251710 LXMAOUAXVUFHIE-BFUOFWGJSA-N 431.455 4.084 10 10 IICE CC[C@@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ncc(-c2ccccc2)[nH]1 1685608758 GDBJIXFJKZMYLD-GGAORHGYSA-N 434.588 4.196 10 10 IICE CC[C@H](C)c1nnc(N2CCC(c3cnn(C)c3)CC2)n1Cc1ccc(N(C)C)cc1C 1694043582 OXPSWRFTKBNAJJ-SFHVURJKSA-N 435.620 4.332 10 10 IICE CC[C@H](C)NC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CC1 1694283207 NZPLYXWGRLIHER-KRWDZBQOSA-N 434.588 4.256 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710612468 YKKGTXOQFORLDQ-GOSISDBHSA-N 427.524 4.105 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCSC2(C)C)n1 1742683899 HEGSQPVKFYIZAA-IBGZPJMESA-N 440.617 4.013 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CCC[C@H](C(C)C)C2)cc1 1746090390 WYSDDKZUCKNRFZ-NRFANRHFSA-N 435.620 4.446 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1763794797 VVHHNZHWAVTBQN-LJQANCHMSA-N 431.600 4.373 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N(C)Cc2c(C)nn(C)c2C)cc1 1766613769 HRNRACZMTYWULX-UHFFFAOYSA-N 435.620 4.112 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N(C)C)c(F)c2)C12CCC2 1767670331 MUNRDGNLBOGGNH-LEWJYISDSA-N 429.584 4.439 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCN(C)C)C2=O)ccc1OCc1ccccc1 1858589243 LNAMAWXNOSQCAC-RCCKNPSSSA-N 442.606 4.427 10 10 IICE COC(=O)Cc1ccc(NC(=O)c2ccc3[nH]c(-c4ccc(N(C)C)cc4)nc3c2)cc1 1872742105 JJHUCDALSJXARZ-UHFFFAOYSA-N 428.492 4.264 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@@H](C)N(C(=O)OC(C)(C)C)C2)c1O 2227748498 AWLCMEHCNSAIOL-CHWSQXEVSA-N 429.355 4.041 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)cc1 2293323899 MVHAUBXZFQUXLM-UHFFFAOYSA-N 446.434 4.080 10 10 IICE CCOC(=O)c1ccc2c(c1)N(CC)C(=CC=C1SC(=S)N(CC)C1=O)N2CC 2293582636 YROPMQKTDXTVGR-UHFFFAOYSA-N 431.583 4.135 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccccc3C)C2=O)o1 2313553249 YAXXTESDJAMKMR-UHFFFAOYSA-N 445.431 4.392 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C)cc3)C2=O)ccc1O[C@H](C)C(=O)O 2314931708 HSKLVJUFVOBLNL-CYBMUJFWSA-N 429.519 4.261 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(O)c1Br 2381146464 LSXFHZNKHBMUOB-ZIAGYGMSSA-N 441.366 4.115 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)ccc1OCCC(=O)O 16911921 ZCVOWPSRVYYTAD-GZTJUZNOSA-N 433.482 4.094 10 10 IICE COc1ccc(Cl)cc1-n1cccc1/C=C1/C(=N)N2C(SC)=NSC2=NC1=O 20211048 CIJMYVNVRWKFLQ-HBDSZSESSA-N 431.930 4.079 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@@H]3C=CC[C@H]32)cc1O 20690278 BYWVLKLBRPAYHT-IECBHUPTSA-N 440.565 4.402 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)sc2c1CCCC2 21450584 YEOGPGFQILAQEY-INIZCTEOSA-N 440.565 4.412 10 10 IICE C[C@@H](Sc1nc2ccccc2[nH]1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 21458049 KXFITARTKJPDAK-CYBMUJFWSA-N 427.485 4.458 10 10 IICE O=C(CNc1ccc(Br)cc1C(=O)c1ccccc1)Nc1cccc(O)c1 35549351 AUNJZCJZVYRSQP-UHFFFAOYSA-N 425.282 4.436 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)c3ccccc3Cl)CC2)c(C)n1-c1ccccc1 62694206 IBCODUXHYNNJPO-UHFFFAOYSA-N 435.955 4.388 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)c2cnn(Cc3ccccc3Cl)c2)cc1 96990801 CQRSOHXCGMIWDW-UHFFFAOYSA-N 434.931 4.148 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(OC(F)(F)F)cc2)cc1 110148224 GUIHISRHMJSWIM-OAQYLSRUSA-N 436.474 4.402 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3)ccc(N)c2C1 705919593 YJJIVCRHQDRFNG-OYRHEFFESA-N 448.611 4.130 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1 743675479 UWEIGORTNCGULY-NRFANRHFSA-N 426.561 4.126 10 10 IICE C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1cc(Br)c(F)cc1O 756760949 KULQZSMYSRHRNT-PSLIRLAXSA-N 433.115 4.441 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Nc1cc(C)nn1C1CCOCC1 771516544 QLWIDWNEPWISJJ-UHFFFAOYSA-N 437.338 4.065 10 10 IICE Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)NCc1cc(Br)ccc1O 806246447 VMKUDOJEHUEINE-UHFFFAOYSA-N 434.334 4.171 10 10 IICE CCOc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1125277034 IZBVDKNJJKKBFU-PDGQHHTCSA-N 430.526 4.454 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(OC(F)(F)Cl)cc3)cc2F)CC1 1125907041 FCEWWHOORJAJHY-UHFFFAOYSA-N 441.881 4.066 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccccc3CCC(C)C)CC2)cc1 1136447841 KUFTYHNAVWUUSA-CCEZHUSRSA-N 435.568 4.127 10 10 IICE CCOC(=O)CN(CCCc1ccc(Br)cc1OC)Cc1ccccc1O 1171390467 NGSCMYDHDROBDB-UHFFFAOYSA-N 436.346 4.161 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CC[C@H](C)N(C(=O)OC(C)(C)C)C2)cc1 1234098042 XNPVCGWHVNRYNL-ICSRJNTNSA-N 432.609 4.462 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(I)c(F)c2)cc1 1264670363 ZVPZCABFABEAKE-UHFFFAOYSA-N 426.273 4.207 10 10 IICE CC(=O)N1CCCN(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c2ccccc21 1265481143 WQDWFPYZGFLQEI-UHFFFAOYSA-N 449.551 4.383 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3csc(-c4ccc(Cl)cc4)n3)C2)cc1 1278862195 ZYBDMLFKNIOCEE-QGZVFWFLSA-N 427.957 4.410 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCN3CCN(c4ccc(F)cc4)CC3)c2C)c1 1290791964 VESJPJWRPPNZSN-UHFFFAOYSA-N 448.586 4.402 10 10 IICE O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)NCc1ccc2cccnc2c1O 1299721963 XLEIZMVVEOUPNH-UHFFFAOYSA-N 426.885 4.052 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CCCN(C)C1CCCCC1 1314753191 MCLYOIKJZJYOLK-JOCHJYFZSA-N 427.593 4.126 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 1354768311 VKQBWCSTCRFYEX-YSGRDPCXSA-N 431.439 4.085 10 10 IICE C[C@H]1CCCN(c2cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)ccn2)C1 1355130902 PWKNMYJJBGHXGC-GBESFXJTSA-N 440.563 4.001 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC3(N4CCSCC4)CCCCC3)ccc21 1360354739 BUSYBJRKOYCLDE-UHFFFAOYSA-N 443.657 4.386 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@@H]1C[C@H]1CN(C(=O)/C=C\c2cccnc2)c2ccccc21 1439584665 KOLUYKQKHKAXOT-LDFOOHBJSA-N 449.551 4.251 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1nn(-c2cc(Cl)ccc2[N+](=O)[O-])cc1O 1448437953 NWRXLVXAWNHGAE-UHFFFAOYSA-N 444.875 4.288 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@H](C)c3ccc4ccccc4c3)CC2)cc1F 1459745907 BJDOGXCSWGNXLD-RTBURBONSA-N 435.543 4.375 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCCOc3cccc(Br)c3)C2)cc1 1461497027 SFCIUMAIGUURCI-QGZVFWFLSA-N 433.346 4.012 10 10 IICE C[C@@H](CCc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1463622100 VGWMCAHEOQKNEV-HNNXBMFYSA-N 430.551 4.006 10 10 IICE CCc1ccc([C@H]2CN(C(=O)OC(C)(C)C)CCN2C(=O)c2cccc(O)c2O)cc1 1467452648 PIIPHFNTHBTJOP-LJQANCHMSA-N 426.513 4.094 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1CC(c2ccccc2)C1 1467479965 BNEJOHZILCEKLU-NDENLUEZSA-N 440.565 4.479 10 10 IICE CCOC(=O)[C@@H](C[C@H]1CCCO1)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1471779848 AGSSVVASAWFBDB-FYYLOGMGSA-N 426.557 4.448 10 10 IICE CN(C)c1ccc(CN2Cc3ccccc3C[C@H]2C(=O)NCCc2ccc(F)cc2)cc1 1473107122 AOEFXQFWLFBIGT-SANMLTNESA-N 431.555 4.178 10 10 IICE Cc1cccc(-c2nnc(N(C)CCc3nccs3)n2Cc2ccc(N(C)C)cc2C)n1 1492503175 XMAMJYPMFMIDMK-UHFFFAOYSA-N 447.612 4.207 10 10 IICE C[C@@H]1CCCN(CCCCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1493794693 XJFBOKJTFIHQLS-OFNKIYASSA-N 441.620 4.374 10 10 IICE CCN(CC)C[C@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1501934870 NDYQJYJKYNZEHM-OAQYLSRUSA-N 426.653 4.067 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(C)OC[C@@H]1C 1503928231 DBDQEAQIRWCRAK-RBUKOAKNSA-N 437.588 4.391 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CC3(SC)CC3)CC2)cc1 1504291921 CUWZYCMAWJKDJT-UHFFFAOYSA-N 443.661 4.488 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C(C)=C\c3ccccc3Cl)CC2)cc1 1524981864 CUQKKXLCLHZJLV-HNENSFHCSA-N 427.976 4.080 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ncccc4C)cc3)cc2F)CC1 1528701496 KHVRFNHRIICKTQ-UHFFFAOYSA-N 448.542 4.393 10 10 IICE CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1534242774 WVWNKSRDDZWPBZ-IXNCKXOBSA-N 425.598 4.011 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cc2ccc(Br)cc2c(=O)o1 1540729264 PQFPUOCTHQVASV-UHFFFAOYSA-N 427.298 4.086 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCOCC2)c(F)c1 1545349434 APFYPDBHXTYAEM-OAHLLOKOSA-N 443.489 4.204 10 10 IICE COc1ccc(N2CCN(c3nnc([C@@H]4CCCCO4)n3CCC=C(C)C)CC2)cc1F 1554960938 SKGSXEUGRMFSJK-QFIPXVFZSA-N 443.567 4.350 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C/[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1557063793 ZOOQJGFZENGGKL-UHNXPTMUSA-N 429.605 4.312 10 10 IICE Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc[nH]n2)c(C)n1-c1ccccc1 1557888220 TYGLZLHKOABSBT-UHFFFAOYSA-N 448.508 4.202 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1 1566185426 HAKUOQINQBJCSK-VWLOTQADSA-N 443.547 4.331 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1587552586 VQZVSZYPUAOSPB-YLJYHZDGSA-N 431.577 4.006 10 10 IICE Nc1c(Br)cc(C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1[N+](=O)[O-] 1588145831 OQMQKBYHRRQBDN-UHFFFAOYSA-N 446.257 4.081 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)cc1 1597238859 JPFQXBAGJSIUKJ-UHFFFAOYSA-N 439.556 4.013 10 10 IICE CCOC(=O)N[C@@H](CC(C)C)Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C 1616010773 GYQVTAYNEVNVRH-SFHVURJKSA-N 431.581 4.078 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3CC3CCC3)cc2F)C[C@@H](C)O1 1620441092 DCZJMXJYEKPPSQ-XQBPLPMBSA-N 431.596 4.100 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1Nc1ccc(C)cc1 1624658759 KOERZOKMKQWVRW-NRFANRHFSA-N 434.492 4.054 10 10 IICE CCN1CCN(c2cccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)c2)CC1 1625671553 RJEORHHLLCYQLI-UHFFFAOYSA-N 444.579 4.230 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCS(=O)(=O)c3ccc(Cl)cc3)c2C)c1 1626761451 IHOJJALPEWLNCV-UHFFFAOYSA-N 430.957 4.260 10 10 IICE CCC[C@H](Cc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1627955619 PMKMFQNCIMLNBF-QGZVFWFLSA-N 444.578 4.396 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nnn(-c3ccc(OC(C)C)cc3)c2C)cc1F 1628769785 JYXNNQXQEZAZRR-UHFFFAOYSA-N 439.535 4.278 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H]1CSCCN1Cc1ccccc1 1633975590 ISGXGEOMNAESKZ-QHCPKHFHSA-N 447.604 4.254 10 10 IICE Cc1ccc(C(=O)NCc2cccc(OCC(F)(F)F)n2)cc1-n1c(C)cc(C=O)c1C 1634787132 XGHXKVDJZKKKIN-UHFFFAOYSA-N 445.441 4.481 10 10 IICE Cc1cc(C(=O)N2CC[C@H](n3cc(Cl)cn3)C2)c(C)n1-c1ccc(Br)cn1 1637178085 POAJKGUNMYESCM-INIZCTEOSA-N 448.752 4.189 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(NCCc4ccccn4)cc3)C2)cc1 1638649394 HRUARCBBYMAXSX-HXUWFJFHSA-N 430.552 4.001 10 10 IICE Cc1cccc(CC2(O)CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)c1 1639903386 KVEPXFIMUCAYSH-UHFFFAOYSA-N 444.575 4.354 10 10 IICE CC[C@@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)n1nnc(-c2ccc(Cl)cc2)n1 1641997474 PQROSAQYSZKQJE-HNNXBMFYSA-N 440.718 4.273 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC3(CCN(Cc4ccccc4)CC3)C2)c([N+](=O)[O-])c1 1642730846 ALASUGXNGDWVSK-CSKARUKUSA-N 435.524 4.274 10 10 IICE C[C@H](Cc1c(F)cccc1F)NC(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1644823971 ZQTGKWOGRCWTNR-CYBMUJFWSA-N 428.401 4.363 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)c1ccc(C(=O)OC)cc1 1651683008 LLLDWTFGAYNEJP-UHFFFAOYSA-N 438.505 4.103 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)O[C@@H](CC)C2)sc(C)c1-c1ccccc1 1653392638 ZLVDXOBEANSHPO-YJBOKZPZSA-N 430.570 4.338 10 10 IICE Cc1cc(Br)c(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)s1 1674529711 HVLIKFITYUHAIG-OAHLLOKOSA-N 439.375 4.415 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)Cc3cnn(-c4ccccc4)n3)c2C)c1 1684478738 HFZYBOOKNPVXMA-UHFFFAOYSA-N 428.540 4.325 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@H](C)CCc2ccc(I)cc2)c1 1686343711 YBUWTPIFHCDOLN-CQSZACIVSA-N 438.309 4.126 10 10 IICE CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1687807500 TXGNDYOLAJUIAH-FQEVSTJZSA-N 438.494 4.096 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(C(C)C)n2Cc2ccc3c(c2)CCCN3C)C1(C)C 1696191333 PSPPSCRHKJPAOF-FCHUYYIVSA-N 425.621 4.472 10 10 IICE CN(Cc1ccccc1O)c1nnc(CNC(=O)c2cccs2)n1CC1=CCCCC1 1696700504 FTRBYJKCMQKYIF-UHFFFAOYSA-N 437.569 4.112 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC[C@@H](O)C1 1726984364 HUNVUVWCVXFHSY-JAXLGGSGSA-N 441.620 4.068 10 10 IICE CC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)C)C1 1727725014 UEFWRCIWFBSIRC-FQEVSTJZSA-N 434.588 4.067 10 10 IICE CCOCc1nnc(N2CC[C@]3(CCSC3)C2)n1Cc1ccc(N(CC)CC)cc1 1729033709 VHFVJZMVEADPQS-QHCPKHFHSA-N 429.634 4.043 10 10 IICE CC(C)c1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1741346918 YOIDYIQWWHYEEL-LJQANCHMSA-N 429.584 4.298 10 10 IICE C[C@H](Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)N(C)C1CC1 1741866224 CAURXMGPXYCKEL-NQSCKRDGSA-N 441.620 4.021 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CCO[C@@H](C)C3)CC2)cc1 1748847128 HFQYBIYTMROXDR-PMACEKPBSA-N 441.620 4.116 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1750233685 ZKRQLXSOCAGMNZ-LBPRGKRZSA-N 436.379 4.129 10 10 IICE CCC1(Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CCOCC1 1764398773 DJHAQZQGTYTJOW-UHFFFAOYSA-N 445.583 4.083 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2ccccn2)n1CCCOC(F)F 1768651658 ULADPEGNYXQNOQ-UHFFFAOYSA-N 442.514 4.206 10 10 IICE CCN(CC)c1ccc(/C=C2/SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)cc1 1858594054 JMCXFZSDAPCEIW-AZGFIHASSA-N 440.590 4.430 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4)c(C)s2)cc1 1859570289 AJZFTBPXQUXIDH-UHFFFAOYSA-N 427.551 4.457 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](N)CC)sc(C)c1-c1ccc(Br)cc1 1865951268 LMEISYROGNDOOQ-CYBMUJFWSA-N 425.348 4.339 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)C2(CO)CCC2)cc1Br 1915780992 UKCQMEDSYOYQND-UHFFFAOYSA-N 433.390 4.107 10 10 IICE CN(Cc1ccccc1)[C@]1(CNCc2cc(Cl)cc(Br)c2O)CCOC1 2098953992 LBJLNEZORZGOKJ-FQEVSTJZSA-N 439.781 4.189 10 10 IICE CCCN(CCC)c1nc2ccccn2c(=O)c1C=C1SC(=S)N(CC(C)C)C1=O 2296546133 OWLHJLWXVOEZNE-UHFFFAOYSA-N 444.626 4.178 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C(C)=O)cc3)C2=O)cc(OC)c1OC 2297478190 HDFRDLUWJWIGSH-UHFFFAOYSA-N 429.519 4.321 10 10 IICE COC(=O)C1=C(C)N(CCc2ccc(OC)c(OC)c2)C(=O)C1=Cc1ccc(Cl)cc1 2313510740 KUOHDLYNYCRHRD-UHFFFAOYSA-N 441.911 4.273 10 10 IICE CC(=O)N[C@H](CC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1ccccc1 9249685 LERXZDHJJYTISX-HSZRJFAPSA-N 436.483 4.227 10 10 IICE COC(=O)c1ccccc1-c1ccc(/C=C2\C(=O)N(CCc3ccccc3)C(=O)N=C2O)o1 33417020 TYCZLRZVVOOARE-HKWRFOASSA-N 444.443 4.278 10 10 IICE CCn1nccc1-c1csc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)c1 65112470 SDNQWCQDLYCRAS-UHFFFAOYSA-N 430.599 4.100 10 10 IICE COc1ccc(CN2C(=O)/C(=C\c3ccc(OCC(=O)O)c(Cl)c3)SC2=S)cc1 209888373 MLIOTTCODCWAGJ-RQZCQDPDSA-N 449.937 4.213 10 10 IICE Cc1cc(C(=O)NCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 731020112 KDUQBRKYGAICBE-IBGZPJMESA-N 426.561 4.256 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)[C@@H]2C1 754877981 JVIJNIHHDBFZET-NRSPTQNISA-N 447.373 4.265 10 10 IICE CC(C)C(=O)N1CCC(N[C@H](C)c2cc(Br)cc(Br)c2O)CC1 756396520 OHSYCEKONRQAIO-LLVKDONJSA-N 448.199 4.215 10 10 IICE O=C1/C(=C/c2cncc3ccccc23)SC(=S)N1CCc1ccc2c(c1)OCCO2 772802758 UIGSLGGYEUBSED-MTJSOVHGSA-N 434.542 4.450 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccccc3C(=O)OC(C)(C)C)CC2)cc1 775357818 OOCJJZFVOLYXIO-UHFFFAOYSA-N 425.529 4.395 10 10 IICE OCC1CCN(c2ccc(CNc3ccc(-c4nnc(Br)o4)cc3)cc2)CC1 784571885 OJSZVDPMYYJLTB-UHFFFAOYSA-N 443.345 4.320 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1cc(Br)ccc1O)c1ccsc1 804737431 QWMXFNJSTYNLKL-UHFFFAOYSA-N 431.311 4.399 10 10 IICE CC[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)cc(Cl)c1O 806142826 GEKOUZQZKZIROM-WAOWUJCRSA-N 448.394 4.339 10 10 IICE Cc1cc(C(=O)O[C@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)nn1C 919587560 SUYITLMNJLOLJX-OAHLLOKOSA-N 431.439 4.166 10 10 IICE Cc1cccnc1CCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1128967989 FIOCOPUJMFAXPV-JXAWBTAJSA-N 445.635 4.182 10 10 IICE C[C@@H]1Cc2cccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)c2O1 1136903950 PFXYJNYWRASGEK-IIBYNOLFSA-N 439.556 4.072 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1155040869 OSFOFUVWHVANCV-OAQYLSRUSA-N 434.378 4.313 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 1155133668 BNUYVSJYVRCKCC-QHCPKHFHSA-N 425.916 4.351 10 10 IICE O=C1[C@H](N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)CCN1CC(F)(F)F 1167680607 IBIFAKKDJHLMBP-ZLHKHBAESA-N 432.442 4.141 10 10 IICE Cc1cc(C(=O)NCc2ccc(CCO)cc2)c(C)n1-c1ccc(Br)cc1 1180193123 FQLOZQZBHUHMQL-UHFFFAOYSA-N 427.342 4.321 10 10 IICE COC1CCN(c2ccc(NC(=O)c3c(F)ccc(O)c3O)cc2C(F)(F)F)CC1 1182568597 KNJALKJNNHJPHT-UHFFFAOYSA-N 428.382 4.123 10 10 IICE COC(=O)c1cc(OCC(=O)N(CCc2ccccc2)Cc2ccccc2)ccc1N(C)C 1189967615 CRLYVHCQDLJURT-UHFFFAOYSA-N 446.547 4.190 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3cc(C(F)(F)F)ccc3C2)N(C)C)cc1 1251500040 BMQBVSXCIOYQHZ-OAQYLSRUSA-N 434.506 4.142 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCOc2cccc(Br)c2C1 1251988494 JYGDREMRHPIPRD-INIZCTEOSA-N 446.389 4.359 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CC(=O)c3ccccc3O2)cc1 1254306947 CQCPOKBNCBNJSQ-OAQYLSRUSA-N 433.508 4.091 10 10 IICE CC[C@H](C)CN(CC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1305611481 WBTVWCUKMGYXSJ-NZQKXSOJSA-N 441.620 4.277 10 10 IICE CCCN(Cc1ccccc1O)C[C@H](O)COc1ccc(Cl)cc1Br 1307500508 FBPQNKROUYIDHQ-INIZCTEOSA-N 428.754 4.460 10 10 IICE CC(C)OC(=O)c1c(NC(=O)C[C@H]2C(=O)Nc3c(F)cccc32)sc2c1CCCC2 1350440058 MNMPGNQWDJOSIT-CQSZACIVSA-N 430.501 4.396 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N(C)CC1CCOCC1 1361098300 QISZZCDXZLWVBC-UHFFFAOYSA-N 425.621 4.296 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)cc1 1437384429 NCMGVAKMWCDASE-UHFFFAOYSA-N 432.446 4.108 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CSc2ccc(Br)cc2)N(C)C)cc1 1439958666 KOACPLNNKFZJFT-IBGZPJMESA-N 436.419 4.026 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)c1 1441694764 WDTJQDZTIAOXGR-FQEVSTJZSA-N 448.903 4.076 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@H]21 1446660207 SNEQBICBCIULJQ-NWANDNLSSA-N 432.542 4.078 10 10 IICE Cc1cc(C)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1O 1447380017 OFACZNIKDUZNJG-VCHYOVAHSA-N 430.526 4.378 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(Br)cn2)CCCC1 1462257398 ORVHYAZBEGRAQI-UHFFFAOYSA-N 428.330 4.003 10 10 IICE CCOC(=O)CC1(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CCCCC1 1466550314 OXPUHQGVBPQXMM-UHFFFAOYSA-N 438.568 4.469 10 10 IICE O=C(CCNC(=O)Nc1ccc(Br)cc1)NCc1c(O)ccc2ccccc12 1472086417 YHBLLBJQGPIRFI-UHFFFAOYSA-N 442.313 4.136 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC(=O)N(C(C)(C)C)C3)cc2Cl)C1 1478528492 OYYYRBMIYUPLSI-AEFFLSMTSA-N 435.012 4.023 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCOCCOC 1499518435 GBOKCINKUGEZMZ-NRFANRHFSA-N 437.588 4.394 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CC(N)=O)CC1 1499799358 IVMXKLGSEROWDW-WEVVVXLNSA-N 446.599 4.411 10 10 IICE CC(C)(C)Cc1nnc(N2CCCCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1508582900 JCKWNKHJHNYZSZ-UHFFFAOYSA-N 429.584 4.271 10 10 IICE CC(C)CN(CC(F)(F)F)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1515065237 BFUOLHAONVWXMU-OQLLNIDSSA-N 448.507 4.464 10 10 IICE COCCOc1cccc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1531994973 RCKLOMHRZHOUNI-UHFFFAOYSA-N 436.552 4.176 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)sc2c1CCCCC2 1533784650 UUCBAGOHJQEVHW-ZDUSSCGKSA-N 446.956 4.449 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)CCc1cccs1 1542226725 HLJPKTPVWRRFCR-UHFFFAOYSA-N 446.624 4.427 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1oc(C2CC2)nc1C(F)F 1545632767 VMDXXYPQEYBROF-AWEZNQCLSA-N 425.863 4.243 10 10 IICE CCCc1c(C(=O)NCc2ccc(N(C)C)cc2C)cnn1-c1cc(F)c(OC)cc1F 1565701622 IXKBXLIUNPRRNY-UHFFFAOYSA-N 442.510 4.416 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CCOCC1 1584368011 WVRCUMJFZQVELO-LJQANCHMSA-N 435.362 4.028 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)COC[C@H]1CCCO1 1610121333 CDYNOSJPWILAME-UYAOXDASSA-N 436.474 4.494 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CC=C(C)CC2)cc1 1615382306 SRXZQRXGGLABMP-UHFFFAOYSA-N 433.604 4.191 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)[C@@H]3CN(Cc4ccccc4)CCO3)c2C)cc1 1618337393 ZBVJZATZJCZZQB-FNZWTVRRSA-N 447.579 4.122 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cccc(OCC(F)(F)F)n2)c1 1623414177 PYEUSFZZLWIRJF-UHFFFAOYSA-N 431.414 4.173 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)cc1 1628635040 SMJQDNAQHFOEES-HXUWFJFHSA-N 445.563 4.481 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NC(=O)CC(C)C)c1ccccc1 1629968238 BZNNLGSODIGBJE-NRFANRHFSA-N 447.373 4.407 10 10 IICE COc1ccc(N2CCCN(C(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)CC2)cc1 1630713526 OKXFUFWJURAXGI-FQEVSTJZSA-N 433.593 4.063 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2COc2cccc(C=O)c2)N(C)C)cc1 1640231980 GBXOUKHFPBJJSH-AREMUKBSSA-N 445.563 4.177 10 10 IICE C[C@@H](NC(=O)CCNC(=O)OCC1c2ccccc2-c2ccccc21)c1ccccc1O 1642827168 ALLSEAQYACGTNP-QGZVFWFLSA-N 430.504 4.498 10 10 IICE COC(=O)[C@H](Cc1cncs1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1651392419 WVJPIXDVZSTJBS-NRFANRHFSA-N 425.554 4.188 10 10 IICE COc1cc(N2CCN(C[C@H]3CCC[C@H](c4ccccc4)O3)CC2)cc(OC)c1OC 1653225676 CYISIEWCQFNCAT-FGZHOGPDSA-N 426.557 4.145 10 10 IICE O=C(Nc1ccc(=O)n(Cc2ccc(Cl)cc2)c1)c1cc2cc(O)c(O)cc2s1 1653355136 QPHMKMZAEIDOEK-UHFFFAOYSA-N 426.881 4.428 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@H](C)Oc3ccc(C(C)C)cc3)CC2)cc1F 1672567659 WUWWDFGWRQGSQY-SFHVURJKSA-N 429.536 4.257 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCC(C)(C)c3ccc4ccccc4c3)cc2)CC1 1674962669 KZLBPGPVIICLGP-UHFFFAOYSA-N 430.596 4.369 10 10 IICE CCC1CCC(N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C2CC2)CC1 1676125228 BHAOBSXDBNYZHD-UHFFFAOYSA-N 426.605 4.031 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 1676765257 BWYDLNAMCWIROA-IBGZPJMESA-N 432.609 4.321 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCC1(Cc2ccccc2)CCCC1 1679575285 KEGAOWSESZAXBH-UHFFFAOYSA-N 435.612 4.498 10 10 IICE CCCCNC(=O)OC[C@H]1CCCCN1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1682101217 MYQKTULANLQKOM-DENIHFKCSA-N 432.609 4.082 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CCCc2ccc(Cl)cc21 1683018488 SQMKQWXHJGDPQX-FQEVSTJZSA-N 435.902 4.332 10 10 IICE C[C@H](NC(=O)NC[C@](O)(c1ccc(Cl)cc1)C(F)(F)F)c1ccc(N(C)C)cc1 1686174084 WSKOTEHTRABRQO-DJJJIMSYSA-N 429.870 4.216 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1708062227 WWRRHXBSPLBTNP-HXUWFJFHSA-N 448.615 4.116 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCO[C@H](C)C1 1708508437 GWGFASMKXLGIKS-PWRODBHTSA-N 441.620 4.332 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cc(C)cn1 1710807535 CSCCZAXQSWNDDV-UHFFFAOYSA-N 447.587 4.030 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCOC[C@@H]1C 1741433381 HZSXQIVABVUVNY-UNMCSNQZSA-N 425.621 4.386 10 10 IICE CO[C@H]1CCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1749157393 BZUZXBAHNVKBOL-HKUYNNGSSA-N 427.936 4.151 10 10 IICE COCCC1(Cn2c(-c3cnn(C)c3)nnc2N(C)Cc2ccccc2O)CCCCC1 1749623650 CPWFUNUYMHUDAN-UHFFFAOYSA-N 438.576 4.008 10 10 IICE Cc1ccc(-c2nnc(N3C[C@H](C)OC(C)(C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1751481811 OJPVUIOAMXIFTH-INIZCTEOSA-N 427.524 4.104 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1751952324 JODNYEJKTRVBPI-UHFFFAOYSA-N 440.617 4.244 10 10 IICE COc1ccc(C2=NN(c3ccc(C)cc3)C(=O)/C2=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 1865678088 SMYPPUVIMXYTHZ-DEDYPNTBSA-N 429.432 4.452 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(COc4cccc([N+](=O)[O-])c4)cc3)CC2)cc1 1872872710 DDXBGHFYOKDMBM-UHFFFAOYSA-N 447.491 4.145 10 10 IICE O=C(COc1c(F)c(F)c(F)c(F)c1F)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1890877352 VYPHZSJJCTXALO-JSGCOSHPSA-N 426.385 4.066 10 10 IICE COc1ccc(C[C@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc2)cc1 1891855641 JFGOOUSMSXKDBQ-SANMLTNESA-N 430.548 4.379 10 10 IICE COc1cccc(O)c1[C@@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)C[C@H]1C(=O)O 1952756751 HWUMWSNYKZVHEI-RXFWQSSRSA-N 445.471 4.239 10 10 IICE O=C1NC(=S)N(c2ccc(F)cc2)C(=O)C1=Cc1cccn1-c1ccc(Cl)cc1 2293618299 AITYLPUKXUFSDL-UHFFFAOYSA-N 425.872 4.101 10 10 IICE O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1cn(Cc2ccccc2F)c2ccccc12 2296398003 MHJQONPUSBSNCY-UHFFFAOYSA-N 439.446 4.495 10 10 IICE Cc1ccccc1N1C(=O)C(=C2C(=O)Nc3ccc(Br)cc32)SC1=S 2297315396 GIHJRKGIEDHBNS-UHFFFAOYSA-N 431.336 4.486 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314770050 YMPSJKORVOYIMP-QGZVFWFLSA-N 428.491 4.100 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(c3ccc(C(=O)O)cc3)C2=O)c1)C(=O)O 2314928440 VRBRTTPDTYDOGH-MRXNPFEDSA-N 443.502 4.033 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381126210 OZLIMUURGKRCDK-VLIAUNLRSA-N 441.366 4.163 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4c(c3)NC(=O)c3ccccc3S4)CC2)cc1 9971967 JWYRGNDGCMYIFN-UHFFFAOYSA-N 445.544 4.375 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3CC)C2)sc2c1CCCC2 20371996 FACKFCBGBZTQFQ-MRXNPFEDSA-N 440.565 4.358 10 10 IICE Cc1ccc(C)c(NC(=O)COc2ccc(Cl)cc2/C=C2\SC(=S)NC2=O)c1 39794048 KJXSLQGKPKCYEB-MFOYZWKCSA-N 432.954 4.463 10 10 IICE CCOc1ccc(N2C(=O)[C@@H]3ON(c4ccccc4)[C@H](c4ccccc4O)[C@@]3(C)C2=O)cc1 245311321 NKXRAMBQNGIYDP-MVERNJQCSA-N 444.487 4.232 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)c(C)n1-c1ccc(F)cc1 741776907 BRNMTNITGYAHRZ-UHFFFAOYSA-N 449.526 4.472 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccn(-c3c(F)cccc3F)n2)cc1 749364148 RJWHOJXQNVXEMI-LJQANCHMSA-N 440.494 4.038 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1 752463816 IXSPNNKYRIGXOF-ZCXUNETKSA-N 449.576 4.437 10 10 IICE Cc1cc(-c2csc(NS(=O)(=O)c3ccccc3Cn3ccnc3)n2)ccc1F 759487756 UHXBOIXEDBVYBT-UHFFFAOYSA-N 428.514 4.303 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCc1ncc(C2CC2)o1 760484910 GZTSMYMPNIRXIW-OQLLNIDSSA-N 434.564 4.338 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CCCC(F)(F)C1 769338384 QZTPPCARACPWEJ-XTCQQWIJSA-N 430.567 4.424 10 10 IICE COc1ccc(OCc2ccccn2)c(CNCc2cc(Br)ccc2O)c1 809713766 ZEENSAVSVPCWOM-UHFFFAOYSA-N 429.314 4.427 10 10 IICE CCOc1ccc(C(=O)N(C)C)cc1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1126681658 NVZWAMFXXCNWHC-UHFFFAOYSA-N 449.551 4.268 10 10 IICE COc1cc(Cl)c(Cl)cc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127266786 AYOHZYXMJJRMLU-UHFFFAOYSA-N 448.394 4.464 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)c(C)n1-c1ccccc1 1129962061 NGWRTRRYTICPMB-NZQKXSOJSA-N 437.584 4.495 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2ccccc21 1130678801 PAKBPEDCHVJMSI-ZJYZBMPFSA-N 426.538 4.221 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CN(Cc3ccccc3)C[C@@]23CCOC3)cc1 1135946260 LOVWJVYBRWZBLD-XNMGPUDCSA-N 435.612 4.030 10 10 IICE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccc(NC(=O)c2ccncc2)cc1 1146962419 HEAMBQIUIWXTJG-ZDUSSCGKSA-N 433.489 4.451 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCc2cccc(CN3C(=O)CSC3=O)c2)cc1 1151361551 ATJIGIJLAVNORT-UHFFFAOYSA-N 433.533 4.220 10 10 IICE Cc1cccc([C@H]2CCCCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1 1167458442 TVRNVABFIYIMKN-XMMPIXPASA-N 439.575 4.204 10 10 IICE CC(=O)N1CCN(c2ccc(Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)cc2)CC1 1187405121 MPGLFWSYJZYPIF-UHFFFAOYSA-N 444.491 4.238 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H](Cc1ccccc1)c1ccccn1 1256099955 XRZCRGVNKWGBKN-SANMLTNESA-N 444.579 4.074 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)nc4ccccc34)cc2F)CC1 1265012302 WPXRRDUIBMFIDC-UHFFFAOYSA-N 426.923 4.099 10 10 IICE Cc1cnn(CC2CC2)c1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1292531487 DNGJUUOPYHZSGF-UHFFFAOYSA-N 428.334 4.419 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC 1295721071 GHUOLPBHZXYEBL-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CC(C)OCC(C)(C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1299293877 CWGNVZUUWPVVNN-RVDMUPIBSA-N 426.629 4.049 10 10 IICE COC[C@@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1301324756 QJAFBZDGNKDYKN-JOCHJYFZSA-N 425.621 4.234 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CCCC(C)(C)C)CCOC1 1303480247 BBTIQOLGBGCEKJ-DEOSSOPVSA-N 430.593 4.487 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCN(c3ccccn3)CC2)cc1 1313678394 CVZDVAIYHPXRHZ-UHFFFAOYSA-N 447.631 4.093 10 10 IICE CC(=O)c1ccc(S(=O)(=O)NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)cc1 1317922210 MVHWQMMRSRTPFZ-UHFFFAOYSA-N 430.913 4.069 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1 1349120601 XZUYKKAQIMUBGN-UHFFFAOYSA-N 429.446 4.159 10 10 IICE CCOC(=O)[C@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 1361046805 MNDWJESNFAHBAJ-DOMQTXCISA-N 443.547 4.469 10 10 IICE CCCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1cccc(C)c1 1436968429 BGPGJEFBBVYZGF-HXUWFJFHSA-N 432.568 4.398 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nccn4c(Br)cnc34)c2C)c1 1438314950 TWFSNPKRMWDTGA-UHFFFAOYSA-N 438.329 4.138 10 10 IICE C[C@H](NC(=O)c1cc(S(=O)(=O)Nc2ccccc2)ccc1Cl)c1ccccc1O 1454828381 XIBYGGUEMHKXIR-AWEZNQCLSA-N 430.913 4.337 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cc2cc(Cl)cc3c2OCC3)cc1 1456080968 BXJQMMJZECVUIR-UHFFFAOYSA-N 426.866 4.475 10 10 IICE Cc1nc(O[C@@H](C)C(F)(F)F)ccc1C(=O)NCc1ccc(N2CCSCC2)cc1 1464260629 MWHQJRSRTHMYBS-HNNXBMFYSA-N 439.503 4.203 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1465834353 KUXHROMCSQMXMI-VXKWHMMOSA-N 442.943 4.234 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCOC3(CCSCC3)C2)cc1 1466193712 YGWIRSZEIUXMRU-NRFANRHFSA-N 426.582 4.010 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1(c2ccccc2Cl)CCC1 1470449617 WSIQAARVCVFMSD-UHFFFAOYSA-N 435.902 4.333 10 10 IICE Cc1cc(C(=O)N[C@H]2CCS(=O)(=O)C3(CCC3)C2)c(C)n1-c1cccc(C(C)C)c1 1472001066 UFSSLNJVZBQMNG-FQEVSTJZSA-N 428.598 4.447 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCCC12CCN(C(=O)/C=C/c1ccc(O)c(O)c1)CC2 1472410084 YZFVCVJWTYVKTH-KOEDOTQGSA-N 430.545 4.045 10 10 IICE COC(=O)c1ccnc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1472511366 WVHLUBLENXDQNT-UHFFFAOYSA-N 428.286 4.291 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(F)ccc3N3CCOCC3)cc2Cl)C1 1524703957 OGXOUEOPRMNQHO-QGZVFWFLSA-N 445.966 4.482 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(C(=O)OC)on2)sc(C)c1-c1ccc(F)cc1 1525141099 NYUWXHLURYNCHX-UHFFFAOYSA-N 432.429 4.066 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1Br 1527481150 GBVQWRHKPYOHRZ-HZPDHXFCSA-N 449.364 4.369 10 10 IICE CC1(C)Cc2cccc(OCC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2O1 1533327603 CVBJKPWMIWQQNA-KRWDZBQOSA-N 446.494 4.166 10 10 IICE Cc1cc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(C)s1 1540739751 QMYYPYJMBMNZSV-GFCCVEGCSA-N 436.580 4.424 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CCCC2(C)C)cc1 1547449608 ZDHBSFKEENVSAH-UNMCSNQZSA-N 441.620 4.275 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCCOC(C)C)CC2)cc1 1554959983 VAXZEILZQIISCV-UHFFFAOYSA-N 427.593 4.086 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](CO)Cc2cccc(Br)c2)cc1 1556182696 ZFSRTLBWJANTRZ-IBGZPJMESA-N 441.369 4.438 10 10 IICE COc1cc(I)ccc1C(=O)NCc1c(O)ccc2ccccc12 1558554121 DNLRUXZJTRGWJA-UHFFFAOYSA-N 433.245 4.089 10 10 IICE COc1ccc(O)c([C@@H](C)NCc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)c1 1559701094 LZABKNZTFQLNJY-GFCCVEGCSA-N 425.485 4.356 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)C2CC2)cc1 1564590602 WSRMHYQFDPNUFO-RTBURBONSA-N 430.593 4.263 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSc3cccc(Br)c3)CC2)cc1 1566562064 AYPVXHVNHGFDBS-UHFFFAOYSA-N 435.387 4.289 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2ccccc2F)c(C)n1-c1cccc(Cl)c1 1587238175 IQUSFUWBWATXBE-UHFFFAOYSA-N 427.907 4.437 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1 1587686547 ALYSFWTVNLFMBO-OKXSDPAFSA-N 436.577 4.406 10 10 IICE CCOc1ccccc1N1C[C@H](C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1=O 1587881107 SECVGMMAEICVKL-JOCHJYFZSA-N 445.563 4.471 10 10 IICE Cc1ccc(C(=O)N2CCN(c3ccc(Cl)cn3)CC2)cc1-n1c(C)cc(C=O)c1C 1598309022 XURPWPSBHYVRLB-UHFFFAOYSA-N 436.943 4.226 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCC[C@@H](OC(C)(C)C)C1 1611964074 LAPJPOVTFMGOQD-JOCHJYFZSA-N 425.621 4.437 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCOC[C@H]2C)cc1 1615381635 AOILZAQMBSYTIW-GOSISDBHSA-N 425.602 4.050 10 10 IICE Cc1cc(CC(=O)Nc2cc3n(n2)CCN(C(=O)OC(C)(C)C)C3)c(C)n1-c1ccccc1 1617746876 QNPYQHKSCKGHEW-UHFFFAOYSA-N 449.555 4.223 10 10 IICE CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1617900756 LTDWAEFXFZZCOQ-UZLBHIALSA-N 437.028 4.315 10 10 IICE Cc1cc(C(=O)NC[C@]2(O)CCN(Cc3ccccc3)C2)c(C)n1-c1cccc(Cl)c1 1618659084 VEEICIJOEIZNGK-RUZDIDTESA-N 437.971 4.114 10 10 IICE Cc1ccc(CN2CC[C@@H](NC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2=O)cc1 1634913771 RHTVKKQGFLLNOG-XMMPIXPASA-N 430.552 4.003 10 10 IICE O=C(NCc1ccc(C2CC2)cc1F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1637125314 WULMSFHNEDKLKY-UHFFFAOYSA-N 446.525 4.201 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)CSc1ccc(Br)cc1[N+](=O)[O-] 1651842725 SDVNXRFJIPAUSR-UHFFFAOYSA-N 438.347 4.174 10 10 IICE Cc1cc(C(=O)N2CCC(c3ccn(C)n3)CC2)c(C)n1-c1ccc(Br)cn1 1652159579 BVHHCNNAXIQXMD-UHFFFAOYSA-N 442.361 4.005 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](C)c3ccc(SC(C)C)cc3)CC2)cc1 1653010973 HFWOTMDYXGACNO-OFNKIYASSA-N 443.657 4.029 10 10 IICE Cc1ccc([C@@H]2CCCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1676125271 CNTANSYMEAFJBE-DEOSSOPVSA-N 434.584 4.134 10 10 IICE Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1681801384 SQIVIHOWQNPCJG-GOSISDBHSA-N 439.581 4.064 10 10 IICE Cc1cc(CCNC(=O)NCC2(C)CCC3(CC2)OCCO3)c(C)n1-c1ccccc1 1683149637 SOVCOVZKLKCSEF-UHFFFAOYSA-N 425.573 4.259 10 10 IICE Cc1ccccc1C[C@@H](CO)NC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1686268231 ADXGGEDPGDNZSR-UWJYYQICSA-N 429.992 4.288 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCN(CC)C(=O)C1 1694985696 ZXBMWJMMTXASIW-XFFZJAGNSA-N 446.599 4.377 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@]3(C)CCCS3)CC2)cc1 1711865082 HRSLCAPOIKAVMO-HSZRJFAPSA-N 429.634 4.413 10 10 IICE CC[C@H](C)[C@@H](Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1743533636 YWJODWXTPWRVMV-NZQKXSOJSA-N 443.636 4.263 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCOC1 1745629040 KFBFOEURFKXRGS-VWLOTQADSA-N 437.588 4.130 10 10 IICE CC(C)CCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1750796870 IUDCUBWTODILFJ-JOCHJYFZSA-N 427.593 4.039 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752135357 NQIXWPVMLSGTRE-TZIWHRDSSA-N 441.620 4.025 10 10 IICE C[C@H]1CCCN(CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1752182654 HMCFEAWEOSSNPP-SFHVURJKSA-N 425.602 4.004 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCCOCC1CCOCC1 1767112981 IJHMFAYNTVJYTE-UHFFFAOYSA-N 430.593 4.042 10 10 IICE COCCC(C)(C)Cn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C 1770973022 CCNAXMSEHUFXMS-UHFFFAOYSA-N 447.599 4.113 10 10 IICE CCNC(=O)c1c(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)sc2c1CCCC2 1871343122 KUKXSIFTFWSUHX-UHFFFAOYSA-N 433.382 4.484 10 10 IICE CC[C@@H](C)N1C(=O)C(NCc2cccnc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164007 HTVYSTSWORQDRG-QGZVFWFLSA-N 428.536 4.157 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccn(Cc2ccccc2Cl)c1=O 1891430591 OAULNVKTTNPXCS-UGKGYDQZSA-N 447.966 4.469 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C(C)C)c(N)c2I)c(O)c1 2080009272 YIRQZFDBTSNYOL-QGZVFWFLSA-N 441.313 4.297 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)ccc2O)[C@@H]2CCCC[C@H]21 2122805269 OYSGSWIRNXURCM-YESZJQIVSA-N 425.367 4.422 10 10 IICE COc1ccc(Br)c(CNC[C@]2(C)CN(Cc3ccccc3)C[C@@H]2C)c1O 2236051175 PETGHGXDWMHSQX-KSFYIVLOSA-N 433.390 4.411 10 10 IICE CCCCCCOc1ccccc1C=C1SC(=S)N([C@H]2CCS(=O)(=O)C2)C1=O 2296712142 BDABQPPRZAPDNE-INIZCTEOSA-N 439.624 4.034 10 10 IICE O=C(NN1C(=O)C(=Cc2cccc3ccccc23)SC1=S)c1ccc([N+](=O)[O-])cc1 2296754979 ZHIPEZJQQIQPKO-UHFFFAOYSA-N 435.486 4.294 10 10 IICE COc1ccc(N2C(=O)C(=Cc3ccc4c(c3)-c3ccccc3C4)C(=O)NC2=S)cc1 2297353911 GJMBAINMMRGTBX-UHFFFAOYSA-N 426.497 4.098 10 10 IICE CCOc1ccc(Br)cc1C=C1SC(=S)N(CCCC(=O)OC)C1=O 2314741431 ZGQVKIXWUKMWPM-UHFFFAOYSA-N 444.372 4.002 10 10 IICE Cc1nc2scc(C)n2c1C=C1SC(=S)N([C@H](C(=O)O)c2ccccc2)C1=O 2323865373 ULBHJBNOFRUUBG-HNNXBMFYSA-N 429.548 4.040 10 10 IICE Cc1ccc(C2=N/C(=C/c3ccc(N(C)C)cc3)C(=O)O2)cc1I 678703 KLMWEVZGIKFYFH-LICLKQGHSA-N 432.261 4.010 10 10 IICE CCCCC(=O)N[C@@H](c1ccc(OC)c(OC)c1)c1cc([N+](=O)[O-])c2cccnc2c1O 6146605 WTQHTBSVJVIQLZ-NRFANRHFSA-N 439.468 4.262 10 10 IICE N=C1/C(=C\c2coc3ccccc3c2=O)C(=O)N=C2SC(Cc3ccc(Cl)cc3)=NN12 20332290 QFLPUKVBJBYMAV-HCNNPVLLSA-N 448.891 4.308 10 10 IICE COC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N(c4cccc(C(=O)O)c4)N=C3C)o2)cc1 27548714 JBXCRTIWFYRWJZ-MOSHPQCFSA-N 430.416 4.238 10 10 IICE CN(C)c1ccc(/C=C2/SC(=O)N(CC(=O)Nc3ccccc3C(F)(F)F)C2=O)cc1 97600812 FPYXVYPEPKROMH-GZTJUZNOSA-N 449.454 4.446 10 10 IICE CCCCN1C(=O)/C(=C2/SC(=S)N(CCCC(=O)OCCC)C2=O)c2ccccc21 206872735 DDBSWMLMQMBGJX-VHEBQXMUSA-N 446.594 4.138 10 10 IICE O=C(/C=C\c1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CCCCCC1 210090220 WLPOMQCEGIXBHI-KAMYIIQDSA-N 433.596 4.229 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@@H](C)c3ccccc3)C2=O)c(C(=O)O)c1OC 210824213 MXHCUPKQUMRYQM-IEMQHYRPSA-N 429.519 4.364 10 10 IICE CC(=O)Nc1cccc([C@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435618815 VAPYEYMTRHIHHC-SFHVURJKSA-N 432.568 4.244 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(NC(C)=O)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526394843 XEAGXTWWDWDXMV-HSZRJFAPSA-N 446.459 4.122 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1 743808569 XPWMELAGOLBWLA-UGSOOPFHSA-N 431.330 4.412 10 10 IICE COc1ccc(N2CCC(NC(=O)NC[C@H]3CCCN(C)[C@@H]3c3cccs3)CC2)cc1 745795668 IBXUMZBRAUTXNR-JPYJTQIMSA-N 442.629 4.108 10 10 IICE Oc1cc(OCc2ccccc2)ccc1CN1CCOC[C@H]1C[C@H](O)c1cccs1 753548055 AMZIYZLNGHMRMZ-OFNKIYASSA-N 425.550 4.357 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](c3cccc(F)c3F)C(F)(F)F)CC2)cc1 776015467 VCPDOJPCSXHGLV-IBGZPJMESA-N 443.416 4.499 10 10 IICE COc1c(C)cnc(Cn2cnc(NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)n2)c1C 790160360 CKEZDLGXLZRKTC-UHFFFAOYSA-N 448.502 4.146 10 10 IICE C[C@@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)cc(F)c1O 797106359 WIYLCUDZSPITFX-SNVBAGLBSA-N 444.732 4.231 10 10 IICE COc1ccccc1[C@H](O)CNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799993273 FNUBQBGTWNEDJS-IIBYNOLFSA-N 431.964 4.118 10 10 IICE C[C@@H]1C[C@H](NC(=O)NCc2cc(Br)ccc2O)CCN1Cc1ccccc1 805177325 YEHJTHBMKZERJE-DNVCBOLYSA-N 432.362 4.007 10 10 IICE Cc1cc(-c2noc([C@@H](C)NC(=O)NCc3cc(Br)ccc3O)n2)ccc1F 805203590 LWQSGBPFTULCHY-LLVKDONJSA-N 449.280 4.213 10 10 IICE O=C(NC[C@H]1CC[C@@H](c2ccccc2)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 811940083 QVZPBAUBJADSSQ-YADHBBJMSA-N 445.510 4.476 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(N2CCCOC2=O)cc1 815600333 QPMCGDUQNPNTFV-OAQYLSRUSA-N 448.611 4.416 10 10 IICE CCc1noc(C[C@@]2(O)CCCN(Cc3ccc(N(CC)Cc4ccccc4)cc3)C2)n1 856593790 RABZLPXLIARXEC-SANMLTNESA-N 434.584 4.228 10 10 IICE Cc1cc(C(=O)N2CCN(CCN3[C@@H](C)CC[C@@H]3C)CC2)c(C)n1-c1cccc(Cl)c1 1136563777 KBPFKUHMJGRNOH-OALUTQOASA-N 443.035 4.378 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cn(-c3cccc(C(F)(F)F)c3)nn2)cc1F 1136729952 WGAHUIAEVNNSHO-UHFFFAOYSA-N 435.425 4.201 10 10 IICE Cc1[nH]nc(Br)c1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1139138643 LFMKUOSNTNVLDD-NSHDSACASA-N 425.758 4.300 10 10 IICE CCCCc1ccc(C(=O)CCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1141926521 IOPIBGVHLGUGSA-UHFFFAOYSA-N 444.522 4.423 10 10 IICE COC(=O)c1ccc2[nH]cc(C3CCN(C(=O)c4ccc(N=NC(N)=O)cc4)CC3)c2c1 1156139375 RQJDUTKZIJCODL-UHFFFAOYSA-N 433.468 4.137 10 10 IICE Brc1cc(CNC[C@@H](c2ccccc2)c2nc[nH]n2)ccc1N1CCCCC1 1181765228 WIUQTWKXTSCAOZ-IBGZPJMESA-N 440.389 4.479 10 10 IICE Cc1nc2ccccc2n1C1CCN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1256237386 YXOMZSTXLAMGDK-VWLOTQADSA-N 448.615 4.060 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](NC(=O)c2ccc(Cl)s2)C(C)C)cc1F 1293225602 YHDJPKJMVPAATR-LJQANCHMSA-N 439.984 4.458 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cn3ccccc3n2)nnc1N(C)CC(C)C 1304241267 UFPBJUSSCWCSFK-UHFFFAOYSA-N 431.588 4.032 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)OC(C)(C)C)c1 1305180253 ROLMAEXBBFBOBK-FSSWDIPSSA-N 437.540 4.177 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H](OC)C(C)(C)C 1305384815 VRWZAITWVSPYSD-UGKGYDQZSA-N 443.636 4.326 10 10 IICE COc1cc(OC)cc(C2(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CCCC2)c1 1434909134 HLXYZBGKGAZCOF-IBGZPJMESA-N 438.568 4.230 10 10 IICE CCc1noc(C)c1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1439876475 WZAIDYOUSJBPOJ-UHFFFAOYSA-N 426.274 4.270 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CC[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C 1440710876 GGRWHQVPNPQZLR-OAQYLSRUSA-N 445.604 4.397 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCc3ccc4cccnc4c3O)cc2[N+](=O)[O-])C1 1451943172 HSTHIJGVNRNUIF-HZPDHXFCSA-N 434.496 4.261 10 10 IICE CC[C@H](C)[C@@H](NC(=O)c1ccc(C)c(O)c1O)C(=O)N1CCC(Cc2ccccc2)CC1 1465004284 NREUZUNWDOFMFH-HTAPYJJXSA-N 438.568 4.032 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@](C)(Cc2ccccc2)[C@H](C)O)cc1 1467801821 AXYNWIXEVTYTLI-IDISGSTGSA-N 432.564 4.195 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1 1471013856 ZGUUKQBDBQRCCG-JKSUJKDBSA-N 435.565 4.187 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3c4ccccc4C(=O)N3C)cc2Cl)C1 1478528106 LVIBEWPYHBTKMJ-OPAMFIHVSA-N 440.975 4.202 10 10 IICE C[C@@H]1CCC[C@](Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1493505629 BHGFGPJUSZQIMZ-CLOONOSVSA-N 436.604 4.136 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)CC2CCCC2)n1Cc1ccc2c(c1)CCCN2C 1504946385 UULHBSOSZZCUAE-IBGZPJMESA-N 441.620 4.059 10 10 IICE CCCCOCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1514553191 YJGIZPYARXDWIO-TZIWHRDSSA-N 430.593 4.355 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCOC(C)(C)C 1517148520 PIAOCNFJLQLVCO-UYAOXDASSA-N 430.593 4.354 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1525821833 JSGLKJDHFMTROB-XMSQKQJNSA-N 448.563 4.065 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Oc2ccc(S(=O)(=O)N(C)C)cc2)c1 1528056775 PHASCBQHLNBRDG-UHFFFAOYSA-N 432.929 4.217 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)cc2Cl)C1 1530426830 WETCEKSVNJUWFA-ZDUSSCGKSA-N 431.876 4.143 10 10 IICE Cc1cc(C)c(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(C)c1 1540794490 VZESBGSVCYPOFU-UHFFFAOYSA-N 430.551 4.110 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@H]2CC2(C)C)c(C)n1-c1ccccc1 1542179775 OVZAIMMJZVQQGO-VQIMIIECSA-N 434.588 4.099 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(I)cc1 1543591947 UGOUBADGJZDLSF-OAHLLOKOSA-N 434.321 4.311 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCCN(c4ccccc4F)C3=O)c2C)cc1 1545799775 SBALJCXARJDIPR-JOCHJYFZSA-N 435.499 4.167 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COc1ccc2c(c1)CCC(=O)N2 1546150904 ZXNYZEQLAVPVPM-SFHVURJKSA-N 430.504 4.446 10 10 IICE CN(C)c1ccc(Cn2c(C3CC3)nnc2N(C)Cc2ccc(Br)o2)cc1F 1552821957 DBPLRXMUDFWFMY-UHFFFAOYSA-N 448.340 4.401 10 10 IICE CC(C)C[C@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1cccc(Br)c1O 1556481395 RYKHNCYESZGCQN-AWEZNQCLSA-N 443.382 4.348 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)N(CC)C[C@@H]2C)sc(C)c1-c1ccccc1 1559712515 OLQCHLQTGCYHJK-IRXDYDNUSA-N 443.613 4.253 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)OC(C)(C)C)C2 1564946551 RNYWVHDFGMHURP-HXHBTQRASA-N 444.620 4.079 10 10 IICE CCOC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccc(OC)c(F)c1 1585305696 INZXBABOJFEZRX-DEOSSOPVSA-N 438.499 4.205 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)cc2C)CCO1 1614219420 BLFNXGVCPAFRSY-FQEVSTJZSA-N 440.979 4.031 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)Nc2ccccc2Oc2ccc(C)cc2)cc1 1617138747 BKOSCPWTZBCUPE-UHFFFAOYSA-N 434.492 4.414 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Br)cc(OC(C)C)c3)C2)cc1 1617262805 NPXGHLUPJSZASG-KRWDZBQOSA-N 433.346 4.254 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O 1617591979 KTCBCVMDQYQORR-FQEVSTJZSA-N 435.911 4.095 10 10 IICE Cc1cc(C(=O)NC[C@H]2COc3ccccc3O2)c(C)n1-c1ccc(Br)cc1 1623920250 RJUATQVTBMMRHC-SFHVURJKSA-N 441.325 4.426 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc(Cl)c1OCC(C)C 1625140741 APTIRHWCTRVDNB-UHFFFAOYSA-N 445.991 4.065 10 10 IICE CCCN(C(=O)c1cc2cc(O)c(O)cc2s1)C1CCN(C(=O)c2ccccc2)CC1 1626386308 DJFKADXYUQKJJF-UHFFFAOYSA-N 438.549 4.470 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3C[C@@H](NC(=O)OC(C)(C)C)C3(C)C)ccc21 1627064654 ZIQHONINBQKIAK-LEWJYISDSA-N 443.588 4.326 10 10 IICE O=C(NCCCSc1nccs1)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1628325301 HQLXKUZJUHLEQP-NSHDSACASA-N 430.382 4.101 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)OC2CCCC2)c(C)n1-c1ccccc1Br 1630470895 BEBODUVLGDLSLN-AWEZNQCLSA-N 433.346 4.461 10 10 IICE Cc1ccc(Nc2nccc(C(F)(F)F)n2)cc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1633818450 ILALOAVRSNBSTA-CYBMUJFWSA-N 446.429 4.320 10 10 IICE COC(=O)/C=C/c1ccc(N2CCCN(Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 1642008922 PGRJGDSWNTWZJX-UXBLZVDNSA-N 429.904 4.147 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC3CCN(CC(=O)OC(C)(C)C)CC3)c2C)c1 1648916156 UYMDVCMPLVCZQB-UHFFFAOYSA-N 439.600 4.247 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)Nc1ncnc2c1cnn2-c1cccc(Br)c1 1650960408 WDXXAHIMNRZTSZ-GFCCVEGCSA-N 440.301 4.032 10 10 IICE CCN(CC(=O)NCc1cccc(OC(C)C)c1)Cc1cc(Br)ccc1O 1657428342 XBPZVEMCKXDBPH-UHFFFAOYSA-N 435.362 4.080 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)c3cccc(OC(F)(F)F)c3)C2)cc1 1673823630 XHXDPTKCFPMIPM-HZPDHXFCSA-N 437.462 4.481 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1 1686827088 VYPABLOCWJVWKG-HNNXBMFYSA-N 448.489 4.218 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCC(F)(F)CC2)cc1 1710026242 BFZYEORUZTWTDR-LJQANCHMSA-N 433.547 4.302 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@H](C)CCSC)n1Cc1ccc(N2CCOCC2)cc1 1726866028 MJCYPZJGQXNDPR-RBUKOAKNSA-N 431.650 4.254 10 10 IICE CCOCc1nnc(N(Cc2cccs2)C2CC2)n1Cc1ccc(N(C)C)c(F)c1 1728993153 GYURHYDPULVONH-UHFFFAOYSA-N 429.565 4.299 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCSC(C)(C)C2)cc1 1746093565 QMLNEHFWBOEGCH-HXUWFJFHSA-N 443.661 4.398 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(C(C)C)CC2)CCOC1 1761278141 XTPVWMOUWLWGEK-DEOSSOPVSA-N 428.577 4.097 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCOCC1 1769685510 ZZYUVSZSBIGCBM-UHFFFAOYSA-N 437.588 4.252 10 10 IICE O=C(CCn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)N1CCCCCC1 1860345095 SWQXCWFVRPEDGY-UHFFFAOYSA-N 440.547 4.367 10 10 IICE CCc1sc(NC(=O)CC(=O)OC)c(C(=O)OC)c1-c1ccc(Br)cc1 1865786039 HGFYANXZRSFDLJ-UHFFFAOYSA-N 440.315 4.028 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2c(O)cccc2Br)C[C@@H]1C1CC1 1895877172 XXQYXTPWVZCBNB-WMLDXEAASA-N 425.367 4.422 10 10 IICE COc1ccc(O)c([C@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@@H]2C(=O)O)c1 1952766990 YXLUWCVAESRSFO-ATIYNZHBSA-N 445.471 4.239 10 10 IICE Oc1c(Br)cccc1Cn1ncc(C2CCC2)c1I 2070240279 GPMWKFVMLJXVMF-UHFFFAOYSA-N 433.087 4.272 10 10 IICE CC(C)(C)OC(=O)NCC[C@H]1CC[C@@H](NCc2cc(Br)cc(F)c2O)C1 2098526363 WISGEQKAQXHWGE-IUODEOHRSA-N 431.346 4.467 10 10 IICE CCOc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccc(C)cc1 20235852 ZPKIVGXGJWGBAI-YUIYYNKLSA-N 447.491 4.302 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(OCC)cc2)C(=O)/C1=C/c1cc(OC)ccc1OC 33309056 UDSZVXQPMAYZIE-RCCKNPSSSA-N 437.492 4.370 10 10 IICE CCOc1cc(/C=C2/SC(=S)N([C@@H](CC(=O)O)c3ccccc3)C2=O)ccc1O 35624423 FUYUHFVXJGBQGB-LZNAANCOSA-N 429.519 4.208 10 10 IICE CCOc1ccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(Cc4ccccc4)c3C)C2=O)cc1 59858740 LCLMBOBCBABVBN-HMAPJEAMSA-N 444.491 4.454 10 10 IICE CC1=NN2C(=N)/C(=C/c3cccc(OCCOc4cc(C)cc(C)c4)c3)C(=O)N=C2S1 103564207 HSWYAQOQJVNFFQ-VAPLQANRSA-N 434.521 4.400 10 10 IICE Cc1cccc(C)c1NC(=O)CN(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435607749 ORLTVLHVAPTZJA-UHFFFAOYSA-N 446.595 4.122 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)C2)n1 731120907 HSTONSUURSVDMB-JOCHJYFZSA-N 449.599 4.187 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3COc3cccc(C=O)c3)CC2)cc1 731597186 BYONGXXWKPUIED-UHFFFAOYSA-N 430.504 4.049 10 10 IICE Cc1ncsc1/C=C\C(=O)N(C)c1ccc(CNC(=O)/C=C/c2scnc2C)cc1 765478637 ILWUXSZERYOASH-GOOGBFEESA-N 438.578 4.222 10 10 IICE CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccc(N3CCOCC3)cc2)[C@@H]2CCCC[C@@H]12 769231614 BZVOWAQKYACRKZ-KJNIBPJZSA-N 427.633 4.207 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@@H](C)c2ccc3c(c2)CC(=O)N3)C1 774062951 HFNSUUBPLNOXAE-KRWDZBQOSA-N 431.536 4.207 10 10 IICE O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2cccc(Br)c2O)C1)C1CCCC1 779620251 REERCXSZGSMVJC-HNNXBMFYSA-N 447.377 4.386 10 10 IICE COc1cc(Br)ccc1[C@H](C)NC(=O)NCCCSc1nccs1 786788643 HUNSWJRMLJRAAA-NSHDSACASA-N 430.393 4.457 10 10 IICE COCCN(Cc1scnc1C)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 786880454 QHIQRRXNFNEAQH-UHFFFAOYSA-N 426.586 4.260 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](C(=O)N4CCCC4)C3)cc2Cl)C1 800719791 NPLAQKJGAXHRFP-ICSRJNTNSA-N 447.023 4.120 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(Cc3ccco3)C3CCCC3)cc2F)C[C@@H](C)O1 917063638 LORPGNCGEWATNK-KDURUIRLSA-N 443.563 4.093 10 10 IICE CCOc1cc2c(cc1/C=C/C(=O)NCc1ccc(N3CCSCC3)cc1)O[C@H](C)C2 918618113 XTHIOPUODROOPC-AHKGRUIUSA-N 438.593 4.292 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(Cl)c(C)c([N+](=O)[O-])c3)n2)cc1 921205452 VTIOEIIGACOERU-UHFFFAOYSA-N 439.902 4.490 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3ccc(OC)c(Br)c3)C2)cc1 1130185435 HVQYBFJZTJCNMV-QGZVFWFLSA-N 447.373 4.042 10 10 IICE Cc1cccc(CC2(O)CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1139704549 LZQFTJMICDAJBP-UHFFFAOYSA-N 430.548 4.425 10 10 IICE CCCN(CCNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C(=O)OC(C)(C)C 1152982116 JMHHTNFVYYUNGJ-UHFFFAOYSA-N 441.572 4.212 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cnc(-c2ccccc2Cl)s1 1162539347 BVGFQYBWWXYTRS-UHFFFAOYSA-N 430.913 4.375 10 10 IICE Cc1cc(C)n2nc(SCc3ccccc3C(=O)N[C@@H](C)c3ccccc3O)nc2n1 1171730926 SAKGLGNWPLGSCJ-INIZCTEOSA-N 433.537 4.230 10 10 IICE CCCOc1c(OC)cc(CCNC(=O)NCc2c(O)ccc3c2CCCC3)cc1OC 1228391541 TTXSUUIJNIJADA-UHFFFAOYSA-N 442.556 4.119 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3CC(C)(C)Oc4ccc(F)cc43)CC2)cc1 1252661811 FXKUWJJSXWGKAW-NRFANRHFSA-N 427.520 4.358 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@@H]1CCC[C@@H](OC)C1 1277969461 CGVWMKYOIYADMI-ODOSVJCGSA-N 446.975 4.153 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3occc3CSc3ccccc3)cc2)CC1 1288913572 YDPJUTGKVKCRFK-UHFFFAOYSA-N 449.576 4.204 10 10 IICE O=C(c1cnc(OC2CCOCC2)c(Cl)c1)N(Cc1ccco1)Cc1ccccc1O 1294672293 OJERGNAGIYBNKM-UHFFFAOYSA-N 442.899 4.434 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1Cc1cccc(Br)n1 1298363516 FQDMMOFFEZFWOA-UHFFFAOYSA-N 444.377 4.415 10 10 IICE Cc1cc(C(=O)Nc2nc(-c3ccco3)n[nH]2)c(C)n1-c1cccc(Br)c1 1306308877 KXWWZRHJWHVYPT-UHFFFAOYSA-N 426.274 4.487 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCN(c3ccccn3)CC2)cc1 1313673231 KHBCRFLCUCWYPO-UHFFFAOYSA-N 433.604 4.018 10 10 IICE CCOCc1nnc(N2Cc3ccccc3O[C@@H](C)C2)n1CCCSc1nccs1 1314324281 KLRDKOAWECTOIP-INIZCTEOSA-N 445.614 4.241 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)Cc1ccc2ccccc2c1 1465043568 QJMRYAAADOHONG-GOSISDBHSA-N 435.501 4.227 10 10 IICE Cc1ccc(C(=O)N2CCO[C@@H](COc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1466855804 REJRXRDNDLDLHB-XMMPIXPASA-N 432.520 4.135 10 10 IICE Cc1cc(C)cc(C2=CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)c1 1478786292 OAHUWVMYIDCWTN-UHFFFAOYSA-N 441.522 4.417 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CCC3(F)CCC3)CC2)cc1F 1504296759 RJPUOFAHIWOPNM-UHFFFAOYSA-N 433.547 4.233 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1514015125 LCBUDKPXDSZEKF-NQIIRXRSSA-N 448.615 4.456 10 10 IICE COc1ccc2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc2c1 1514714286 BIWLSTZSHBQZSE-QGZVFWFLSA-N 427.451 4.244 10 10 IICE COCCO[C@@H](C)c1nnc(N2C[C@@H]3CCC[C@@]2(C)C3)n1Cc1ccc(N(C)C)c(F)c1 1519340932 IRHNULQJHINPEH-PDOGEWKWSA-N 445.583 4.024 10 10 IICE COc1cccc(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)c1OC(C)C 1530461362 FUXUBEFWLQGBHJ-UHFFFAOYSA-N 447.535 4.227 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC(C(=O)C(F)(F)F)CC1 1542224760 RPNVFXWDQGQQQP-UHFFFAOYSA-N 437.510 4.172 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nc(C(F)(F)F)cs1 1543147511 YMWHTXNKIKWAFM-UHFFFAOYSA-N 436.507 4.347 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1547447475 BVKPDOPBRQIYLO-HXUWFJFHSA-N 448.615 4.162 10 10 IICE CS(=O)(=O)c1ccc(Sc2ccccc2C(=O)N2Cc3cccc(O)c3C2)cc1 1558035736 NTWRMHFCLBOHPS-UHFFFAOYSA-N 425.531 4.103 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(OC2CCCC2)c1 1565986387 XOQJNVUXPADVPH-UHFFFAOYSA-N 438.568 4.155 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CC(c4ccc(OC)c(C)c4)=NO3)c2C)cc1 1567999336 MDHBLLPRCKUWAA-QFIPXVFZSA-N 447.535 4.343 10 10 IICE COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1568840683 FSOQMYFZYCQPKO-IBGZPJMESA-N 428.838 4.315 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NCc2ccc3cccnc3c2O)c1C(F)(F)F 1570531587 JOQWJPFWBPCUKT-UHFFFAOYSA-N 426.398 4.383 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C)CC(C)C 1586411857 AIBNPRSKFAKVJD-MRXNPFEDSA-N 435.362 4.422 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCOC3(CCSCC3)C2)cc1-n1c(C)cc(C=O)c1C 1596670486 UKUHLFLUDPSHKH-OAQYLSRUSA-N 426.582 4.390 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1616437157 RKDHBYBJGORZFX-MHZLTWQESA-N 446.547 4.086 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2cccn2C)n1CCOC(C)(C)C 1617892791 CSPXEAQWZMSEDW-UHFFFAOYSA-N 436.604 4.335 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ncccc32)c(C)n1-c1ccccc1Br 1620656421 NDRFLLDHEKZZJP-UHFFFAOYSA-N 425.330 4.348 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1 1629204337 MEGRYXMJBJLBPV-UHFFFAOYSA-N 430.508 4.372 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Nc2nccs2)cc1F 1629880056 ZUODYRYQBPIJFB-UHFFFAOYSA-N 440.544 4.165 10 10 IICE Cc1ccc(C2=NO[C@H](CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)cc1C 1633765615 RZPWNCWUZBASDN-QFIPXVFZSA-N 429.520 4.446 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc(Br)cnc1C1CC1 1635839517 GBVIGACBYXMHEZ-UHFFFAOYSA-N 426.108 4.120 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 1642997772 MQYOHARQSBQZHY-WIYYLYMNSA-N 429.605 4.288 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 1643394869 ZHGHNPHTGPOLTP-WMZHIEFXSA-N 443.950 4.305 10 10 IICE CC(C)[C@](C)(NCC(=O)NCc1ccc(N(C)C)cc1)c1ccc(Br)cc1 1653292412 BTOLBSNBNJTVFD-QFIPXVFZSA-N 432.406 4.292 10 10 IICE CCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1672133022 MZVZDMPDCCRUOF-IEBWSBKVSA-N 435.012 4.024 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4c(Br)cccc43)C2)cc1 1673822735 GPZRSSLTZYKBKA-HNNXBMFYSA-N 430.346 4.056 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(CCc2ccccc2)Cc2cccnc2)N(C)C)cc1 1676653192 HNLWUZLYIRSKEV-AREMUKBSSA-N 445.611 4.205 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](CO)Cc3ccccc3)cc2Cl)C1 1686268901 IEFXYTJALBHBRW-RXVVDRJESA-N 429.992 4.227 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3Cc4cccc(Br)c4C3)C2)cc1 1686854886 IBWOXNAEWRFIMI-OAHLLOKOSA-N 430.346 4.009 10 10 IICE CC1CCN(c2ccc(Cn3c(C(C)C)nnc3N3CCN(CC(F)F)CC3)cc2)CC1 1693700670 NMTHRBWWIGWYRL-UHFFFAOYSA-N 446.590 4.073 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1708362939 WKUPKQSZVDCASC-ZHZLYBIUSA-N 444.620 4.336 10 10 IICE COc1ccc(CN(C)c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)cc1 1730145814 LWKWFDBTDLKRJU-KRWDZBQOSA-N 445.614 4.066 10 10 IICE CCOC[C@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1747286763 UMBJBURMSBRZEY-FQEVSTJZSA-N 439.629 4.216 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1761679210 YIXSWDOSFCLDCY-GOSISDBHSA-N 434.588 4.114 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(C)CC2CCCCC2)cc1 1764935654 TVWIBKCSLDUANR-QFIPXVFZSA-N 438.620 4.140 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(CC)n1Cc1ccc(N2CCSCC2)cc1 1768398125 QULBYMYGUZTFFR-GOSISDBHSA-N 433.691 4.410 10 10 IICE O=C(O)Cc1ccc(N2C(=O)/C(=C\c3ccccc3Br)SC2=S)cc1 1860073510 MBSPWJFXKZMXJC-XNTDXEJSSA-N 434.336 4.482 10 10 IICE CCC[C@H](N)C(=O)Nc1sc(C)c(-c2ccc(Br)cc2)c1C(=O)OC 1866017613 MZKOGJCHRRBRNV-ZDUSSCGKSA-N 425.348 4.339 10 10 IICE CN1CCCc2cc([C@H](CN)N(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2074370645 JDKLFMQGAMATRI-DEOSSOPVSA-N 438.616 4.096 10 10 IICE COc1ccc([C@H](n2nc(C3CCC3)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2080008273 YWTOWNUKHVVWRV-KRWDZBQOSA-N 436.350 4.362 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cccc(Br)c2O)[nH]1 2082942348 PXSATFKIKCAKPT-SNVBAGLBSA-N 428.352 4.231 10 10 IICE CC(C)(C)OC(=O)N1CCC(C)(C)[C@H]1CNCc1cc(Br)cc(F)c1O 2139855401 GFPKYRYKODEXDA-OAHLLOKOSA-N 431.346 4.419 10 10 IICE CN(C)c1ccc([C@@H](O)c2ccc(Br)cc2I)cc1 2142280660 HCQRDCUORFTTLW-OAHLLOKOSA-N 432.099 4.201 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C2=O)cc1 2294133925 NGJJTHCPDGLWEK-UHFFFAOYSA-N 431.404 4.138 10 10 IICE COCCN1C(=O)C(=C2C(=O)N(Cc3ccccc3Cl)c3ccccc32)SC1=S 2296705077 NLQHLSJVCWZJDF-UHFFFAOYSA-N 444.965 4.105 10 10 IICE CC(C)(C)c1ccc(Oc2nc3ccccn3c(=O)c2C=C2SC(=S)NC2=O)cc1 2296718500 NIUXJSXXBNENCI-UHFFFAOYSA-N 437.546 4.273 10 10 IICE CCN1C(=O)C(=C2SC(N(C)c3ccc(Cl)cc3)=NC2=O)c2cc([N+](=O)[O-])ccc21 2297368322 GXNNCQUHUOPEIN-UHFFFAOYSA-N 442.884 4.092 10 10 IICE Cc1ccccc1-n1c(C)cc(C=C2C(=N)N3N=C(N4CCCC4)SC3=NC2=O)c1C 2297499414 BQKZSEGMGUOQQW-UHFFFAOYSA-N 432.553 4.075 10 10 IICE CCCOc1ccc(C=C2C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc1OC 2313548277 QTRWARGZZAOBSY-UHFFFAOYSA-N 430.460 4.304 10 10 IICE CCOC(=O)N1CCC(N2C(=O)C(=Cc3ccc(N(CC)CC)cc3)SC2=S)CC1 2323858428 USEYZLREIOHVHA-UHFFFAOYSA-N 447.626 4.355 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)C2=Cc2cccc(OC)c2O)cc1 2332099585 JQUILKHSNSHCDD-UHFFFAOYSA-N 432.451 4.379 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1ccc(Br)cc1O)[C@@H]2F 2333286525 ZAPHLZQKQDAQHM-AESZEHBQSA-N 429.330 4.123 10 10 IICE Cc1ccc(CN=c2[nH]c(CCNC(=O)OC(C)(C)C)cs2)c(O)c1Br 2352942458 FRWPZFXKUWFJTF-UHFFFAOYSA-N 442.379 4.021 10 10 IICE Cc1ccc(CN[C@@H]2CC[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c(O)c1Br 2352949158 ZQVDFPNWNKMHKJ-ARFHVFGLSA-N 425.367 4.483 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)cc1Br 705846070 OZWMAGKEICDCIO-DKOYFPBOSA-N 427.386 4.288 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(F)c(N4CCCS4(=O)=O)c3)c2C)c1 731649121 WFJZBYKEFRJRHQ-UHFFFAOYSA-N 441.528 4.334 10 10 IICE COC(=O)c1ncccc1OCC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 755820623 KFXCIXONHBDIGL-UHFFFAOYSA-N 430.407 4.139 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@@H](CC(F)(F)F)C1 764766118 XRHZHWSEUSMZIV-ZDUSSCGKSA-N 439.400 4.026 10 10 IICE C[C@@H](CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)NC(=O)OC(C)(C)C 764981552 IZEXWPSXDOPBBF-HNNXBMFYSA-N 441.519 4.066 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Oc2ccc3c(c2)CCCC(=O)N3)C1 768139412 YCHZRJXJPIMXJI-UHFFFAOYSA-N 431.536 4.288 10 10 IICE Cc1n[nH]c(C)c1[C@H](C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 772033052 QAKDQADUJZFOQX-CYBMUJFWSA-N 437.496 4.082 10 10 IICE Cc1cc(C(=O)COC(=O)c2ncccc2Br)c(C)n1-c1ccc(F)cc1 796095198 CVKHPQUYNVXNFP-UHFFFAOYSA-N 431.261 4.430 10 10 IICE CC[C@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)ccc1O 797085337 DPXJDCRFPSTSDJ-INIZCTEOSA-N 440.769 4.482 10 10 IICE COc1ccccc1[C@@H](O)CNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799993271 FNUBQBGTWNEDJS-IERDGZPVSA-N 431.964 4.118 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802695087 QNIUWUKBLRHXNL-GMAHTHKFSA-N 449.599 4.394 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCN(CC(F)(F)F)C(=O)C2)cc1 804714832 CVFRKDINEINSEG-UHFFFAOYSA-N 433.434 4.015 10 10 IICE COc1cc(Br)cc(CN2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c1O 809753169 ZMNSOCSFNGISDP-HNNXBMFYSA-N 443.345 4.328 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1O 920487770 ZZRRSYUZTXXMHC-MRXNPFEDSA-N 428.529 4.069 10 10 IICE CCN1CCN(/C=C2/SC(=S)N(c3cc(C(F)(F)F)ccc3Cl)C2=O)CC1 1084231309 AYWOFJPWEQCYCJ-GXDHUFHOSA-N 435.924 4.202 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)C1 1127165741 OEFSHXWOMNLPFQ-FQEVSTJZSA-N 447.579 4.046 10 10 IICE Cc1cc(C(=O)N[C@H](CCCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1137517404 KJTKSTCNRHDMOY-HXUWFJFHSA-N 442.357 4.495 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])cc1 1142712428 AETCKKKEMGYFCP-LJQANCHMSA-N 445.947 4.455 10 10 IICE CN(Cc1ccccc1)C1(CNCc2cc(Br)cc(F)c2O)CCOCC1 1179531912 QVMHURRRAXBYQT-UHFFFAOYSA-N 437.353 4.065 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CC[C@H](C)N(C(=O)OC(C)(C)C)C2)cc1 1234098041 XNPVCGWHVNRYNL-AZUAARDMSA-N 432.609 4.462 10 10 IICE CCc1cc2c(CC(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)csc2s1 1264737249 VERDAILFSPFLGA-INIZCTEOSA-N 441.622 4.086 10 10 IICE CC(C)NC1CCN(c2nnc(CC(C)(C)C)n2CCCSc2nccs2)CC1 1288262354 LEGXYHRLBILOGD-UHFFFAOYSA-N 436.695 4.472 10 10 IICE C/C=C/[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCc1ccc(N(CC)CC)c(F)c1 1293225647 ZZORXZCJYQNRTJ-KWKDUPADSA-N 433.568 4.347 10 10 IICE CO[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCCC1 1293793541 QYGAMBSHHLYJRX-NHCUHLMSSA-N 433.593 4.030 10 10 IICE CCOC(C)(C)Cn1c([C@@H](C)CC)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1296436979 JXYRJBLCMNGXCP-IBGZPJMESA-N 429.609 4.080 10 10 IICE CCOCc1nnc(N(C)C[C@@H]2CC=CCC2)n1Cc1ccc(N2CCSCC2)cc1 1297069813 CMJGFOCSOSUZPS-HXUWFJFHSA-N 441.645 4.209 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1298842759 VULDRWXLUVNBPW-VGSWGCGISA-N 449.334 4.364 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)C)n2CCC(C)C)c(C)n1-c1ccccc1 1304190800 WDWRRTFNZWVDHA-UHFFFAOYSA-N 436.604 4.360 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cc(C)nc(N2CCCC2)c1 1305383723 OOZQCHKTMQOBSX-SFHVURJKSA-N 434.588 4.486 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](c1ccc(F)cc1F)c1nccn1C 1312883041 ASNUPBSAGRDWCV-AOMKIAJQSA-N 441.526 4.093 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 1313123862 JCPLEPKSGKAEHF-KPZWWZAWSA-N 426.344 4.371 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1)C(C)C 1315189977 UQSSSHPOLKFOHB-JOCHJYFZSA-N 437.588 4.249 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(C)c3C)C2)sc2c1CCCC2 1351238343 CVNIXMFIMJSRFS-HNNXBMFYSA-N 426.538 4.022 10 10 IICE Cc1cc(CCNC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)c(C)n1-c1ccccc1 1438177902 LOALWVCSFKUMOU-QFIPXVFZSA-N 438.616 4.221 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCn3cnc4c(C)cccc4c3=O)c2C)c1 1438314293 RBNGZJSMHCTGFG-UHFFFAOYSA-N 428.536 4.127 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2C1 1445883882 OIOPIQBYWAPVAE-KXBFYZLASA-N 443.975 4.056 10 10 IICE CCOC(=O)c1n[nH]c([C@H](CC(C)C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)n1 1467595551 YVYATPNCYIUZLK-IBGZPJMESA-N 441.507 4.045 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1509473141 MXKADDWCAKYTHY-IAGOWNOFSA-N 437.635 4.020 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)CC1CC(F)(F)C1 1510675887 VTEWLCRDEOGALL-UHFFFAOYSA-N 440.542 4.168 10 10 IICE C[C@H]1COCCN1c1nnc(-c2cccc(Cl)c2)n1CCCSc1nccs1 1512536331 SCPCOBMQPVHWST-AWEZNQCLSA-N 436.006 4.463 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2nccs2)cc1F 1517002877 CHTQIGGKAVUILJ-UHFFFAOYSA-N 442.589 4.277 10 10 IICE COC(=O)[C@H](COC1CCC1)N(C)C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1517712667 VQIIUULEMCQTCJ-QFIPXVFZSA-N 438.528 4.351 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(CN2CCCCC2)o1 1520922249 IYWNLOPKBDZVMJ-UHFFFAOYSA-N 433.499 4.266 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](CC3CCCCC3)NC(=O)OC(C)(C)C)CC2)cc1 1526035205 CPKPQSPJLSLCMG-QFIPXVFZSA-N 445.604 4.208 10 10 IICE CCCc1c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccc(C)cc1 1528555156 XHMBZYAYWJSAKO-HXUWFJFHSA-N 432.568 4.461 10 10 IICE Cc1ccc(CN(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)s1 1542374615 PVXLOEUNZHHVOE-HXUWFJFHSA-N 429.565 4.389 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](c3cccs3)N3CCN(C)CC3)c2C)c1 1542926556 FNVJHNFOPWCWJL-HSZRJFAPSA-N 436.625 4.183 10 10 IICE C[C@@H]1CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)CC1(C)C 1544370803 KYLVKVYJQPZPGO-OAHLLOKOSA-N 429.619 4.246 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc3cc(O)c(O)cc3s2)cc1 1544530039 URNBSUGZGMSHRN-GOSISDBHSA-N 426.538 4.200 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H]3CCC[C@@H]32)n1CCCSc1nccs1 1545892580 WPMQNPJNCSQTKA-WBVHZDCISA-N 448.662 4.214 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCC[C@H]1C(=O)N1c2ccccc2C[C@@H]1C 1556515673 HXFMSPDENKCKIO-DFQSSKMNSA-N 441.568 4.278 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)cc1 1557355664 ICIGLDYWUSDLOQ-JOCHJYFZSA-N 445.991 4.088 10 10 IICE CCOC(=O)C[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)cc1 1583672190 YULGPNRUPLGFRT-HSZRJFAPSA-N 436.483 4.470 10 10 IICE Cc1ccc(CN2C[C@@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1587461046 JBVQCKINWOSFMD-DEOSSOPVSA-N 429.564 4.110 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3cc(Cl)ccc3Cl)CC2)c(OC)c1 1595997534 VXKZNSRWMIHLAV-UHFFFAOYSA-N 439.339 4.128 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CNC(=O)OC(C)(C)C)C1CCCCCC1 1611430873 HTXOLROMDDEMSX-VQIMIIECSA-N 434.577 4.256 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2N(C)CCCC2(C)C)n1 1612187662 RFCFQKVYPQGVFF-QFIPXVFZSA-N 434.588 4.111 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@@H](C)OC3(CCOCC3)C2)cc1 1615374708 CGUPIIMMKASFAH-HXUWFJFHSA-N 441.620 4.070 10 10 IICE CC1(C)C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCO1 1616572773 MOCZSFSMXQOLOB-CYBMUJFWSA-N 429.318 4.303 10 10 IICE Cc1ccc(OCc2cccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2)cn1 1616858151 IFQQAYRDQHAWEL-VWLOTQADSA-N 432.568 4.068 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Cl)c(F)cc2Br)N(C)C)cc1 1616858154 IFUJZUIYQXAZJI-SFHVURJKSA-N 442.760 4.340 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@H]3CCCN(c4ccccc4)C3=O)c2C)cc1 1617210889 UGNNPYJPAVJPSN-DEOSSOPVSA-N 431.536 4.370 10 10 IICE CN1CCCc2cc(CNC(=O)C[C@@H](O)c3ccc(OCc4ccccc4)cc3)ccc21 1625847696 CDTKJEJQOMDEPU-AREMUKBSSA-N 430.548 4.388 10 10 IICE C[C@@H](NC(=O)c1ccc(NCCc2ccccn2)cc1)c1ccc(N2CCOCC2)cc1 1626978154 JVJMZVCGRNAUNC-HXUWFJFHSA-N 430.552 4.064 10 10 IICE CCN(CC)c1ccc(CNC(=O)COc2ccc(Br)cc2F)cc1F 1628769981 REBLNQZWBSTWQT-UHFFFAOYSA-N 427.289 4.269 10 10 IICE CC[C@]1(c2ccc(NC(=O)c3sccc3-n3c(C)ccc3C)cc2)CCC(=O)NC1=O 1631042263 WNHUQBSTMNTKRJ-XMMPIXPASA-N 435.549 4.492 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cc2)cc1 1634448518 TVGISHNKJUPUBN-GOSISDBHSA-N 437.565 4.353 10 10 IICE Cc1cccc(-n2ncc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2C)c1 1635940273 AUDIPQGVKRTCIM-FQEVSTJZSA-N 438.959 4.243 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@@H](c4ccc(F)c(Cl)c4)C3)C2)cc1 1636354355 XQWFPGUBVSABQQ-KSFYIVLOSA-N 447.938 4.097 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccccc3COc3cccc(C=O)c3)CC2)cc1 1636702264 KHTBFZRCFMUUGX-UHFFFAOYSA-N 444.531 4.439 10 10 IICE O=C(NCc1ccc(C2CCC2)cc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1638592984 ZGKZSWCZVWSAOH-UHFFFAOYSA-N 442.562 4.452 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCN(c4ccc(F)cc4)C3=O)cc2Cl)C1 1639534562 QYZCNQCHMGOCSK-JXFKEZNVSA-N 443.950 4.385 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)NCc2cccc(Br)c2O)CC1=O 1640083613 DVUNNTOBAUMQEA-HOCLYGCPSA-N 445.357 4.338 10 10 IICE COC(=O)/C=C/c1ccc(N2CC3(CC(OC)(OC)C3)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 1643213457 DHOLGWUUKQLROQ-YUAYGMJFSA-N 438.480 4.112 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](C(=O)NCc2c(O)ccc3ccccc23)(C(F)(F)F)C1 1645441181 VSLMMDPJOKUJHF-NRFANRHFSA-N 438.446 4.351 10 10 IICE Cc1cc(CC(=O)N2CCN[C@@H](Cc3ccc(F)cc3)C2)c(C)n1-c1ccc(Cl)cc1 1647962352 VDBRKOXFRPKRQJ-QHCPKHFHSA-N 439.962 4.472 10 10 IICE O=C(CN(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2)NOCc1ccccc1 1653580789 CBLJYFGUCAPATF-KPKJPENVSA-N 430.504 4.226 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)OCc2ccccc2)c1O 1658628108 YFHOOXSPGMTOAY-QPAOKJHLSA-N 427.928 4.496 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)Cc3cccc(F)c3)cc2Cl)C1 1680561727 FLWZLFSZPOXNKX-JXFKEZNVSA-N 433.955 4.118 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](c4ccn(C)n4)C3)cc2Cl)C1 1680561972 GVWFWBWLMMIVJW-HKUYNNGSSA-N 429.996 4.399 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 1681728875 CCHHEAODNJCVGG-IYARVYRRSA-N 445.604 4.401 10 10 IICE CCCN(CCC)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1709733749 YWDTUNBENPKAIZ-FQEVSTJZSA-N 429.634 4.010 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)OC)C1 1712051567 LZLKGNJHURBPOW-NRFANRHFSA-N 437.588 4.393 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc2c(c1)CCCN2C 1712515678 CUUZBXJKGZFPPH-SLFFLAALSA-N 441.620 4.058 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2Cc2ccc(Cl)nc2)cs1 1725255139 YOSFQDHDGMXRLP-UHFFFAOYSA-N 440.960 4.073 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN(C)[C@H](C)CC 1726985513 KFALRLJFFLMRLB-NHCUHLMSSA-N 442.652 4.247 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2cnn(C)c2)cc1 1728382753 YDCZJGCHNUSOIA-UHFFFAOYSA-N 433.560 4.111 10 10 IICE CCO[C@@]1(c2nnc(N(C)C3CCCCC3)n2Cc2ccc(N(C)C)cc2C)CCOC1 1728753849 GGGOUGMYUDDKPB-VWLOTQADSA-N 441.620 4.122 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@H](C)N(CC)C[C@H]2C)cc1 1746089805 HQWBOGGNHAFOAP-LEWJYISDSA-N 447.631 4.154 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@H](C)c3nccs3)CC2)cc1F 1748849761 XPAQRKAZYZNMMQ-INIZCTEOSA-N 444.580 4.136 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)CC[C@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1751843722 RRLCDSWSOMLNAA-FXAWDEMLSA-N 435.620 4.187 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCO4)n3CCCC(C)(C)C)CC2)cc1F 1768704817 OXKMTMQZTNHILR-OAQYLSRUSA-N 445.583 4.430 10 10 IICE CNC(=O)[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C)CCC1 1769117868 KHMXMGAQKHXUJX-SFHVURJKSA-N 448.615 4.361 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)c1ccc(C)s1 1857996804 GZBCEBCLACELNP-UHFFFAOYSA-N 435.502 4.480 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Cc3ccccc3)c3cccc(OC)c3)CC2)cc1 1858087346 SYNCCBFGJALBQY-SANMLTNESA-N 430.548 4.379 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](CNCc1cc(Br)ccc1O)C2 2126080572 APGOEETYMSYYDS-ZQIUZPCESA-N 425.367 4.280 10 10 IICE O=C(NN1C(=O)C(=Cc2cccs2)SC1=S)c1ccccc1Br 2296025058 BFNFEKPMJDRHPD-UHFFFAOYSA-N 425.354 4.057 10 10 IICE CCCN1C(=O)C(=C2SC(=S)N(CC(C)C)C2=O)c2cc(Br)ccc21 2296711430 ZCQDXMVFLDSNRT-UHFFFAOYSA-N 439.400 4.433 10 10 IICE COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(C=C2C(=N)N3C=C(C)SC3=NC2=O)c1C 2296807962 DQIVLLOVUOIWJI-UHFFFAOYSA-N 437.481 4.178 10 10 IICE COc1ccc(C=C2SC(=S)N(C[C@@H](c3ccc(OC)cc3)N(C)C)C2=O)cc1 2323879831 JSYPOLDYKXQNNW-IBGZPJMESA-N 428.579 4.208 10 10 IICE CCC(=O)Nc1ccc(S(=O)(=O)NCc2cc(C)n(-c3ccc(F)cc3)c2C)cc1 9527507 DGWVCLUOLOMGHJ-UHFFFAOYSA-N 429.517 4.060 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(/C=C3\NC(=O)N(Cc4ccc(F)cc4)C3=O)c2C)cc1 33348430 RIWYEYBKNLEYID-XKZIYDEJSA-N 447.466 4.113 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)Nc2cc(C(=O)N3CCCCCC3)ccc2OC)c1 729039627 OGAIYFZQGWATDM-MRXNPFEDSA-N 441.528 4.308 10 10 IICE CCN1CC[C@@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)[C@@H]1c1cc(F)c(F)c(F)c1 782749267 HFSXZJZBQDYNTG-OFNKIYASSA-N 442.485 4.472 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1125188670 TVIXLZMSUQBSMD-UHFFFAOYSA-N 437.606 4.034 10 10 IICE Cc1cc(C(=O)N[C@H](c2ccc(Cl)c(F)c2)c2nn[nH]n2)c(C)n1-c1ccc(F)cc1 1153820280 LTSJBERGRUSJEB-LJQANCHMSA-N 442.857 4.058 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1 1162107227 FLXILTMOWBKSGT-ODHYRZOZSA-N 431.536 4.172 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccncc3)Cc3cccs3)C2)cc1 1252116496 SCZVJGXTVZOCQP-HXUWFJFHSA-N 436.581 4.390 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2cnc3ccccc3n2)C1 1276403079 OKGANZNNXROHOX-JXOMPUQVSA-N 430.508 4.126 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3nc(-c4ccc(F)cc4)cs3)C2)cc1 1276832496 WHASRIJIMXZYOM-INIZCTEOSA-N 425.529 4.143 10 10 IICE Cc1cc(C(=O)N[C@H](C)CNc2ccccc2)c(C)n1-c1ccc(Br)cn1 1306698700 PAKQJGKTNDSTMS-CQSZACIVSA-N 427.346 4.482 10 10 IICE CN(Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1312834379 XQBNCCGLINPJFP-UHFFFAOYSA-N 444.309 4.450 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C1 1314271276 DJCBFRIDMROZTM-GMAHTHKFSA-N 441.620 4.072 10 10 IICE CC(C)Oc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1[N+](=O)[O-] 1350934113 YHZUMKRBDCAMGF-HZPDHXFCSA-N 445.491 4.065 10 10 IICE CC1=C(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOCCCO)CC1 1360883217 MCYRVHJEXQWGOB-UHFFFAOYSA-N 449.599 4.298 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1451059733 TUNQPPOWRKVDBW-UHFFFAOYSA-N 431.508 4.200 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1451108636 KJTYFBUKOPDULR-MJGOQNOKSA-N 443.548 4.491 10 10 IICE CCC(C)(C)OC1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1453530005 BRVSGJWOJIOPGB-WJDWOHSUSA-N 438.640 4.146 10 10 IICE CCc1ccc(CN2CCN(C(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)CC2)cc1 1462469906 JTGIDQWJUWKICH-UHFFFAOYSA-N 433.596 4.425 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(OC2CC2)cc1OC 1467631610 NYMKVTIIYVMTDH-UHFFFAOYSA-N 440.540 4.239 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCCc4c3ccc(=O)n4C)cc2Cl)C1 1469959558 KSNTXDDKBWDHJI-OXJNMPFZSA-N 442.991 4.152 10 10 IICE CCS(=O)(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1470214596 OIAZZQFRLUMYGS-UHFFFAOYSA-N 429.517 4.271 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CC2)cc1 1473295139 CCAIHUIEKSHLFG-INIZCTEOSA-N 436.383 4.392 10 10 IICE O=C(NCc1c(Cl)cccc1-n1ccnc1)N(Cc1ccccc1O)C[C@H]1CCCO1 1478717573 YUFRWDXTDFZNSG-GOSISDBHSA-N 440.931 4.122 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N2CCN(CC)[C@@H](C)C2)cc1 1501834138 IQWONDAXQJQJBR-IBGZPJMESA-N 436.604 4.271 10 10 IICE CNC(=O)[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC1(C)C 1503701950 BEDGZCASQRGTCR-FXAWDEMLSA-N 448.615 4.217 10 10 IICE CN(Cc1cccs1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1517154029 CEHQMHNTYUMGLF-UHFFFAOYSA-N 439.629 4.450 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CCC[C@H]3C)CC2)cc1F 1518307493 DPDKQJHFJAJYOI-QZTJIDSGSA-N 429.584 4.486 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)CCc4ccccc43)cc2Cl)C1 1524705182 UUOMEJRKVOWDBW-KRWDZBQOSA-N 425.960 4.172 10 10 IICE Cc1sc(Br)nc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533328096 GDGGHWDXPWFQIM-NSHDSACASA-N 446.317 4.214 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)cc1 1538161399 XCUAIFJTTMJFLT-UHFFFAOYSA-N 431.536 4.180 10 10 IICE CC[C@@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1545965408 XEVAUTYRJKHPDD-IBGZPJMESA-N 440.979 4.210 10 10 IICE Cc1cc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)c(C)n1-c1cccc(Br)c1 1556668425 DHRKHEBOGYIFDD-JOCHJYFZSA-N 430.390 4.415 10 10 IICE CCCCn1nc(C)c(-c2cc(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)n[nH]2)c1C 1557063070 CNISFHZFIQRLDL-QGZVFWFLSA-N 436.604 4.426 10 10 IICE CCOC(=O)c1sc(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)nc1C 1559125515 QCQJREORGHSHBJ-UHFFFAOYSA-N 425.466 4.380 10 10 IICE Cc1ccc(C(=O)N[C@@H](Cc2ccccn2)c2ccc(Br)cc2)c(O)c1O 1567809007 KWBJYMSBRNHNEU-SFHVURJKSA-N 427.298 4.278 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Cl 1588173003 JXLAAYJLMPNNJH-UHFFFAOYSA-N 438.977 4.175 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2CC(F)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613174855 ITWJXYYHYVSHFW-OSFYOIPJSA-N 443.611 4.233 10 10 IICE CN(CC(=O)N1CCN(c2ccccc2F)CC1)c1ccc(OCc2ccccc2)cc1 1617258741 DTQNWLVCPPGXCJ-UHFFFAOYSA-N 433.527 4.190 10 10 IICE CN(C[C@H]1CCOC1)c1nnc(Cc2ccccc2F)n1CCCSc1nccs1 1618135003 UVZQAOFETKIOFW-MRXNPFEDSA-N 447.605 4.120 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)NCc2ccc(N3CCSCC3)cc2)C1 1625970296 YEIFFJJZHYPSNL-OJLWIZQOSA-N 445.629 4.059 10 10 IICE CCNC(=O)Nc1cc(F)ccc1NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1629446366 LLLNBMOPYDLKLS-UHFFFAOYSA-N 426.492 4.437 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H]2CCC[C@@]2(NC(=O)OC(C)(C)C)C1 1636262267 DQAVIAPZQBJNLS-JVFUWBCBSA-N 444.620 4.081 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C)C[C@@H]3Cc3ccccc3)c2C)c1 1637578322 UVXMAXSCAROQCA-SANMLTNESA-N 430.596 4.471 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]3OCCC[C@H]3C2)sc(C)c1-c1ccccc1 1642219372 XGGFHMWPFJWIEC-RBUKOAKNSA-N 442.581 4.340 10 10 IICE COc1ccc([C@@H]2COCCN2C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1643339569 PXBMYACESXYVOE-VWLOTQADSA-N 432.520 4.058 10 10 IICE CCC[C@@H](C(=O)OCC)n1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1645133118 HXFGGZNTVUAFAH-NRFANRHFSA-N 436.512 4.260 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccccc2F)c(C)n1-c1ccccc1Br 1645516141 MZDTXDGCEBBJJG-QGZVFWFLSA-N 445.332 4.329 10 10 IICE COc1cc(N2CCOc3c(Cl)cc(Br)cc3C2)c([N+](=O)[O-])cc1OC 1651494881 DPHAHHXUFGLXFP-UHFFFAOYSA-N 443.681 4.427 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2ccccc2F)c(C)n1-c1ccc(Br)cc1 1652029009 DMVITTKUAHMFLG-IBGZPJMESA-N 445.332 4.329 10 10 IICE COc1cc(OC)cc(N2CCCN(Cc3ccc(N4CCC(OC)CC4)cc3)CC2)c1 1652903117 VQVKBRSYTVTADI-UHFFFAOYSA-N 439.600 4.031 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCc1ccc(Br)cc1O)C2 1665470780 GIFPDRZLYMJGGD-AYGBPOKTSA-N 425.367 4.422 10 10 IICE FC(F)(F)CO[C@@H]1CCCN(c2nnc(C3CC3)n2CCCSc2nccs2)C1 1698469219 RBCALBSWOYJSQW-CQSZACIVSA-N 447.552 4.342 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(N)=O)C1 1723045353 UCNAYPSCEWJNFU-FQEVSTJZSA-N 432.572 4.021 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)o1 1724346602 FVMYPSBUAXQMHC-UHFFFAOYSA-N 434.519 4.055 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@@H]3CCC[C@H]32)cc1 1728379304 QEYIQKFSKOTVBI-RBBKRZOGSA-N 438.620 4.080 10 10 IICE CC[C@@]1(C)CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)cc2C)C1 1744256950 OTNPRTYWNJUATL-VWLOTQADSA-N 435.620 4.189 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)C[C@@H](C)C1 1745877859 LIFLDWJPZQKBFU-KDURUIRLSA-N 448.615 4.313 10 10 IICE FC1(F)CCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)CC1 1770713340 XDQHBLQVNOOYBK-UHFFFAOYSA-N 436.557 4.138 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1772860360 UFLUSXZWGSTWNM-AUSIDOKSSA-N 441.620 4.011 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)[C@H](C)C(=O)N4)c(C)s2)cc1 1859574030 JXKPPWDPPJXMEX-LBPRGKRZSA-N 443.550 4.374 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1nc(-n2cccc2)sc1CCc1ccccc1 1860375371 SRXMZNJTSFLLAR-UHFFFAOYSA-N 433.533 4.103 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CN3CCN(C(=O)c4cccs4)CC3)cc2)c1 1860859424 GJMKHYWGXOVWLP-UHFFFAOYSA-N 448.592 4.024 10 10 IICE O=C(N[C@@]1(c2cc(Cl)cc(Br)c2O)C[C@H]1C(=O)O)OCc1ccccc1 1952821756 SBTKKBYBUNHJNT-SCLBCKFNSA-N 440.677 4.034 10 10 IICE COC(=O)c1nn(Cc2cccc(C(F)(F)F)c2O)c(C(F)(F)F)c1Br 2079200516 MOBRXBPUBMTSQL-UHFFFAOYSA-N 447.129 4.224 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](CNCc1cccc(Br)c1O)C2 2126082873 MFIQLMNZQVKWMX-QRTARXTBSA-N 425.367 4.280 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)c1cc(I)ccc1Br 2163081355 ZBQVIWHDHTUXRG-INIZCTEOSA-N 445.142 4.429 10 10 IICE COc1ccc(Br)c(CNC2(CNC(=O)OC(C)(C)C)CCCC2)c1O 2227747648 DDTJXQBHYKTUON-UHFFFAOYSA-N 429.355 4.090 10 10 IICE CC(C)Oc1ccc(C=C2C(=O)NC(=S)N(c3ccc(Br)cc3)C2=O)cc1 2294244543 WCWFJGINEIMFHI-UHFFFAOYSA-N 445.338 4.068 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 2294581505 UZBKFXNAPWWUJW-UHFFFAOYSA-N 443.843 4.303 10 10 IICE COc1ccc(C=C2SC(=S)N(c3cc(C(=O)O)ccc3C)C2=O)c(OC)c1OC 2297554604 KNUYISNLGCBQEB-UHFFFAOYSA-N 445.518 4.125 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)NCCc1ccccc1 2297554659 PFGSUVDBKFRZDQ-UHFFFAOYSA-N 428.554 4.166 10 10 IICE CCCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccccc2C)C1=O 2313547867 DWSYDANWMPLHKT-UHFFFAOYSA-N 443.297 4.213 10 10 IICE COCCN1C(=O)C(=Cc2cc3ccccc3nc2N2CCC(C)CC2)SC1=S 2314648364 XXDUAOCTNALGMO-UHFFFAOYSA-N 427.595 4.319 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)c4cccc(C)c4)c(C(=O)O)c3)CC2)cc1 64589631 WAEPZHVWILYXSP-UHFFFAOYSA-N 445.519 4.281 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccc(C)c(C)c3)=NC2=O)ccc1OCC(=O)O 210461346 IEFSLSAEFPEBPX-ODLFYWEKSA-N 426.494 4.248 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccc(F)cc3)C2=O)cc1 210714918 VHLBEBMUGWBNKO-QGOAFFKASA-N 430.526 4.454 10 10 IICE Cc1cc(/C=C\C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)c(C)n1-c1ccccc1 212150303 SEUBLMQGGQFVGR-SEYXRHQNSA-N 431.540 4.001 10 10 IICE CCCCC(CCCC)N/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O 214997731 SKCALVCPKXMROU-GHRIWEEISA-N 436.350 4.254 10 10 IICE CN1CCCc2cc(NC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccc21 743125807 MBAOWLYDNYYKDV-SFHVURJKSA-N 430.499 4.461 10 10 IICE CO[C@@H](C)c1cccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 751061757 YXGLRMCXFGXCSF-ZDUSSCGKSA-N 432.523 4.214 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)c1O 769498471 JAVSRDLPLILERI-UXPWSPDFSA-N 442.943 4.144 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(O)c(-c2nc3ccccc3s2)c1 776744483 VOVSUYAHEYPSFI-UHFFFAOYSA-N 434.930 4.165 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@](C)(Cc3ccccc3)C(C)C)CC2)cc1 1124585733 RNJMCJGHYXKFRD-HHHXNRCGSA-N 437.628 4.229 10 10 IICE COc1ccc(Oc2ccc(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)nc2)cc1 1130185926 WNDQHKFXDKQZQZ-GOSISDBHSA-N 433.508 4.147 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccco2)N(C)C)c(C)n1-c1ccc(Br)cc1 1135476654 VLBOMXICZPNHPS-LJQANCHMSA-N 430.346 4.482 10 10 IICE Cc1ccc(C(=O)N2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1137054013 NMVTYUPXNBEDTE-OAQYLSRUSA-N 439.556 4.296 10 10 IICE Cc1cc(Cn2nnc(C(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)c2C)no1 1137816768 QWYYHUVWGQKIHF-KRWDZBQOSA-N 431.496 4.040 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2cc(C)ccn2)cc1 1137817795 JOKKVXDQJGNLRH-UHFFFAOYSA-N 440.883 4.357 10 10 IICE Cc1cc(CCNC(=O)Cn2cc(C=O)c(-c3ccccc3)n2)c(C)n1-c1ccccc1 1150449197 DCTRIFGJUUPRKU-UHFFFAOYSA-N 426.520 4.129 10 10 IICE Cc1cc2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)ccc2n(C)c1=O 1159398110 VVVZRKAYIJWYLT-UHFFFAOYSA-N 427.504 4.248 10 10 IICE Cc1cc(C(=O)N[C@@H](c2ccccc2F)[C@H](C)O)c(C)n1-c1ccc(Br)cn1 1164548323 FQBJIMWZHYHXTM-VBKZILBWSA-N 446.320 4.243 10 10 IICE Cc1cc(C(=O)NCc2nc3c([nH]2)CCCC3)c(C)n1-c1ccccc1Br 1178922285 JOUUPEURIGZXTH-UHFFFAOYSA-N 427.346 4.389 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](OCC(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1291517169 QDLQOWCFBIQRSW-SIKLNZKXSA-N 425.621 4.474 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(=O)c(OCc3ccc(F)cc3)co2)cc1F 1293224721 GFKFQDXTSOJCDM-UHFFFAOYSA-N 442.462 4.273 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1300833491 DUHBUGZMXRYDIP-FQEVSTJZSA-N 443.592 4.045 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)CC(C)(C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1304195508 NECVKKNZBMLYKF-SFHVURJKSA-N 448.615 4.313 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H]2CCCO2)c(C)n1-c1ccccc1Br 1304200023 FQCNEQNNFNPLBU-ZWKOTPCHSA-N 447.373 4.267 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)CC[C@H]3C)n2CCCSc2nccs2)n1 1304751461 LSSIPDHPPHBVLP-DOTOQJQBSA-N 445.662 4.403 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1)OC 1305806294 FLIZDSKDEGJLFJ-YADHBBJMSA-N 437.588 4.393 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CCc3nncn3CC2)sc(C)c1-c1ccc(F)cc1 1352683160 JQIYRDSWHUWVGG-OAHLLOKOSA-N 442.516 4.222 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCNC(=O)c2cc3ccccc3[nH]2)cc1 1353013215 KIXYLCFOUSKGPM-UHFFFAOYSA-N 444.535 4.176 10 10 IICE C[C@@H](NC(=O)c1nccc2c(Br)cccc12)c1ccc(N2CCOCC2)cc1 1356164562 CZYMNIRQLWWILN-OAHLLOKOSA-N 440.341 4.325 10 10 IICE CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)NCc1cc(Cl)ccc1O 1452946329 NMQRLLVFZHFHKT-CYBMUJFWSA-N 427.975 4.026 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)COc2ccc3oc4c(c3c2)CCCC4)N(C)C)cc1 1463287971 ZTPVLCBMTITKAK-HSZRJFAPSA-N 435.568 4.176 10 10 IICE CC[C@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@H](O)c1c(F)cccc1F 1465917566 DLEQFGKNLMVNLK-REWPJTCUSA-N 430.495 4.425 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)cc2F)CC1 1528701648 NMPZIMYSGSYVSP-UHFFFAOYSA-N 449.492 4.334 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1535557557 BGEFLPVWZMLHFB-HNNXBMFYSA-N 442.922 4.301 10 10 IICE CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1542410719 ORXIEJIKQBGGBN-QHVZWZFWSA-N 429.630 4.330 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3scnc3-c3ccccc3)cc2F)C[C@@H](C)O1 1544675789 AQADIOMJPIDPKM-CALCHBBNSA-N 439.556 4.422 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccon2)n1Cc1ccc(N2CCSCC2)cc1 1545344822 ACVZWOQVFIVUQE-QGZVFWFLSA-N 426.590 4.018 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H]3Cc3cc(F)ccc3F)C2)cc1 1564962729 OKFSMKAHQBZWLM-UTKZUKDTSA-N 429.511 4.216 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1565161874 GOLDOUIBVCKUHS-NRFANRHFSA-N 425.573 4.400 10 10 IICE COC(=O)CCCc1csc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1566277838 KLYUBTHLIHEDPJ-UHFFFAOYSA-N 425.510 4.111 10 10 IICE Cc1cc(C(=O)N(C)CCN2C(=O)c3ccccc3C2=O)c(C)n1-c1cccc(Cl)c1 1567194644 ZBXRNEJLTMZZJP-UHFFFAOYSA-N 435.911 4.116 10 10 IICE CC(C)(C)[S@](C)(=O)=NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1584721477 BQGDFQYDVPKBER-YYFQYTQESA-N 430.642 4.152 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(OC(F)(F)F)cc3)CC2)cc1F 1595483544 WLLPWNMWBIOUKY-UHFFFAOYSA-N 440.437 4.359 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCO[C@@H]1CCCC[C@@H]1C 1614012355 QZCSJEROFYYPCS-NZQKXSOJSA-N 441.620 4.161 10 10 IICE COCCN(Cc1nc(N)c2c3c(sc2n1)C[C@H](C)CC3)c1ccc(OC)c(OC)c1 1615904118 AINNVBUGLNQMOO-CQSZACIVSA-N 442.585 4.069 10 10 IICE Cc1nn(-c2ccccc2)c2sc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cc12 1627463732 DQPAKXPUXHKYOH-QFIPXVFZSA-N 447.608 4.494 10 10 IICE Cc1ccc(C(=O)NC2CCC(O)(c3cccnc3)CC2)cc1-n1c(C)cc(C=O)c1C 1634561652 JOWMBSXABBKVER-UHFFFAOYSA-N 431.536 4.170 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1 1637122916 RXMFYNLAPTXPJF-UHFFFAOYSA-N 442.397 4.023 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(C(=O)NCC(C)(C)C)cc3)c2)CC1 1637939590 LFPXPLYYOBDLGN-UHFFFAOYSA-N 436.600 4.245 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1 1683046829 URZNGKKVNQPLNE-PWRODBHTSA-N 444.620 4.320 10 10 IICE CN(Cc1ccccc1C(F)(F)F)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686724028 ALLKQNNPQDWAFT-UHFFFAOYSA-N 443.416 4.162 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@H]3C)n2CCCOC(C)C)c(C)n1-c1ccccc1 1707273739 CDWSRYGQZVUZOC-HXUWFJFHSA-N 437.588 4.393 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1728045259 JMWNTZXAHLPHTP-SANMLTNESA-N 448.615 4.457 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc[nH]4)n3CC(C)(C)SC)CC2)cc1 1730182100 YMKBKHKLWYKQKM-UHFFFAOYSA-N 440.617 4.140 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CCC[C@H](O)C1 1747720684 PMJHVKKILPWKNZ-IRLDBZIGSA-N 425.621 4.363 10 10 IICE CCC[C@H](Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1763865521 HDGNMXLFBZFFGO-JOCHJYFZSA-N 434.588 4.392 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1765062006 AICONCYVHAAZGR-CTNGQTDRSA-N 425.621 4.376 10 10 IICE COc1ccc2[nH]cc(/C=C3/SC(=S)N(c4ccc(OC)c([N+](=O)[O-])c4)C3=O)c2c1 1860084653 ZEXAWWJQCSXCLL-CNHKJKLMSA-N 441.490 4.499 10 10 IICE CCN[C@H](c1ccc2c(c1)CCN2C)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044754826 PZURYZPXUYJBMJ-LADGPHEKSA-N 439.600 4.440 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)C1=Cc1ccc(-c2ccc3c(c2)C(=O)NC3=O)o1 2297311188 VNYOIGGGJNABRK-UHFFFAOYSA-N 425.444 4.253 10 10 IICE COc1cc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)ccc1OC(C)C 2297498997 HVQXVNPBATVIQY-UHFFFAOYSA-N 428.535 4.029 10 10 IICE CC(=O)c1ccc(N2C(=O)/C(=C\c3ccccc3OCCC(=O)O)SC2=S)cc1 16911436 VNZARQRGTNSTHO-LDADJPATSA-N 427.503 4.149 10 10 IICE CC[C@H](C)N(Cc1ccc(N(CC)CC)cc1OS(=O)(=O)CC)C(=O)NC(C)(C)C 36008663 YXSJZSAMYJSQJM-KRWDZBQOSA-N 441.638 4.370 10 10 IICE Cc1cccc(N2C(=O)N=C(O)/C(=C\c3c(C)nn(-c4ccc([N+](=O)[O-])cc4)c3C)C2=O)c1 59858103 UZCYHVUVMOOITP-UDWIEESQSA-N 445.435 4.212 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H](CCc3noc(C4CCOCC4)n3)C2)cc1 675023420 FBQLEJBMEPFETF-FQEVSTJZSA-N 448.567 4.466 10 10 IICE COc1ccc2nc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)ccc2c1 726564491 LVSBSUNGDYIMDL-UHFFFAOYSA-N 427.451 4.244 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1ccc(N3CC=CC3)cc1)O[C@@H](C)C2 740915404 PPVICHVWXNVLKW-HYVJGQCMSA-N 433.552 4.140 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 743415566 GEMIIPLGXSYYMZ-OAQYLSRUSA-N 425.573 4.203 10 10 IICE COC(=O)/C=C/c1ccc(N(Cc2cccc(C)n2)Cc2cccc(C)n2)c([N+](=O)[O-])c1 751232728 JTTKRVQAODPVLS-ACCUITESSA-N 432.480 4.395 10 10 IICE C[C@H]1CN(c2ccc(CN[C@@H](C)c3ccc(N4CCOCC4)cc3Cl)cn2)C[C@@H](C)O1 764945579 IVPHLIQTOTZZBB-OTWHNJEPSA-N 445.007 4.036 10 10 IICE Cc1cc(O)c(C(C)C)cc1NS(=O)(=O)c1ccc(CCNC(=O)CC(C)C)s1 769634312 SUELZDCWNNAXFP-UHFFFAOYSA-N 438.615 4.391 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](c3ccccc3)[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 771940105 NRFLNFLACQWJJG-ZUXGEGRZSA-N 441.547 4.016 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 773285554 NDYJKXKILLXUJD-SQJMNOBHSA-N 449.595 4.012 10 10 IICE C[C@H](N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(N2CCOCC2)c(F)c1 776931976 OROWHLNAWLTKPR-PGRDOPGGSA-N 432.543 4.327 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CN[C@H](c3ccccc3)c3cccc([N+](=O)[O-])c3)cc2)C1 779021497 ZMZBVVLBAFRINX-WIOPSUGQSA-N 444.535 4.176 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@H](c2ccco2)C1 1136805022 QWGWJEYODVEBJT-BRYHAGSVSA-N 430.526 4.026 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(I)cc(C)c1C 1140198369 AXVSMERIYYHXSC-UHFFFAOYSA-N 430.282 4.029 10 10 IICE O=C(CNC(C1CCCCC1)C1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 1197263876 FAWVPHZPAWHZJY-UHFFFAOYSA-N 445.623 4.397 10 10 IICE C[C@H](NC(=O)N1CCCC[C@H]1COC(=O)NC1CCCCC1)c1ccc(N(C)C)cc1 1226647198 RCNKNPFGKQYDQO-AVRDEDQJSA-N 430.593 4.437 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC[C@H](O)c2ccc(-c3ccccc3)cc2)N(C)C)cc1 1256236298 FLHAWPPBHKLBQR-UIOOFZCWSA-N 446.595 4.055 10 10 IICE CC1(C)CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CC(C)(C)O1 1289031384 ADUSIHBXCSSNNB-UHFFFAOYSA-N 444.630 4.373 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)CCCNC(=O)OC(C)(C)C)c1 1298460324 CKOOSNFLXFHRGD-MRXNPFEDSA-N 427.545 4.330 10 10 IICE Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1313304109 CPOAJKFCBLECFW-NBGIEHNGSA-N 448.611 4.380 10 10 IICE C[C@@](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)(C1CC1)C(F)(F)F 1354755275 POCQQQJEMXUMGH-RXEWJAMOSA-N 446.491 4.264 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@](C)(CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1355032539 WAXWNGQDRFQAEF-VWLOTQADSA-N 447.620 4.311 10 10 IICE CCCC[C@@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 1358428075 ILGDHXWYDKHDQW-HXUWFJFHSA-N 427.568 4.021 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2cc(F)ccc21 1434874073 VIXWWRUSWUVZLR-NPBUNYCVSA-N 444.528 4.360 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1csc(I)c1 1436853674 YLWAMJMEVMRHPZ-LBPRGKRZSA-N 428.339 4.088 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(F)ccc1I 1460979095 AQXOEODXEMEMJA-CYBMUJFWSA-N 440.300 4.166 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3sc(SCC(C)C)nc3C)C2)cc1 1461077751 PCRHOSGTTNKLNQ-QGZVFWFLSA-N 433.643 4.393 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CCc2ccc(C(N)=O)cc2)cc1 1464994784 AWUXJDRHKFJSQF-UHFFFAOYSA-N 431.536 4.026 10 10 IICE CCC(C)(C)[C@H]1CCc2nc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)sc2C1 1467889966 QGFWMJBMUUMMHQ-LBPRGKRZSA-N 437.587 4.014 10 10 IICE Cn1cc([C@H]2CCN(c3nnc(CC(C)(C)C)n3CCCSc3nccs3)C2)cn1 1517377234 VTZQPOUWGGSQDW-INIZCTEOSA-N 445.662 4.233 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3cc(Br)ccc3F)C2)cc1 1526247589 ZHBZITUVMJLPFQ-OAHLLOKOSA-N 435.337 4.172 10 10 IICE CC(C)c1nnc(N2CCOC(C)(C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1541369293 GNONZTQCHGEBBP-SFHVURJKSA-N 429.634 4.007 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCNc1ccc(C(F)(F)F)cn1 1542401975 VCVMAAAFCCJCHY-UHFFFAOYSA-N 430.430 4.162 10 10 IICE CSc1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)o1 1544267545 GBSMMHPBQJPAOR-SFHVURJKSA-N 433.574 4.372 10 10 IICE C[C@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccccc1O 1545681762 ALOBGCXGWCZOEX-QGZVFWFLSA-N 430.504 4.183 10 10 IICE CCCO[C@H]1CCCN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1559533494 MZSXRAFLMUJZHK-HKUYNNGSSA-N 434.536 4.070 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc(NCC)c(Cl)c1 1568378526 IDBJMUWSLMLGLN-UHFFFAOYSA-N 432.952 4.169 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccc(F)c(I)c1 1570027840 ZANHSOSLESHLQP-UHFFFAOYSA-N 440.039 4.373 10 10 IICE CC(C)(C)Cc1nc(-c2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc2)no1 1585535979 LETKNXANIPIBFY-UHFFFAOYSA-N 448.567 4.216 10 10 IICE O=C(CCC[S@](=O)c1ccc(Br)cc1)NCc1cccc(Cl)c1O 1606860795 UEZQMALPMYJGQX-DEOSSOPVSA-N 430.751 4.012 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)NCc1ccc(Cl)cc1 1615674049 CLSUZIFHHXKBGA-CYBMUJFWSA-N 425.754 4.335 10 10 IICE O=C(/C=C/c1cncc(F)c1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616573327 ULDYNUMRSPITPI-QPJJXVBHSA-N 438.260 4.345 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H](c3ccncc3)C3CCCC3)cc2F)C[C@@H](C)O1 1625089691 DSOLHYZRKFDWJA-RHGYRFJNSA-N 425.548 4.425 10 10 IICE Cc1ccc(C(=O)NC[C@]2(CO)C[C@H]2c2ccc(F)cc2)cc1-n1c(C)cc(C=O)c1C 1625096946 SSXXSHWFIQUUNB-OZXSUGGESA-N 434.511 4.250 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cn(Cc2ccccc2)nc1-c1cccnc1 1627026572 OLUAWARFURMJRK-UHFFFAOYSA-N 433.508 4.115 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(F)c(Br)c(Cl)c1 1630288101 RIPSTSBXJAXDLQ-UHFFFAOYSA-N 441.728 4.133 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3nc(C4CCCC4)cs3)cc2F)C[C@H](C)O1 1630555946 SLSPGSITDOZOLK-HOTGVXAUSA-N 431.577 4.412 10 10 IICE CN(Cc1ccc(Cl)cc1Cl)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1638479791 WJABFWQPMGBBPU-UHFFFAOYSA-N 449.382 4.037 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@H](c3ccc(F)c(F)c3)C2)N(C)C)cc1 1638918245 SOPXOXKOTTVHHT-AUSIDOKSSA-N 430.543 4.223 10 10 IICE Cc1cc(C(=O)Cn2cncc(Br)c2=O)c(C)n1-c1ccc(C(C)C)cc1 1640964366 VTXCSWSGYPNWRJ-UHFFFAOYSA-N 428.330 4.420 10 10 IICE Cc1cc(C(=O)N(C)CCCn2cnc3c(N)ncnc32)c(C)n1-c1cccc(C(C)C)c1 1643079278 MUWOWXQFMOMSSI-UHFFFAOYSA-N 445.571 4.102 10 10 IICE CC(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cn1 1643195968 ZCQMABOLPBZXBJ-UHFFFAOYSA-N 441.329 4.487 10 10 IICE Cc1ccccc1CN1CCC(NC(=O)CN(C)c2ccc(-c3nccs3)cc2)CC1 1646086124 ZQHHVUJIDUCGPZ-UHFFFAOYSA-N 434.609 4.336 10 10 IICE CC(C)c1ccc(-c2noc(CCC(=O)NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1 1646430973 HUPZMHIKJJDGAC-UHFFFAOYSA-N 448.567 4.070 10 10 IICE COC[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(Cl)cc1 1653449008 MCOCHCSKTBBETE-JOCHJYFZSA-N 448.906 4.031 10 10 IICE Cc1ccc(CC2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)CC2)cc1C 1684141857 OMJOIPCDMGATMI-UHFFFAOYSA-N 435.612 4.429 10 10 IICE CC(C)N(C)CC1CCN(c2nnc(C3CC3)n2CCCSc2nccs2)CC1 1692465200 LROPHHOCWXOQDX-UHFFFAOYSA-N 434.679 4.351 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC(N2CCCCC2)CC1 1707305359 XYKMBPFKWSJLDB-UHFFFAOYSA-N 438.664 4.354 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2C[C@H](C)C(F)(F)[C@H](C)C2)cc1 1710026443 ICONVYOZBVYMIN-WSTZPKSXSA-N 447.574 4.404 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC[C@H](OC(C)(C)C)C1 1751431764 LXPUVOUCRKHLRJ-NRFANRHFSA-N 436.604 4.480 10 10 IICE CC(C)c1nnc(N2CCC[C@H](C(F)F)C2)n1Cc1ccc(N2CCSCC2)cc1 1760920155 TZCFVQOHXPWXMY-SFHVURJKSA-N 435.588 4.485 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1)OC 1763857929 NZPCAQSQVIRKMP-FGZHOGPDSA-N 437.588 4.393 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1 1769198195 OOCRYHOCUCVQDT-AVRDEDQJSA-N 437.588 4.250 10 10 IICE COC(=O)c1c(C(F)(F)F)nn([C@@H](c2ccc(C)cc2O)C2CC2)c1Br 2079038291 YCULXPTVWYIJHG-CYBMUJFWSA-N 433.224 4.464 10 10 IICE C[C@@H](N)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)cc1Br 2144880459 UWDHQKPOCUVOER-GOSISDBHSA-N 432.406 4.198 10 10 IICE CCN(CC)c1ccc(C=C2C(=O)NN(c3ccc(Cl)c(Cl)c3)C2=O)cc1[N+](=O)[O-] 2293544011 LZMQGEIGGNFJFI-UHFFFAOYSA-N 449.294 4.209 10 10 IICE CCSc1nnc(-c2ccccc2NC=C2C(=O)N(c3ccccc3)N=C2C)c(O)n1 2297313301 XIOTVQHADGDTLL-UHFFFAOYSA-N 432.509 4.075 10 10 IICE COC(=O)COc1ccccc1C=C1SC(=S)N(CCCc2ccccc2)C1=O 2297359838 AUAPPFQORUTSBW-UHFFFAOYSA-N 427.547 4.072 10 10 IICE C[C@H]1CN(C2=NC(=O)C(=Cc3cn(-c4ccccc4)nc3-c3ccncc3)S2)C[C@H](C)O1 2314457984 ZMSDAPPANQSZRZ-IRXDYDNUSA-N 445.548 4.014 10 10 IICE O=C(O)Cc1ccc(N2C(=O)C(=Cc3cccc(Br)c3)SC2=S)cc1 2314531903 FQGNKBJOVHNNBG-UHFFFAOYSA-N 434.336 4.482 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccccc3)C2=O)ccc1OCCC(=O)O 2314933690 CJXGECXMPBMGFF-UHFFFAOYSA-N 443.546 4.340 10 10 IICE COc1ccc(N2CCN([C@@H](c3cccs3)[C@@H](C)NC(=O)c3ccco3)CC2)cc1 4057492 YALGGFXFIBVQKV-VGOFRKELSA-N 425.554 4.032 10 10 IICE O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccc(-c2ccccc2C(=O)O)o1 33679314 MMXKHPDFFPKFKN-GDNBJRDFSA-N 443.242 4.413 10 10 IICE O=C(COc1ccc(/C=C2\SC(=S)N(Cc3ccco3)C2=O)cc1)N1CCCCC1 39793781 DKUAZVMPDQYZRE-UYRXBGFRSA-N 442.562 4.072 10 10 IICE O=C(N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@@H]1CC(=O)N(Cc2ccco2)C1 69260835 RWCHKSPCJPPPRZ-IBVKSMDESA-N 440.499 4.393 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3cc(Br)cc(F)c3O)CC[C@H]2C1 715788869 MTWRVGKLGICJQY-JGGQBBKZSA-N 443.357 4.419 10 10 IICE CCN(Cc1ccccc1NC(=O)NCc1cccc(OC)c1O)C(=O)OC(C)(C)C 737021344 YHUUMVKCWSQCMR-UHFFFAOYSA-N 429.517 4.480 10 10 IICE Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)nc(C)n1 755160221 CUCZQOQJSHYURW-UHFFFAOYSA-N 429.423 4.142 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(N2CCOC2=O)cc1 773143680 CBOCBIRLCSLZLI-FQEVSTJZSA-N 434.584 4.026 10 10 IICE CCN1CC[C@@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)[C@H]1c1cc(F)c(F)c(F)c1 782749265 HFSXZJZBQDYNTG-NFBKMPQASA-N 442.485 4.472 10 10 IICE CCOC(=O)c1csc(CCNC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n1 786727886 PXWKWLOVDSWSHG-UHFFFAOYSA-N 444.601 4.131 10 10 IICE CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 786800446 AZZPKLUQMLSGRM-FQEVSTJZSA-N 438.538 4.091 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccn(C2CCCCC2)n1 791525696 SQQFJQUBUDJZML-UHFFFAOYSA-N 436.478 4.174 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2CCC(F)(F)C2)NC(=O)OC(C)(C)C)cc1 797892395 FVRHONHYFNXXSD-MAUKXSAKSA-N 425.520 4.260 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC[C@H](CNC(=O)CC(F)(F)F)C1 804201791 GUGNAPSHOPZLHO-OAHLLOKOSA-N 427.492 4.076 10 10 IICE O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1CNc1cccc(Br)c1 1084420328 PRZAIWUHFSNCRV-FRKPEAEDSA-N 449.351 4.449 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1cc(Cl)ccn1 1125693116 ZFEGLQBZUMBEIE-SXGWCWSVSA-N 436.917 4.209 10 10 IICE COc1ccc(N2CCC(NC(=O)C3(NC(=O)OC(C)(C)C)CC4(CCC4)C3)CC2)cc1 1125816477 MHAQZJIQVMJPPD-UHFFFAOYSA-N 443.588 4.008 10 10 IICE CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1142627737 XBSIYCZBEBYSQX-CQSZACIVSA-N 443.544 4.085 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1[C@@H]2Cc3ccc(Br)cc3[C@@H]21 1230199974 FHNMGYKTWPZWNU-ITGOXPRASA-N 442.401 4.392 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@H]3c3noc(C(C)C)n3)c2C)c1 1254074338 OZZDNQGOYAPFGB-NRFANRHFSA-N 437.544 4.192 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCc3ccc4c(c3)CCCC4)cc2F)CC1 1265011842 DIUMXEZGILVVQN-UHFFFAOYSA-N 437.603 4.486 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cccc(OCCCN(C)C)c2)CCCC1 1265223711 BNSDHCQFRBHOAX-UHFFFAOYSA-N 435.568 4.498 10 10 IICE CSc1ccc(N2C[C@@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1287662381 ZTPZGYFKOBSUBD-FQEVSTJZSA-N 433.577 4.485 10 10 IICE O=C(Nc1cc(Cl)ccc1NS(=O)(=O)c1ccccc1F)c1cc(O)cs1 1290797387 GQVVLQWPMYJVKJ-UHFFFAOYSA-N 426.878 4.299 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)CC3(C)C)cc2)CC1 1293145108 MLOWOYWZGCQRDP-OAQYLSRUSA-N 429.605 4.432 10 10 IICE CC[C@@](O)(C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1294858228 BLVTZURWPXUHKS-KNQAVFIVSA-N 437.367 4.077 10 10 IICE CCN1C[C@@H](C)N(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@H]1C 1295985283 QYZYFYJDHBYUPM-HZPDHXFCSA-N 446.646 4.404 10 10 IICE CC[C@@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1306388333 VNOJKUYODIJGPJ-GHTZIAJQSA-N 429.634 4.007 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOc4ccc(O)cc4C3)cc2Cl)C1 1312591758 ZGONVHLMYJIIRC-MRXNPFEDSA-N 429.948 4.386 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC2CC2)n1CC[S@](=O)C(C)(C)C 1314737775 VAELLQNGQWGHAL-HKBQPEDESA-N 443.661 4.014 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C 1315728778 BGCPMPPRXZSUIP-HRAATJIYSA-N 443.592 4.045 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1442312837 GVNDIRPZAJMRDZ-FXAWDEMLSA-N 425.573 4.260 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3cc(C(F)(F)F)ccc3Cl)c2)CC1 1456658921 AGHNXOCQXOCBHN-UHFFFAOYSA-N 425.838 4.313 10 10 IICE C[C@@H]1CN(C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)c2cc(Br)ccc2O1 1459595599 XUNOZXIQMYMXRM-IUODEOHRSA-N 437.334 4.177 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C/C=C/c2ccc(Br)cc2)N(C)C)cc1 1463279701 JNWULSCEAHBIFO-YAQIIAKESA-N 430.390 4.338 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H](CCNC(=O)OC(C)(C)C)C1 1470556561 XILSXNPMRMMVCV-WOJBJXKFSA-N 446.636 4.328 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(OCc4ccccc4)cc3)C2)cc1 1470772296 JIAMHYUHCDBGDH-JOCHJYFZSA-N 431.536 4.352 10 10 IICE C[C@H](NC(=O)c1ccccc1SCc1nnnn1-c1ccccc1)c1ccccc1O 1471194874 PWBJCEATHLAIIS-INIZCTEOSA-N 431.521 4.151 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(CC3CC3)C3CCCCC3)cc2F)C[C@@H](C)O1 1473148011 XTPQNCJSYZUTLW-RTBURBONSA-N 431.596 4.100 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCC(=O)NC(C)(C)C 1495110671 GAJCLPDLIMHZFY-IBGZPJMESA-N 440.636 4.333 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H](C)Cc1cccs1 1499154543 SSOUBUOAKSENQO-QGZVFWFLSA-N 443.592 4.255 10 10 IICE CCc1nnc(N2CCC[C@@H](n3nc(C)cc3C)C2)n1CCCSc1nccs1 1513891148 FGMKTLKYKOLKJI-QGZVFWFLSA-N 431.635 4.134 10 10 IICE Cc1cnc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1516530921 DBFJMFKXKMAQPO-CDCQXCROSA-N 435.571 4.059 10 10 IICE COC1CCC(CCn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CC1 1518557530 VQBGHEYEIOLGPP-CKHPTIKVSA-N 428.577 4.109 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(OC)CCCC1 1519089891 WNLLIGXOYNNVQI-UHFFFAOYSA-N 437.588 4.394 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@@H](C)C1 1519144617 OCRNMVNJGKQVHS-XLIONFOSSA-N 429.584 4.125 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1 1541040836 AXUOQBDQEFXHIA-UHFFFAOYSA-N 430.596 4.080 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2ccccc2C(F)(F)F)CCCC1 1545584957 LBTKZVOXBZJYDX-QFIPXVFZSA-N 446.469 4.397 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COc1ccc2c(c1)CCC(=O)N2 1546150903 ZXNYZEQLAVPVPM-GOSISDBHSA-N 430.504 4.446 10 10 IICE CO[C@H](Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1554658196 GNNGLIQXFFNRIC-XMMPIXPASA-N 448.615 4.172 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2cc(F)cc(Cl)c2)cc1 1556455494 MSUJLLHJTWOVTI-JOCHJYFZSA-N 428.891 4.091 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H]2CCCO2)c(C)n1-c1cccc(Br)c1 1558606725 DHFRAUFUIRAAMP-VQTJNVASSA-N 447.373 4.267 10 10 IICE COc1cc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 1559072371 AZLRXHIDEAKBLK-UHFFFAOYSA-N 441.406 4.080 10 10 IICE CC1(C)[C@H](c2ccccc2)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1564895642 PNCQWPHGLKBFRE-IBGZPJMESA-N 429.511 4.279 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(c4cccc(C(F)(F)F)c4)C3)C2)cc1 1564962501 LWJJRVXWQBNDNZ-INIZCTEOSA-N 433.474 4.349 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(C(F)(F)F)c1O 1566356554 HZWBSLDHWNHVPR-AWEZNQCLSA-N 428.838 4.164 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccn3cc(C(F)(F)F)nc23)cc1 1583920217 YWRXANOSGTULGR-SFHVURJKSA-N 446.473 4.241 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1[N+](=O)[O-] 1597260462 MUVIRCWLTNPKHJ-UHFFFAOYSA-N 445.273 4.421 10 10 IICE CC[C@H]1CCCN1c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1614159865 XZGOOWDIOHUMKK-SQJMNOBHSA-N 441.620 4.120 10 10 IICE CC(C)c1cncnc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1617062540 RBDZPKGEOSUZJP-OQLLNIDSSA-N 432.596 4.282 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1620254331 FSMICHGEHLJCLX-CVEARBPZSA-N 439.676 4.490 10 10 IICE Cc1cc(C(=O)NCCOc2ncccc2F)c(C)n1-c1ccc(Br)cc1 1623361605 XGLMHSFOXILQQT-UHFFFAOYSA-N 432.293 4.200 10 10 IICE O=C(Nc1cccc(Cl)c1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1624229235 WYBVAHIXIVWCAE-UHFFFAOYSA-N 447.856 4.007 10 10 IICE Cc1nc([C@H](NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)c2cnn(C)c2)no1 1628637353 OJDBHGTYUZYVSL-JOCHJYFZSA-N 432.528 4.162 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](CN1CCCC1)c1ccccc1 1629055399 IWNCBAIMUPOIOR-NZQKXSOJSA-N 443.538 4.253 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CC[C@H](NC(=O)OC(C)(C)C)CC3)ccc21 1630930747 WAFHGWAMSJQNHT-MXVIHJGJSA-N 443.588 4.470 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C(F)(F)c1ccc(OC)cc1 1635489283 RFZUHBLAVFEOMG-UHFFFAOYSA-N 434.483 4.176 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 1636848115 UNESZCZJEOOYRZ-FQEVSTJZSA-N 444.579 4.186 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cc(=O)c(OCc2ccc(F)cc2)co1 1638305731 NPAGICWGVMAKDT-UHFFFAOYSA-N 438.238 4.300 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)c2cc(O)cs2)C1 1641085746 WCMPHEHZPKVAJU-CRAIPNDOSA-N 434.533 4.363 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1642107459 SPAAEVRCYIYERZ-APWZRJJASA-N 426.561 4.112 10 10 IICE Cc1cc(C(=O)CSc2nnnn2Cc2cccs2)c(C)n1-c1cccc(F)c1 1656151671 QJSCSFXWXCESBL-UHFFFAOYSA-N 427.530 4.305 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 1683165998 INFKWVCVYFMSOS-CTNGQTDRSA-N 427.976 4.437 10 10 IICE CN(Cc1ccccn1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1696702653 FOGBBSGJONGYCW-KRWDZBQOSA-N 430.603 4.190 10 10 IICE C#CCSCCn1c(Nc2cnn(C)c2)nnc1-c1cc(C)n(-c2ccccc2)c1C 1705665553 XOHUOQFJZFYKAC-UHFFFAOYSA-N 431.569 4.196 10 10 IICE Cc1cccc(OCc2nnc(N3CCOC[C@H]3C)n2CCCSc2nccs2)c1 1707630683 DZOMHDWJWASKPE-QGZVFWFLSA-N 445.614 4.030 10 10 IICE Cc1ccc(-c2nnc(N3CCN(C(C)(C)C)CC3)n2Cc2ccc(N(C)C)c(F)c2)o1 1724318536 KUVKCMCACULVQR-UHFFFAOYSA-N 440.567 4.020 10 10 IICE CC1CCN(c2ccc(Cn3c(-c4cnccn4)nnc3N(C)CCC(F)F)cc2)CC1 1762950202 QCYCGZWHHXXEIR-UHFFFAOYSA-N 441.530 4.111 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCCCN(C)C)C(=O)N(C3CCCC3)C2=O)cc1 1873167403 FXALBFSNSRLUDB-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CC[C@H](NC[C@@H]1[C@H]2C[C@@H]2CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 1906022755 DUSZTTAQKKNCFD-NQZOLGFYSA-N 425.367 4.451 10 10 IICE CCN[C@H](c1ccccc1O)[C@@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 1942402001 YSGMQWZNIFCWJE-RCZVLFRGSA-N 425.573 4.212 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]2[C@@H]1CNCc1cc(Cl)cc(Br)c1O 2078327244 AZCQZGXAJJILER-LNSITVRQSA-N 431.758 4.153 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C3(C)CC3)c(N)c2I)c(O)c1 2079021728 HSIKIMXKXIUIFM-HNNXBMFYSA-N 425.314 4.381 10 10 IICE CCc1nn(Cc2ccc(Br)cc2O)c(I)c1C1CC1 2079635873 SLHSMLMYVMDUIC-UHFFFAOYSA-N 447.114 4.444 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C(F)(F)F)c(C(=O)O)c2Br)c(O)c1 2079845126 QECZEMWCHIWUMD-LBPRGKRZSA-N 437.212 4.322 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(NCc2cc(Br)ccc2O)C[C@H]2CC[C@H]1C2 2131762159 ZNZGELWXWGHENZ-KPHUOKFYSA-N 425.367 4.328 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C=C3NC(=O)N(Cc4ccccc4F)C3=O)c2C)cc1 2297316350 AOSKNOWFRHMAEE-UHFFFAOYSA-N 447.466 4.113 10 10 IICE CCOc1cc(C=C2C(=N)N3C=CSC3=NC2=O)ccc1OCc1ccc2c(c1)OCO2 2297317060 DFCLZAVQQXKXJA-UHFFFAOYSA-N 449.488 4.170 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)C2=C(C)NC[C@H]2CCCO2)cc1 2313683387 YWYVEMBZYCRXLA-GOSISDBHSA-N 448.548 4.098 10 10 IICE CCOc1ccc(C=C2SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)cc1OC 2323758220 CDUAKOGWCGQYPS-UHFFFAOYSA-N 429.519 4.224 10 10 IICE CCN(CC)CCN1C(=O)C(=Cc2cc(Cl)cc(Br)c2O)SC1=S 2323790200 XDNHTIIPJNIYOO-UHFFFAOYSA-N 449.823 4.351 10 10 IICE Cc1nc2scc(C)n2c1C=C1SC(=S)N(Cc2cccc(C(=O)O)c2)C1=O 2326973111 GLMRCHJUCNQWLQ-UHFFFAOYSA-N 429.548 4.112 10 10 IICE Cc1ccc(CNC[C@@]23CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352940312 DAYMHCHBWNGQIK-MGPUTAFESA-N 425.367 4.200 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1cc(Br)cc(F)c1O)[C@H]2F 2358241765 UOMXYRQLWGYAND-SYAUCNOPSA-N 447.320 4.262 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(OC)c2)C(=O)/C1=C/c1ccc(SC)cc1 33313666 HIBSYAHMJJWYIM-LDADJPATSA-N 425.506 4.303 10 10 IICE COc1cccc([C@@H]2CN(C(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)CCO2)c1 444273297 MTUXHIDROFCMFW-SANMLTNESA-N 447.579 4.017 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](Cc3nccn3C)c3ccccc3)ccc21 608208422 NQSJMOXFFPXRAC-QHCPKHFHSA-N 430.552 4.352 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@H](NCc1cccc(Br)c1O)C2 701066794 SQQKKKOJQLQOFH-DBVUQKKJSA-N 445.357 4.434 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc3c(c2)NC(=O)CCN3)c(C)n1-c1ccc(F)cc1 729719521 VMYMCOBJBCOXTK-UHFFFAOYSA-N 435.455 4.027 10 10 IICE Cc1cc(CCNC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)c(C)n1-c1ccccc1 746426871 RNZCGDRERFHZPJ-UHFFFAOYSA-N 430.957 4.124 10 10 IICE CO[C@H](C)c1nc(C)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 749402913 RRFWSXQVPPWNHF-KGLIPLIRSA-N 425.501 4.159 10 10 IICE O=C(O)c1cccc(N2C(=O)/C(=C\c3cnc(-c4ccccn4)s3)SC2=S)c1 753134562 JOQDBJRHSXKPNK-OQLLNIDSSA-N 425.516 4.309 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2cc(I)ccc2n1 794883123 SMEOMYJIAHHFOV-UHFFFAOYSA-N 445.304 4.178 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CCc2ccccc2C1 914439558 KXGGBKPWFBSCSH-SQFNAUOLSA-N 442.631 4.403 10 10 IICE COCCCNC(=O)c1cccc(N2C(=O)/C(=C/c3ccc(C)cc3)SC2=S)c1 1088613793 SULJDKNFWCRYEO-UYRXBGFRSA-N 426.563 4.167 10 10 IICE CC(C)COc1ccc(C(C)(C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1129661288 IZHAZHGFWBVFJC-UHFFFAOYSA-N 446.538 4.430 10 10 IICE CC[C@H](c1cccc(OC)c1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1170028107 YBYAKCADPBCLCH-HSZRJFAPSA-N 442.515 4.492 10 10 IICE C[C@@H](NC(=O)c1nn(-c2ccc(Cl)cc2C(F)(F)F)cc1O)c1ccccc1O 1171723271 QVYKKMGCXKIRBF-SNVBAGLBSA-N 425.794 4.447 10 10 IICE Cc1cc(C(=O)NCc2cccc(N(C)S(C)(=O)=O)c2)c(C)n1-c1ccc(Cl)cc1 1180265761 BHANNVKJEZZLPA-UHFFFAOYSA-N 445.972 4.073 10 10 IICE C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1264610745 MLPNZANKMDBYPQ-CYBMUJFWSA-N 432.457 4.490 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCN1CCSCC1 1291443076 QVJOSGFFBMTDED-HXUWFJFHSA-N 442.677 4.077 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(OCc4ccccc4)c3)cc2F)C[C@H](C)O1 1291755269 CBBPQZYZPDMNST-OALUTQOASA-N 449.526 4.343 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H](c3ccc(Cl)cc3Cl)N3CCOCC3)ccc21 1292206995 ORKPFXYCHFDOHR-QFIPXVFZSA-N 448.394 4.066 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@]3(C(F)(F)F)CCN(Cc4ccccc4)C3)ccc21 1292207292 SQTPBDKIXKRYEO-HSZRJFAPSA-N 431.502 4.140 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(CCOc2ccccc2Cl)C1 1297004897 CEYNNRIGFRCJEN-IBGZPJMESA-N 444.959 4.102 10 10 IICE CN(C[C@@H]1CC=CCC1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1298500656 NRGKXGVJAJSWRI-MRXNPFEDSA-N 427.603 4.167 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCO[C@H](c2ccco2)C1 1304238517 SSQUSGOPJLOXID-QFIPXVFZSA-N 437.588 4.460 10 10 IICE CCC[C@@](C)(O)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1306542905 PJFCAFXDYQQTON-AREMUKBSSA-N 448.615 4.052 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@H]2C(=O)Nc3c(F)cccc32)sc2c1CCCCC2 1350512364 SYQFBWOJSGUKPE-CQSZACIVSA-N 430.501 4.397 10 10 IICE CCc1nc2ccccc2c(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)c1C 1351458319 VUEZVAXYMRCVDS-UHFFFAOYSA-N 446.595 4.056 10 10 IICE COc1ccc(-c2nc(C)sc2CC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1435578498 SNPORDIKHUQSPL-UHFFFAOYSA-N 437.565 4.027 10 10 IICE Cc1ccc([C@H](CN2CCOCC2)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1440683912 NEICPWAFGIGMJJ-VWLOTQADSA-N 435.543 4.345 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)N2CCCC2)C(C)C)c(C)n1-c1ccc(Br)cc1 1452301740 AIEXQGAXOWBDDD-FQEVSTJZSA-N 446.389 4.233 10 10 IICE CCCCN(Cc1ccc(N2CCCCC2)c(C)c1)c1c(O)nc(=O)n(CCCC)c1N 1459749092 VYGWETOHAPYRRQ-UHFFFAOYSA-N 441.620 4.437 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CCN1C1CCCCCC1 1471114443 FRRXDNLHORRCTF-IBGZPJMESA-N 438.410 4.483 10 10 IICE CCCCO[C@H]1C[C@@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(C)C 1473259613 KJFGIIJVJOQHLT-PKTZIBPZSA-N 448.563 4.316 10 10 IICE C[C@H]1Cc2cc(Cl)ccc2N1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1473901912 NRIURCJSIZISIW-GVDBMIGSSA-N 445.966 4.160 10 10 IICE CCc1nnc(N(C)Cc2ccc(Br)o2)n1Cc1ccc2c(c1)CCCN2C 1513787393 CWIDWRJBCZWIMJ-UHFFFAOYSA-N 444.377 4.263 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cc4c3OCCO4)cc2Cl)C1 1524244264 BZZSYSIKOSOFQN-CQSZACIVSA-N 445.903 4.186 10 10 IICE CCCc1c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cnn1-c1ccc(C)cc1 1527715304 UNYUKHLEUHFIKB-UHFFFAOYSA-N 432.568 4.494 10 10 IICE C[C@@H]1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCC1=O 1539360779 HAKPITNIENXGDH-OLZOCXBDSA-N 427.302 4.103 10 10 IICE Nc1cc(C(F)(F)F)ccc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1544435708 WJKIYGPLVFDRKX-UHFFFAOYSA-N 447.379 4.073 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](CN3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1545424636 FAXSMHXWLPIRJA-CTNGQTDRSA-N 442.627 4.357 10 10 IICE CCOc1ccc(C[C@@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1545632278 HFVVAXGIJIPZPV-DYESRHJHSA-N 430.976 4.404 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2cnccn2)n1CCCC(C)(C)C 1554159433 DVRJQGZQNXWZQD-UHFFFAOYSA-N 449.603 4.034 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CC[S@](=O)C(C)(C)C 1554160222 RZNYZJWCUOFCII-HKBQPEDESA-N 445.677 4.359 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1N(C(=O)OCc2ccccc2)CC1(C)C 1557063273 JPYUZWVYTQYFBI-CVDCTZTESA-N 437.584 4.155 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C2CCC2)cc1 1564895778 ULJMCPUKCAOJTR-QFIPXVFZSA-N 445.510 4.151 10 10 IICE COc1ccc(CN(CCO)C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)c(OC)c1 1567075207 MOQXNJQCDYBQRJ-UHFFFAOYSA-N 442.943 4.399 10 10 IICE CNC(=O)OC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1570017401 MSVBGLZBFQXQRU-GOSISDBHSA-N 448.361 4.207 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](C)Cc2ccc(F)c(Br)c2)cc1 1586648822 COVALFWUZCNBLB-OAHLLOKOSA-N 437.353 4.370 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1598187355 LRKFSWIUUFJYOI-UHFFFAOYSA-N 441.373 4.460 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1C[C@H](C)O[C@H](C(F)(F)F)C1 1611963527 SPUDLGVQZVUEFF-LPHOPBHVSA-N 439.526 4.055 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1613037472 JSMCRPPUTIPOSY-RBUKOAKNSA-N 443.661 4.082 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(=O)c2ccc(Cl)cc2o1 1622635042 OYJKNXQJVJYTME-MRXNPFEDSA-N 447.318 4.200 10 10 IICE Cc1csc(N2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)n1 1624315796 SOWAFUHVUYAPNQ-UHFFFAOYSA-N 428.989 4.404 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4cc(Br)sc4[nH]3)C2)cc1 1630618982 PSBCGLUBLVVMQO-LBPRGKRZSA-N 434.359 4.257 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1CCN(c2ccccn2)CC1 1631531164 JFZBTDZKYNSMIY-JOCHJYFZSA-N 444.579 4.089 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](COC(C)C)C2)c(C)n1-c1ccccc1Br 1633322131 ZKQGYHRSZIKEFU-KRWDZBQOSA-N 435.362 4.123 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1634184701 AFJSWEHKNFXYPZ-AREMUKBSSA-N 432.520 4.157 10 10 IICE Cc1cc(C(=O)N2CCC3(CCCCO3)CC2)c(C)n1-c1ccc(Br)cn1 1636638668 XAOWTFIUZHZCRK-UHFFFAOYSA-N 432.362 4.427 10 10 IICE CC(C)c1ccc(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 1652700034 LAAYKKAEFLFAQK-OALUTQOASA-N 427.564 4.315 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1 1683046828 URZNGKKVNQPLNE-PCCBWWKXSA-N 444.620 4.320 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@@H]1C 1695815323 WWYKQJVOPNYNKR-VQTJNVASSA-N 438.664 4.216 10 10 IICE CSc1cc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)ccn1 1698374193 ZBOUQSXKVCXLEV-UHFFFAOYSA-N 437.594 4.438 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCN(CCC(C)(C)C)CC1 1707306327 ZCFWOCQYCKKDLW-UHFFFAOYSA-N 438.664 4.212 10 10 IICE CCOCc1nnc(N2CCCN(C(C)(C)C)CC2)n1Cc1ccc(N(CC)CC)cc1 1710721998 PHFBLFYZXLCGOC-UHFFFAOYSA-N 442.652 4.020 10 10 IICE CN(CCC(F)F)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1729496572 NYCBJILPAMCWHQ-UHFFFAOYSA-N 444.555 4.033 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCN(C(C)(C)C)CC1 1742141713 MBOBFFOAKNOTCV-UHFFFAOYSA-N 438.664 4.354 10 10 IICE Cc1cccc(N(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)c1 1742143273 TYMKDUKOQYRGEP-UHFFFAOYSA-N 425.587 4.394 10 10 IICE CCc1nnc(N2CCN([C@@H](C)c3ccsc3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1744690699 RLXKRPGEYKJFEV-KRWDZBQOSA-N 442.608 4.039 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC[C@H](C)C1 1752066505 WFCYNWUDOMOJHI-FPOVZHCZSA-N 438.620 4.089 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CCOC(C)(C)C)CC2)cc1F 1770257785 GEECVTSUEFCPEG-UHFFFAOYSA-N 447.599 4.156 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)Oc1ccc(CNC(=O)C2CC2)cc1 1858893370 UDJBZDAVPYCYMC-UHFFFAOYSA-N 440.455 4.099 10 10 IICE CCn1cc(OCC2CCCCC2)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870482392 ITMSPKJMKUVCJI-UHFFFAOYSA-N 439.600 4.158 10 10 IICE Oc1cc(Br)ccc1CN[C@@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156290340 ZJWXMKMUVWLQJK-RBBKRZOGSA-N 431.374 4.068 10 10 IICE CN(Cc1csc(=NCc2cccc(Br)c2O)[nH]1)C(=O)OC(C)(C)C 2217851307 TXKVYTISFXGMGE-UHFFFAOYSA-N 428.352 4.012 10 10 IICE C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)SC1=S 2297480322 OZHAEYSYUMWGOQ-MRVPVSSYSA-N 438.870 4.183 10 10 IICE Cc1ccccc1C=C1SC(=S)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 2314828192 REZIFLTXQMUFFR-UHFFFAOYSA-N 427.507 4.133 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)C(=Cc3cccc(O)c3)SC2=S)cc1 2314831114 CRXXVRXTHAJVFN-UHFFFAOYSA-N 442.562 4.411 10 10 IICE CCN1N=C(C(F)(F)F)C(=Cc2cc(Br)c(OC(C)C)c(OC)c2)C1=O 2332127303 KQRWWJSTRKYDJW-UHFFFAOYSA-N 435.240 4.409 10 10 IICE Cc1ccc(CN[C@@H]2[C@@H]3CCCCN(C(=O)OC(C)(C)C)[C@H]32)c(O)c1Br 2352944477 INFAQYIMIVLQFG-USXIJHARSA-N 425.367 4.341 10 10 IICE CCC1=NN2C(=N)/C(=C\c3cccn3-c3ccc(Br)cc3)C(=O)N=C2S1 13660078 NVCWFUUSHBNFKG-NIIVYLOLSA-N 428.315 4.269 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S)Nc1ccc(Cl)cc1 15039483 GBPKTPBJHPXHIW-YVLHZVERSA-N 448.953 4.371 10 10 IICE COc1ccc(CNC(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)cc1 29071812 AMMMRGJZQCFRKR-OAQYLSRUSA-N 437.565 4.146 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccc(C)cc1)C[C@H](c1cccc(OC)c1O)N2 65298157 UVHCGPMZYCGOJZ-OAQYLSRUSA-N 437.540 4.182 10 10 IICE biogenic COc1cc(C)c(/C=C2/C(=O)NC(=S)N(c3cc(Cl)cc(Cl)c3)C2=O)cc1C 208733840 ZHUHAZBYCMGSIU-SOFYXZRVSA-N 435.332 4.450 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S)Nc1ccccc1C(F)(F)F 210671881 RFXMOEONMGHHLF-OQLLNIDSSA-N 438.452 4.251 10 10 IICE CCOc1ccc(N2C(=O)[C@@H]3ON(c4ccccc4)[C@H](c4ccccc4O)[C@]3(C)C2=O)cc1 245311322 NKXRAMBQNGIYDP-UMFSSWHCSA-N 444.487 4.232 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)N[C@@H](C)c1cc(OC)ccc1O)O[C@H](C)C2 730828271 SFOORTMFRLNWIJ-IUHVXIRESA-N 426.513 4.039 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c([N+](=O)[O-])c1 747621044 SCQGPHVMFLTYBI-FNQPIQQGSA-N 436.386 4.378 10 10 IICE O=C1[C@@H]2C[C@@H](C3CCCCC3)CN2C(=O)N1C1CCN(c2ccc(OC(F)F)cc2)CC1 761158691 KZGJSALXHKMQKP-UTKZUKDTSA-N 447.526 4.490 10 10 IICE O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)c2ncccc12 766495616 NFTDZFLFJAYEHJ-UHFFFAOYSA-N 430.442 4.206 10 10 IICE C[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc2ncsc2c1 776817412 VNSHKPFBWAIXQT-CQSZACIVSA-N 441.512 4.361 10 10 IICE O=C(c1cccc(O)c1O)N(Cc1ccccc1)C[C@@H](O)c1ccccc1C(F)(F)F 790939531 DCIWLDGBEKUAFH-HXUWFJFHSA-N 431.410 4.493 10 10 IICE COc1ccc(C(=O)CC(C)(C)CC(=O)NCc2cc(Br)ccc2O)cc1 804733644 WTVBPQOTCVLATQ-UHFFFAOYSA-N 434.330 4.469 10 10 IICE CC(C)CC(=O)Nc1cccc(CNC(=O)NCc2cc(Br)ccc2O)c1 804987725 KTADDDQQKBMKFI-UHFFFAOYSA-N 434.334 4.139 10 10 IICE CCOCCCn1c([C@H]2OCC[C@H]2c2ccccc2)nnc1N(C)Cc1ccccc1O 812197597 NNKNBPKLMYMBLG-GMAHTHKFSA-N 436.556 4.292 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2nc(-c3cccc(F)c3)cs2)cc1)C(F)(F)F 917864190 LKBXWRDARIAPST-UHFFFAOYSA-N 445.419 4.251 10 10 IICE CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)c(C)c3C)C2=O)cc1 1084418394 ROPZTQIZFYHCQV-WJDWOHSUSA-N 443.297 4.131 10 10 IICE Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1C 1130939945 GNRUJQLEYSWRJG-ZHZULCJRSA-N 442.581 4.393 10 10 IICE CN1CCN(c2ccc(CNC(=O)COc3cc(Cl)c(Cl)cc3Cl)cc2)CC1 1133123843 YYHASSYLXZQXNK-UHFFFAOYSA-N 442.774 4.094 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(-c2cccc(Cl)c2F)no1 1136985205 YIHOTTQEBUYBOS-UHFFFAOYSA-N 447.869 4.164 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(Cc2ccccc2)CC(C)(C)O)C1 1137813239 OFTAEKRJDSZXFY-UHFFFAOYSA-N 433.596 4.208 10 10 IICE C[C@H](CSC(F)(F)F)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1147505482 JXDMMOGVNPIJDB-CZUORRHYSA-N 449.539 4.324 10 10 IICE Cc1cc(=O)n(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)cc1[N+](=O)[O-] 1165832005 DGJAUKKTFYVESS-UHFFFAOYSA-N 433.386 4.374 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccccc1Sc1ccc(Br)cn1 1176748507 USXKIKOWDVYXCH-UHFFFAOYSA-N 431.311 4.337 10 10 IICE C[C@@H](N[C@H](C)c1c(F)cccc1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1197979142 RRNFXGVKKGZOFZ-ZIAGYGMSSA-N 434.442 4.418 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3Cc4ccc(C)c(Br)c4C3)C2)cc1 1230300915 MMTFXYGFCHOHBC-INIZCTEOSA-N 444.373 4.318 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)C[C@@H](C)c1nccs1 1289424718 ZWYWOXPODRYLBZ-GOSISDBHSA-N 447.612 4.459 10 10 IICE Cc1cc(I)ccc1NC(=O)c1cc2cc(O)c(O)cc2s1 1290090579 WRJGPZQOCNGBPT-UHFFFAOYSA-N 425.247 4.478 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)/C(=C/c3ccc(O)c(OC)c3)c3ccccc3)C2)cc1 1300633911 NMYKVGYRPBRETR-DOZBRYHWSA-N 444.531 4.345 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@H]3CC(=O)NC(=O)N3)cc2)c(C)n1-c1cccc(Cl)c1 1301334829 ZRIJGXSDUMZAGS-HXUWFJFHSA-N 436.899 4.270 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2C[C@]2(C)COCCO2)c(C)n1-c1ccccc1 1361045698 GGHDTRWEXNAMQP-RUZDIDTESA-N 437.588 4.250 10 10 IICE Cc1ccc(Cn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)s1 1361285507 AUWFUNLHWPIZQT-UHFFFAOYSA-N 439.629 4.368 10 10 IICE Cc1ccc2c(c1)CN(C(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)CC2 1461455128 GKOPPRMTYMRQBS-DEDYPNTBSA-N 440.565 4.310 10 10 IICE Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1468645597 RSEHKKFCMVSUOQ-UHFFFAOYSA-N 447.494 4.032 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@H]1Cc1ccccc1Cl 1470904055 CSTSDXZBLIPKTB-NRFANRHFSA-N 427.976 4.218 10 10 IICE CCN(C)C(=O)OC[C@H]1CCCCN1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1479063185 BWPKUIJIVFYVIO-HSZRJFAPSA-N 440.588 4.289 10 10 IICE Cc1nnc(N(Cc2cccs2)C[C@@H]2CCCO2)n1CCCSc1nccs1 1492790213 YAVQXYOSGPHYSP-INIZCTEOSA-N 435.644 4.473 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCSC1 1495753005 OPXGOOSPPSWKPR-DLBZAZTESA-N 433.597 4.019 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2=O)cc1 1528554586 JCTPEIHGIMGNJY-REWPJTCUSA-N 449.595 4.096 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3cccc(C(C)C)c3)cc2F)CC1 1528701595 MKTAZHDXEXTTCD-IBGZPJMESA-N 427.564 4.175 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(-c2cccc(OC)c2)no1 1545508585 GWTAFFSBBOSVCQ-UHFFFAOYSA-N 431.286 4.481 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3(SC)CCC3)CC2)cc1 1554958762 FXJDAQLRUDMIMW-UHFFFAOYSA-N 429.634 4.413 10 10 IICE Cc1cc(C(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)c(C)n1-c1cccc(C(C)C)c1 1556113993 NVEUUDDCDMOCET-AREMUKBSSA-N 444.535 4.330 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@@H](CNC(=O)OC(C)(C)C)C2CC2)c1 1556284980 UDNPPMHBJYPOGC-QFIPXVFZSA-N 439.556 4.282 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 1557063511 QTEJYFKCRFLSDT-GCJKJVERSA-N 425.573 4.374 10 10 IICE COC(=O)C[C@H]1CN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ccccc21 1558060066 LWGNZRNQEXAJHM-FQEVSTJZSA-N 430.504 4.143 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCn2nc(C(=O)NCc3c(O)ccc4ccccc34)cc21 1558555371 ZDHBXIASKGONCV-GOSISDBHSA-N 436.512 4.032 10 10 IICE CCOc1ccc(N2CCN(C(=O)CC(C)(C)CC(=O)c3ccc(OC)cc3)CC2)cc1 1566563176 VLFLPHMAIYEWDA-UHFFFAOYSA-N 438.568 4.432 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1 1568137390 PXOUNNZZKFCUKV-UHFFFAOYSA-N 430.448 4.096 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCOC(C)(C)C 1613167869 HYAQCAGXFFUJRK-IBGZPJMESA-N 429.609 4.080 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CC1CC1 1614973183 IBYQXENBYYTPAE-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@H]3OCCC[C@H]3C2)cc1F 1617666918 GHPFLNGDJHXFKK-GHTZIAJQSA-N 429.584 4.125 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCOc2ccccc2)NC(=O)OC(C)(C)C)cc1 1618253805 QYBNGXLPEDMMCH-QFIPXVFZSA-N 441.572 4.294 10 10 IICE COC[C@H]1CCCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1619697372 OQSWXXSCEAEGAW-KRWDZBQOSA-N 444.630 4.150 10 10 IICE CC(=O)N(c1ccccc1)c1nc(CNCc2ccc(N3CCC(O)CC3)cc2)cs1 1621454013 RMGSVFYLQNBJBX-UHFFFAOYSA-N 436.581 4.079 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(OCc3nccn3C)cc2)cc1 1624914535 MPQBDDAGYUEAAK-UHFFFAOYSA-N 442.519 4.400 10 10 IICE CCCCNC(=O)OC[C@H]1CCCCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1636350430 IFZUEZYSWLVTHA-HSZRJFAPSA-N 439.556 4.428 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1636354174 SPWPKMWOVXALDR-QFIPXVFZSA-N 446.595 4.471 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C)nc(-c2ccc(Cl)cc2)n1 1638528935 BJCVTHPDFCWKOH-UHFFFAOYSA-N 439.899 4.017 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)cc1 1640970921 VSECKCBOEDCCSX-MHZLTWQESA-N 443.591 4.225 10 10 IICE C[C@@H](NC(=O)c1cc(Br)ccc1I)c1ccccc1O 1643738596 INPBBIWKEJSDDY-SECBINFHSA-N 446.082 4.250 10 10 IICE Cc1sc2nc(CS[C@H](C)C(=O)NCc3cc(Cl)ccc3O)nc(O)c2c1C 1644590720 MFCWRSOPEZPDHI-LLVKDONJSA-N 437.974 4.311 10 10 IICE O=C(Cc1csc(NC(=O)c2ccccc2F)n1)NCc1c(O)ccc2ccccc12 1647788606 KYJVYMVVFAHWPS-UHFFFAOYSA-N 435.480 4.252 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)c2cc(Cl)ccc2F)CCCC1 1648241593 UKNBBRTXMVGVEX-UHFFFAOYSA-N 428.891 4.320 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3c(O)cc(Cl)cc3Cl)cc2F)C[C@@H](C)O1 1648474122 ABVGTHULDGZWDR-VXGBXAGGSA-N 427.303 4.382 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccsc4)C3=O)c2C)cc1F 1652633225 ZMTMXBUSNOAQGD-HSZRJFAPSA-N 439.512 4.253 10 10 IICE CC(C)c1ccc(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1652700033 LAAYKKAEFLFAQK-KDURUIRLSA-N 427.564 4.315 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)C2CC2)cc1 1676901663 OIQRRRZWKKMBIV-BWKNWUBXSA-N 442.604 4.359 10 10 IICE C[C@H](NC(=O)NCc1noc(-c2cccc(Br)c2)n1)c1ccc(N(C)C)cc1 1681779089 JUQFZUYMCSWJSM-ZDUSSCGKSA-N 444.333 4.126 10 10 IICE COc1cccc(CN(CC(C)C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1681850240 UNHZXVWHGWZGHF-UHFFFAOYSA-N 447.526 4.178 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@H](Oc4ccccc4Cl)C3)C2)cc1 1683337003 ROHCHQZCEVNPRE-PXNSSMCTSA-N 429.948 4.038 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@@]1(Cc2ccccc2)C=CCCC1 1687155130 GITOAFMFFDHNNQ-MHZLTWQESA-N 433.596 4.416 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCC1CCN(C(C)C)CC1 1687190024 FQHGAEHVHLPCRL-UHFFFAOYSA-N 426.399 4.197 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC(C)=C(C)C2)n1Cc1ccc(N(C)C)cc1C 1694317660 MQLLLLPFMFDJRV-UHFFFAOYSA-N 438.620 4.166 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1[C@@H]1CCC[C@H](C(F)(F)F)C1 1707860853 RRTQSZWJBWNIDO-AZUAARDMSA-N 437.510 4.353 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc2c(c1)CCCN2C 1712550436 LWWYMMMVQQIVAZ-PMACEKPBSA-N 441.620 4.059 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1731109660 XDLDLQRHSZCNIK-KRWDZBQOSA-N 447.624 4.147 10 10 IICE Cc1cc(-c2nnc(N3CCOCC3)n2CCCCOC(C)C)c(C)n1-c1ccccc1 1742119789 XDVWDNYBKCFRMO-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)CCOC)C1CC1 1745933674 FHSWMBGEJQCPTL-RUZDIDTESA-N 437.588 4.129 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC[C@@H](OC(C)(C)C)C1 1751431765 LXPUVOUCRKHLRJ-OAQYLSRUSA-N 436.604 4.480 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1767995827 WPXQOBCJIGZBHU-CTNGQTDRSA-N 425.621 4.475 10 10 IICE O=C(CCNCc1cc(Cl)cc(Br)c1O)OCCCc1ccccc1 1857870184 IKIPYMYIRFZPQU-UHFFFAOYSA-N 426.738 4.464 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccco3)C(=O)N(C3CCCC3)C2=O)cc1 1873164169 PDAPYQCKGGHPBS-UHFFFAOYSA-N 429.520 4.499 10 10 IICE CCCCOCCCN1C(=O)C(NC2CC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873167020 OPBGOJZMXYHJDZ-UHFFFAOYSA-N 435.568 4.133 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC12CCC(NCc1c(O)cccc1Br)CC2 1965972620 OEKZQHYAGRYHBF-DJMMNXNOSA-N 425.367 4.470 10 10 IICE CC(C)Cc1cnn(Cc2c(O)cccc2Br)c1I 2070297861 LKTXWQMOHCSVJO-UHFFFAOYSA-N 435.103 4.203 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)cc(F)c2O)CC12CCC2 2099383506 PVADSOZPOQYTPA-CQSZACIVSA-N 429.330 4.316 10 10 IICE CNCc1ccc(N(C)Cc2ccccc2I)cc1Br 2280339795 HZNSTVCJZBPMBZ-UHFFFAOYSA-N 445.142 4.410 10 10 IICE CN1CCN(c2ccc(N3C(=O)C(=Cc4c[nH]c5ccccc45)SC3=S)cc2)CC1 2321684715 XVMDLASVTHSQBL-UHFFFAOYSA-N 434.590 4.326 10 10 IICE Cc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C2CC2)c(O)c1Br 2352687410 GQYNIUMMIORWMZ-DOTOQJQBSA-N 425.367 4.341 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC(NCc3cc(Br)cc(F)c3O)C[C@H](C2)C1 2365513489 BKQYKZLYZJRKAB-STQMWFEESA-N 443.357 4.419 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1 6172129 HROTVLITXNAXOI-MHWRWJLKSA-N 428.828 4.134 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1cc(C)cc(C)c1 20236224 QNTPFCYFVTWVNB-ZIJAOZNWSA-N 447.491 4.220 10 10 IICE COc1cccc(OCCCOc2ccc(/C=C3\C(=N)N4C=CSC4=NC3=O)cc2)c1 103703986 XTHAETDLAIMUBR-VUIJKGMJSA-N 435.505 4.320 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)CC(F)(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 726949238 XCXKZZHISLDZCA-UHFFFAOYSA-N 441.881 4.421 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@H](c2ccsc2)C1 758815544 REJSYBYXTPVRJU-LPHOPBHVSA-N 437.512 4.101 10 10 IICE Cn1ccc([C@@H](NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c2ccc(F)cc2)n1 775622237 SDUGDTMXANAOQI-QFIPXVFZSA-N 448.464 4.294 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F 798090665 WQDDUKKCQXOXNM-OCCSQVGLSA-N 427.245 4.111 10 10 IICE COc1ccccc1-c1ncc(CNCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 813770249 PINPBKDUNCFDFY-QZTJIDSGSA-N 436.531 4.195 10 10 IICE CCCOc1cccn2c3c(nc12)CCN[C@@H]3c1cc(Cl)cc(Br)c1O 821242599 JASYKERMEWNPBC-MRXNPFEDSA-N 436.737 4.480 10 10 IICE CCOc1cc(CNCc2ccc(N3CCSCC3)cc2)cc(Br)c1O 916835722 WHCQPGGMLXUGTH-UHFFFAOYSA-N 437.403 4.396 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)NCc1cc(F)cc(Br)c1 918131018 RWUPFFYNHZELOY-UHFFFAOYSA-N 438.366 4.141 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@H](O)COc1ccccc1C(F)(F)F 1167512492 OIZPKQVBRHAMCY-HNNXBMFYSA-N 448.279 4.435 10 10 IICE Cc1ccc(C(=O)NCC(=O)N2CCCCc3ccccc32)cc1-n1c(C)cc(C=O)c1C 1179664056 LZLPZZNMQIHWPG-UHFFFAOYSA-N 443.547 4.314 10 10 IICE COc1ccc2c(c1)OC[C@H](NC(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)C2 1225636830 MNYKMIYJJXNSBV-VQIMIIECSA-N 443.975 4.388 10 10 IICE CO[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1227208221 LVTGVANCURWKDO-IFXJQAMLSA-N 433.902 4.439 10 10 IICE CC(C)(C)c1nnc(N2CCC([C@@H]3CCOC3)CC2)n1CCCSc1nccs1 1286996816 FQLHTVUCZWMEKT-QGZVFWFLSA-N 435.663 4.467 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)C[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291472979 XNILCZKKMXTLQY-OTWHNJEPSA-N 429.584 4.298 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(NCc4ccccn4)c3)cc2F)C[C@H](C)O1 1291756370 PWXQBKKKWDDFJN-OALUTQOASA-N 448.542 4.376 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)cc1 1292879460 ANRQMXCGZCRLIK-RUZDIDTESA-N 444.531 4.184 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cnn1Cc1ccccc1 1295272530 KIZKMLHTYZSYPB-UHFFFAOYSA-N 432.568 4.245 10 10 IICE CC[C@@](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)(C(=O)OC)c1ccccc1 1299266082 IUYXJPCOYZXVDB-SANMLTNESA-N 432.520 4.157 10 10 IICE CCS(=O)(=O)Cc1ccc(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1299438392 OSERTRVGIAUYCG-UHFFFAOYSA-N 426.538 4.290 10 10 IICE Cc1cc(C(=O)NC[C@H](CC(=O)O[C@H]2CCOC2)CC(C)C)c(C)n1-c1ccc(F)cc1 1300012856 CVOGEFLQWSTKCN-UGKGYDQZSA-N 444.547 4.348 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)c3cc(Br)cnc3F)ccc21 1350627518 BCSOJPLUBYXNTL-UHFFFAOYSA-N 425.213 4.011 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3ccc(Br)cc3)cc2F)C[C@@H](C)O1 1350933306 MSJVAQWWTTUJRA-IYBDPMFKSA-N 449.364 4.451 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(Cl)cn1 1352802011 WDRNVARAJAAUMD-GDNBJRDFSA-N 435.933 4.128 10 10 IICE O=C(CCC(=O)c1c(F)cccc1F)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444983402 DEQICGRTKSAZNA-CQSZACIVSA-N 438.421 4.314 10 10 IICE COc1ccc(C(=O)N[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)c2ccccc2)cc1 1445898446 APSAZICWKSRKOR-VWLOTQADSA-N 444.531 4.067 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)COC1CCN(C)CC1 1457571480 BISNQMJCPQYXCH-OAQYLSRUSA-N 449.517 4.409 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc2c(c1)COC2 1457978010 JJPIZZNCEOBQSS-NVMNQCDNSA-N 428.510 4.086 10 10 IICE COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 1459178912 RBPCCGHTAKTGCP-JTSKRJEESA-N 441.572 4.074 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC(C)(C)CC[C@@H]2CO)sc(C)c1-c1ccccc1 1460491160 QQGLZWHZYVDBSG-GOSISDBHSA-N 444.597 4.322 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2 1460981543 HMYTYWFTDDZWNF-CMJOXMDJSA-N 444.000 4.391 10 10 IICE CN1CC[C@@](Cc2ccccc2)(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C1=O 1464543079 VVLYRQSSHWXSLI-HHHXNRCGSA-N 433.596 4.163 10 10 IICE O=C(Cc1ccccc1OCc1ccncc1)N(Cc1ccccc1O)C[C@H]1CCCO1 1466290176 SCFQGZBYGPCCOQ-HSZRJFAPSA-N 432.520 4.117 10 10 IICE Cc1nn(C)c(C)c1CN(C)c1nnc(C2CCC2)n1CCCSc1nccs1 1492719524 OILFLISOKKEUNQ-UHFFFAOYSA-N 431.635 4.171 10 10 IICE COc1cc(N2CCN(C(=O)C[C@H]3CCC[C@@H](C(F)(F)F)C3)CC2)cc(OC)c1OC 1521836738 LABNXLUWNKTPLO-JKSUJKDBSA-N 444.494 4.120 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1524704389 QHBOORMPUYWKPL-IEBWSBKVSA-N 432.008 4.374 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc2cncc(Br)c2n1 1531706968 YJQRDSZWZJQQNE-UHFFFAOYSA-N 425.330 4.265 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCOc2ccc(Br)cc21 1536550092 OGVMHBLJPPNOTK-BEFAXECRSA-N 431.374 4.437 10 10 IICE Cc1ccccc1OCCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1542200540 QNHBBUIEUVTRSD-UHFFFAOYSA-N 428.330 4.369 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)c(Br)[nH]2)cc1 1543179765 VFCVAEKBWQZVOE-UHFFFAOYSA-N 429.156 4.316 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1[C@H]2c3ccc(Br)cc3C[C@H]21 1556481478 ULXKRDAGDZDTBY-VNQPRFMTSA-N 437.131 4.119 10 10 IICE CCn1cc([C@@H](O)CN(Cc2ccccc2)Cc2ccc(N3CCC(OC)CC3)cc2)cn1 1559747167 VATUUXSSOLQDNR-MHZLTWQESA-N 448.611 4.254 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2C[C@@H](OC)C2(C)C)sc(C)c1-c1ccccc1 1559845929 QWFCKQSDXHCGEV-IAGOWNOFSA-N 430.570 4.242 10 10 IICE Cc1cc(CCNC(=O)NC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)c(C)n1-c1ccccc1 1565162096 LSHJDDCQJDBXNL-AZGAKELHSA-N 435.543 4.241 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC[C@@H](NC(=O)OC(C)(C)C)C3)c2C)c1 1565193144 PTHMAVWHSPWQPT-HXUWFJFHSA-N 426.561 4.211 10 10 IICE CC(C)(C)O[C@H]1C[C@@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1585854533 YQWRCCHNGYKKII-LWLFMNRZSA-N 438.640 4.192 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cnn(-c2ccccc2)c1C(F)F 1625969948 MYOPEFPJUSDMDH-UHFFFAOYSA-N 428.508 4.293 10 10 IICE O=Cc1ccc(-c2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cc2)cc1 1626059360 YMSUBSNOYUMMEI-UHFFFAOYSA-N 436.458 4.211 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@]23CC[C@@](C)(C(=O)O2)C3(C)C)cc1 1627425768 OXZKJELESWSZQD-IZZNHLLZSA-N 436.552 4.416 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)CNC(=O)OC(C)(C)C)c(C)n1-c1ccc(C(C)C)cc1 1627896677 VJGBKCCFLSBYHB-OAQYLSRUSA-N 443.588 4.175 10 10 IICE CCCN(CC)c1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 1629055849 SZMVJLBPJVLMCI-SFHVURJKSA-N 432.515 4.318 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1 1632158200 VFYRSUYJTDIXFU-FYYLOGMGSA-N 443.385 4.474 10 10 IICE Cc1cc(C(=O)N[C@]2(CO)CCCC(C)(C)C2)c(C)n1-c1ccc(Br)cn1 1633160680 NBMYOSCVAJBKJP-OAQYLSRUSA-N 434.378 4.313 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc3cnccc3c2)NC(=O)OC(C)(C)C)cc1 1634161603 ACKDUQRAOWAZFD-JOCHJYFZSA-N 434.540 4.297 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2CCN3C(=O)C(F)(F)F)c(C)n1-c1ccccn1 1638770612 PQNWNMNIRSGSLD-UHFFFAOYSA-N 428.414 4.193 10 10 IICE CCC[C@@H](C)c1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 1640006947 ANZNPJVFFQQIAB-GFCCVEGCSA-N 434.543 4.134 10 10 IICE COc1ccc(NS(=O)(=O)c2cc(C(=O)N[C@@H](C)c3ccccc3O)ccc2C)cc1 1643742216 UCNVOTOFSMAROO-INIZCTEOSA-N 440.521 4.001 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCc1ccc(-c2ccco2)cc1F 1686353571 YZMLKLWPLUHYDB-UHFFFAOYSA-N 445.441 4.200 10 10 IICE CC(C)c1nnc(N2CC[C@@](O)(c3ccccc3F)C2)n1CCCSc1nccs1 1691796028 BVCITNZUWFCAAD-NRFANRHFSA-N 447.605 4.277 10 10 IICE CC(C)SCCn1c(Cc2cn3ccccc3n2)nnc1N(C)Cc1ccccc1O 1692630838 USQKPXYGIVGAPT-UHFFFAOYSA-N 436.585 4.000 10 10 IICE C#CCCCCn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1705520597 ZUWNDUIQLVUWTD-UHFFFAOYSA-N 445.615 4.180 10 10 IICE CC1=CCCN(c2nnc(Cc3csc(C)n3)n2Cc2ccc(N(C)C)c(F)c2)C1 1707692735 VRBVCYVIVCIMIK-UHFFFAOYSA-N 426.565 4.044 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(CCOC)CC1 1708507546 MPFZZRKFUSMUEV-HXUWFJFHSA-N 441.620 4.334 10 10 IICE CCOCc1nnc(N2CCCC[C@H](SC)C2)n1CCCSc1nccs1 1729051108 BFZRGRYNUNJOOS-HNNXBMFYSA-N 427.665 4.175 10 10 IICE COc1cc(C)c(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CC(=O)N3)c(C)s1 1859574808 LKAPQMGYAZZTCH-UHFFFAOYSA-N 443.550 4.039 10 10 IICE CC(=O)N1CCCc2cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)ccc21 1865992575 LFZUOLJYZKJMLG-AREMUKBSSA-N 448.611 4.009 10 10 IICE Oc1c(Br)cc(Cl)cc1CN[C@H]1CCOC[C@@H]1OCc1ccccc1 1965931098 CMQXWHNMUDLALF-ROUUACIJSA-N 426.738 4.272 10 10 IICE COc1ccc(Br)c(CNCCC2CCN(C(=O)OC(C)(C)C)CC2)c1O 2236050933 MFQBLXRRWBLOMA-UHFFFAOYSA-N 443.382 4.290 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)c1O 2236051563 VGZHYVJWLITALZ-XKGZKEIXSA-N 431.374 4.164 10 10 IICE CCCOC(=O)CN1C(=O)C(=Cc2cccc(OCc3ccccc3)c2)SC1=S 2297465433 CQEXFBAMLFDPRG-UHFFFAOYSA-N 427.547 4.420 10 10 IICE CCC1=NN(Cc2c(F)cccc2Cl)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141070 FFEKPAPCKGLUJW-UHFFFAOYSA-N 445.834 4.350 10 10 IICE Cc1ccc(CN[C@H]2CCC3(C2)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352689280 XMCOZJKCIRONSD-HNNXBMFYSA-N 425.367 4.342 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C(/Br)[C@@H]1C(=O)N(c2ccccc2)N=C1C 35079635 RMYWIKONPQRBGB-WQYLVOBCSA-N 437.297 4.097 10 10 IICE O=C(C1=CN(c2cc(F)cc(F)c2)c2cc(Cl)ccc2S1(=O)=O)N1CCCCC1 65096304 IZAIYAFICYLORU-UHFFFAOYSA-N 438.883 4.398 10 10 IICE CCCOc1ccc(-c2nc3sc(=Cc4ccc(N(CC)CC)cc4)c(=O)n3n2)cc1 254873124 IRGVFBXSFGOXPN-UHFFFAOYSA-N 434.565 4.001 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC3CCN(C(=O)c4ccccc4)CC3)ccc21 523125548 BBPBDAFOFBGUHQ-UHFFFAOYSA-N 447.579 4.187 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(C(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)[C@@H]2C1 754877976 JVIJNIHHDBFZET-HMXCVIKNSA-N 447.373 4.265 10 10 IICE Cc1cncc(/C=C\C(=O)Nc2cccc3c2OCCN3C(=O)/C=C\c2cncc(C)c2)c1 791076206 HWTXRVCPNPSLKX-VRHVFUOLSA-N 440.503 4.184 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@H](C)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802678590 UDNKULMCRODMOY-JQVVWYNYSA-N 435.572 4.145 10 10 IICE Cc1ccc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)n1 806944408 FSUQSKZZQXAVOM-LJQANCHMSA-N 446.979 4.034 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 1126582944 OMYNHMAOTBIJJU-MRXNPFEDSA-N 447.482 4.037 10 10 IICE O=C(/C=C/Sc1cc(F)ccc1F)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127181931 QEHCUHVMNXLROA-NTEUORMPSA-N 443.563 4.419 10 10 IICE CCCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccc(C)cc1 1129990617 DVSSTSMDIGBXME-FQEVSTJZSA-N 432.568 4.398 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H](c1ccccn1)C1CC1 1134170553 NKIMPXXKTDEOQF-ZPBCLNFZSA-N 441.553 4.080 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4Cl)C3)cc2)CC1 1136705326 IUFPFEFUTBIBGS-IBGZPJMESA-N 425.960 4.246 10 10 IICE CC(C)(C)C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1 1192652077 AWDFAHNTBCRMSB-QFIPXVFZSA-N 445.554 4.185 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)c2cc(OC)c(OC)c(OC)c2)CCCC1 1265165287 PFQQHCWDYSOJJS-UHFFFAOYSA-N 438.524 4.218 10 10 IICE CCOC(=O)[C@]1(CNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CCCOC1 1287367250 GXLBHBYITXSOEJ-DEOSSOPVSA-N 438.528 4.258 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C(F)(F)F)ccc3Cl)CC2)c(OC)c1 1287485603 VLGKQMZBSIDUBH-UHFFFAOYSA-N 428.838 4.338 10 10 IICE COCCN1CCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C(C)(C)C1 1300222140 RQFMYTPXQZAILQ-UHFFFAOYSA-N 448.405 4.039 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCN(c4ccc(C)c(C)c4)C[C@@H]3C)C2)cc1 1312902845 QIQYBVFURRQCAZ-VXKWHMMOSA-N 436.600 4.059 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CC3(C(C)C)CC3)CC2)cc1F 1315512965 QVQMHPVMPGJURJ-UHFFFAOYSA-N 429.584 4.387 10 10 IICE COc1ccccc1-c1nnc(N2CCOC(C)(C)C2)n1CCCSc1nccs1 1315609540 NFBYQZKNGZWEIE-UHFFFAOYSA-N 445.614 4.208 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C[C@@H]3OCc4cc(Cl)ccc43)cc2F)C[C@@H](C)O1 1350931717 BVFNOCAPIWFPHW-KIMHZCHSSA-N 432.923 4.371 10 10 IICE Cc1nc2c(F)cccc2cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1354659291 VARSTRQPXJAJRE-GASCZTMLSA-N 425.479 4.365 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 1435117712 HDQOETKVPHHZRX-UHFFFAOYSA-N 435.528 4.439 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)c1 1442728823 PUKQCGUXQVJFLM-UHFFFAOYSA-N 449.938 4.158 10 10 IICE Cc1cc(C(=O)NCCC[C@@H]2CCCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1449742499 LBPMOZWTJVRRIT-LJQANCHMSA-N 426.561 4.399 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](c2ccc(F)cc2)c2ncc[nH]2)cc1 1453498694 ARNOIQKADWCWGN-XMMPIXPASA-N 430.483 4.217 10 10 IICE CSc1ncc(I)c(N[C@H](C)Cc2ccc(N(C)C)cc2C)n1 1458438719 RQWKFPISLCFRKA-GFCCVEGCSA-N 442.370 4.221 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C(F)F)c(C)n1-c1ccccc1 1460677511 ZTIJQUOFGPRSGN-FQEVSTJZSA-N 447.526 4.350 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)cc3O)cc2F)C[C@@H](C)O1 1464309850 OAMFWOLFFYKMKV-CHWSQXEVSA-N 426.410 4.094 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@@H]1COC(=O)NC1CCCC1 1478841080 OYKHSCAMJPLPTM-WMZHIEFXSA-N 444.620 4.225 10 10 IICE Cc1csc([C@H](C)Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)n1 1492637931 AYGACBXCHIOPPR-MRXNPFEDSA-N 434.569 4.175 10 10 IICE CCN(CCC1CCN(c2nnc(C)n2Cc2ccc(N(C)C)c(F)c2)CC1)CC1CC1 1502179842 VFCXWXZPYGCJQO-UHFFFAOYSA-N 442.627 4.178 10 10 IICE Cc1c(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nnn1-c1ccccc1 1519550090 FWTGPRINBXYLPB-KRWDZBQOSA-N 437.975 4.324 10 10 IICE O=C(Cn1c(=O)ccn(Cc2ccccc2)c1=O)Nc1ccc(N=Nc2ccccc2)cc1 1523242288 PTRHROJZUALLQW-UHFFFAOYSA-N 439.475 4.112 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CCO[C@H]1c1cncc(Br)c1 1531705300 CNMQWNXWIIJRNJ-RTWAWAEBSA-N 444.373 4.181 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](CCS(C)(=O)=O)c3ccccc3)c2C)c1 1534760016 PNPRBKUZYPQIPX-DEOSSOPVSA-N 438.593 4.237 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C(=O)/C=C/c2cnc3ccccc3n2)C1 1535503740 XVHDMADKSNSKFS-QFQMRYFISA-N 444.535 4.373 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)C2(CNC(=O)OC(C)(C)C)CCOCC2)cc1 1536556485 HHIQBHGJVVRWED-UHFFFAOYSA-N 441.572 4.240 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@H](C)c3ccc(F)c(Br)c3)C2)cc1 1538745527 FCRDAXAIHULCJD-HOCLYGCPSA-N 435.337 4.486 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2C[C@@H](F)CN2C(=O)OCc2ccccc2)cc1 1539308218 PADJBHVTBBMUCN-FYYLOGMGSA-N 441.547 4.240 10 10 IICE Cc1cc(-c2nc(C)c(C(=O)NCc3ccc(N4CCOCC4)cc3)s2)ccc1F 1543817979 USTRXEMOQMMXQE-UHFFFAOYSA-N 425.529 4.333 10 10 IICE CCOCCC1(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCC1 1544268471 MCBMDJSXGUNTLR-NRFANRHFSA-N 447.620 4.422 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1cnc(C)s1 1545503500 BPWAMEPHYJIMHD-KRWDZBQOSA-N 440.617 4.330 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC(C)C)cc2)sc(C(C)=O)c1C 1559748391 KHPKJVAQZRNKSX-UHFFFAOYSA-N 432.542 4.298 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1565169458 MFOGFQLUBPNXCT-NRFANRHFSA-N 444.620 4.464 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2cccc(F)c2)c(C)n1-c1cccc(Cl)c1 1565751552 LJTWNELYTDAAKI-UHFFFAOYSA-N 427.907 4.437 10 10 IICE CC(C)(C)c1ccc(C2(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)cc1 1596683423 BABWXPDPZYUQBG-UHFFFAOYSA-N 428.523 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2n[nH]c3nc(C(F)(F)F)ccc23)cc1 1607624612 NHBWSZJXCNUHAM-UHFFFAOYSA-N 441.413 4.378 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1613370130 CWMUNNOTHMMWAA-GOSISDBHSA-N 436.604 4.313 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C=C\c2cccnc2C)cc1 1616141614 BHBCTZUWICPZDK-QINSGFPZSA-N 429.520 4.047 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3nccnc3NC(=O)C(C)(C)C)cc2Cl)C1 1617900245 HQCNFPGVFIMEEW-HNNXBMFYSA-N 443.979 4.281 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(F)cc3NC(=O)OC(C)(C)C)CC2)cc1F 1630201847 CDFIWLSRZDLRBK-UHFFFAOYSA-N 447.482 4.283 10 10 IICE Nc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccnc1-c1ccccc1 1630262890 RCDNMOGIORCXPG-LJQANCHMSA-N 436.943 4.084 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](CN3CCCC3)c3ccc(OC)cc3)ccc21 1636587957 QRUQCUKKEWHFPV-RUZDIDTESA-N 449.595 4.480 10 10 IICE Cc1ccc(Oc2ccc(OCC(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc2)cc1 1646430912 FHLFAPHGWUEEDT-UHFFFAOYSA-N 446.547 4.444 10 10 IICE O=C(NCc1c(O)cccc1F)c1nn(-c2cccc(Br)c2)c2c1CCCC2 1652295452 JYBUEDGXMMOHMX-UHFFFAOYSA-N 444.304 4.288 10 10 IICE COc1ccc([C@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2ccco2)cc1 1686813227 VRMOFXQHEKMPIG-VWLOTQADSA-N 449.551 4.086 10 10 IICE Cc1cc(-c2nnc(N3CCN(C)C(=O)C3)n2CCCC(C)(C)C)c(C)n1-c1ccccc1 1692985021 LHVISYZLGOZEKB-UHFFFAOYSA-N 448.615 4.457 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1693651622 SRACJSPJJPVWEB-XXBNENTESA-N 435.572 4.201 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCSC1 1694129359 CPSCVYZVTMEPPF-QZTJIDSGSA-N 447.624 4.409 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1)OC 1694370417 SOBDPFFSXUYEGW-JQVVWYNYSA-N 437.588 4.391 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCCC1 1696989534 YPBGJAADCJAOLU-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(CC)n2Cc2ccc(N(C)C)cc2C)C12CCCC2 1710850515 JDFPMNYFEHOHCB-FCHUYYIVSA-N 425.621 4.437 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C[C@H]1C(F)(F)F 1750346948 ZHUHJKCJUXRJCP-MGPQQGTHSA-N 447.552 4.403 10 10 IICE C[C@H]1COC(C)(C)CN1c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1770682891 ODIABYZADYFXIG-JKSUJKDBSA-N 437.635 4.162 10 10 IICE Cc1c(OCc2ccc(Br)cc2)c(=O)ccn1CCOc1ccc(N)cc1 1857919351 FZIWJQHGSHOVBN-UHFFFAOYSA-N 429.314 4.159 10 10 IICE Nc1ccc(OC(=O)Nc2ncccc2OCC(=O)c2ccc(Br)cc2)cc1 1858695795 URLPUMVFZFCKGZ-UHFFFAOYSA-N 442.269 4.299 10 10 IICE CCCOc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1[N+](=O)[O-] 1860398453 DZJVXGYYIPXDIE-UHFFFAOYSA-N 430.416 4.411 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](CNCc3cc(Cl)cc(Br)c3O)[C@H]2C1 2055517849 UFPFZCRTHPQHTK-BTTYYORXSA-N 431.758 4.011 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NCc2cccc(Br)c2O)C12CCC2 2118417124 CAZJWIYDROOFKH-HOCLYGCPSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(CCNCc2ccc(Br)cc2O)C1 2140332928 WWMNQUWPXGCNNN-FOIQADDNSA-N 425.367 4.282 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3Cc3ccccc3C)C2=O)cc1Cl 2293519283 XBVPIUXXYGTZTF-UHFFFAOYSA-N 449.894 4.173 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)N3CCCCCC3)C2=O)cc1OC 2297349592 BKUFSCPMKZKFSQ-UHFFFAOYSA-N 448.610 4.088 10 10 IICE O=C1C(=Cc2ccccc2Cl)SC(=S)N1NS(=O)(=O)c1ccc(Cl)cc1 2314716744 KLBMDJXHIAGFJQ-UHFFFAOYSA-N 445.374 4.088 10 10 IICE CCCOC(=O)CCCN1C(=O)C(=Cc2ccc(OCC)c(OCC)c2)SC1=S 2314761048 OHVXIRRSQZOIEU-UHFFFAOYSA-N 437.583 4.419 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]2C[C@@H]1CNCc1cc(Br)ccc1O 2335118613 HCVSQYFITFEMMP-XKQJLSEDSA-N 425.367 4.422 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3C[C@H]2C[C@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352675435 GPVRGWGQPLIABY-YHUYYLMFSA-N 425.367 4.245 10 10 IICE COc1cc(/C=C2\SC(=S)N(NC(=O)c3cccs3)C2=O)ccc1OCC(C)C 33362313 WQHWIMHJGKFIRJ-YVLHZVERSA-N 448.591 4.338 10 10 IICE CCCNS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(OC)c(OC)c1)N2 226859814 GTEMQVYYVWFXHU-PMAPCBKXSA-N 428.554 4.219 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNCc1cc(Br)cc(F)c1O 721107020 XTGAWQOYVAHKRR-QWHCGFSZSA-N 431.346 4.277 10 10 IICE Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)o1 745647074 IMFLQMZZRZHJBP-OPAMFIHVSA-N 429.536 4.371 10 10 IICE O=C(NCCCNc1ccccc1F)NC1CCN(c2ccc(OC(F)F)cc2)CC1 753149367 JGEPHOUNHFVPBC-UHFFFAOYSA-N 436.478 4.197 10 10 IICE CC[C@H](Nc1cccc2c1CCN2S(C)(=O)=O)c1cc(Br)ccc1O 775550990 FBXREWMDLAKSQU-HNNXBMFYSA-N 425.348 4.040 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 801937759 VWCNNWLCZDLWNU-OAHLLOKOSA-N 431.916 4.190 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1c[nH]nc1-c1cccc(OC(F)F)c1 804738611 WWCGQUHGTCBSAP-UHFFFAOYSA-N 438.228 4.076 10 10 IICE O=C(CCc1ncc(-c2ccc(F)cc2F)o1)NCc1cc(Br)ccc1O 804738969 LASLIFQCYFEAJV-UHFFFAOYSA-N 437.240 4.337 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCCOc3ccccc3Br)C2)cc1 1129990870 IRQSPVKOXUABOW-KRWDZBQOSA-N 447.373 4.259 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1132011370 MLWZKBBCDFOWEN-XMMPIXPASA-N 445.563 4.412 10 10 IICE Cc1ccc(N2CCC[C@H](NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2=O)cc1 1137039180 RUXSWINLRYNHCM-VWLOTQADSA-N 443.547 4.069 10 10 IICE COC(=O)c1coc(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1 1149733845 FEQYZOOPOFDQTK-UHFFFAOYSA-N 431.286 4.166 10 10 IICE Cc1ncc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(Cl)c1Cl 1160600285 UOLQSQCLZJXYQA-TXEJJXNPSA-N 426.319 4.380 10 10 IICE C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1163900861 CUUDVKYAOQQUBL-AWEZNQCLSA-N 441.881 4.115 10 10 IICE Cc1cc(C(=O)NCc2cccc(NS(=O)(=O)C3CC3)c2)c(C)n1-c1ccc(F)cc1 1180287463 WNBXPGVAJBLFDL-UHFFFAOYSA-N 441.528 4.067 10 10 IICE Cc1nc2ccccc2n1C1CCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1256237385 YXOMZSTXLAMGDK-RUZDIDTESA-N 448.615 4.060 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(NC(=O)c4ccc(F)cc4)c3)C2)cc1 1276832171 PBNLYQAMBIACAJ-GOSISDBHSA-N 447.510 4.343 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(CC2CC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1291401069 GBTYLLFLIFGDNR-KBMIEXCESA-N 425.621 4.264 10 10 IICE CC[C@@H]1CCCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1293387492 VTHBHJXPJDBPHJ-WOJBJXKFSA-N 441.620 4.059 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCN(C(C)(C)C)CC2)cc1 1313676954 GSECZEDULNBBJT-UHFFFAOYSA-N 449.647 4.099 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C1 1314420222 KGJRYFHBJDRDRU-QGZVFWFLSA-N 446.646 4.175 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1cc(I)c(F)cc1F 1323705744 AKEWGELCYMZESO-UHFFFAOYSA-N 435.555 4.011 10 10 IICE CC(C)(C)OC(=O)CCCCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354755444 RMGDIUBIHWXNSI-INIZCTEOSA-N 426.504 4.275 10 10 IICE COc1ccc(N2CCN(C(=O)CCSc3nc4ccccc4s3)CC2)cc1F 1445844647 NIFNPWCVYWWDJH-UHFFFAOYSA-N 431.558 4.275 10 10 IICE C[C@@H](Sc1nc2ccccc2s1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460742395 VZNRIOKHWYCMIS-CYBMUJFWSA-N 449.548 4.208 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(F)c1I 1460981834 ISQOJVAIJDHAKG-CYBMUJFWSA-N 440.300 4.166 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2C[C@@H]2COCCO2)c(C)n1-c1ccccc1 1510608560 YRWMNOXABKYWPF-JOCHJYFZSA-N 437.588 4.250 10 10 IICE CCc1nnc(N(C)CC(=O)Nc2cccc(C)c2C)n1CCCSc1nccs1 1513786724 XHCGSFIOXPTNTI-UHFFFAOYSA-N 444.630 4.171 10 10 IICE CCOC(=O)CN(C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(C)cc1 1530029090 CMXHEZMPINMSJX-UHFFFAOYSA-N 434.536 4.433 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2 1533458425 UCEANSXWJYOKPJ-AAHBMTESSA-N 440.512 4.206 10 10 IICE COCCO[C@]12CCC[C@@]1(NC(=O)c1cc(-n3c(C)ccc3C)ccc1Cl)CCO2 1537523806 NZPKHPLCILLJJT-DHIUTWEWSA-N 432.948 4.180 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](c3cccs3)N3CCN(C)CC3)c2C)c1 1542926557 FNVJHNFOPWCWJL-QHCPKHFHSA-N 436.625 4.183 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)n(Cc2ccccc2)c1C 1546151614 AADXMDQYWYCPBA-UHFFFAOYSA-N 440.927 4.328 10 10 IICE CC(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)cn1 1557106702 MSBMJVNSTOKTOT-UHFFFAOYSA-N 441.329 4.487 10 10 IICE CN(Cc1ccccc1NC(=O)Cc1ccc(O)c(O)c1)C(=O)c1cc2ccccc2o1 1565738786 IOCCSWMWWOGJJZ-UHFFFAOYSA-N 430.460 4.297 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(NC(=O)C4CCCCC4)c3)C2)cc1 1584439457 LXXKCADEHGBLRI-LJQANCHMSA-N 435.568 4.470 10 10 IICE C[C@@H]1CN(c2ccnc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c2)C[C@@H](C)O1 1597950542 MBDKOKMTAOZMQK-WOJBJXKFSA-N 436.600 4.394 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)Nc1nc(C(F)(F)F)ccc1I 1612240937 GHEHKGNALLBMFF-QMMMGPOBSA-N 438.187 4.159 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Cl)cc(F)c3Br)C2)cc1 1617262947 PKBMQIMLIJUJLZ-LBPRGKRZSA-N 427.701 4.259 10 10 IICE Cc1ccc([C@H](C)CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1617949577 AFWFYZGCPKHYMU-OAHLLOKOSA-N 430.551 4.096 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCN1CCN(c2cccc(Cl)c2)CC1 1630709643 LOGFREYDHZWXKN-UHFFFAOYSA-N 443.035 4.355 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3cc(CCc4ccccc4)ccc3O)c2)CC1 1634193791 FQESTBMSFVPTLS-UHFFFAOYSA-N 443.547 4.098 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@](CO)(Cc2ccccc2)C1 1636717044 WSHLXAGUEPQBDO-MHZLTWQESA-N 430.548 4.364 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@]1(C)CC(c2cccc(Cl)c2F)=NO1 1639341183 OYEXSLRPTIWMJT-NPMXOYFQSA-N 431.939 4.484 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 1642997769 MQYOHARQSBQZHY-GHTZIAJQSA-N 429.605 4.288 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(CC(=O)NCc3ccc4cccnc4c3O)cc21 1643285165 SFFFVBKNBDXFFW-UHFFFAOYSA-N 433.508 4.097 10 10 IICE NC(=O)[C@@H]1CN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C[C@H]1c1ccccc1 1643430587 MDMMPSLMWPJGLC-XZOQPEGZSA-N 427.508 4.241 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCc4ncc(Br)n4C3)c2C)c1 1648685373 TUFQBWMXAKSQEO-INIZCTEOSA-N 427.346 4.106 10 10 IICE C[C@H]1CSCCN1c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N(C)C)c(F)c1 1649569546 MLZBWKRRMLIZFX-AWEZNQCLSA-N 446.983 4.189 10 10 IICE COC(=O)c1cnc(SCC(=O)N2CCc3sccc3[C@H]2c2ccccc2)s1 1652854267 ZBGUINRMEJNDOL-GOSISDBHSA-N 430.576 4.258 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)[C@H](C)C(=O)OCC)sc(C)c1-c1ccccc1 1653194183 HWHXQTYITVHXMG-LSDHHAIUSA-N 446.569 4.016 10 10 IICE COC1CCN(c2ccc(CN3C[C@@H]4CCC[C@]4(CNC(=O)OC(C)(C)C)C3)cc2)CC1 1654144468 FTEODQUFKMRVMO-LVXARBLLSA-N 443.632 4.429 10 10 IICE CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)CCC2 1676653739 WFYBTPKKKKCGGD-VQTJNVASSA-N 429.634 4.093 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H](c4cncn4C(C)(C)C)C3)C2)cc1 1683339761 FTMKSMWOQUXKPI-VQTJNVASSA-N 439.604 4.062 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccsc2)n1Cc1ccc(N2CCOCC2)c(F)c1 1692082121 CPJYGJAENXENGO-UHFFFAOYSA-N 443.592 4.199 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1698229936 RTNKCIYFQBYMBK-AVRDEDQJSA-N 445.583 4.024 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C1 1709695158 XUIKEPBZLSQHSE-KRWDZBQOSA-N 436.695 4.383 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1750859921 UAKZITQRPPEEEN-GOSISDBHSA-N 444.630 4.230 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N(C)CC1CC(F)(F)C1 1751432252 BSWIOAJYKUMDQN-LJQANCHMSA-N 433.547 4.076 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CC(F)(F)Br 1767113347 OFIBUMZWUDKXTR-UHFFFAOYSA-N 429.309 4.341 10 10 IICE CN(C(=O)OC(C)(C)C)[C@H]1CCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2044636319 UTTMJLZYZJNJRW-INIZCTEOSA-N 446.592 4.008 10 10 IICE Cc1nn(Cc2c(O)cccc2Br)c(I)c1C(C)C 2079590219 MTDHHEDPGWUBRM-UHFFFAOYSA-N 435.103 4.436 10 10 IICE COC(=O)c1c(C(F)F)nn([C@H](c2ccc(OC)cc2O)C(C)C)c1Br 2079874617 HXQPOAYABMAEAX-AWEZNQCLSA-N 433.249 4.329 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C3CCC3)c(N)c2I)c(O)c1 2080043461 VCUVIVPJKXZOTF-QGZVFWFLSA-N 441.313 4.297 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(CNCc2cccc(Br)c2O)CC12CCC2 2097949859 FZHFLPCXMRZBBV-FQEVSTJZSA-N 425.367 4.329 10 10 IICE Cc1cc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)o2)cc([N+](=O)[O-])c1C 2313557337 ANJMQEYXFUODMM-UHFFFAOYSA-N 449.394 4.277 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380758993 ZCBPHZYOCWMOGX-HIFRSBDPSA-N 441.366 4.163 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3CC[C@H]([C@@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2380801706 AHCNGDHBGVHAQJ-KLZNWCGWSA-N 443.357 4.431 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14470804 FRVPGFYRPRNZIK-MDOVXXIYSA-N 433.917 4.325 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C\c1cc(Cl)c2c(c1)OCCCO2 96912701 QXBFJKRAWSSAFA-YVMONPNESA-N 442.943 4.010 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@@H](c2ccccc2Cl)N3)CC1 226748381 JNCQFZUXRIAJTR-PNCHPQGNSA-N 444.000 4.103 10 10 IICE C[C@H](NC(=O)C(C)(C)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 726502665 FLZKHUMNINSJIU-INIZCTEOSA-N 431.374 4.441 10 10 IICE Cc1sc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 742749428 GYCNRHSNGQZVTB-MRXNPFEDSA-N 448.545 4.027 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)c(C)n1-c1cccc(Cl)c1 763772423 GINBAWMQKJVBTM-TZIWHRDSSA-N 428.916 4.305 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc4nc(-c5ccccn5)oc4c3)CC2)cc1 777728094 FTUHCZUNYBWHRI-UHFFFAOYSA-N 429.480 4.253 10 10 IICE COCCc1nnc(-c2cccc(C(=O)N(Cc3ccco3)Cc3ccccc3O)c2)o1 778892029 URWBEXMUNDXABT-UHFFFAOYSA-N 433.464 4.067 10 10 IICE COCCNC(=O)c1ccc(NCc2cc(C)cc(Br)c2O)cc1Cl 789888165 DJMGUNJUCALREG-UHFFFAOYSA-N 427.726 4.105 10 10 IICE Oc1c(Br)cc(Br)cc1CNCc1ccnc(OC(F)F)c1 793626318 YJBLTKNQKFAHJV-UHFFFAOYSA-N 438.066 4.203 10 10 IICE CN(C)c1ccc(CNC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c(C(F)(F)F)c1 796503740 QJFQXAMVMKFRMO-UHFFFAOYSA-N 428.886 4.147 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@@H]1Cc2ccc(Cl)cc2C1 800018900 KTFBEAXRICQMIL-GOSISDBHSA-N 435.902 4.377 10 10 IICE C[C@@H]1CN(c2ccc(CNc3ccc(/C=C/C(=O)O)cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 917087270 VQFJIPVFOLUFRX-VZLFFANISA-N 429.448 4.057 10 10 IICE CCOc1ccc2ccccc2c1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1125975904 DXFZDYOMTVRTDA-UHFFFAOYSA-N 435.543 4.450 10 10 IICE CCN(C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(N2CCOCC2)cc1 1168620798 CDTMZLVHIBSZIO-UHFFFAOYSA-N 445.563 4.339 10 10 IICE CCN(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)C1CCN(C(=O)OC(C)(C)C)CC1 1230200821 MHKCKRIJRXBFOR-IBGZPJMESA-N 446.636 4.423 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@H](c4ccccc4)CC3)cc2)CC1 1251104646 PCRNNTBLRANOKJ-LADGPHEKSA-N 448.611 4.304 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H](c2ccc(F)cc2)CC1 1251751053 SZQDGICMDXDWCP-SFHVURJKSA-N 447.501 4.420 10 10 IICE COc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c2ccccc2n1 1264992775 MBPYRZRSBUPWLS-UHFFFAOYSA-N 427.451 4.244 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2cc(=O)n(C)cc2Br)c1 1289278487 RCBZUOZRRSGNJE-UHFFFAOYSA-N 434.721 4.461 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2C[C@@]2(O)CCSC2)c(C)n1-c1ccccc1 1289352973 KRBLVMZBEXYQSM-DEOSSOPVSA-N 439.629 4.313 10 10 IICE CC[C@@H]1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCO1 1289510801 LYDKTZHCKXINIW-DZGCQCFKSA-N 429.318 4.303 10 10 IICE C[C@H]1CN(c2nnc(-c3ccccc3Cl)n2CCCSc2nccs2)CCO1 1291227287 WNWQDVKVRKODDW-AWEZNQCLSA-N 436.006 4.463 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnn(Cc2ccccc2)c1Br 1292179842 KXBRFSHBDHPHPN-UHFFFAOYSA-N 441.373 4.422 10 10 IICE CC[C@@H]1CCCCN1CCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1293374948 ZLJQEWYQDZHTOI-IRLDBZIGSA-N 427.593 4.126 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(-n2ccccc2=O)cc1F 1300706676 IETLLLGKERIXDP-UHFFFAOYSA-N 429.451 4.449 10 10 IICE Cc1cc(-c2nnc(N3CCC(F)(F)C3)n2CCCCCO)c(C)n1-c1ccccc1 1304196980 WSVIKPHXDGOOKT-UHFFFAOYSA-N 429.515 4.361 10 10 IICE CCCOc1ccc(C(C)(C)NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1313420067 WUANDJYZQBQXAF-QHCPKHFHSA-N 426.605 4.379 10 10 IICE COCCn1cc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(C)cc4)c3C)cs2)nn1 1354688460 QBNSUJSQIMGJHA-UHFFFAOYSA-N 436.541 4.016 10 10 IICE C[C@@H](NC(=O)c1cc2c(Br)cncc2s1)c1ccc(N2CCOCC2)cc1 1357929060 SPMKTGOBGVYAMN-CYBMUJFWSA-N 446.370 4.386 10 10 IICE CC(C)Cc1nnc(N2CCN(C3CCC3)C[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1359856176 WSINSPUYXCHVEI-IBGZPJMESA-N 442.627 4.041 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2cc(Cl)cc3c2OCC3)cc1 1442621503 ZNCDEDQJTRIYRQ-QFIPXVFZSA-N 428.960 4.091 10 10 IICE COCCN(CCOc1ccc(F)cc1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1443944668 NGYVRLFKGJINTO-UHFFFAOYSA-N 438.499 4.213 10 10 IICE COC(=O)CC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1447232160 HXKRDXLYYNRPTP-XMMPIXPASA-N 446.547 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 1469104657 QUOJZXCCWWQBRT-MCEIDBOGSA-N 429.605 4.144 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)Nc3cc(C)c(Cl)cc3OC)CC2)cc1 1473297188 WPYAAJBUNINFQM-QGZVFWFLSA-N 431.964 4.205 10 10 IICE Cc1cc([C@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)C2)c(O)cc1Cl 1479030918 UXVYLICRRIUKSN-SFHVURJKSA-N 443.975 4.014 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4ccncc4)n3CCC(C)C)CC2)cc1 1504293018 XGQBMYSXITVCHS-UHFFFAOYSA-N 434.588 4.035 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc[nH]4)n3CCCCSC)CC2)cc1 1504293044 XRXJNGSNUQOGDK-UHFFFAOYSA-N 440.617 4.142 10 10 IICE COC(=O)c1ccc(C)c(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1524768873 CSWJQQOVMAMEHT-UHFFFAOYSA-N 434.536 4.246 10 10 IICE Cc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1C 1526015445 QDFUCQSPMZIURZ-UHFFFAOYSA-N 433.596 4.115 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)C2CC2)cc1 1526185592 LIHOSGBHKJSKLL-DEOSSOPVSA-N 435.568 4.435 10 10 IICE COc1ccc(N2CCN(C(=O)C3(C(=O)OC(C)(C)C)CCCCCC3)CC2)c(OC)c1 1534596467 QVBJGURNFWTARN-UHFFFAOYSA-N 446.588 4.035 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(Cc2ccc(-c3ccccc3F)s2)CC1 1539368760 ARSHABWHQKJNJS-POHAHGRESA-N 438.524 4.323 10 10 IICE C[C@H]1CCCN(c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccn2)C1 1539583071 XZSLUMUCIYMYRB-HKUYNNGSSA-N 444.526 4.318 10 10 IICE Cc1cc(-c2nnc(N3CCCC(C)(C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1542183738 DHOAVYWROHGQGO-UHFFFAOYSA-N 448.615 4.457 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC[C@H](C[C@@H]2CCOC2)C1 1542224354 DUCJGYUDACUELW-RTWAWAEBSA-N 425.621 4.467 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1 1542885737 HEPHCCMSXNLCKO-DEOSSOPVSA-N 430.504 4.255 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(OCc4ccccc4)ccc3[N+](=O)[O-])ccc21 1544164704 OTKGRUBCXYVLOH-UHFFFAOYSA-N 431.492 4.486 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](c3ccc(C)cc3)N3CCOCC3)c2C)cc1 1544878996 ZNGDOGGLRRQQAS-AREMUKBSSA-N 447.579 4.214 10 10 IICE O=C(Cc1c[nH]c2ccc(Br)cc12)N(Cc1ccccc1O)C[C@H]1CCCO1 1546033912 JHZVNUHYHDXIPM-GOSISDBHSA-N 443.341 4.386 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H](SC)C(C)(C)C 1546529515 KGTSTCFIEKSNDX-IBGZPJMESA-N 435.613 4.093 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(c2=O)CCCC3)c(C)n1-c1ccc(OC(F)F)cc1 1559394304 URIRMOBECKBNDS-UHFFFAOYSA-N 427.451 4.014 10 10 IICE COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1565453005 PZXFSKCZAAMDON-FGZHOGPDSA-N 432.996 4.038 10 10 IICE CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1583700004 PMBWLALXENHIML-CVDCTZTESA-N 428.621 4.292 10 10 IICE Cc1ccc2nc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)sc2c1 1584704188 AJMMYSKXTRFPRF-UHFFFAOYSA-N 445.547 4.425 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCOC1 1614505347 HNUGSELWIXWBOE-VWLOTQADSA-N 437.588 4.130 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cc2cncn2Cc2ccccc2)cc1 1624287407 ZLEZWDAKMYMMBT-UHFFFAOYSA-N 428.536 4.362 10 10 IICE COC(=O)[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1cc(F)ccc1F 1627680148 NIVKOUAXTGROML-JOCHJYFZSA-N 440.446 4.137 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nc(C(C)C)n(-c3ccccc3F)n2)cc1F 1628769559 ARYYBXBMYXPABL-UHFFFAOYSA-N 427.499 4.445 10 10 IICE Cc1cc(C(=O)NCCN(C)CC(F)(F)F)c(C)n1-c1cccc(Br)c1 1633263214 DHRTXTXGEYHHFS-UHFFFAOYSA-N 432.284 4.081 10 10 IICE Brc1cc(CNCc2ccc(-n3ccnc3)nc2)ccc1N1CCCCC1 1656715602 OISWLJMWHHLAEU-UHFFFAOYSA-N 426.362 4.310 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@@H]1CN(C)C(=O)OC(C)(C)C 1683426070 USYXYZXNAROLTM-DENIHFKCSA-N 446.636 4.423 10 10 IICE CCO[C@@H]1C[C@H](N(C)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C12CCCCC2 1685681203 BZKWKWIIJGVHKO-XPWALMASSA-N 430.637 4.125 10 10 IICE Cc1ccc([C@H](CC(F)(F)F)NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1686018175 JDYQSLFBHZVDNX-NRFANRHFSA-N 434.506 4.240 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3ccc(Br)cc3OC)C2)cc1 1686130672 ZFGDNSDLNMCEEW-HOCLYGCPSA-N 448.361 4.105 10 10 IICE CC(C)Cc1nnc(N2CCCO[C@@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1692195970 CCRFAPSBNMBYKP-NRFANRHFSA-N 425.621 4.376 10 10 IICE CC(C)SCCn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1692630038 UKRCNPHDBCSWDJ-FQEVSTJZSA-N 429.634 4.160 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1COCCO1 1695206936 AACOQKPMRDMGBS-QFIPXVFZSA-N 437.588 4.394 10 10 IICE COc1cccc(-c2nnc(N(C)C[C@H]3CCCO3)n2CCCSc2nccs2)c1 1697509017 BOQWJMFYZPUINV-GOSISDBHSA-N 445.614 4.208 10 10 IICE CON(C)c1nnc(-c2ccc(Br)s2)n1Cc1ccc2c(c1)CCCN2C 1698263025 IEKFBIVHXUJMFL-UHFFFAOYSA-N 448.390 4.197 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCn1cccn1 1698430352 GLZAFBSYAWQMCC-UHFFFAOYSA-N 449.628 4.439 10 10 IICE C[C@H]1CCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C[C@@H]1C 1726618121 CECWHFYYFQVWJO-IRXDYDNUSA-N 428.631 4.385 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1727053184 XLYXDMGKLBXVRV-HXUWFJFHSA-N 448.615 4.079 10 10 IICE CN(CCC(F)(F)F)c1nnc(CC2CC2)n1Cc1ccc(N2CCSCC2)cc1 1729496801 JIUBPRUNSMBKNE-UHFFFAOYSA-N 439.551 4.221 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CC(C)(C)C1 1729706208 ZISQCGWARRXVLY-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CC[C@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)NC)C1 1744223593 GEPOSDBOCLBUFS-RUZDIDTESA-N 434.588 4.115 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)n1CC1(C)CC1 1747753820 JXEKAKVWMJGLQB-HDICACEKSA-N 441.576 4.191 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](COC)O[C@H](C)C1 1765769455 IMGTYLDVSAVJBG-KNQAVFIVSA-N 437.588 4.393 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](CC(C)C)n3sc4ccccc4c3=O)CC2)cc1 1873831877 QCDXUGBCJREDNQ-NRFANRHFSA-N 439.581 4.008 10 10 IICE Cc1ccc([C@@H](n2nc(C)c(C(=O)O)c2I)C(C)(C)C)c(O)c1 2079107598 BGTXNTWYQJTIIW-CQSZACIVSA-N 428.270 4.144 10 10 IICE CN(C)c1ccc([C@@H](O)c2cc(Br)ccc2I)cc1 2106797621 CIVDECJAKZXRBP-OAHLLOKOSA-N 432.099 4.201 10 10 IICE CCOc1ccccc1NC(=O)CCN1C(=O)C(=Cc2ccccc2F)SC1=S 2296755616 RPROQSMGPNNOED-UHFFFAOYSA-N 430.526 4.454 10 10 IICE O=C(CCN1C(=O)C(=Cc2cc(Cl)ccc2O)SC1=S)Nc1ccc(F)cc1 2314827723 LDSCYZRSFMQNQR-UHFFFAOYSA-N 436.917 4.415 10 10 IICE CCOc1ccc(C=C2SC(=S)N(Cc3cccc(C(=O)O)c3)C2=O)cc1OC 2326974290 YDPDHTIKNANZTB-UHFFFAOYSA-N 429.519 4.194 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478425 XQUBCKFRSLPEOD-YDIMBITNSA-N 434.540 4.493 10 10 IICE Cc1ccc(/C=C2\C(=O)N(c3cccc(Br)c3)C(=O)N=C2O)cc1[N+](=O)[O-] 33317040 SYTFAZMXPSFHPQ-AUWJEWJLSA-N 430.214 4.172 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)OC(C)(c4ccccc4)OC3=O)o2)cc1 59567111 CZNIBGJTQSLTJB-UHFFFAOYSA-N 432.428 4.480 10 10 IICE CSC1=NSC2=NC(=O)/C(=C/c3ccc(OCCOc4ccccc4)cc3)C(=N)N12 96450459 WYXSOMZJYLIPJU-GQCVOSMTSA-N 438.534 4.084 10 10 IICE O=C(COc1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1)N1CCCCC1 211948872 YKIYYICREYTOIP-HMMYKYKNSA-N 438.574 4.484 10 10 IICE O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccnc1)N2 226897089 HEPZVZBTBUTURQ-TZBSWOFLSA-N 431.561 4.429 10 10 IICE Oc1cc2c(cc1CNc1ccc(I)cc1Br)OCO2 312625227 RJVVJLXBFNNLQW-UHFFFAOYSA-N 448.054 4.100 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCN(c3ccccc3)C2)C1 443944585 HFOATSYSDAABMJ-OAQYLSRUSA-N 430.596 4.051 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H]4CN(Cc5ccccc5)C[C@@H]4C3)ccc(N)c2C1 705983506 YJJIVCRHQDRFNG-NHCUHLMSSA-N 448.611 4.130 10 10 IICE O=C(CSCC(=O)N(Cc1ccco1)Cc1ccccc1O)Nc1ccc(F)cc1 743430836 NXGSCTBJFGRWDS-UHFFFAOYSA-N 428.485 4.025 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccnn2[C@@H](C)CC(C)C)c(C)n1-c1ccccc1 746354867 YIZOGJBGFYYUND-IBGZPJMESA-N 435.572 4.195 10 10 IICE Cc1cc(N(C)C)cc(C)c1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768905709 GDGAJOYUEHJKHZ-UHFFFAOYSA-N 435.616 4.223 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 775718502 FOTAGKOEKDROEJ-CQSZACIVSA-N 436.350 4.423 10 10 IICE Cc1cc(Br)cc([C@@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)c1O 779019638 XZUXTMANCBGHBB-QWHCGFSZSA-N 427.364 4.246 10 10 IICE COc1ccc(N2C(=O)/C(=C/c3ccc(Br)cc3OC)SC2=S)cn1 781549821 JUBRKWMDOCTCOE-AUWJEWJLSA-N 437.340 4.267 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C2CCCCC2)[nH]n1 791249082 CDSJMBLCACBASG-UHFFFAOYSA-N 426.561 4.460 10 10 IICE CN1CC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1c1ccc(F)c(F)c1 805242898 GFVNCDRTXYJUKX-SJORKVTESA-N 430.282 4.222 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@H](C)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 812251921 JRXQKVXMNBXILT-DENIHFKCSA-N 435.572 4.147 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)o1 1084416028 QHOKYWCCLUQJNZ-UYRXBGFRSA-N 431.404 4.084 10 10 IICE O=C(Cc1cc(Cl)ccc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127267201 GVPXDQUOJHACCT-UHFFFAOYSA-N 432.395 4.384 10 10 IICE CCCN(CC)c1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1127268182 UKQOEFXVPJUQPI-UHFFFAOYSA-N 434.628 4.385 10 10 IICE Cc1cc(CC(=O)N2CCC(NC(=O)NC3CCCCC3)CC2)c(C)n1-c1ccccc1 1136395662 UKTIBRGVGBLHOY-UHFFFAOYSA-N 436.600 4.260 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1-c1ccccn1 1137438273 JXLKHEGIHFBFMJ-FQEVSTJZSA-N 438.959 4.243 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(c4cccc(Br)c4)CC3)CC2)cc1 1137658544 MBUMDGAORBXQRZ-UHFFFAOYSA-N 429.358 4.228 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@@H]3NC(=O)NC3=O)cc2)c(C)n1-c1cccc(C(C)C)c1 1149229326 OFTDZUGCUFCPRR-QFIPXVFZSA-N 430.508 4.350 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCN(c2ccccc2Cl)C1 1150348981 UCQURSOWARCORI-VQIMIIECSA-N 448.394 4.306 10 10 IICE COC(=O)c1cc(C2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)no1 1152837757 CMHQWTWALNZYDF-UHFFFAOYSA-N 425.460 4.028 10 10 IICE COc1ccc([C@@H](NC(C)C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1160693025 LKWYCHMOSNIZLP-JOCHJYFZSA-N 447.526 4.121 10 10 IICE CC1(C)[C@@H](c2ccccc2F)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751261 YBLCDKAZXYKQKW-GOSISDBHSA-N 447.501 4.418 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc2c1OC(F)(F)O2 1264992911 QXILULJZMYJFEY-UHFFFAOYSA-N 426.366 4.008 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccnc3OCc3ccccc3F)C2)cc1 1276832436 USNFHBWBJNEJSL-GOSISDBHSA-N 435.499 4.065 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnn(Cc2ccccc2)c1Br 1290291579 ZTVCRBPWCHODHC-UHFFFAOYSA-N 427.346 4.032 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1291361144 HPFMFZNTWNLQOB-YKSBVNFPSA-N 439.629 4.455 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N[C@@H](c1cccc(F)c1)c1cccc(Br)c1 1294755111 BIMZMMWWCSJUHI-OAQYLSRUSA-N 430.273 4.448 10 10 IICE Cc1ccc([C@@H](NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)[C@H](C)S(C)(=O)=O)cc1 1297147339 CQVDHRPFWSPNKR-MBSDFSHPSA-N 442.556 4.446 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1302008354 MNTVFPMMVWBLKQ-SFHVURJKSA-N 447.599 4.128 10 10 IICE C[C@H]1CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C[C@H](C)O1 1305152626 RIGCAKLUHGCBKT-GJZGRUSLSA-N 433.578 4.337 10 10 IICE CC1CCN(Cc2csc(NC(=O)CN(Cc3ccc(N(C)C)cc3)C3CC3)n2)CC1 1307424988 YYFVNIDHXHZUQC-UHFFFAOYSA-N 441.645 4.044 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)c(OC)c1 1454475952 OWKLUYGETPJVIP-UHFFFAOYSA-N 437.515 4.213 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](C)Oc3ccc(C)cc3Br)C2)cc1 1461077957 QZSXTVJMVBKMEL-SJORKVTESA-N 447.373 4.176 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(Nc2ncccn2)c1 1467630215 YPRVWPLKBUHNHJ-UHFFFAOYSA-N 447.539 4.222 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3nc4cc(Br)cnc4[nH]3)c2C)cc1 1468328969 HBSLRBFWVCLFHD-UHFFFAOYSA-N 440.301 4.389 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCC1(CNC(=O)OC(C)(C)C)CC1 1469811248 BCGLHSSUICAOGP-UHFFFAOYSA-N 439.556 4.331 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC1(C)CCC2(CC1)OCCO2 1471499037 LBGULGOEGIBUNI-UHFFFAOYSA-N 441.366 4.010 10 10 IICE COc1cccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1473327728 WDBWISXQXZZDLB-HZPDHXFCSA-N 428.488 4.148 10 10 IICE CCC(C)(C)Cn1c([C@@H]2CCCOC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1494754471 WNZIZIOOIBZFLE-HXUWFJFHSA-N 441.620 4.334 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCOC(C)(C)C 1495753083 OXGOFWJAAMJECM-KRWDZBQOSA-N 433.572 4.081 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1503139025 OLHIEEDKYOUQFH-OAQYLSRUSA-N 443.661 4.256 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1511989828 SMLCNIYPHXXNQS-BGYRXZFFSA-N 439.648 4.315 10 10 IICE CC[C@@H]1[C@@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1525593831 MYNSMEMDIMMRGC-PZJWPPBQSA-N 448.519 4.436 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4c(F)cccc4F)CC3)ccc21 1529753348 FBABRFLWAYBGJY-UHFFFAOYSA-N 427.495 4.145 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-c2ccc(Cl)cc2)on1 1546151692 DCHAPLQSQFEQHY-UHFFFAOYSA-N 435.263 4.169 10 10 IICE CCC[C@](C)(O)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1546838540 GCRHKAFZBHCXPY-VWLOTQADSA-N 434.588 4.128 10 10 IICE CN(CC1CCC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1554222430 VQKWNXCYRXEAIS-UHFFFAOYSA-N 439.648 4.360 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(-c2ccc(F)cc2)no1 1556426471 ODNMJEROIDLLKY-UHFFFAOYSA-N 439.487 4.483 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)CCCC1 1557180281 BRLVUFHILGJQJF-IAGOWNOFSA-N 443.588 4.337 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccccc1SCC(=O)N1CCCC1 1570416734 LBIGDKSSWITPAY-LJQANCHMSA-N 439.625 4.137 10 10 IICE Cc1cc(CC(=O)NC/C=C/CNC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1597517525 LFYGHVOMYOMKNC-VOTSOKGWSA-N 431.964 4.487 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C)c2nccs2)cs1 1612392768 IFJKMNGBRBYROA-CQSZACIVSA-N 440.598 4.236 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](CC(N)=O)C1 1614272848 QWNNBSMWRFDDII-CTTRRDQISA-N 446.599 4.411 10 10 IICE Cc1ccc(CN(CCOCCNC(=O)OC(C)(C)C)c2ccc3c(c2)OCCO3)s1 1615958285 VYAKCGMESJJQFE-UHFFFAOYSA-N 448.585 4.376 10 10 IICE Cc1ccc(C(=O)N2CCC[C@@H](c3nncn3C(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1616710142 SYKXHIQKQBQQIV-OAQYLSRUSA-N 433.556 4.407 10 10 IICE CSCCCN(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1620286745 PYLWQCXNHDQEPI-NRFANRHFSA-N 443.661 4.256 10 10 IICE CCSc1ccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c(Br)c1 1625607951 QSVFDQINEQRHTE-UHFFFAOYSA-N 449.414 4.257 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 1627068606 BQQWLZVLNDQVCO-UHFFFAOYSA-N 428.448 4.391 10 10 IICE Cc1ccc(C(=O)N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)cc1-n1c(C)cc(C=O)c1C 1628760491 VXRUCOFQCRWEKC-JYFHCDHNSA-N 434.511 4.155 10 10 IICE COc1ccc(-c2cc3nc(CN[C@H](C)c4cc(OC)ccc4O)[nH]c(=O)c3s2)cc1 1642504447 LMDALTJXPNLFRW-CYBMUJFWSA-N 437.521 4.225 10 10 IICE C[C@@H](NC(=O)c1ccc(Br)cc1I)c1ccccc1O 1642828054 XNZZPFVKQKYJQV-SECBINFHSA-N 446.082 4.250 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N(C)CC1CCCCC1 1643540010 HIZJTLALMJDOPO-UHFFFAOYSA-N 429.586 4.472 10 10 IICE C[C@H](S[C@@H](C)C(=O)OC(C)(C)C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1652801233 SDQURUJZVUXNOW-KBPBESRZSA-N 439.533 4.252 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC(Cc4ccc(C(C)C)cc4)CC3)nc12 1653179960 GBRDCNQZQPMIGJ-UHFFFAOYSA-N 436.556 4.190 10 10 IICE Cc1cccc(C)c1OC[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1ccccc1 1653883222 CZYSAWXNCNFYIA-VWLOTQADSA-N 431.580 4.396 10 10 IICE COC(=O)CN(CCC1CCN(C(=O)OC(C)(C)C)CC1)Cc1cc(Cl)ccc1O 1657603382 VDWQONLWLGQEQS-UHFFFAOYSA-N 440.968 4.058 10 10 IICE CCCCN(CC(=O)Nc1sc2c(c1C(=O)OCC)CCC2)Cc1ccccc1O 1658434676 ZWRFOAAGJDAJMV-UHFFFAOYSA-N 430.570 4.360 10 10 IICE C[C@H](c1cc2ccccc2o1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686724227 OWLTZVFWDRSARK-OAHLLOKOSA-N 429.467 4.450 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@@H]3C)n2CCCCCCO)c(C)n1-c1ccccc1 1692986281 PLVKZNIRKHEBOY-FQEVSTJZSA-N 437.588 4.130 10 10 IICE CCC1CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1694903476 ATULVVYLADEQQO-UHFFFAOYSA-N 439.583 4.020 10 10 IICE COCCC1(Cn2c(N3CCCN(c4ccc(OC)cc4)CC3)nnc2C(C)(C)C)CC1 1697947217 FEOZGXIPCDUNMH-UHFFFAOYSA-N 441.620 4.118 10 10 IICE CC[C@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1708585721 HZNWXJWOGONGFT-SFHVURJKSA-N 435.620 4.053 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@@H]1CCCCO1 1743563799 MSRVFRZGOVHDHR-OFNKIYASSA-N 441.620 4.224 10 10 IICE CC/C=C/Cn1c(CC2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1745104798 CBMGPMZZBSLTHC-QPJJXVBHSA-N 427.568 4.451 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCc2cccs2)cs1 1762268455 VULFZVBCHBXRKC-UHFFFAOYSA-N 425.583 4.280 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1)OC 1763855853 FFIWEZBXDKFAOF-OAQYLSRUSA-N 437.588 4.393 10 10 IICE COc1cc(C)c(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)[C@H](C)C(=O)N3)cs1 1859574426 LLARYPJGFJKKFY-ZDUSSCGKSA-N 443.550 4.292 10 10 IICE O=C(O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cccc1[N+](=O)[O-] 1951946892 DIZPAKVCBNXTMI-LJQANCHMSA-N 448.431 4.355 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)NCCCCN=[N+]=[N-] 1963731941 DFXMZFFWMAAEFM-HNNXBMFYSA-N 440.342 4.092 10 10 IICE Cc1ccc([C@H](C)n2nc(C(C)(C)C)c(C(=O)O)c2I)c(O)c1 2079034478 NDSTUUFVVKQXPV-JTQLQIEISA-N 428.270 4.107 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2cc(Br)cc(F)c2O)C1(C)C 2105944113 FAKJCPFBZUTBEL-CYBMUJFWSA-N 431.346 4.419 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(Br)cc2)C(=O)C1=Cc1cccc(O)c1 2293724491 JJMAQMUHDMNFIU-UHFFFAOYSA-N 428.282 4.422 10 10 IICE CCOC(=O)[C@@H](C)N1C(=O)SC(=Cc2cc(C)n(-c3ccc(N(C)C)cc3)c2C)C1=O 2294010801 LCFYVNGMIUSPIA-MRXNPFEDSA-N 441.553 4.148 10 10 IICE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1cccc2ccccc12 2313682961 OOHXBUBNNRRTBA-UHFFFAOYSA-N 444.447 4.400 10 10 IICE COc1ccc2c(c1)C(=CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCCCC1)CC2 2326006534 XUGXGEVOXGVHFU-AREMUKBSSA-N 433.596 4.434 10 10 IICE Cc1ccc(CN2CC3(CC(NC(=O)OCc4ccccc4)C3)C2)c(O)c1Br 2327600312 SSRKIECPYLBOHW-UHFFFAOYSA-N 445.357 4.354 10 10 IICE N=C1/C(=C\c2cn(Cc3ccc4c(c3)OCO4)c3ccccc23)C(=O)N=C2SC=CN12 2431840 KUKKGZNWWRVATD-LMMXRSGHSA-N 428.473 4.195 10 10 IICE CC[C@H]1SC(=S)N(CCC(=O)Nc2ncc(Cc3ccc(Cl)cc3)s2)C1=O 11635795 MPNARMMFYNWGON-CQSZACIVSA-N 440.015 4.355 10 10 IICE COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)/C1=C/c1ccc(Br)cc1 100276611 SZNAQLORODFKDX-XDHOZWIPSA-N 442.309 4.331 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C/c1cc(OC)ccc1OC 101394325 WTJWZOJBNPGHHG-GZTJUZNOSA-N 443.883 4.243 10 10 IICE O=S(=O)(Nc1nc(-c2ccccc2)c(CN2CCOCC2)s1)c1ccc(Cl)cc1 170548737 IBSSCMCPNPEFMG-UHFFFAOYSA-N 449.985 4.097 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(Nc3ccccc3)C2=O)ccc1OCCC(=O)O 210465656 VNPNKNPYSFTBBA-AQTBWJFISA-N 444.534 4.167 10 10 IICE O=S(=O)(Nc1nc(-c2sccc2Br)cs1)c1ccc(Cl)nc1 727248438 QAMLVHKUJPVWMR-UHFFFAOYSA-N 436.765 4.483 10 10 IICE Cc1cc(C(=O)COC(=O)c2csc(-c3cnccn3)n2)c(C)n1-c1ccc(F)cc1 728378097 CVKININRKOOLHD-UHFFFAOYSA-N 436.468 4.186 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)ccc21 730249296 BSTXDUYVCRXFBX-LJQANCHMSA-N 443.588 4.281 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)cc1 734073576 LKPXNAVZLGHXEB-XMMPIXPASA-N 446.551 4.253 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1ccc(N3CC=CC3)cc1)O[C@H](C)C2 740915400 PPVICHVWXNVLKW-FHZYATBESA-N 433.552 4.140 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCOC2)no1 752845687 OIHQMSTVIMDZGB-HXUWFJFHSA-N 446.555 4.322 10 10 IICE COC[C@@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1 752957791 KTFCIERGJYONOG-HXUWFJFHSA-N 437.462 4.083 10 10 IICE O=C1[C@@H]2C[C@H](C3CCCCC3)CN2C(=O)N1C1CCN(c2ccc(OC(F)F)cc2)CC1 761158699 KZGJSALXHKMQKP-UWJYYQICSA-N 447.526 4.490 10 10 IICE COc1ccc(N2CCC(N3C(=O)N[C@H](C[C@H]4CCCc5ccccc54)C3=O)CC2)cc1 761221189 ICOBOFHQXSNPKW-NTKDMRAZSA-N 433.552 4.095 10 10 IICE CSc1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)ccn1 766752513 ZXBPQXGBQRLIMW-SDNWHVSQSA-N 435.621 4.485 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3CCC[C@@H](c4nncn4C4CC4)C3)c2C)cc1 774696376 DPMYUWJSWZWDHY-HXUWFJFHSA-N 447.583 4.482 10 10 IICE Cc1cc(Br)c(O)c(CNCC(=O)Nc2cc(Br)ccc2C)c1 781629848 BEWWSACFEYAVFO-UHFFFAOYSA-N 442.151 4.262 10 10 IICE O=C(NCc1ccc(C2CC2)cc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 790205294 ZGJJXAAANGEDRZ-UHFFFAOYSA-N 433.474 4.419 10 10 IICE O=C(CO[C@H]1CCCc2ccccc21)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 797435437 HQLRLQZKXKJDJO-QFIPXVFZSA-N 448.485 4.252 10 10 IICE Cc1cc(F)cc([C@]2(F)CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)c1 800701647 TZUQVTFSHCRZKO-DEOSSOPVSA-N 447.501 4.015 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c(C)nn(C)c3Sc3ccccc3)C2)cc1 1130185802 RSRCXFLZNDZLEJ-GOSISDBHSA-N 436.581 4.145 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4cccc(C)c4)c3C(F)(F)F)C2)cc1 1131029756 GBCSRKAOAMQAGL-INIZCTEOSA-N 444.457 4.217 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1-n1c(C)cc(C=O)c1C 1148752808 CLGYPBOVHDBHPP-JOCHJYFZSA-N 449.938 4.404 10 10 IICE CCOC(=O)[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cc(C)n(-c2ccccn2)c1C 1154177344 GUWDYFNWYQEWGM-SANMLTNESA-N 431.536 4.270 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@]3(C(=O)OC(C)(C)C)CCCO3)cc2Cl)C1 1155727482 SYSHPJYDBKNEQI-HJPURHCSSA-N 436.980 4.083 10 10 IICE CC(=O)c1cc(F)cc(CN(Cc2cc(C)nc(N3CCCCC3)n2)CC(C)C)c1O 1168233171 DNYHWNFOJFJBQR-UHFFFAOYSA-N 428.552 4.481 10 10 IICE CCOc1ccc(N(CC(=O)N2CCCN(Cc3ccc(C)cc3)CC2)CC2CC2)cc1 1196952994 PHSMGYJSLBBFOC-UHFFFAOYSA-N 435.612 4.345 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3cccc(Oc4ccccc4)c3)CC2)c(OC)c1 1197104845 MDKXHSFINUDXLL-UHFFFAOYSA-N 447.535 4.257 10 10 IICE COc1ccc(N(CCOc2cccc(S(C)(=O)=O)c2)Cc2ccccc2)cc1OC 1198837115 JIISAGJSDCGDQT-UHFFFAOYSA-N 441.549 4.193 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@H]1COc2cccc(Br)c2C1 1235756893 UNRBGAJOQJOMQH-MRXNPFEDSA-N 433.346 4.470 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(Cc2nc3ccccc3s2)C2CC2)N(C)C)cc1 1251499991 AYLHDEFOJIHCOX-NRFANRHFSA-N 437.613 4.339 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(CC(=O)OC)Cc3ccc(Cl)cc3)ccc21 1264645159 LLGFNZCYPPNRPH-UHFFFAOYSA-N 442.943 4.373 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@]34C[C@H]3CN(C(=O)OC(C)(C)C)C4)cc2Cl)C1 1270440621 RTFVHPHEOJGKMN-READRUSDSA-N 448.007 4.450 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cccc(OCC(=O)N(C)C)c3)c2C)c1 1291692466 NMIYZDMNOBLEMM-UHFFFAOYSA-N 433.552 4.108 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1295414495 IWKFCRYFABWHMD-AJSBUHFISA-N 441.620 4.275 10 10 IICE Cc1cc(C(=O)CSc2nnnn2Cc2cccs2)c(C)n1-c1ccc(F)cc1 1307277273 LYSLBKZBXUVKLV-UHFFFAOYSA-N 427.530 4.305 10 10 IICE COc1ccc(N(C)C[C@H](NS(=O)(=O)c2ccc(C)cc2)c2ccccc2)c(OC)c1 1307597424 HCPBHKCTQSJBKR-QFIPXVFZSA-N 440.565 4.168 10 10 IICE C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1312363171 CRDKCQNLRVCHKA-HRAATJIYSA-N 436.522 4.305 10 10 IICE CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCc1cccc(Br)c1O 1312558077 OUNKCCOKVZCZOH-IBGZPJMESA-N 434.378 4.111 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CCCCS3)CC2)cc1F 1315512783 NQCICHFTQDPNHR-GOSISDBHSA-N 447.624 4.336 10 10 IICE COc1ccc(-c2noc(CCCC(=O)N(C)Cc3ccc(N4CCCC4)cc3)n2)cc1 1351674387 UNARFRNKPODANN-UHFFFAOYSA-N 434.540 4.327 10 10 IICE CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357613341 YRTQKYOSLABFGC-HFJWLAOPSA-N 437.559 4.439 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)CCCc3ccccc3)CC2)c(C)n1-c1ccccc1 1358298769 ABCDXUNELRLCDD-UHFFFAOYSA-N 443.591 4.330 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@@H](c2ccnn2C)C1 1361098080 NHDGUVWZVKPGCE-OAQYLSRUSA-N 449.647 4.407 10 10 IICE CCc1cc(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c2c(CC(C)(C)C)noc2n1 1437581349 STEHZDVMNOBFNY-QGZVFWFLSA-N 436.556 4.391 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)/C(F)=C\c1ccc(C(F)(F)F)cc1 1444752909 YQMABOLOEBLBEI-YBFXNURJSA-N 440.412 4.432 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H](c3c(F)cccc3Cl)N3CCCCC3)C2)cc1 1461496114 OIELHJTVGADREB-SBUREZEXSA-N 445.966 4.410 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)cc3O)cc2F)C[C@H](C)O1 1464309856 OAMFWOLFFYKMKV-STQMWFEESA-N 426.410 4.094 10 10 IICE CC[C@@H](Cc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1464758602 HKSSKVJKUOWFDT-INIZCTEOSA-N 430.551 4.006 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1469959986 MPHXYYFOUBFNCQ-WMZOPIPTSA-N 435.996 4.450 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)O1 1479233070 UBFGYESWYYDSBQ-HIFRSBDPSA-N 439.272 4.186 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H](c3ccc(F)cc3)CC2)N(C)C)cc1 1479533619 HSXZHRTUIFXOEA-CYFREDJKSA-N 426.580 4.474 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)CC2CC(F)(F)C2)cc1 1501837443 DKCFCZPDTXRAAL-UHFFFAOYSA-N 443.546 4.055 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCc1ccco1 1501853185 AJCPCBNYGIQUNN-UHFFFAOYSA-N 446.555 4.108 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC(F)(F)CO1 1512804235 JFJNCPDADHUZEA-PXNSSMCTSA-N 433.547 4.452 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512878449 ZDIRQSNQPXITRB-UYAOXDASSA-N 429.584 4.298 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCOC(F)F 1512984506 OGQODPXHFTZIND-QGZVFWFLSA-N 437.535 4.146 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CC[C@@H](C)[C@H]2C)cc1 1515520966 BDPWPSLTUIUUFB-RTBURBONSA-N 447.587 4.055 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCOc2ccc(C(F)(F)F)cn2)CCCC1 1518801000 POYQHQDUFYPWJT-UHFFFAOYSA-N 447.457 4.138 10 10 IICE CC(C)(C)c1nc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)co1 1521122515 QRMCVVJKXXQUBL-MHWRWJLKSA-N 448.541 4.446 10 10 IICE CO[C@@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C1CCCC1 1530035433 FVCDHGJPRDTSAX-WLSWZUKCSA-N 438.640 4.051 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(N4CCC(C)CC4)cc3)cc2F)CC1 1530377735 ZSGRWWWGRBIVDV-UHFFFAOYSA-N 438.591 4.134 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2CCCn3cc(C(F)(F)F)nc32)cc1 1537497362 GBOCOQBKTUROSK-HNNXBMFYSA-N 448.411 4.436 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@]1(C)CCCS1 1541325575 CTKYVZRARSCZII-QHCPKHFHSA-N 429.634 4.160 10 10 IICE Cc1cc(C(=O)NCCNC(=O)Cc2cccc(F)c2)c(C)n1-c1ccc(C(C)C)cc1 1542755966 LUDGNUNKDNRPAH-UHFFFAOYSA-N 435.543 4.445 10 10 IICE CC[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)NC(=O)OC(C)(C)C 1556692411 LWISXWUPRJYKLB-FQEVSTJZSA-N 427.545 4.248 10 10 IICE CCO[C@H]1CCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1616602591 MXYNQZJOVWLMHJ-DLBZAZTESA-N 437.635 4.164 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)C(C)(C)C)CC3(C)C)c2C)cc1 1623933073 LFERQPLJRFXOMS-UHFFFAOYSA-N 425.573 4.212 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)cc1 1624269715 CRLZIHUAZNAUNE-OAQYLSRUSA-N 443.591 4.430 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)C[C@H](C)NC(=O)OC(C)(C)C)c1 1638952484 MKKCFKIGGFSSKT-HOTGVXAUSA-N 427.545 4.328 10 10 IICE CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)CCC2 1676653737 WFYBTPKKKKCGGD-PMACEKPBSA-N 429.634 4.093 10 10 IICE CCn1cc(CN(C)c2nnc(-c3ccccc3)n2CCCSc2nccs2)cn1 1695783008 UMYXGLYBSNZGFG-UHFFFAOYSA-N 439.614 4.437 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](CC)C1 1705895526 JSORBAAYYQGUAQ-NRFANRHFSA-N 446.599 4.281 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](CC)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1709258703 NAPUSUNIHIMIDY-RBUKOAKNSA-N 429.584 4.442 10 10 IICE C[C@H](CN1CCCC1)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1741868422 OBLBRMUQCGLIHW-QGZVFWFLSA-N 440.979 4.067 10 10 IICE CCOCCCCn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1766523924 JPZPXZMZDXKIAH-UHFFFAOYSA-N 443.636 4.409 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(CC)n1Cc1ccc(N2CCSCC2)cc1 1768398126 QULBYMYGUZTFFR-SFHVURJKSA-N 433.691 4.410 10 10 IICE COCCCN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1771033591 NUVHYRNLIZGFIZ-UHFFFAOYSA-N 434.588 4.097 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1c(C)noc1C 1771065705 GGNGEEDHBMHZDY-UHFFFAOYSA-N 434.544 4.088 10 10 IICE CC(C)Oc1ccc(S(=O)(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1858074648 PRLSFGGUYSDYAG-XMMPIXPASA-N 445.629 4.045 10 10 IICE CCN(CC)CCNC(=O)c1ccc(/N=N/N2CCN(C/C=C/c3ccccc3)CC2)cc1 1860481176 REMLJXRQARDRAF-DADYSPOESA-N 448.615 4.088 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)c2ccc(C(=O)c3ccccc3)cc2)c2nccn2C)cc1 1865964973 FURJOKUPHMEBFW-XMMPIXPASA-N 438.531 4.237 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)cc1O 1951841618 BKUAOFVLNCQLCE-RUZDIDTESA-N 433.460 4.326 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NCc3cc(Br)cc(F)c3O)CC[C@H]2C1 1962831809 XSPBZPZBGYWMMR-PEYYIBSZSA-N 429.330 4.029 10 10 IICE CN1CCc2cc([C@@H](N)C[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536538 LLTAWPQMMLZRFE-YADHBBJMSA-N 425.573 4.179 10 10 IICE O=C(OCc1ccccc1)N1C[C@H](NCc2c(O)cccc2Br)C2(CCC2)C1 2028689925 PAHXSTJPROKXPW-FQEVSTJZSA-N 445.357 4.436 10 10 IICE CN(C)c1ccc([C@H](O)c2cc(Br)ccc2I)cc1 2106797620 CIVDECJAKZXRBP-HNNXBMFYSA-N 432.099 4.201 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(NCc3cc(Br)cc(F)c3O)CCC[C@@]2(F)C1 2182446910 DBUQZYXXHHWKSD-MOPGFXCFSA-N 447.320 4.265 10 10 IICE Cc1cccc(OCCCOc2cccc(C=C3C(=O)NN(c4ccccc4)C3=O)c2)c1 2293345721 MTADTLZWHSWHMB-UHFFFAOYSA-N 428.488 4.304 10 10 IICE CCOc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccccc1C 2297347415 HOGVJIHUYLOYBN-UHFFFAOYSA-N 447.491 4.302 10 10 IICE COc1ccc2[nH]cc(C=C3SC(=S)N([C@H](Cc4ccccc4)C(=O)O)C3=O)c2c1 2297471607 UEEILFGJBHVNAT-GOSISDBHSA-N 438.530 4.074 10 10 IICE Cc1ccc(CN(C)[C@]2(C(=O)O)CC[C@H]2OCc2ccccc2)c(O)c1Br 2381129523 LHWIYRLATLGCPB-DYESRHJHSA-N 434.330 4.098 10 10 IICE COc1ccc([C@@H]2Nc3ccc(C(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@@H]32)cc1OC 14479715 WZSJEHQOMYRBNY-GBWYYYKWSA-N 434.536 4.439 10 10 IICE CN(C(=O)CCCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1 96515300 LNISULGIKUEYOR-UHFFFAOYSA-N 426.472 4.234 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccccn3)CC2)c(C)n1-c1ccc(Br)cc1 247847371 SYULBDQNVTXGBZ-UHFFFAOYSA-N 439.357 4.214 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN(Cc1ccccc1)Cc1ccccc1 302917005 OOSBGMAMXBEONX-UHFFFAOYSA-N 443.591 4.184 10 10 IICE CC[C@@H](NCc1cnn(C)c1NC(=O)OC(C)(C)C)c1cc(Br)ccc1O 379932377 WUKWRFVFUFOSFC-OAHLLOKOSA-N 439.354 4.476 10 10 IICE CC(=O)NCc1ccc(-c2nc(NS(=O)(=O)c3ccc(F)cc3C)sc2C)s1 727249332 VPYGBOXRIFCHPM-UHFFFAOYSA-N 439.559 4.064 10 10 IICE Cc1cc(CCNC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 765555196 IBABOZSBGPJWOS-IBGZPJMESA-N 435.515 4.301 10 10 IICE CCCN(CCC)c1ccc(CN2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)cc1 769428240 NYJKHYHKRWVVLP-UHFFFAOYSA-N 449.583 4.101 10 10 IICE COc1ccc(N2CCN(C(=O)CCCC(=O)c3ccc(Br)cc3)CC2)cc1 770813263 GPTUYOUBDFQHOB-UHFFFAOYSA-N 445.357 4.160 10 10 IICE O=C(CSc1nnc(C(F)(F)F)s1)Nc1cccc2c1C(=O)c1ccccc1C2=O 780358049 WABHCJGDKWENDM-UHFFFAOYSA-N 449.435 4.063 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CN(C)C3CCN(c4cnccn4)CC3)c2C)c1 789367175 RDGFYDDIJYUJLJ-UHFFFAOYSA-N 449.624 4.390 10 10 IICE Cc1cc(-c2nnc(N3CCC(C(=O)N(C)C)CC3)n2CC(C)C)c(C)n1-c1ccccc1 802678360 WQNSOCXCCDUUPJ-UHFFFAOYSA-N 448.615 4.313 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cc2sc(N3CCCC3)nc2s1 804741419 XSYJPKWDCNTGRH-UHFFFAOYSA-N 438.372 4.356 10 10 IICE O=C(NCc1ccc(Oc2cccnc2)c(F)c1)NCc1cc(Br)ccc1O 806537596 MWRAEXDXPBAWHT-UHFFFAOYSA-N 446.276 4.481 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Nc1ccc(F)c(C(=O)OC)c1C 810264641 XFGABMLOMVUXPO-UHFFFAOYSA-N 439.281 4.443 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@H]1c1nnc(CC(F)(F)F)o1)c1ccc(N(C)C)cc1 812200066 NTWIEUNWKKSJFT-CJNGLKHVSA-N 425.455 4.238 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3ccc(NC(C)=O)cc3F)cs2)s1 917871441 PKGOWQACBCEMDB-UHFFFAOYSA-N 425.532 4.332 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccsc3Br)cc2F)C[C@H](C)O1 1125188719 UXRHPLDBCORGGX-RYUDHWBXSA-N 427.339 4.193 10 10 IICE COc1cccc([C@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCCC2)c1 1135279714 MDUCICAWUVDJII-SANMLTNESA-N 445.563 4.482 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1136442911 JENPOKBYIBFLDD-BBTUJRGHSA-N 433.593 4.030 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1 1138047183 IQHBXZKAIZMKSR-AFMDSPMNSA-N 429.564 4.086 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(s1)CC[C@H](C(C)(C)C)C2 1138053242 CHQSGUDHJHTVMY-IRXDYDNUSA-N 445.581 4.215 10 10 IICE COC(=O)c1cn(-c2cccc(NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)c2)nn1 1140577962 OTVXQLXPIHQFFA-UHFFFAOYSA-N 429.480 4.022 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(Br)c2ccccc2c1 1167763086 XFTFGNZNKUIDMC-UHFFFAOYSA-N 439.353 4.493 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC[C@H]3CCC4(CCOCC4)CO3)c2C)cc1 1177602102 GMBPCCAXKMKHRS-JOCHJYFZSA-N 426.557 4.198 10 10 IICE CCS[C@@H]1CCCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 1190936113 VHLKEDXXDZUAKA-DLBZAZTESA-N 436.577 4.397 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)[C@@H](O)c3c(Cl)cccc3Cl)C2)cc1 1230857416 AMKABXLYAHJALN-LAPQFRIASA-N 438.355 4.002 10 10 IICE CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1264689251 NRDLHSGDVMZMEF-GJZGRUSLSA-N 444.938 4.233 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CC[C@@](C)(CC)C2)cc1 1295406670 ZHGSNYCRJRZWCQ-RUZDIDTESA-N 438.620 4.035 10 10 IICE CCN(CC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)c1ccc(OC)c(OC)c1 1307575028 UJJYDDFPZFQSDG-NRFANRHFSA-N 445.991 4.137 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1313121143 VRURGYCQHNVSLM-BWKNWUBXSA-N 435.616 4.168 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCN(C(C)C)C1 1316302671 QGXYGICRXBGSHK-OAQYLSRUSA-N 436.604 4.471 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C/c3ccc(F)c4ccccc34)CC2)cc1 1353705566 CYQHVVSFORCRBS-RIYZIHGNSA-N 447.554 4.329 10 10 IICE CC[C@](C)(NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nccs1 1353971781 NJJXWJVUMAZBIA-IURSYISVSA-N 449.598 4.315 10 10 IICE Cc1cc(C(=O)NCCCCN2CCC(C)CC2)c(C)n1-c1ccc(Br)cn1 1441498350 ROBYMFSZJOIBAD-UHFFFAOYSA-N 447.421 4.494 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1450061653 YWQBWHXVQSSENF-DLBZAZTESA-N 427.545 4.247 10 10 IICE CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1458023931 YYNVLMNEXQXFQK-NYMACZPPSA-N 441.660 4.312 10 10 IICE Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1462465013 BHMTVJUGUZLAIK-UHFFFAOYSA-N 442.535 4.079 10 10 IICE Cc1ccc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CC2)cc1-n1c(C)cc(C=O)c1C 1465343692 HYILDEMNEYRYDT-NRFANRHFSA-N 439.556 4.248 10 10 IICE COc1cccc(CNC(=O)[C@H]2CCCCC23CCN(C(=O)OC(C)(C)C)CC3)c1O 1465993551 SIALOONHNXXTTJ-GOSISDBHSA-N 432.561 4.225 10 10 IICE Cc1cc(C(=O)N(Cc2cnn(C)c2)CC(C)C)c(C)n1-c1ccc(Br)cn1 1468786514 IHQFABMJHMQXSA-UHFFFAOYSA-N 444.377 4.284 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCN(C4CCCCC4)C3=O)cc2Cl)C1 1469961666 XFQRAYMRPIEWCP-DYESRHJHSA-N 447.023 4.309 10 10 IICE CN(CCC(F)(F)F)c1nnc(C2CC2)n1Cc1ccc(N2CCSCC2)cc1 1503568751 MKFDFGRHGSXMLC-UHFFFAOYSA-N 425.524 4.146 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1513372403 FRINVBSWDLNDNU-GOSISDBHSA-N 440.636 4.246 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCO[C@@](C)(C(C)(C)C)C1 1542227055 RIZCLNPCVIQSHS-RUZDIDTESA-N 436.604 4.337 10 10 IICE Cc1cc(C(=O)N[C@@H]2C[C@H](N(C)C)C23CCC3)c(C)n1-c1ccc(Br)cc1 1557697611 WJDKWAJJVYOBTF-UXHICEINSA-N 430.390 4.459 10 10 IICE CC[C@H](NC(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1cccc(OC)c1OC 1565240640 DCEAPYKMGPFFJZ-NRFANRHFSA-N 427.545 4.085 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnc2ncc(Br)cc2c1 1585264070 LIVKXKLHFUJGMA-AWEZNQCLSA-N 427.346 4.128 10 10 IICE Cc1cc(CC(=O)NC/C=C\CNC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1597517524 LFYGHVOMYOMKNC-SREVYHEPSA-N 431.964 4.487 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3nc(-c4ccc(C(C)C)cc4)no3)C2)cc1 1598364297 PHJPDSXNPTZLRP-IBGZPJMESA-N 448.567 4.444 10 10 IICE COc1ccc(N(Cc2ccc(C(C)C)cc2)Cc2nnc(S(C)(=O)=O)s2)cc1 1616231423 QZTLTPLRVASHAE-UHFFFAOYSA-N 431.583 4.280 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1 1624625757 ATBSTJIAPLNQIH-UHFFFAOYSA-N 449.576 4.360 10 10 IICE Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2cc3cc(O)c(O)cc3s2)c1C 1626906996 YRXHHYUJYOJBGI-OAHLLOKOSA-N 428.535 4.083 10 10 IICE CCCCN(C)CC1CCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CC1 1627188617 HHOHGRIQIXPQTP-UHFFFAOYSA-N 425.617 4.499 10 10 IICE Cc1nnc2n[nH]c(NC(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)c2c1C 1635124700 ANEMKQLFSTWVKA-UHFFFAOYSA-N 439.317 4.392 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1F 1635252847 AMEACCNSWTWJMI-UHFFFAOYSA-N 435.908 4.047 10 10 IICE C[C@@H]1CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC12CCC2 1637328090 KSIHVIYOVSBLKZ-QLENYVDCSA-N 432.586 4.456 10 10 IICE Cc1ccc(CC(C)(C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1638325566 WMROQPUNPCLESW-UHFFFAOYSA-N 444.578 4.314 10 10 IICE Cc1cc(C(=O)N2CCN(C)[C@H](C(C)(C)C)C2)c(C)n1-c1ccc(Br)cn1 1639428524 SAUUAWUYMNZAMV-SFHVURJKSA-N 433.394 4.054 10 10 IICE Cc1c(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cccc1NC(=O)N(C)C 1639929671 AUDLFGLZCDOELL-UHFFFAOYSA-N 432.524 4.490 10 10 IICE CCN(CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])Cc1cc(Br)ccc1O 1644711586 ZKTQDCCSJXGBLD-UHFFFAOYSA-N 442.697 4.177 10 10 IICE CC(C)CN(Cc1ccccn1)[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1655659147 VOOVOAWMSNDANP-SFHVURJKSA-N 441.531 4.342 10 10 IICE COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1F 1657960819 HVQCMJQZQRCUHU-CABCVRRESA-N 446.478 4.288 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(Cl)cc1 1658008036 AYNDMPZLLVESNX-HYFFOGBASA-N 447.982 4.450 10 10 IICE CN(CC(=O)NCCc1cnn(-c2ccccc2)c1)c1ccc(OCc2ccccc2)cc1 1658279690 FSBFAESVLKRPNO-UHFFFAOYSA-N 440.547 4.246 10 10 IICE Cc1cc(CCNC(=O)N2CCOC[C@@H]2C[C@H](O)c2ccccc2)c(C)n1-c1ccccc1 1674924263 NNIMZJGLGGYLTM-UIOOFZCWSA-N 447.579 4.171 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](c1nc(-c2ccncc2)no1)C(C)C 1683421290 LIBDOERTDACGJX-UWJYYQICSA-N 436.560 4.134 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCc4cc(Br)ccc43)C2)cc1 1683787923 SFBRDVHFRVNIHS-OXQOHEQNSA-N 430.346 4.023 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H]2Cc2cc(F)ccc2F)N(C)C)cc1 1685609216 MEWMHWAKANSMHJ-JTHBVZDNSA-N 430.543 4.050 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(c4ccc(Cl)cc4)CC3)cc2)CC1 1687441100 AOQDPXCWQSFSFF-UHFFFAOYSA-N 426.992 4.181 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCCC2)nnc1N1CCO[C@@H](C(F)(F)F)C1 1693006279 TXNIMNLWFGJWFU-LJQANCHMSA-N 437.510 4.126 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](OC)C1 1712389958 KSUULAGOUKRJPD-JPYJTQIMSA-N 437.588 4.250 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccncc1Cl 1729418279 CKBYADICNBFLNW-UHFFFAOYSA-N 441.322 4.432 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C[C@H]1C 1743166576 NPFVLHBSJGWWBL-VQTJNVASSA-N 425.621 4.234 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)[C@@H](C)C1 1745777994 OFLWVWDWBKJQFE-OALUTQOASA-N 448.615 4.361 10 10 IICE CCc1nnc(N2CCC(Oc3cc(C)ccn3)CC2)n1Cc1ccc(N(CC)CC)cc1 1763001033 DFIOXWXAAVGWDY-UHFFFAOYSA-N 448.615 4.486 10 10 IICE CC(C)(C)C(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1860548517 NODYBVJLWDJFRN-UHFFFAOYSA-N 427.460 4.094 10 10 IICE CCCN[C@H](CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1)c1ccccc1O 1947471572 WCPRQHPSHCWXQN-JOCHJYFZSA-N 427.589 4.460 10 10 IICE O=C(N[C@H]1CC[C@@H]1NCc1cc(Cl)cc(Br)c1O)OCc1ccccc1 1977132693 VMQZLKDBVLSBAX-IRXDYDNUSA-N 439.737 4.355 10 10 IICE Cc1ccc([C@@H](n2nc(C(F)F)c(CO)c2I)C2(C)CC2)c(O)c1 2079052813 XEZLVDPFRZFHSW-CQSZACIVSA-N 448.251 4.321 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1O 2236033486 RTOONQNXEHDOKL-UONOGXRCSA-N 443.382 4.336 10 10 IICE CNCc1ccc(N(C)Cc2cccc(I)c2)c(Br)c1 2280342746 HTQZHGKLTRKWQR-UHFFFAOYSA-N 445.142 4.410 10 10 IICE O=C(CN1C(=O)C(=Cc2cccc(Cl)c2)SC1=S)Nc1ccc2nccnc2c1 2296601821 AEZKQMGOCHMWCI-UHFFFAOYSA-N 440.937 4.123 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccc(Br)c2)SC1=S)N1CCCC1 2296755632 UUBGRMFJYFMBEH-UHFFFAOYSA-N 439.400 4.053 10 10 IICE CCCN(CCC)c1nc2ccc(C)cn2c(=O)c1C=C1SC(=S)N(C(C)C)C1=O 2296846611 DWFMNVOPWBFCIY-UHFFFAOYSA-N 444.626 4.239 10 10 IICE CN1C(=O)COc2cc(N3C(=O)C(=Cc4c(F)cccc4Cl)SC3=S)ccc21 2321736707 QEJJHYACHVIJQL-UHFFFAOYSA-N 434.901 4.240 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(O)c1Br 2381132859 GXUTVQYGPPMVJP-KGLIPLIRSA-N 441.366 4.115 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C/c1ccc([N+](=O)[O-])cc1 6172106 FHUHNSYNOYEQFB-MHWRWJLKSA-N 428.828 4.134 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@H]32)ccc1O 20692995 XYSAVTXIARQLBC-PNCHPQGNSA-N 426.538 4.012 10 10 IICE COc1ccccc1C(=O)NN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S 33326190 BEQIPWHEKFHQNN-XNTDXEJSSA-N 449.351 4.004 10 10 IICE CCOc1cc2c(cc1/C=C1\C(=O)N(c3cccc(Cl)c3C)C(=S)N=C1O)OCO2 33458107 JXKCSCYEWXPJSK-QPEQYQDCSA-N 444.896 4.447 10 10 IICE COc1ccc(/C=C2\C(=N)N3N=C(SCc4ccccc4)SC3=NC2=O)c(OC)c1 96473271 QQXNXVGOLNBUDR-WZBMNHFVSA-N 438.534 4.214 10 10 IICE CCN1C(=O)/C(=C\c2cc(Br)ccc2OCc2ccccc2F)NC1=S 105001228 WXFKYFHMCLEDII-MHWRWJLKSA-N 435.318 4.245 10 10 IICE CCNC(=O)Nc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1C 469125201 PJRRIEAKJUOXHV-UHFFFAOYSA-N 447.583 4.496 10 10 IICE Cc1ccc2c(c1C)OC[C@H]2NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 728309501 NJJWQADBKKFBAF-HXUWFJFHSA-N 431.483 4.307 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@H]1C[C@@H]1C1CCCCC1 743554427 DTPGPBIDZQYNNA-QUCCMNQESA-N 425.495 4.310 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccnc(Oc4ccc(F)cc4F)c3)CC2)cc1 788719072 DMHFJNVNQUFKMS-UHFFFAOYSA-N 425.435 4.123 10 10 IICE Cc1cc(-c2nnc(N3CCC(F)(F)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802694667 LXXZHZPTROEUMR-IBGZPJMESA-N 427.499 4.377 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3nc(C4CC4)oc3C)c2C)cc1 803918124 SGOYZBLXZUEYLO-UHFFFAOYSA-N 436.464 4.094 10 10 IICE CCOc1c(Cl)cc(CNC(=O)NCc2cc(Br)ccc2O)cc1OC 804937035 WRYXJCYLADRVEY-UHFFFAOYSA-N 443.725 4.215 10 10 IICE CCN(C)Cc1cc(O[C@H]2CCN(C(=O)c3sccc3-n3c(C)ccc3C)C2)ccn1 856638211 WUDGXLDFMUZZNM-NRFANRHFSA-N 438.597 4.296 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cccc(NC(=O)OCC(C)C)c3)CC2)cc1 920233448 BDZMJIFDSNRVNK-UHFFFAOYSA-N 426.517 4.254 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 1129814326 FFUOPGJAWNXBQJ-SFHVURJKSA-N 428.598 4.138 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082118 PLEAUEYTXOQFDG-PBHICJAKSA-N 438.906 4.312 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)cc1)C1CCCCC1 1142528059 HBEIYAMZANGLTI-ZBYYUNFXSA-N 427.589 4.185 10 10 IICE C[C@H](Oc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cn1)c1ccccc1 1158716691 HEYAPNGDORNQEV-CYFREDJKSA-N 432.568 4.320 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1251951665 SKPZSSVJTWWFMY-RISCZKNCSA-N 432.348 4.192 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3ccc(C(C)C)c(C)c3)CC2)c(OC)c1 1287478362 QUIVIKXDUWPPLT-LJQANCHMSA-N 426.557 4.252 10 10 IICE Cc1nc2c(cc1C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)c(C)nn2C 1297010636 RGEGWOPJQLWVFI-CQSZACIVSA-N 425.964 4.405 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1 1297892470 GENFKZPHMZNMKI-NRFANRHFSA-N 446.425 4.269 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1 1298840865 QZPGVOPMFRLYEK-JOCHJYFZSA-N 444.453 4.318 10 10 IICE C[C@@H]1C[C@H]1c1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n[nH]1 1299911227 RKQFNXAJROYEQT-HODWKROWSA-N 432.596 4.215 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCNC(=O)C(C)(C)C 1305380289 DXTHTEIUPNDLNJ-LJQANCHMSA-N 440.636 4.191 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)[C@H](CCc3ccccc3)C(F)F)C2)cc1 1312901399 GGCVWJUHXNQKBK-SIKLNZKXSA-N 431.527 4.429 10 10 IICE CN(C)c1ccc(CNC(=O)c2cc(I)cc(C(F)(F)F)c2)cc1 1348909465 IVLURVKQHMOMRT-UHFFFAOYSA-N 448.226 4.306 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccccc1-n1cccc1 1355708801 VOLTZHUFXPLQTG-UHFFFAOYSA-N 429.442 4.263 10 10 IICE O=C(C[C@@H]1OCc2cc(Cl)ccc21)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445885455 RCLWHCGWAWLJDT-RXVVDRJESA-N 435.351 4.441 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1)C1CCCCC1 1464536375 KZXQRDULGBHULH-IBGZPJMESA-N 441.494 4.235 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSCC(=O)c3ccc(Cl)cc3)CC2)cc1 1466208393 IECZLGQMMUWCCU-UHFFFAOYSA-N 432.973 4.003 10 10 IICE COC(=O)c1csc(-c2cccc(CNC(=O)c3cc4cc(O)c(O)cc4s3)c2)n1 1466860931 SAVBPEGTHXYXBW-UHFFFAOYSA-N 440.502 4.153 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CC[C@H](F)C1 1495755649 WLZZBXLNNBPUAZ-BZSNNMDCSA-N 433.547 4.404 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2c(F)cccc21 1514722598 VUEQUHFJMSKIIT-LDADJPATSA-N 430.501 4.145 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@@H]32)sc2c1CC[C@@H](CC)C2 1523797597 UQDZFMKBHZCSQT-MUIFIZLQSA-N 432.586 4.073 10 10 IICE COc1cnc2ccccc2c1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533330523 YUFXGNBWSTYWFR-OAHLLOKOSA-N 427.451 4.244 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1nn(-c2ccc(Cl)cc2F)c2c1CCC2 1540518376 MATDRMCHCXWEPK-UHFFFAOYSA-N 426.923 4.492 10 10 IICE Cc1cccc(N2CCN(Cc3ccc(NC(=O)/C=C/c4ccc(O)c(O)c4)cc3)CC2)c1 1543836236 TUJUNKLBQBCVOP-XYOKQWHBSA-N 443.547 4.380 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccccn3)CC2)n1CCCSc1nccs1 1545539651 GAWFJPLNLVTSRZ-QGZVFWFLSA-N 443.646 4.152 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 1545931514 KYIAABAUNYBQAU-NRFANRHFSA-N 447.620 4.309 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](CC)Cc1cccc(Br)c1 1557115389 UJOMMEGQGYNFOX-KRWDZBQOSA-N 448.357 4.315 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccccc3CN3CC[C@H](O)C3)c2C)c1 1567483242 LPOMYZGITWMGEO-VWLOTQADSA-N 431.580 4.208 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@@H]1CCCOC1 1583308284 LLDLZANNLRRLDD-JFBHYCPVSA-N 438.640 4.051 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)Cc2csc(CNC(=O)OC(C)(C)C)n2)cc1 1587460086 PKKFYDXMNLKURK-UHFFFAOYSA-N 446.617 4.215 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@](C)(O)C2CCCCC2)n1 1612185619 LWTKDJWIUSYISH-RUZDIDTESA-N 435.572 4.322 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccoc2)cc1F 1617667286 NFTAJLWKPHFIFX-UHFFFAOYSA-N 425.533 4.413 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCCN(C)C(=O)c1ccncc1 1623925604 SLVZYHLIZBKXFR-FQEVSTJZSA-N 431.536 4.429 10 10 IICE CN1CCCc2cc(CNC(=O)c3cnn(Cc4ccccc4)c3Br)ccc21 1625847904 MDPTYSMYLXJMSV-UHFFFAOYSA-N 439.357 4.006 10 10 IICE CCN(CC)c1ccc(CNC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1F 1627604639 MJBWJAPWQWPIQY-UHFFFAOYSA-N 433.527 4.385 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C1 1628627150 OJDOMALTCORHSB-IERDGZPVSA-N 439.556 4.282 10 10 IICE Cc1cc(C(=O)N2C[C@]3(C)CN(C)C[C@]3(C)C2)c(C)n1-c1ccccc1Br 1634385909 DZHWACFCMJEZET-SZPZYZBQSA-N 430.390 4.270 10 10 IICE CCO[C@H]1C[C@](O)(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1635726156 LZXJZTLDYZCHQW-UGKGYDQZSA-N 449.389 4.153 10 10 IICE Cc1cc(C(=O)NCc2cc(C3CC3)nn2C)c(C)n1-c1cccc(Br)c1 1639195873 NMWVULMUKRWTNF-UHFFFAOYSA-N 427.346 4.398 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)C/C=C/c1ccc(Br)cc1 1639588203 XLVWYBPXRDOEIG-AATRIKPKSA-N 432.314 4.150 10 10 IICE CC[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C[C@@H](CC)O1 1643170981 LPACSVXVMFRGDC-DSWHRGLISA-N 438.640 4.146 10 10 IICE CCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)nnc1-c1ccco1 1643341193 DTXAJDRVROMUTK-UHFFFAOYSA-N 425.489 4.475 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3COc3cccc(C=O)c3)C2)cc1 1643346121 JXCFQGYBBFHJAK-NRFANRHFSA-N 444.531 4.343 10 10 IICE COC(=O)c1c(NC(=O)CN2CCCCc3cc(OC)ccc32)sc2c1CC[C@H](C)C2 1644968794 HMDTVRVSXDZBHD-HNNXBMFYSA-N 442.581 4.450 10 10 IICE O=C(NCc1c(O)cccc1F)c1ccc(NC(=O)c2ccc(Br)o2)cc1 1646029556 ZXIMLOKRDLSEBU-UHFFFAOYSA-N 433.233 4.069 10 10 IICE C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1653056942 SERFDGQHEOONQQ-HUUCEWRRSA-N 443.459 4.048 10 10 IICE COc1cc(Br)ccc1CCCNC(=O)NCc1cccc(Cl)c1O 1670920553 ZLQBZJQZJQZBMX-UHFFFAOYSA-N 427.726 4.249 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1683858292 PEOHQFMSNVJNSC-OAQYLSRUSA-N 442.604 4.360 10 10 IICE Cc1csc(N2CCN(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)CC2)n1 1686269783 YZJKCXXIZFLXAJ-INIZCTEOSA-N 448.036 4.373 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@@H]1COC(=O)N1CCCCC1 1686826376 GZINCSPCNFMNOW-NZQKXSOJSA-N 444.620 4.179 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](COC)C1 1696425065 YRBWORSDQGVEDM-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CC(C)(C)c1nnc(N2CCO[C@@H](c3ccco3)C2)n1CCCSc1nccs1 1706119604 PSBVFBJOYLEKSS-MRXNPFEDSA-N 433.603 4.385 10 10 IICE Cc1noc([C@H]2CCCN(c3nnc(CC(C)C)n3CCCSc3nccs3)C2)n1 1742888374 IEKFVEDVGABVTH-INIZCTEOSA-N 447.634 4.191 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743493156 GLRRGLNJTDMEKB-CLOONOSVSA-N 436.604 4.307 10 10 IICE CC[C@H]1CCCN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1744924970 LONZTIQYOFFNEQ-KRWDZBQOSA-N 431.635 4.157 10 10 IICE COc1ccc(-c2csc(CCC(=O)N3CCN(c4ccc(OC)cc4)CC3)n2)cc1 1858124601 WWAFORFPTITICK-UHFFFAOYSA-N 437.565 4.109 10 10 IICE CNc1cc(C(=O)N2CCN(c3ccc(F)cc3)CC2)c(Nc2ccccc2)c(F)c1N 1858181522 VMJKFRYTWWFUGO-UHFFFAOYSA-N 437.494 4.295 10 10 IICE CC(=O)c1ccc(NC(=O)CCNCc2cc(Cl)cc(Br)c2O)cc1 1860715543 LPPUENKKGADMRG-UHFFFAOYSA-N 425.710 4.129 10 10 IICE CCOC(=O)c1cccc(N2C(=O)C(O)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)c1 1872956040 AHCWZPFJPDZPSZ-UHFFFAOYSA-N 430.460 4.113 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2[C@H]1[C@@H]2NCc1cc(Cl)cc(Br)c1O 1965929879 QAPQKGRPJWILQN-YUELXQCFSA-N 431.758 4.296 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cc(Br)ccc3O)C[C@]2(C)C1 2116288606 RZYDYKIOKRTMIS-YYFZDKIDSA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)c1O 2236043867 MXSDVLRSGAVHPL-ZDUSSCGKSA-N 443.382 4.289 10 10 IICE CC[C@H](NC[C@H]1[C@@H]2C[C@@H]2CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2332566806 DUSZTTAQKKNCFD-IRWJRLHMSA-N 425.367 4.451 10 10 IICE COc1ccc(Br)c(CNC[C@@]23CC[C@@H](C2)N(C(=O)OC(C)(C)C)C3)c1O 2363714512 WSBFSEJFRHBIDQ-RNODOKPDSA-N 441.366 4.043 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O 3243321 UNTFIFMQLBMFIN-UOWJXHAGSA-N 425.487 4.435 10 10 IICE COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/c1ccc2c(c1)OCO2 6172110 ZWHYQHXWFCPQKZ-LZYBPNLTSA-N 431.366 4.311 10 10 IICE COc1ccc(C2=NN(c3ccccc3)C(=O)/C2=C(\C)NCc2ccc3c(c2)OCO3)cc1 19633789 BFUFBPJMSFPHJZ-JJIBRWJFSA-N 441.487 4.239 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnn(-c2ccc(C(F)(F)F)cn2)c1C 105816660 AQALGDNKABZWMO-UHFFFAOYSA-N 431.462 4.323 10 10 IICE CN1C(=O)C(C)(C)c2cc(-c3csc(NS(=O)(=O)c4ccc(F)cc4)n3)ccc21 170549572 FFPMLPFONUCGRY-UHFFFAOYSA-N 431.514 4.004 10 10 IICE CCOC(=O)c1ccc2c(c1)nc(/C(Cl)=C\c1ccc(N(C)CCOC)nc1)n2CC 606442138 SNHMVDIJQSFTTH-QGOAFFKASA-N 442.947 4.447 10 10 IICE COc1cccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccc(N4CCCCC4)cc3)C2)c1 726716356 ICXASMBIOXDSOY-QFIPXVFZSA-N 436.600 4.353 10 10 IICE Cc1cc(C(=O)Nc2cnn(-c3ncccn3)c2)c(C)n1-c1ccccc1Br 737979898 JZZXRMMQPFUEPB-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc(CN2CCCC2)cc1 745350674 XWPHRYFUXHBEFI-UHFFFAOYSA-N 446.389 4.482 10 10 IICE C[C@H]1CN(c2ccc(CNC3CCN(CCc4ccccc4)CC3)cc2F)C[C@@H](C)O1 765117457 FAADCPHQPUKDPX-OYRHEFFESA-N 425.592 4.236 10 10 IICE O=C(C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1)N1CCc2ccccc21 769121936 JJKPHCRPQQFEEE-UHFFFAOYSA-N 448.567 4.386 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nnc(C(C)(C)C)s2)C1 797273136 YAWWIQHPJOYTAR-UHFFFAOYSA-N 426.586 4.300 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cccc(OCC(F)F)c2)C1 1125742528 TZPMMTRFNQEUMH-UHFFFAOYSA-N 441.522 4.368 10 10 IICE Cn1cc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)c(Br)n1 1167363919 OPRQRNOVJLYNFJ-UHFFFAOYSA-N 435.366 4.160 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N[C@@H](C)c2ccccc2O)sc2c1CC[C@H](C)C2 1175419251 UJTKOMOQWSCXNV-SOUVJXGZSA-N 430.570 4.433 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](C)c3ccc(Br)cc3)C2)cc1 1221066983 MEPKCIGDOCRCRS-CVEARBPZSA-N 432.362 4.344 10 10 IICE C[C@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1264849984 RYNOOIFAOIKYFS-QFGUUYLXSA-N 429.542 4.032 10 10 IICE CC(C)CN1C[C@@H]2CN(C(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)CCN2C1=O 1271319246 YDCSRGXEKUFCTR-NRFANRHFSA-N 448.571 4.386 10 10 IICE Cc1ccc(Oc2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cc2)nc1 1275224707 VDGQLBYUVYCDET-UHFFFAOYSA-N 439.462 4.227 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)cc1F 1293224624 BIDYAAOZUPFSQY-DEOSSOPVSA-N 447.554 4.329 10 10 IICE CCO[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1296984433 VJLHGPVCFCFQRD-OAQYLSRUSA-N 425.621 4.303 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1C[C@H]1CCCCC(F)(F)C1 1298363278 BKXCUNDJQYOVPN-INIZCTEOSA-N 428.487 4.293 10 10 IICE CCc1ccccc1NC(=O)CN(C)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1349797737 SYDOIIPGNWGDIG-UHFFFAOYSA-N 433.552 4.188 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1OC 1350595408 CKFCBDCYJBAMHZ-WQRHYEAKSA-N 446.525 4.073 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1356037310 WCJSXMVBVJHHML-HZPDHXFCSA-N 436.474 4.246 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CCN(c2ccc3cccc(O)c3n2)CC1 1451662984 ABBYBEAXSIKWNJ-IBGZPJMESA-N 446.595 4.279 10 10 IICE C[C@@H]1CCCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1CCCNC(=O)OC(C)(C)C 1453580610 HGMBZHYCQPMAOI-CRAIPNDOSA-N 431.537 4.395 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)C2(CCC2)CC1 1455258944 RYWGFFVHWIPYFP-UHFFFAOYSA-N 432.542 4.318 10 10 IICE Cc1cc(C(=O)N2CCC(O)(CN3CCCCC3)CC2)c(C)n1-c1cccc(Cl)c1 1457071040 SMDDIUGFWNEOPF-UHFFFAOYSA-N 429.992 4.201 10 10 IICE O=C(CCC1CCOCC1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1463209525 SUDLKYZHJVIPJV-UHFFFAOYSA-N 429.318 4.304 10 10 IICE Cc1c(C(=O)NCc2c(O)ccc3ccccc23)nnn1-c1ccccc1Br 1472084805 DPOKUCCMWUFUAX-UHFFFAOYSA-N 437.297 4.127 10 10 IICE CCCCNC(=O)[C@H]1CC[C@@H](C)N(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1514491959 GPTXHVAAISGOMI-KNQAVFIVSA-N 440.636 4.002 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CCCCSC)CC2)cc1F 1518308560 AJGSLJSAJIZEAS-UHFFFAOYSA-N 435.613 4.094 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(F)(F)c1cccc(Cl)c1 1526015140 FUGHWRZLQKFUDU-UHFFFAOYSA-N 433.930 4.280 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(F)c(C(F)(F)F)cc3F)cc2F)CC1 1530377132 OXCQMPLGTFCDJT-UHFFFAOYSA-N 445.407 4.195 10 10 IICE CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1530890263 RNJNZAIUCDAAAJ-RUZDIDTESA-N 431.580 4.280 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ncc(C(=O)OC)c4ccccc34)ccc21 1538699253 OCAAFMNNHCJRDF-UHFFFAOYSA-N 431.492 4.492 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C/C=C/c1ccc(Br)cc1 1540536858 UXGXYPODHTWWAM-NSCUHMNNSA-N 429.358 4.348 10 10 IICE C[C@@H](CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCc2ccccc21 1546185058 GCOFGVBQBQRXFL-KRWDZBQOSA-N 429.511 4.214 10 10 IICE CCC[C@H](Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1546913997 FSCOICCKZUEQKG-JOCHJYFZSA-N 443.636 4.155 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1565701668 JXHMCVAGEWUHHZ-HXUWFJFHSA-N 433.499 4.221 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCCN(c2ccccc2Cl)C1=O 1565958921 ZFXYGDNQYKHHRC-NRFANRHFSA-N 449.938 4.485 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2c(Br)c(F)ccc2[nH]1 1568605611 QZALOKJZGSYUHJ-UHFFFAOYSA-N 442.082 4.468 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C(=O)OC(C)(C)C)c(C)n1-c1cccc(C(C)C)c1 1584489671 FISQMBBBFWCEDM-JOCHJYFZSA-N 426.557 4.400 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C\[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 1585698406 OEBQIYGBIVFTFV-LVWOJMJRSA-N 433.568 4.491 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C1CCCCC1 1587974065 GMQKOIXLHHUWPV-LJQANCHMSA-N 448.361 4.103 10 10 IICE CCCN(CC(N)=O)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 1595569872 ZTNJQXUFXUTXSQ-MNDPQUGUSA-N 442.563 4.125 10 10 IICE CCN1C[C@H](CN(C)C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)Oc2ccccc21 1624611626 OVMUZRIIPLOPBH-QHCPKHFHSA-N 431.536 4.266 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)c1 1631033209 BOQXRKYZNMMHPT-XMMPIXPASA-N 430.504 4.021 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc3c(O)ncnc3c2)cc1 1633066438 OBEJSOLXOHBRMM-UHFFFAOYSA-N 428.492 4.257 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCCc2c[nH]c3c(Cl)cccc23)N(C)C)cc1 1637399306 NNSXGLOIEQBTAZ-NRFANRHFSA-N 427.980 4.032 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cnn(-c3ncccc3Cl)c2C(F)(F)Cl)c1 1645800694 OXPUHGPWUNTGGC-UHFFFAOYSA-N 427.238 4.153 10 10 IICE CC(=O)c1cc(F)cc(CN2CCOc3cc(NC(=O)OC(C)(C)C)ccc3C2)c1O 1648139183 DGDSAIZNTSUFLV-UHFFFAOYSA-N 430.476 4.476 10 10 IICE CCOC(=O)c1csc(CC2CCN(Cc3cc(Cl)cc(C(C)=O)c3O)CC2)n1 1659978946 GBMVQDRXWYCBQG-UHFFFAOYSA-N 436.961 4.336 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@H]3CO)cc2Cl)C1 1680561272 AVBUQVAYUFZFOW-GAJHUEQPSA-N 427.976 4.378 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCc4cc(Cl)cc(Cl)c4C3)cc2)CC1 1687441669 VCMRBPKTXIXNPB-UHFFFAOYSA-N 433.383 4.013 10 10 IICE C[C@@H]1CCCC[C@H]1OCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1708047931 WEODXQZEFQAFLY-STZQEDGTSA-N 428.577 4.457 10 10 IICE CC(C)OCCCn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1723709108 YPGQKZSCLQPFAF-UHFFFAOYSA-N 448.365 4.193 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(CC(C)C)CC1 1747192795 LLIDFNCOCRYNJZ-UHFFFAOYSA-N 445.583 4.115 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N(C)CC1CC(F)(F)C1 1751432251 BSWIOAJYKUMDQN-IBGZPJMESA-N 433.547 4.076 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](CC(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1761012178 RBHSZCKYUOGUEV-JOCHJYFZSA-N 425.621 4.234 10 10 IICE CC[C@@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)CCO1 1763572774 VQRVHEXDLYPOJH-LJQANCHMSA-N 443.642 4.317 10 10 IICE CC[C@H]1CCCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(CC)CC)cc1 1765153222 ZGCJQWKVPMEILY-QFIPXVFZSA-N 435.620 4.413 10 10 IICE CCC[C@@H](NC(=O)c1cccc2ccccc12)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862239988 NLQHLPVOLKMYQW-RUZDIDTESA-N 445.563 4.096 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(C(C)(C)C)cc4)n(C)n3)CC2)cc1 1862365091 XEIWIUSBBDYIRD-UHFFFAOYSA-N 432.568 4.356 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])N2CCCCC2)cc1 1866100242 XUUMPVUBGUNVPC-NRFANRHFSA-N 430.936 4.271 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCC3)C(=O)N(CCOC(C)C)C2=O)cc1 1873165102 BREOQZJANQIAHW-UHFFFAOYSA-N 435.568 4.131 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(Cc3ccccc3)C[C@@H]2C(F)F)c1O 2236046171 USRUDHRDLYYBBT-RDJZCZTQSA-N 441.316 4.019 10 10 IICE CNCc1ccc(N(C)Cc2cccc(I)c2)cc1Br 2280348298 YAJKQFGKTGQNGJ-UHFFFAOYSA-N 445.142 4.410 10 10 IICE CN1C(=O)C(=Cc2ccc(OC(=O)c3ccccc3)c(Br)c2)SC1=S 2293806403 NWYHLNKLDWYLBE-UHFFFAOYSA-N 434.336 4.499 10 10 IICE N=C1C(=Cc2ccc(OCc3ccc4c(c3)OCO4)c(Cl)c2)C(=O)N=C2SC=CN12 2297317075 KXFULBKXNWDZCG-UHFFFAOYSA-N 439.880 4.425 10 10 IICE CC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=S)N(c4ccccc4F)C3=O)o2)cc1 2297617257 UREMIIIOMCEJKU-UHFFFAOYSA-N 434.448 4.120 10 10 IICE Cc1ccccc1NC(=O)[C@@H](C)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314836196 BKEKRQQXDIOUGM-CYBMUJFWSA-N 427.507 4.132 10 10 IICE CCN(CC)c1ccc(/C=C2\C(=O)N(Cc3ccc(F)cc3)C(=S)N=C2O)c(O)c1 17086549 MWGOQTJGTBXDGX-WQRHYEAKSA-N 427.501 4.045 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)c3cc(C)ccc3C)c3ccco3)CC2)cc1 38605946 WOZHXASAEZRXLB-DEOSSOPVSA-N 433.552 4.198 10 10 IICE COCCOC(=O)c1ccc(N[C@@H](c2ccccn2)c2ccc3cccnc3c2O)cc1 54620235 RKFACNWFAIYJBQ-HSZRJFAPSA-N 429.476 4.340 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)/C=C\c3c(Cl)nc4sccn34)cc2F)C[C@@H](C)O1 102712519 KAVYDEKLLYAIHM-HLMASZERSA-N 448.951 4.132 10 10 IICE Nc1ccc(F)c([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1O 687755720 DVSVMAUVWHCMKI-FQEVSTJZSA-N 436.439 4.168 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CCN(c4cccc(OC)c4)C3)c2C)cc1 726563477 NQPQPXICIMZSKJ-HXUWFJFHSA-N 433.552 4.368 10 10 IICE C/C=C/c1ccc(OCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(OC)c1 726565586 DFYDNAFITNXGSZ-ONEGZZNKSA-N 446.494 4.494 10 10 IICE NC(=O)c1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCCCC4)cc3)cc2)cc1 729346320 PKXBCGWWZXUBHZ-UHFFFAOYSA-N 429.520 4.498 10 10 IICE COc1ccccc1CCN(C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904413 PYNQFSREXOEHKX-SFHVURJKSA-N 433.499 4.150 10 10 IICE O=C(NCc1ccc(C(F)F)cc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 765232337 ZFOJWUNRAVURKN-UHFFFAOYSA-N 443.416 4.479 10 10 IICE CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3ccc4ncsc4c3)n2)c(F)c1 775149946 NXWSICXHYCPLRH-UHFFFAOYSA-N 448.526 4.318 10 10 IICE Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799934424 YEHDJOQGVVUWMT-HZPDHXFCSA-N 432.012 4.357 10 10 IICE CSc1cc(O)ccc1NS(=O)(=O)c1cc(Br)cc2cccnc12 808112310 RJLMHXKJRVAANC-UHFFFAOYSA-N 425.329 4.226 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3c4c(nn3C)CCCC4)cc2Cl)C1 812909307 VAANLUQAGZZNFA-INIZCTEOSA-N 429.996 4.188 10 10 IICE COC(=O)c1cc(Br)cc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1124550090 YFPDKKPIQWOYFG-UHFFFAOYSA-N 431.330 4.108 10 10 IICE Cc1ccc(S(=O)(=O)CCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1128383914 GMFKNUOPZKHSDJ-SFHVURJKSA-N 449.016 4.365 10 10 IICE C[C@H](OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cncc(F)c1 1129618743 CMTCQJAUXSOROL-OPFCKLNOSA-N 434.489 4.256 10 10 IICE Cc1cc(C(=O)NCc2cn(C3CCC3)nn2)c(C)n1-c1ccc(Br)cc1 1144297289 AYXIRKXRPCTYLV-UHFFFAOYSA-N 428.334 4.103 10 10 IICE COc1ccccc1CN1CCN(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1 1234326745 MBKXNZAQVAMTGC-UHFFFAOYSA-N 432.568 4.130 10 10 IICE CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1235243240 LRXILQXCEIKOHS-ZEQRLZLVSA-N 439.600 4.239 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(CCCc4ccccc4)C3=O)c2C)cc1 1294448204 QYMZEMHWDHMURQ-RUZDIDTESA-N 445.563 4.066 10 10 IICE CCN(C)c1nnc(C(=O)Nc2ccc(C)c(C)c2)n1CCCSc1nccs1 1295088192 LHUMLGMQSOLNHM-UHFFFAOYSA-N 430.603 4.242 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCSC3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1304188302 BASMWHNIZHGMBR-WIYYLYMNSA-N 438.645 4.244 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1305192698 QWELXCMXTXKDFR-SFHVURJKSA-N 436.579 4.390 10 10 IICE CCc1nnc(N2CC=C(C(F)(F)F)CC2)n1Cc1ccc(N2CCSCC2)cc1 1306109251 CLDLOGKTWIMDEX-UHFFFAOYSA-N 437.535 4.141 10 10 IICE CCC[C@H](Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1306589582 INQJTOWWUDAZMG-HSZRJFAPSA-N 441.620 4.224 10 10 IICE C[C@H](NC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1)c1ccc(OC(F)(F)F)cc1 1307424500 SOIRQZKKLZOZTB-INIZCTEOSA-N 435.490 4.493 10 10 IICE C[C@H](NC(=O)CCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1 1350628434 KEGIACZIUFHQCJ-INIZCTEOSA-N 426.472 4.058 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)COc2ccc(F)cc2F)C1 1355655299 AKMDQPXPZROUDP-KRWDZBQOSA-N 441.522 4.270 10 10 IICE Cc1cnc2c(c1)N(C(=O)CCCN1C(=O)/C(=C\c3cccs3)SC1=S)CC2 1436453029 FSYQPIZWLBVOTL-GZTJUZNOSA-N 429.592 4.022 10 10 IICE Cc1ccc(C(=O)N2CCC([C@@H]3N(C(=O)OC(C)(C)C)CC34CCC4)CC2)c(O)c1O 1455152976 HQHVLWRIKREXFI-FQEVSTJZSA-N 430.545 4.048 10 10 IICE CC(=O)N[C@H](C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)C(C)C 1457572314 FTGUUPJSWHEDTK-FPOVZHCZSA-N 435.490 4.459 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1470189515 SNDPPECFQYQOEL-GOSISDBHSA-N 441.519 4.349 10 10 IICE Cc1ccc(O)c(CNC(=O)NCC[C@@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)c1 1471068572 LEFDKEBIAXHARU-QGZVFWFLSA-N 425.529 4.429 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@@H]3c3cccc(Cl)c3)CC2)cc1 1473431064 YGLVITQYUMDISJ-UKILVPOCSA-N 444.019 4.059 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@@H]1CN(CC(F)(F)F)C[C@H]1c1ccccc1 1478807105 GTMKRGRZTRXSFD-LEWJYISDSA-N 447.501 4.101 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1500428001 QAVWAGWAAIYPDR-UHFFFAOYSA-N 436.604 4.457 10 10 IICE CCCN1CCC(N(C)c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)CC1 1514901385 CRLFXKUPTWMCJE-UHFFFAOYSA-N 449.647 4.017 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1 1525762970 VMQIFDSONCQKTC-INIZCTEOSA-N 426.948 4.444 10 10 IICE Cc1c(Br)csc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015026 BQRRKVCUXLXUNA-UHFFFAOYSA-N 448.430 4.281 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Cl)c(-n4cccc4)cc3OC)C2)cc1 1532106022 PRXNOIVJUDCMGD-INIZCTEOSA-N 425.916 4.157 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 1540247367 JTJBZDAHHNHDQZ-UHFFFAOYSA-N 448.498 4.036 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)C[C@@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543033866 RPCKOJDWNDRRIR-QZTJIDSGSA-N 435.620 4.045 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(F)(F)F)C2)c(C)n1-c1cccc(Br)c1 1544152736 AYOJGUWYQBYSMM-INIZCTEOSA-N 431.252 4.260 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(F)(F)c1ccc(Cl)cc1 1544721750 VHXYDTJZPKCKOC-UHFFFAOYSA-N 433.930 4.280 10 10 IICE COc1cc(OC)cc([C@@H](O)CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1545563523 UYHXTUUWOJKKFO-QFIPXVFZSA-N 428.916 4.228 10 10 IICE CCn1cc(C2CCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)c(F)c3)CC2)cn1 1547608524 ZHOAESRWBIBHDW-UHFFFAOYSA-N 439.583 4.255 10 10 IICE COCCN(CCNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)C(=O)OC(C)(C)C 1556075845 OGTBTXGQUJSXHA-UHFFFAOYSA-N 429.561 4.016 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3n[nH]cc3I)c2C)c1 1557588472 HBDDWYVPERPQPB-UHFFFAOYSA-N 434.281 4.291 10 10 IICE CC(C)(C)n1nc(Br)c2c(NCc3ccc(N4CC=CC4)cc3)ncnc21 1559114081 HYRUBGYLJPWQEF-UHFFFAOYSA-N 427.350 4.332 10 10 IICE COC(=O)C1(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCCC1 1566254956 CZSOBJCVLBWDPY-UHFFFAOYSA-N 433.346 4.320 10 10 IICE CC(C)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1[N+](=O)[O-] 1566357019 VGKWHISWXAUCCJ-SFHVURJKSA-N 431.920 4.472 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)ccc21 1585665390 RKRWOSFEIVUJHQ-FQEVSTJZSA-N 435.568 4.169 10 10 IICE CN(C)Cc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1587782593 YXFNZNODONUBMV-CPNJWEJPSA-N 443.569 4.117 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1cccc(S(=O)(=O)C(F)(F)F)c1 1608062207 PSOXZOGHSOBDDG-UHFFFAOYSA-N 442.484 4.379 10 10 IICE CC(C)COc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1616858208 JAKKHUJVBUCBBA-QHCPKHFHSA-N 449.599 4.006 10 10 IICE COc1cccc([C@H](CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)N(C)C)c1 1623420049 FOZZUQLDGJUWKK-VWLOTQADSA-N 433.552 4.256 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(Cl)c(F)cc1Br 1623452160 TTWXITXXHAFRAP-UHFFFAOYSA-N 441.728 4.350 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Cc2ccccc2)ccc1O 1623928096 FCHKCGYQBKCIBI-UHFFFAOYSA-N 439.895 4.157 10 10 IICE CC(C)Cc1c[nH]c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1628491743 WLLISGNYLVDLOI-OAQYLSRUSA-N 428.577 4.275 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(Br)ccc1O 1629056113 ZVNPPSLUHOUNOO-CYBMUJFWSA-N 441.272 4.155 10 10 IICE Cc1c(Br)cc(F)cc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1629878633 CSZLYUAJFKBIFF-UHFFFAOYSA-N 435.337 4.035 10 10 IICE Cc1cc(C(=O)NC[C@@]2(N(C)C)CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1630863403 NGPDNJCLVNMAAM-IVZQSRNASA-N 447.421 4.492 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC(C)(C)CNC(=O)OC(C)(C)C 1631167503 SBFXXQSKCXMZJL-UHFFFAOYSA-N 443.382 4.444 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](CO)Cc3cc(F)c(F)c(F)c3)c2C)c1 1634296399 ABGIEJFGUXOVIV-GOSISDBHSA-N 430.470 4.401 10 10 IICE Cc1cc(CNC(=O)[C@H]2[C@@H](CNC(=O)OC(C)(C)C)C2(F)F)c(C)n1-c1ccccc1 1635331123 MTCNJVQUUSGBDU-RTBURBONSA-N 433.499 4.116 10 10 IICE Cc1cc(CC(=O)NC[C@@](C)(O)c2ccccc2Br)c(C)n1-c1ccccc1 1639552405 DGUZYSBMWOIEHF-HSZRJFAPSA-N 441.369 4.423 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2COC)sc(C)c1-c1ccccc1 1643411585 YLKUEMLIIHOMNH-SFHVURJKSA-N 430.570 4.340 10 10 IICE Cc1ccccc1[C@@H](C)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1655222691 CJOUHBSYLDRNSO-VAMGGRTRSA-N 427.564 4.057 10 10 IICE Cc1cc(=O)n(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)cc1C(F)(F)F 1656841257 OJJDPNQDFOXOCK-UHFFFAOYSA-N 446.425 4.237 10 10 IICE Cc1cc(CNC(=O)NCCNc2ccc(-c3ccccc3)nn2)c(C)n1-c1ccccc1 1684604833 VYPCCAPTFOJWDT-UHFFFAOYSA-N 440.551 4.462 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCSC[C@@H]2c2ccccc2)N(C)C)cc1 1685686377 MCLBECJNIHVFQW-DHIUTWEWSA-N 426.630 4.245 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccnc(C(F)(F)F)c1 1686516251 GJSRDQHFVJOKMA-UHFFFAOYSA-N 432.240 4.300 10 10 IICE CC1CCN(c2ccc(Cn3c(N4CCCO[C@@H](C)C4)nnc3C(C)(C)C)cc2)CC1 1726598218 QFIADYMOIKQHQZ-FQEVSTJZSA-N 425.621 4.475 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCCOC1CCCCC1 1727504324 UAMPGEMTSNVFOI-UHFFFAOYSA-N 441.620 4.053 10 10 IICE COc1cccc(CN(C)c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)c1 1730243122 ABKJWNIRDCJWED-GOSISDBHSA-N 445.614 4.414 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1)OC 1765557525 NZPCAQSQVIRKMP-YADHBBJMSA-N 437.588 4.393 10 10 IICE CC[C@H](Oc1ccccc1/C=C1/SC(=S)N([C@H](CC(C)C)C(=O)O)C1=O)C(C)=O 1772763732 WLWXDLWPFVEKKL-MAIUNSNDSA-N 435.567 4.134 10 10 IICE Cc1cc(C)c2oc(=O)c(C(=O)N[C@@H](c3ccc(N(C)C)cc3)c3nccn3C)c(C)c2c1 1866296883 JYWSSHLTRZBORA-QFIPXVFZSA-N 444.535 4.037 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)C1(CN)CC(OCc2ccccc2)C1 2018784167 KHCXSHSCYPLGGG-UHFFFAOYSA-N 425.573 4.224 10 10 IICE CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCCOc1ccccc1OC 2293476900 QVEGERFJWYKGCL-UHFFFAOYSA-N 445.562 4.383 10 10 IICE CCN(CC)c1ccc(C=C2C(=O)NC(=S)N(c3ccc(Cl)cc3)C2=O)c(OC)c1 2294224280 XOSJOJNFPLCYCK-UHFFFAOYSA-N 443.956 4.026 10 10 IICE O=C1NC(=S)N(c2ccccc2)C(=O)C1=Cc1ccccc1OCc1cccc(F)c1 2297578575 AIYGQNUKOVXCDE-UHFFFAOYSA-N 432.476 4.236 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(Cc4ccccc4)C3=O)c2C)cc1C 2313631465 NSCGZTZPDXKVMT-UHFFFAOYSA-N 427.504 4.373 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(CCCC(=O)OCC)C2=O)cc1OCC 2314761690 WZRYTIARCAFWGN-UHFFFAOYSA-N 437.583 4.419 10 10 IICE Cc1ccsc1[C@@H]1Nc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2[C@@H]2C=CC[C@H]21 20688507 TVZJABPZMJNSFD-NWUWZPLHSA-N 430.595 4.340 10 10 IICE CCN(CC)c1ccc(CN(C[C@H](O)COc2ccc(OC)cc2)c2ccccn2)cc1 54120835 QMQQLYZZBDMASN-QHCPKHFHSA-N 435.568 4.383 10 10 IICE COCCN1C(=O)/C(=C/c2csc(N(C(C)=O)c3cccc(C)c3C)n2)SC1=S 98002419 AMAXDZWZCSHIBJ-YVLHZVERSA-N 447.607 4.292 10 10 IICE COc1cccc(CNc2cc(I)ccc2Br)c1O 311536404 HYDMAJUHDBUHCX-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2CCN(Cc3ccccc3)CC2)C1 435643156 BNDSEHOKSHOUDO-UHFFFAOYSA-N 444.623 4.189 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3OC)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526405469 DJJKQBGLAXGKLL-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)C(C)(C)C1 715817241 FSFILUQCSXZRQQ-OAHLLOKOSA-N 431.346 4.419 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCC(CN4CCc5ccccc54)CC3)CC2)cc1 732458529 IZHRPVSUYDFVTI-UHFFFAOYSA-N 448.611 4.148 10 10 IICE C[C@H](N[C@H](CO)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1Cl 773062215 BMPLWXNWISTZOW-VBKZILBWSA-N 439.781 4.323 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cccc(CCCO)c1 782088837 SHAYWBUXRGFJPZ-NBVRZTHBSA-N 446.619 4.293 10 10 IICE O=C(CO[C@H]1CCCc2ccccc21)NC1CCN(c2ccc(OC(F)F)cc2)CC1 797447516 DPXKGCAZVNOULQ-QFIPXVFZSA-N 430.495 4.467 10 10 IICE COc1ccc(CNC(=O)NCc2cc(Br)ccc2O)c(C(F)(F)F)c1 805049695 JBFIDAFRSLZWHI-UHFFFAOYSA-N 433.224 4.182 10 10 IICE COC(=O)c1cc(NC(=O)NCc2cc(Br)ccc2O)cc(Cl)c1F 806455891 AVGVDOOFPFRKPL-UHFFFAOYSA-N 431.645 4.056 10 10 IICE O=C(C[C@@H](c1ccc(O)cc1)C1CC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472230 IXHCWTOJLIZXJZ-RBBKRZOGSA-N 428.960 4.416 10 10 IICE O=C(c1ccc(F)c(F)c1)N1CCN(Cc2c(O)ccc3oc4c(c23)CCCC4)CC1 917453483 UXJDIJGIHZMKDN-UHFFFAOYSA-N 426.463 4.253 10 10 IICE CC[C@H](C)NC(=O)c1cccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1125099393 YOQFPCTYSPFIHC-SFHVURJKSA-N 447.579 4.373 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)O2)C1 1133272677 KDKLOQWNQYLWSY-HRAATJIYSA-N 437.506 4.024 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)ccc(F)c3Br)CC2)cc1F 1150239697 JKEPXHBIFSEQHH-UHFFFAOYSA-N 425.273 4.007 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(Cl)c4ccccc34)CC2)cc1F 1150239888 KHMVTAYQBXATGU-UHFFFAOYSA-N 428.891 4.369 10 10 IICE COC(=O)COc1ccc(N(C)Cc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)cc1 1169188306 RYHVDJAQOGWPTM-UHFFFAOYSA-N 440.540 4.168 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)NC2CCCCC2)CC1 1292478796 QQHPRDPJEKDNRU-UHFFFAOYSA-N 435.568 4.208 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccc(C)o4)n3CCC(C)C)CC2)cc1F 1300247431 NAGCZEHBMZZYAB-UHFFFAOYSA-N 427.524 4.367 10 10 IICE CSC1(Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)CCC1 1302625154 MVUXVTQQWVQNEA-UHFFFAOYSA-N 443.661 4.334 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)CCCC1 1353599654 FNCDTXILNUJOAL-UHFFFAOYSA-N 433.552 4.209 10 10 IICE CC(C)c1nnc(N2CCS[C@@H](C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1359726476 MYMWGOZVMDTGRE-MSOLQXFVSA-N 431.675 4.333 10 10 IICE CSc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1359801160 QMGWCTVVFJNRLX-GDNBJRDFSA-N 433.555 4.173 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]2C)CCCC1 1436494146 XSDNWTTYGCAUII-ROUUACIJSA-N 439.600 4.023 10 10 IICE Cc1cc(CC(=O)NCCCCN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1445350615 QGZKRDOSFRYAQV-KDURUIRLSA-N 432.008 4.296 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)c1 1448294525 KULCEYJIUMWREN-RUZDIDTESA-N 439.556 4.284 10 10 IICE CO[C@@H]1C[C@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1449632426 QIHHACXFTRTBAR-ZWKOTPCHSA-N 432.362 4.281 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCC(C)(C)NC(=O)OC(C)(C)C)ccc21 1455251898 SNRFLHFOUUASSE-UHFFFAOYSA-N 431.577 4.328 10 10 IICE Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc3cc(O)c(O)cc3s2)cc1C 1464815347 PBPOQBKNZBIEBK-OAHLLOKOSA-N 428.535 4.083 10 10 IICE CC[C@H](CC(F)(F)F)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465325381 PWCOJWXLDHAGIQ-PBHICJAKSA-N 431.499 4.413 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C\c1ccccc1OC(F)(F)F 1466398187 JYWNKFWCTXYPOE-TWGQIWQCSA-N 443.805 4.159 10 10 IICE Cc1cc(CCNC(=O)NCc2ccc(Br)cn2)c(C)n1-c1ccccc1 1470969407 VDPKLSKBVJZHAT-UHFFFAOYSA-N 427.346 4.294 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(CCC(=O)OC(C)(C)C)CC3)C2)cc1 1478859481 GKUHEJWXUZVCNZ-HXUWFJFHSA-N 445.604 4.065 10 10 IICE CC(C)N(CC(F)(F)F)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1515101511 LIYNDNSJHAXHMK-NTEUORMPSA-N 434.480 4.216 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3csc4cc(C)sc34)cc2F)CC1 1530377626 WRCADRNCOZRXAP-UHFFFAOYSA-N 431.602 4.411 10 10 IICE CCCOc1c(Cl)cc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cc1OC 1530951456 JPHBTNNCGXVPPS-UHFFFAOYSA-N 448.947 4.117 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533327081 AXWGPEKVYVARQM-CVEARBPZSA-N 441.519 4.019 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)cc21 1542490410 MKORKGOGZNWKJD-NRFANRHFSA-N 436.556 4.210 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1C[C@H](C)O[C@@H](C)C1 1543645828 USEGLLXXJWEJJG-PMACEKPBSA-N 441.620 4.078 10 10 IICE Cc1ccc(C(=O)Nc2ccc(CS(C)(=O)=O)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1545524149 HTTSIDMNZZLDAH-UHFFFAOYSA-N 442.512 4.151 10 10 IICE CC[C@]1(C)CCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1546062054 JWKGKPLTLKNRSN-UQBPGWFLSA-N 441.620 4.059 10 10 IICE CO[C@]1(C)CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1554692704 ZHHUQNWPXAZVPK-XUZZJYLKSA-N 445.583 4.169 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CC=CCC3)CC2)cc1F 1554959924 SVARWFIVGCDSAO-GOSISDBHSA-N 427.568 4.406 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCOc1ccccc1CC 1556426248 DMMCQROMWKZTCK-UHFFFAOYSA-N 426.557 4.407 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 1557063510 QTEJYFKCRFLSDT-AVRDEDQJSA-N 425.573 4.374 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccco3)c3ccc(Cl)cc3)nc12 1559621604 BMLFXIPWECIKQL-UHFFFAOYSA-N 426.860 4.065 10 10 IICE COc1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)CN[C@H](C)c2ccccc2O)cc1 1560075197 WFZLKVZRNOEHTK-HOYKHHGWSA-N 429.520 4.429 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H](c3ccc(F)c(Cl)c3)C3CC3)cc2)CC1 1564777967 URVRBJLSEWKCND-JOCHJYFZSA-N 430.955 4.181 10 10 IICE COc1cccc(CNC(=O)NCc2cc(C(F)(F)F)ccc2Br)c1O 1565343265 CSEWZUYFBMEGRR-UHFFFAOYSA-N 433.224 4.182 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1598028342 JLJXIBXDHDKREF-UIFIKXQLSA-N 437.559 4.292 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccccc3CN3CCC[C@H]3CO)c2C)c1 1611496506 NCTFKABFLHZIBW-VWLOTQADSA-N 431.580 4.289 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3ccc(OCc4ccccc4)cc3)CC2)cc1 1616489840 SWBNEHZTYWRZRN-UHFFFAOYSA-N 445.563 4.425 10 10 IICE Cc1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cnc1C(F)F 1618662118 MCVRKNMIJLYFOA-UHFFFAOYSA-N 437.358 4.264 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccc(S(=O)(=O)NCC2CC2)cc1 1627889677 BNHIBDHAYVGUOT-UHFFFAOYSA-N 429.567 4.096 10 10 IICE Cc1ccc(C(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1628880189 GFIIEBOGTJJWKB-MBSDFSHPSA-N 429.520 4.139 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@]1(C(=O)OC(C)(C)C)CC1(C)C 1629969208 QXUNFNXWLLATJJ-HXUWFJFHSA-N 426.351 4.261 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@H](c1cccc(Br)c1)N1CCCC1 1630272921 HFVUHDFRTUQPPI-QFIPXVFZSA-N 443.385 4.487 10 10 IICE COc1ccc(Br)cc1C1(C(=O)NCc2c(O)ccc3c2CCCC3)CC1 1631438354 CKFJZDGYWFDZCE-UHFFFAOYSA-N 430.342 4.390 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(Cl)c(NS(C)(=O)=O)c3)c2C)c1 1631794240 PZWLLMDUTBBFCG-UHFFFAOYSA-N 445.972 4.357 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C)[C@H]3c3cccc(Cl)c3)cc2)CC1 1633110907 LJWJXIRLRPKYPA-UPVQGACJSA-N 439.987 4.412 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc2nnc(-c3ccsc3)n2n1 1642420815 YDFGKOBGSGJWBX-UHFFFAOYSA-N 430.331 4.347 10 10 IICE CC(C)c1ccc([C@H](CNC(=O)c2c(F)ccc(O)c2O)NC(=O)OC(C)(C)C)cc1 1654307182 UOPXNSJRKNKDOR-KRWDZBQOSA-N 432.492 4.356 10 10 IICE COc1ccc(N(C)CC(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)cc1Cl 1657676047 QLLDDARSWAMULN-FQEVSTJZSA-N 436.383 4.392 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@@H](C)[C@H](CCNC(=O)OC(C)(C)C)C1 1683426497 YHDQHOLMWRHMLR-SFHLNBCPSA-N 446.636 4.184 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(CN(C)C(=O)OC(C)(C)C)CC1 1686826753 OLMYMARDMUITAZ-LJQANCHMSA-N 446.636 4.281 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C12CCC2 1687055057 NWRUYTYKTDGSNA-HXUWFJFHSA-N 429.561 4.002 10 10 IICE CC[C@@]1(C)CCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1694431959 JIFAMHHXZLEAJR-CYFREDJKSA-N 429.609 4.051 10 10 IICE C#CCN(CC#C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@@H]1OC 1705574473 FAEZOGQBAVBMBU-DHLKQENFSA-N 441.579 4.241 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1cccc(C)n1 1712408296 WZZIDFQAQAMODX-UHFFFAOYSA-N 444.583 4.381 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@@H](C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1724199791 WCLHNRZZWRTRJL-IBGZPJMESA-N 437.588 4.129 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H](C)C(=O)NC 1727847330 GZTSHEZBMIXXFQ-HCWHUNCVSA-N 434.588 4.137 10 10 IICE CCO[C@]1(c2nnc(N(CC)C3CCCC3)n2Cc2ccc(N(C)C)cc2C)CCOC1 1746666885 NFFRYZHWBXMYHQ-RUZDIDTESA-N 441.620 4.122 10 10 IICE CC(C)(C)c1nnc(N2CC[C@H](N3CCCCC3)C2)n1CCCSc1nccs1 1750144457 UZBBIQIRRXNWOQ-KRWDZBQOSA-N 434.679 4.279 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCN([C@H](C)c3ccsc3)CC2)cc1 1764934631 XXILQKZGCJVMHK-LJQANCHMSA-N 438.645 4.426 10 10 IICE COCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N([C@H]2CCCC[C@H]2C)C1=O 1873165713 QWCADKMMVRKGDJ-JPYJTQIMSA-N 449.595 4.379 10 10 IICE CC(C)(C)OC(=O)NC1CC(F)(CNCc2cc(Cl)cc(Br)c2O)C1 2043081261 GVVZCHMYYGMYOG-UHFFFAOYSA-N 437.737 4.293 10 10 IICE O=C1NC(=S)SC1=Cc1cn(-c2ccccc2)nc1-c1cc2ccccc2oc1=O 2053497394 IIBNBOUXOJSYET-UHFFFAOYSA-N 431.498 4.135 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@H](CNC(=O)OC(C)(C)C)C2(C)C)c1O 2236054037 DITALSJWQHHVQT-MLGOLLRUSA-N 443.382 4.192 10 10 IICE COc1ccc(Br)c(CN[C@@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)c1O 2236054173 FNQDIQGHGUOIIK-OXQOHEQNSA-N 441.366 4.185 10 10 IICE COC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)o2)cc1 2294130694 AVHQGNVMOGYTMF-UHFFFAOYSA-N 444.443 4.016 10 10 IICE O=C(CN1C(=O)C(=CC=Cc2ccccc2)SC1=S)NCCc1c[nH]c2ccccc12 2296554337 QWNWOBZYKBYDSC-UHFFFAOYSA-N 447.585 4.284 10 10 IICE COc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccc(F)cc3)C2=O)cc1OC 2296881465 IWXHZNSYASSHKK-UHFFFAOYSA-N 446.525 4.073 10 10 IICE COc1ccc2c(C=C3SC(=S)N([C@H](Cc4ccccc4)C(=O)O)C3=O)c[nH]c2c1 2297471777 BECPYPHDBTVBQG-GOSISDBHSA-N 438.530 4.074 10 10 IICE COc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1Br 2314765237 YLKJPRORTPTUGR-UHFFFAOYSA-N 449.351 4.004 10 10 IICE COc1cc(C=C2SC(=S)N(CCCC(=O)Nc3ccccc3C)C2=O)ccc1O 2314827931 PKYPYJRUQHJZIH-UHFFFAOYSA-N 442.562 4.329 10 10 IICE COc1ccc2[nH]cc(C=C3SC(=S)N(c4ccc(OC)c([N+](=O)[O-])c4)C3=O)c2c1 2321630830 ZEXAWWJQCSXCLL-UHFFFAOYSA-N 441.490 4.499 10 10 IICE CCN(CC)S(=O)(=O)c1cc(O)c(/N=N/c2c(C)nn(CC)c2O)c2ccccc12 15771709 XCTJCTXEWRKMBG-QURGRASLSA-N 431.518 4.222 10 10 IICE Cc1ccc(N2C(=O)/C(=C\c3ccc(N4CCOCC4)cc3C)C(O)=NC2=S)c(C)c1 33309091 MKONBCAJDRSSEH-ZHZULCJRSA-N 435.549 4.120 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1/C=C1/SC(=S)N(CCC)C1=O 33457852 IGIDYTAIRQICNT-FOWTUZBSSA-N 430.599 4.216 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@H](c3ccccc3Br)C2)c([N+](=O)[O-])c1 72073129 BEIPTSQJQITLCS-XSBJJCPUSA-N 447.285 4.121 10 10 IICE COc1ccc(N2CCCN(C(=O)c3c(C)nn(-c4ccc(F)cc4)c3Cl)CC2)cc1 108432755 MTBRVVFUEKDGFQ-UHFFFAOYSA-N 442.922 4.334 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526282509 UIBCRFVMKSITGG-JOCHJYFZSA-N 429.432 4.040 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](c1nnc2ccccn12)C(C)C 745796051 OCYBQIDZPBIGTH-GOSISDBHSA-N 446.349 4.126 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCO[C@@H]1c1cnn(-c2ccccc2F)c1 752922378 AJZQJVPZALOMND-XUZZJYLKSA-N 436.531 4.204 10 10 IICE Cc1cc(Br)c(O)c(CN2CCc3c(ncn3CCc3ccccc3)C2)c1 761216751 QUUWDDKKINNMFA-UHFFFAOYSA-N 426.358 4.461 10 10 IICE CCN(CC)CCCNC(=O)c1ccc(NC(=O)N(C)Cc2ccccc2O)cc1Cl 769016343 GYDAAMALUQRRNO-UHFFFAOYSA-N 446.979 4.171 10 10 IICE Cc1cc(C(=O)COC(=O)Cc2cc3ccccc3nc2O)c(C)n1-c1ccc(F)cc1 915572140 RJQUXKHCRNZVBM-UHFFFAOYSA-N 432.451 4.456 10 10 IICE O=C(NCc1ccc(OCc2ccccn2)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 918231046 CBSQTWJVEOSYIA-XMMPIXPASA-N 447.535 4.257 10 10 IICE Cc1cc(/C=C2/C(=O)N(C)C(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc([N+](=O)[O-])c1 1084073666 XESUFSJOWMGICT-BKUYFWCQSA-N 444.447 4.011 10 10 IICE CC[C@H](NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2)C(=O)NC 1129926295 ZWURRVQULXVJNB-BKELBIJQSA-N 442.563 4.042 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1149872110 OTAKCGGRZJCTHF-LJQANCHMSA-N 428.529 4.405 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1157102200 KLDTWUATXJMPJF-GOSISDBHSA-N 441.471 4.038 10 10 IICE COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)N[C@@H](C)c3ccccc3O)c2)cc1 1171723734 ZIJREURKWGBPKV-INIZCTEOSA-N 440.521 4.001 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccccc3)C3CCCCC3)CC2)cc1 1190474615 FRTRHMKVEVEUOT-SANMLTNESA-N 437.628 4.013 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)c4ccc(F)cc4Cl)CC3)cc2)CC1 1190651592 NOABPZWWTUHVIM-UHFFFAOYSA-N 445.966 4.052 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(c2cccc(F)c2F)CC1 1233603831 IGFUAPJFGOSJSW-UHFFFAOYSA-N 429.511 4.015 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](OCC(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1291517170 QDLQOWCFBIQRSW-UGKGYDQZSA-N 425.621 4.474 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2OC2CC2)NC(=O)OC(C)(C)C)cc1 1293792441 HRJAWHUZFFZHPL-OAQYLSRUSA-N 439.556 4.290 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CC[C@@H](C(C)(C)C)C2)cc1F 1298055426 DAPMGBMXNYGHOO-RTBURBONSA-N 429.584 4.298 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NOCCCC(F)(F)F 1302859160 LRCOCBNDXBMHOX-ZRDIBKRKSA-N 438.518 4.120 10 10 IICE O=C(NCc1cccc(O)c1O)c1ccccc1OCc1ccccc1Br 1303193937 VHFNWEBDFFJPJP-UHFFFAOYSA-N 428.282 4.369 10 10 IICE Cc1nnc(CCn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)s1 1304780986 WUWFPAOOJJNEKP-UHFFFAOYSA-N 439.633 4.215 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](CC(N)=O)C1 1306701082 QWFOTFZCANZBRA-HXUWFJFHSA-N 434.588 4.245 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C 1315728781 BGCPMPPRXZSUIP-KKSFZXQISA-N 443.592 4.045 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3csc(-c4ccccc4)n3)cc2F)C[C@@H](C)O1 1350934085 XVCXEGALCUAUDL-IYBDPMFKSA-N 425.529 4.493 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3oc4c(C)ccc(C)c4c3C)CC2)cc1 1350977364 XMQWOXGGLBMBBO-UHFFFAOYSA-N 435.568 4.309 10 10 IICE COc1ccc(N2CCC(NC(=O)c3c(F)ccc(Br)c3OC)CC2)cc1 1352537837 ODFBFYQDIQRCLT-UHFFFAOYSA-N 437.309 4.004 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCSc3ccc(OC)cc3)cc2F)CC1 1360091315 NGDXEZMTYDFCSO-UHFFFAOYSA-N 445.604 4.165 10 10 IICE CCCc1c(C(=O)N2CCOc3cc(N(C)C)ccc32)nnn1-c1cccc(C(C)C)c1 1361102453 SMKMIEDOHJQEAH-UHFFFAOYSA-N 433.556 4.448 10 10 IICE Cc1ccc(C(=O)Nc2ccccc2SCCC(N)=O)cc1-n1c(C)cc(C=O)c1C 1443145547 XHFBFUXJDMCQPA-UHFFFAOYSA-N 435.549 4.435 10 10 IICE Cc1ccc(C(=O)N2CCN([C@@H](C)c3nccs3)CC2)cc1-n1c(C)cc(C=O)c1C 1447405339 GOCHBAKGYMYRDT-IBGZPJMESA-N 436.581 4.191 10 10 IICE Cc1cccc(NCCNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 1456130315 QKPMKDSGLRCGIW-UHFFFAOYSA-N 427.346 4.402 10 10 IICE Cc1cc(C(=O)N2C[C@@H]3CC[C@@H](N(C)C)C[C@H]3C2)c(C)n1-c1ccc(Br)cn1 1457145004 MHPAXNYGAHKWTJ-JENIJYKNSA-N 445.405 4.054 10 10 IICE COC(=O)/C=C/c1ccc(N(Cc2ccc(OC)cc2OC)CC2CC2)c([N+](=O)[O-])c1 1458341179 UPUIKESKNOXDNK-YRNVUSSQSA-N 426.469 4.215 10 10 IICE CCC(CC)(CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(F)cc1 1470897713 QQYIMTAADXBCOP-UHFFFAOYSA-N 427.564 4.344 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)c(C)n1-c1ccccc1 1471035535 SEKZNMALMXYZSA-UHFFFAOYSA-N 448.542 4.291 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C[C@@H](C)O1 1494394282 HNBGGEXKXNOJER-HZPDHXFCSA-N 447.605 4.261 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@@H]2c2cnn(C)c2)cc1F 1503393293 IVUDDMAQMZQVNM-HXUWFJFHSA-N 439.583 4.195 10 10 IICE COCC[C@@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1504787695 ZZRNYNIEIPYSIF-NRFANRHFSA-N 425.621 4.296 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CCS1 1514155002 HERUBHKBSRTDCA-RTWAWAEBSA-N 429.634 4.274 10 10 IICE CCSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1 1516926379 INKBTMKJWLOSNM-UHFFFAOYSA-N 425.602 4.332 10 10 IICE CC[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N(C4CC4)C3)c2C(=O)OC(C)(C)C)C1 1523612866 CPRNRXJFQHOXMV-ZIAGYGMSSA-N 432.586 4.168 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccc4)C3)cc2Cl)C1 1524702698 CLMGGUOVFGGIOM-RXVVDRJESA-N 439.987 4.241 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Cl)c(-n4cccc4)cc3OC)C2)cc1 1532106023 PRXNOIVJUDCMGD-MRXNPFEDSA-N 425.916 4.157 10 10 IICE Cc1cc(CC(=O)NCc2ccc(Cn3ccccc3=O)cc2)c(C)n1-c1ccccc1 1535126937 SWEWCFAXTDHWOD-UHFFFAOYSA-N 425.532 4.163 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)C3CCN(CCC(F)(F)F)CC3)ccc21 1535833253 QAVVWHCBDDGMEZ-UHFFFAOYSA-N 439.522 4.393 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Cl)cc(F)c2Br)N(C)C)cc1 1537483236 NNONVYGOTYFCEH-KRWDZBQOSA-N 442.760 4.340 10 10 IICE Cc1cn2ccc(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)cc2n1 1540176871 DPJAQJGJAINSGE-LICLKQGHSA-N 440.525 4.012 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1 1543999503 OVTZHTZLASKEQM-UHFFFAOYSA-N 443.547 4.463 10 10 IICE CCC(=O)N[C@@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(CC)CC)cc2)C1 1545164939 NEZACBLZVGTBIV-TZIWHRDSSA-N 440.636 4.181 10 10 IICE CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2sccc2-n2c(C)ccc2C)c1 1545455574 UZSIEHUILIKZBI-AWEZNQCLSA-N 431.583 4.485 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@H](OC)C3CC3)CC2)cc1 1554959709 PXUOVXAAGRYDCR-JOCHJYFZSA-N 441.620 4.017 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC2(c3ncc(Br)cn3)CCC2)cc1 1585020859 HPZJEBXYHLGXTO-UHFFFAOYSA-N 425.330 4.456 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1 1598022633 KTAMUYODUZMNRZ-YLJYHZDGSA-N 439.556 4.282 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1617528404 SHOAKQGAWBEFBU-QUCCMNQESA-N 431.650 4.173 10 10 IICE CC(=O)N/C(=C\c1cccs1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1617900713 LIUPHPCFYUTDQR-GEYIUBJWSA-N 431.989 4.431 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)CC(=O)c1ccc(F)cc1 1626516969 WBBTWHQCZSCUFE-QGZVFWFLSA-N 442.531 4.423 10 10 IICE CC(C)(C)OC(=O)N1CCOc2cc(C(=O)NCCCSc3nccs3)ccc2C1 1628325508 JRCFWSYUOCJHEI-UHFFFAOYSA-N 449.598 4.185 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 1629602146 GIXQKDPMZCWMRP-OAQYLSRUSA-N 435.911 4.095 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccnc(N2CCC[C@H](C)C2)c1 1629969459 VCWJQDLQPFJFRT-HNNXBMFYSA-N 432.362 4.448 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)C1CCCCCC1 1631069657 KLZINAMWJDKFRN-JOCHJYFZSA-N 445.604 4.003 10 10 IICE C[C@H](NC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1)c1ccccc1O 1632249818 CNEIKJJOFMXHNJ-ZFWWWQNUSA-N 449.320 4.023 10 10 IICE Cc1cc(C(=O)N2C[C@@]3(C)CN(C)C[C@]3(C)C2)c(C)n1-c1ccccc1Br 1634385908 DZHWACFCMJEZET-FGZHOGPDSA-N 430.390 4.270 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC[C@H](CNC(=O)OC(C)(C)C)C3)c2C)c1 1637577358 CGJILTHBUSYEAS-HXUWFJFHSA-N 440.588 4.459 10 10 IICE CO[C@H](C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)[C@@H]1CCOC1 1641202973 PVAJTXXSPZVLRR-JJXUHFIVSA-N 436.474 4.350 10 10 IICE COC1CCN(c2ccc(CN3CCC([C@@H](C)NC(=O)OC(C)(C)C)CC3)cc2)CC1 1641742606 CJHZTFIJKBXQOE-LJQANCHMSA-N 431.621 4.427 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4C(C)(C)[C@H]3C)cc2F)C[C@@H](C)O1 1647754716 NTRPBGMVFXJTDW-CEXWTWQISA-N 439.575 4.242 10 10 IICE O=c1oc2ccc([N+](=O)[O-])cc2n1CCCN1CCCc2cc(OC(F)(F)F)ccc21 1652745345 GMIXCFRNTYWNRR-UHFFFAOYSA-N 437.374 4.244 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3CCCOc4cc(Cl)ccc43)C2)cc1 1670974015 ZNHXSGBFTWIQKP-KKSFZXQISA-N 429.948 4.388 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1695619671 KNYBZALRMKWCJR-IBGZPJMESA-N 436.604 4.182 10 10 IICE CCc1nnc(N2CC[C@H](c3ccc(OC)cc3)C2)n1CCCSc1nccs1 1709078946 IKMJBCTXDSMYSX-KRWDZBQOSA-N 429.615 4.482 10 10 IICE CCCCN(C)c1nnc(-c2noc3c2COCC3)n1Cc1ccc(N(CC)CC)cc1 1709596326 ZHACVPGOQPTCOU-UHFFFAOYSA-N 438.576 4.137 10 10 IICE C[C@H]1CN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C[C@@H](C)S1 1763102946 VAWUMJYPCGWZPJ-GASCZTMLSA-N 434.660 4.253 10 10 IICE CC[C@@H](NC(=O)c1c(C)ccc2ccccc12)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1861906905 ZQHNQOANUZSMGK-XMMPIXPASA-N 445.563 4.014 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccccc3)C(=O)N(CCCN(C)C)C2=O)cc1 1873421433 XRAYNORLNYHILG-UHFFFAOYSA-N 442.563 4.238 10 10 IICE CN[C@H](c1ccc2c(c1)CCN2C)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OCc1ccccc1 2044755264 VXXBCNDUBDPENG-PUZWTLIVSA-N 439.600 4.438 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2060638751 AMIXSIAQKXPPCH-WMZHIEFXSA-N 443.548 4.132 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)[C@@H]2CC[C@H]21 2121183670 LULCLHIYIOIMOP-CWRNSKLLSA-N 429.330 4.171 10 10 IICE N=C1C(=Cc2cc(Br)ccc2O)C(=O)N=C2SC(C3CCCCC3)=NN12 2293591298 KEHVWXYTNWVLLX-UHFFFAOYSA-N 433.331 4.354 10 10 IICE COc1ccc(CCNC=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)cc1 2297325197 YKUKYEJQNCGHDQ-UHFFFAOYSA-N 442.475 4.071 10 10 IICE COc1ccc(C=C2SC(=S)N(CCC(=O)Nc3cccc(C)c3)C2=O)cc1OC 2297476661 UETHZOFEBNIQFN-UHFFFAOYSA-N 442.562 4.242 10 10 IICE O=C(O)Cc1ccc(N2C(=O)C(=Cc3ccc(Br)cc3)SC2=S)cc1 2314534039 WNWRFVSGUQRGTA-UHFFFAOYSA-N 434.336 4.482 10 10 IICE CC[C@H](CCNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380786090 HAROLJKOHVBSDJ-CQSZACIVSA-N 443.382 4.363 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC[C@@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381145229 CDBNHENNGOXPKI-IUODEOHRSA-N 441.366 4.115 10 10 IICE Cc1cc(C)cc(N2C(=O)N=C(O)/C(=C\c3cc4c(cc3Br)OCO4)C2=O)c1 1214765 XRIHBIVNTBDFKX-MKMNVTDBSA-N 443.253 4.301 10 10 IICE COCCNC(=O)c1cccc2c1N[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC=C[C@H]21 14471233 AVPLTBQWZCPHJR-AVYPCKFXSA-N 427.888 4.451 10 10 IICE COc1ccc([C@H]2Nc3ccc(C(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@@H]32)cc1OC 14479714 WZSJEHQOMYRBNY-AJGMTHFWSA-N 434.536 4.439 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3\SC(=S)N(CCCOC)C3=O)o2)cc1 34982596 MFZIEOOLDTYWRU-AQTBWJFISA-N 431.535 4.361 10 10 IICE COc1cccc(/C=C/C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)c1OC(F)F 96945979 VVLIWLPQNHJMIS-FMIVXFBMSA-N 442.466 4.259 10 10 IICE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCc1ccccc1CN1CCCCCC1 97570514 WLPOMQCEGIXBHI-SDNWHVSQSA-N 433.596 4.229 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CC(=O)OC3CCCCC3)C2=O)cc1OC 206454951 JLSJKVOCQWECCL-LDADJPATSA-N 435.567 4.171 10 10 IICE COc1ccccc1[C@H](O)CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 725884517 BROPNAHZUFSVJI-HXUWFJFHSA-N 443.341 4.329 10 10 IICE COc1cccc(N2CC[C@H](CNC(=O)N(C)Cc3ccc(N4CCCCC4)cc3)C2)c1 726716355 ICXASMBIOXDSOY-JOCHJYFZSA-N 436.600 4.353 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3ccc(C(=O)OC(C)(C)C)cc3)CC2)cc1 743694147 LRGDXEBHISLGBH-UHFFFAOYSA-N 439.556 4.072 10 10 IICE C[C@@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccncc1 749470612 QJPTUBGSTZLTDC-IQGJIOQQSA-N 431.608 4.044 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 764535895 HOVMQBGXFQWCSJ-KNQAVFIVSA-N 444.620 4.464 10 10 IICE Oc1cccc([C@H]2CN(Cc3cc(Br)cc(Br)c3O)CCO2)c1 775701326 RPIZUUVOKOKNDF-MRXNPFEDSA-N 443.135 4.196 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](c3cccc(F)c3F)C(F)(F)F)CC2)cc1 776020153 NHPMFESWZXPWNW-SFHVURJKSA-N 429.389 4.109 10 10 IICE CCN(Cc1cn(C)nn1)Cc1c(O)ccc2c(=O)c(-c3ccccc3Cl)c(C)oc12 781581727 JXDNCCUAVUFJGY-UHFFFAOYSA-N 438.915 4.278 10 10 IICE Cc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(-c2ccnn2C)c1 801727862 ZNZZPUYAXGQZMV-UHFFFAOYSA-N 429.612 4.217 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cccc(NC(=O)c2ccc(F)cc2)c1 804739047 OQKBDODJQGVDTG-UHFFFAOYSA-N 443.272 4.476 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnc(OCC3CC3)cn2)cc1 857450108 OJDIJAMDXRUORM-UHFFFAOYSA-N 432.524 4.187 10 10 IICE CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1128138409 WVLILKYPVQTFSS-BCHFMIIMSA-N 431.580 4.467 10 10 IICE COc1ccc([C@H]2[C@@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CCC(=O)N2C)cc1 1132267855 PIUKULANNAUEEL-AHWVRZQESA-N 445.563 4.329 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)sc(C)c1-c1ccccc1 1194487015 AXRZCQZSDVIAMK-HBGVWJBISA-N 442.581 4.242 10 10 IICE CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)c2cc3cc(O)c(O)cc3s2)cc1 1294550178 LAIFFHJRYXVGPP-CQSZACIVSA-N 442.537 4.099 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(Nc4cc(F)cc(F)c4)n3)CC2)cc1 1294755425 FNYUUCNQHXIZKW-UHFFFAOYSA-N 430.480 4.136 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cn(Cc2ccc(Cl)cc2Cl)nn1 1294868705 FWMLKKRXZDJIJP-UHFFFAOYSA-N 431.323 4.148 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 1295406941 ZXOMRZRMKXRPPL-BMPCTQGYSA-N 444.572 4.103 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(N4C[C@H](C)O[C@@H](C)C4)cc3)c2)CC1 1296014167 RYKQKWHOKOIPMI-SFTDATJTSA-N 436.600 4.083 10 10 IICE CO[C@H]1CCCN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C1 1300774746 SZGNYMPMQAMNDH-KRWDZBQOSA-N 447.605 4.262 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@@H](N(C)C)C23CCC3)c(C)n1-c1ccccc1Br 1301549171 RHBMWLLPDYKXKG-VQTJNVASSA-N 430.390 4.459 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(Br)cn4ncnc34)c2C)c1 1302260498 BCLZNRIPAWYUCS-UHFFFAOYSA-N 438.329 4.138 10 10 IICE CCCN(CC1CC1)c1nnc([C@H](C)CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1306810480 HXPOBTCXBXXSGH-GOSISDBHSA-N 429.584 4.442 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(N(C)c4ccccc4)nc3)cc2F)CC1 1435076462 QXBHLMXYYIJKBF-UHFFFAOYSA-N 447.558 4.061 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2n[nH]c(C)c2I)c1 1452516056 FMWIMWUGCVRXBO-UHFFFAOYSA-N 434.281 4.291 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCCCNC(=O)C(F)(F)F 1458866454 XYALSIZIMRIUSE-UHFFFAOYSA-N 436.297 4.493 10 10 IICE COc1ccc(NC(=O)[C@H](C)N2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)cc1 1459464293 JTBCAYXGZGTSGI-KRWDZBQOSA-N 439.556 4.500 10 10 IICE CC(C)CC[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1459718794 DZXKOZPMANOSSL-RZUBCFFCSA-N 433.612 4.346 10 10 IICE COC[C@H](Cc1ccccc1)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1465654140 BPGODCLSKLKRLI-IBGZPJMESA-N 442.357 4.239 10 10 IICE CC[C@@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cccc(OC)c1OC 1471136733 YKERISUVUSMXSV-UYAOXDASSA-N 428.529 4.251 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3cccc(F)c3)n2)c(C)n1-c1ccc(OC(F)F)cc1 1472948391 SISZSQKWSKBFCX-UHFFFAOYSA-N 441.413 4.371 10 10 IICE CCN1CCOC[C@@H]1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1524646273 FQRFLCGXXDUUBF-HXUWFJFHSA-N 428.533 4.016 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2(c3cc(OC)cc(OC)c3)CCCC2)cc1 1531378649 BHLWZZPCRUVURR-UHFFFAOYSA-N 426.557 4.119 10 10 IICE CC(C)c1cc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n(C)n1 1538918777 FPTOCNLADRNVNK-UHFFFAOYSA-N 439.317 4.268 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(Sc2nncn2C)cc1 1540637159 BWOFVVACUBABFX-UHFFFAOYSA-N 431.521 4.439 10 10 IICE Cc1cc(CC(C)(C)C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1Br 1542300830 ONPWNUZACVIXAV-UHFFFAOYSA-N 445.401 4.479 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 1542431972 NIFVYVBDKLFYAB-FCHUYYIVSA-N 448.394 4.044 10 10 IICE CCOc1ccc(N2CCN(C(=O)COc3ccc(OCc4ccccc4)cc3)CC2)cc1 1545929871 PINAPRUHANTYSJ-UHFFFAOYSA-N 446.547 4.392 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CCC[C@H](C(F)F)C2)cc1 1547443954 IBLIVFVHXPVKRX-SFHVURJKSA-N 443.546 4.055 10 10 IICE CC[C@@](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)(C(=O)OC)c1ccccc1 1556997780 WQYIKUORAUSDCB-MHZLTWQESA-N 446.547 4.466 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)/C=C\c3cc4cnn(C(C)C)c4[nH]c3=O)c2C)c1 1557889578 ZBMZHIXFPXWBJK-KTKRTIGZSA-N 443.551 4.351 10 10 IICE Cc1cc(C(=O)N[C@@H](Cc2ccccc2)c2nc(O)n[nH]2)c(C)n1-c1cccc(Cl)c1 1557911914 QRSYAZAHRFUYCA-FQEVSTJZSA-N 435.915 4.285 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)cc1 1565252874 WXTPAWZALBRCIJ-YADHBBJMSA-N 431.964 4.347 10 10 IICE Cc1nnc(N(C)Cc2cc(Br)cs2)n1Cc1ccc2c(c1)CCCN2C 1612534828 RISLKJATWNKBDR-UHFFFAOYSA-N 446.418 4.478 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](COC)OC 1614160767 QFZMROXCEWXYKI-IRLDBZIGSA-N 437.588 4.393 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCCS(=O)(=O)c1ccccc1 1615477898 SUEBOROFRDZFGS-UHFFFAOYSA-N 444.597 4.328 10 10 IICE Cc1cc(C(=O)N[C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c(C)n1-c1ccc(Br)cn1 1620754530 WMAXIBSACNLEDX-ATZDWAIDSA-N 432.362 4.185 10 10 IICE Cc1cc(C(=O)NCCN(C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1628967936 OZWLKZCYHWCLOX-UHFFFAOYSA-N 427.346 4.118 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC(Oc3cccc(Br)c3)CC2)cc1 1633781990 HTVSAEHBXMJCTO-UHFFFAOYSA-N 431.290 4.295 10 10 IICE C[C@H](NC(=O)N[C@@H]1C[C@H]2CC[C@@H]([C@H]1C)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634434692 FIZLWBQCRCLZAV-KHDMTIDOSA-N 430.593 4.289 10 10 IICE COC(=O)CN(CC(=O)N[C@@H](c1ccccc1)C1CCCC1)Cc1cc(Cl)ccc1O 1642071993 OQRLQHQTDDMBCJ-DEOSSOPVSA-N 444.959 4.068 10 10 IICE COC1CCN(c2ccc(CNC(C)(C)COc3ncccc3Br)cc2)CC1 1644968848 ITQWCFRYJAVJOH-UHFFFAOYSA-N 448.405 4.407 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]2C[C@@H](C)O)sc(C)c1-c1ccccc1 1649398795 XTEIPUNFFUPIFZ-CRAIPNDOSA-N 430.570 4.074 10 10 IICE C[C@@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(-n2cccn2)c(F)c1 1672977901 BBVRZKPAARVVSV-YLJYHZDGSA-N 438.503 4.169 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4cc(C(F)(F)F)ccc4C3)C2)cc1 1682188304 NBYYNMLTANKBMQ-INIZCTEOSA-N 433.474 4.308 10 10 IICE COc1ccccc1C[C@@](C)(CO)NC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1683304248 UPSLRWSYGPYPSX-SANMLTNESA-N 435.568 4.204 10 10 IICE CC(C)[C@H]1OCCC[C@@H]1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1706361959 MBGFZHFQDFRNEC-ZJSXRUAMSA-N 435.572 4.057 10 10 IICE CCOCc1nnc(N2CC(C)(C)OC[C@@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1728998112 QTNUKLAIGOFYLQ-FQEVSTJZSA-N 441.620 4.103 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CC[C@@H](C(C)(C)C)C2)cc1F 1729330510 RMHDQLGTXAOQNY-HXUWFJFHSA-N 436.579 4.390 10 10 IICE CC[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1744890353 PNXAIZDECYYINJ-GOSISDBHSA-N 429.584 4.226 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)[C@@H]2CCSC2)cc1 1746089987 LGGGIILDSMTAOH-OAQYLSRUSA-N 436.629 4.485 10 10 IICE CCN(CC)c1ccc(/C=C2/SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)cc1 1858594055 JMCXFZSDAPCEIW-NGYXKBBWSA-N 440.590 4.430 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(NCc3c(O)cccc3Br)CCC[C@@]2(F)C1 2126044957 BGBLFFDCARFZKL-MOPGFXCFSA-N 429.330 4.126 10 10 IICE Brc1cc(N2C[C@@H]3[C@H](CCN3Cc3ccccc3)C2)ccc1CNC1CC1 2188882472 ZDNUZTDSAKJPRV-AUSIDOKSSA-N 426.402 4.412 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@@H]1NC(=O)c1ccc(Br)cc1I 2225793213 UIXRDEUJRPEICS-QWRGUYRKSA-N 435.063 4.015 10 10 IICE COc1ccc(-n2cccc2C=C2C(=N)N3N=C(c4ccccc4F)SC3=NC2=O)cc1 2297346901 XYQKWSYDAVBXGK-UHFFFAOYSA-N 445.479 4.292 10 10 IICE COc1cc(C=C2C(=O)NN(c3ccc(Cl)cc3)C2=O)ccc1OCc1ccccc1 2297549641 LWSFGNYKXYVXBI-UHFFFAOYSA-N 434.879 4.389 10 10 IICE O=C1NN(c2cccc(Cl)c2)C(=O)C1=Cc1cc(Cc2ccccc2)cc([N+](=O)[O-])c1O 2297578238 CAUSUDHNCKFSMN-UHFFFAOYSA-N 449.850 4.006 10 10 IICE CCOc1ccc(OCC)c(N2C(=O)NC(=O)C(=Cc3cn(CC)c4ccccc34)C2=O)c1 2313556913 OLDRCLFOAWIJQA-UHFFFAOYSA-N 447.491 4.125 10 10 IICE CCCN1C(=O)C(=Cc2c(Oc3ccccc3F)nc3ccccn3c2=O)SC1=S 2314507829 LSJVMZYRHHWCEU-UHFFFAOYSA-N 441.509 4.237 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2C[C@@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381130884 GJARBRXKMMGLFG-DOMZBBRYSA-N 441.366 4.067 10 10 IICE O=C(NN1C(=O)/C(=C\c2c(Cl)cccc2Cl)SC1=S)c1ccccc1O 7002436 VYULSCJENNCUES-RIYZIHGNSA-N 425.318 4.245 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14472864 WRJUHDOLWODIRD-AUSJPIAWSA-N 433.917 4.325 10 10 IICE COCCNC(=O)c1ccc2c(c1)C(=O)N(c1ccc(/N=N/c3ccccc3)cc1)C2=O 21125846 OFRCUPZJZHFCRT-CYYJNZCTSA-N 428.448 4.279 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)Oc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 62694681 IYZMHFIQDQERLC-UHFFFAOYSA-N 435.499 4.233 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C/c2ccc(OCCC(C)C)c(OC)c2)SC1=S 206838901 KGYHUVJFOWFPKO-AQTBWJFISA-N 437.583 4.275 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccc(OC)cc3)=NC2=O)ccc1OCCC(=O)O 210469279 QVJKIQUHAGEADC-UYRXBGFRSA-N 442.493 4.030 10 10 IICE C[C@@H](NC(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(N2CCOCC2)cc1 776014897 SDDDFVYKIWDZCU-BFUOFWGJSA-N 443.416 4.465 10 10 IICE C[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnn(C2CCCC2)c1 800476563 LEVAYPXCMNUIES-IBGZPJMESA-N 449.578 4.105 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1cc(Br)cc2cccnc12 808525867 IWKGXMPNKSAXRR-UHFFFAOYSA-N 447.339 4.317 10 10 IICE CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1128138410 WVLILKYPVQTFSS-NIYFSFCBSA-N 431.580 4.467 10 10 IICE CC(C)[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1136187905 QGRMRJWGQWONPT-IBGZPJMESA-N 444.578 4.424 10 10 IICE Cc1cc(CC(=O)NC[C@H](O)COc2cccc(C(F)(F)F)c2)c(C)n1-c1ccccc1 1137399578 BHQYYQAAWJTRAX-NRFANRHFSA-N 446.469 4.212 10 10 IICE COC(=O)[C@@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc2cc(O)c(O)cc2s1 1138094960 GTQRFHURXUGKOZ-RHSMWYFYSA-N 425.506 4.094 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCOc2ccc(Br)cc21 1141803052 DNEYEXKLKKOOCQ-SFHVURJKSA-N 447.398 4.185 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H](c2nccn2C)C(C)(C)CO)cc1 1143509166 GYONYXOXGJDWNP-NRFANRHFSA-N 434.544 4.391 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(-c4c(F)cccc4F)s3)CC2)cc1F 1150239674 IRRCUTZZGXABFM-UHFFFAOYSA-N 433.455 4.198 10 10 IICE COc1cc([C@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1S(C)(=O)=O 1181301537 QPPNOHZALXRSGG-HNNXBMFYSA-N 444.528 4.136 10 10 IICE CC(=O)c1c(C)cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1C 1184206516 NMRZPMWZHAAODI-UHFFFAOYSA-N 444.534 4.326 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@H](c4nccn4C)C3)cc2Cl)C1 1227210261 ZDFRGWICDPQNGB-BLIXFSHQSA-N 445.995 4.029 10 10 IICE O=C(NCc1cccc(Cl)c1O)NC[C@H]1c2ccccc2C(=O)N1Cc1ccccc1 1230967588 OTRZGFNWWORNQW-NRFANRHFSA-N 435.911 4.242 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)N3CCCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 1264733367 YRFZEXICWFLSHW-QFIPXVFZSA-N 449.595 4.130 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CCS[C@@H](C(C)C)C1 1289423454 LNHQFUWFEUZBIJ-IFMALSPDSA-N 443.661 4.173 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(COC)CCC1 1291609552 HYYNHILDSRDQHF-GOSISDBHSA-N 445.583 4.083 10 10 IICE CO[C@@H]1CCCN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C1 1300774747 SZGNYMPMQAMNDH-QGZVFWFLSA-N 447.605 4.262 10 10 IICE CCC1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CCC(=O)NC)CC1 1305900268 OCCZIGILXRMFLD-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CNC(=O)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1ccc(F)cc1C 1307151201 RBEUSNXZCQUJSH-LJQANCHMSA-N 449.482 4.290 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)c(C)n1-c1ccccc1 1313101436 WLYRHEVJKCXIIF-JOCHJYFZSA-N 429.923 4.462 10 10 IICE C[C@@H]1[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1313127548 JFJPKSNCXVAFPS-QYRPDUKASA-N 430.593 4.071 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCO[C@@H]1C(C)C 1314304482 CMTVTMCUFBMYLJ-XUZZJYLKSA-N 441.620 4.112 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1)C(C)C 1315188706 LBSRGTDCCVRZIZ-XXBNENTESA-N 437.588 4.249 10 10 IICE CC(C)(C)c1cc(CNCc2cccc([C@]3(C)NC(=O)NC3=O)c2)c(O)c(C(C)(C)C)c1 1318366574 BHVJIUQQDNGYNW-SANMLTNESA-N 437.584 4.332 10 10 IICE C[C@@H](NC(=O)Cc1cc(Br)ccc1Cl)c1ccc(N2CCOCC2)cc1 1434913242 YOPMXRHODANVMR-CQSZACIVSA-N 437.765 4.359 10 10 IICE Cc1cc(CC(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c(C)n1-c1ccccc1 1434915726 NESLKMKAMNBUHF-UHFFFAOYSA-N 433.577 4.464 10 10 IICE Cc1cc(CC(=O)N2CCN(c3ccc(F)cn3)CC2)c(C)n1-c1ccc(Cl)cc1 1435719916 UNKXGEPYTOCJFF-UHFFFAOYSA-N 426.923 4.173 10 10 IICE O=C(Cc1noc2ccc(Br)cc12)N(Cc1ccccc1O)C[C@H]1CCCO1 1446570293 VMMZBSYZJOCHKK-MRXNPFEDSA-N 445.313 4.046 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC(C)(C)C(=O)NCC3CCCCC3)ccc21 1457747333 NESYXYLTHUSHEG-UHFFFAOYSA-N 427.589 4.109 10 10 IICE COC1CCN(c2ccc(CN3CCO[C@H](c4cccc(OC(F)F)c4)C3)cc2)CC1 1459873544 DDQYVEDHHJZXGS-QHCPKHFHSA-N 432.511 4.477 10 10 IICE CCc1c(C(=O)NCc2cccc(Br)c2O)cnn1-c1ccccc1Cl 1467761090 MUCGKXPXYPPRNV-UHFFFAOYSA-N 434.721 4.486 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@]2(C)CCCO)sc(C)c1-c1ccccc1 1473282972 WKWRNLGRKUIIFA-DEOSSOPVSA-N 444.597 4.466 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@](CC)(CO)C2)sc(C)c1-c1ccccc1 1473409638 GQNQNHKFUKNWBN-XMMPIXPASA-N 444.597 4.323 10 10 IICE CN(CC(=O)Nc1cccc(I)c1)c1ccc(-c2nccs2)cc1 1473535203 CZAIZBVOWNQDCD-UHFFFAOYSA-N 449.317 4.490 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1501934869 NDYQJYJKYNZEHM-NRFANRHFSA-N 426.653 4.067 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1516378927 IPRJRIISCBITQC-LEWJYISDSA-N 429.584 4.439 10 10 IICE C[C@@H](NC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1)c1ccc(N(C)C)cc1 1517377716 XWIZMDIHNYRLAH-VULIGXMUSA-N 444.564 4.343 10 10 IICE COc1cnc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(Br)c1 1524130108 HHHJAAHXLWCGBJ-UHFFFAOYSA-N 444.329 4.334 10 10 IICE Cc1cn(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nc1C(F)(F)F 1530425125 OAEWPXOQZBVYFI-ZDUSSCGKSA-N 428.886 4.416 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(COc3ccc(F)cc3)o2)N(C)C)cc1 1537478054 TZFQTIQCORPRDI-JOCHJYFZSA-N 425.504 4.096 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2CCN([C@@H]3CCSC3)CC2)cc1 1540800057 DIWZNASGAKETDY-JOCHJYFZSA-N 427.614 4.092 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)cc1F 1556327982 QWKGEWFYALLYCA-LJQANCHMSA-N 439.462 4.304 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 1558757172 SBIOXPZCQINVIW-MRXNPFEDSA-N 427.715 4.273 10 10 IICE CCCO[C@H]1CCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1559533496 MZSXRAFLMUJZHK-MJGOQNOKSA-N 434.536 4.070 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)n1 1566849312 JZIKKKLXOSMKRG-UHFFFAOYSA-N 448.306 4.009 10 10 IICE Cc1cc(CC(=O)N(CCN(C)C)CC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1584032921 WUFRLSCKIRYIEQ-UHFFFAOYSA-N 448.007 4.022 10 10 IICE C[C@@H](NC(=O)[C@@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1585423743 KUGZYPKYQIRAHN-VGSWGCGISA-N 439.556 4.301 10 10 IICE CC(C)(C)c1cc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)no1 1585681554 IMTBEXNGIKTUDI-MHWRWJLKSA-N 448.541 4.446 10 10 IICE CC(C)Cc1ccccc1CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1586842136 VVYLMBKINCCBRY-UHFFFAOYSA-N 442.471 4.499 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCN(C(=O)OC(C)(C)C)C3(C)C)ccc21 1597413329 AEPJCMFJLSWQPN-OAQYLSRUSA-N 443.588 4.422 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2ccc(F)cc2F)c2nccn2C)c1 1603532505 CPYAYCLIRFRFKZ-HSZRJFAPSA-N 448.473 4.438 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)CC[C@@H]3C)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935052 FLHNVQCILTVGIT-ROUUACIJSA-N 434.588 4.066 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCC(CCN2CCCC[C@H]2C)CC1 1611963742 YXNBBOOMLLIOGI-OAQYLSRUSA-N 438.664 4.490 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3cnc4c(cnn4C(C)(C)C)c3=O)c2C)c1 1613596477 FWOHGXUNXJLFEY-UHFFFAOYSA-N 449.580 4.360 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CSC[C@@H]3C(=O)N[C@H](C)C(C)C)c2C)c1 1616945445 HQAFIGWBUKGKOP-XMSQKQJNSA-N 427.614 4.387 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(C(C)(C)C)c3-c3ccccc3)CC2)cc1F 1622563725 DFBGWRHXFWIOSD-UHFFFAOYSA-N 436.531 4.415 10 10 IICE CN(c1ccc(CNC(=O)COc2ccc(Br)cn2)cc1)C1CCCCC1 1625905156 KHAVTIYLVFMDPS-UHFFFAOYSA-N 432.362 4.308 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(I)cc2)cc1F 1628770057 UIVDVECXZCGPRV-UHFFFAOYSA-N 426.273 4.207 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnc(-c4c(F)cccc4F)s3)CC2)cc1 1630992714 TWNFSYTZAQUYNQ-UHFFFAOYSA-N 429.492 4.449 10 10 IICE CC[C@@H]1CN([C@H](CC)C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CCO1 1633065798 CSDGIXOWIIYJOB-ILBGXUMGSA-N 439.600 4.184 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(N4C[C@@H](C)O[C@H](C)C4)nc3)c2C)cc1 1634526125 NLTKSHLTKOHRTA-QZTJIDSGSA-N 434.540 4.364 10 10 IICE O=C(CC1CCN(CC(F)(F)F)CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1634753839 SDPOMBMPDAHJHM-INIZCTEOSA-N 449.464 4.037 10 10 IICE CCCOc1cc(OC)ccc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941813 XAZWKKLOOVJUOD-SFHVURJKSA-N 432.948 4.237 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C\c2ccc(O)c(O)c2)C1 1638739930 VOUJULSIEPFJFE-XANBCXBQSA-N 430.545 4.139 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(O)(Cc2ccc(F)cc2)CC1 1638909120 YEAZOENVVNCFLH-UHFFFAOYSA-N 434.511 4.256 10 10 IICE CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 1657724964 FENLTHZEUBICGH-HXUWFJFHSA-N 437.367 4.339 10 10 IICE Cc1nnc(N2CCC([C@@H](O)c3ccc(F)cc3)CC2)n1CCCSc1nccs1 1693475896 UZHHEDAASFMRQF-IBGZPJMESA-N 447.605 4.315 10 10 IICE CN(CCOC(C)(C)C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1696830406 MYKKBCCJXOLGIJ-UHFFFAOYSA-N 441.620 4.072 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(OC)c3)n2CCCSc2nccs2)CCO1 1744983724 ZIKGDXMNJHUZRY-KRWDZBQOSA-N 445.614 4.208 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)C(C)(C)C)CC1 1745656594 OITHAGBRCBUIKZ-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCN(C)c1nnc(-c2cnn(-c3ccccc3)c2)n1CCCSc1nccs1 1745910240 NTMWOSXFTQGWGJ-UHFFFAOYSA-N 425.587 4.226 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)[C@@H]2CCSC2)cc1F 1747572526 VRAYQDCETVQSJC-QGZVFWFLSA-N 431.606 4.126 10 10 IICE Cc1nnc(N2CCC[C@@H](CN3CCCCCC3)C2)n1CCCSc1nccs1 1762583313 UJFAFPCLAJFNRE-IBGZPJMESA-N 434.679 4.318 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1764632959 IHQYTIQQOPAFLW-LJQANCHMSA-N 440.567 4.312 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC[C@H]3C[C@H](F)C3)CC2)cc1 1768703629 QSDVAICODUAVKZ-WGSAOQKQSA-N 429.584 4.439 10 10 IICE COc1cc(CCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(OC)c1OC 1859616521 NYWMXSBKUHRXGZ-UHFFFAOYSA-N 445.471 4.059 10 10 IICE O=C(O)CCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2cccs2)SC1=S 2053493402 YWLDDBSYVUMQCK-UHFFFAOYSA-N 441.559 4.277 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C(C)C)c(C=O)c2I)c(O)c1 2079998119 MJFFMNUXUCFGJA-QGZVFWFLSA-N 442.297 4.383 10 10 IICE C[C@H](NCc1c(O)cccc1Br)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116239059 PHQCMFTYDMQSAA-YVEFUNNKSA-N 425.323 4.492 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1O 2236032585 OHOUHNHLJFPXIG-CYBMUJFWSA-N 443.382 4.289 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](C2CC(NCc3cc(Br)cc(F)c3O)C2)C1 2280151185 DRSOJPHGVVPYQL-VEAWUBTESA-N 443.357 4.419 10 10 IICE CCOc1cc(C=C2SC(=S)N(NC(=O)c3ccc(Cl)cc3)C2=O)ccc1OC 2314764354 AKUGDHXIDRGTEF-UHFFFAOYSA-N 448.953 4.294 10 10 IICE C[C@@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)C1=O 11636164 UWGUCRUWDUWEIX-NSHDSACASA-N 440.015 4.355 10 10 IICE Cc1cc(=O)n(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c2c(C)cccc12 32530458 CLLNUAFEBCHQDN-UHFFFAOYSA-N 436.467 4.032 10 10 IICE O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C/C=C\c2ccc([N+](=O)[O-])cc2)SC1=S 33695662 LAVLUVFDSPKJCP-ZJPWPMHWSA-N 440.502 4.048 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC3(CC2)C[C@@H](Oc2cnccn2)CCO3)cc1 675022469 PHPBPENQDOFAIM-QHCPKHFHSA-N 446.551 4.117 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)cc1Br 705883915 UDGKUCKUXPJMKO-ANZJIFDASA-N 426.402 4.255 10 10 IICE C[C@H]1[C@H](NCc2cccc(Br)c2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709348201 VLYXEYUQGHTRQE-LBRJOISOSA-N 425.367 4.421 10 10 IICE COc1cc(Cc2noc(-c3ccc(-n4c(C)ccc4C)cc3)n2)ccc1S(C)(=O)=O 762038221 XIYBQYKIXCZEPF-UHFFFAOYSA-N 437.521 4.147 10 10 IICE CN(C)c1ccc(CNC(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)cc1 763277113 TYOPJFGRTUYJEG-UHFFFAOYSA-N 426.524 4.381 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2ccc(Br)cn2)C1 766874814 CVNSVXXIGLZLHT-UHFFFAOYSA-N 442.357 4.309 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@@H](CO)c3cccc(Br)c3)cc2)CC1 766970817 AYPFWSAYKGRMLN-NRFANRHFSA-N 446.389 4.218 10 10 IICE Cc1cc(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)c(C)n1-c1ccccn1 771821960 BVECUKQNGVSGIN-KRWDZBQOSA-N 430.430 4.196 10 10 IICE Cc1c(NC(=O)NCc2cc(Br)ccc2O)cccc1C(=O)N1CCCC1 806245122 RRKWRFOJAMNXHD-UHFFFAOYSA-N 432.318 4.021 10 10 IICE COc1ccc2ccc(-c3nn(-c4ccccc4)cc3C(=O)OCC(=O)C(C)=O)cc2c1 808509642 UAGHGPZAHOBHQB-UHFFFAOYSA-N 428.444 4.016 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(O)cc(C(F)(F)F)c1 857456854 QUZBILDQGIVRNF-AWEZNQCLSA-N 430.373 4.411 10 10 IICE CCN(C(=O)/C=C\c1cc2cnn(C(C)C)c2[nH]c1=O)c1ccc(Br)cc1 914758349 KHXQKCPHYBGNOI-YHYXMXQVSA-N 429.318 4.134 10 10 IICE CCOc1ccc(-c2csc(NS(=O)(=O)c3c(Cl)nc4ccccn34)n2)cc1 917907537 VWZRDNGSUNJDPY-UHFFFAOYSA-N 434.930 4.311 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)c(C)n1-c1ccc(F)cc1 918133660 FTEMWRGKJDKUHY-OAHLLOKOSA-N 429.517 4.096 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)NCc1ccccc1OCc1ccccc1 918218752 PIVDGBRGWHQMNI-UHFFFAOYSA-N 449.526 4.241 10 10 IICE CC(C)O[C@@H]1CCCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1130762855 DJOYWNWNQJKCDL-UHVIJJLKSA-N 438.640 4.146 10 10 IICE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccc(N(C)C)cc1 1135825436 TZNDLRCXPIJUSN-SFHVURJKSA-N 443.547 4.296 10 10 IICE CN(C)c1ccc2c(c1)OCCN2[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O 1168860310 XAJNBNKKBYYFSN-HXUWFJFHSA-N 433.474 4.161 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)C[C@@H]1CCCC(=O)N1 1182481670 KAKPREPRZZEFGD-LPHOPBHVSA-N 433.474 4.357 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCOC12CCCCC2 1289485781 MTLOXNZVDIKQDE-DNKLCNGGSA-N 448.585 4.025 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)c1cccc(Br)c1 1296843474 IXXAURXVQYSONW-OAQYLSRUSA-N 441.325 4.133 10 10 IICE COc1ccc(N2CCCN([C@H](C)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)cc1 1307424483 RXFUMBDYYCEPSY-NHCUHLMSSA-N 435.612 4.352 10 10 IICE CC(=O)N(c1ccccc1)c1nc(CNC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cs1 1308972125 OIGQXMHBEWUPNF-QHCPKHFHSA-N 437.613 4.286 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(F)c(I)c1 1436852385 VUUVFQJUKCPKAK-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE COc1ccc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1C 1456526656 VCJOUQDTLOCYMG-CQSZACIVSA-N 446.550 4.063 10 10 IICE COc1cc2c(=O)ncn(CC(=O)c3cc(C)n(-c4ccc(C)c(C)c4)c3C)c2cc1F 1459030868 YUZZMNTVXYAQQQ-UHFFFAOYSA-N 433.483 4.451 10 10 IICE O=C(CCCCc1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)cc1 1470445961 JFMCJIGJKANOQB-UHFFFAOYSA-N 445.401 4.439 10 10 IICE CC(C)C[C@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)CC(=O)OC(C)(C)C 1470871291 QTZIMRGBOWGKIR-FPOVZHCZSA-N 448.604 4.477 10 10 IICE O=C(CSc1ccc([N+](=O)[O-])cc1F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473014210 OYUMMHHCJMUZIC-UHFFFAOYSA-N 436.420 4.240 10 10 IICE C[C@@H](SCC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473053324 PWZMGZBUEHVGHY-OAHLLOKOSA-N 429.497 4.405 10 10 IICE CC[C@@](C)(NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)cc1 1473708232 ZSTHRLREBHOQQY-AREMUKBSSA-N 430.479 4.455 10 10 IICE CCCCN(Cc1ccccc1F)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786905 YDVIFJOGNSTDSG-UHFFFAOYSA-N 435.490 4.452 10 10 IICE C[C@H]1CSCCN1c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1494614500 YQTNRUMHYPKDGC-GJZGRUSLSA-N 425.649 4.100 10 10 IICE CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1542410721 ORXIEJIKQBGGBN-WQKFDGFASA-N 429.630 4.330 10 10 IICE Cc1cc(C(=O)Cn2c(-c3cccnc3)noc2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 1559368807 MFPLUQUWFWHHNL-UHFFFAOYSA-N 430.508 4.486 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2nsc3ccccc23)NC(=O)OC(C)(C)C)cc1 1565884405 QNJYUDYHJULTAO-GOSISDBHSA-N 440.569 4.358 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC(C)CC3)n2CCCSc2nccs2)n1 1612491450 NXXPCNJNJZEZED-UHFFFAOYSA-N 431.635 4.015 10 10 IICE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C(=O)c1ccc(N=NC(N)=O)cc1 1618753043 NIWUFEBCSHJDJN-UHFFFAOYSA-N 439.516 4.406 10 10 IICE Cc1n[nH]cc1C1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1627359430 XIGXTQSJSOQIMP-UHFFFAOYSA-N 442.361 4.303 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](N3CCC3)[C@H](F)C2)c(C)n1-c1ccc(Br)cc1 1635745759 QUJBNIZZSDETHY-WOJBJXKFSA-N 434.353 4.115 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1 1644866052 SYDVKPNSJKUKRM-UHFFFAOYSA-N 431.492 4.242 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](C(=O)NCc2cccc(Cl)c2O)(c2ccccc2)C1 1648609204 UARIMPWGYCUQBC-QHCPKHFHSA-N 430.932 4.241 10 10 IICE COC1CCN(c2ccc(CN3C[C@@]4(C)CN(C(=O)OC(C)(C)C)C[C@@]4(C)C3)cc2)CC1 1654405194 GBQFDECFOZBUPP-WMPKNSHKSA-N 443.632 4.381 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCc3c(Cl)cc(Cl)cc3C2)N(C)C)cc1 1685608554 CZIMNLTWBXZRIJ-OAQYLSRUSA-N 435.399 4.430 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCOCC2CCOCC2)o1 1707346130 SXRQEFBSHSDZDF-UHFFFAOYSA-N 440.544 4.022 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1726463566 KBXHYXRHTTYOOE-OYRHEFFESA-N 448.615 4.440 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726968155 RQMJHYUDVOLCIA-VQTJNVASSA-N 425.621 4.285 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1cnc(C)s1 1727002861 NQVIEDYDWUAGRG-OAHLLOKOSA-N 444.580 4.079 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1727690329 WMSWQIJHPLSPQH-NQIIRXRSSA-N 448.615 4.456 10 10 IICE CC(C)Cc1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1741449808 OQFGWUCWUUWLOO-UHFFFAOYSA-N 439.648 4.360 10 10 IICE CCCCN(CC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764082648 DYGWMTRSMLKDPX-UHFFFAOYSA-N 427.637 4.459 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)C(C)(C)C1 1767787397 ACZFYVDTZFHCDM-GOSISDBHSA-N 448.615 4.361 10 10 IICE CCCOc1cccc(CNCCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1860714656 OWUIGPVDBRJVAR-UHFFFAOYSA-N 442.515 4.369 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)[C@H](C)C(=O)NC2CCCC2)sc2c1CC[C@H](C)C2 1866236150 DFOXYRBDPSRGDV-SOUVJXGZSA-N 434.602 4.319 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2(NCc3c(O)cccc3Br)CC2)C1 1967775691 NFOJSPCGQSSVSQ-CQSZACIVSA-N 425.367 4.424 10 10 IICE NCc1cc(F)c(N2CCN(Cc3ccccc3)CC(F)(F)C2)cc1Br 2093139196 ANDIGCLFOGPPEI-UHFFFAOYSA-N 428.296 4.004 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NCc2cc(Br)ccc2O)C12CCC2 2118417015 BHBGDEYKTUBNDF-PBHICJAKSA-N 425.367 4.328 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)c1O 2236051498 UHEPAXRVWRPFPB-ZIAGYGMSSA-N 443.382 4.336 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(C(C)C)C1=O 2314415033 VCSGMURXJWRESV-UHFFFAOYSA-N 430.599 4.215 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3ccc(F)cc3)nc3c(C)cccn3c2=O)SC1=S 2314507421 JTCXNXSJFGJORE-UHFFFAOYSA-N 441.509 4.155 10 10 IICE Cc1cccc(Oc2nc3c(C)cccn3c(=O)c2C=C2SC(=S)N(C)C2=O)c1C 2314509577 WNOVNUSFVXZNHX-UHFFFAOYSA-N 437.546 4.243 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccc(O)cc3)SC2=S)cc1 2314836279 CFUFYCWUFDHDMC-ZDUSSCGKSA-N 428.535 4.019 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3cccc(C(=O)O)c3)C2=O)cc1)C(=O)O 2314927658 IWTZUMOPHWLJRA-INIZCTEOSA-N 443.502 4.033 10 10 IICE O=C(c1cc2ccccc2c(CN2CC=C(c3ccccc3)CC2)c1O)N1CCOCC1 9777981 OWVJDZAESQYRGX-UHFFFAOYSA-N 428.532 4.307 10 10 IICE COc1cccc(C(=O)COC(=O)c2ccc3c(c2Cl)C(=O)c2ccccc2C3=O)c1 10732302 URXHOTLEQSPEHT-UHFFFAOYSA-N 434.831 4.164 10 10 IICE O=C(O)COc1ccc(/C=C2/SC(=S)N(CCc3ccccc3)C2=O)cc1Cl 33313538 KCYBHGZVYYZHJY-GZTJUZNOSA-N 433.938 4.247 10 10 IICE CCCN1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccc(C)cn3c2=O)SC1=S 33459291 XSPVNIUILPEKQV-ATVHPVEESA-N 442.610 4.359 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)c3ccc(C)cc3C)c3ccco3)CC2)cc1 38598102 FGQZBLKCHIDQJC-XMMPIXPASA-N 433.552 4.198 10 10 IICE COc1cc(/C=C2/SC(=S)N(CNc3ccc(C)cc3)C2=O)cc(OC)c1OC 59382177 JUZUXAMNYQZECN-WOJGMQOQSA-N 430.551 4.292 10 10 IICE CC[C@@H](C)N1C(=O)/C(=C\c2cc3cc(C)ccc3nc2N2CCOCC2)SC1=S 208279775 FCWKYZIWHVLXCT-DQPIFXJKSA-N 427.595 4.380 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2)N1CCOCC1 226715526 UVHIHJSTROXJTD-XQBPLPMBSA-N 430.957 4.187 10 10 IICE COc1cccc(CNc2ccc(I)c(Br)c2)c1O 381733655 NBJJWNKUYSUOFK-UHFFFAOYSA-N 434.071 4.380 10 10 IICE Nc1ccc(-n2ccc(C(=O)NCCCN(Cc3ccccc3)Cc3ccccc3)n2)cc1 390588449 ROGYYDXWYSGSTN-UHFFFAOYSA-N 439.563 4.277 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H](CCc3noc(C4CCOCC4)n3)C2)cc1 675023421 FBQLEJBMEPFETF-HXUWFJFHSA-N 448.567 4.466 10 10 IICE Cc1cc(C(=O)COC(=O)c2csc(C(C)C)n2)c(C)n1-c1ccc2c(c1)OCO2 726687666 GMDIZNIPOHLJAH-UHFFFAOYSA-N 426.494 4.442 10 10 IICE CC1CCN(c2ccc(CNC(=O)N3CCC(NC(=O)CC4CCCC4)CC3)cc2)CC1 731364349 MAIYEZJKZYBVPU-UHFFFAOYSA-N 440.632 4.293 10 10 IICE CCOCc1cc(CNC2CCN(C(=O)c3ccc(OCC)cc3)CC2)ccc1OC 747854562 OLWBZYXGLXIHDV-UHFFFAOYSA-N 426.557 4.025 10 10 IICE C[C@H]1C/C(=C/c2ccc(N(C)C)cc2)c2nc3ccccc3c(C(=O)N3CC(CO)C3)c2C1 773957536 VEFORKKRLPZRES-SBGXLDQMSA-N 441.575 4.488 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cccc(Br)n2)C1 805985922 KHQNAIZAOMNRFR-UHFFFAOYSA-N 442.357 4.309 10 10 IICE CN(c1ccc(CNC(=O)[C@@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1)C1CCCCC1 810244684 WZSMZBKAEMSBFZ-NRFANRHFSA-N 433.568 4.277 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC(C(=O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])c1 917077825 UIPXQEZVENVDLP-CLTKARDFSA-N 430.407 4.159 10 10 IICE Cc1cc(C(=O)CSc2nnc(N3CCCC3)s2)c(C)n1-c1ccc2c(c1)OCO2 919675423 DGBDIAXBLUWZMJ-UHFFFAOYSA-N 442.566 4.250 10 10 IICE CCN1C(=O)C(=C/C=C/C=C/C=C2/Sc3ccccc3N2CC)C(=O)N(CC)C1=S 1082889415 WKJXXHUWIYDRSU-KLEOUXGUSA-N 439.606 4.494 10 10 IICE Cc1cc(C=c2sc3nc4ccccc4n3c2=O)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 1084332214 NMIJTFBUVBZUFF-UHFFFAOYSA-N 449.919 4.216 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H](N2CCOCC2)C(F)(F)F)cc1 1128694352 UJCQXEMOCDTFSH-HXUWFJFHSA-N 449.477 4.161 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCCSc3ccc(Cl)cc3)cc2)CC1 1133847899 VHOUSLUUGVOYCS-UHFFFAOYSA-N 446.016 4.230 10 10 IICE CCOc1ccc(C[C@@H](CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)C(=O)OC)cc1 1142335223 ALXMNMJKWRGDEU-QHCPKHFHSA-N 448.563 4.183 10 10 IICE C[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(I)cc1 1150386527 JWGIIMHWNLOOAF-CYBMUJFWSA-N 435.305 4.296 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(C)c1NC(=O)c1ccncc1 1162108670 SQTMSJILUUCWTI-IBGZPJMESA-N 430.552 4.378 10 10 IICE CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H](C)c1cccc(OC)c1 1167131069 KQCLMSABVMFMMZ-KRWDZBQOSA-N 442.515 4.492 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4sc([N+](=O)[O-])cc4c3=O)c2C)cc1F 1189300725 VQOPDVNMUQLOJZ-UHFFFAOYSA-N 440.456 4.104 10 10 IICE CCN(C(=O)CNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)c1ccccc1 1227209447 VABJHKGPFAMARU-GOSISDBHSA-N 442.991 4.429 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(Cl)n1 1289850639 GXJYONIQYDANIK-XNTDXEJSSA-N 435.933 4.413 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3c(C)[nH]c4ccc(Cl)cc34)CC2)cc1 1290317001 DDBXVUDOUWAVKT-UHFFFAOYSA-N 440.975 4.080 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(CC(C)C)C(C)C)n1Cc1ccc(N(C)C)cc1C 1302267920 UDWAHWPOPOMJSM-GMAHTHKFSA-N 443.636 4.296 10 10 IICE CS[C@@H](C)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1302569521 QECADFHSWLJPHE-IBGZPJMESA-N 443.661 4.235 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCC23CCOCC3)c(C)n1-c1ccc(Br)cn1 1302581364 BYNCLLTYTSECBO-MRXNPFEDSA-N 432.362 4.188 10 10 IICE CCn1cc(CC(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nn1 1306450035 ICHXCXLDACRLCE-LJQANCHMSA-N 431.462 4.152 10 10 IICE Cc1cc(CNC(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1313132802 KWPIUSOTZHPCIG-FQEVSTJZSA-N 426.561 4.293 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3ccc(OC(F)F)cc3)cc2F)C[C@@H](C)O1 1355129987 KHDXWJPUFBQYIZ-XWYPRVOQSA-N 448.485 4.461 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H]3C)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1361049729 OBEGATMFQZWEKB-GOSISDBHSA-N 434.588 4.256 10 10 IICE Cc1cc(CNC(=O)[C@@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1454622751 CUVWANBOUPKNPJ-NQIIRXRSSA-N 441.572 4.471 10 10 IICE COc1cccc(OC(F)(F)F)c1C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 1464450321 BACZPBUXOYMFND-UHFFFAOYSA-N 449.473 4.378 10 10 IICE CN(c1ccc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1)C1CCCCC1 1464538403 OMKUAPJLXPQVCX-UHFFFAOYSA-N 433.512 4.479 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(c2cccc(Cl)c2)CC1 1470905438 NYMBJGLIQMWJSM-UHFFFAOYSA-N 427.976 4.390 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccn2)cc1F 1503394928 UIVXLQDVHUPEKH-UHFFFAOYSA-N 436.560 4.215 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Oc2cc([S@](C)=O)c(C)cc2OC)CCCC1 1526114595 UUDZFAAOGCMKDX-HKBQPEDESA-N 441.549 4.189 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc3c(c2)nc(Cc2cccs2)n3C)cc1 1530904667 JHSGHAFEDLOISS-UHFFFAOYSA-N 448.592 4.443 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(CN4CCCCC4)c3)cc2F)C[C@H](C)O1 1542112860 HDNKCISQISXZBH-PMACEKPBSA-N 439.575 4.355 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2c2ccccc2)c(C)n1-c1ccc(Br)cn1 1544742297 DFLLMRLFDCERIV-FQEVSTJZSA-N 440.341 4.465 10 10 IICE COc1ccc(N2CCN(c3ncncc3-c3ccc(Br)cc3)CC2)cc1F 1559135936 CGQXKPKYKGXYHA-UHFFFAOYSA-N 443.320 4.380 10 10 IICE Cc1ccc(O)c(CNC(=O)NC[C@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)c1 1564736220 PSXPFNZCQIHDAI-FQEVSTJZSA-N 425.529 4.034 10 10 IICE CCCc1ccc(N2C[C@H](C(=O)NCc3ccc(N(CC)CC)c(F)c3)CC2=O)cc1 1565687878 BDNYJRKEPKRYEH-HXUWFJFHSA-N 425.548 4.294 10 10 IICE CN(CCCOc1ccccc1CNC(=O)c1ccc(N=NC(N)=O)cc1)C1CCCC1 1566169428 PIJJYWGZSMWYNG-UHFFFAOYSA-N 437.544 4.422 10 10 IICE Cc1ccc(C(=O)N[C@H](Cc2ccccn2)c2ccc(Br)cc2)c(O)c1O 1567809006 KWBJYMSBRNHNEU-GOSISDBHSA-N 427.298 4.278 10 10 IICE COc1ccc(CNC(=O)Cc2csc(-c3sccc3Br)n2)c(O)c1 1568099889 DCHCCEBICFRYAO-UHFFFAOYSA-N 439.356 4.207 10 10 IICE Cc1c(CN(C)c2nnc(-c3ccccc3)n2CCCSc2nccs2)cnn1C 1611864921 ROWFTHGZACODAJ-UHFFFAOYSA-N 439.614 4.262 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1C[C@@H](C)S[C@H](C)C1 1611963142 IPRXRJGEFQVABF-OPYAIIAOSA-N 429.634 4.273 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CCCC4)n3CC(F)(F)F)CC2)cc1 1619301442 KZWJSRJMANLJCA-UHFFFAOYSA-N 437.510 4.298 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN([C@H](C)c3ccccc3F)C2=O)c(C)n1-c1ccccn1 1624785427 XGXLYCYBLOUBIL-VGOFRKELSA-N 434.515 4.110 10 10 IICE Cc1ccccc1C(=O)NC1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CC1 1625641832 KZPFZIQOKHMQMV-UHFFFAOYSA-N 443.547 4.250 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2oc3ccccc3c2Br)N(C)C)cc1 1627465314 ZAPOEBYDTUUOLS-QGZVFWFLSA-N 430.346 4.294 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3Cc4cc(Br)ccc4O3)cc2)CC1 1628608972 RQTZZBQDDBKYJJ-OAQYLSRUSA-N 429.358 4.305 10 10 IICE CSc1ccc([C@@H](CNC(=O)c2cccc(O)c2O)N2CCc3sccc3C2)cc1 1630139295 XYQURCRFLJYNJT-LJQANCHMSA-N 440.590 4.411 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3nc(C4CCCC4)cs3)cc2F)C[C@@H](C)O1 1630555947 SLSPGSITDOZOLK-HZPDHXFCSA-N 431.577 4.412 10 10 IICE COCCN(CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1)C(=O)OC(C)(C)C 1631531020 DWGNMSPRISOGFY-LJQANCHMSA-N 442.556 4.366 10 10 IICE CCOC(=O)[C@]1(C(C)C)CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1637410503 ODDKVIOSRGBQHC-RUZDIDTESA-N 425.573 4.257 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cc(Br)c(Br)[nH]1 1638305948 RNVHTKADVBIMNC-UHFFFAOYSA-N 442.922 4.482 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H]3CC[C@H]2[C@H](C)[C@H](O)C3)sc(C)c1-c1ccccc1 1644016031 YEYPQQIHVLCXHA-UDTPNQRGSA-N 442.581 4.072 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H]2CCOC2)c(C)n1-c1ccc(Br)cc1 1645743116 GZFWFGNUTQHPJR-PXNSSMCTSA-N 447.373 4.124 10 10 IICE C[C@H](NC(=O)[C@H](NCC(F)(F)F)c1cc(Br)cs1)c1ccccc1O 1648894320 KZECJNVFEKCEAP-LKFCYVNXSA-N 437.281 4.287 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)Nc4cc(C)ccc4S3(=O)=O)c2C)c1 1652142472 QDANWAWEHLNZJY-UHFFFAOYSA-N 437.521 4.130 10 10 IICE COc1ccc(N(Cc2ccc(C(C)C)cc2)Cc2nnnn2CC2CCOCC2)cc1 1653738069 LEQLGVXMSLFIJY-UHFFFAOYSA-N 435.572 4.439 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](C)NC(=O)OC(C)(C)C 1682101860 VXJMHLFPRGTQBT-IPJJNNNSSA-N 446.636 4.469 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC[C@H](Cc1ccccc1)c1ccccn1 1684805625 UHGLLALGMDROQM-DEOSSOPVSA-N 444.579 4.086 10 10 IICE CCC[C@@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1709558850 BACVALZBGZSVHD-JOCHJYFZSA-N 443.661 4.083 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3cccc(OC)c3)n2CCCSc2nccs2)C1 1712260622 YLXRGUDUHRZSRD-MRXNPFEDSA-N 445.614 4.065 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nccn1C(F)F 1723270029 JKJWQNLCSMSKDS-UHFFFAOYSA-N 443.546 4.353 10 10 IICE CC[C@@H](C)c1nnc(N2CCc3c(ccnc3N(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1726956429 KUSAUDOJEMCQLR-GOSISDBHSA-N 447.631 4.238 10 10 IICE CC[C@@H]1CCCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)c(F)c2)C1 1727733535 UFWPTNUQDHWISW-LJQANCHMSA-N 439.583 4.020 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccco1)OC 1749323446 HLUKHNDYOLJCTP-QFIPXVFZSA-N 449.555 4.243 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(SC)CC1 1763712763 XIARBXMKUAAEAA-GOSISDBHSA-N 429.634 4.413 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@H]1OC 1764228103 HFVZHUQHYXKYMO-NFBKMPQASA-N 437.588 4.250 10 10 IICE CCOCc1nnc(N2CC[C@](C)(CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1766291065 NWGMASVVOITRJK-QHCPKHFHSA-N 429.634 4.043 10 10 IICE O=C(O)Cc1sc(NS(=O)(=O)c2ccc3c(c2)CCCC3)nc1-c1cccs1 1858003935 BVJSFWHTIRWMFE-UHFFFAOYSA-N 434.564 4.178 10 10 IICE CN1CCN(c2ccc(N3C(=O)/C(=C\c4ccc(F)c(F)c4)SC3=S)cc2)CC1 1860085270 AEQXJQFFTVDROC-CPNJWEJPSA-N 431.533 4.122 10 10 IICE COc1cc(C)c(C)cc1S(=O)(=O)Nc1sc2c(c1C(=O)NC(C)C)CCCC2 1871342729 BYEUGDHXHZFFDV-UHFFFAOYSA-N 436.599 4.191 10 10 IICE C[C@@]1(NCc2cc(Br)ccc2O)CCCN(C(=O)OCc2ccccc2)C1 1940888009 PSKYVYRUSCQBHP-OAQYLSRUSA-N 433.346 4.436 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C(C)C)c(C=O)c1I 2079997837 IPKDDALGBXTIBS-CQSZACIVSA-N 428.270 4.137 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(F)C[C@@H](CNCc2cc(Br)cc(F)c2O)C1 2111961044 HBDFZPIHUDTZJU-MXXVBZNESA-N 435.309 4.026 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3c(O)cccc3Br)C[C@@]2(C)C1 2116279454 XGLAPVBLPPHLJB-YRVVQQKDSA-N 425.367 4.280 10 10 IICE Cc1cccc(COc2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)cc2)c1 2293682646 XKSYKLLLQQONBR-UHFFFAOYSA-N 430.435 4.380 10 10 IICE CCN1C(=O)C(=Cc2cc(OC)ccc2OCCOc2ccc(OC)cc2)SC1=S 2297358826 UFEIYXJNWDYDFG-UHFFFAOYSA-N 445.562 4.383 10 10 IICE CCCCCCN1C(=O)C(=C2SC(=S)N(CC(=O)OC(C)C)C2=O)c2ccccc21 2297465525 UHOGSPRSMYMWER-UHFFFAOYSA-N 446.594 4.137 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)C2=Cc2ccc(O)c(OC)c2)cc1 2332134800 LOLHJNMKXXWROI-UHFFFAOYSA-N 432.451 4.379 10 10 IICE CC[C@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCCN1C(=O)OC(C)(C)C 2381133934 VHGYHMFWOFMQOY-HXUWFJFHSA-N 441.366 4.259 10 10 IICE CC(C)(C)c1ccc(/C=C2/SC(=S)N(CCC(=O)NCc3ccco3)C2=O)cc1 102860920 MCYBODDICQUAPJ-QGOAFFKASA-N 428.579 4.485 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C\c3c(C)nn(-c4ccccc4)c3C)CC2)cc1 209668796 CGJXTRLXBIRMIV-PFONDFGASA-N 430.552 4.250 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1 471298578 QUWRIFXXLJKOFO-HSZRJFAPSA-N 444.623 4.046 10 10 IICE C[C@@H]1[C@@H](NCc2cccc(Br)c2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709348205 VLYXEYUQGHTRQE-QIJZBDPFSA-N 425.367 4.421 10 10 IICE CC(C)c1noc2ncc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc12 742806611 SGQMNPJFBOKEBW-OAHLLOKOSA-N 430.455 4.346 10 10 IICE Cc1nc(-c2cccc(NC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)no1 743125874 NHBWHGATYIXZBD-QGZVFWFLSA-N 443.454 4.437 10 10 IICE COC(=O)/C=C\c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)cc1 747857449 NDAWFQIQFIEHRN-XGICHPGQSA-N 432.498 4.245 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C)c1 750391975 OWKLOCHOYJMAFH-LADGPHEKSA-N 448.567 4.338 10 10 IICE C/C(=C\C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc([N+](=O)[O-])cc1 783965678 JLITXVFCXYOVOB-CCEZHUSRSA-N 431.439 4.385 10 10 IICE CCOC(=O)c1oc2ccc(S(=O)(=O)Nc3nc(-c4ccccn4)cs3)cc2c1C 788841450 KBWOBLBGSCXOSB-UHFFFAOYSA-N 443.506 4.237 10 10 IICE CC(=O)C(=O)CSc1nnc(COc2ccccc2F)n1[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 808010275 RDSMVRYBQAQVSC-IWCQGFGOSA-N 431.533 4.244 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc(OC)c1OC 1083981570 HBTLVRIHKSUOKS-CXUHLZMHSA-N 432.479 4.026 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)cc1 1142061844 NCSOWNVMFHCROF-UHFFFAOYSA-N 439.515 4.298 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cc(Br)cc(F)c1O 1142197427 IOERCGBLBFNLPK-UHFFFAOYSA-N 448.336 4.078 10 10 IICE Cc1ccccc1C1(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCC1 1144716065 WILOPQTVPAUHJK-UHFFFAOYSA-N 442.562 4.372 10 10 IICE O=C(CN1CCC[C@H]1CCC1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 1168174975 KOTJCFIEGPEDTP-QFIPXVFZSA-N 431.596 4.103 10 10 IICE Cc1cc(CNC(=O)N[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c(C)n1-c1ccccc1 1234335214 AXCRELDJYGYHRW-VXKWHMMOSA-N 445.485 4.428 10 10 IICE COc1cccc(C[C@H](C)CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1266258947 LVWVDQWEQMTGMU-NRFANRHFSA-N 435.612 4.112 10 10 IICE Cc1c(Br)c(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)nn1C 1270438819 CGZZCJOQAGWNLI-LBPRGKRZSA-N 439.785 4.311 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1291102789 SRMSVABIZBFTTN-LJQANCHMSA-N 434.588 4.193 10 10 IICE CCOC(=O)Cc1c(C(=O)NCc2ccc(N(CC)CC)c(F)c2)[nH]c2ccccc12 1293225121 MVIIZGVFRPHYBV-UHFFFAOYSA-N 425.504 4.189 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1O 1293283218 PIMXPIMKEAYIOO-UHFFFAOYSA-N 439.462 4.227 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC[C@H](C(F)(F)F)O2)c(C)n1-c1ccc(Br)cn1 1303441552 DGOLDMHGHMVCFJ-DZGCQCFKSA-N 446.267 4.091 10 10 IICE CCO[C@@H]1C[C@](NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)(C(=O)OC)C1(C)C 1326016307 NUWRGOVXNPDFOH-XXBNENTESA-N 432.948 4.224 10 10 IICE C[C@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)F)c1ccc(N2CCOCC2)cc1 1351696670 ODNIKBPEFHLVNR-INIZCTEOSA-N 426.467 4.138 10 10 IICE Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1357835140 CXWXTHUQMYFKNE-IYBDPMFKSA-N 429.492 4.203 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CSc2ccccc21 1360898201 WMFORTDBMABYEU-GYXHFJGISA-N 444.578 4.380 10 10 IICE C=CC(=O)N1CCC(C(=O)N(C)Cc2ccc(N(CC)CC)cc2)(c2ccccc2)CC1 1440675515 SENGOEVGICRAGV-UHFFFAOYSA-N 433.596 4.238 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccccc3N3CCN(C)CC3)c2C)c1 1443775720 QSADOMVHSOCGRT-UHFFFAOYSA-N 430.596 4.393 10 10 IICE O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1464697951 SVMANEDSQUUZSV-UHFFFAOYSA-N 439.846 4.177 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1c(Cl)cccc1C(F)(F)F 1465394781 ACQBEFJIMKGVPP-UHFFFAOYSA-N 426.866 4.498 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC1CC(OCc2ccccc2)C1 1469710590 XBSSDNXDVUSDBC-UHFFFAOYSA-N 433.346 4.434 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccc(F)cc3)C3CCOCC3)C2)cc1 1470593383 LPVQZCFPFNORPQ-HXUWFJFHSA-N 441.547 4.051 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O 1478591115 VVQYIGYOCVOBLQ-IBGZPJMESA-N 449.382 4.396 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1504963865 ODXLOQKEQBIJFC-ROUUACIJSA-N 447.599 4.128 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCCC(F)(F)CC1 1529019350 KBQIGBSPEBMWFN-OWBHPGMISA-N 430.567 4.377 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCNC(=O)[C@@H]2c2ccccc2)cc1 1529584414 TWWFENXXVPROIE-QHCPKHFHSA-N 427.508 4.481 10 10 IICE Cc1ccc(C(=O)N2CCCN(C(=O)CC3CCCC3)CC2)cc1-n1c(C)cc(C=O)c1C 1543032381 FKIDWLSMCDFVAQ-UHFFFAOYSA-N 449.595 4.470 10 10 IICE CCc1nnc(N2CCCO[C@@H](c3ccccc3)C2)n1CCCSc1nccs1 1546518812 OJDLXALSSQKZLJ-GOSISDBHSA-N 429.615 4.447 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)C2CC2)cc1 1564590600 WSRMHYQFDPNUFO-OALUTQOASA-N 430.593 4.263 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1 1565126876 FHTHEGQHWHZQPU-PKTZIBPZSA-N 443.975 4.021 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4c(cc3Cl)NC(=O)CO4)cc2Cl)C1 1568142313 REINFEJTKBVSPA-CYBMUJFWSA-N 448.350 4.491 10 10 IICE Cc1ccc(C(=O)NCc2ccccc2Cn2ccnc2)cc1-n1c(C)cc(C=O)c1C 1570075789 WBMUTNGHTVQXIJ-UHFFFAOYSA-N 426.520 4.390 10 10 IICE C[C@H]1CN(C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)c2ccc(Br)cc2O1 1587043720 MMQMTLBXMSLNJG-WFASDCNBSA-N 437.334 4.177 10 10 IICE COCc1nc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)sc1C(=O)OC 1587212157 XPXGOJZQRFFDKG-UHFFFAOYSA-N 447.944 4.318 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2ccc(F)cc2F)c2nccn2C)c1 1603532506 CPYAYCLIRFRFKZ-QHCPKHFHSA-N 448.473 4.438 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)N1CCCC1=O 1613340454 GUHCQBUTUBSDSA-UHFFFAOYSA-N 436.375 4.210 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CCO)c2ccccc2)sc(C)c1-c1ccccc1 1616007341 QMIUCMPIERUTET-UHFFFAOYSA-N 438.549 4.338 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2nc3ccccc3s2)NC(=O)OC(C)(C)C)cc1 1618253470 NXBXXZPEWFPFMG-GOSISDBHSA-N 440.569 4.358 10 10 IICE COc1ccc(C(=O)CCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1622635307 XCBBUTWMKBVENP-HXUWFJFHSA-N 444.959 4.188 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1 1623307640 YUFCNPBXLOENPC-HXUWFJFHSA-N 438.553 4.146 10 10 IICE CCOC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1627679482 MYSJGIVCLGPCNK-MJGOQNOKSA-N 433.346 4.318 10 10 IICE CCc1cccc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1629679140 LPQTUSTTXVFHQB-QFIPXVFZSA-N 425.573 4.240 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](c2cccc(Br)c2)N2CCCC2)c1 1630366683 VWHYDSCUOPKQDG-VLIAUNLRSA-N 433.346 4.178 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)cc1 1631200575 PISYCZAPKDDWOX-VWLOTQADSA-N 434.536 4.086 10 10 IICE C[C@@H](NC(=O)N1CCC[C@@H](CC(=O)NCc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 1634434975 JTDZTRLPQDUIOB-QUCCMNQESA-N 440.563 4.081 10 10 IICE C[C@@H]1Oc2c(cccc2C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)NC1=O 1635126150 JJEPHTROOVGNER-CABCVRRESA-N 427.932 4.226 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3ccccn3)ccc2=O)c(C)n1-c1ccc(F)c(Cl)c1 1641304951 IJZBULWBKWQSAL-UHFFFAOYSA-N 436.874 4.388 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1 1643283257 NEBQMDOALDTWHB-UHFFFAOYSA-N 429.398 4.016 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)Cc2cn(-c3cccc(Br)c3)nn2)c1O 1645431579 DZINTPNMOMQTRN-UHFFFAOYSA-N 449.736 4.223 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)Nc2cccc(C(=O)N(C)C)c2)cc1 1657676495 YVRDXBGTWVOQRA-UHFFFAOYSA-N 431.536 4.085 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1ccc(Cl)cc1)C1CC1 1673472364 IWZBHWIICAJZQR-UHFFFAOYSA-N 435.902 4.329 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)Cc3ccccc3C(F)(F)F)C2)cc1 1680731169 ATZXYBQAMZPMTR-IAGOWNOFSA-N 435.490 4.471 10 10 IICE CCC(CC)(CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(F)cc1 1682972606 AMNDCJFPCQAJPO-UHFFFAOYSA-N 426.580 4.135 10 10 IICE CCN(c1nnc(-c2cnccn2)n1CCCSc1nccs1)[C@H](C)C1CCC1 1695549730 RUJGHKMGDZJUCB-OAHLLOKOSA-N 429.619 4.389 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCCC(F)(F)F)cs1 1725253574 SOKYFZMRUVTHLM-UHFFFAOYSA-N 425.480 4.318 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1747509336 TUKVPWVMXTXFAY-OXJNMPFZSA-N 435.613 4.351 10 10 IICE Cc1cc(-c2nnc(N3CCC(C(C)C)CC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1761676271 DBHXATNCRALDHA-UHFFFAOYSA-N 448.615 4.313 10 10 IICE COc1ccc(N2CCCCC2)cc1NS(=O)(=O)c1ccc(Br)s1 1858033138 FQOROJQNINWCDP-UHFFFAOYSA-N 431.377 4.310 10 10 IICE O=C1/C(=C\c2cc(Cl)ccc2O)SC(=S)N1c1ccc(N2CCOCC2)cc1 1860087897 ZBECJGFYVUVELP-LDADJPATSA-N 432.954 4.288 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3)C(=O)/C2=C/c2ccc3c(c2)OCCO3)cc1 1865672031 WKAWABVQZACSRS-PXLXIMEGSA-N 426.472 4.297 10 10 IICE COC(=O)c1c(NC(=O)Cc2ccccc2S(C)(=O)=O)sc(C)c1-c1ccccc1 1866155328 SMEKCZSQCYZIGZ-UHFFFAOYSA-N 443.546 4.095 10 10 IICE CN(C)c1ccc([C@@H](N)C2(NC(=O)OC(C)(C)C)CCN(Cc3ccccc3)CC2)cc1 2044751962 HDACZQZPVYKAEJ-HSZRJFAPSA-N 438.616 4.312 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NCc2cc(Br)cc(F)c2O)C1 2149375968 QXPFXORXDDSZMH-XGWLTEMNSA-N 443.357 4.419 10 10 IICE CC[C@]1(CNCc2c(Br)ccc(OC)c2O)CCCN1C(=O)OC(C)(C)C 2236054596 KFGDQCCHPXVOEY-HXUWFJFHSA-N 443.382 4.433 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2ccc(OCc3ccccc3)c(Br)c2)S1 2293370031 AZOZGAYIOPMQAQ-UHFFFAOYSA-N 431.311 4.135 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)ccc1OCCC(=O)O 2314933927 FHCYSJFLJWXLRI-UHFFFAOYSA-N 447.509 4.484 10 10 IICE O=C1C(=Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C(c2ccccc2)=NN1Cc1ccccc1 2332141249 MSVBZCZBVZFPGT-UHFFFAOYSA-N 441.443 4.196 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2ccc(F)cc2)c1C 1053685 LVPSZOMDFNQDOC-UKKLRFBMSA-N 438.499 4.085 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(C[C@H](O)CN2CCCCC2)c2ccccc12 13541056 WAJAAXUKXQAYFT-TXUMJUCDSA-N 442.563 4.294 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3cccc(O)c3)C2=O)ccc1OCCC(=O)O 210463823 MXYRLWIFQORQQQ-WQRHYEAKSA-N 445.518 4.050 10 10 IICE CC(=O)Nc1cccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526395961 FKVAUQRVEYWASV-QHCPKHFHSA-N 430.460 4.422 10 10 IICE Oc1c(Br)cccc1[C@H](c1ccc(OC(F)(F)F)cc1)N1CCOCC1 575290712 HINNMEFHDCNNNW-INIZCTEOSA-N 432.236 4.475 10 10 IICE COc1ccc(NC(=S)NNc2nnc(-c3ccccc3)n2-c2ccccc2)cc1F 726457309 MSSXMDYXJRYJBY-UHFFFAOYSA-N 434.500 4.396 10 10 IICE C[C@H]1Cc2ccccc2[C@H]1NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 732241459 JQWLOBZCAQHXPS-BTYIYWSLSA-N 433.474 4.275 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)N[C@H](C)Cn1cncn1 749212998 NUBLOYJLQCPERL-KUHUBIRLSA-N 446.477 4.161 10 10 IICE CC(C)N(Cc1ccccc1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 769649906 BUYWVSGNYGALQT-UHFFFAOYSA-N 430.551 4.305 10 10 IICE CCOC(=O)C1(COC)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 796566302 CYCODZJPKIUFAN-UHFFFAOYSA-N 438.528 4.332 10 10 IICE CCn1cc(C(=O)NCc2cc(Br)ccc2O)c(=O)c2cc(Cl)ccc21 804732969 GXQJRJDEZUQFBH-UHFFFAOYSA-N 435.705 4.073 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccn(Cc2ccccc2)n1 807255433 NKOUIEPAMAUDDD-UHFFFAOYSA-N 443.345 4.131 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H]1Cc1c(F)cccc1Cl 918225013 ZQZUSRHKWRRZPZ-KRWDZBQOSA-N 449.929 4.372 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C(=C/c3ccccc3)C(F)(F)F)cc2F)CC1 1125908786 ZCOJAUCQGDAGQC-RGEXLXHISA-N 435.465 4.230 10 10 IICE CC1(Nc2nc(CC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)cs2)CCCC1 1151903354 JDMDQVFDHHIZPY-IBGZPJMESA-N 429.586 4.344 10 10 IICE Cc1cc(C(=O)NCCN2CCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1177339220 ZKBPCLOWGSULCJ-UHFFFAOYSA-N 439.357 4.044 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1291516517 FJQNVOVDCBMBRT-HKUYNNGSSA-N 438.551 4.098 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCSc3ncnc4[nH]cnc34)cc2Cl)C1 1297011334 XLWAFTWEYBYKJX-CQSZACIVSA-N 444.992 4.041 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCOC[C@@H](C3CCC3)C2)nnc1C(C)(C)C 1304239915 FHSJSQWHRSGQRN-NRFANRHFSA-N 425.621 4.251 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCCOC(F)(F)F 1314750059 HIOFXLMNOJKMDG-UHFFFAOYSA-N 441.841 4.262 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CC[C@@H](C)C2 1349304822 JYFYWNXNIMDIEL-ZIAGYGMSSA-N 444.528 4.180 10 10 IICE Cc1cc(F)ccc1-n1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)nn1 1358434224 VKKRYRGYNCJJKP-UHFFFAOYSA-N 433.487 4.216 10 10 IICE CCOC(=O)[C@H](CCCC(C)C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1439190078 IRBMBUVXXDPFTR-QFIPXVFZSA-N 441.616 4.282 10 10 IICE CN(C)c1ccc(CNC(=O)c2nn(-c3ccc(Cl)cc3C(F)(F)F)cc2O)cc1 1440647062 OZLWVNZXEZQVFD-UHFFFAOYSA-N 438.837 4.246 10 10 IICE C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCc3ccc4cccnc4c3O)cc2[N+](=O)[O-])C1 1451943166 HSTHIJGVNRNUIF-HOTGVXAUSA-N 434.496 4.261 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3cn(C)nn3)C2)c(C)n1-c1cccc(Br)c1 1457191667 VMUSLSOKBPZHTE-INIZCTEOSA-N 442.361 4.005 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)/C=C/c1cc2cnn(C(C)C)c2[nH]c1=O 1469205543 NHUITGAEHSGYOT-AQDCRGGLSA-N 434.540 4.189 10 10 IICE Cc1ccc(O)c(CNC(=O)NCc2ccc(Br)c(Br)c2)c1 1479422759 GWGLIXQPAAJLHX-UHFFFAOYSA-N 428.124 4.225 10 10 IICE CC(C)N(Cc1ccccn1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1527616715 INNJHKDEQDXGBO-CPNJWEJPSA-N 443.569 4.249 10 10 IICE Cc1cc(CNC(=O)c2cncc(I)c2)c(C)n1-c1ccccc1 1531612789 WKUZXHGMRYOFTP-UHFFFAOYSA-N 431.277 4.024 10 10 IICE CN(CCOc1ccccc1C(=O)NCc1ccc(N(C)C)c(F)c1)C(=O)OC(C)(C)C 1535619304 MJQUTMIKCVRALM-UHFFFAOYSA-N 445.535 4.067 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)/C=C\[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1540567476 NKPWFIIUPYVZIB-QKQONQEDSA-N 427.589 4.449 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2CCn2cncn2)c(C)n1-c1ccccc1 1542181003 HHVXRJCRXLLIKW-UHFFFAOYSA-N 432.576 4.127 10 10 IICE CCCS(=O)(=O)Nc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1542268346 SHNGNWUXWLVSLP-UHFFFAOYSA-N 439.537 4.311 10 10 IICE O=C(COc1ccc(OCc2ccccc2)cc1)NCc1cccc(Br)c1O 1556480311 LXIUKAOPDNNHFB-UHFFFAOYSA-N 442.309 4.429 10 10 IICE Cc1ccc(C(=O)N2CCN(c3c(F)cccc3F)CC2)cc1-n1c(C)cc(C=O)c1C 1557186107 ZRBPBSVXCDDEMV-UHFFFAOYSA-N 437.490 4.456 10 10 IICE CCOC(=O)[C@@H](Cc1cc(Cl)cc(Cl)c1)NCc1ccc(N2CCOCC2)cc1 1560053476 XZLMDYICIGVEGA-OAQYLSRUSA-N 437.367 4.094 10 10 IICE COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1565162085 LJJGHJJBTDATPH-MHZLTWQESA-N 445.563 4.163 10 10 IICE COC(=O)CN(C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C1CCCCC1 1584018565 QCRUYYAPCOGCEL-UHFFFAOYSA-N 448.361 4.200 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1OCc1ccccc1 1585536134 RVRNWTOVYVTNBQ-UHFFFAOYSA-N 446.547 4.165 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC([C@@H]3CCCO3)CC2)nnc1C(C)(C)C 1611963815 BMBNGDHUOIMTGN-QFIPXVFZSA-N 425.621 4.394 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613195443 AUUBPKMLJFLKGS-AQNXPRMDSA-N 425.621 4.141 10 10 IICE C[C@]1(CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1(F)F 1618062405 NOVLCKNZCNGUNE-RTGRKSDTSA-N 430.567 4.281 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc(Cn3cncn3)c2)cc1 1628566324 ZWDNSZPQJKKTFD-UHFFFAOYSA-N 441.535 4.248 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)c1 1629048792 MBWXSGJRWVCGHG-QFIPXVFZSA-N 445.519 4.068 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3CCCN3Cc3ccc(Cl)cc3)CC2)cc1 1630718259 SOWWNDGYYJYGSQ-QHCPKHFHSA-N 427.976 4.052 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(OC(F)(F)F)c(Cl)c3)CC2)cc1F 1631377178 LIVUVDHRCSPIKO-UHFFFAOYSA-N 432.801 4.349 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)N3CCN(c4ccc(OCC)cc4)CC3)CC2=O)cc1 1632153543 CCQILWPILPERBG-QFIPXVFZSA-N 449.595 4.130 10 10 IICE CC(C)n1cnc(-c2ccc(Cl)cc2)c1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1635503733 OWHBFNRRXFKOGI-UHFFFAOYSA-N 448.932 4.114 10 10 IICE C[C@@H](NC(=O)COc1ccc(CCCNC(=O)OC(C)(C)C)cc1)c1ccccc1O 1635799318 YLQLZVWLICOGFG-QGZVFWFLSA-N 428.529 4.106 10 10 IICE Cc1cc(C(=O)NCc2nn(C)cc2C(F)F)c(C)n1-c1ccccc1Br 1635906136 YPBRXTKXWMLDEO-UHFFFAOYSA-N 437.288 4.458 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3ccccn3)nc3ccccc23)N(C)C)cc1 1637004478 BZEIKJBBIZFHKJ-SANMLTNESA-N 439.563 4.396 10 10 IICE COCc1ccc([C@H]2COCCN2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)o1 1637410474 NADXNGCJUNHJGK-HSZRJFAPSA-N 437.540 4.159 10 10 IICE Cc1cc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(C)n1-c1ccc(Cl)cc1 1638379588 HGSJCBXNIQYKHA-QHCPKHFHSA-N 437.971 4.244 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CN(Cc4ccc(C)cc4)CCO3)c2C)cc1 1648932950 XIQHCNDVSHMZRI-VWLOTQADSA-N 447.579 4.042 10 10 IICE CN(C)c1ccc([C@@H](CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 1651821697 GUDZBFRLGBWSKC-MRXNPFEDSA-N 445.476 4.247 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)c4cccc(Cl)c4S3(=O)=O)c2C)c1 1651974263 RBOQWKDQYORJCH-UHFFFAOYSA-N 442.924 4.083 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3CC3CCCC3)cc2F)C[C@@H](C)O1 1654062621 OVRIDJOYDOLJEQ-XQBPLPMBSA-N 431.596 4.100 10 10 IICE COc1ccc(N(Cc2nc(-c3cc(OC)c(OC)c(OC)c3)no2)CC2CC2)cc1 1658702121 GWNYQNGXPQMCBM-UHFFFAOYSA-N 425.485 4.188 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCCc3cccc(-c4ccccc4)c3)cc2)CC1 1674744291 MBSLSMNBHDPJRH-UHFFFAOYSA-N 428.580 4.147 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](C)c3nc(C(F)(F)F)cs3)C2)cc1 1680588821 LXHYTQNMIHSKTR-STQMWFEESA-N 428.480 4.057 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3cc(OCC(F)F)ccn3)c2C)c1 1680854499 FDWLNXARRUPGEO-UHFFFAOYSA-N 428.483 4.441 10 10 IICE CCOCc1nnc(N(C)[C@H]2CC[C@H](SCC)C2)n1Cc1ccc(N(C)C)cc1C 1696241881 MUGHMXDHXRDIHE-SFTDATJTSA-N 431.650 4.348 10 10 IICE CCc1nnc(N2CCC[C@H](c3noc(C(C)C)n3)C2)n1Cc1ccc(N(C)C)cc1C 1727576980 OWDATHBRGFJNBJ-IBGZPJMESA-N 437.592 4.154 10 10 IICE CCCN(CCc1cccs1)c1nnc(C)n1Cc1ccc(N2CCOCC2)c(F)c1 1728110996 XEBDCFGMXGOAIG-UHFFFAOYSA-N 443.592 4.131 10 10 IICE CC[C@H](C)c1nnc(N2CCN(C3CCCC3)CC2)n1CCCSc1nccs1 1743756487 FDQLDHPBYQDIAQ-KRWDZBQOSA-N 434.679 4.495 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)OCC)CC1 1745655493 KBEVYPVDTGDBCG-UHFFFAOYSA-N 436.560 4.041 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC[C@H]1CCCCO1 1760895719 OBEKLNAZWHGIJI-HSZRJFAPSA-N 441.620 4.224 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H]2CC)n1Cc1ccc2c(c1)CCCN2C 1762273496 BQHAUELIJPHWAT-OAQYLSRUSA-N 438.620 4.006 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CC(=O)N4C)c(C)s2)c(C)c1 1859572436 HURIJMWHHXGUFL-UHFFFAOYSA-N 427.551 4.055 10 10 IICE CC1(C)C[C@H](N(Cc2ccccc2)c2cc3c(cc2Br)[C@@H](O)C(=O)N3)CO1 1915453952 HTVUGSPBFIAMOR-IFXJQAMLSA-N 431.330 4.009 10 10 IICE CN(C)c1ccc([C@H](CN)N(CCCNC(=O)OC(C)(C)C)Cc2ccccc2)cc1 2018744259 PGHLNLRHVXFTCK-QHCPKHFHSA-N 426.605 4.169 10 10 IICE CCc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(Cc4ccccc4)C3=O)c2C)cc1 2297624898 CGAZXNZZDYRYJL-UHFFFAOYSA-N 427.504 4.319 10 10 IICE CCOc1c(Cl)cc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1Cl 2313558528 CVXVVYZFBLOYDP-UHFFFAOYSA-N 439.295 4.363 10 10 IICE CCC1=NN(Cc2ccc(F)cc2)C(=O)C1=Cc1cc(Br)cc(OC)c1O 2332124860 XZVSRXJQZGIMCP-UHFFFAOYSA-N 433.277 4.494 10 10 IICE Cc1ccc(CN[C@@H]2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c(O)c1Br 2352680342 PZJSPPFUSCEJCC-OWCLPIDISA-N 425.367 4.198 10 10 IICE COCCCN1C(=O)/C(=C/c2cc(C)n(-c3cccc(Cl)c3)c2C)C(C(=O)OC)=C1C 34705042 CIILMWMGZOMODV-FYJGNVAPSA-N 442.943 4.457 10 10 IICE CCCCCN1C(=O)/C(=C/c2cc3ccccc3nc2N2CCOCC2)SC1=S 40562453 DAEMXTRGAZMLIY-CYVLTUHYSA-N 427.595 4.463 10 10 IICE COc1ccc(N2CCN(c3ncnc(Oc4cc(C)cc(C)c4)c3[N+](=O)[O-])CC2)cc1 40582558 CXOUTOKUYIUPFS-UHFFFAOYSA-N 435.484 4.129 10 10 IICE CC(C)(C)N(Cc1cccc(F)c1)C(=O)CN(Cc1ccccc1O)C[C@H]1CCCO1 112599871 JAJKWNMLJDVZPV-JOCHJYFZSA-N 428.548 4.340 10 10 IICE CCOC(=O)[C@H]1CCCN([C@H]2CC(=O)N(c3ccc(/N=N\c4ccccc4)cc3)C2=O)C1 245298148 XMVWGUNIZDVFBX-BOMGHSENSA-N 434.496 4.009 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccnc(-n4cccn4)c3)no2)C1 568378808 XZTZYHKLMGWSMH-UHFFFAOYSA-N 439.523 4.087 10 10 IICE CC(C)CNC(=O)c1ccc(NC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 586691680 GGVDBCSDWJHZKK-UHFFFAOYSA-N 441.487 4.492 10 10 IICE CC(C)NC(=O)c1cccc(NC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 586699519 SWVIFILSKJFYHZ-UHFFFAOYSA-N 427.460 4.244 10 10 IICE COc1ccc(OC(C)C)c(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 730384867 FSALSCIZWKIWEW-UHFFFAOYSA-N 449.551 4.187 10 10 IICE COc1cc(Br)cc(CNC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)c1O 769420969 UWUDTKVLAFDIFK-CYBMUJFWSA-N 448.279 4.123 10 10 IICE COc1c([N+](=O)[O-])ccc(CN(CC(=O)Nc2ccccc2C(F)(F)F)C(C)C)c1O 774822707 OMZNTXZJHSJMRB-UHFFFAOYSA-N 441.406 4.177 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cnc(-c4ccc(F)c(F)c4)s3)CC2)cc1 779853901 LPGLFADMUIUAEJ-UHFFFAOYSA-N 429.492 4.449 10 10 IICE Cn1cc(-c2cc(F)ccc2NC(=O)NCc2ccc(N3CCSCC3)cc2)cn1 797670107 OHQQPPKBOXODQY-UHFFFAOYSA-N 425.533 4.101 10 10 IICE COc1cccc([C@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCCC2)c1 1135457921 BMVBOMHUINCQMV-SANMLTNESA-N 445.563 4.482 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@@H](C(=O)NCc1ccc(N(C)C)cc1)C2 1135643668 XYBHHEVISCGEKM-OAQYLSRUSA-N 427.520 4.183 10 10 IICE Cc1cc(C(=O)NCCNC(=O)c2cccs2)c(C)n1-c1ccccc1Br 1137565697 AOEVQOCNFKHSAM-UHFFFAOYSA-N 446.370 4.078 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(CCCCN2Cc2ccc(N3CCOCC3)cc2)C1 1138496054 NZIZMVAQYIQVDZ-VWLOTQADSA-N 429.605 4.279 10 10 IICE CON(C[C@@H]1CCC[C@@H](C)C1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1141631576 GWFHANJBDZDGOS-HUUCEWRRSA-N 438.571 4.084 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC(Cc2ccsc2)C1 1148780939 LYSXSXFGWYJUMQ-LICLKQGHSA-N 448.660 4.492 10 10 IICE CCc1sc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1Br 1152401396 MAHPFVSDCLTTOC-UHFFFAOYSA-N 446.750 4.247 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3CSC3=NCCS3)C2)cc1 1162718684 OHTWBQAATSUCMU-QGZVFWFLSA-N 441.622 4.288 10 10 IICE CC(=O)N1CCCCC[C@H]1C1CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251980949 DTCMUGOUYJKYOL-NLFFAJNJSA-N 442.648 4.205 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(F)c(Br)cc3F)CC2)cc1 1264733145 OYGMDCIDLTZKKX-UHFFFAOYSA-N 425.273 4.088 10 10 IICE CC(C)N1CCCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CC1 1287993396 LRCJFTKUCUFAIP-UHFFFAOYSA-N 434.679 4.495 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1OC(F)(F)F 1294859819 PGHXCINEBKJQFA-OAHLLOKOSA-N 428.838 4.339 10 10 IICE CC(C)(C)OC(=O)COc1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cc1 1355287466 IHTHEPZEKAZTRG-UHFFFAOYSA-N 444.491 4.369 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2c2ccco2)c(C)n1-c1ccc(Br)cn1 1444114874 BCSZPJUTXJAWNU-QGZVFWFLSA-N 430.302 4.058 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1 1449378446 XZNYYTVBNAXALP-UHFFFAOYSA-N 429.517 4.044 10 10 IICE CCc1nc(C(=O)NCc2ccc3cccnc3c2O)nn1-c1c(Cl)cccc1Cl 1451946194 CNPNFQQOIFIZOC-UHFFFAOYSA-N 442.306 4.320 10 10 IICE O=[N+]([O-])c1ccc(NCc2cc(F)c(N3CCOCC3)c(F)c2)nc1-c1ccccc1 1458432124 PGYYFRVTITWBBP-UHFFFAOYSA-N 426.423 4.384 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4cncn4C)CC3)cc2Cl)C1 1469958813 HKNKAVXDDYXQIF-KRWDZBQOSA-N 429.996 4.399 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](CCO)c2ccco2)sc(C)c1-c1ccccc1 1473412136 GMISSPHIKCCUBM-QGZVFWFLSA-N 442.537 4.145 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)c(C)n1-c1ccccc1 1478654605 ZCRZERJJGKSCLM-DNVJHFABSA-N 435.572 4.287 10 10 IICE CCc1nnc(N2CCC(n3cc(Cl)cn3)CC2)n1Cc1ccc(N(CC)CC)cc1 1498964232 ZZXNHDNMHZHDED-UHFFFAOYSA-N 442.011 4.426 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(COc4ccc(C)nc4)c3)C2)cc1 1537109410 OALAXGKVTWHVCJ-OAQYLSRUSA-N 431.536 4.234 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cn2ccccc2=O)c2ccccc2)c(C)n1-c1ccccc1 1538239151 YGQJKRDZKNYPQY-VWLOTQADSA-N 425.532 4.356 10 10 IICE C[C@H]1CCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C[C@H]1C 1544425879 HPTLNJDQHPGDAI-DLBZAZTESA-N 428.631 4.385 10 10 IICE CSC1(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2ccccc2O)CCN(C)CC1 1555860719 NDFCXGHBGMYNRU-UHFFFAOYSA-N 441.601 4.016 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2c(NC(=O)c3ccco3)sc3c2CCC3)c1 1566374290 BWAOAYCZWJKDQQ-LBPRGKRZSA-N 426.494 4.287 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@]3(N(C)C)COc4ccccc4C3)cc2Cl)C1 1568142217 PKSHAXZWXKTXKB-CJAUYULYSA-N 442.003 4.128 10 10 IICE C/C(=C/C(=O)N1C[C@H]2CCCCN2c2cc(Br)c(F)cc21)c1cnccn1 1583070302 HUBLYVFJZMHUCH-YLHGKKIISA-N 431.309 4.187 10 10 IICE Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595583453 JBGFBDGMRSDFFC-SFHVURJKSA-N 431.920 4.273 10 10 IICE Cc1cc(C(=O)NCc2ccccc2N(C)C)c(C)n1-c1ccc(Br)cn1 1598121685 VEZRKOCBSJXCLR-UHFFFAOYSA-N 427.346 4.248 10 10 IICE Cc1nnc(N(C)[C@@H]2CCCN(Cc3ccccc3)C2)n1CCCSc1nccs1 1612532528 WTRYFYUQGKFMGT-HXUWFJFHSA-N 442.658 4.326 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)C[C@H]2CCCO2)cc1 1615382386 VMFSERUQJLSBAW-JOCHJYFZSA-N 439.629 4.440 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H](Nc3cccc(Br)c3)C2)cc1 1618831277 SOLOJNFWFCGVSD-QGZVFWFLSA-N 430.306 4.328 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)cc1 1626107504 YAGCJHMDWYQOIF-RTWAWAEBSA-N 437.367 4.301 10 10 IICE COC(=O)c1cnc(C2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)s1 1633213731 BMNGUEISHDLUIO-UHFFFAOYSA-N 429.567 4.419 10 10 IICE Cc1cc(C(=O)NCc2ncccc2N(C)C)c(C)n1-c1ccc(Br)cc1 1636949749 YSZYBVLBEGIAGI-UHFFFAOYSA-N 427.346 4.248 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@](CO)(Cc3ccccc3)C2)c1 1637843581 JCVGHEVQZNSFAH-MHZLTWQESA-N 430.548 4.364 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(CN4CC[C@H](O)C4)cc3)c2C)c1 1641130998 NWYSHVNWAKNBRI-VWLOTQADSA-N 431.580 4.208 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c(O)cnc4ccc(Cl)cc34)cc2F)C[C@H](C)O1 1648474285 HLVJWTWIWMTZEX-KBPBESRZSA-N 443.906 4.277 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)C2=O)c(C)c1 1656399030 SYOMKJSUCKQBRZ-AREMUKBSSA-N 447.510 4.500 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)C[C@@H](O)c1cccc(Br)c1 1673745226 RKQMQXCSGORJBG-HRAATJIYSA-N 448.405 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1673745261 RRYDOWJHPBRGOP-WIYYLYMNSA-N 446.636 4.327 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@H]2CC(C)(C)Oc3ccc(F)cc32)N(C)C)cc1 1674160884 JWYGDMUDMREWSL-LEWJYISDSA-N 428.552 4.096 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC([C@H](F)c4ccccc4F)CC3)cc2)CC1 1684973402 QVDSXWPWFOHYJQ-DEOSSOPVSA-N 442.554 4.210 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@]3(CCCc4ccccc43)C2)N(C)C)cc1 1687807267 QEYHHMRMHYOXAS-VPUSJEBWSA-N 434.628 4.435 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2C[C@H](C)O[C@H](C(F)(F)F)C2)nnc1C(C)(C)C 1707305898 PSVCSCVURLCQRQ-YJBOKZPZSA-N 439.526 4.154 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](COC)C1 1727847408 IAKITSZILRBWSB-RWKBYAJOSA-N 435.572 4.170 10 10 IICE CCc1nnc(N2CCN(c3ccc(C)cc3)CC2)n1CCCSc1nccs1 1764912420 UZGZTLIBTUSFEM-UHFFFAOYSA-N 428.631 4.114 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCSC1 1765963086 VYPMQSYJZRFUCH-DEOSSOPVSA-N 439.629 4.457 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)/C(=C\c3c(C)nc4ccccn34)SC2=S)c1 1860085537 QIXCGAQUWWKZER-MHWRWJLKSA-N 443.937 4.489 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(Br)c2O)N2CCCCC2)cc1 1866247355 UWKXNJKNSQZNRI-FQEVSTJZSA-N 446.389 4.178 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc3c(c2)C(=O)N(Cc2ccc(Cl)cc2)C3=O)c1 1873894922 FFRMHOSOKFOVLN-UHFFFAOYSA-N 433.895 4.455 10 10 IICE CC[C@H](NC[C@@H]1[C@@H]2C[C@H]2CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 1906022754 DUSZTTAQKKNCFD-JSQNDZKTSA-N 425.367 4.451 10 10 IICE CN1CCc2cc([C@@H](N)C[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536537 LLTAWPQMMLZRFE-VXKWHMMOSA-N 425.573 4.179 10 10 IICE CCCN(CCNC(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044768983 MDEDKTJBUCVDOC-UHFFFAOYSA-N 448.608 4.303 10 10 IICE COc1cccc(Cn2nc(C3(C)CC3)c(C3(C)CC3)c2I)c1O 2079763655 PKOOFSAGEUEXJU-UHFFFAOYSA-N 438.309 4.353 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2cccc(Br)c2O)CC12CC2 2115366222 HVFPEJQPRZNUQI-AWEZNQCLSA-N 425.367 4.424 10 10 IICE Cc1c(NC=C2C(=O)N(c3ccccc3)N=C2c2ccccc2)c(=O)n(-c2ccccc2)n1C 2296726020 ZZKBABNHKBTLJY-UHFFFAOYSA-N 449.514 4.231 10 10 IICE CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O 2313548086 LFBYLXAXYVTZIV-UHFFFAOYSA-N 443.297 4.131 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccccc3O)SC2=S)cc1 2314831121 CUUWXURSHKUJJU-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccccc3OCCC(=O)O)SC2=S)cc1 2314931934 JKNMCOOCJPXKEI-UHFFFAOYSA-N 429.519 4.345 10 10 IICE CC(=Cc1ccccc1)C(=O)N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 2330422380 CVVKPZDRJIGUQJ-QGZVFWFLSA-N 438.483 4.009 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@@H](Cc1cccc(Br)c1)NC(=O)OC(C)(C)C 2362990615 RYQZBZBLMFJUSV-OAHLLOKOSA-N 440.342 4.044 10 10 IICE CN(C)c1ccc([C@H](O)Cc2ccc(I)c(Br)c2)cc1 2377340011 MWPDKIWEQSXACO-MRXNPFEDSA-N 446.126 4.396 10 10 IICE CC(=O)N[C@@H](CC(=O)OCC(=O)c1cc(C)n(-c2cccc(F)c2)c1C)c1ccccc1 9249710 FKSSFYGBDSJUFN-QHCPKHFHSA-N 436.483 4.227 10 10 IICE CC(=O)N1CC[C@H](NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c2ccccc21 436037307 ZFIDNPWTKWZHDO-QHCPKHFHSA-N 444.579 4.022 10 10 IICE C[C@@H](NC(=O)N1CCC(CN2CCc3ccccc32)CC1)c1ccc(N2CCOCC2)cc1 732242799 IYBFJZNPMAISHR-OAQYLSRUSA-N 448.611 4.069 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@@H]1CCOc2ccc(Br)cc21 745747705 IBZBBUPCPFDRNN-GOSISDBHSA-N 431.330 4.357 10 10 IICE CCCN(C[C@H]1CCCCO1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745905369 NOJIHGCRTWGDPI-FXAWDEMLSA-N 425.520 4.248 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2ccncn2)c(C)n1-c1cccc(Br)c1 754922837 OLFVADBWPLDBAS-SREVYHEPSA-N 440.297 4.086 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)ccc1NC(=O)c1cccs1 758159311 OVTCCLDCCCGFJR-UHFFFAOYSA-N 449.576 4.418 10 10 IICE O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2cc(Br)ccc2O)C1)C1CCCC1 779619315 KZXIQXVGBFOPTE-OAHLLOKOSA-N 447.377 4.386 10 10 IICE COc1cc(F)c(F)cc1NC(=O)C(=O)N(c1ccc(N)cc1)[C@H](C)c1ccccc1 810392907 HHYGBHWCXCBYNW-CQSZACIVSA-N 425.435 4.289 10 10 IICE Cc1nc2ccccn2c(=O)c1CCSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1 814738428 YVFVVADRRGINKB-HXUWFJFHSA-N 446.576 4.380 10 10 IICE Cc1cc(OCc2ccccc2)c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)s1 1133123615 TUQUXJCVJFVMCC-UHFFFAOYSA-N 435.593 4.317 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c(C)n1-c1cccc(C(C)C)c1 1135829010 ACMRTKRCOJBAIQ-QGZVFWFLSA-N 439.581 4.356 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@]1(c2ccccc2)CCC(=O)NC1 1137816626 MVKVIWBZMKXQPS-DCFHFQCYSA-N 428.532 4.330 10 10 IICE COc1ccc(Cn2cc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cn2)cc1 1140249020 WVJUIMTXLODQJK-UHFFFAOYSA-N 428.492 4.412 10 10 IICE C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1nc(-c2ccc(Br)cc2)no1 1150695541 NKGUWEMXKWWPHX-SNVBAGLBSA-N 443.261 4.153 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H](NC(=O)c3cc(O)cs3)c3ccccc3O2)C1 1158594024 NNABKMBNLJYUID-KSFYIVLOSA-N 430.526 4.087 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](c3cccc(C)c3)c3ccccn3)C2)cc1 1225430775 QOIGTKJSILDXHJ-NBGIEHNGSA-N 430.552 4.314 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H](CCC(=O)OC(C)(C)C)C3)C2)cc1 1230301134 RCKLPNQPDNBQPJ-PMACEKPBSA-N 445.604 4.065 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1 1230809659 SHCMNRSRGBGQJW-NQIIRXRSSA-N 433.911 4.043 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@]2(C)CC2(Br)Br)cc1 1290324416 QECOPEAHIGMMOY-INIZCTEOSA-N 432.200 4.387 10 10 IICE Cc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1-c1cnn(C)c1 1292382631 UYLZMLRCIKXTJM-XMMPIXPASA-N 432.568 4.283 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@@H](C)CNC(=O)OCC2c3ccccc3-c3ccccc32)c1 1301047420 XEVVQAVITIFCDM-SFHVURJKSA-N 444.531 4.492 10 10 IICE COc1ccc(C(=O)N[C@H](C(=O)NCc2c(O)ccc3ccccc23)c2ccccc2)cc1 1304090031 VSJUCLGIALNQLQ-VWLOTQADSA-N 440.499 4.342 10 10 IICE CC(C)(C)OC(=O)Nc1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)s1 1450709529 QZBPAIOOTYHPDW-UHFFFAOYSA-N 436.497 4.452 10 10 IICE CCc1c(C(=O)NCc2cccc(Cl)c2O)cnn1-c1ccc(Br)cc1 1457039541 WVVJHZBIQADUFB-UHFFFAOYSA-N 434.721 4.486 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](c4cccc(Br)c4)C3)C2)cc1 1470773481 PNYFGUWKCBJJMB-HKUYNNGSSA-N 444.373 4.236 10 10 IICE COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)NCc2c(O)ccc3ccccc23)cc1OC 1472086153 NYMVDSPTXFHGRJ-YOEHRIQHSA-N 434.492 4.087 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1Nc1ccc(CCN2CCOCC2)cc1 1472665073 DZYQRODEHOWRAL-UHFFFAOYSA-N 431.492 4.444 10 10 IICE Cc1cc(CCNC(=O)N(Cc2cccc(C(N)=O)c2)C2CC2)c(C)n1-c1ccccc1 1479064869 XSCGDLFEFZMPDC-UHFFFAOYSA-N 430.552 4.110 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@H]1CC[C@H](F)C1 1503474034 VJUAVGHNVHNXCX-RTWAWAEBSA-N 443.611 4.478 10 10 IICE CC/C=C\Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@]1(OCC)CCOC1 1514217009 FWQXCNSZMFTUTR-KBDOHKNDSA-N 439.604 4.133 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2cccnc2)n1CCCOC(F)F 1517122698 ZZXLETZYESKKSX-UHFFFAOYSA-N 442.514 4.206 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3(CNC(=O)OC(C)(C)C)CC3)cc2Cl)C1 1519549485 BFWLJENHAHGEBR-INIZCTEOSA-N 435.996 4.497 10 10 IICE Cc1ccc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)cc1C 1520969454 GVLPFGXTBQCIMG-LJQANCHMSA-N 447.501 4.313 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2NC(=O)OC(C)(C)C)C2CC2)cc1 1524794559 XDBVNIUSXMLKBG-HXHBTQRASA-N 427.589 4.183 10 10 IICE CCN(CC)c1nc2sc(C(=O)N(C)CCN(C)c3ccc(OC)cc3)cc2s1 1531375421 XYIFVUPXNXXELZ-UHFFFAOYSA-N 432.615 4.421 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1C[C@H](O)CC2(CCCC2)C1 1542227234 WOEBCERXUITGJQ-JOCHJYFZSA-N 425.621 4.031 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(I)c(Cl)c1 1543591975 UTLJGJUCTWOVHZ-UHFFFAOYSA-N 440.712 4.475 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(c3ccnn3C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545413652 PDVKNLATEDRXSF-QGZVFWFLSA-N 439.583 4.163 10 10 IICE CC[C@]1(C)CCN(c2nnc([C@H]3OCC[C@H]3COC)n2Cc2ccc(N(C)C)cc2C)C1 1546081676 URQHYPNOQBGQPD-UWDQQESISA-N 441.620 4.051 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)n1-c1cccc(Cl)c1 1557939828 ZQKAXKZIPFZTKG-JOCHJYFZSA-N 427.888 4.293 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cccn4ncc(Br)c34)cc2)CC1 1565663631 JLQDAMPZZLOUMR-UHFFFAOYSA-N 427.346 4.263 10 10 IICE CCOc1c(OC)cc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1OC 1583722724 CFLOPYYVBXVGPS-UHFFFAOYSA-N 436.508 4.253 10 10 IICE Cc1ncc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1596446813 KOJQNTLJZVQMQK-GPILYODUSA-N 435.571 4.059 10 10 IICE COC(=O)CCOc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1598196194 JMHWCBMGUQMLFS-UHFFFAOYSA-N 434.492 4.409 10 10 IICE CC[C@H](C)c1nnc(N(CC)C[C@@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1613191311 ONCMKLFTOJWPLE-UGKGYDQZSA-N 443.661 4.398 10 10 IICE Cc1cc(C(=O)Cn2nnnc2Cc2ccccn2)c(C)n1-c1ccc(C(C)(C)C)cc1 1613597041 WUXMWXDVIYASJP-UHFFFAOYSA-N 428.540 4.247 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3CC3CCC3)cc2F)C[C@@H](C)O1 1620441089 DCZJMXJYEKPPSQ-JQVVWYNYSA-N 431.596 4.100 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(Cc2ccc(Cl)cc2Cl)nn1 1625794896 WWKFADNONPATRB-UHFFFAOYSA-N 432.355 4.362 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnnn2-c2cc(Cl)ccc2Cl)cc1F 1627604153 AQQWXGYRXBECLY-UHFFFAOYSA-N 436.318 4.489 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2csc(-c3ccc4c(c3)OCCO4)n2)cc1F 1627604404 GYYGIKLBHIAWOF-UHFFFAOYSA-N 441.528 4.497 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CCCN(C)C(=O)OC(C)(C)C)CCCC1 1630035974 KGBSXQQWKYSUKG-UHFFFAOYSA-N 443.588 4.244 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2N(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1630262706 JZOLRPWQLNLFGD-OAHLLOKOSA-N 440.521 4.409 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)COc2ccccc2)c(C)n1-c1ccccc1Br 1631311429 QLUIAIGEFQNGIR-QGZVFWFLSA-N 443.341 4.026 10 10 IICE COc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC(C)C)c1 1631425914 SBHDMNXQXOOOEQ-SFHVURJKSA-N 432.948 4.236 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)CC2)cc1 1632044590 PTEPYOASBGTJSI-AREMUKBSSA-N 438.568 4.195 10 10 IICE COc1cc(OC)cc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1635800468 ORRJCHYCRCZVPF-QFIPXVFZSA-N 428.916 4.228 10 10 IICE COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1639551450 PDYFPAZPOLTGAM-CQSZACIVSA-N 435.427 4.372 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)NCc2ccc3cccnc3c2O)C1 1639625080 WRCLSPDIVUOFDK-UHFFFAOYSA-N 433.508 4.164 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(Br)cc(Cl)c3O)C2)cc1 1648855076 PBWHFGWOVRRBED-GFCCVEGCSA-N 439.737 4.073 10 10 IICE COc1ccc(N(CC(=O)N2CCN(c3ccc(F)cc3)CC2)Cc2cccs2)cc1 1653577928 LZHKXSHUXMMFGS-UHFFFAOYSA-N 439.556 4.251 10 10 IICE COC(=O)[C@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)c1ccc2c(c1)CCO2 1658584799 KTNZZNZNJLFCST-XMMPIXPASA-N 444.491 4.479 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCNc1cccc(Br)c1 1673743119 AMJJKNUFFKHUEI-INIZCTEOSA-N 433.394 4.166 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c(C)n1-c1ccccc1 1674925016 YMJJBWPSWOUDFP-RSXGOPAZSA-N 435.543 4.146 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCN(Cc1ccccc1)c1ccccn1 1683424328 AILBFYUGPODFLC-QFIPXVFZSA-N 445.611 4.393 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)[C@@H](C)C1 1683426075 UUAPJDVMVRLXIJ-ZJOUEHCJSA-N 446.636 4.184 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H](O)c3ccc(-c4ccccc4)cc3)C2)cc1 1683504151 LWYWXZQFKQMXLX-IBVKSMDESA-N 445.563 4.221 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3Cc3ccccc3Cl)cc2)CC1 1683702172 YFSCARBCACJZHX-JOCHJYFZSA-N 426.992 4.009 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](CO)c2ccc(Cl)cc2)c(C)n1-c1ccccc1 1684444545 OBCIXIXZILXESL-NRFANRHFSA-N 425.960 4.365 10 10 IICE C[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1cccc(OC(F)(F)F)c1 1685090943 OJJJDEUVTQEVCO-MGPUTAFESA-N 438.494 4.314 10 10 IICE CC(C)(C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1706109597 NYKULWGMUWCUGO-INIZCTEOSA-N 444.630 4.267 10 10 IICE Cc1cc(-c2nnc(N3CCN(C)C(=O)C3)n2CC(C)(C)C(C)C)c(C)n1-c1ccccc1 1707274841 JDJZUJWVCJORRP-UHFFFAOYSA-N 448.615 4.313 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752767627 GKJAHJHKEAFAOU-RTBURBONSA-N 429.584 4.442 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1763606596 JTZBDXAPGKXAQZ-XLIONFOSSA-N 429.584 4.298 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC1CCOCC1 1763747101 BXPQEHTUKIIVGE-GOSISDBHSA-N 445.583 4.083 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1767111943 KYSCRCXUTYUSOB-KRWDZBQOSA-N 441.576 4.145 10 10 IICE CCC1=NN(Cc2cccc(Cl)c2)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679196 AFIHQFFJFWWHEN-CXUHLZMHSA-N 427.844 4.211 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](NC(=O)[C@@H](C)C3CCCC3)c3ccccc3)CC2)cc1 1868891448 UJSFSJADNYVSHJ-NBGIEHNGSA-N 449.595 4.028 10 10 IICE CN[C@@H](CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1)c1ccc(N(C)C)cc1 1999528313 ZRGVJYIHQYKTGZ-QHCPKHFHSA-N 426.605 4.040 10 10 IICE CCN[C@@H]1C(=O)Nc2cc(N(CCCOC)Cc3ccccc3)c(Br)cc21 2152205501 JRKOSILJFWSOQC-FQEVSTJZSA-N 432.362 4.095 10 10 IICE Brc1cc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)ccc1CNC1CC1 2188882474 ZDNUZTDSAKJPRV-WMZHIEFXSA-N 426.402 4.412 10 10 IICE Cc1cccc(COc2ccc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)cc2)c1 2297352660 KBDYBBHKGNERQU-UHFFFAOYSA-N 445.548 4.246 10 10 IICE Cc1ccc(CN[C@]23CCC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352690523 BVMQWDWMOGZUGG-YWZLYKJASA-N 425.367 4.342 10 10 IICE CC[C@H](C)N(CC(=O)NCc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2352942162 ALWCPZUCCJTJOA-ZDUSSCGKSA-N 429.355 4.115 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2C[C@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380756404 KVXGVNREBFIGCR-UONOGXRCSA-N 441.366 4.115 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)O[C@@H](C)C(=O)Nc3cccc(NC(C)=O)c3)c2C)cc1 26661406 AYAKLNPJGJCMJH-KRWDZBQOSA-N 449.507 4.245 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 226692564 QLJBGIYWAKSRKB-GJLBYMJHSA-N 427.526 4.498 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCc2cccc(Br)c2C1 735681741 QHDBYFBQOGXXCB-UHFFFAOYSA-N 446.414 4.270 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](C)C[C@@H]3c3ccco3)cc2F)C[C@H](C)O1 743876198 VXSJTAZSHQILHT-GKAYAJSDSA-N 443.563 4.122 10 10 IICE Cc1cc(C(=O)[C@@H](C)OC(=O)/C=C/c2ccncn2)c(C)n1-c1ccc(OC(F)F)cc1 754921560 GUJUYYDMLNUOHF-VCIFKONDSA-N 441.434 4.313 10 10 IICE COc1cc(N2CCN(C(=O)Nc3csc4ccccc34)CC2)cc(OC)c1OC 760033056 FAZQPRNQVVHQDI-UHFFFAOYSA-N 427.526 4.281 10 10 IICE COc1cc([C@@H](C)NCCc2cc(C)n(-c3ccccc3)c2C)ccc1S(C)(=O)=O 764717508 QNENIIDDQVCKHL-GOSISDBHSA-N 426.582 4.400 10 10 IICE CCc1ccc(-c2csc(NS(=O)(=O)c3c(OC)cc(OC)cc3OC)n2)cc1 777665137 DQGRHKIDTYNXGQ-UHFFFAOYSA-N 434.539 4.199 10 10 IICE COc1cccc(CNC(=O)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1O 777750257 HZPFXEKQRPSLJK-ICSRJNTNSA-N 435.927 4.217 10 10 IICE CCn1c(O)nnc1C1CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)CC1 779232384 VYHINULTGCHRFX-UHFFFAOYSA-N 427.936 4.084 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc2cc(OC)ccc2n1 791249371 VVPMYBJOBWSBNV-UHFFFAOYSA-N 435.524 4.246 10 10 IICE Cn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c2cc(F)ccc21 797612523 FJWLELJPCRZSAT-UHFFFAOYSA-N 435.421 4.103 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OC[C@H](F)C(F)(F)F 800126257 CAYVYDHCZARHDE-HUYFXPKMSA-N 427.466 4.173 10 10 IICE Cc1nc2cc(NC(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)ccc2o1 916633677 KSTKXXPAJVQAQZ-UHFFFAOYSA-N 434.418 4.313 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@@H](C)C2 1124130755 YMVHLCZZOYOVIB-CABCVRRESA-N 426.538 4.041 10 10 IICE COC(=O)C(C)(C)c1csc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)n1 1129180959 OUTXGKLVAAUDMW-UHFFFAOYSA-N 441.553 4.075 10 10 IICE Cc1cc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c(C)n1-c1ccccc1 1132264649 ZAKDJDQAHRZAOC-VXNXHJTFSA-N 447.579 4.076 10 10 IICE Cc1cc(C(=O)N2CCCN(C3CCCC3)CC2)c(C)n1-c1ccc(Br)cn1 1136939200 SEOBFFLUVRXOMP-UHFFFAOYSA-N 445.405 4.342 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(OCc2ccccc2)ccc1O 1141804320 VTERGSPKXDGYJO-UHFFFAOYSA-N 434.561 4.454 10 10 IICE COc1ccc(N2CCN(c3nc(-c4cc(Cl)cc(Cl)c4)no3)CC2)c(OC)c1 1187380164 LLMYKJXJGHCDDH-UHFFFAOYSA-N 435.311 4.387 10 10 IICE COc1ccc(N(C)CCN(C)[C@H](C)C(=O)Nc2ccc(C)cc2Br)cc1 1195790689 VPUPETPEXIEJNA-MRXNPFEDSA-N 434.378 4.161 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)CC1 1196048472 VSNANIDIDSFUTO-HSZRJFAPSA-N 443.632 4.382 10 10 IICE COc1ccc(C[C@H](C)CNC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1OC 1225337529 HSRBZCAFQKFFLN-HKUYNNGSSA-N 427.589 4.187 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1251951666 SKPZSSVJTWWFMY-SMDDNHRTSA-N 432.348 4.192 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H]([C@H]3CCOC3)C2)cc1 1295420556 SIKRKNITZYSAGU-VXKWHMMOSA-N 425.621 4.234 10 10 IICE CCc1ccccc1N1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC)CCCCC3)CC1=O 1353748860 QLKJDBCXJYKUKO-INIZCTEOSA-N 440.565 4.358 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(SC)cc3)C2)sc2c1CCCC2 1353964894 RNTNGECFEDLYCH-CYBMUJFWSA-N 444.578 4.127 10 10 IICE O=C(COc1ccccc1Br)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1357322674 CVQWHEXUZNCLGD-UHFFFAOYSA-N 436.261 4.242 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3coc4cc(Cl)ccc34)cc2F)CC1 1359920003 GBMLIJUWBBIWPC-UHFFFAOYSA-N 429.923 4.226 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1360273602 NRMOBSSXHJNOCB-RFMKRLFESA-N 439.987 4.425 10 10 IICE COc1cc(Br)c(N)c(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1 1450702318 BNELROXROZTJQN-UHFFFAOYSA-N 438.285 4.002 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cnc(F)c(Br)c2)cc1 1456089317 QWSQNCQMWARUGU-UHFFFAOYSA-N 434.231 4.254 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 1460972477 CHQLBRKBNIPDKP-GOSISDBHSA-N 447.579 4.351 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cc(Br)cc2c1OCCO2 1469303716 UVQQLHUCIUMDAL-UHFFFAOYSA-N 431.330 4.141 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C(=O)OC(C)(C)C)cc1 1479492797 ZCYZPZWCBFEZCY-HKBOAZHASA-N 430.593 4.215 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(c4c(F)cccc4F)CCC3)cc2F)C[C@H](C)O1 1516811673 FKXIPEIBIUBYRX-HOTGVXAUSA-N 432.486 4.456 10 10 IICE CCSCCCn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1516932920 MLHVZLICNOGZLZ-UHFFFAOYSA-N 431.650 4.345 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3ccc(Br)c(C)c3)CC2)c(OC)c1 1534587829 QHZJUELPHWDSIS-UHFFFAOYSA-N 447.373 4.056 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccn(C(F)F)n1 1538920184 QHQMDCASNQYTKH-UHFFFAOYSA-N 433.216 4.003 10 10 IICE COc1cc(Br)cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 1544529295 CMYVLLOLRKFFEE-HXUWFJFHSA-N 447.373 4.345 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C[C@@H](C)n1cc(Br)cn1 1545508623 IKXRIIBFLHVQOE-LLVKDONJSA-N 445.155 4.114 10 10 IICE O=C(Cc1ccc(Br)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632099 BLIBUVMSMSSIAQ-SFHVURJKSA-N 437.765 4.131 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]3CCC[C@H]32)n1Cc1ccc(N(C)C)cc1C 1555658026 ZEYGEGBOOOLGAB-ZRCGQRJVSA-N 441.620 4.194 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCCC[C@@H]2C(=O)Nc2ccc3c(c2)CCO3)c1O 1559600048 KFRYVXNYGLKWPC-HXUWFJFHSA-N 428.916 4.176 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3CO)c2C)c1 1566448079 PPAIETSSMCIYFG-SHQCIBLASA-N 445.607 4.324 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1583527491 WZYVDKGPJIVMNZ-SVMVAKDDSA-N 429.992 4.461 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(Sc4ccccc4Cl)nn3)C2)cc1 1585987364 AYXDSGHFBKWKBO-HNNXBMFYSA-N 440.956 4.299 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)COc2cc(Cl)cc(Cl)c2)c(C)n1-c1ccccn1 1587360161 ZLBQRPQWYKCTLX-GOSISDBHSA-N 448.350 4.308 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1C 1598229230 YYASJDBBCBYWLZ-DEOSSOPVSA-N 429.564 4.366 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCC3(CCOCC3)O2)c(C)n1-c1ccccc1Br 1598410844 XXZZWQBLSZNTJA-KRWDZBQOSA-N 447.373 4.315 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2N(C)CCCC2(C)C)n1 1612187661 RFCFQKVYPQGVFF-JOCHJYFZSA-N 434.588 4.111 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@](C)(CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1613347437 FMBIWGXWQWNQHI-CYFREDJKSA-N 443.661 4.398 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(CC)[C@@H]2c2cccc(C)c2)cc1F 1616924866 OPWZZGKJDKDORK-GBXCKJPGSA-N 425.548 4.206 10 10 IICE COc1cccc([C@@H]2CN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CCO2)c1 1622248179 RQIGZHPVKKYALV-VWLOTQADSA-N 432.520 4.437 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1CC(N(C)C(=O)OC(C)(C)C)C1 1622328206 QMYDHHYGGGVDDX-UHFFFAOYSA-N 441.366 4.149 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2c(F)ccc(I)c2Cl)c1 1622779284 MTRZVVDJNUUPKJ-QMMMGPOBSA-N 449.647 4.289 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])c(F)cc1C 1626511636 OCEVIKWIVFPMHK-UHFFFAOYSA-N 431.464 4.045 10 10 IICE CCN(C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)[C@H]1CCN(c2ccccc2)C1=O 1627374530 PPCNFCFYEWOJPW-DEOSSOPVSA-N 443.547 4.483 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1628720662 VBMCRBQPQIRUKH-HXUWFJFHSA-N 425.573 4.352 10 10 IICE COCCO[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1633839026 TVUFSELJBGVFLK-QGZVFWFLSA-N 435.362 4.124 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H](O)COc1ccc(SC)cc1 1641892754 OWKDKLBJGREHDY-MRXNPFEDSA-N 426.376 4.138 10 10 IICE Cc1cc(CNC(=O)[C@@H](NC(=O)NCc2ccccc2)C(C)C)c(C)n1-c1ccccc1 1642459227 FWZGAUVJXUYENE-DEOSSOPVSA-N 432.568 4.234 10 10 IICE COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCN(c2ccc(OC)cc2OC)CC1 1644225435 LDLFLSGKJZWWQZ-HXUWFJFHSA-N 439.339 4.047 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N(C)CC(=O)Nc2ccc(C)cc2)cc1 1652802099 LBPGRKABKACNKL-UHFFFAOYSA-N 445.563 4.150 10 10 IICE CSc1ccc([C@H](CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)N(C)C)cc1 1673025395 UJPKYRWCLMKMTA-QHCPKHFHSA-N 426.630 4.451 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1 1680477798 QQLVBUYFUJIDNA-QGZVFWFLSA-N 446.954 4.272 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@@H]3CO)cc2Cl)C1 1680561274 AVBUQVAYUFZFOW-SBUREZEXSA-N 427.976 4.378 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4cc(Br)ccc4C3)C2)cc1 1683503880 DMJWWKBGRAYFGR-MRXNPFEDSA-N 444.373 4.052 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@H](c2ccc(F)c(F)c2)C1 1684280343 JJMMUARGPWRNHH-IBGZPJMESA-N 429.511 4.015 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C(=O)OC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1694046943 YDVLOILCYCCPES-PZJWPPBQSA-N 439.604 4.076 10 10 IICE CCC[C@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1695163107 PYTYGXVIORRXQJ-DEOSSOPVSA-N 448.615 4.164 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)C[C@H]1CCCO1 1696424764 RJCFEXMKJNYFIW-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@](C)(OC)C1CC1 1708507489 LQDYZWLHRPNUSE-KBMIEXCESA-N 441.620 4.332 10 10 IICE CCc1nnc(N2CCC[C@@H](C(F)(F)F)C2)n1Cc1ccc(N2CCSCC2)cc1 1727576216 RIQOKQYSSUVOPI-QGZVFWFLSA-N 439.551 4.221 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(F)(F)F 1731145180 APSWSTCQWZMOGY-DDUZABMNSA-N 441.473 4.018 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCC[C@@](C)(OC)CC2)cc1 1746092327 IZGZSJYHLCDJAT-SQJMNOBHSA-N 441.620 4.072 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)cc1C 1752742325 KCFLZYSPNDDUIG-GHTZIAJQSA-N 435.620 4.332 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@]3(CCOC3)C2)cc1 1766613518 FWKJCMMGVYDWIF-VWLOTQADSA-N 425.621 4.378 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CCO[C@@H](C)C3)CC2)cc1 1768704490 GRXYGPVJAQQOPI-LEWJYISDSA-N 441.620 4.017 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(c2ccccc2)c2ccccc2)N2CCOCC2)cc1 1858074058 BFRMDQYEWAOPHS-AREMUKBSSA-N 443.591 4.074 10 10 IICE CC[C@@H](CO)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 1858590226 CQOGKOMEWLHNSJ-RONKMWSCSA-N 429.563 4.246 10 10 IICE CCCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCO[C@H](C)C2)n1 1868386734 GIUQRUYOEGTSSK-MRXNPFEDSA-N 442.519 4.173 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(C)(C)C)c(CN)c2I)c(O)c1 2079039564 DBLGCOLBACBUCG-MRXNPFEDSA-N 439.341 4.257 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@@]2(NCc2cccc(Br)c2O)C1 2126058765 UUSQEPMGGJIGQE-RBUKOAKNSA-N 429.330 4.126 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)[C@@H](Cc1cccc(Br)c1)NC(=O)OC(C)(C)C 2237413323 DHWPMYARZGWVKB-OAHLLOKOSA-N 440.342 4.044 10 10 IICE CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc(Cl)c1OCC 2294095624 XEKSMVDWGLBKTG-UHFFFAOYSA-N 449.290 4.457 10 10 IICE COC(=O)c1ccc(C=C2N=C(c3ccccc3F)N(c3ccc(OC)cc3)C2=O)cc1 2297332305 DUOLCHUCYLSRJB-UHFFFAOYSA-N 430.435 4.455 10 10 IICE CSC1=NSC2=NC(=O)/C(=C\c3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C(=N)N12 20238915 VDSPNBKSMOUVRQ-SBPWCSLQSA-N 427.467 4.103 10 10 IICE O=C1/C(=C/c2cccn2-c2ccc([N+](=O)[O-])cc2)C(O)=NC(=S)N1c1ccc(F)cc1 20479467 CJXBUOPGSXXTJM-LDADJPATSA-N 436.424 4.196 10 10 IICE CCN(CC)c1ccc(CN(C[C@@H](O)COc2ccccc2C=O)c2ccccn2)cc1 54120905 MILOEBFFFVLTPS-XMMPIXPASA-N 433.552 4.187 10 10 IICE COc1cc(/C=C2/SC(=S)N(NC(=O)c3ccccc3C)C2=O)ccc1OC(C)C 206930983 NUCKUWUEYFQYCF-XDHOZWIPSA-N 442.562 4.337 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccccc2O)SC1=S)Nc1ccc(O)cc1 210743550 XFPYRYZWFJZRRG-XMHGGMMESA-N 442.562 4.498 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC([C@H]3CCCCCN3C(C)=O)CC2)c1O 738219441 IWRRZMUMAMEETE-XMMPIXPASA-N 438.568 4.335 10 10 IICE O=C(/C=C\c1ccc(Br)o1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742807307 ZKYRHGMIFTVICS-KJJQSCHISA-N 441.272 4.442 10 10 IICE CN1CC[C@H](NC(=O)NCCCSc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 755083238 JEQBQSLZLHBSEF-HOTGVXAUSA-N 428.986 4.162 10 10 IICE COc1ccc(Cn2nc(C)c(CN(C)c3cc(OC)c(OC)c(OC)c3)c2C)cc1 768518300 AZJHMHMLLWFANU-UHFFFAOYSA-N 425.529 4.219 10 10 IICE O=C(CCC(=O)c1ccc(F)c(F)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771060134 VVTHVUULVYQDLU-KRWDZBQOSA-N 436.886 4.068 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 773144911 GIJVLOGVOANDDB-LJQANCHMSA-N 432.612 4.299 10 10 IICE COc1cc([C@H](C)NCC(=O)N(C)Cc2ccc(N(C)C)cc2)ccc1OC1CCCC1 775010901 DSZBAJPPRLXPCI-IBGZPJMESA-N 439.600 4.392 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1n[nH]c2cc(F)ccc12 789886975 ZQPJCSMRFREWOC-XNTDXEJSSA-N 446.554 4.384 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCSc3ccccc3)C2=O)cc2c1OCCO2 814267929 LYXVTOWKJNLPRI-QGOAFFKASA-N 445.587 4.460 10 10 IICE Cc1cc(C(=O)COC(=O)[C@@H]2CCCN2C(=O)c2ccccc2)c(C)n1-c1ccccc1 912681587 HSUMXMJGDIXMDI-QHCPKHFHSA-N 430.504 4.125 10 10 IICE COc1ccc([C@@H]2[C@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CCC(=O)N2C)cc1 1132267856 PIUKULANNAUEEL-AOYPEHQESA-N 445.563 4.329 10 10 IICE Cc1cc(C(=O)NC[C@H]2COc3ccccc3C2)c(C)n1-c1ccc(Br)cn1 1135724547 DUSPKMSDJUMKDS-INIZCTEOSA-N 440.341 4.233 10 10 IICE COc1cccc(CC2(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)CCCCC2)c1 1141901893 RMMHAGWEWMQGRG-UHFFFAOYSA-N 440.559 4.480 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCN(c2ccccc2Cl)C1 1150348978 UCQURSOWARCORI-LPHOPBHVSA-N 448.394 4.306 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(C)c4ccccc43)cc2F)C[C@@H](C)O1 1194792083 PULLSLVKICGYLX-RTBURBONSA-N 439.575 4.243 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1CCCNc1ccc(C(F)(F)F)cn1 1292841067 MSLKTSUBZILEFU-UHFFFAOYSA-N 434.466 4.099 10 10 IICE Cc1ccc(C(=O)NC(C)(C)c2cn(-c3ccccc3)nn2)cc1-n1c(C)cc(C=O)c1C 1294644628 BYXJTNKPLLXLMG-UHFFFAOYSA-N 441.535 4.461 10 10 IICE CC(C)(C)OC(=O)[C@]1(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC=CCC1 1294858250 BWRVMVUFZDWGHE-NTKDMRAZSA-N 448.991 4.194 10 10 IICE Cc1cc(C(=O)N2CC[C@]3(CCCN(C)C3)C2)c(C)n1-c1ccccc1Br 1298519435 SQCAKLCHUINQJF-QFIPXVFZSA-N 430.390 4.415 10 10 IICE Cn1ccnc1[C@@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1Cl 1326553699 TWYWHSRVZGLQMO-QFIPXVFZSA-N 428.939 4.053 10 10 IICE CCc1nc(CN(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cs1 1351417816 BCKBQTJNLCEQEW-MHWRWJLKSA-N 449.598 4.095 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1nc2c(s1)CCCC2 1352173399 STIIKVPWQDIUPE-LFIBNONCSA-N 447.582 4.391 10 10 IICE Cc1cccc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1C 1459860212 MFDFXBSRKWNFOQ-BJLQDIEVSA-N 427.564 4.023 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(c4ccc(Cl)cc4)C3=O)c2C)cc1 1465296716 WINBDDLNSVRDEY-QFIPXVFZSA-N 437.927 4.291 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cn1c(SC(F)F)nc2ccccc21 1469103886 MFFZSUPNBLCHDK-OAHLLOKOSA-N 432.540 4.473 10 10 IICE C[C@H](NC(=O)NCC1(c2ccccc2)CC(O)(C(F)(F)F)C1)c1ccc(N(C)C)cc1 1469854668 SYFINOATNFKMMQ-XDGVHFHYSA-N 435.490 4.138 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1495431778 FYIHPTVBCDYJQI-IFMALSPDSA-N 449.647 4.489 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4ccccn4)n3CCCC(C)C)CC2)cc1 1504291922 CXHOSOIVGUQBBP-UHFFFAOYSA-N 448.615 4.425 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)cc1C 1519309438 XWZOAKCCIDRWQT-FQEVSTJZSA-N 429.609 4.195 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CCCCC2 1525452510 CRMARUAVVDJHKT-KRWDZBQOSA-N 440.565 4.181 10 10 IICE CCCCOc1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cn1 1538061052 OSWHCWUUHWZQCI-UHFFFAOYSA-N 445.431 4.196 10 10 IICE CC[C@H](C)c1nc(C)c(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)n1 1542490209 HOALLWSVNKWETG-FDDCHVKYSA-N 438.616 4.423 10 10 IICE O=C(Cc1ccc(O)c(O)c1)NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 1544133889 SLZBQWRNFSQKQC-UHFFFAOYSA-N 446.818 4.450 10 10 IICE O=Cc1cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)ccc1F 1546150828 YNYSTWLXASZFMC-UHFFFAOYSA-N 431.511 4.255 10 10 IICE CCCN(CCC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1547135501 WJPMRFWBFFEHSS-JOCHJYFZSA-N 445.583 4.170 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@@H]1N(C)CCCC1(C)C 1554175187 KCZGQRBVEQUJBW-NRFANRHFSA-N 439.629 4.393 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C\[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1557063791 ZOOQJGFZENGGKL-BDRZJWEDSA-N 429.605 4.312 10 10 IICE COc1c(C)cccc1CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1584979445 GXNWIEKYCOQXSH-ATVHPVEESA-N 446.619 4.363 10 10 IICE CCCN1CCN(c2ccc(NC(=O)c3ccc(N=NC(N)=O)cc3)cc2Cl)CC1 1597537556 DRSDJCSKDXSDMW-UHFFFAOYSA-N 428.924 4.287 10 10 IICE CC(C)Cc1ncnc(NCc2ccc(N(C)C)c(F)c2)c1I 1611886657 UOPUPYIVMPYUHF-UHFFFAOYSA-N 428.293 4.097 10 10 IICE Cc1ccc(-c2nnc(N3CCO[C@@H](C(C)(C)C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1612046598 ZLDIDISMHKPDEJ-OAQYLSRUSA-N 441.551 4.351 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccc(OC)c(O)c1 1616862185 XBLWJQCNWOHQJH-OAQYLSRUSA-N 442.899 4.106 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc3cccnc3c2)NC(=O)OC(C)(C)C)cc1 1618254065 WHBUOAGWFYHJSS-QFIPXVFZSA-N 434.540 4.297 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1cccc(CN2C(=O)CSC2=O)c1 1623338684 AXNYFDBJKIVDHA-UHFFFAOYSA-N 439.562 4.281 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccnc1Nc1ccccc1F 1626055709 BWAVJDWJVIUAJS-UHFFFAOYSA-N 442.441 4.009 10 10 IICE Nc1cc(Br)ccc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1629055349 ICLNYOPIEMEQJL-CYBMUJFWSA-N 440.288 4.032 10 10 IICE CC[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc2c(c1)OCCO2 1630760049 OJEJREQFGIOHIL-QHCPKHFHSA-N 432.520 4.488 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)C[C@H](O)c1ccccc1Br 1636262678 JBTXVTKZEUNBEZ-KKSFZXQISA-N 448.405 4.130 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC3(CCCC3)C2)sc(C)c1-c1ccccc1 1644784915 DIBYVACVCFOXFY-UHFFFAOYSA-N 442.581 4.484 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1c(O)cc(Cl)cc1Cl 1650717782 ZBPDZIRNTXHWQT-UHFFFAOYSA-N 449.256 4.484 10 10 IICE Cc1cc(CNC(=O)c2cccnc2I)c(C)n1-c1ccccc1 1651183310 NJMQVJAINXGERV-UHFFFAOYSA-N 431.277 4.024 10 10 IICE COc1ccc(N(C)CC(=O)N(C)[C@@]2(c3ccccc3Cl)CCCCC2=O)c(OC)c1 1652957634 MRDDMPSDVSATEP-XMMPIXPASA-N 444.959 4.290 10 10 IICE Cc1cc(-c2csc(NC(=O)/C=C3/SCC(=O)N3C)n2)c(C)n1-c1ccc(F)cc1 1654198261 WWKPUWTWHHWRAN-AWQFTUOYSA-N 442.541 4.342 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@@H]1CCN([C@H](C)c2ccc(F)cc2)C1=O 1657431351 LCRSHRSOJOEICE-AUUYWEPGSA-N 435.337 4.478 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCNc1cccc(Br)c1 1673743120 AMJJKNUFFKHUEI-MRXNPFEDSA-N 433.394 4.166 10 10 IICE CCO[C@H](C)c1noc(CN(C)C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)n1 1675107900 HPJOEVYUEWJLKY-GOSISDBHSA-N 425.533 4.225 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)C[C@@H](O)Cc3ccccc3)cc2Cl)C1 1682023106 ALRYTMYCWBEFHR-NQIIRXRSSA-N 429.992 4.321 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCSC3)n2CCCCCO)c(C)n1-c1ccccc1 1692984009 BLDVNHMDMAOCCT-NRFANRHFSA-N 439.629 4.457 10 10 IICE Cc1nnc(N(C)Cc2cnn(Cc3ccccc3)c2)n1CCCSc1nccs1 1693457821 KFLDVWDDFRTBLN-UHFFFAOYSA-N 439.614 4.107 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(C)[C@@H]2CCC[C@H](C)C2)cc1 1695623447 DLLWSUSATDVJOQ-BWAGFHJFSA-N 438.620 4.139 10 10 IICE CCN(CC)[C@@H](Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccccc1O)c1ccco1 1710019187 AGPGLFHPUUBZAQ-FQEVSTJZSA-N 434.544 4.291 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CCC[C@@H]3OC)CC2)cc1 1711865238 OBEJACVOAADVJA-OFNKIYASSA-N 441.620 4.017 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCO[C@@H]1C 1728026850 JOGGHDNVCQRQRD-NLFFAJNJSA-N 437.588 4.129 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC1CC1 1728256266 IZASMIPIHGXVGF-UHFFFAOYSA-N 434.588 4.067 10 10 IICE COc1cc(Cl)ccc1-c1nnc(N(C)OC)n1CCCSc1nccs1 1729991158 CVWLBVMVZQQGOA-UHFFFAOYSA-N 425.967 4.244 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1749301228 YCTWZBJBKAMDDK-KRWDZBQOSA-N 425.602 4.188 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C[C@H](C)O1 1765293035 ITEUPQISLMNMEO-AVRDEDQJSA-N 439.629 4.357 10 10 IICE CCOc1c(Br)cc(/C=C2/C(=O)N(c3ccccn3)N=C2CC)cc1OC 1865671418 ZXTNFGHOTUXNBA-GXDHUFHOSA-N 430.302 4.448 10 10 IICE Cc1cc(C)cc(N2C[C@@H](C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2=O)c1 1874179276 WAYNJVIFHVCWKG-KRWDZBQOSA-N 438.483 4.070 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCn1cc(Br)cn1 1969383559 LNBIOVMPRLMHML-UHFFFAOYSA-N 435.366 4.123 10 10 IICE N=C1/C(=C/c2ccc([N+](=O)[O-])o2)C(=O)N=C2SC(C34C[C@H]5C[C@@H](C3)C[C@@H](C4)C5)=NN12 2059064201 ZFMCLGHQFBCEPS-ADQRWVFNSA-N 425.470 4.023 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@H](CN)c1cnn(Cc2ccccc2)c1 2074363733 GSNCULBBYDNSRX-HSZRJFAPSA-N 435.572 4.092 10 10 IICE Cc1cc(O)c([C@@H](n2nc(C)c(CO)c2I)C2(C)CC2)cc1C 2079932338 CHHQFCNZNPJKOA-MRXNPFEDSA-N 426.298 4.000 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1C(C)(C)[C@@H]2NCc1cccc(Br)c1O 2119292229 AIFOSYHNWLZRCR-XYPHTWIQSA-N 425.367 4.278 10 10 IICE COC(=O)C1=C(C)N(CCc2ccc(OC)c(OC)c2)C(=O)C1=Cc1cccc(Cl)c1 2293453449 KTLOLVYVJMZDEW-UHFFFAOYSA-N 441.911 4.273 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3ccc4c(c3)C[C@@H](C)O4)SC2=S)cc1OC 2296175745 ONHGQNYKHDSLIU-CQSZACIVSA-N 441.574 4.471 10 10 IICE COc1ccc2cc(C=C3SC(=S)N(c4cccc(C(=O)O)c4)C3=O)c(O)nc2c1 2296593708 OKELJYJPYCGPMV-UHFFFAOYSA-N 438.486 4.053 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccc2c(c1)OCO2 2296754875 MUPQBMANBITLKT-UHFFFAOYSA-N 432.548 4.097 10 10 IICE COc1ccccc1N1C(=O)C(=Cc2cc(OC)c(OC(C)=O)c(OC)c2)SC1=S 2297366851 VSYPYJYDUIVPQD-UHFFFAOYSA-N 445.518 4.044 10 10 IICE CCCC[C@@H](NC(=O)C(C)=Cc1ccccc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 2330075975 MOXMCYZDMXYORB-RUZDIDTESA-N 449.595 4.122 10 10 IICE Cc1ccc(CNC(=O)[C@]2(NC(=O)OC(C)(C)C)C[C@H]2C(C)C)c(O)c1Br 2380753153 CMZXUJIXLISUGZ-XOBRGWDASA-N 441.366 4.019 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC=C[C@@H]21 20706319 ZALBRIVEQAUVNA-HTZUNMPGSA-N 427.888 4.451 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3cccc(F)c3)C2=O)cc1OC 33417604 QDWQONQRXRDZND-WOJGMQOQSA-N 446.525 4.073 10 10 IICE COC(=O)CCCCCN1C(=O)/C(=C/c2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 40846609 VNAZIZHJCXZASI-UVTDQMKNSA-N 428.919 4.183 10 10 IICE COc1ccc(Nc2nn(CN3CCN(c4ccc(OC)cc4)CC3)c(=S)s2)cc1 115103472 BAGVAFDXPBQYCE-UHFFFAOYSA-N 443.598 4.215 10 10 IICE Cc1cc2nc3sc(=Cc4ccc(N5CCC(C)CC5)c([N+](=O)[O-])c4)c(=O)n3c2cc1C 252668058 DUCBGKXNPZMMAP-UHFFFAOYSA-N 448.548 4.218 10 10 IICE COc1ccc(-c2csc(N3N=C(C)[C@H](N=Nc4ccccc4C(=O)O)C3=O)n2)cc1 575733368 FBTXRPYXQOVFMT-SFHVURJKSA-N 435.465 4.392 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2CNCc1c(O)cccc1Br 706881413 RSUYRRRJYPLZBM-CQSZACIVSA-N 425.367 4.282 10 10 IICE CC(C)n1ncc2cc(/C=C\C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c(=O)[nH]c21 742417101 UPTMRHOYEZOFIC-KAMYIIQDSA-N 447.583 4.404 10 10 IICE COc1cccc(F)c1[C@@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 743554468 FTZUUDYEPZLZGT-OWCLPIDISA-N 433.499 4.147 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCO[C@@H](C3CCCCC3)C2)c([N+](=O)[O-])c1Br 754124013 POXNJKBSLYGBBA-CQSZACIVSA-N 444.282 4.060 10 10 IICE COc1ccc(-n2cc(CNC(=O)N(Cc3ccccc3O)C3CCCCC3)nn2)cc1 756069115 DZKXCORAPDLIGN-UHFFFAOYSA-N 435.528 4.026 10 10 IICE COc1cccc(-c2nsc(NC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)n2)c1 757937137 PVHXERCXNHFCQP-GOSISDBHSA-N 440.525 4.132 10 10 IICE Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 772881989 CPWIINNAKHPNMB-OAQYLSRUSA-N 426.948 4.312 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1 775182434 FGHJRHQFPLYTBF-GJZGRUSLSA-N 433.346 4.325 10 10 IICE COc1ccc(N2CCC(NS(=O)(=O)c3cc(C(C)C)c(OC)cc3C)CC2)cc1 788611074 FGYHSMKIPBCPHU-UHFFFAOYSA-N 432.586 4.083 10 10 IICE COc1c(NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cccc1C(N)=O 800555890 BZNIXQNDBWVIAS-AWEZNQCLSA-N 430.936 4.006 10 10 IICE C[C@H]1CCC(F)(F)CN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1135067276 PIZQRZUVQKSJBL-XBUHWIKASA-N 428.501 4.063 10 10 IICE CC[C@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CCCN1C(=O)OC(C)(C)C 1136281347 BQPOCRXRFAMUCI-HSZRJFAPSA-N 433.618 4.036 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1 1136537237 ZYLMGWWUUDPFRY-UHFFFAOYSA-N 439.556 4.284 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)NCCOc1c(Cl)cc(Br)cc1Cl 1137955841 OMILFOUHTLKSLL-DUXPYHPUSA-N 447.112 4.376 10 10 IICE C[C@H](NC(=O)c1ccc2n1CCN(C(=O)OC(C)(C)C)[C@@H]2C)c1ccc(N(C)C)cc1 1154669106 RCKXBEVYOKKWPE-DLBZAZTESA-N 426.561 4.357 10 10 IICE O=C(Nc1ccc(C(=O)NCc2c(O)cccc2O)c(O)c1)c1ccc(Cl)c(Cl)c1 1156880930 IDWJTJLCRUBIDT-UHFFFAOYSA-N 447.274 4.293 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)/C(F)=C\c1ccc(F)c(C(F)(F)F)c1 1167763100 XINOCZCCWNDNGL-UDWIEESQSA-N 440.412 4.432 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(Cc3ccc(Br)cc3)CC2)c1O 1168324833 NZJYCFYRIJCNGC-UHFFFAOYSA-N 437.765 4.329 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1C[C@H](C)O[C@H](C)C1 1289424564 YIFXBQSGHQYVMJ-CALCHBBNSA-N 440.979 4.030 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2cccs2)cc1F 1298059799 BFDQFTGTJYYBTB-UHFFFAOYSA-N 436.560 4.215 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)nc12 1307761542 TVNBTYFCNILAAX-OAHLLOKOSA-N 448.445 4.010 10 10 IICE CCO[C@H](CCn1c(C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C1CCCC1 1314057654 QOHPCNYCBKRSMU-XMMPIXPASA-N 441.620 4.045 10 10 IICE Cc1nc(-c2ccccn2)sc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1354658538 PQCYXDPHFJTAKJ-HUUCEWRRSA-N 440.544 4.196 10 10 IICE CC(C)[C@@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CCO1 1359753905 UIWXOZYVDJXIFO-KRWDZBQOSA-N 449.671 4.431 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(Cc4cccc(Cl)c4)CC3)cc2F)CC1 1435077147 UNXBXJGRBCTJFP-UHFFFAOYSA-N 429.967 4.260 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1447566089 WPUZYLJLQYMKHE-BEFAXECRSA-N 426.513 4.027 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1O 1454803694 FRXKUMCTMDSLAN-RNEAKCBISA-N 430.526 4.000 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)c2ccc(Br)cc2)N(C)C)cc1 1463279344 HTDZEWDPMBYCJV-HXUWFJFHSA-N 432.406 4.212 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(OC(C)(C)C)n1 1467631701 PCODKTWVFLBEKW-UHFFFAOYSA-N 427.545 4.261 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](c3ccc(F)c(C)c3)C3CC3)CC2)c(OC)c1 1469448490 PJBHTZRSFFCOLJ-HSZRJFAPSA-N 427.520 4.134 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2C[C@H]2COCCO2)c(C)n1-c1ccccc1 1510608563 YRWMNOXABKYWPF-QFIPXVFZSA-N 437.588 4.250 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnn(CCOC)c1 1514568068 SEBDROFROOJCML-UHFFFAOYSA-N 447.587 4.090 10 10 IICE CN(Cc1nccs1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1517187572 SSQHSCFIGNBGRU-CQSZACIVSA-N 436.632 4.252 10 10 IICE Cc1cc(Cl)nc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1518613109 HJBHDFJUVCBPGU-YBEGLDIGSA-N 449.960 4.090 10 10 IICE COc1ccc(CSCC(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1[N+](=O)[O-] 1523552821 CGUIBCVRKWPWNO-UHFFFAOYSA-N 429.542 4.095 10 10 IICE CC(C)C[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1526259694 KZEKFGRMUQALGG-OFNKIYASSA-N 442.003 4.488 10 10 IICE C[C@H]1CC(F)(F)CCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1532074396 IPMJGQJXKPBSPY-GVIGZQTCSA-N 430.567 4.376 10 10 IICE CC1(C)COc2ccc(C(=O)Nc3cccc(N(CC(N)=O)Cc4ccccc4)c3)cc21 1537582567 DAHIQYYDIQJQTP-UHFFFAOYSA-N 429.520 4.101 10 10 IICE CSC1(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CCCCC1 1538104370 LMGPZXWFBNUBAG-UHFFFAOYSA-N 438.505 4.166 10 10 IICE CC(C)(C)OC(=O)[C@@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)C 1539581909 MCMHMNYCPJATKM-MAUKXSAKSA-N 440.531 4.377 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 1556515561 CYFOJDQBSCKWPM-UHFFFAOYSA-N 431.529 4.496 10 10 IICE Cc1cc(CN2C(=O)c3cc(Br)ccc3S2(=O)=O)ccc1N1CCCCC1 1559387957 RTGBPHGQLBHSGQ-UHFFFAOYSA-N 449.370 4.093 10 10 IICE Cc1ccc(C(=O)N(C)Cc2nccn2CC(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1565565252 ZERMNESRKNQDSF-UHFFFAOYSA-N 432.446 4.246 10 10 IICE Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c(C)n1-c1ccc(Br)cn1 1567467208 DRVCQXKSSQISGV-LBPRGKRZSA-N 444.329 4.024 10 10 IICE CCN(C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)c1ccc(N2CCOCC2)cc1 1587346521 SBUSKRTYAXSAHY-UHFFFAOYSA-N 435.568 4.408 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(OC)cc1 1606860829 VSJQKGQDERAASK-DENIHFKCSA-N 444.959 4.450 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613195445 AUUBPKMLJFLKGS-UFYCRDLUSA-N 425.621 4.141 10 10 IICE CCCc1noc2nc(C3CC3)cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c12 1616858499 NHICUYMWQYCPFX-QFIPXVFZSA-N 435.572 4.151 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc2cccnc2c1O)c1c(F)cccc1F 1630532119 HVIIKXFLKBYNPF-LJQANCHMSA-N 443.450 4.101 10 10 IICE Cc1cc(C(=O)NCCn2cnc3ccccc32)c(C)n1-c1ccc(Br)cn1 1631376377 QIKNIQSRWRJNSW-UHFFFAOYSA-N 438.329 4.031 10 10 IICE COc1ccc2[nH]nc(NC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)c2c1 1631962511 LGXQHMVHDSVTOW-UHFFFAOYSA-N 440.301 4.389 10 10 IICE C[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@@H]1CCNC(=O)OC(C)(C)C 1632029244 NPSOXDNFEHJWOK-DZGCQCFKSA-N 434.558 4.468 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1c(O)cccc1F)c1cccc(C(F)(F)F)c1 1635367001 VCQHXCFGFYDLHK-QGZVFWFLSA-N 442.409 4.432 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nc(-c3ccccn3)cs2)cc1 1639276954 MSVNRPTZNPJNQK-UHFFFAOYSA-N 430.533 4.284 10 10 IICE COc1ccc([C@H](NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)cc1 1645123359 ADUVUTUFKBQBHK-RUZDIDTESA-N 442.515 4.396 10 10 IICE COc1ccc(N(C)CC(=O)NCc2cn(Cc3ccccc3)nc2-c2ccccc2)cc1 1654957968 RXPSGHHEOFGPJC-UHFFFAOYSA-N 440.547 4.360 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(NC(=O)OC(C)(C)C)cc3)C2)cc1 1682646224 PQFVYGPBGQFVMA-IBGZPJMESA-N 440.544 4.120 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H](c2ccc(F)c(F)c2)c2nccn2C)C2CC2)cc1 1684618107 QLDVHFPUKDITMM-QFIPXVFZSA-N 439.510 4.228 10 10 IICE CC(C)CN(CCc1ccc(F)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1685608776 GVQNUJRXQRVZAR-DEOSSOPVSA-N 428.596 4.405 10 10 IICE COc1cccc(CN(CC(C)C)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1685609146 KWMOYCGLLVRQCI-XMMPIXPASA-N 426.605 4.232 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1C[C@H]2CC[C@@H]([C@@H]1C)N2C(=O)OC(C)(C)C 1687270507 FRYKVFWEEMELAY-GFRNBQLOSA-N 444.620 4.461 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N3CC[C@@H](C)[C@@H](O)C3)cc2)CC1 1693702315 UWZHVOMJBDYEEL-OFNKIYASSA-N 439.648 4.358 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCSCC2)cc1 1695626305 ZRVILMUYZQYENQ-UHFFFAOYSA-N 427.643 4.378 10 10 IICE CCO[C@H](CCn1c(CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1)C(C)C 1696017322 NBHIRRSEQVMGCK-JOCHJYFZSA-N 429.609 4.017 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ncnn1C(C)(C)C 1706280002 XXZXKVUCPKJJBR-UHFFFAOYSA-N 436.608 4.033 10 10 IICE CCOCc1nnc(N2CCCC[C@H](SCC)C2)n1Cc1ccc(N(C)C)cc1C 1729052218 LKLKYVBPCZOYSW-NRFANRHFSA-N 431.650 4.349 10 10 IICE CN(Cc1cccc(F)c1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1729412955 FWXOZMRJVWGTTJ-UHFFFAOYSA-N 441.561 4.150 10 10 IICE CO[C@H](Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1729882884 KXVDNNXULKSNHL-RBBKRZOGSA-N 441.620 4.080 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1CCOC1CCCCCC1 1747753007 ALNNQOHULBCLED-UHFFFAOYSA-N 435.572 4.345 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCCC2CCOCC2)cs1 1751766804 CBUJAKZGHZBUHQ-UHFFFAOYSA-N 441.601 4.183 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1764149658 PNQGESCCHCQCGW-HSZRJFAPSA-N 448.615 4.261 10 10 IICE CCOCCC1(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCC1 1766508345 MVQWDYLAIVRLFY-NRFANRHFSA-N 428.577 4.459 10 10 IICE CN(CCc1nccs1)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1767291682 SPOGZRGNYLONIL-UHFFFAOYSA-N 443.627 4.114 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010406503 VJMOMDRUCRPOLA-RTBURBONSA-N 431.537 4.036 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C3(C)CC3)c(N)c2I)cc1C 2080012705 SOXATUMUGYKEGG-MRXNPFEDSA-N 437.325 4.443 10 10 IICE CCSC1=NN2C(=N)C(=Cc3cc(C)n(-c4ccccc4OC)c3C)C(=O)N=C2S1 2297470152 NTQUGQBBQHRFBW-UHFFFAOYSA-N 439.566 4.433 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCO3)SC(=S)N1C[C@H](c1ccccc1)N1CCCC1 2323886468 AWIBEOIREGPEER-GOSISDBHSA-N 438.574 4.454 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1c(O)cccc1Br)[C@H]2F 2333274431 IVIAUTWDKGZDHT-FIUQPQMISA-N 429.330 4.123 10 10 IICE Cc1ccc(CNC[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352953010 RINHQHWHPHJZQP-CABCVRRESA-N 427.383 4.492 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380722536 QNILOYYDQSXSLN-VLIAUNLRSA-N 441.366 4.163 10 10 IICE Cc1oc2c(CN[C@@H](Cc3ccccc3)C(=O)O)c(O)ccc2c(=O)c1Oc1ccccc1 16028653 YNFWNDBWALDABO-NRFANRHFSA-N 445.471 4.385 10 10 IICE biogenic CN(C)c1ccc(CNC(=O)CC2CCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1 35528888 IYZFAIQHGPYFTC-UHFFFAOYSA-N 428.964 4.356 10 10 IICE Cc1ccsc1/C=C1/SC(=S)N(NC(=O)c2ccc(Br)cc2)C1=O 40940442 GBUKAPXDPMNYFU-MDWZMJQESA-N 439.381 4.365 10 10 IICE CCCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1OC 40940506 JPHFUQZDZDQHMN-UYRXBGFRSA-N 442.562 4.339 10 10 IICE CCOc1cc2c(cc1/C=C/C(=O)NC1CCN(c3ccc(OC)cc3)CC1)O[C@@H](C)C2 110358178 DPGWCIFGPWUITF-DNXKIMQPSA-N 436.552 4.216 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@@H](c2ccc(Cl)cc2)N3)CC1 226720954 NTFMATRYGUUETK-ZRCGQRJVSA-N 444.000 4.103 10 10 IICE COc1ccc(Nc2nc(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)cs2)cc1 740740913 FADAKKXPGYEYKG-UHFFFAOYSA-N 438.553 4.256 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccn(-c2c(F)cccc2F)n1 749369789 CLJRTEPTGNWSQU-UHFFFAOYSA-N 448.420 4.151 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCCCSc1nccs1)O[C@H](C)C2 759581287 SMFHKEKCGWMFBE-KMFMINBZSA-N 433.599 4.203 10 10 IICE COc1ccc(C)cc1C1(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)CCOCC1 765310894 QQMFDFBADTWGMQ-FQEVSTJZSA-N 442.575 4.378 10 10 IICE Cc1ccc(C)n1C1CCN(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1 769036500 MBUPDURNNKJWBY-UHFFFAOYSA-N 449.643 4.184 10 10 IICE C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 776173366 RYWRBWNVQIWPAS-UWJYYQICSA-N 438.538 4.091 10 10 IICE O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 778927895 VTQVVMJOVWCIOZ-PMVMPFDFSA-N 444.531 4.341 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 793579767 CXQXRIDFNITWNI-UHFFFAOYSA-N 437.540 4.480 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1nc([C@H](C)OC)no1 801957079 CVSFOXFWINZSJW-KRWDZBQOSA-N 435.532 4.099 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)C(C)C)CC2)c(C)n1-c1cccc(Br)c1 918064423 ISLZWHUOYGLJIK-UHFFFAOYSA-N 446.389 4.233 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@H](NC(=O)OC(C)(C)C)C3)c2C)cc1 918681013 AOGUEDKCTQYKJJ-SFHVURJKSA-N 427.545 4.232 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cnn(-c3ccc(Cl)cc3)n2)cc1 1125961764 FRTZTVQVJOOYLK-UHFFFAOYSA-N 437.853 4.191 10 10 IICE CCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1cccc(Cl)c1 1130185454 IGNAGYOTWNOMBT-QGZVFWFLSA-N 438.959 4.353 10 10 IICE Cc1cc(CC(=O)N2CCCS(=O)(=O)C[C@@H]2c2ccccc2)c(C)n1-c1ccccc1 1134441669 IHYWABMIMNUDLA-XMMPIXPASA-N 436.577 4.025 10 10 IICE Cc1cc(C(=O)NCCc2csc(N(C)C)n2)c(C)n1-c1ccc(Br)cc1 1136564458 HDUOELCYCHUFFS-UHFFFAOYSA-N 447.402 4.352 10 10 IICE COc1cccc([C@@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c2nccn2C)c1 1149424341 BOBZXWJDFGDGJA-XMMPIXPASA-N 442.519 4.168 10 10 IICE CCn1c(SCC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)nnc1-c1cccs1 1162108791 UPXRHQFFAAONPD-INIZCTEOSA-N 443.642 4.240 10 10 IICE COc1ccc(N(CCc2ccccc2)Cc2c(I)cnn2C)cc1 1191890766 BPDZAYHOFIUFQI-UHFFFAOYSA-N 447.320 4.283 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1ccccc1F)C1CCC1 1229780202 GFHVFYVVHCCASL-UHFFFAOYSA-N 433.474 4.205 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CC(=O)OC(C)(C)C)C2CCC2)CCCC1 1277668658 WOYRRRYDWYTZEV-UHFFFAOYSA-N 426.557 4.252 10 10 IICE Cc1ccc(F)c(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1293793524 QKEHEILUPVXTJQ-OAQYLSRUSA-N 429.536 4.125 10 10 IICE Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2)n1 1294859135 JJUAVWRYGOFBRN-OAQYLSRUSA-N 438.959 4.243 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@](C)(CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1295275442 SOGPKQICGKKFSW-RUZDIDTESA-N 447.620 4.311 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@@H]1Oc1ccccc1 1296810638 BAUSHCKKMIQYSL-CAOCKLPOSA-N 436.552 4.259 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C 1312805410 IKLNBBJEOOLDQX-CPJSRVTESA-N 440.632 4.381 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H]1c1ncc(Br)cn1 1312885478 QAPVOTGWTDIZNX-DNVCBOLYSA-N 446.393 4.091 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc2cc(Br)cnc2n1C 1350045612 UYLKOZOVJKDKAO-UHFFFAOYSA-N 429.362 4.453 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(OC)c1 1357835526 GDXIDNFXTUSCOE-IRXDYDNUSA-N 430.520 4.167 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCSC1 1359680954 KRPVOIHBIBDVEP-HXUWFJFHSA-N 429.634 4.018 10 10 IICE CC1(C)OC(=O)c2ccccc2[C@@H]1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333609 SCPZXOVUOURZET-FOIQADDNSA-N 444.478 4.106 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(NC(=O)OCC(F)(F)F)cc2)cc1 1437379645 JPXVEVRZBASZQT-UHFFFAOYSA-N 439.434 4.014 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)OC(C)(C)C 1448439723 QUNSHZASIWIQKI-SFHVURJKSA-N 442.560 4.391 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 1469248435 HXOKJLYULRUIFJ-GOSISDBHSA-N 444.318 4.168 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3C[C@H]3c3ccccc3Br)CC2)cc1 1469968895 FLBTXVKGRTYADX-PZJWPPBQSA-N 444.373 4.236 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@H]3c3ccc(Br)cc3)C2)cc1 1478861308 XWCBUDQFHGAYAS-KKSFZXQISA-N 444.373 4.441 10 10 IICE CC(C)[C@@H](CCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)OC(C)(C)C 1479013803 XVFGRSHERHOCTM-VQTJNVASSA-N 449.592 4.022 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1cc(Cl)cc(Cl)c1F 1479126921 TWMPNGVXRAMGOT-UHFFFAOYSA-N 426.319 4.311 10 10 IICE Cc1ncc(CN(C)c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)s1 1511584310 IPGFSPBYBMXZQI-FQEVSTJZSA-N 444.580 4.174 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCC[C@H]3C)CC2)cc1F 1518307488 DPDKQJHFJAJYOI-MSOLQXFVSA-N 429.584 4.486 10 10 IICE CCC(CC)N(CCOC)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1525186474 GBNNMMNBUIMZBU-JXAWBTAJSA-N 438.590 4.081 10 10 IICE Cc1cccnc1Oc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1535345715 LSNVMFKIMHITCK-UHFFFAOYSA-N 439.462 4.227 10 10 IICE Cc1c(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc(CNC(=O)OC(C)(C)C)n1C 1540567236 FFGDKHZIUOYCAM-UHFFFAOYSA-N 440.588 4.231 10 10 IICE CC[C@@H](C)NC(=O)c1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1540845501 ZICVDZZRLCXUIW-QGZVFWFLSA-N 431.536 4.365 10 10 IICE CN(c1ccc(CNC(=O)C[C@@H]2COCCN2C(=O)OC(C)(C)C)cc1)C1CCCCC1 1542411916 FFIDHEKOOUWVDB-JOCHJYFZSA-N 445.604 4.098 10 10 IICE Cc1cccc(OCc2nnc(N3CCO[C@@H](C)C3)n2CCCSc2nccs2)c1 1542686357 MIMWRNAKWMFJJZ-KRWDZBQOSA-N 445.614 4.030 10 10 IICE Cc1cc(C(=O)N[C@H](C(C)C)[C@H](CO)C(C)C)c(C)n1-c1ccc(Br)cn1 1556712894 ZJHLABHLNPCALK-UYAOXDASSA-N 436.394 4.271 10 10 IICE Cn1c(C(=O)NCc2ccc(N3CCCCC3)cc2)cc2cc(Br)cnc21 1557139464 DQARWAGHOZHNSL-UHFFFAOYSA-N 427.346 4.256 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N2CCOc3c(F)cc(F)cc32)C1 1586450477 GZAULAKSPGJZLN-UHFFFAOYSA-N 430.451 4.297 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3[C@H](CCCN3C)C2)c(C)n1-c1ccccc1Br 1587989992 JPKOGANRWOXUCS-XLIONFOSSA-N 430.390 4.413 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@H](C2CCC2)CC1 1588094830 CNKQSOAOADXGAI-INIZCTEOSA-N 434.583 4.297 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1csc([C@@H](C)NC(=O)OC(C)(C)C)n1 1597781668 UBGWILCNDDSLMK-OAHLLOKOSA-N 432.590 4.457 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2cccc(C)n2)n1CCCSc1nccs1 1615569205 ZCCGFBUNJCLIBA-KRWDZBQOSA-N 444.630 4.293 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C[C@@H]1C(=O)Nc2c(Br)cccc21 1617879753 MPXHWGJVFOLYDR-INIZCTEOSA-N 431.330 4.409 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC2CC2)c2ccc(OC)cc2)sc(C(C)=O)c1C 1618018570 MALRTDWIUTZWPQ-UHFFFAOYSA-N 444.553 4.300 10 10 IICE CCON(Cc1ccccc1)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1618583059 NHHMISCQUKOASX-KRWDZBQOSA-N 428.488 4.243 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1624535527 GTOVPEZRLZRWTB-GDBMZVCRSA-N 433.394 4.102 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1625027906 UFDGEEHETGVIIC-UHFFFAOYSA-N 447.535 4.275 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2cccc(CSCc3ccccc3)c2)c1 1628082311 NEQKLGXKZMRYFC-UHFFFAOYSA-N 442.562 4.449 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCCCN1Cc1ccccc1 1635940752 ILNJASHYBJIORR-XZOQPEGZSA-N 442.003 4.181 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3sc(C)cc3Br)C2)cc1 1636354511 ZCZVZWVNLCDWER-CQSZACIVSA-N 438.391 4.153 10 10 IICE CCOc1ccc(N2CCN([C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)CC2)cc1 1642355276 YUYONBGRTMOAMT-OAQYLSRUSA-N 434.367 4.320 10 10 IICE O=C(CN(Cc1ccccc1O)C1CCCC1)Nc1ccccc1C(=O)NC1CCCC1 1644565153 FSNNNZWGUBQBQW-UHFFFAOYSA-N 435.568 4.448 10 10 IICE Cc1cc(C(=O)NCc2nc(CN(C)C)cs2)c(C)n1-c1ccccc1Br 1644883989 LWQQVUXXJICDBC-UHFFFAOYSA-N 447.402 4.305 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1680563093 PAJDIAAUVXHTBP-OXJNMPFZSA-N 433.955 4.118 10 10 IICE CO[C@H](Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 1697173620 OSLLPFOSPNDEBY-JOCHJYFZSA-N 443.636 4.011 10 10 IICE Cc1nnc(N2CCC(Oc3cccc(C#N)c3)CC2)n1CCCSc1nccs1 1707888751 NWHTUUPFANNOKI-UHFFFAOYSA-N 440.598 4.145 10 10 IICE CC[C@H](C)c1nnc(N2CCc3c(ccnc3N(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1726956430 KUSAUDOJEMCQLR-SFHVURJKSA-N 447.631 4.238 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCOC[C@H]1C 1741433378 HZSXQIVABVUVNY-IFMALSPDSA-N 425.621 4.386 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCC3(OC)CCC3)CC2)cc1 1768703922 YTIXQSWMVWNANU-UHFFFAOYSA-N 427.593 4.086 10 10 IICE Cc1cccc(Cn2cccc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c2=O)c1 1861857650 FUPBQURLEWXCSI-UHFFFAOYSA-N 448.478 4.233 10 10 IICE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2cc(Br)ccc2I)C1 1912147624 YPMOUCABFLEKHP-SECBINFHSA-N 449.090 4.216 10 10 IICE CSc1ccc(C=C2SC(=O)N(CCNC(=O)[C@@H](C)Oc3ccccc3)C2=O)cc1 2042444238 LAIZZRNTNNHQCR-OAHLLOKOSA-N 442.562 4.029 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236056348 VEQIDBNQFZYINT-AWEZNQCLSA-N 443.382 4.290 10 10 IICE CCC1=NN2C(=N)C(=Cc3ccc(OCCOc4cccc(C)c4)cc3)C(=O)N=C2S1 2293355689 WXOPVHVPRGMKMX-UHFFFAOYSA-N 434.521 4.482 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(NS(=O)(=O)c2ccc(C)cc2)C1=O 2296883030 KCPBIJRLUJKCAR-UHFFFAOYSA-N 430.576 4.036 10 10 IICE O=C1C(=Cc2cccc(F)c2)SC(=S)N1CC(=O)N1CCCC[C@@H]1c1cccnc1 2297471072 WNZTTXMNTGEIAJ-GOSISDBHSA-N 441.553 4.176 10 10 IICE Cc1ccc(CN(C)C(=O)CCCNC(=O)OCc2ccccc2)c(O)c1Br 2327603889 UIQRDFHZOJRFIS-UHFFFAOYSA-N 449.345 4.128 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352941326 PNGVTSWUHZMEJK-ZDUSSCGKSA-N 429.355 4.067 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](CC2CC2)NC(=O)OC(C)(C)C)c(O)c1Br 2380793709 UEUQZPIFVUNFHB-HNNXBMFYSA-N 441.366 4.115 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3cccc(O)c3)SC2=S)cc1 15040093 CRXXVRXTHAJVFN-RGEXLXHISA-N 442.562 4.411 10 10 IICE CCN1C(=O)/C(=C\c2cc(C)n(-c3ccc(Cl)c([N+](=O)[O-])c3)c2C)C(O)=NC1=S 33311409 KDPPMOGDDSBWAQ-ZSOIEALJSA-N 432.889 4.143 10 10 IICE CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1OCc1ccccc1C 33332246 LCWSYRBJKCGSFK-JCMHNJIXSA-N 428.488 4.434 10 10 IICE CCN1C(=O)/C(=C/c2c(NC3CCC(C)CC3)nc3c(C)cccn3c2=O)SC1=S 33457677 KNONNKWVNIXDOU-ATVHPVEESA-N 442.610 4.215 10 10 IICE CCCCCCN1C(=O)/C(=C2/SC(=S)N(CC(=O)OCCC)C2=O)c2ccccc21 98027904 OMSZLJKALBUMPZ-VHEBQXMUSA-N 446.594 4.138 10 10 IICE CCN(CC)c1ccc(N2C(=O)/C(=C/c3ccccc3OCC(=O)O)SC2=S)cc1 210432871 QEQGYYXXUZOARV-UYRXBGFRSA-N 442.562 4.402 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H]3C[C@H]3c3cccc4ccccc34)CC2)cc1 730769387 FDPAVVJIXDFGML-RRPNLBNLSA-N 443.591 4.280 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c1O 740857472 PBSZRTMDRIFXGF-QRWLVFNGSA-N 428.529 4.067 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C/c2ccccc2OCC(F)(F)F)SC1=S 742347002 SPMSTXUOHQYEIJ-UVTDQMKNSA-N 433.473 4.474 10 10 IICE Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742798455 NUNKBFDWXAPUJU-GOSISDBHSA-N 434.531 4.085 10 10 IICE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1c1cccc(F)c1 746760462 XDWARJIVJCGFMP-MWTRTKDXSA-N 429.511 4.219 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N(C)Cc3nc4c(s3)CCCC4)cc2F)C[C@H](C)O1 747495718 MPVFUGPITJTDQR-HOTGVXAUSA-N 446.592 4.116 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2[C@@H](C)CC(O)C[C@@H]2C)sc(C)c1-c1ccccc1 759484665 VNMLVMXRCUCNMX-HOTGVXAUSA-N 444.597 4.463 10 10 IICE CC(=O)OCCc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 768187457 OCETVSZWQCOJMM-UHFFFAOYSA-N 433.552 4.152 10 10 IICE COc1ccc(CNC(=O)N[C@@H](c2ccc(Cl)cc2)C2C[C@@H]3CC[C@H](C2)N3C)c(O)c1 801804492 MXLVNNUXMWEMPT-FVCZFXSJSA-N 443.975 4.468 10 10 IICE C[C@@H](NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccc(N2CCOCC2)cc1Cl 808728669 QQTAZDHFZGVAPD-OAHLLOKOSA-N 428.920 4.459 10 10 IICE Cc1ccc2occ(CC(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)c2c1 1125130932 CCHHGHBVOSQHML-UHFFFAOYSA-N 432.442 4.456 10 10 IICE Cc1cccnc1CCCNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1128967996 FIOCOPUJMFAXPV-NBVRZTHBSA-N 445.635 4.182 10 10 IICE CN1CCN(c2ccc(CNC(=O)C[C@@H](Cc3ccccc3)c3ccccc3)cc2)CC1 1132898866 HHRGUFHLLHJMRR-AREMUKBSSA-N 427.592 4.471 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c2ccc(F)cc2F)cc1F 1136454211 PAGZILYPSWHSGO-LJQANCHMSA-N 437.462 4.052 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccc(Cl)cc1 1136733653 CZYOWIXWROHTPX-HXUWFJFHSA-N 425.891 4.422 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C2)c1 1136789746 CGEWLKMMKKVYHT-QZTJIDSGSA-N 439.556 4.377 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)cc1F 1144977846 NBRNCVAISGHFCV-UHFFFAOYSA-N 431.515 4.395 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)c([N+](=O)[O-])c1 1162949340 NBMJOESYGQDQLM-ANGAQGJPSA-N 439.516 4.331 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2nccn2-c2cccc(C)c2C)cc1 1164596912 FDIAPJWHSAQYDC-UHFFFAOYSA-N 438.597 4.185 10 10 IICE Cc1cc(CC(=O)N2CCCN(C(=O)Cc3cccc(F)c3)CC2)c(C)n1-c1ccccc1 1294532022 OTDZUBNMOIQAMR-UHFFFAOYSA-N 447.554 4.079 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)CS(=O)(=O)CC 1294592679 HOCJRGYLPWZBRS-GOSISDBHSA-N 443.617 4.022 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CC[C@@H]1CCCCO1 1314753038 KUQAVYGJCLEKJJ-TUNNFDKTSA-N 442.604 4.498 10 10 IICE CCn1nc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1C1CC1 1355469043 JFVNSQUXKFRKLX-GZTJUZNOSA-N 444.557 4.150 10 10 IICE CCOc1ccc(C[C@@H](C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1357834737 AQOZSLAVXZBTHV-QRVBRYPASA-N 428.548 4.333 10 10 IICE CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@H](CC)CN1C(=O)OCc1ccccc1 1444317952 HBBUIHBKTYJFEC-MOPGFXCFSA-N 426.513 4.058 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCCNC(=O)/C=C\c3ccccc3)c2C)cc1 1448193334 GUWLVYRMLOJFTE-GDNBJRDFSA-N 431.536 4.052 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1 1450705027 MKQICVASTQSMQQ-UHFFFAOYSA-N 437.565 4.404 10 10 IICE Cc1ccc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)n1 1464604325 LSLCVLJGTPVCOA-SFHVURJKSA-N 432.362 4.040 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3ccc(Cl)cc3Br)CC2)cc1 1466208398 ILHHIHZVDDDBMV-UHFFFAOYSA-N 437.765 4.393 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 1469946677 VYCBDCTVXCRTQA-SAABIXHNSA-N 435.902 4.200 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 1470044116 WKQQSCIMKNCLJG-UHFFFAOYSA-N 438.538 4.234 10 10 IICE CC(C)(C)OC(=O)NCCC[C@@H](NC(=O)NCc1c(O)cccc1F)c1ccccc1 1470371514 FJBZVSBAORIEIM-LJQANCHMSA-N 431.508 4.377 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1 1471013855 ZGUUKQBDBQRCCG-HZPDHXFCSA-N 435.565 4.187 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)C2CC2)cc1 1478832502 ADIAGJQHBYZCTR-RBUKOAKNSA-N 430.593 4.120 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCSc1nccs1 1492781070 KVAWRNISKKRAPU-UHFFFAOYSA-N 428.631 4.462 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCS[C@H](C)[C@@H]1C 1510684023 WGPYYSRARMUJGN-RBUKOAKNSA-N 436.629 4.017 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@H](C)C1 1519135706 NIUVQOFPVNCKGU-HKUYNNGSSA-N 440.567 4.168 10 10 IICE COc1cccc(-c2cc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)on2)c1 1527481314 JAMAOJQJKJKHHO-HZPDHXFCSA-N 439.487 4.033 10 10 IICE O=C(COc1ccc2c(c1)CCCC2)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1539582069 OLJUIWUOEABCRV-IBGZPJMESA-N 430.495 4.331 10 10 IICE COc1cccc2c1CC[C@@]2(NC(=O)OC(C)(C)C)C(=O)NCc1cc(Cl)ccc1O 1557386567 IZOFTGPGQJYDEE-QHCPKHFHSA-N 446.931 4.037 10 10 IICE Brc1cc(CNCc2nncn2-c2ccccc2)ccc1N1CCCCC1 1560262622 JHJOEDKEVLYUGN-UHFFFAOYSA-N 426.362 4.310 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC[C@H](C3CC3)N2C(=O)OC(C)(C)C)cc1F 1565688492 ZEFRDFIWZSNEMB-TZIWHRDSSA-N 433.568 4.466 10 10 IICE COC(=O)C1(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCCC1 1566255602 RGEABZXHLAGZEZ-UHFFFAOYSA-N 433.346 4.320 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)c2C)cc1 1569583314 KRMGSKGKTNMYFG-QZTJIDSGSA-N 425.573 4.210 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(C)C)C(=O)N2CCOCC2)c(C)n1-c1ccc(C(C)C)cc1 1570677884 QCYRAUVVKWVNSN-DEOSSOPVSA-N 439.600 4.221 10 10 IICE C[C@]1(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C[C@@]1(F)Cl 1586777703 KWKAAVSHARYUEQ-DTVHYBFXSA-N 444.956 4.238 10 10 IICE Cc1ccc(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)cc1-n1c(C)cc(C=O)c1C 1611468851 GGSJOIYSRLGVKY-QGZVFWFLSA-N 429.520 4.225 10 10 IICE CO[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC[C@H]1C 1619525959 OBNDJECUIVQPCJ-GCJKJVERSA-N 425.621 4.159 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCc4cc(C(C)C)ccc43)CC2)cc1 1624985576 SUCBKEGDDOYHIM-SEYXRHQNSA-N 447.579 4.003 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3C[C@H]4CCN(C(=O)OC(C)(C)C)C[C@H]43)c2C)cc1 1627004216 CNKOGAOLGZTAQH-XMSQKQJNSA-N 439.556 4.184 10 10 IICE COc1ccccc1C1(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 1630257444 WLJGWHRWOQSKSN-LJQANCHMSA-N 428.960 4.257 10 10 IICE COc1ccccc1CN1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1632381910 RMUHEFPUZJSPAR-UHFFFAOYSA-N 445.563 4.182 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](OCC1CCCC1)c1ccccc1 1632701420 DWBOADHXVLUDCN-HSZRJFAPSA-N 445.943 4.495 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c(C)n1-c1cccc(Br)c1 1634690513 ZPHOLRTZUPCQRB-GIMINZRKSA-N 447.373 4.265 10 10 IICE Cc1ccc(C(=O)N2C[C@H](CCNC(=O)OC(C)(C)C)Cc3ccccc32)c(O)c1O 1645198264 SDQKLKJBDDIDPD-MRXNPFEDSA-N 426.513 4.140 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC(=O)NCc3c(O)ccc4c3CCCC4)C[C@H]2C1 1673507663 CTWRNXUEHDBFKV-FHWLQOOXSA-N 443.588 4.106 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@](O)(c2ccc(Cl)cc2)C1 1673745313 SWECTVJQGVDPMQ-UUOWRZLLSA-N 429.992 4.339 10 10 IICE CC(C)(C)OC(=O)N1c2ccccc2CC[C@@H]1CCNC(=O)NCc1ccccc1O 1683631455 OXAWMUILNGENKP-LJQANCHMSA-N 425.529 4.338 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN1CCCCC1 1694106860 ASSIONSLNCYUFM-NRFANRHFSA-N 440.636 4.003 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1710028564 XMDFRZVFCSPBMH-AREMUKBSSA-N 448.615 4.164 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1ccc(C)nc1 1727001687 IIMMLVVJYNAYOG-KRWDZBQOSA-N 438.551 4.018 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C(C)C)C1 1729150351 AJAAGNXRYSOYIF-QHCPKHFHSA-N 437.588 4.250 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC(F)C3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1742117780 SQTXYWCAMGTBCZ-PELRDEGISA-N 438.595 4.487 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)[C@H]2CCSC2)cc1 1746094658 XPOKAXXITLIUKH-QFIPXVFZSA-N 436.629 4.100 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1CCC(OC)CC1 1747029422 CZXMHJTVVSSRLR-UHFFFAOYSA-N 441.620 4.256 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1C[C@@H](O)CC2(CCCC2)C1 1761697706 CWBSKMSYLMPCSI-QFIPXVFZSA-N 439.648 4.421 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(C3CCC3)C[C@@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1761886047 LDFCDRJNDNSZCX-RTBURBONSA-N 442.627 4.356 10 10 IICE CC[C@H](C)c1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763821488 PMXRJSLFIACFOZ-KRWDZBQOSA-N 447.624 4.147 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N(C)C2CCC(NC(C)=O)CC2)cc1 1764931608 ULWMPPVLLGTLET-UHFFFAOYSA-N 440.636 4.180 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1765070598 BHSOZZHYRMXAMS-HTAPYJJXSA-N 435.620 4.187 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1771455144 VYWVTPNQSDSRCA-LJQANCHMSA-N 438.645 4.264 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3ccc([N+](=O)[O-])s3)SC2=S)N(C)C)cc1 1858594451 ZWVFVHDTJLBIGE-VGVSSDJJSA-N 449.579 4.169 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)Oc2ccc(N)cc2)sc(C(=O)OCC(C)C)c1C 1860083595 SFXMQYQDQZKFCE-AWEZNQCLSA-N 448.541 4.034 10 10 IICE Cc1ccc(N=c2nc(N(C)Cc3ccccc3)[nH]c(N(C)Cc3ccccc3)n2)c(O)c1 1871731225 CJKUKQLTEQDBIT-UHFFFAOYSA-N 440.551 4.324 10 10 IICE CN(C)c1cccc(NC(=O)c2cccc(NC(=O)N3CCN(c4ccccc4)CC3)c2)c1 1873894899 DDXMQXYOXRGMBB-UHFFFAOYSA-N 443.551 4.359 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](CNCc2cc(Br)ccc2O)(C2CC2)C1 2093193633 SWWJDFAJVUIVSZ-FQEVSTJZSA-N 425.367 4.282 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccc(F)cc1 2314831798 SEEMDVCDXBRJNH-UHFFFAOYSA-N 445.497 4.354 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccc(O[C@H](C)C(=O)O)cc3)SC2=S)cc1 2314929287 KMITWFPXVNCILG-CYBMUJFWSA-N 429.519 4.343 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3C[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(O)c1Br 2352682484 YEMKSQCQRHJOEU-KLHDSHLOSA-N 425.367 4.245 10 10 IICE Cc1ccc(CNC[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)c(O)c1Br 2381140461 KTYYQZREBQYQJY-AWEZNQCLSA-N 449.336 4.445 10 10 IICE COc1cc([C@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@H]32)ccc1O 14459034 VYITUVMZDWJWNS-XLNZFTOWSA-N 440.565 4.402 10 10 IICE NS(=O)(=O)c1cc2c3c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N3C[C@H]1CC=C[C@H]21 15658639 FUJFNZKSUFSRDU-UKFDBNNRSA-N 449.532 4.137 10 10 IICE CCCCCN1C(=O)/C(=C2\SC(=S)N(CCCCCC(=O)O)C2=O)c2ccccc21 40927743 CXMXKOYYRREUPE-HNENSFHCSA-N 446.594 4.440 10 10 IICE O=C(Nc1ccc(F)cc1)c1ccc(N2CC[C@@H](NCc3cc(Cl)ccc3O)C2)nc1 65257012 GHVUCPTTZVEEJU-HXUWFJFHSA-N 440.906 4.201 10 10 IICE CC(=O)N1CCCc2cc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)ccc21 435688173 MNXKIUNLKLLPOJ-UHFFFAOYSA-N 444.579 4.346 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cc(OC)ccc3OC)[C@@H]2c2ccc(O)c(O)c2)cc1 526218043 HAECRRYHZJSJCZ-QHCPKHFHSA-N 449.459 4.181 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3cccc(C)c3)[C@H]2c2ccc(O)c(O)c2)c1 526324286 YFLPRZMBEQAXBM-QHCPKHFHSA-N 433.460 4.481 10 10 IICE CC1CCN(c2ccc(CNC(=O)CSCC(=O)Nc3ccc(F)cc3)cc2)CC1 731053277 LKWBFKLUGQODNS-UHFFFAOYSA-N 429.561 4.050 10 10 IICE COc1ccc(N2CCN(Cn3nc(C(C)C)n(Cc4ccco4)c3=S)CC2)cc1F 754015135 WPIQPZVDNTYAFF-UHFFFAOYSA-N 445.564 4.106 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)c3ccc([N+](=O)[O-])cn3)c2C)c1 761985691 KSXAHFMCENBAHY-UHFFFAOYSA-N 425.466 4.159 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc([C@H]2CCCOC2)c1 768532758 GTEBXRZIDDHZSE-VWLOTQADSA-N 433.596 4.043 10 10 IICE Cn1ncc(Br)c1/C=C1\SC(=S)N(CCSc2ccccc2)C1=O 778245194 FUYFKHLQISOMDG-ZROIWOOFSA-N 440.413 4.176 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N(C)[C@H]3CCCC[C@H]3C(F)(F)F)cc2F)CC1 813063264 OKFYKACGLAUSON-MJGOQNOKSA-N 444.517 4.230 10 10 IICE O=C(C[C@H](c1ccc(O)cc1)C1CC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472228 IXHCWTOJLIZXJZ-IRLDBZIGSA-N 428.960 4.416 10 10 IICE COC(=O)[C@@H]1CCN(Cc2c(O)ccc3c(=O)c(-c4ccccc4Cl)c(C)oc23)C1 917478716 CCVFEWXNFUTUTR-CQSZACIVSA-N 427.884 4.122 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC1CCC(F)(F)CC1 1128338443 ONYLRWHCPLAFGP-WJDWOHSUSA-N 442.528 4.359 10 10 IICE C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661174 IHWOREOKBIDWDP-INIZCTEOSA-N 432.511 4.183 10 10 IICE COCc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1F 1136903478 DXFMEFSEJSSBSV-OAQYLSRUSA-N 445.535 4.034 10 10 IICE CC[C@@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1141985237 LLPNSMDUQINJKI-WIYYLYMNSA-N 433.593 4.063 10 10 IICE Cc1ccc(C(=O)Nc2nc(C3CCN(C(=O)OC(C)(C)C)CC3)cs2)c(O)c1O 1160348786 XSQLWDWTFFRTPC-UHFFFAOYSA-N 433.530 4.230 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)OCCN(Cc1ccc(N3CCOCC3)cc1)C2 1175643580 XIAVGXBXUZPVHY-UHFFFAOYSA-N 439.556 4.265 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(-c4cccs4)cc3)CC2)c(OC)c1 1230763597 CSGLBQYXYYBUFK-UHFFFAOYSA-N 437.565 4.464 10 10 IICE C[C@@H]1CC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)CN1C(=O)OC(C)(C)C 1234107043 OMZAYGNCMLPAOM-BXUZGUMPSA-N 432.348 4.286 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)C2)cc1 1252922040 CWQCDOVUQXOZCT-IHRRRGAJSA-N 439.400 4.046 10 10 IICE CC(C)(CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C(F)(F)F 1270087212 LAOBODZJXBVPDU-LCYFTJDESA-N 434.480 4.122 10 10 IICE COc1ccc(CNC(=O)c2ccc(Cn3cc(Cl)c(C(F)(F)F)n3)cc2)c(O)c1 1296968784 RALYORYDQKQZAM-UHFFFAOYSA-N 439.821 4.248 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1297230188 SJJVIMBHZWCJBJ-OAQYLSRUSA-N 429.634 4.041 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(Cl)c(F)c1 1305083786 CLRSOSKAUCVIGK-KUHUBIRLSA-N 439.314 4.453 10 10 IICE CN(Cc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(N2CCOCC2)cc1 1307958338 UABHXRYHGQZEBK-UHFFFAOYSA-N 437.584 4.453 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)[C@H](C)c1cccc(N2CCOC2=O)c1 1312886032 TXWKDMGOKPDIDV-RTBURBONSA-N 438.572 4.351 10 10 IICE CCOCc1nnc(N2CCC[C@]3(CC=CCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1314377734 MIZGGGCQNWLYDF-XMMPIXPASA-N 427.568 4.395 10 10 IICE C[C@@H](NC(=O)c1ccccc1Sc1ccc(S(C)(=O)=O)cc1)c1ccccc1O 1454808117 SUXOQWGQAVYGGQ-OAHLLOKOSA-N 427.547 4.438 10 10 IICE Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)NCc1cccc(Br)c1O 1467761832 UZSCURYLLHFFTM-UHFFFAOYSA-N 438.684 4.371 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCC[C@@H]3CCC(=O)OC(C)(C)C)C2)cc1 1470594989 YHTLBSARFUMHFV-TZIWHRDSSA-N 445.604 4.208 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@]3(C)Cc3cc(F)c(F)c(F)c3)C2)cc1 1470771339 DGUQNTVDNGKDCS-BXKMTCNYSA-N 447.501 4.498 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@H]2Cc2ccccc2Cl)N(C)C)cc1 1479533654 ICUQKCFBNQQLHN-GGAORHGYSA-N 429.008 4.425 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N(C)Cc1cn(C)nc1C(F)(F)F 1510679887 VNFUPKMDIGERLT-UHFFFAOYSA-N 449.525 4.213 10 10 IICE CCCCCn1cc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)c(C)n1 1514421952 RJULXCNUZBNHTK-JOCHJYFZSA-N 438.576 4.215 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CC1CC(C)(C)C1 1517119567 IAJSBZOYHXXXBQ-UHFFFAOYSA-N 425.621 4.485 10 10 IICE Cc1ccc(F)c(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1526177181 RCEXODSPMPGJSG-CPNJWEJPSA-N 446.544 4.223 10 10 IICE Cc1ccc(Cc2nc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cs2)cc1 1535346342 UPMGRGPGGWRKDM-UHFFFAOYSA-N 443.519 4.087 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnn(C)c2)nnc1N(Cc1ccco1)C(C)C 1542227303 YQHKCKYNYMYNLK-UHFFFAOYSA-N 433.560 4.109 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1 1542490758 XRUYKFAKUXYRMR-SFTDATJTSA-N 436.474 4.013 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4cccc(C)c4)cn3)CC2)c(OC)c1 1543631425 BQWVRBWHLSWGCS-UHFFFAOYSA-N 433.508 4.162 10 10 IICE Cc1noc(C)c1C[C@H](C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1544109112 SJWMWFZQJWQFQD-NSHDSACASA-N 431.334 4.217 10 10 IICE CCC(=O)N[C@@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(CC)CC)cc2)C1 1545164938 NEZACBLZVGTBIV-PZJWPPBQSA-N 440.636 4.181 10 10 IICE Cc1cc(C)n(-c2ccc(C(=O)Nc3cccc(N4CCN(C(C)C)CC4)c3)cc2F)n1 1556090500 YOFAZPCRLVDUDH-UHFFFAOYSA-N 435.547 4.411 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2CC(=O)N1CCCN(Cc2ccccc2C)CC1 1559927049 FTZHRKMIWDYQKX-RUZDIDTESA-N 449.639 4.373 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c(C)n1-c1cccc(Br)c1 1587227830 XZOSSSXJXSRLPJ-SXLOBPIMSA-N 431.374 4.478 10 10 IICE COc1ccc(NS(C)(=O)=O)cc1NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1587924314 KEPPZWRDLUPLTK-UHFFFAOYSA-N 447.944 4.380 10 10 IICE CC(C)c1nc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)nn1-c1c(Cl)cccc1Cl 1611432137 WSIIGJAHKNKHHO-GFCCVEGCSA-N 449.338 4.470 10 10 IICE COc1ccc2c(c1)c(C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)c(C)n2C 1622635251 VIOSFGQGYBHSBK-GOSISDBHSA-N 441.959 4.249 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)CC2)c(OC)c1 1623759547 HMKHVMMSBFZAMG-RTBURBONSA-N 435.351 4.463 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)cc1 1630497965 ZCGWNXRPKKMDCU-QFIPXVFZSA-N 435.955 4.498 10 10 IICE Cc1cc(C(=O)N2CCOc3ncccc3C2)c(C)n1-c1cccc(Br)c1 1632409587 ZFQLDZGBNIVLPL-UHFFFAOYSA-N 426.314 4.286 10 10 IICE Cc1ccnc(Oc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)c1 1634347479 JAUYDAPHCPHHLN-UHFFFAOYSA-N 431.536 4.321 10 10 IICE Cc1cc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(C)n1-c1ccccc1 1637228218 HKDDCXBUXCZCPA-UHFFFAOYSA-N 432.568 4.055 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](CC(N)=O)c3ccccc3Cl)c2C)c1 1637577595 DXBJAXBSBVJFSY-QFIPXVFZSA-N 438.959 4.472 10 10 IICE C[C@@]1(NC(=O)/C=C\c2ccc(O)c(O)c2)CN(Cc2ccccc2)C[C@H]1c1ccccc1 1645813044 JJSHUEVJUPJNGB-AIXIFZESSA-N 428.532 4.286 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccc(C(=O)N=[S@](C)(=O)N(C)C)cc1 1647826440 XKDAEDDGFJXHPD-PMERELPUSA-N 444.582 4.123 10 10 IICE Cc1cc(C(=O)CSc2nnnn2CC(C)C)c(C)n1-c1cccc(Br)c1 1652553946 KNWBZCNRIOGONO-UHFFFAOYSA-N 448.390 4.474 10 10 IICE CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)o1 1684280791 QKPVWBFNEWBZNU-WZONZLPQSA-N 425.573 4.486 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC2(c3ccc(F)cc3F)CCCC2)N(C)C)cc1 1684606800 JRKDITVBKJECGA-JOCHJYFZSA-N 430.543 4.402 10 10 IICE C[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC(C)(C)O1 1693814054 YYSKVWDLYFLJJS-HOTGVXAUSA-N 437.635 4.162 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1712552680 WJNKCFFMKRPNFG-GOSISDBHSA-N 433.572 4.026 10 10 IICE CC(C)CN(c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1741549372 XAEVUMMPWSNSHB-QHCPKHFHSA-N 441.620 4.275 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccnc(C(F)(F)F)c1 1742756073 NYDUBFPFZBOROH-UHFFFAOYSA-N 430.478 4.285 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1745007105 VUJRVZLDMUIXLR-SIKLNZKXSA-N 434.588 4.238 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccco2)cc1F 1747571736 BVWHFOOMMVEVLT-UHFFFAOYSA-N 440.910 4.476 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)NC(C)C)nnc1N(C)[C@@H](C)C1CCCCC1 1751431813 NAGVTYKMHGEMTB-IBGZPJMESA-N 440.636 4.244 10 10 IICE Cc1ccccc1Cc1nnc(N(C)C[C@H]2CCCO2)n1CCCSc1nccs1 1762091658 IFFGYPMYJYIEBN-LJQANCHMSA-N 443.642 4.431 10 10 IICE CCCN(CCC)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc2c(c1)CCCN2C 1764353453 TVXGUYAKAITVLE-GMAHTHKFSA-N 441.620 4.059 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1764937312 PYODNUGITSXBDT-DEOSSOPVSA-N 448.615 4.020 10 10 IICE CCN(CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)CCC(F)(F)F 1766899480 ZOVYZADMFXUTSH-UHFFFAOYSA-N 441.542 4.483 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1Cc1sccc1Br 1767774033 FOQXVTWKOBNYKV-UHFFFAOYSA-N 437.363 4.029 10 10 IICE Cn1nc(CNCc2cc(Cl)cc(Br)c2O)c(Br)c1Cl 1966042061 MSCAJOWDRDRNMK-UHFFFAOYSA-N 443.954 4.247 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C2CC2)c(CO)c1I 2079983162 YRFNEIKXGCYIKK-OAHLLOKOSA-N 426.298 4.179 10 10 IICE CC[C@@H](C)N1C(=O)C(=C2C(=O)N(CC)c3ccc(Br)cc32)SC1=S 2296711309 LWLCPRBMYDXTQZ-SECBINFHSA-N 425.373 4.186 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3cccc(OC)c3)SC2=S)N(C)C)cc1 2318684212 ULUZAKNTRQBKJN-IBGZPJMESA-N 428.579 4.208 10 10 IICE CC[C@H](CCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352932805 RGQKDEDNLPCMOO-CYBMUJFWSA-N 429.355 4.020 10 10 IICE Cc1ccc(CN(C)C(=O)CCN(C(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380794063 XFKZBDYRQAKAFY-UHFFFAOYSA-N 441.366 4.211 10 10 IICE CCN1C(=O)/C(=C\c2ccc(NC(=O)/C=C/c3cccc([N+](=O)[O-])c3)cc2)SC1=S 6178517 KKAQFDMENGTPQN-AXXDXGDFSA-N 439.518 4.468 10 10 IICE C[C@H](Sc1nc2ccccc2n1C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 8808063 AZUPVBQNEHDVNF-AWEZNQCLSA-N 441.512 4.468 10 10 IICE CCOc1ccc(-c2ccc(/C=C3\C(=N)N4N=C(CC)SC4=NC3=O)o2)c([N+](=O)[O-])c1 20238678 OLXYSUYSSFDMFU-AZYSWTJUSA-N 439.453 4.283 10 10 IICE COc1ccc(N2CCOCC2)c(NC(=O)/C=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 206022214 DETTWCZBOTXQNN-FLIBITNWSA-N 449.463 4.352 10 10 IICE CCOc1ccc(N2C(=O)/C(=C/c3cccc(OCCC(=O)O)c3)SC2=S)cc1 210420000 OGYQTUJXAAUBPN-AQTBWJFISA-N 429.519 4.345 10 10 IICE COc1cc(F)c([N+](=O)[O-])c(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 301428741 FBBDRFZHZGTCIJ-UHFFFAOYSA-N 429.370 4.210 10 10 IICE [N-]=[N+]=NCc1cccc(C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)n1 381935950 UOTAOGBEBAUCSP-QFIPXVFZSA-N 443.463 4.426 10 10 IICE C[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cc(Br)cc(Cl)c1O 756561557 DXYDNCVVLHAATO-SJCJKPOMSA-N 425.754 4.158 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 768903810 LFILLOOTBMFGDX-UHFFFAOYSA-N 431.414 4.152 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(Br)c1 768910962 JMZZJPXYDFCCGX-UHFFFAOYSA-N 442.401 4.220 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCCc2cccnc21 776118273 OPCFSQAMPHDYKG-QFIPXVFZSA-N 426.536 4.057 10 10 IICE O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 778927898 VTQVVMJOVWCIOZ-WWNPGLIZSA-N 444.531 4.341 10 10 IICE CN1CCC[C@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)[C@H]1c1ccc(C(F)(F)F)cc1 779518654 LLMSEOAYRDHLTM-OSVAWIQDSA-N 434.458 4.329 10 10 IICE Cc1ccc(NC(=O)NCc2cc(Br)ccc2O)c(OC[C@H]2CCCO2)c1 806228896 ODFRFUKDSRDYDA-MRXNPFEDSA-N 435.318 4.343 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC[C@@H](c4ccccc4)O3)cc2F)C[C@@H](C)O1 811863936 GTIOCAXBTKJDAW-FQBFJXBRSA-N 441.547 4.159 10 10 IICE C[C@H](NC(=O)N1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1)c1ccc(N(C)C)cc1 812200068 NTWIEUNWKKSJFT-XJKSGUPXSA-N 425.455 4.238 10 10 IICE C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1ccc(-n2cncn2)cc1 919655704 XIRQUEADRWVBKL-IBGZPJMESA-N 444.539 4.399 10 10 IICE COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920869798 ALULNHDSLGXQEU-JPYJTQIMSA-N 439.556 4.148 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 1135800917 VMEPBLUJGASEIE-UHFFFAOYSA-N 440.341 4.163 10 10 IICE CNC(=O)c1ccc(CN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)C2CC2)cc1 1136514642 NQDZMUIOJPKTDS-UHFFFAOYSA-N 429.520 4.071 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NCc2cnn(C)c2)cc1 1137350421 MQPBSRAZLCTGJG-UHFFFAOYSA-N 443.345 4.163 10 10 IICE C[C@H](NC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1)c1ccc(N(C)C)cc1 1138363540 NXYGKXYVLFCULB-INIZCTEOSA-N 441.528 4.184 10 10 IICE Cc1cc(C(=O)NCc2c(O)ccc3ccccc23)ccc1NS(=O)(=O)C(F)(F)F 1157041266 AVBLGRBKVBEYDP-UHFFFAOYSA-N 438.427 4.045 10 10 IICE CCOCCNC(=O)CSc1ncc(-c2ccc(Br)cc2)n1CC(C)C 1188366461 YATQUXUOGATKOB-UHFFFAOYSA-N 440.407 4.213 10 10 IICE CSCC1(CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 1278765691 NAIKZMDAZIHINL-QINSGFPZSA-N 440.681 4.379 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC[C@@H]2CC[C@H](C(F)(F)F)O2)C1 1288684283 LHMFOVIFZCSPHU-HRAATJIYSA-N 437.506 4.024 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2C(=O)N2CCOCC2)c(C)n1-c1cccc(C(C)C)c1 1292758734 SWTGGTFCGCUDTJ-DEOSSOPVSA-N 437.584 4.071 10 10 IICE CCN1C[C@@H](C)N(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@@H]1C 1295985285 QYZYFYJDHBYUPM-JKSUJKDBSA-N 446.646 4.404 10 10 IICE Cc1cc(-c2nnc(N3CCCCCC3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1304195076 IYMYPRJXOGZMJO-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CCC(C)(C)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1305287323 ZDZMWJKFBFERCW-UHFFFAOYSA-N 448.615 4.173 10 10 IICE O=C(NCc1cccc(COC[C@H]2CCCO2)c1)NCc1cc(Cl)cc(Cl)c1O 1313049007 TXGZVJLUQVYQNN-GOSISDBHSA-N 439.339 4.394 10 10 IICE CCOCc1nnc(N2CCO[C@@](C)(C(C)(C)C)C2)n1Cc1ccc(N(CC)CC)cc1 1314407422 YGBXFAUSJKOHOF-RUZDIDTESA-N 443.636 4.351 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@@H]2CCCOC2)n1CCCOC(F)F 1314737781 VBWCUDALDVDDME-LJQANCHMSA-N 449.546 4.038 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](CCc3ccccc3)C(C)C)cc2F)CC1 1352969990 OOJZQMKISXRFLE-HSZRJFAPSA-N 425.592 4.489 10 10 IICE CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1464071823 TUTKZBARMJMUJU-UHFFFAOYSA-N 447.535 4.324 10 10 IICE O=C(NCCCSc1nccs1)c1cc(Br)cc(N2CCCC2)c1 1464903487 WGWPAYFRSMSQCH-UHFFFAOYSA-N 426.405 4.418 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@]2(C)CCO[C@H]2C2CC2)sc(C)c1-c1ccccc1 1473373262 RSGNYJXTRXKBFJ-URXFXBBRSA-N 442.581 4.386 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3c4ccccc4C(=O)N3C)cc2Cl)C1 1478528101 LVIBEWPYHBTKMJ-AOMKIAJQSA-N 440.975 4.202 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)SC)C1 1519478092 RWVRDAOKODLSEY-YLJYHZDGSA-N 425.602 4.329 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(=O)c(OCc2ccc(F)cc2)co1 1525762505 QXPIEIHZJNWIEV-QGZVFWFLSA-N 438.499 4.093 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2[C@@H]3CCCC[C@@H]3CCN2C(=O)OC(C)(C)C)cc1F 1527013375 AYCVFBZWNHRALP-OPYAIIAOSA-N 433.568 4.324 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2ccc(Br)cc2Cl)cc1 1527595635 NQEMTIZUDALYDL-UHFFFAOYSA-N 425.754 4.248 10 10 IICE C[C@@H](Cc1cccs1)N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1534082802 VJRGMPNVHOARCE-ZDUSSCGKSA-N 434.473 4.135 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@@H](C)N(C(=O)c1cc(-n3c(C)ccc3C)ccc1Cl)C2 1537957804 SKYNXGPFRMVYDR-MRXNPFEDSA-N 440.931 4.165 10 10 IICE Cc1cc(C(=O)NC[C@H](c2cccs2)N(C)C)c(C)n1-c1ccc(Br)cn1 1540342384 YCNLZEHHRMJGGF-QGZVFWFLSA-N 447.402 4.346 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3cc4ccc(C(C)(C)C)cc4[nH]3)CC2)cc1 1542432198 VXUDOMYCLMDOES-UHFFFAOYSA-N 434.584 4.026 10 10 IICE O=C(Cc1csc(C2CCCC2)n1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632387 JXADKXFAEUNLKL-GOSISDBHSA-N 434.005 4.483 10 10 IICE CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccc3cccnc3c2O)c1 1557123585 RFLJAWNFEMGNLK-UHFFFAOYSA-N 426.904 4.444 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)c3ccc(F)cc3)cc2Cl)C1 1564649307 AJQWNJBFMPFXCW-QFBILLFUSA-N 433.955 4.291 10 10 IICE CCN(CC)C(=O)CCC1CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 1564946247 LSQMUUDFNZQWDZ-HXUWFJFHSA-N 430.637 4.062 10 10 IICE CC1CCN(c2ccc(CNC(=O)C(F)(F)c3ncccc3Br)cc2)CC1 1565664104 VOAJGTMEZUDFAS-UHFFFAOYSA-N 438.316 4.489 10 10 IICE Cc1cc(CNC(=O)c2cccc(I)c2O)c(C)n1-c1ccccc1 1587025914 FIFZIECMTXCXMV-UHFFFAOYSA-N 446.288 4.334 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(Br)cc(C=O)c2)cc1 1627205389 QCBMVXQTYKTBJV-NRFANRHFSA-N 445.357 4.149 10 10 IICE COc1cc(I)c(Cl)cc1C(=O)N[C@@H](C)c1ccccc1O 1632250551 WDQRVQINFIJPMO-VIFPVBQESA-N 431.657 4.150 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc4cc(Br)ccc4o3)C2)cc1 1636853840 LGXKHNVGXGNIQZ-MRXNPFEDSA-N 444.329 4.282 10 10 IICE O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)NCc1ccc2cccnc2c1O 1643283196 KPHDRVYQGQHLPX-JOCHJYFZSA-N 425.488 4.118 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1c(O)cccc1F)c1ccc(C(F)(F)F)cc1 1645050110 CSTSCEUTSQDXCY-KRWDZBQOSA-N 442.409 4.432 10 10 IICE Cc1cc(C(=O)Cn2nc([N+](=O)[O-])cc2[N+](=O)[O-])c(C)n1-c1ccc(C(C)(C)C)cc1 1652855900 KORDUJAWXNGAIQ-UHFFFAOYSA-N 425.445 4.287 10 10 IICE COC1CCN(c2ccc(CN3CCCC[C@H]3COC(=O)N3CCCCC3)cc2)CC1 1658547364 LMGXOANKXRHVQG-QHCPKHFHSA-N 429.605 4.279 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccco3)Cc3ccccc3O)C2)cc1 1673823274 NUGBAIVSYDRFKU-LJQANCHMSA-N 435.524 4.232 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3oc(-c4ccccc4)cc3C2)N(C)C)cc1 1684607928 XOVZZWVEJDVYQO-QHCPKHFHSA-N 432.568 4.383 10 10 IICE Cc1cc(CCNC(=O)NC(C)(C)c2cn(-c3ccccc3)nn2)c(C)n1-c1ccccc1 1687217698 VGLGGPBNHWIQSA-UHFFFAOYSA-N 442.567 4.452 10 10 IICE Cc1nnc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)[C@H](C)CC#N)s1 1707850883 KNRHQCZHBZSXRW-OAHLLOKOSA-N 446.584 4.299 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)CNC(=O)OC(C)(C)C 1708398697 AVKHFRWPCRFGCS-SJORKVTESA-N 431.581 4.294 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@H]2C)n1Cc1ccc(N(CC)CC)cc1 1708724425 JMYOPTSIOBCSFW-RBUKOAKNSA-N 440.636 4.326 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC[S@@](=O)CC)C1 1709288450 IDWKGJNHJPFFFW-GEFUHLBYSA-N 439.629 4.358 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@@H](CCOC)C2)cc1 1728379218 HHBWIDPUKDSLOX-NRFANRHFSA-N 434.588 4.097 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H]3CCO[C@@H]3C(C)C)CC2)cc1 1730181910 VEAJTAMWYHLINX-NFBKMPQASA-N 441.620 4.188 10 10 IICE COCCC1(Cn2c(CC(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CC1 1730646765 OTFJWJUTVXEHSO-UHFFFAOYSA-N 441.620 4.019 10 10 IICE CC(C)Cc1nnc(N(Cc2ccco2)C(C)C)n1Cc1ccc(N2CCOCC2)cc1 1741440061 HUSDDJAWBAMRAX-UHFFFAOYSA-N 437.588 4.370 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](N3CCCC3)C2)n1CCCSc1nccs1 1743703985 ZLIBKTQLJIFLHF-ROUUACIJSA-N 434.679 4.495 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](OC)[C@H](OC)C1 1745075603 LVKYBLBLFHBVOI-IKVOXUJTSA-N 435.572 4.169 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ccsc1 1750708157 SVMVJYYHIDVRFA-UHFFFAOYSA-N 425.602 4.059 10 10 IICE COc1cccc(-c2nnc(N3CCC[C@@H](OC)C3)n2CCCSc2nccs2)c1 1770339274 CZKXBYBYMWRNAV-GOSISDBHSA-N 445.614 4.208 10 10 IICE Cc1cccc(-c2ncc(C(=O)O)c(=Nc3cccc4c3C(=O)c3ccccc3C4=O)[nH]2)c1 1859832879 QUAOCHNODWSEGM-UHFFFAOYSA-N 435.439 4.091 10 10 IICE CCN1C(=O)C(Nc2ccc([N+](=O)[O-])cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422678 JOOBOIOXRKCXLT-UHFFFAOYSA-N 430.464 4.214 10 10 IICE Cc1cc(O)c([C@H](C2CCC2)n2nc(C)c(CO)c2I)cc1C 2079939398 NPROQRRHQRVGNJ-KRWDZBQOSA-N 426.298 4.000 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1cccn1-c1ccccc1 2313564829 AQRIXVWVZDUFJJ-UHFFFAOYSA-N 426.259 4.451 10 10 IICE Cc1ccccc1Oc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C(C)C)C1=O 2314509757 YQGRFAFESHEBAG-UHFFFAOYSA-N 437.546 4.405 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(c3ccc4c(c3)OCO4)C2=O)c1)C(=O)O 2314932598 XDOVFERYLZAQGD-OAHLLOKOSA-N 443.502 4.063 10 10 IICE COc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(Cl)c(O)c(Cl)c3)C2=O)cc1Cl 2210933 NARYCXZZLHNNPX-ONNFQVAWSA-N 441.654 4.027 10 10 IICE N=C1/C(=C\c2cccn2-c2cccc(F)c2)C(=O)N=C2SC(COc3ccccc3)=NN12 32964238 QVQQLDSZDPSTPO-DMNVVODESA-N 445.479 4.315 10 10 IICE COc1cc2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)[nH]c2cc1OC 742800269 PYWCKFGGMUSBFR-OAHLLOKOSA-N 445.466 4.185 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)CC1 812266227 YJKOJFZEBRNEHQ-HSZRJFAPSA-N 447.583 4.315 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C/c3ccccc3C(F)(F)F)CC2)cc1 1124515465 GAOBVKIITVESTR-KPKJPENVSA-N 447.501 4.056 10 10 IICE COc1ccc(N(C)C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cc1 1130571767 OWNJIXHGPLTSGV-LGMDPLHJSA-N 432.592 4.401 10 10 IICE COC(=O)[C@@]1(C)CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@@H]1C 1151524237 UFZYFSCUGNAHRJ-ZSEKCTLFSA-N 433.346 4.128 10 10 IICE CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1152400872 GEOAINDMBZVSLU-RXVVDRJESA-N 442.556 4.412 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 1154026591 NPQUJMXLVJLKHN-OWYHZJEWSA-N 432.561 4.103 10 10 IICE COc1ccc([C@H](Cc2ccc(F)cc2)NCC(=O)NCc2ccc(N(C)C)cc2)cc1 1168800709 GCJSUYWTFJPNCL-VWLOTQADSA-N 435.543 4.090 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1c(F)cccc1F 1176323222 SPBYCXXCASTAJN-UONOGXRCSA-N 434.442 4.418 10 10 IICE COC(=O)[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1cc(C)cc(C)c1 1296804207 BOTLUFQFCHSGAK-RUZDIDTESA-N 432.520 4.096 10 10 IICE COc1cc(Cl)c(Br)cc1C(=O)Nc1cccc(N2CCOCC2)c1 1321104327 FPYWQZNGYGZURB-UHFFFAOYSA-N 425.710 4.200 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccnc2C(F)F)NC(=O)OC(C)(C)C)cc1 1444503554 KBTJCDHUQDELGG-KRWDZBQOSA-N 434.487 4.081 10 10 IICE CC1(C)CCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CCS1 1448734619 IHKIFFXFEWATEN-DTQAZKPQSA-N 438.615 4.161 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1 1458276647 LNLHDZXZXSJJHL-YCRREMRBSA-N 435.402 4.126 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(Cc3ccc(OC(F)(F)F)cc3)CC2)N(C)C)cc1 1463278753 GRFJWYFKCGJPCQ-NRFANRHFSA-N 449.517 4.393 10 10 IICE CN(c1ccc(CNC(=O)[C@@H](c2ccccc2F)N2CCOCC2)cc1)C1CCCCC1 1464540953 RLMJGHSIQBXRRV-RUZDIDTESA-N 439.575 4.284 10 10 IICE COc1cccc([C@H](O)CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1465913550 QOTUTKVAFZQMBM-OAQYLSRUSA-N 443.341 4.329 10 10 IICE CCn1c(=O)n(CC(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)c2ccccc21 1466399965 ZHUBZKGCTKAKPP-LJQANCHMSA-N 429.520 4.319 10 10 IICE Cc1cc(C(=O)NCc2cc3n(n2)CCCC3)c(C)n1-c1cccc(Br)c1 1469619798 WUHUCYVMZUSUTN-UHFFFAOYSA-N 427.346 4.319 10 10 IICE COc1ccc(N(CCC(C)C)CC(=O)NCC(=O)Nc2cccc(Cl)c2C)cc1 1473445704 UHLGZVYZBNCIQU-UHFFFAOYSA-N 431.964 4.264 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3c4ccccc4C(=O)N3C)cc2Cl)C1 1478528111 LVIBEWPYHBTKMJ-ZHRRBRCNSA-N 440.975 4.202 10 10 IICE CCC(CC)(Cn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C)OC 1513276276 LSZINBMMUMWLPX-UHFFFAOYSA-N 447.599 4.255 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCOC)CCO1 1514126547 QFWVKGTZKJQZFB-JOCHJYFZSA-N 437.588 4.394 10 10 IICE O=C(CCOc1cc(Cl)ccc1Cl)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524851282 LRCCSNULSBZVNS-UHFFFAOYSA-N 445.293 4.194 10 10 IICE COc1cccc(C2=NO[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)c1 1524936356 ARCPZHGPHNGELM-XMMPIXPASA-N 433.508 4.076 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)C[C@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543033867 RPCKOJDWNDRRIR-ROUUACIJSA-N 435.620 4.045 10 10 IICE Cc1ccc(Br)c2cc(C(=O)NCc3ccc(N4CCOCC4)cc3)[nH]c12 1543817613 NLRPJOXLOKIEQW-UHFFFAOYSA-N 428.330 4.005 10 10 IICE C[C@H](NC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)c1ccccc1O 1557967411 BJSCZEWAGKMQEZ-ZDUSSCGKSA-N 448.903 4.477 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](c3ccc(C(C)C)cc3)C(C)C)CC2)cc1 1559708311 PQKWROBCYDJACR-BDYUSTAISA-N 439.644 4.288 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](C(=O)NCC4CC4)C3)cc2Cl)C1 1564650452 XAQWQUAZKPVRIZ-YLJYHZDGSA-N 447.023 4.024 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccc(F)cc2F)c1 1566374760 SRWQYMKACIDWMC-BLVKFPJESA-N 436.455 4.122 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(=O)n(-c2ccccc2F)n1 1566846327 RPJGFHIKJDIMGY-SFHVURJKSA-N 443.478 4.481 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)cc1 1568710176 SCFATNMUEJBDDX-XUZZJYLKSA-N 448.588 4.476 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccccc2)N(C)C)c(C)n1-c1ccc(Br)cn1 1587215847 YIEPUBQEXHOFBP-HXUWFJFHSA-N 441.373 4.284 10 10 IICE CN(c1ccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)cc1)C1CCCCC1 1597949703 FLQUQFOQGAWICQ-UHFFFAOYSA-N 439.512 4.455 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(c3cccc(Br)c3)CC(=O)C2)cc1F 1616924795 NZABDFNEARFQLE-UHFFFAOYSA-N 447.348 4.352 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C(=O)c2ccc(Cl)cc2)CC1 1624056594 GOJSBEQZDLNACA-UHFFFAOYSA-N 449.938 4.158 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)COc1cccc(Br)c1 1631166446 FXEWXUZFZZZIFC-UHFFFAOYSA-N 443.135 4.345 10 10 IICE C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@@H](OC1CCOCC1)c1ccccc1 1632094472 WWTJWYDCDXJRNY-RCDICMHDSA-N 427.522 4.368 10 10 IICE CC[C@@H](c1ccccc1OC)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635996861 PNEQFRRVAFQVBY-FQEVSTJZSA-N 433.499 4.103 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCn4ncc(Br)c4C3)c2C)c1 1637578324 UYFIHUAPLARXRT-UHFFFAOYSA-N 442.361 4.087 10 10 IICE CCOC(=O)NCCC(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1641203074 USLOGYOFYRYNHD-GOSISDBHSA-N 437.462 4.434 10 10 IICE CC[C@H](NCc1ccc(N2CCC(OC)CC2)cc1)c1ccccc1OCC(=O)N(C)C 1645094202 WJRGYFGSQJLFSE-DEOSSOPVSA-N 439.600 4.010 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CSCCN1Cc1ccccc1 1681325262 VQCNAWUGBOWNIM-DEOSSOPVSA-N 440.657 4.290 10 10 IICE Cc1ccc(C[C@]2(C)CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1683018009 BLZQKCRSGTWIBK-VWLOTQADSA-N 443.538 4.417 10 10 IICE COc1ccc(C[C@H]2CCCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)C2)cc1 1684606309 DXJGXFWPBPQCGS-PXDATVDWSA-N 438.616 4.028 10 10 IICE COc1cccc(C=C2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CC2)c1 1684606597 HCIYXPHQAULHBC-RUZDIDTESA-N 436.600 4.253 10 10 IICE CC[C@H](C)[C@@H](Cn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1708375364 UGEBHDGVTNCSNB-HTAPYJJXSA-N 445.583 4.081 10 10 IICE CCc1nnc(N2CC[C@@H](COc3ccccc3)C2)n1CCCSc1nccs1 1709088152 ROHNEWBRTJRGNU-QGZVFWFLSA-N 429.615 4.385 10 10 IICE CCC1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1709290430 VQQHFGPIEIJDFZ-GOSISDBHSA-N 429.584 4.442 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCC[C@H](C(F)F)C2)cc1 1710026326 DISTWABMHLOANR-OALUTQOASA-N 433.547 4.158 10 10 IICE CCOCCN(CC)c1nnc(C2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1729148030 ODGJVXMVUCSKTN-UHFFFAOYSA-N 429.634 4.010 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)OC)[C@@H](C)C1 1764370979 GRHHPPJJGQAHJZ-SFHVURJKSA-N 436.560 4.040 10 10 IICE COc1ccccc1OCc1nnc(N2CC=CCC2)n1CCCSc1nccs1 1770500621 BBIMYDNSVDXUTQ-UHFFFAOYSA-N 443.598 4.271 10 10 IICE COC1CCC(CCn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)CC1 1770567764 HXUCRZGKHOCDBP-UHFFFAOYSA-N 435.572 4.201 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(NC(C)=O)cc3)C2=O)ccc1OC 1860087155 DRJSVSXGGOQLRR-XDHOZWIPSA-N 428.535 4.458 10 10 IICE O=C(CNCc1cc(Cl)cc(Br)c1O)Nc1ccc(Br)cc1 1860720938 CKTMNUQWRJBZRM-UHFFFAOYSA-N 448.542 4.299 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccccn3)N=C2C)cc(Br)c1OC(C)C 1865671910 URPZWKIQZMXRLT-OQLLNIDSSA-N 430.302 4.446 10 10 IICE COc1cc2cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)n(C)c2cc1OC 1874180039 WRVGBXHLPDOUPK-UHFFFAOYSA-N 440.455 4.223 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 1891418761 UUGJEKORCVBLDS-YOEHRIQHSA-N 435.402 4.412 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@H](CNCc2cccc(Cl)c2O)C1 2025242847 DJJMRRWOCIMRGR-HXUWFJFHSA-N 445.991 4.257 10 10 IICE CN(CC1(NC(=O)OC(C)(C)C)CC1)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2057937855 BULPJVGFSGCDDZ-UHFFFAOYSA-N 446.592 4.056 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(CCNCc2ccc(Br)cc2O)C1 2140332930 WWMNQUWPXGCNNN-MGPUTAFESA-N 425.367 4.282 10 10 IICE COCCC1(NCc2cccc(Br)c2O)CCN(C(=O)OC(C)(C)C)CC1 2157601797 HKUMDLQHYQHHMI-UHFFFAOYSA-N 443.382 4.051 10 10 IICE COc1ccc(Br)c(CN[C@@H]2[C@H]3CCCCN(C(=O)OC(C)(C)C)[C@H]32)c1O 2236055445 PWDXRZLZMBBDPX-CSMYWGQOSA-N 441.366 4.041 10 10 IICE O=C1NC(=Cc2ccc(N3CCCC3)cc2)C(=O)N1Cc1ccc(Br)cc1 2293415038 IMZGYXWRMYOFCS-UHFFFAOYSA-N 426.314 4.142 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCO3)SC(=S)N1CNc1ccc(Br)cc1 2297616692 XPGASFBUSVAVKO-UHFFFAOYSA-N 449.351 4.449 10 10 IICE O=C1C(=Cc2cc(Br)ccc2O)SC(=S)N1c1ccc([N+](=O)[O-])cc1 2313608939 AXYOCGMTLHWKBT-UHFFFAOYSA-N 437.296 4.469 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccccc3C)C2=O)ccc1O 2314836928 LVIPJLYEESTABZ-CQSZACIVSA-N 442.562 4.328 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cccc(Br)c2O)C[C@@H]2CCC[C@H]21 2335123904 BPLXWEGFQABZPZ-JLJPHGGASA-N 425.367 4.422 10 10 IICE COc1ccc(S(=O)(=O)c2nnn(-c3ccc(N)cc3)c2-c2ccc(Cl)cc2)cc1 11730526 QNZCOLGMLNCLDF-UHFFFAOYSA-N 440.912 4.011 10 10 IICE Cc1cccc(NC(=O)Cc2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)c1 573604687 GVWMOGYTWUYUAR-UHFFFAOYSA-N 443.551 4.329 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN(Cc1ccccc1O)C1CCCC1 732204804 SFTKYWLMCSEEAW-UHFFFAOYSA-N 432.568 4.256 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 749798160 OEEQRJHGOMNHKL-PXDATVDWSA-N 447.583 4.138 10 10 IICE Cc1cc(C(=O)COC(=O)CCc2ccc(N)nc2)c(C)n1-c1ccc(OC(F)F)cc1 759815188 NDSJSGWCWIJVFT-UHFFFAOYSA-N 443.450 4.031 10 10 IICE COc1cccc(-c2nc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)no2)c1 760343906 JFLAXPHVTWLRLV-UHFFFAOYSA-N 432.480 4.247 10 10 IICE CN(C)c1ccc(N2C(=O)/C(=C\c3ccc4c(c3)sc(=O)n4C)SC2=S)cc1 773124630 JMXMQGXFLBHHHL-GZTJUZNOSA-N 427.576 4.072 10 10 IICE CC[C@@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1cc(Br)ccc1O 775497143 NDURYDJVAKYJLB-SJKOYZFVSA-N 427.364 4.328 10 10 IICE COc1cc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc(OC)c1C(C)C 779144280 NNRURBYLSCQWCR-UHFFFAOYSA-N 427.545 4.328 10 10 IICE COc1ccc(CNC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)c(O)c1 796350423 MORQMWUTYLOPOO-GOSISDBHSA-N 439.339 4.169 10 10 IICE O=C(NCc1csc(CCc2ccccc2)n1)NCc1cc(Br)ccc1O 806934911 RPMPOFVEMIJEOJ-UHFFFAOYSA-N 446.370 4.396 10 10 IICE CC1(C)Cc2ccc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cc2O1 1125132124 RHZJNWZPZBIRTL-UHFFFAOYSA-N 434.458 4.186 10 10 IICE CCc1cnc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1127419280 NICZIMODBWZQSJ-DHDCSXOGSA-N 436.555 4.179 10 10 IICE CCc1noc(-c2ccc(CCNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc2)n1 1136567030 LBIWKYJKJBLHKX-UHFFFAOYSA-N 442.519 4.492 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc2c(F)ccc(F)c2c1 1137437965 FFQGHQPORSRQFM-INIZCTEOSA-N 431.870 4.266 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(CC(=O)N3CCCCCC3)C(C)C)c2C)cc1 1140301493 ZZGAIUIZDRLGMB-UHFFFAOYSA-N 425.573 4.356 10 10 IICE COc1ccc(N(CCC(C)C)CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)cc1 1194074209 QGHYLJVXRGUYLE-UHFFFAOYSA-N 429.586 4.226 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1 1230196176 VRFREKDVNAHNMO-IRFCIJBXSA-N 446.636 4.327 10 10 IICE Cc1nnc(N(C)[C@H]2CCCN(c3ccccc3)C2)n1CCCSc1nccs1 1290706871 MYPWICVBAYSXCB-IBGZPJMESA-N 428.631 4.331 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCN(C)C(C)C 1291563014 MAAQHWDADVFIBG-OAQYLSRUSA-N 442.652 4.247 10 10 IICE CC(C)CCN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1303049759 LLLKUHGYNIDJJA-UHFFFAOYSA-N 431.600 4.373 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1313681649 UXBLVXSCKRRORH-VXKWHMMOSA-N 441.620 4.275 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCCNC(=O)OC(C)(C)C 1314753739 XWHUQBVOBFUPFE-UHFFFAOYSA-N 431.581 4.124 10 10 IICE CO[C@H]1C[C@@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1449632412 QIHHACXFTRTBAR-MSOLQXFVSA-N 432.362 4.281 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2cc(F)ccc2N(C)C)C1 1463505224 XBMZGFBIQYQZRX-GOSISDBHSA-N 436.575 4.490 10 10 IICE COc1cc(CCNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)c([N+](=O)[O-])cc1OC 1463762803 IRBFJMOVLWAWOT-UHFFFAOYSA-N 437.496 4.300 10 10 IICE CC(C)(C)CC[C@H](CO)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1467486694 SHLPJCCSCZZZJT-RGHBXIHOSA-N 440.656 4.033 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cnn(-c2ccc(Br)cc2)n1 1467497709 NEAJOVVDUHCFEI-UHFFFAOYSA-N 429.318 4.178 10 10 IICE COc1ccc(N(CC(=O)Nc2nnc(CC(C)C)s2)Cc2ccccc2)cc1OC 1473903405 SVZVCGIOIRUTPN-UHFFFAOYSA-N 440.569 4.399 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCOCCC(C)C)CC2)cc1 1504292768 RSORBCKLRGRLKK-UHFFFAOYSA-N 443.636 4.364 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CC[C@@H](C)C3)CC2)cc1F 1504295873 KBVOJHOSONQOFM-RTBURBONSA-N 429.584 4.387 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)N(C)C)cc1 1539708070 WBPPWDQYFHJNMA-VWLOTQADSA-N 444.579 4.062 10 10 IICE CN1CCC(Oc2ccc(CNC(=O)N(C)Cc3ccc(N4CCCC4)cc3)cc2)CC1 1564732578 IKVQCMARKGRGAO-UHFFFAOYSA-N 436.600 4.101 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1566386564 LKUVAVOIRQMTSK-SFHVURJKSA-N 427.342 4.363 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2C)c1C 1570012388 IAKKBAPUQAUWPB-UHFFFAOYSA-N 437.565 4.404 10 10 IICE Cc1nnc(N2CCC(C(=O)c3cccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1612555552 DPEPBDMUVUBBQP-UHFFFAOYSA-N 427.549 4.001 10 10 IICE CCc1nnc(N2CCC[C@H](C[C@H]3CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613996499 GJCVMZPSSYNMIT-FGZHOGPDSA-N 425.621 4.378 10 10 IICE CC[C@H](c1ccc(Br)cc1)N1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 1616786374 UJEIUQORZVQKLZ-GOSISDBHSA-N 433.346 4.078 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1617528403 SHOAKQGAWBEFBU-ICSRJNTNSA-N 431.650 4.173 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)Cc1ccccc1OC 1623577257 WAOXCPFYDLYEEY-IBGZPJMESA-N 438.499 4.004 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](c1ccncc1)C1CCCC1 1631425349 CMFDMABYBOSMJU-JTHBVZDNSA-N 427.976 4.495 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)Cc1cccc(F)c1 1632807420 XQOHQGNTSPJIJJ-IBGZPJMESA-N 438.499 4.004 10 10 IICE CCCOc1cc(OC)ccc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941812 XAZWKKLOOVJUOD-GOSISDBHSA-N 432.948 4.237 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(-c2ccccc2Br)s1 1638348290 QPVFYEGHDDXLMK-LLVKDONJSA-N 433.327 4.345 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1Cc2cc(Br)ccc2OC2(CCC2)C1 1638579666 SUBWMMXXHFDEAX-CLTKARDFSA-N 430.298 4.217 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2cc(C(=O)NCc3cccc(Cl)c3O)on2)CC1 1640404835 IGZOXKURSGBSQA-UHFFFAOYSA-N 435.908 4.078 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1642107461 SPAAEVRCYIYERZ-QFBILLFUSA-N 426.561 4.112 10 10 IICE COc1ccc([C@H]2COCCN2C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1643339566 PXBMYACESXYVOE-RUZDIDTESA-N 432.520 4.058 10 10 IICE Cc1cc(C(=O)N2Cc3cncnc3[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1644316470 IYVGFBCZAZFSKU-CYBMUJFWSA-N 425.330 4.406 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)Cc3ccccc3C(F)(F)F)C2)cc1 1680731168 ATZXYBQAMZPMTR-DLBZAZTESA-N 435.490 4.471 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@]3(CCCc4ccccc43)C2)N(C)C)cc1 1687807266 QEYHHMRMHYOXAS-BDYUSTAISA-N 434.628 4.435 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3C[C@H](C)O[C@@H](C)C3)CC2)cc1 1697471272 YFOPFFBSJKHTTI-PMACEKPBSA-N 441.620 4.330 10 10 IICE CCN(CC)[C@H](Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccccc1O)c1ccco1 1710019188 AGPGLFHPUUBZAQ-HXUWFJFHSA-N 434.544 4.291 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCSC2)cs1 1742565018 DWRAICZCCOZWMY-MRXNPFEDSA-N 429.615 4.119 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3Cc3ccc(C)nc3)CC2)cc1 1748848273 ZFEHDHFXPCAAJX-UHFFFAOYSA-N 448.615 4.344 10 10 IICE CC1(C)CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CCS1 1751297193 ZYESNNNBNBKHFR-UHFFFAOYSA-N 432.644 4.311 10 10 IICE C[C@H]1C[C@H](Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C[C@@H](C)O1 1762752360 CDFVYOQQDRGWBS-IZZQQSIFSA-N 426.586 4.476 10 10 IICE C[C@@H]1CCC[C@@H]1Cn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 1762875683 KJKAVLAMXRKGGG-IAGOWNOFSA-N 439.585 4.048 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@@H]1CCOC1 1769684213 NEPWOSOCMXOGMU-OAQYLSRUSA-N 437.588 4.252 10 10 IICE O=C(CCn1ccc2ccc(OCc3ccccc3)cc21)NCCc1ccc(O)c(O)c1 1860234132 QQJXHMSHMHKGQV-UHFFFAOYSA-N 430.504 4.381 10 10 IICE CC(=O)Nc1c(Br)cc(C(=O)Nc2ccc(N)cc2)cc1Br 1866064002 MWHGWJDSWYWWHQ-UHFFFAOYSA-N 427.096 4.005 10 10 IICE Cc1cc(C)c2[nH]c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc(=O)c2c1 1866490218 GOFSGPCGWHYJNS-XMMPIXPASA-N 446.595 4.168 10 10 IICE COCCCN1C(=O)C(Nc2ccccc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420896 YWHMHCCOEURAAP-UHFFFAOYSA-N 429.520 4.323 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C=Cc3c(Cl)nc4sccn34)cc2F)C[C@H](C)O1 2041588373 KAVYDEKLLYAIHM-KBPBESRZSA-N 448.951 4.132 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cc(Br)cc(F)c2O)[nH]1 2138331922 PXUBPAHSKPASQP-SECBINFHSA-N 446.342 4.370 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cc(OC)c(Cl)cc1OC 2313683404 ZDCGOCYIGRQOEL-UHFFFAOYSA-N 443.887 4.009 10 10 IICE COc1cc(C=C2SC(=S)N(CCN(C)C)C2=O)ccc1OCc1ccccc1 2323839338 FOSJBBMMAJHCPM-UHFFFAOYSA-N 428.579 4.037 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380738015 UDFNRLZGKAMSMH-OAHLLOKOSA-N 443.382 4.409 10 10 IICE Cc1nc2c(C(=O)NCCc3ccc(Cl)cc3)cnn2c(O)c1Cc1ccccc1F 8592918 FMTFJASLURFGGE-UHFFFAOYSA-N 438.890 4.099 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14551128 FCGBWFYRUSJTSC-IMSXRSKXSA-N 434.540 4.493 10 10 IICE COc1cc(NC(=O)c2cc(Cl)c(OC)c(Cl)c2)c(N2CCOCC2)cc1OC 20496438 BQPKVTJSKRBYCO-UHFFFAOYSA-N 441.311 4.108 10 10 IICE COc1ccc(O)c(CNc2ccc(Br)c(I)c2)c1 311714574 KQVHGMMXPSGBIX-UHFFFAOYSA-N 434.071 4.380 10 10 IICE COC(=O)/C=C\c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3Cl)cs2)cc1 747854106 UPBRLTIYWKONAB-FLIBITNWSA-N 434.926 4.451 10 10 IICE Cc1cc(C(=O)N(C)C2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(C)n1-c1ccccn1 752160912 HJBHAXGJTRRQQA-YOFSQIOKSA-N 438.572 4.492 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1ccc(Cl)cn1 775830582 IVXYMQKFFGHLEO-OQLLNIDSSA-N 437.999 4.094 10 10 IICE CC(C)(C)OC1CC(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 792591136 YUMFVPBUBDRUGX-UHFFFAOYSA-N 428.495 4.142 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3[nH]ccc3s2)NC(=O)OC(C)(C)C)cc1 793575696 XMQVHAKIBFWPDV-QGZVFWFLSA-N 428.558 4.291 10 10 IICE CCOC(=O)[C@H]1CC[C@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c2ccccc21 802305773 TZVKODPRRBWZSJ-SVBPBHIXSA-N 447.623 4.490 10 10 IICE O=C(NCc1cccc(OCC(F)(F)F)c1)NCc1cc(Br)ccc1O 804917208 NGWFSADPHHODJF-UHFFFAOYSA-N 433.224 4.095 10 10 IICE O=C(NCc1ccc(Br)c(F)c1)NCc1cc(Br)ccc1O 805022781 DCCREMRYKJRAFN-UHFFFAOYSA-N 432.087 4.056 10 10 IICE Cc1ccc(-c2nc(CCNC(=O)NCc3cc(Br)ccc3O)co2)cc1 806681407 YRVLBIWLHSUXMN-UHFFFAOYSA-N 430.302 4.160 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc[nH]c2C2CCC2)NC(=O)OC(C)(C)C)cc1 813465998 XFOJOEBXCKAEHB-HXUWFJFHSA-N 426.561 4.344 10 10 IICE CCc1ccc(/C=C2/C(=O)NC(=O)N(c3cc(C)c(C)cc3Br)C2=O)cc1 1084181426 WQZFNODVQAGICZ-WJDWOHSUSA-N 427.298 4.295 10 10 IICE CC(C)NC(=O)CSc1ccccc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1124549440 IPBVZERSHDRHAH-UHFFFAOYSA-N 425.598 4.176 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](COC(C)C)C2)c(C)n1-c1ccc(Br)cc1 1138367752 AKTRNOLZCULHLJ-IBGZPJMESA-N 435.362 4.123 10 10 IICE CCc1c(C(=O)N(CC)Cc2ccc(N(C)C)cc2)nnn1-c1ccc(OC(C)C)cc1 1142410240 HCTVAHHBDUEBFA-UHFFFAOYSA-N 435.572 4.345 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)COc2c(F)cccc2F)cc1 1146911949 YRHGHJWEOHOYHZ-OAHLLOKOSA-N 426.463 4.311 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)ccc3Br)CC2)cc1F 1150241322 XQUCKZYPSHZMCQ-UHFFFAOYSA-N 427.701 4.213 10 10 IICE COc1cc([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3ccc(C(C)(C)C)cc3)c2C)c1=O 1166619649 XYMBWVXANAWESZ-UHFFFAOYSA-N 437.496 4.353 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H](O)COc1ccccc1C(F)(F)F 1167512493 OIZPKQVBRHAMCY-OAHLLOKOSA-N 448.279 4.435 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3ccc(-c4ccccc4)cc3)CC2)cc1 1168633011 JECDXEAVIXMJID-WXVAWEFUSA-N 445.607 4.196 10 10 IICE Brc1cc(CNCc2ccc(N3CCSCC3)cc2)cc2c1OCCO2 1199376524 JYVBIVCCKLXVFZ-UHFFFAOYSA-N 435.387 4.063 10 10 IICE Cc1cc(CCNC(=O)N2CCn3nc(C(F)(F)F)cc3C2)c(C)n1-c1ccccc1 1233974428 NLVYAVUEUIBOEC-UHFFFAOYSA-N 431.462 4.077 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CCN2C(=O)OC(C)(C)C)cc1 1255098077 OFTVMFKZJXTHKZ-FQEVSTJZSA-N 442.560 4.067 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)N3CCN(c4ccc(OC)cc4OC)CC3)c2)c1C 1287485619 VSJVSPNBMZCBOC-UHFFFAOYSA-N 448.567 4.031 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@](C)(O)c1ccc(F)c(Br)c1 1290334818 PNHXLFQJRWECMG-QFIPXVFZSA-N 449.364 4.445 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1291516520 FJQNVOVDCBMBRT-PKOBYXMFSA-N 438.551 4.098 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(C[C@H]4CC(=O)NC4=O)cc3)c2C)c1 1293733882 JYVFMLXNTLGJLL-FQEVSTJZSA-N 429.520 4.168 10 10 IICE CCCN(CC)Cc1ccc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1 1295590059 CHEDWIVLVSFSBR-UHFFFAOYSA-N 432.948 4.093 10 10 IICE Cc1nc2c(cc1C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)c(C)nn2C 1297010635 RGEGWOPJQLWVFI-AWEZNQCLSA-N 425.964 4.405 10 10 IICE CCOCc1nnc(N2CCS[C@@H](C)[C@@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1297345852 ZOUWDEMOCLENCN-PMACEKPBSA-N 443.661 4.429 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 1299721969 XRMVNFQUASEENR-SFHVURJKSA-N 444.318 4.168 10 10 IICE CCOc1ccc(Nc2ncccc2C(=O)N(C)CCN(C)c2ccc(OC)cc2)cc1 1300279251 GBEJZZLKIJXZKT-UHFFFAOYSA-N 434.540 4.441 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1306788097 LCGYCADFRDVAQE-OAQYLSRUSA-N 426.653 4.067 10 10 IICE CO[C@@H]1CCC[C@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1315690050 FWOFSJCBIXKPNP-YVNJGZBMSA-N 442.604 4.354 10 10 IICE CO[C@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC[C@H]1C 1315714920 DJHNTXNHAVOGFO-AEFFLSMTSA-N 429.615 4.445 10 10 IICE CC(C)Cc1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1359873545 NMGHNOZXPPWRJI-UHFFFAOYSA-N 445.702 4.410 10 10 IICE O=C(CCc1ccc(C(F)F)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1435574776 YGNYYYKNDMMZKK-UHFFFAOYSA-N 427.539 4.405 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1440664369 IQAAZLFUNONTOB-OBIZFTICSA-N 439.987 4.459 10 10 IICE COc1cc(/C=C\C(=O)NCc2ccc(N3CCCC3)cc2)cc(Br)c1O 1441191162 YOVZXGKRKJNDDY-TWGQIWQCSA-N 431.330 4.093 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(OC(F)F)c(F)c1 1448683263 FYORFJPHGKLYRL-UHFFFAOYSA-N 438.446 4.429 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H](NC(=O)c3ccc(N=NC(N)=O)cc3)C(C)(C)[C@@H]21 1454467443 NMTINWSKUCQVCM-BRWVUGGUSA-N 429.521 4.003 10 10 IICE COC1(C(F)(F)F)CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1456354615 CEJJYCVSHXZFCE-UHFFFAOYSA-N 431.252 4.260 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@H](C(=O)NCc1ccc(N(C)C)cc1C)C2 1465029381 KGMNWRUBGGBYGA-QFIPXVFZSA-N 441.547 4.491 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC([C@H](O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])c1 1472803275 CJZDOINICPYBCL-CDKWRECCSA-N 432.423 4.009 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3CC3CCCCC3)cc2F)C[C@@H](C)O1 1473131582 GTHZHVGIQPZHJI-MZKRTTBSSA-N 445.623 4.490 10 10 IICE CCN(CC)c1ccc(Cn2c(N(C[C@@H]3CCOC3)C3CC3)nnc2C(C)(C)C)cc1 1501847516 QTKPAHZVQIAMSA-FQEVSTJZSA-N 425.621 4.475 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1519268671 PRYBMHMALULASY-IEBWSBKVSA-N 447.599 4.128 10 10 IICE Cc1cc(CC(=O)NCc2ccc(NC(=O)C(F)(F)F)cc2)c(C)n1-c1ccccc1 1520321216 SHZORDWYVYPYAY-UHFFFAOYSA-N 429.442 4.454 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1coc2ccccc12 1526850921 YIHSATVGAVNPKX-ODLFYWEKSA-N 440.521 4.480 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)COc2ccccc2Br)cc1 1528644477 WDDLPEHSLMGENJ-UHFFFAOYSA-N 445.279 4.485 10 10 IICE Cn1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c(C(F)F)n1 1540300214 PCVVUXBDILLWOV-XYOKQWHBSA-N 442.538 4.039 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCOC(F)(F)C(F)(F)F)cc1 1565297529 CFKDCFAOMVOHEC-UHFFFAOYSA-N 435.393 4.229 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(I)c(F)cc1F 1583569548 NKIIRCXZAVOBCE-UHFFFAOYSA-N 444.263 4.298 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@]1(c2ccccc2)C[C@@H](NC(=O)OC(C)(C)C)C1 1585786548 DWBSZVVSABLEGW-WVPZODRTSA-N 437.584 4.302 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3ccc(C)cc3C)c3c2CCC3)cc1 1586649153 IGBUVFWPXIYLNE-UHFFFAOYSA-N 432.568 4.195 10 10 IICE Cc1ccc(CN2CCO[C@@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)cc1 1587510960 MCWIXEFVDRAVRE-DEOSSOPVSA-N 435.543 4.172 10 10 IICE Cc1cc(CC(=O)N2CC3(CCCN(C(=O)OC(C)(C)C)C3)C2)c(C)n1-c1ccccc1 1589646672 PKIGAUBJMZJBCW-UHFFFAOYSA-N 437.584 4.496 10 10 IICE CC(C)(C)Cc1nnc(N2CCN3CCCC[C@H]3C2)n1CCCSc1nccs1 1597336573 HXLGBRFKISYEKU-KRWDZBQOSA-N 434.679 4.180 10 10 IICE COc1cc(Br)c(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1OC 1597801110 XOBZXJYEVSYIQU-CQSZACIVSA-N 435.362 4.202 10 10 IICE CN(C)c1ccc(CNC(=O)CNC2(c3ccc(Br)cc3)CCCC2)cc1 1616240040 YWULHYDTPBMUJB-UHFFFAOYSA-N 430.390 4.190 10 10 IICE CC(C)Oc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)ccc1Br 1618643747 NPDZPQVRGVUCOK-HXUWFJFHSA-N 448.405 4.335 10 10 IICE CNS(=O)(=O)c1ccc(O)c(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c1 1625730483 RDPZELPMISRKMG-UHFFFAOYSA-N 441.553 4.084 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C1CCN(C(=O)c2cccnc2)CC1 1632697189 HNIDSMRXLUULJW-FQEVSTJZSA-N 443.547 4.429 10 10 IICE COc1cccc(CN(C)C(=O)Cc2ccc(O)c(O)c2)c1OCc1ccccc1F 1634885036 QHHLJGRAFKXCDA-UHFFFAOYSA-N 425.456 4.026 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2ccncc2Cl)c(C)n1-c1ccc(Cl)cc1 1635602277 OSNTWEJRKXRQCL-MRXNPFEDSA-N 432.351 4.377 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@H](CO)C(C)(C)C)sc(C)c1-c1ccccc1 1642319031 DCJDHFFOUQNBFP-QGZVFWFLSA-N 432.586 4.178 10 10 IICE O=C(NCCN=[S@@](=O)(c1ccccc1)C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1644345048 IRTZDLPGVQCDHX-GDLZYMKVSA-N 444.456 4.089 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCc3cc(Cl)ccc3O)cc2CC1 1644590729 MOFWQOZMRYYYIH-UHFFFAOYSA-N 430.932 4.311 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2Cc1nnnn1-c1ccccc1Br 1653956938 RDCHDSPVAIEXEH-MRXNPFEDSA-N 442.361 4.268 10 10 IICE COc1ccccc1NC(=O)[C@H]1CCCN(Cc2ccc(N3CCC(OC)CC3)cc2)C1 1654990102 QLSTXYAJJMIVLR-NRFANRHFSA-N 437.584 4.161 10 10 IICE Cc1cc(C)c([N+](=O)[O-])c(OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)n1 1656405857 DNKALGNAUWKTAL-UHFFFAOYSA-N 437.452 4.047 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H]2c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1694108836 SEXQCBNNPMHUPY-UZLBHIALSA-N 425.556 4.120 10 10 IICE CCOC(C)(C)Cn1c([C@@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695986733 WRJWLDIAHZJFDU-IBGZPJMESA-N 429.609 4.332 10 10 IICE CC[C@H](C)c1nnc(N2CC(C)(C)OC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708421146 FGKMGUFPBIWOJU-IBGZPJMESA-N 441.620 4.070 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCCCO2)n1CCOCC(F)F 1711080322 MOESXVXADCFQTM-HXUWFJFHSA-N 449.546 4.038 10 10 IICE Cc1csc(CCCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)n1 1725049512 LKBZKODCKRXIAA-UHFFFAOYSA-N 434.569 4.470 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCSC1 1749750563 SSCRECZLGVPHLQ-IBGZPJMESA-N 425.602 4.188 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cnc(C(C)C)nc2)n1Cc1ccc(N(C)C)c(F)c1 1760995770 YRZXKVRYYBNDOM-UHFFFAOYSA-N 439.583 4.280 10 10 IICE CCCN(CCC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1766019160 ANYWSGDKRSSMGO-UHFFFAOYSA-N 427.572 4.020 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3cccnc3)C(=O)N(CC(C)C)C2=O)cc1 1873164016 IEPLKXQKWAGXIB-UHFFFAOYSA-N 428.536 4.015 10 10 IICE CN(Cc1cnn(Cc2ccccc2)c1)c1ccc(C=CC(=O)O)c(Br)c1 1915065231 MMYFQWBTGKIXGB-UHFFFAOYSA-N 426.314 4.428 10 10 IICE CN[C@H]1C(=O)Nc2cc(N(Cc3ccccc3)Cc3ccco3)c(Br)cc21 1915122950 FJRJWZMCPDPLKO-HXUWFJFHSA-N 426.314 4.462 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(NCc3cc(Br)cc(F)c3O)C[C@@H]2C1 1967824123 FIIOIFJZHLWZBW-YJYMSZOUSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)[C@H](N)c1ccc(N2CCCC2)cc1 1999537239 VRUBYAYSIILFOO-XZOQPEGZSA-N 425.573 4.397 10 10 IICE O=C(NC1CC1)c1nn(Cc2cc(C(F)(F)F)ccc2O)c(C(F)(F)F)c1Cl 2079242697 BRZUYABFNSOMLH-UHFFFAOYSA-N 427.732 4.220 10 10 IICE Cc1cc(O)c([C@@H](C2CCC2)n2nc(C)c(C(=O)O)c2I)cc1C 2079931607 HBBMUBYOGQRCLA-MRXNPFEDSA-N 440.281 4.206 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)c1O 2236054166 FLHORVQKSWGJFJ-ZDUSSCGKSA-N 443.382 4.289 10 10 IICE COCCN1C(=O)C(=Cc2ccc(OCc3ccc(F)cc3)c(OC)c2)SC1=S 2297349610 DHSCLVVQSZDOAR-UHFFFAOYSA-N 433.526 4.261 10 10 IICE COc1ccc(C=C2SC(=S)N(C(=O)c3ccccc3Br)C2=O)cc1 2297507377 HDKJAPLBARAZDU-UHFFFAOYSA-N 434.336 4.499 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)c(C)c1 2313548711 CNNKBOHEGJQMGG-UHFFFAOYSA-N 431.404 4.138 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)cc1 2314828680 VIVKIEGGOFFUAB-UHFFFAOYSA-N 427.507 4.133 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@@H]1[C@@H](NCc1ccc(Br)cc1O)C2 2333987486 VYKHRTFLUYPQQU-NKKGCODLSA-N 425.367 4.326 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@H](Cc1ccc(Br)cc1)NC(=O)OC(C)(C)C 2362981962 WDVFQZWRAOGCFV-HNNXBMFYSA-N 440.342 4.044 10 10 IICE Nc1nc(-c2ccccc2)c(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)s1 31903235 XUODZJWBEIDSSU-UHFFFAOYSA-N 425.469 4.420 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)c(C)n1-c1ccccc1 62694253 CDVFKPHAHLLUPU-UHFFFAOYSA-N 431.536 4.231 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3ccc(NC(C)=O)cc3)C2=O)c(OC)c1OC 210164846 CWLOAJQRXBTFGV-GZTJUZNOSA-N 444.534 4.077 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)c(C)n1-c1ccccc1 728311381 XZRSSVHOEBGRSK-SFHVURJKSA-N 430.552 4.216 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cc3ccccc3nc2O)C1 769665983 YVOOUHNSBVXJTH-UHFFFAOYSA-N 429.520 4.405 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cnn(Cc2ccccc2)c1 773146107 OKOBFESHRSVIJP-JOCHJYFZSA-N 429.612 4.314 10 10 IICE COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1Cc1cc(C)cc(Br)c1O 781914726 YWPYWDMCSDFECD-SFHVURJKSA-N 433.346 4.383 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1 792036789 YADAANZHZRKQBU-OAQYLSRUSA-N 429.536 4.159 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cccc2c1CN(c1ccccn1)C2 806368766 HMTSQRFNFUNJAV-UHFFFAOYSA-N 439.313 4.392 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)N1CCO[C@H]2CCCC[C@H]21 917205083 BYQLXDUIEJBFRK-IRLDBZIGSA-N 437.565 4.454 10 10 IICE CCOc1cc(N(CC)CC)ccc1/C=C1/C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O 1084112275 IUFLNRZZEXJIBF-ZHZULCJRSA-N 435.524 4.215 10 10 IICE CN(C)c1cc(F)c(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1[N+](=O)[O-] 1136446431 IJWLMAOCUIUPEX-UHFFFAOYSA-N 428.508 4.499 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1nsc2ccccc12 1139585337 QIYLJUWNSFTSLD-UHFFFAOYSA-N 425.554 4.227 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc3c(c2)nc(C)n3[C@H](C)CO)c1 1140727226 LRCQNYOFFHEONT-MRXNPFEDSA-N 430.508 4.370 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2cc(C(F)(F)F)ccn2)cc1 1141466889 GVYCTVLYLHLHIV-UHFFFAOYSA-N 429.442 4.222 10 10 IICE Cc1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 1147887671 DMRFSKWADICPEG-OAQYLSRUSA-N 425.529 4.052 10 10 IICE Cc1ccc(NS(=O)(=O)c2cccc(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)c2)cc1 1154668421 GREHFCVJRPXNSG-GOSISDBHSA-N 437.565 4.353 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc([C@@H]4CC(=O)NC(=O)N4)cc3)c2C)c1 1167726717 WVIRNVHZVGOMGE-QFIPXVFZSA-N 430.508 4.234 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](CC(C)C)c3ccc(Cl)cc3)CC2)cc1 1168623693 XKJZLRZPNMBPPO-NOZRDPDXSA-N 446.035 4.209 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)N=S(C)(C)=O 1188366139 TXLHSCUOPBAPRF-UHFFFAOYSA-N 444.420 4.315 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3ccc(Br)nc3)c2C)cc1 1189095756 ZXPHCUPROIQOIW-UHFFFAOYSA-N 443.297 4.300 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C1 1230694101 QNBQGISSXWYUSA-CJNGLKHVSA-N 441.366 4.197 10 10 IICE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1251980677 CNAHKESUPPDVBW-SIKLNZKXSA-N 446.636 4.423 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2c3ccoc3CCN2C(=O)OC(C)(C)C)cc1F 1293225102 MCIKFNFWHLCCNU-NRFANRHFSA-N 445.535 4.416 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2nccn2Cc2ccc(Br)cc2)cc1 1294598927 QCBFLLXEBFJKGP-UHFFFAOYSA-N 427.262 4.109 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC[C@H](c3ccnn3C)C2)cc1 1295420117 MIXOVPQLWZCZBE-QFIPXVFZSA-N 449.647 4.489 10 10 IICE COC1(C)CN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)C1 1299785159 VFTNGDYVYBWXSY-UHFFFAOYSA-N 429.615 4.041 10 10 IICE Cc1cc(C(=O)NCc2ccc(Br)cc2[N+](=O)[O-])c(C)n1-c1ccccn1 1303102181 JQGNONPUSGWTMZ-UHFFFAOYSA-N 429.274 4.090 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H]3C(C)C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1304196625 ULZILMVRVNLKAW-HSZRJFAPSA-N 448.615 4.456 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@H]1COc2cccc(Br)c2C1 1313197461 MYVADOLKRDYTQD-LLVKDONJSA-N 446.128 4.264 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@@H](C(=O)OC)Oc2ccccc21 1349686226 SHXABHCWOYRKCA-GNNUASRNSA-N 432.476 4.004 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(C(C)C)c(Cl)c3)CC2)cc1 1351455946 FRIQCWYBNFCONB-UHFFFAOYSA-N 429.992 4.414 10 10 IICE Cc1cc(C(=O)N[C@H](C)Cc2cccc(O)c2)c(C)n1-c1ccc(Br)cn1 1449473852 PXPCPWMZUNEYFD-CYBMUJFWSA-N 428.330 4.318 10 10 IICE CCOc1cc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1OC 1456451361 VUMJGVBDEUNMIM-UHFFFAOYSA-N 435.568 4.132 10 10 IICE COc1ccc(N2CC[C@@H](CNc3ccc(F)cc3S(=O)(=O)C(F)(F)F)C2)cc1 1458443351 RWFQTLBGTVCIRN-ZDUSSCGKSA-N 432.439 4.066 10 10 IICE Cc1cc(CC(=O)NCCc2ccc(OCC(F)(F)F)nc2)c(C)n1-c1ccccc1 1459299455 XLAMFYGAJNDZGI-UHFFFAOYSA-N 431.458 4.332 10 10 IICE CCS(=O)(=O)Nc1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1OC 1464338803 YFFLGPKEYBZRQL-UHFFFAOYSA-N 441.553 4.425 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc4cccc(C(F)(F)F)c4nc3O)CC2)cc1 1464352772 WALSMRRDRBWZFS-UHFFFAOYSA-N 445.441 4.320 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@H](Oc1ccc(F)cc1Br)c1ccccc1 1471661602 VAYIHDLTEANMJF-HXUWFJFHSA-N 446.272 4.436 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)C[C@@H]3CCCO[C@H]3c3ccccc3)C2)cc1 1478860716 RAUYOQXATQSEBR-KJWPAHLWSA-N 437.584 4.331 10 10 IICE CC[C@](C)(O)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1494794591 IMMVSHCCNHAJSE-VWLOTQADSA-N 434.588 4.046 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2COC(C)(C)OC2)n1Cc1ccc(N(C)C)cc1C 1495171846 BKFHBIBKOOPVCO-QGZVFWFLSA-N 429.609 4.050 10 10 IICE CCN(CC(C)C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1501711753 SFVGNHRPASDXLT-JOCHJYFZSA-N 445.583 4.026 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CC1(N(C)C)CCCC1 1503487090 FQWVYRXWIOWIPR-UHFFFAOYSA-N 425.602 4.147 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1 1512653645 SYQUKGNGBJDPMW-DFBJGRDBSA-N 437.588 4.129 10 10 IICE CN1CCCc2cc(Cn3c([C@H]4CCCCO4)nnc3N(C)CCC(F)(F)F)ccc21 1517411792 LNQODRHFVHSYKZ-LJQANCHMSA-N 437.510 4.339 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(OCC(=O)OC(C)(C)C)c1 1525762960 VHPYXJWLXLZKBC-SFHVURJKSA-N 426.557 4.143 10 10 IICE O=C(C[C@@]12CCCC[C@@H]1C2(F)F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245787 NPVPHXDWPMNXLH-HKUYNNGSSA-N 432.433 4.374 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Oc3cc([S@](C)=O)c(C)cc3OC)ccc21 1529581347 LDLHTONVYBDPOU-PMERELPUSA-N 429.538 4.178 10 10 IICE CCCN(CCC)C(=O)c1cccc(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c1 1529705922 CIKHOHGQHUZMLE-FQEVSTJZSA-N 437.584 4.214 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3nc(C(F)(F)F)n4c3CCCC4)ccc21 1532343482 HODUSNOQNPFJSG-UHFFFAOYSA-N 448.489 4.386 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2C[C@H]2CCC(=O)N2)c(C)n1-c1ccccc1 1542181002 HHEJWMBEDPAPEI-LJQANCHMSA-N 434.588 4.114 10 10 IICE CCN1CCN(Cc2ccc(CNC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)cc2)CC1 1543969780 ZTVPLCDWVHYGNM-UHFFFAOYSA-N 444.623 4.470 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N=[S@@](C)(=O)c2ccc(N(C)C)cc2)CCCC1 1544121039 JAHRGENSEULHER-HKBQPEDESA-N 439.581 4.278 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)cc1 1545095195 MSPKQUJJNFWXOY-SANMLTNESA-N 429.564 4.182 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCCO2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1545194666 HWWFCFRGQOSIQV-OAQYLSRUSA-N 445.583 4.430 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)C1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CCOCC1 1556884647 GWGXHOLHMZAAPQ-GFCCVEGCSA-N 447.359 4.025 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)NCc3ccc(N4CCCCC4)cc3)ccnc21 1557139441 CYMMOLIVPKBQFH-UHFFFAOYSA-N 436.556 4.300 10 10 IICE COc1cc(C(=O)NCc2c(O)cccc2O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 1558533286 BCYMNCPGKPMUSW-UHFFFAOYSA-N 444.827 4.390 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1564589682 JBMXZMJVCCDUSB-KGLIPLIRSA-N 432.348 4.334 10 10 IICE COc1cc(CCC(=O)NCc2ccc3cccnc3c2O)ccc1OCC(F)(F)F 1570531432 GKWFXMHKMARGQC-UHFFFAOYSA-N 434.414 4.139 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1583527489 WZYVDKGPJIVMNZ-NPPFBWRTSA-N 429.992 4.461 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccn3cc(C(F)(F)F)nc23)cc1 1583920216 YWRXANOSGTULGR-GOSISDBHSA-N 446.473 4.241 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2Cl)C1 1586083085 VWPGXLQBTYUUMH-WMZOPIPTSA-N 443.950 4.385 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C3CCOCC3)C2)c(C)n1-c1ccc(Br)cn1 1596437840 BFZMLAFQOHEECB-QGZVFWFLSA-N 432.362 4.140 10 10 IICE O=C(CSc1cccc(Br)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 1597090137 PDQQZGVNFKNTAH-QGZVFWFLSA-N 436.371 4.455 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](C(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1613267246 GSBSZYJNWVJEGQ-HKUYNNGSSA-N 433.547 4.158 10 10 IICE C[C@@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F)c1ccc(N(C)C)cc1 1616834630 KUIPNUNRTGEAJF-JLTOFOAXSA-N 433.499 4.474 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)N(CCN2CCCC2)c2ccccc2)C1 1618187625 OYGHALNYVYQAQE-QZMUEMGWSA-N 427.589 4.319 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(C)ccc(Br)c4[nH]3)CC2)cc1 1630082665 WXOLUUHFBCEAHJ-UHFFFAOYSA-N 428.330 4.210 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)CCN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1631697620 BMLBGMMKMFCIKC-UHFFFAOYSA-N 432.542 4.176 10 10 IICE CC(C)(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC1 1634338559 GTHLGDZDYQZTCS-RTWAWAEBSA-N 428.621 4.183 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc([C@]4(C)NC(=O)N(C)C4=O)cc3)c2C)c1 1639233150 TZECBINUIBHRQT-SANMLTNESA-N 444.535 4.360 10 10 IICE CCc1ccc(N(C[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)CC(C)(C)C)cc1 1643117202 IUHIVWKTPDUHQX-RUZDIDTESA-N 439.644 4.293 10 10 IICE Cc1cnn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1C(=O)NCc1cc(Cl)ccc1O 1644590670 JYMIIEFSZJLNAL-QGZVFWFLSA-N 448.951 4.053 10 10 IICE CCn1c(SCC(=O)NCc2cccc(Cl)c2O)nnc1-c1ccc(Cl)cc1 1648605853 BGZTYLFBBZXJSD-UHFFFAOYSA-N 437.352 4.386 10 10 IICE COC(=O)c1cnc(SCC(=O)N2CCc3cc(-c4csc(C)n4)ccc32)s1 1656579843 CFHXYSWTKUBCAO-UHFFFAOYSA-N 431.564 4.043 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1 1683421118 GESRUBLPGOJDQV-IBGZPJMESA-N 448.611 4.258 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C(=O)c4ccsc4)CC3)c2C)c1 1684599857 MSQWHQOLWAMCKM-UHFFFAOYSA-N 436.581 4.132 10 10 IICE CCN(Cc1ccc2ccccc2c1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1685244417 QIOLHHWAPJSYFB-UHFFFAOYSA-N 444.579 4.273 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CCN2Cc2ccccc2)cc1 1687136835 RGKHRHYLJLBJTN-XMMPIXPASA-N 432.568 4.332 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1)OC 1694369475 PHIXYKPREVGGTF-HXUWFJFHSA-N 425.602 4.331 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCCC[C@@H]3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1694712257 XCXKBLJKYGLODW-PZJWPPBQSA-N 442.627 4.185 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)COC)CCO1 1694919805 JVPHSGFOASNACZ-PGRDOPGGSA-N 437.588 4.250 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCN(CC)C(=O)C1 1694985699 ZXBMWJMMTXASIW-YRNVUSSQSA-N 446.599 4.377 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCC[C@](C)(OC)CC2)cc1 1746092324 IZGZSJYHLCDJAT-BWKNWUBXSA-N 441.620 4.072 10 10 IICE CCN(CC1CCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1765142617 VYLLOXLDCBTKOI-UHFFFAOYSA-N 429.584 4.226 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC[C@H](C)C1 1767766286 DNPNAMLOTYJVPL-GHTZIAJQSA-N 448.615 4.361 10 10 IICE O=C(O)c1ccccc1/C=C1\C(=O)N(c2ccc(Br)cc2)N=C1C(F)(F)F 1865674174 RCAUGMFUSFYBNM-ZROIWOOFSA-N 439.187 4.496 10 10 IICE COc1ccc(Br)cc1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1865981371 VWMIHMOYNAUUHI-UHFFFAOYSA-N 436.261 4.485 10 10 IICE Cc1nn(Cc2cc(Br)ccc2O)c(I)c1C(C)C 2079595774 OQYFUCNGMRUZSN-UHFFFAOYSA-N 435.103 4.436 10 10 IICE Cc1c(C=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)c2ccccc2n1Cc1ccccc1 2297309464 LABPGDYRHVMQDT-UHFFFAOYSA-N 439.471 4.253 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccccc3C(=O)OC)C2=O)cc1OC 2314538973 ICVVAECQEFNIDK-UHFFFAOYSA-N 429.519 4.286 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3C[C@H]2C[C@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352675432 GPVRGWGQPLIABY-CAOSSQGBSA-N 425.367 4.245 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381129223 HBMSECCTHUAQIU-HIFRSBDPSA-N 441.366 4.115 10 10 IICE COC(=O)[C@@H](C)N1C(=O)/C(=C/c2cn(Cc3ccccc3)c3ccccc23)SC1=S 1810231 OMVRTSWSEVCNQD-GEYIUBJWSA-N 436.558 4.452 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccccc3C)=NC2=O)ccc1OCCC(=O)O 16920016 MDLZLHUPSJAZLE-CPNJWEJPSA-N 426.494 4.330 10 10 IICE O=C(/C=C/c1cccc2cccnc12)N1CCCc2cc(S(=O)(=O)N3CCCC3)ccc21 105551360 VZTVSQGQOIYHHD-JLHYYAGUSA-N 447.560 4.012 10 10 IICE C[C@H](NC(=O)c1ccccc1SC[C@@H]1CCCO1)c1ccc(N2CCOCC2)cc1 109179966 RIPOVRQLWVHHQQ-RXVVDRJESA-N 426.582 4.285 10 10 IICE COc1ccc(CNc2cc(I)ccc2Br)c(O)c1 311707090 JAOZPVWUAUKQCQ-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC[C@H](C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C)c1c(C)noc1C 726008951 ORMDMHVWHPHJJO-SFHVURJKSA-N 438.480 4.347 10 10 IICE Cc1cc(-c2csc(NC(=O)CNC(=O)c3ccccn3)n2)c(C)n1-c1ccc(F)cc1 740076409 ZJDRXBQURSKZKW-UHFFFAOYSA-N 449.511 4.120 10 10 IICE Cc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)n1 742749269 FFHSXIMFDZRHGF-SFHVURJKSA-N 432.952 4.105 10 10 IICE C[C@@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)cc(F)c1O 757639033 UGWHHISQSHRFKI-IAQYHMDHSA-N 449.299 4.357 10 10 IICE C[C@H]1CN(Cc2cc(Br)cc(Br)c2O)C[C@@]2(CCO[C@H](C)C2)O1 797604479 GTPQTSYOTJSPLB-PEBVRCNWSA-N 449.183 4.076 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@H]1Cc2ccc(Cl)cc2C1 800018903 KTFBEAXRICQMIL-SFHVURJKSA-N 435.902 4.377 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCCC4)cc3)n2C[C@H]2CCCO2)n1 802688167 DRNFPXNMVLTIEU-HSZRJFAPSA-N 446.599 4.454 10 10 IICE COc1ccc2c(CC(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)coc2c1 916457139 YAVZGBNUHCRKHY-UHFFFAOYSA-N 448.441 4.156 10 10 IICE CN(C)C[C@@H](Cc1ccccc1)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 919655063 QNNQTUUEVXTKPU-HSZRJFAPSA-N 434.584 4.230 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCc4cc(OC)c(OC)cc4CC3)c2C)cc1 919895088 VHNMAVDPXKSZIJ-UHFFFAOYSA-N 434.536 4.361 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(F)(F)c1ncccc1Br 1124939359 LXNMEYNEHUNBQN-UHFFFAOYSA-N 426.305 4.439 10 10 IICE Cc1cc(CC(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)c(C)n1-c1ccccc1 1127029800 IYFXKNYONJDCPX-UHFFFAOYSA-N 431.536 4.184 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccc(C(F)(F)F)cc3)c2)cc1 1130745291 SPFFECRLOCTBSF-UHFFFAOYSA-N 432.446 4.108 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCN3C(=O)[C@@H](C)Oc4ccccc43)c2C)c1 1132044830 YRBZITDIIOOYKE-HXUWFJFHSA-N 431.536 4.223 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCC[C@H](C(F)(F)F)O2)C1 1133272679 KDKLOQWNQYLWSY-IIBYNOLFSA-N 437.506 4.024 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)s1 1157071476 JYQBVKJLGLQBOL-KBPBESRZSA-N 443.548 4.040 10 10 IICE CC1(C)CN(C(=O)CSC2=NC(=O)/C(=C/c3csc4ccccc34)S2)CCO1 1166269263 YLHYSVMGMLKRKG-SXGWCWSVSA-N 432.592 4.242 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CC[C@@H](C(=O)OC(C)(C)C)c3ccccc32)C1 1168421840 QIOIQAMSLRTKEQ-IEBWSBKVSA-N 442.556 4.462 10 10 IICE CNC(=O)[C@@]1(C(F)(F)F)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1195739693 ZRXVRWGKNKPMCJ-HXUWFJFHSA-N 433.434 4.041 10 10 IICE CC1(C)CCCC[C@H]1CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1264770794 LVIYKDUWLMTNMC-FQEVSTJZSA-N 439.579 4.165 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@H](C)[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290415576 TWQRSDLQFQDRKU-LSDHHAIUSA-N 428.581 4.122 10 10 IICE COc1cc(OC)cc(C2(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)CCCC2)c1 1294823624 DFJBRUWSNADUIH-UHFFFAOYSA-N 442.531 4.012 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@@H]3C)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1304197099 XQSAPQRUVGHWJM-QUCCMNQESA-N 448.615 4.456 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@H](COC)C2)cc1 1313676989 HJRBLIPBVYLSKG-NRFANRHFSA-N 434.588 4.097 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCO[C@H]1C(C)C 1314304481 CMTVTMCUFBMYLJ-URXFXBBRSA-N 441.620 4.112 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)C[C@@H]2CCCOC2)cc1F 1314659201 SFLDWNMEQJLTKY-FQEVSTJZSA-N 429.584 4.127 10 10 IICE CO[C@@H](Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1315202610 CHBBLVDSEIUIFC-QFIPXVFZSA-N 449.603 4.033 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1ccnc(OCC(F)(F)F)c1 1359780939 OHSVIWUEIUWVEZ-UHFFFAOYSA-N 449.477 4.203 10 10 IICE COc1ccc(N2CCN(CCNC(=O)CSc3ccc(C(C)(C)C)cc3)CC2)cc1 1442474708 QTSVKJANTOQVQF-UHFFFAOYSA-N 441.641 4.023 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CCN(c2noc3ccc(Cl)cc23)CC1 1449124604 RHHYRRCGCZMTBE-UHFFFAOYSA-N 434.920 4.205 10 10 IICE O=C(CN1CCCCC[C@H]1C(F)(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1460773117 NPUVHLDWFNKFKX-IBGZPJMESA-N 430.426 4.207 10 10 IICE CCOC(=O)[C@](C)(NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1462846817 SCQIFXOHQIFCKX-HHHXNRCGSA-N 447.579 4.003 10 10 IICE CC(=O)Nc1ccccc1C(F)(F)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1464608614 WTIFJRQNHRHHJS-FQEVSTJZSA-N 445.510 4.011 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC2(c3cccc(F)c3F)CCCC2)N(C)C)cc1 1469786028 LAKXFAOJJZUHMG-QFIPXVFZSA-N 444.570 4.445 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCC1(c2cccc(Cl)c2)CCC1 1479136947 ISIWNFHJCHSJPR-UHFFFAOYSA-N 442.003 4.470 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCCCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1499052864 WALSPIUDDZVPHH-JOCHJYFZSA-N 438.664 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCC(F)(F)CC2)cc1 1501844435 SFKYCJXVERWAHI-UHFFFAOYSA-N 440.542 4.394 10 10 IICE O=C(CCCNC(=O)c1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1515929454 WQVOUHRXCHOAGF-UHFFFAOYSA-N 446.890 4.264 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCOc2cccc(C(F)(F)F)n2)CCCC1 1521384796 DMNULJHOBUHOMV-UHFFFAOYSA-N 447.457 4.138 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1csc(I)c1 1523554482 VPJOSOCXVVLGSP-UHFFFAOYSA-N 426.323 4.225 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3cc(F)ccc3Br)C2)cc1 1529708523 PDODTSMIPRXPPT-HNNXBMFYSA-N 435.337 4.172 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2nc(F)ccc2Br)cc1 1537497777 TVWPKSCYRHGNET-UHFFFAOYSA-N 434.231 4.254 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1OC 1544093249 AIKFXXHYWRFRAG-QFIPXVFZSA-N 441.572 4.376 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(CNC(=O)OC(C)(C)C)n(C)c1C 1557063068 CIXJWQIZEUXJTP-QGZVFWFLSA-N 442.604 4.094 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC/C=C/c2ccc(Br)cc2)N(C)C)cc1 1564815094 UUEGAGIEAZHQOQ-LYSGITKLSA-N 445.405 4.130 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(Nc4ccccc4Cl)CC3)C2)cc1 1565055505 DRDUIXBGVCXTKQ-SFHVURJKSA-N 428.964 4.213 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](C(=O)OC(C)(C)C)C(C)C)CCCC1 1584899103 QJHPKZVGOFNJNH-FQEVSTJZSA-N 428.573 4.259 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCC(CCN2CCCC[C@@H]2C)CC1 1611963741 YXNBBOOMLLIOGI-NRFANRHFSA-N 438.664 4.490 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCc3cccs3)CC2)cc1 1619301201 AXIIBALKFCZKSX-UHFFFAOYSA-N 425.602 4.431 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 1627467505 KAOAROHWOYRSQS-UHFFFAOYSA-N 447.539 4.314 10 10 IICE C[C@@H](NC(=O)c1coc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1)c1ccc(N(C)C)cc1 1633315823 XWINKAAPOVFFMS-BEFAXECRSA-N 428.533 4.304 10 10 IICE CC(C)CN(CCc1ccc(F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1637228076 GDWTZRBPAJYYAU-UHFFFAOYSA-N 427.564 4.197 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ccc2cccnc2c1O)Cc1ccccc1 1638573274 PTIDREOFDVCROT-FQEVSTJZSA-N 435.524 4.083 10 10 IICE COc1ccc2c(c1)CN(CC(=O)NCc1ccc(N(C)C)cc1)[C@@H](C1CCCCC1)C2 1642020758 OIUQYAHODQCQMI-AREMUKBSSA-N 435.612 4.385 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1ccc(Br)nc1N 1643540330 MFRPDCRAIJKFEC-UHFFFAOYSA-N 447.358 4.373 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3c(F)ccc(Br)c3C2)c([N+](=O)[O-])c1 1651108203 AFDCIJIMHFHUDF-XVNBXDOJSA-N 435.249 4.245 10 10 IICE O=C(NCc1c(O)cccc1O)c1cccc(OCc2ccccc2Br)c1 1652623624 XZYGETNSQOXZDW-UHFFFAOYSA-N 428.282 4.369 10 10 IICE CCCN(Cc1ccccc1O)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1653476308 UUOFXFRFANSEGG-QGZVFWFLSA-N 442.515 4.407 10 10 IICE Cc1cc(CNC(=O)N[C@@H](Cn2ccccc2=O)c2ccccc2)c(C)n1-c1ccccc1 1680556519 MYCIBNYYEAMCOE-VWLOTQADSA-N 440.547 4.497 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCO[C@H](c3ccncc3)C2)cc1 1682628277 PGFPZYMEZFBUEI-QPPBQGQZSA-N 434.540 4.373 10 10 IICE CC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1708106145 CHKSVQMTXTXXEF-UHFFFAOYSA-N 425.621 4.069 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2C[C@H](C)CC[C@@H]2C)cc1 1710023804 DHUHDIQGYYVMSS-UXHICEINSA-N 438.620 4.033 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](CC(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742699682 XYRUZQUGHXKANB-JOCHJYFZSA-N 449.647 4.435 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@H]3CCCCS3)CC2)cc1F 1748849434 QFGNKRJRMZJXAM-GOSISDBHSA-N 433.597 4.162 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](c3cnn(C)c3)C2)n1CCCSc1nccs1 1763598536 OVFXRIFWYBULSF-HZPDHXFCSA-N 431.635 4.158 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)C[C@H]2CCCCO2)cc1 1766613607 HYOOBGMAZGYGAP-XMMPIXPASA-N 448.615 4.164 10 10 IICE CCOCc1nnc(N2CCOC3(CCCCC3)C2)n1Cc1ccc(N(CC)CC)cc1 1767971035 AXDKERZVZMTPLA-UHFFFAOYSA-N 441.620 4.249 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)N(C)C)cc1 1858594167 NYBULIJBRKYUDG-LSCADSNKSA-N 443.550 4.108 10 10 IICE CN1C(=O)COc2cc(/N=N/N3CCN(C(c4ccccc4)c4ccccc4)CC3)ccc21 1860487557 DPNJWTYNSMIYGA-BYYHNAKLSA-N 441.535 4.448 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CC3)C(=O)N(Cc3ccc(F)cc3)C2=O)cc1 1873167008 ODFVKPYCFLEKSA-UHFFFAOYSA-N 429.495 4.265 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCc1cccc(Br)c1O)C2 2103449427 IAXVOPZOAQDPKL-RBVVOMGSSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NCc2cccc(Br)c2O)C12CCC2 2118417122 CAZJWIYDROOFKH-GDBMZVCRSA-N 425.367 4.328 10 10 IICE COC(=O)C1=C(C)N(C)C(=O)C1=Cc1cc(C)n(-c2ccc(Br)cc2)c1C 2294737407 RXYLUSUZSQBIEJ-UHFFFAOYSA-N 429.314 4.159 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352949590 GPVRGWGQPLIABY-JJXSEGSLSA-N 425.367 4.245 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2cccc(C)c2)c1C 3652080 VTXUGKVHJBBVRP-DHNIJCFSSA-N 434.536 4.254 10 10 IICE C[C@@H](CCCCC(=O)Nc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1ccc(O)c(O)c1 13887720 ZRBLJEGNAJFUPE-XOBRGWDASA-N 440.462 4.327 10 10 IICE CCCCC(CCCC)N/C=C1/C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O 19943090 SKCALVCPKXMROU-LGMDPLHJSA-N 436.350 4.254 10 10 IICE COc1cc(/C=C2\SC(=S)N(CNc3cccc(C)c3)C2=O)cc(OC)c1OC 59382172 VQMVTWKPLXQRLF-WQRHYEAKSA-N 430.551 4.292 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S)NCc1ccccc1 210733716 AOQIYLMYYHISRL-DEDYPNTBSA-N 435.574 4.466 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3cccc(Br)c3O)CC[C@H]2C1 401140046 VCPFGEZHRSWYSI-XHSDSOJGSA-N 425.367 4.280 10 10 IICE CC(C)c1noc(-c2ccnc(N3CC=C(CCN4C(=O)c5ccccc5C4=O)CC3)c2)n1 480820763 MHHOSYRXXUNMSW-UHFFFAOYSA-N 443.507 4.078 10 10 IICE CCOc1ccc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 748027974 VGTXNNVRKZEEDK-CQSZACIVSA-N 446.550 4.144 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3c(F)cccc3Cl)n2)c1 780704615 YJCOGZRVDBCTFR-UHFFFAOYSA-N 428.894 4.421 10 10 IICE O=C(COc1ccc(C(=O)c2ccccc2)cc1)NCc1cc(Br)ccc1O 804737622 MSRYOSWMNDGMOT-UHFFFAOYSA-N 440.293 4.081 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCOC3)n2C[C@@H]2CCCCO2)c(C)n1-c1ccccc1 812440493 CWCLWJTVXUTTTL-VXKWHMMOSA-N 435.572 4.147 10 10 IICE COc1ccc(N2CCCN(C[C@@](C)(O)c3ccc(Br)cc3F)CC2)cc1 815021985 LAUZSRXZIPNYGC-OAQYLSRUSA-N 437.353 4.017 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@@H](NC(=O)OC(C)(C)C)C1 1138319618 YLUXSJWVHNDMGV-LJQANCHMSA-N 425.529 4.036 10 10 IICE CON(C[C@@H]1CCC[C@H](C)C1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1141631577 GWFHANJBDZDGOS-LSDHHAIUSA-N 438.571 4.084 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@H](CC(C)C)c3ccc(Cl)cc3)CC2)cc1 1168623689 XKJZLRZPNMBPPO-ILBGXUMGSA-N 446.035 4.209 10 10 IICE CC[C@@H](C)c1ccccc1OCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266259246 VVHZDJGGROHWGO-OAQYLSRUSA-N 435.612 4.427 10 10 IICE CCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1ccccc1Cl 1294823297 GYROBYLJLFECNT-UHFFFAOYSA-N 442.922 4.198 10 10 IICE CCN(CC1CCC1)c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1295698981 SECORTNSMLOMLJ-UHFFFAOYSA-N 425.621 4.285 10 10 IICE Cc1ccc(C)c(C(=O)c2ccccc2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1301349558 IQDNHKDVXJPVSL-UHFFFAOYSA-N 442.559 4.426 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1 1312444772 XLMUXFYIQINPOB-OAQYLSRUSA-N 446.954 4.272 10 10 IICE CCOCCC1(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2ccccc2O)CCCC1 1314447409 LZMZAMOHOGNRGI-HXUWFJFHSA-N 428.577 4.111 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4ccc(OC)c(OC)c4)CCCC3)C2)cc1 1436968472 CFOOHUGDNJMQDZ-LJQANCHMSA-N 438.568 4.167 10 10 IICE CC[C@](C)(CCCNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C1OCCO1 1444854838 UAKJYNWMIRWRJM-RUZDIDTESA-N 426.557 4.135 10 10 IICE CC(C)[C@H]1CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CCS1 1444994815 WHQXJVGLWGIKMY-ABPVARSCSA-N 438.615 4.017 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1c[nH]nc1I 1446808201 WBWJWINXFZNEDY-ZDUSSCGKSA-N 447.276 4.124 10 10 IICE C[C@H]1CC[C@@H](C(F)(F)F)CN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1459928843 DCSCQAPXWHVKDY-UONOGXRCSA-N 430.426 4.063 10 10 IICE C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NCc3ccc(N(C)C)c(F)c3)cc2[N+](=O)[O-])C1 1519249832 UHMUJKUYDDNYIT-IYBDPMFKSA-N 428.508 4.212 10 10 IICE CCOc1ccc(Br)c(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1F 1528317467 KCKGFJOAEQHFEK-ZDUSSCGKSA-N 437.309 4.004 10 10 IICE C[C@H](Cc1cnc2ccccc2n1)C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1530325017 LBFPEKIAFSNKHZ-MRXNPFEDSA-N 430.474 4.466 10 10 IICE COc1ccccc1N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1531689930 DMUUMWRNADYIJF-QGOAFFKASA-N 430.526 4.089 10 10 IICE COc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1OC(C)C 1539582074 ONYQDEUFTYOQQG-MRXNPFEDSA-N 434.483 4.483 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1564634579 PRBGSUWNDKAUPO-HSZRJFAPSA-N 432.524 4.095 10 10 IICE CC[C@H](Cc1ccccc1)N(CC)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1564895745 SSVCAQBOHQRCHA-HXUWFJFHSA-N 431.527 4.354 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@H]1CCCOC1 1567449551 BFNATLQBXXIRRU-REWPJTCUSA-N 426.557 4.306 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)c2ccc(O)cc2)c(C)n1-c1ccccc1Br 1570781876 AQEVPLQHLIQIHN-QFIPXVFZSA-N 443.341 4.200 10 10 IICE CN1CCCc2cc(CNC(=O)C3(S(=O)(=O)c4ccc(F)cc4)CCCCC3)ccc21 1597847926 BQICRPBPILWQGE-UHFFFAOYSA-N 444.572 4.001 10 10 IICE Cc1cccc(-c2nnc(N3CCOC(C)(C)[C@H]3C)n2CCCSc2nccs2)n1 1612212789 RFGDUOAPXQZTGY-MRXNPFEDSA-N 444.630 4.291 10 10 IICE CCCCOCCn1c(C2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1614585840 ZCRANMGRNYIAPA-UHFFFAOYSA-N 445.583 4.227 10 10 IICE Cc1cc(CCNC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)c(C)n1-c1ccccc1 1623733434 IAHPHCTZWWFVHV-XMMPIXPASA-N 443.547 4.074 10 10 IICE O=C(Nc1ccc(F)cc1)Nc1cccc2c1CCN(C(=O)Cc1ccc(O)c(O)c1)C2 1628107754 GTUQJKHJWRMAFM-UHFFFAOYSA-N 435.455 4.008 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)Cc1ccncc1 1628408750 BBUUHWRFKNIGIN-JOCHJYFZSA-N 433.552 4.374 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C3CC3)c2C)cc1 1629739022 LPEMMAUAWYYWCI-OAQYLSRUSA-N 427.545 4.136 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@H](C)N(C(=O)c1cc(C)n(-c3ccc(Cl)cc3)c1C)C2 1635117717 ZRKUDWHJNWIJID-HNNXBMFYSA-N 440.931 4.165 10 10 IICE COc1ccc(Br)cc1-c1nc(C(=O)NCc2c(O)cccc2F)cs1 1635367034 WPCFHDKZIUCXIB-UHFFFAOYSA-N 437.290 4.356 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2nc(Br)ccc2O)CCCC1 1638891543 YUUCOEKJNRETNU-UHFFFAOYSA-N 430.302 4.031 10 10 IICE Cc1cc(C(=O)Cn2cnc3ccc(Cl)cc3c2=O)c(C)n1-c1ccc(Cl)cn1 1640728267 GEFHAIXXBLHQDE-UHFFFAOYSA-N 427.291 4.389 10 10 IICE COC(=O)CN(Cc1nnc(-c2cccc3ccccc23)o1)Cc1cc(Cl)ccc1O 1652735395 XMZWIDOILIGRAK-UHFFFAOYSA-N 437.883 4.424 10 10 IICE C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1653056940 SERFDGQHEOONQQ-CABCVRRESA-N 443.459 4.048 10 10 IICE COc1ccc(N2CCN(CC(=O)N(Cc3ccccc3)c3ccccc3)CC2)cc1F 1653749485 PSWZZXMFOQMQHG-UHFFFAOYSA-N 433.527 4.190 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@]2(CCN(C(=O)OC(C)(C)C)C2)C1 1683252972 BQICDRIZZPOULG-DFBJGRDBSA-N 444.620 4.035 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC([C@@H]2CCCO2)CC1 1693006458 ZJZSFOJDSQMWBI-QHCPKHFHSA-N 425.621 4.295 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCSC1 1694129364 CPSCVYZVTMEPPF-ZWKOTPCHSA-N 447.624 4.409 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1694338574 NCKIHBVVPDYWBH-QFIPXVFZSA-N 440.636 4.244 10 10 IICE CCCCN(C)CC1CCN(c2nnc(C3CC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1709601435 MFQHSADYLWKOIQ-UHFFFAOYSA-N 442.627 4.357 10 10 IICE COCCCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1712392997 WXZANBYGBPINQH-UHFFFAOYSA-N 440.979 4.267 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC(F)(F)C1 1723271690 UHKPWVUUIYFCIW-FQEVSTJZSA-N 447.574 4.385 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1 1743445846 PMBGYGCHRGTNIY-RUZDIDTESA-N 437.588 4.129 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(=O)OC)C1 1745077206 YOAIZCJZSQAHRL-FXVWLTTGSA-N 433.556 4.318 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1745223611 RJZASYTVZAIWHE-OAQYLSRUSA-N 448.615 4.021 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCN(C)C(C)C)n1 1751603713 FFDWAFCVQJIECN-UHFFFAOYSA-N 447.631 4.225 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCc1nccc(C(F)(F)F)n1 1752615637 MSCWOBUGEYMXNC-CQSZACIVSA-N 434.466 4.185 10 10 IICE CO[C@]1(C)CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768179173 BDQDDXWPRNFHFT-XMMPIXPASA-N 429.584 4.270 10 10 IICE COc1ccc(N2CCN(C(=O)CCn3nc(-c4ccccc4)c4ccccc43)CC2)cc1 1858210458 HZTHILGWCPCZJU-UHFFFAOYSA-N 440.547 4.451 10 10 IICE O=C(CCn1ccc2cc(OCc3ccccc3)ccc21)NCCc1ccc(O)c(O)c1 1860232552 FIGSYFCDEZGEIG-UHFFFAOYSA-N 430.504 4.381 10 10 IICE CCCCCCNC(=O)Cn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@@H]21 1860347426 OZCCLYNLCKJJMH-AREMUKBSSA-N 444.579 4.485 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cc(Br)c(OC)cc4o3)CC2)cc1 1871336413 MPTKEIQEHPKXSR-UHFFFAOYSA-N 445.313 4.175 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)ccc2O)C[C@H]1C1CC1 1895873457 GSHPMNVMBFVTHW-IRXDYDNUSA-N 425.367 4.422 10 10 IICE CC(C)(c1cccc(O)c1O)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1952542426 CRHBVBRKXDQSMO-HSZRJFAPSA-N 447.487 4.367 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C(C)C)c(CN)c2I)cc1C 2079972602 WZDLYHSQDCBMBT-GOSISDBHSA-N 439.341 4.392 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@@H](C)C(C)(C)O)c(Br)c1 2169925544 SXWWXOWOHOUPRN-KRWDZBQOSA-N 435.406 4.351 10 10 IICE CC[C@H](c1cc(Br)ccc1O)N1CC(COCc2ccccc2)(C(=O)O)C1 2284125871 QLKBNRSQVRXMNK-GOSISDBHSA-N 434.330 4.209 10 10 IICE CCC1=NN2C(=N)C(=Cc3ccc(OC(=O)c4cccs4)c(OC)c3)C(=O)N=C2S1 2293556267 AEXNOXCRJFNNPU-UHFFFAOYSA-N 440.506 4.005 10 10 IICE CCOc1cc(C=C2SC(N(C)c3ccc(Cl)cc3)=NC2=O)ccc1OCC(=O)O 2294787865 VQCYZORFWOCFLK-UHFFFAOYSA-N 446.912 4.309 10 10 IICE CC1=CC2=NC(=O)C(=Cc3cn(CCOc4cccc(C)c4)c4ccccc34)C(=N)N2O1 2297347424 JUWIWLRUEMPBNV-UHFFFAOYSA-N 426.476 4.479 10 10 IICE CCCOc1ccccc1C=C1SC(=S)N([C@@H](Cc2ccccc2)C(=O)O)C1=O 2314926590 MRTSSIFVOOMTKV-KRWDZBQOSA-N 427.547 4.373 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(NCc3cc(Cl)cc(Br)c3O)CC[C@H]1C2 2320537682 XTJHQTIUBNMPCB-SCLBCKFNSA-N 431.758 4.440 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352940324 DDOBQJRIWADFMX-GJZGRUSLSA-N 427.383 4.492 10 10 IICE O=C(/C=C/c1ccc(Oc2cccnc2)c(F)c1)NCc1ccc(N2CCOCC2)cc1 109971809 UFKRHANBDRCDIK-UXBLZVDNSA-N 433.483 4.179 10 10 IICE CCN(CC)c1ccc(C=c2sc3nc(-c4ccc(OCC(C)C)cc4)nn3c2=O)cc1 254601822 WLOYWICQEXGXHN-UHFFFAOYSA-N 448.592 4.247 10 10 IICE Cc1ccc(NC(=O)COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(F)c1 769664219 AYEHPWTYHZSVLU-UHFFFAOYSA-N 437.515 4.037 10 10 IICE O=C(Nc1c[nH]nc1[C@@H]1CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1)C1CCCC1 779619175 KKMRVVLDWIKNAJ-CQSZACIVSA-N 447.923 4.185 10 10 IICE O=C(c1cccc(O)c1O)N1CCO[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 790936308 APZIQZKKAKOKRR-OAHLLOKOSA-N 435.320 4.349 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCc2cc(Cl)ccc2N2CCOCC2)cc1 798489526 DURVJQMZEAZZHF-UHFFFAOYSA-N 445.007 4.364 10 10 IICE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 803030165 MDFJSLFEGJBMNO-PXNSSMCTSA-N 428.529 4.022 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccc(CNC(=O)c2cccs2)cc1 804734483 NJEDZBZRHAADGU-UHFFFAOYSA-N 445.338 4.076 10 10 IICE O=C(CCc1cc(F)ccc1Br)NCc1cc(Br)ccc1O 804738598 WQQUJMZRTFIAOR-UHFFFAOYSA-N 431.099 4.305 10 10 IICE CC(C)c1noc2ncc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)cc12 917715748 UMAVFQHDQMHBBO-GJZGRUSLSA-N 426.492 4.029 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C(\C)c3ccccc3Cl)CC2)cc1 1124584849 GHHZEYVVSDNRIK-VHEBQXMUSA-N 427.976 4.080 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@@H](C)c3ccc(Cl)c(Cl)c3)CC2)cc1 1136453875 AEYZYYUHPXTFAH-INIZCTEOSA-N 436.383 4.044 10 10 IICE Cc1cccc2nc(CCNC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)cn12 1252709228 DUPNOUTXUUVLRT-UHFFFAOYSA-N 431.540 4.256 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C 1255600005 RVWCVRNIZJEQOU-UYAOXDASSA-N 432.609 4.176 10 10 IICE C[S@@](=O)(=NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1 1289018869 JOALZNWTVBSKCO-AELSSEKOSA-N 448.566 4.101 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)cc2)cc1 1290250038 PJAWGGFVAQYVPI-UHFFFAOYSA-N 443.956 4.137 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCOc1ccc(Cl)cn1 1292832413 BQVINBDOYXAQNM-UHFFFAOYSA-N 440.979 4.205 10 10 IICE CSCC[C@H](C)N(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)c(F)c1 1302732168 QYMVKZWCBYYFCH-KRWDZBQOSA-N 442.608 4.095 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCCCCC3)n2Cc2ccc(N(C)C)c(F)c2)n1 1304758796 GVKOUIBQEKYTSB-UHFFFAOYSA-N 439.583 4.164 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCN(C)[C@@H]1c1cccs1 1306080541 MJBPYVOCZWOGFD-AVRDEDQJSA-N 425.602 4.327 10 10 IICE COCC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1315991857 LSORNCZHBDTDGD-PZJWPPBQSA-N 437.588 4.250 10 10 IICE CCc1ccc(N2C[C@H](C(=O)Nc3sc4c(c3C(=O)OC)CCCCC4)CC2=O)cc1 1354176608 POZMNVSEHZQCHO-MRXNPFEDSA-N 440.565 4.358 10 10 IICE Cc1cc(CC(=O)NCc2nnc3ccc(C(F)(F)F)cn23)c(C)n1-c1ccccc1 1356290982 MCPCNXHIQHLGOM-UHFFFAOYSA-N 427.430 4.015 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1CC[C@H](Cc2ccccc2)O1 1435331992 HWUAEBISDAGKGE-QIJUGHKUSA-N 430.495 4.163 10 10 IICE COc1cc(-c2ccccc2)sc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1439326499 IYBGVYMXYPMIEU-UHFFFAOYSA-N 449.576 4.055 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CSC[C@@H]3C(=O)Nc3ncc(C)s3)c2C)c1 1443281880 PATBXYOHCQSFBD-LJQANCHMSA-N 440.594 4.321 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCN1C(=O)CCc2cc(F)ccc21 1445653785 IRNHZJDOMJYRKS-UHFFFAOYSA-N 449.320 4.012 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3[nH]c4ccccc4c3Br)C2)cc1 1452035054 YEEVMUVEJWCYMG-AWEZNQCLSA-N 428.330 4.195 10 10 IICE Cn1ncc(NC(=O)OC(C)(C)C)c1CCC(=O)NCc1ccc(N2CCCCC2)cc1 1452051329 KGPKPYZWUUEYBR-UHFFFAOYSA-N 441.576 4.006 10 10 IICE Cc1oc(-c2ccccc2)c(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1C 1462802129 CSFJDCBUUHOUPW-UHFFFAOYSA-N 431.536 4.195 10 10 IICE CN(c1ccc(CNC(=O)c2cc3c(cc2Cl)NC(=O)CO3)cc1)C1CCCCC1 1464534549 DFHSFAXLEPLZHS-UHFFFAOYSA-N 427.932 4.370 10 10 IICE COc1ccccc1[C@H](CO)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1466357045 NDMXCYBZCYXWAJ-FQEVSTJZSA-N 443.341 4.329 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512386999 RALVLDQYORBMOI-SFHVURJKSA-N 429.584 4.298 10 10 IICE CCCN(CC)CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1514703559 SKBPUBHMZSHQLJ-IFMALSPDSA-N 443.636 4.271 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(CCC(F)(F)F)s3)cc2F)C[C@@H](C)O1 1527482236 VPZNYBKNJGIWGB-BETUJISGSA-N 445.482 4.321 10 10 IICE CC[C@H](C)NS(=O)(=O)c1cccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 1534503075 RJDAIPWIDBZRHH-INIZCTEOSA-N 425.554 4.423 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c(C)n1-c1ccccc1 1536262364 RZBRYAQAIBXOKH-UHFFFAOYSA-N 431.536 4.118 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4ccccc4nc3Cl)cc2F)CC1 1537534553 DOXDCCNMWXYXHO-UHFFFAOYSA-N 426.923 4.099 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@](O)(c1nc2ccccc2s1)C(F)(F)F 1540518311 JTBXQTQUXRLRJC-FQEVSTJZSA-N 437.487 4.161 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(Br)cncc2s1 1540536417 CDTJSGDDEULNNJ-UHFFFAOYSA-N 446.370 4.168 10 10 IICE Cc1ncc(CN(C)c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)cc2C)s1 1542958588 FYCQYFNAFUXKPX-UHFFFAOYSA-N 447.612 4.088 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2C[C@H](C)S[C@H](C)C2)cc1 1547447087 OAWCFLXQUVVOIW-WSTZPKSXSA-N 429.634 4.007 10 10 IICE CCOC1(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCCC1 1547929881 NOUJJOSNCKYJMX-UHFFFAOYSA-N 441.620 4.224 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](Cc2ccccc2)[C@H](C(=O)NCc2cc(Cl)ccc2O)C1 1557387563 VGTUQVKCTLPIAF-UYAOXDASSA-N 444.959 4.388 10 10 IICE Cc1cccc(CN2CCO[C@H](CNC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)c1 1557975222 VYPMFHMGKPVQPD-XMMPIXPASA-N 431.580 4.342 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC2(CC1)OCCc1ccsc12 1564946186 ZGORFYNFWLGVNB-SFHVURJKSA-N 427.614 4.327 10 10 IICE Cc1cccc(-c2nnc(N3CCSC(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1612214156 AZYYKSHJTICUMS-UHFFFAOYSA-N 436.629 4.403 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)CCCO1 1612961434 YMXCSVULKWKKSU-INIZCTEOSA-N 447.605 4.262 10 10 IICE CC1CCN(c2ccc(CNC(=O)C3(C(=O)Nc4c(F)cccc4F)CC3)cc2)CC1 1616695225 NSKNGGHLQSPMOF-UHFFFAOYSA-N 427.495 4.236 10 10 IICE Cc1ccc(OCc2cccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2)cn1 1616858149 IFQQAYRDQHAWEL-RUZDIDTESA-N 432.568 4.068 10 10 IICE CO[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1620132486 XCYIRZBJLPMZMX-JOCHJYFZSA-N 425.621 4.376 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCN(C(=O)OC(C)(C)C)C1CC1 1622328479 ZZVHCKINUQTQBD-UHFFFAOYSA-N 441.366 4.293 10 10 IICE CCCN(CC)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 1622635155 RQNNFCJQGHPALW-FQEVSTJZSA-N 430.980 4.071 10 10 IICE COc1cccc(-n2cc(C(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)nn2)c1 1623924072 GCLHKUNQRJFKQT-GOSISDBHSA-N 428.492 4.385 10 10 IICE Cc1scc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1C 1624048075 OHHVJJDBYZDSPF-RQZCQDPDSA-N 434.583 4.412 10 10 IICE CC(C)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NCc1ccc(N2CCSCC2)cc1 1625969509 CZVJOTLRFQHDKL-FQEVSTJZSA-N 449.661 4.432 10 10 IICE CCC[C@@H](Cc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1627955618 PMKMFQNCIMLNBF-KRWDZBQOSA-N 444.578 4.396 10 10 IICE COc1cccc(-c2noc([C@H](C)NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)n2)c1 1629147232 PQISXOGUMPFPNX-INIZCTEOSA-N 444.491 4.456 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC2CN(C(=O)OCc3ccccc3)C2)c1 1629738500 SAIHSXFXOYBBJN-UHFFFAOYSA-N 437.927 4.498 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3=Cc4ccccc4O[C@@H]3C(F)(F)F)C2)cc1 1630618746 GLJAYCABHMTJQD-BTYIYWSLSA-N 432.442 4.045 10 10 IICE C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1633746755 KREXBAOETVBCSL-SFHVURJKSA-N 444.576 4.361 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 1635284202 KXZVRLWFEGTZHM-IEBWSBKVSA-N 436.961 4.263 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)cc1 1636405161 DNAYTOSUHISRRT-KRWDZBQOSA-N 440.975 4.465 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)CN(C(=O)N1Cc3cccc(O)c3C1)CCO2 1638060794 FXIFZFOPGURTJL-UHFFFAOYSA-N 425.485 4.069 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639897994 UDAHHYPGBBPOBN-APWZRJJASA-N 432.362 4.283 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H]2CCOC2)c(C)n1-c1ccc(Br)cc1 1645743115 GZFWFGNUTQHPJR-FXAWDEMLSA-N 447.373 4.124 10 10 IICE O=C(N[C@@H]1CCCc2ccccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1648288499 UPOPKDXHFPFRSM-GOSISDBHSA-N 428.535 4.062 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]3[C@H](C2)C3(F)F)sc(C)c1-c1ccccc1 1653831042 ZCWXMKSTHJPBRK-CVEARBPZSA-N 434.508 4.426 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H](CNC(=O)OC(C)(C)C)[C@@H](C)C3)cc2)CC1 1656339490 RZMUPVWCFNRBNG-FPOVZHCZSA-N 431.621 4.285 10 10 IICE CC(=O)N(c1ccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1)[C@@H]1C[C@@H]1C 1662054469 QXCJNJDBTOEJRB-HOOSLVGPSA-N 436.556 4.167 10 10 IICE COc1cc(N2CCN(C(=O)NC3CCC4(CCCCC4)CC3)CC2)cc(OC)c1OC 1681390064 FGZGOHWHXUNGDC-UHFFFAOYSA-N 445.604 4.437 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](C)NC(=O)OC(C)(C)C 1682101857 VXJMHLFPRGTQBT-CNNODRBYSA-N 446.636 4.469 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)cs1 1693341675 XBXWIOJOGBLXOC-UHFFFAOYSA-N 447.612 4.088 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1)OC 1695114732 OMXYDILBWHDLFU-VXKWHMMOSA-N 437.588 4.393 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C(C)C)C1 1697994989 GEBNZLAGDOAUOR-HSZRJFAPSA-N 437.588 4.250 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccccn3)CC2)n1Cc1ccc(N(CC)CC)cc1 1708528114 GQESHDZEPHVEGS-NRFANRHFSA-N 447.631 4.408 10 10 IICE COCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)CC1 1730568656 UMLKHIJHHVTZOM-IBGZPJMESA-N 437.588 4.250 10 10 IICE Cc1cccc(CCn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)n1 1742344095 IUDUKDQEHNKEMQ-FYYLOGMGSA-N 449.599 4.485 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CC[C@H](CC(C)C)C2)cc1 1746090221 QYNHNLJOKIHJPX-OAQYLSRUSA-N 435.620 4.446 10 10 IICE Cc1csc(CN(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)c1 1762230757 PNWSXMDAHHAHIB-UHFFFAOYSA-N 445.643 4.324 10 10 IICE CCCNC(=O)[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N(CC)CC)cc2)C1 1764502988 FDCBWNDSPWWLED-OAQYLSRUSA-N 440.636 4.039 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CCS1 1765264519 MXMPMNGIHGVEAV-NRFANRHFSA-N 436.629 4.403 10 10 IICE COc1ccc(OCc2nnc(N3CC[C@@H](C)C3)n2CCCSc2nccs2)cc1 1770281567 VPMHNIYMOUGNNQ-MRXNPFEDSA-N 445.614 4.351 10 10 IICE C[C@@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1cc([N+](=O)[O-])ccc1O 1951719950 DLGKTAHYTZLCDX-DEOSSOPVSA-N 448.431 4.139 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)[C@@H](N)c1ccc(N2CCCC2)cc1 1999537237 VRUBYAYSIILFOO-GOTSBHOMSA-N 425.573 4.397 10 10 IICE Cc1nn(Cc2ccc(Br)cc2O)c(I)c1C(F)F 2079590457 NQCGKZZHLSTEKS-UHFFFAOYSA-N 443.029 4.250 10 10 IICE COc1ccc(Cn2nc(C(C)(C)C)c(C3CC3)c2I)c(O)c1 2079819699 BWLVTPCLTBUPSQ-UHFFFAOYSA-N 426.298 4.425 10 10 IICE N=C1C(=Cc2ccc(OCc3ccccc3)c(Br)c2)C(=O)N=C2SC=NN12 2293541149 HYRZFFUPWPPPJE-UHFFFAOYSA-N 441.310 4.277 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C(=O)O)cc4C)o3)C2=O)cc1C 2293561018 IKONIBMODBLOQM-UHFFFAOYSA-N 444.443 4.236 10 10 IICE COc1ccc(N2C(=O)C(=C3C(=O)Nc4ccc(Br)cc43)SC2=S)cc1 2296679733 HFKLKBRDAIRWDK-UHFFFAOYSA-N 447.335 4.186 10 10 IICE O=C1NC(=O)N(c2cccc(Br)c2)C(=O)C1=Cc1ccc(Cl)cc1Cl 2297550937 PTXDSYXVGAVMPD-UHFFFAOYSA-N 440.080 4.422 10 10 IICE CCOc1ccc(NCN2C(=O)C(=Cc3cc(OC)ccc3OC)SC2=S)cc1 2313502155 WLHBYMVMKPXQKV-UHFFFAOYSA-N 430.551 4.373 10 10 IICE Cc1cc(C=C2C(=O)NC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)n1C[C@H]1CCCO1 2313630178 UADVIOGNABQCIR-JOCHJYFZSA-N 443.503 4.104 10 10 IICE CCCN1C(=O)C(=Cc2c(Oc3cccc(C)c3)nc3ccccn3c2=O)SC1=S 2314504418 NXCSNLZADBLNMB-UHFFFAOYSA-N 437.546 4.406 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccccc1 2314828222 RMTZMUAKWJSAHE-UHFFFAOYSA-N 427.507 4.215 10 10 IICE CCOc1ccc(C=C2C(=O)N(c3ccccn3)N=C2c2ccc(OC)cc2)cc1OC 2332124451 DCQKCJORXHSLEM-UHFFFAOYSA-N 429.476 4.332 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)c(O)c1Br 2381133779 SNHHICIZCKGWKJ-HIFRSBDPSA-N 441.366 4.020 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cc(C)cc(C)c3)C2)sc2c1CCCC2 11356149 AZJOYUZDUZLYKK-INIZCTEOSA-N 440.565 4.412 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)c(C(=O)O)c1OC 16906167 NOKMSLBWLJTMRH-RIYZIHGNSA-N 435.910 4.461 10 10 IICE COCCN1C(=O)/C(=C\c2ccc(OCc3cccc([N+](=O)[O-])c3)cc2)SC1=S 33436398 XBAFNMOQXNPNHL-LDADJPATSA-N 430.507 4.021 10 10 IICE O=C1N=C(O)/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)C(=O)N1CCc1ccccc1 59861806 IQNOENKGTOFVBU-XMHGGMMESA-N 431.404 4.400 10 10 IICE CCOC(=O)Cc1sc(NS(=O)(=O)c2ccc(CC)cc2)nc1-c1ccccc1 71556433 GVZUHXGTZLUTIF-UHFFFAOYSA-N 430.551 4.279 10 10 IICE O=C1/C(=C\c2cccn2-c2ccc([N+](=O)[O-])cc2)C(O)=NC(=S)N1c1ccccc1F 83311724 QAMKMFMCRQUACL-VBKFSLOCSA-N 436.424 4.196 10 10 IICE COc1ccc(N2CCN(c3ncccc3-c3nnc(-c4ccc(C)cc4)o3)CC2)cc1 96339005 XRVFMCABDUHTBB-UHFFFAOYSA-N 427.508 4.442 10 10 IICE Cc1ccc2nc(N3CCOCC3)c(/C=C3/SC(=S)N(CC(C)C)C3=O)cc2c1 208279869 OQHFYSDWHDENFU-XDHOZWIPSA-N 427.595 4.237 10 10 IICE COc1ccc(N(Cc2nnnn2-c2ccccc2Br)[C@H](C)C2CC2)cc1 732202958 JVKFOIORNVPQBY-CQSZACIVSA-N 428.334 4.239 10 10 IICE COc1ccc(O)c(CNC(=O)c2cccnc2Oc2ccc(F)cc2Br)c1 734016135 ATPNVQZBADFKIS-UHFFFAOYSA-N 447.260 4.420 10 10 IICE CCC(C)(C)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1 752222825 RMOIANRMORMSRH-NRFANRHFSA-N 436.600 4.075 10 10 IICE COC(=O)c1ccc(O)c([C@H](C)Nc2cc(C(=O)N3CCCCCC3)ccc2OC)c1 757588915 CDHRANDXLSQRDV-INIZCTEOSA-N 426.513 4.377 10 10 IICE O=C(CN1CCOC[C@H]1C[C@@H](O)c1ccco1)Nc1ccc(N=Nc2ccccc2)cc1 763664047 KLIOMGRDKCDDPO-FGZHOGPDSA-N 434.496 4.458 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc([C@H]4CCCOC4)c3)cc2F)C[C@@H](C)O1 766367800 PPPCVAZHGBTQGU-SVMVAKDDSA-N 426.532 4.263 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)COC(=O)c3cnc(C(=O)OC(C)(C)C)cn3)c2C)c1 801891105 HFWMAOSJIFSEDE-UHFFFAOYSA-N 449.507 4.188 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCCN2Cc2ccc(N3CCOCC3)c(F)c2)C1 816658273 JDVVTLMEUSGCGH-RBBKRZOGSA-N 447.595 4.274 10 10 IICE CCOC(=O)c1c(NC(=O)c2ccc3c(n2)OCCO3)sc(C)c1-c1ccc(F)cc1 1124634751 FCYKGKRBTCWHGA-UHFFFAOYSA-N 442.468 4.458 10 10 IICE CN(C)c1ccc(CN(C(=O)c2nn(C)c(C(F)(F)F)c2Br)C2CC2)cc1 1124905869 WRPWQFBOTVTUKU-UHFFFAOYSA-N 445.283 4.072 10 10 IICE Cc1cc(CC(=O)N(CCC(=O)OC(C)(C)C)C2CCOCC2)c(C)n1-c1ccccc1 1130406374 HKQMTXPPBALXDG-UHFFFAOYSA-N 440.584 4.376 10 10 IICE Cc1ccc(O[C@@H](C)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134682173 YYAJCTRUCYOVFA-OXJNMPFZSA-N 448.405 4.010 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccccc3O)CC2)c(C)n1-c1ccc(Cl)cc1 1149872101 OMMKMTZSYLFBMT-UHFFFAOYSA-N 437.927 4.051 10 10 IICE C[C@H](NC(=O)c1cnc(Br)c(Br)c1)c1ccc(N(C)C)cc1 1269588666 TYROMHGCNQHBGV-JTQLQIEISA-N 427.140 4.164 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H]3C(C)C)n2Cc2ccc(N(C)C)cc2C)n1 1290638884 MGVRGGHWFYLGDO-QHCPKHFHSA-N 435.620 4.187 10 10 IICE CO[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCCC1 1293793743 QYGAMBSHHLYJRX-SFTDATJTSA-N 433.593 4.030 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1293884055 SYALDMPUGDMXLW-HXUWFJFHSA-N 448.615 4.406 10 10 IICE COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)NCc2cc(Cl)ccc2O)cc1 1300396363 PNVOMMLSSVQKDZ-UHFFFAOYSA-N 428.847 4.376 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCCN(Cc3ccccc3)CCOCC2)cc1 1304165336 VEBPZQVJRYVCNY-UHFFFAOYSA-N 431.580 4.459 10 10 IICE CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)N1CCOCC1 1306923942 ICIMBMQZVQTTMJ-QHCPKHFHSA-N 425.529 4.375 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1312883687 DZEHMOKJKSOXCH-CVDCTZTESA-N 425.573 4.088 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCN(c4ncccc4F)CC3)c2C)c1 1313132488 NVVHVSINGFXKCL-UHFFFAOYSA-N 435.547 4.359 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1(c2ccccc2)CC1 1352259936 YMOTWCKRNOOPFC-NBVRZTHBSA-N 426.538 4.223 10 10 IICE O=C(C[C@H]1CSc2ccccc2O1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354767412 NZAYCRVZHRVRIY-QAPCUYQASA-N 434.508 4.316 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(Br)cc3Cl)C2)cc1 1436971342 MZPYSKTUEWYEFI-AWEZNQCLSA-N 437.765 4.296 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccco2)N(C)C)c(C)n1-c1cccc(Br)c1 1440550337 CBLWHNHQJMVVLX-LJQANCHMSA-N 430.346 4.482 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C)[C@@H]2CNC(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1445158658 OONHPMKZFUJJLX-UZLBHIALSA-N 426.561 4.255 10 10 IICE C[C@H](NC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCC3)c1ccccc1O 1454820994 UTWXPAGHQFSKNN-LBPRGKRZSA-N 429.567 4.092 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)C[C@@H](O)COc2ccc(C(F)(F)F)cc2)c1O 1459494197 VLMMKOYIAJMAGF-MRXNPFEDSA-N 431.838 4.139 10 10 IICE Cc1c(Br)cnn1CC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1459584356 POENELQHFPNAEV-ZDUSSCGKSA-N 439.785 4.160 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](C(N)=O)[C@H](C)c3ccccc3)cc2Cl)C1 1469960130 OLXJNVQQICVHAO-DRSNIGMVSA-N 442.991 4.033 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCc1nc(O)c2c3c(sc2n1)CCC3 1472607435 NZIRJTNKQJGKPV-UHFFFAOYSA-N 438.597 4.321 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C3)cc2)CC1 1473252199 JSSKLVHZYIXZJD-PZJWPPBQSA-N 431.621 4.427 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@@H]2CC2(O)CCCCC2)N(C)C)cc1 1479535652 YAYXILPNKVZPDX-PKTZIBPZSA-N 430.637 4.005 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1500010006 WWQAWLQSMRLEPY-SFHVURJKSA-N 446.603 4.402 10 10 IICE COCCN(Cc1c(C)nn(C)c1C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1528097401 DPIFIIMBLKAGFJ-UHFFFAOYSA-N 442.991 4.316 10 10 IICE CCCc1nccnc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1532023287 IVHXUXILRITSLB-QINSGFPZSA-N 432.596 4.111 10 10 IICE CN(c1ccc(CNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2)cc1)C1CCCCC1 1542412355 XITKMRJHVMAPJI-UHFFFAOYSA-N 436.531 4.394 10 10 IICE C[C@@H]1CCCCN1CCCCn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O 1544017805 RRHPDFUGUDYKRI-HXUWFJFHSA-N 436.604 4.280 10 10 IICE Cc1cc(CCNC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1557819003 SMZJYSBLWHQQPL-HXUWFJFHSA-N 425.573 4.400 10 10 IICE CCOCCCN1CC[C@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@H](C)C1 1565726638 XFLFFRFWNYKUHW-DVECYGJZSA-N 439.600 4.082 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1 1566374291 BXHLSCNWGQAKQC-GZOOOWMASA-N 448.922 4.369 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1 1568137234 KBWZUHCUDJRFMB-QGZVFWFLSA-N 445.357 4.337 10 10 IICE CCN(C)C(=O)OC[C@H]1CCCCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1568721351 UZOBIHNYXHXHDD-JOCHJYFZSA-N 439.556 4.298 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@@H]1CCCOC1 1583308286 LLDLZANNLRRLDD-QBGPEFOPSA-N 438.640 4.051 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N2CCO[C@H](COC(C)C)C2)cc1 1615379319 GARAIFIOOWKNKI-QHCPKHFHSA-N 441.620 4.070 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1 1618809818 LMNOCMYRRHCWML-LJQANCHMSA-N 441.535 4.249 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](O)c1ccc(Cl)c(Cl)c1 1622635233 UQTSUKNYGHJHRF-HNAYVOBHSA-N 443.758 4.167 10 10 IICE Cc1ccc(N2N=C(Br)C[C@H]2C(=O)NCc2ccc(N3CCCC3)cc2)cc1 1624321674 GVMXQGVYVVCPRD-FQEVSTJZSA-N 441.373 4.199 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1629144377 DURJRSHIEGZYBL-NJBZPOFQSA-N 426.513 4.056 10 10 IICE Cc1cc(C(=O)Nc2nc3c(s2)CS(=O)(=O)CC3)c(C)n1-c1ccc(C(C)C)cc1 1629804682 ZYOHERDOUPBYLK-UHFFFAOYSA-N 443.594 4.397 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1sc(SCC(C)C)nc1C 1630481204 OWWWBOJPDNUGGD-UHFFFAOYSA-N 436.599 4.040 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2ccc(N3CCOC3=O)cc2)cc1 1631239428 QTJFZLUSLOLOGL-GOSISDBHSA-N 445.519 4.283 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(OCc4ccccc4)cs3)CC2)cc1F 1631380537 IWYCFPYBQBSEJP-UHFFFAOYSA-N 426.513 4.437 10 10 IICE Cc1ccc(C(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1632108513 SVPDIKWGWYOWDN-QFIPXVFZSA-N 428.891 4.471 10 10 IICE CC[C@H](CSc1ccccc1)NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1633461577 POJTUVWZRCELNW-GOSISDBHSA-N 429.586 4.106 10 10 IICE Cc1cc(C(=O)N[C@H](CO)C(=O)OCc2ccccc2)c(C)n1-c1cccc(C(C)C)c1 1637802555 QPKKGEOZGDLAAD-XMMPIXPASA-N 434.536 4.052 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](OCC1CCCC1)c1ccccc1 1639587992 NQLUTWUDRQFEFP-XMMPIXPASA-N 425.525 4.232 10 10 IICE COC(=O)c1cc(OCC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)ccc1N(C)C 1641368815 XJYLVZBPAARHDF-XMMPIXPASA-N 444.531 4.092 10 10 IICE Cc1nc(C)c(Br)c(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1651492101 DDCRKLROTNAYLV-OAHLLOKOSA-N 425.758 4.291 10 10 IICE CCOc1ccc(N2CCN(Cc3nc4ccc(Br)cc4n3C)CC2)cc1 1657875551 BLWQJHHMUCARDG-UHFFFAOYSA-N 429.362 4.057 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(Cc4cccc(F)c4F)CC3)C2)cc1 1682645777 JRTBFJZWYYLISW-IBGZPJMESA-N 429.511 4.216 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC(c3cccs3)c3cccs3)cc2)CC1 1683701850 NIGMEXHDBSICCH-UHFFFAOYSA-N 426.611 4.150 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@H]2Cc2cc(F)ccc2F)N(C)C)cc1 1685609214 MEWMHWAKANSMHJ-GGAORHGYSA-N 430.543 4.050 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCc3c(ccnc3N(C)C)C2)nnc1C(C)(C)C 1693010203 SOCQZCQCJCQGET-UHFFFAOYSA-N 447.631 4.022 10 10 IICE CCc1nnc(N2CC[C@@H](c3ccc(OC)cc3)C2)n1CCCSc1nccs1 1709078947 IKMJBCTXDSMYSX-QGZVFWFLSA-N 429.615 4.482 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H]3OCCC[C@H]3C2)cc1 1710026989 VCEVOZNNCGRBFQ-JTHBVZDNSA-N 425.621 4.376 10 10 IICE Cc1ccc(OCc2nnc(N3CCO[C@H](C)C3)n2CCCSc2nccs2)cc1 1724439064 NLSSRZTXPQMUJV-QGZVFWFLSA-N 445.614 4.030 10 10 IICE CC[C@@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1744932896 ZXYFXJQDPNVUMO-WOJBJXKFSA-N 425.621 4.285 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@H]1C[C@H](F)C1 1752608529 DTNNDDGLRISRKK-JBACZVJFSA-N 429.584 4.403 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](NC(C)=O)C1 1763605761 LOFZIFIMDPANEP-FLVSMNSFSA-N 446.599 4.424 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1763781910 JFWGZEOUSIAUGM-GOSISDBHSA-N 446.603 4.402 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C1 1768035831 ZSINSEAKBAHMNS-OAQYLSRUSA-N 436.604 4.041 10 10 IICE COC[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1770902174 VNUSNDWXZFKAKF-PZJWPPBQSA-N 437.588 4.250 10 10 IICE O=S(=O)(c1ccc(Br)cc1)N1CCn2c3c(c4ccccc42)CCC[C@@H]31 1858183452 CIAZCFKDAKZWKW-IBGZPJMESA-N 431.355 4.486 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)c(OC)c1 1860085041 IELDEHHJMKYMOT-LZYBPNLTSA-N 431.564 4.436 10 10 IICE CCN1CCc2cc([C@@H](O)[C@@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044721160 ZPOYPJSTSPWEKD-ISKFKSNPSA-N 439.600 4.128 10 10 IICE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@@H](O)c1ccc(N2CCCC2)cc1 2044729677 INLUCHANGVJONU-XMMPIXPASA-N 439.600 4.347 10 10 IICE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](NC(=O)OC(C)(C)C)[C@H](C)OCc1ccccc1 2044755263 VXXBCNDUBDPENG-NTUVXCKYSA-N 439.600 4.438 10 10 IICE CC(C)[C@@H]1[C@@H](NCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2126372082 OSSSSTGQLLVFOX-JKSUJKDBSA-N 431.346 4.417 10 10 IICE CCCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2C(=O)O)SC1=S 2314770169 ZYSBLMUIDCPYPH-SFHVURJKSA-N 441.530 4.281 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC(NCc3c(O)cccc3Br)C[C@H](C2)C1 2339995111 PLRISLRVXBJBKV-KBPBESRZSA-N 425.367 4.280 10 10 IICE O=C1/C(=C\NCCc2ccc(O)cc2)C(c2ccccc2)=NN1c1nc2ccccc2s1 19631907 FNLKKYVLBNKSHE-SILNSSARSA-N 440.528 4.469 10 10 IICE CCN1C(=O)/C(=C\c2c(Sc3ccccc3)nc3ccc(C)cn3c2=O)SC1=S 33305383 BYKFWOOVYVIDMJ-LFIBNONCSA-N 439.587 4.375 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc4c(c3)OCO4)C(=O)N=C2O)c(C)n1-c1ccc(F)cc1 33316236 WMWDJEYZMBZGDE-GRSHGNNSSA-N 447.422 4.469 10 10 IICE COc1cccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc3C2)c1 35349265 FMHAEGAWAKEKOL-AREMUKBSSA-N 429.564 4.291 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cccc(OCc4c(C)noc4C)c3)CC2)cc1 110362714 LRTAMJVGOIHLEJ-UHFFFAOYSA-N 435.524 4.278 10 10 IICE CCOC(=O)c1c(NC(=O)CCN(C)Cc2noc(C)n2)sc(C)c1-c1ccccc1 782053264 BVQBYQFWNYOCDU-UHFFFAOYSA-N 442.541 4.052 10 10 IICE C[C@H](N[C@@H]1CCN(C(=O)COc2ccccc2)C1)c1ccc(N2CCCCC2)c(F)c1 800993691 MSHJKKRVZQHDFB-PZJWPPBQSA-N 425.548 4.147 10 10 IICE Cc1ccc(CNC(=O)NCc2cc(Br)ccc2O)c(OC[C@H]2CCCO2)c1 805198644 RYLFMWKLSPUFKO-GOSISDBHSA-N 449.345 4.020 10 10 IICE COc1cc(OC)c(CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c(OC)c1 918231008 RTQUZXKKROZJDC-UHFFFAOYSA-N 427.545 4.044 10 10 IICE CCCO[C@@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)cc1C 1129549420 JWCSWEVURMVRNK-JOCHJYFZSA-N 436.474 4.033 10 10 IICE O=C(CSc1ccc2ccccc2c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549663 UZWGEOQRNVIOBI-UHFFFAOYSA-N 428.504 4.363 10 10 IICE Cc1ccc(-n2ncc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2C(C)C)cc1 1134681579 ASLBQCJRVFDHHI-XMMPIXPASA-N 433.600 4.403 10 10 IICE CCOC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(O)c1 1137441795 MYIHICHEWQJRSE-QHCPKHFHSA-N 440.927 4.416 10 10 IICE CC(C)Cc1ncnc(NCCCSc2nccs2)c1I 1162438176 SJCYQXBAUMXJBB-UHFFFAOYSA-N 434.372 4.331 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H](C)c1cccc(OC)c1 1190474110 CXIQWSAQNDACCB-QGZVFWFLSA-N 442.515 4.492 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc3ccn(C)c3c2)NC(=O)OC(C)(C)C)cc1 1293793232 MHVAFXGMVNYWKV-OAQYLSRUSA-N 436.556 4.240 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@@H]1Cc1ccccc1 1294481915 OVTWOKCKAUCNJC-GCFJHJGGSA-N 440.565 4.261 10 10 IICE CCOc1ccc(SCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1294858210 AUPYJGLNZIXZPB-GOSISDBHSA-N 434.989 4.317 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CCCCC[C@H]3NC(=O)OC(C)(C)C)CC2)cc1 1295275174 IZZICPSREDQCPU-FCHUYYIVSA-N 445.604 4.208 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CC1CCC(C(=O)OCC)CC1 1297229022 YRAZVKYUWWSTKA-UHFFFAOYSA-N 446.588 4.135 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2ccccn2)n1Cc1ccc2c(c1)CCCN2C 1302727184 ZPDDTSKXEBHAQY-GOSISDBHSA-N 436.629 4.349 10 10 IICE CCCN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(CC)CC)cc1 1306774086 AFBPKKMFZFNRAQ-UHFFFAOYSA-N 431.588 4.257 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCCO)C1 1316322219 MXQLHMLYKRVALR-QFIPXVFZSA-N 437.588 4.130 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(O[C@H]4CC4(F)F)cc3)cc2F)C[C@@H](C)O1 1350933543 OUYDISXEVUXHNI-ZSDSOXJFSA-N 434.458 4.156 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 1354113813 OFYRDDZBZHVAQC-UHFFFAOYSA-N 428.444 4.065 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)OCc2ccc(Br)cn2)CCCC1 1357961375 CPDNWARUUUUNRT-UHFFFAOYSA-N 429.314 4.430 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)(F)F)n2CC2(O)CC2)c(C)n1-c1ccccc1 1361045725 HMNLWVOCLAZNDC-UHFFFAOYSA-N 433.478 4.266 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 1440681590 HIOMSHSSNGUZRO-BHDDXSALSA-N 427.589 4.138 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCN(CC(F)(F)F)CC2(C)C)CCCC1 1458325961 JLWGYPBBPPKWAJ-UHFFFAOYSA-N 437.506 4.014 10 10 IICE CCc1cc2nncn2c(SCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)n1 1459064899 UMJVNXSAOWOVOY-UHFFFAOYSA-N 426.933 4.118 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCSC[C@H]2C(F)(F)F)C1 1463349197 YBZISVUKKDISRK-FQEVSTJZSA-N 439.547 4.304 10 10 IICE COCCOc1cc(OC)ccc1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1464543125 WBZKUCQQQRFKRQ-UHFFFAOYSA-N 426.557 4.419 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-c2ccc(Cl)cc2)on1 1468817111 XFBOCCQHOGZOPA-UHFFFAOYSA-N 433.842 4.040 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@]2(C)CCO[C@@H]2C2CC2)sc(C)c1-c1ccccc1 1473373261 RSGNYJXTRXKBFJ-QPPBQGQZSA-N 442.581 4.386 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@]1(O)CCC[C@H]1C 1509131975 JPEJGNCQKIECBG-CJFMBICVSA-N 425.621 4.264 10 10 IICE Cc1nc(Cl)c(Cl)cc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015915 ZEDANEHPACNOAF-UHFFFAOYSA-N 433.383 4.159 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc3c(c2)C(=O)N(C2CCCCC2)C3=O)cc1 1534245410 BYUFEZZRMQKFDU-UHFFFAOYSA-N 433.552 4.392 10 10 IICE Cc1cc(CC(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)c(C)n1-c1ccccc1 1536761926 ZYDVKJNIEJCGNW-UHFFFAOYSA-N 447.604 4.393 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ncccc3Oc3ccccc3)cc2F)CC1 1537535330 RBDAIVZCNZXZDA-UHFFFAOYSA-N 434.515 4.085 10 10 IICE Cc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1NC(=O)CN1CCCCC1 1542434072 VQPZAWGOHRFCQB-UHFFFAOYSA-N 439.537 4.298 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1 1564946461 PXGNXEXABICUEY-WXVAWEFUSA-N 434.628 4.300 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(CN2CCCCC2)o1 1566356591 IYDXYASJQBKPGT-LJQANCHMSA-N 431.964 4.019 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C/c1ccc(I)o1 1584095977 RXQGLDMEFIVJMM-PLWJUESGSA-N 438.309 4.019 10 10 IICE CC[C@@H](C)c1ncc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1585946376 YXEKVMJQXHOYDR-VGSSETLESA-N 444.557 4.359 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3cc(OC)ccc3Cl)no2)cc1 1586650470 ZZSUMCOXDRDTHH-UHFFFAOYSA-N 429.904 4.221 10 10 IICE Cc1nc2ccc(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)cc2[nH]1 1595320913 IAUJIEAYDUXRMS-VCHYOVAHSA-N 440.525 4.240 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CC=CCC2)CCOC1 1610362207 WVFJXMQJADSXAB-CYFREDJKSA-N 426.561 4.017 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)c(C)c4)c3C)C2=O)o1 1613523550 JIDVRIZDUWGABF-RUZDIDTESA-N 433.508 4.262 10 10 IICE COC(=O)c1cc(-c2csc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)n2)c[nH]1 1616288851 IXLDADCSURKMNC-UHFFFAOYSA-N 448.504 4.397 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1CCCOC1CCCCC1 1617939840 IPLDLQQCXXPMKW-UHFFFAOYSA-N 435.572 4.345 10 10 IICE CSc1nc(O)cc(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 1627727850 NQAAJLIJUYSGEN-UHFFFAOYSA-N 447.358 4.004 10 10 IICE CSc1cccnc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1628432393 DLLFBJIQOFRILR-RVDMUPIBSA-N 433.555 4.173 10 10 IICE Cc1ccc(C(=O)N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)cc1-n1c(C)cc(C=O)c1C 1628760492 VXRUCOFQCRWEKC-OZXSUGGESA-N 434.511 4.155 10 10 IICE Cc1cc(C(=O)N[C@@H]2CON(C(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(C(C)C)c1 1639908151 ITLQOTQQCVYHDT-IBGZPJMESA-N 427.545 4.498 10 10 IICE O=C(CN(Cc1cccs1)c1ccc2c(c1)OCCO2)NCc1cc(F)cc(F)c1 1642024794 FLHFBOJFYKSTNI-UHFFFAOYSA-N 430.476 4.121 10 10 IICE Cc1cc(C(=O)NC2(C(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccc(Cl)cc1 1642201310 JBJSQVYPMVFCQE-UHFFFAOYSA-N 432.948 4.368 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3ccccc3[C@H]2NC(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1645686980 UADOPCGQMGAEGW-FYYLOGMGSA-N 446.551 4.410 10 10 IICE COc1ccc(N2CCN(Cc3ccc(Br)cc3Cl)CC2)c(OC)c1 1659857657 XIZGKPIOYIDJBM-UHFFFAOYSA-N 425.754 4.442 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(CCc1ccccn1)Cc1ccncc1 1682101436 QDHUQUSKZUSJRB-OAQYLSRUSA-N 431.584 4.237 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N3CCOC[C@@H]3C)cc2)CC1 1693702341 VOLDXJKQOCNQFB-FQEVSTJZSA-N 425.621 4.376 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CCCCSC)CC2)cc1F 1697471725 MBYKOYYBMMXCSG-UHFFFAOYSA-N 433.597 4.163 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@]3(C)CCCS3)CC2)cc1 1730179711 CIQZTKXRIJVURC-DEOSSOPVSA-N 443.661 4.488 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2CC2CCC(F)(F)CC2)n1 1742684804 SLVOMFHMZLRYFW-UHFFFAOYSA-N 444.530 4.307 10 10 IICE CCCN(CCC)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1745639212 YDGQMMQXKVJIQC-UHFFFAOYSA-N 434.588 4.160 10 10 IICE CCCC[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858591978 FCFQSJGWAMJZAP-GKWYLQRDSA-N 432.336 4.433 10 10 IICE Cc1cc(O)c([C@@H](C(C)C)n2nc(C3CC3)c(CO)c2I)cc1C 2079982544 XCXMTAWVZYOFQW-GOSISDBHSA-N 440.325 4.425 10 10 IICE OCc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)cc1Br 2130156832 IGSYEUFWNPHLAM-SFHVURJKSA-N 429.280 4.195 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)C12CCC2 2175027984 WFFZIEZDFIFPLB-XJKSGUPXSA-N 443.357 4.467 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H](C)C2)c1O 2236053845 ATEVMFXMJRFDRM-KGLIPLIRSA-N 443.382 4.289 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3cccc(OC)c3)C2=O)cc1 2296881528 MZFMYJILKFJMTJ-UHFFFAOYSA-N 426.563 4.488 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)c(Br)cc1O 13914748 KGXXZYOINJOCOM-NVNXTCNLSA-N 445.269 4.058 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)c2C)cc1 14266263 PPALNAQYOZOXGS-AREMUKBSSA-N 445.519 4.143 10 10 IICE COc1ccc(N2CCN(C(=O)CN(C)[C@@H](C)c3ccc(Cl)cc3Cl)CC2)cc1 105815102 LZMRXCHXFSPYAB-INIZCTEOSA-N 436.383 4.344 10 10 IICE COCCCN1C(=O)c2ccc(NC(=O)N(c3ccccc3)c3ccc(N)cc3)cc2C1=O 217280885 WYXOREOHNFKJFU-UHFFFAOYSA-N 444.491 4.272 10 10 IICE CCN(CC)c1ccc(CNC(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)cc1F 303347088 MUCMHGRNTULWRP-LJQANCHMSA-N 428.552 4.006 10 10 IICE O=C(O)/C=C\c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1Br 705929756 IEAMOZGPYMJVRV-HTYVVJRYSA-N 427.342 4.115 10 10 IICE C[C@H](N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1)c1ccc(N2CCOCC2)c(F)c1 773105150 QEAIAUHQZSKMIV-WRPOGVCQSA-N 449.929 4.077 10 10 IICE C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 775940077 FUITZYQPBPKAIE-BXUZGUMPSA-N 448.488 4.058 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc([C@@H]2CCOC2)n1Cc1ccccc1 802213672 IANBEGRQONRVTG-HSZRJFAPSA-N 431.584 4.457 10 10 IICE O=C(CCc1nnc(-c2ccc(Cl)cc2)o1)NCc1cc(Br)ccc1O 804738282 JYWYVZSEIYJQGX-UHFFFAOYSA-N 436.693 4.107 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCOC3)n2C[C@H]2CCCCO2)c(C)n1-c1ccccc1 812440492 CWCLWJTVXUTTTL-FGZHOGPDSA-N 435.572 4.147 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)NC1CCN(C2CC2)CC1 928976663 XUIUJTCVCWSLJC-UHFFFAOYSA-N 436.581 4.027 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)cc1 1116545225 BQLGUVSFTKHYAX-NRFANRHFSA-N 436.600 4.241 10 10 IICE Cc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1125256317 IDFHARBWCOTPNX-ZIAGYGMSSA-N 435.883 4.239 10 10 IICE CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549745 TXKNENGBBGIDOT-NRFANRHFSA-N 438.902 4.175 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2(Cc3ccccc3Br)CC2)cc1 1130547239 GUALHPQTWIIKJC-UHFFFAOYSA-N 431.374 4.375 10 10 IICE Cc1nc(COc2ccccc2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cs1 1134881877 IYUCWNOZTOISAG-QFIPXVFZSA-N 438.597 4.129 10 10 IICE COC(=O)c1cc(Br)cc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 1135964512 DGJXPWZFNGWLMD-UHFFFAOYSA-N 445.357 4.498 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3=CCN(C(=O)OC(C)(C)C)CC3)c2C)cc1 1138669665 YGIYBHOEYQSJMO-UHFFFAOYSA-N 439.556 4.400 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCc1ccccc1F 1167331877 BYMGKTUKGJMKER-INIZCTEOSA-N 430.479 4.103 10 10 IICE Cc1nn(-c2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc2)c(C)c1Cl 1167762565 OVXDHIGDPSPVHD-UHFFFAOYSA-N 438.959 4.034 10 10 IICE O=C(OCc1ccccc1)N1CCC(CN(Cc2ccccc2O)C[C@H]2CCCO2)CC1 1167983448 MASGHDAWSGVQML-XMMPIXPASA-N 438.568 4.422 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccc(NCc3c(O)cccc3F)c([N+](=O)[O-])c2)c(C)c1 1187678209 ZYVADQQHKUDBNS-UHFFFAOYSA-N 445.472 4.469 10 10 IICE CC(=O)c1ccc(Br)c(NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1219895167 JNLYJXWKJOJOPQ-FQEVSTJZSA-N 447.377 4.142 10 10 IICE CCC(CC)(CNC(=O)NCc1cccc(Br)c1O)C(=O)OC(C)(C)C 1252101131 PBCYGKFMKGMTBY-UHFFFAOYSA-N 429.355 4.102 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(N=S(C)(C)=O)cc2)C1 1274161878 LLMUFTJUSHBMPM-UHFFFAOYSA-N 438.597 4.406 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2nc(C3CC3)cs2)NC(=O)OC(C)(C)C)cc1 1293793511 QCCQREWQPZRLQG-GOSISDBHSA-N 444.601 4.011 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1-c1cnn(C)c1 1294859800 OWELYMYRHBGMKX-NRFANRHFSA-N 438.959 4.149 10 10 IICE Cc1cc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)c(C)n1-c1cccc(Cl)c1 1296268333 NIDWGRIUSFEKEV-QHCPKHFHSA-N 437.971 4.244 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)O[C@H](C)C1 1300955869 GTWJDBFZRRTROY-MISYRCLQSA-N 437.588 4.249 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@H]3c3ccc(Cl)c(Cl)c3)nc12 1307417398 CRZLNTLYIVJMTJ-KRWDZBQOSA-N 435.311 4.256 10 10 IICE CCN(CC1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1)C(=O)OC(C)(C)C 1444767288 GJSCSDLCXODMLH-UHFFFAOYSA-N 434.558 4.422 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)c1 1448294528 KULCEYJIUMWREN-VWLOTQADSA-N 439.556 4.284 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)CC2=O)cc1 1461076861 LJCJYJAIXIFIAD-FGZHOGPDSA-N 449.595 4.033 10 10 IICE C[C@H]1CN=C(N2CCN(C(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)CC2)S1 1465133779 VDECXYJLAQVVRC-KRWDZBQOSA-N 436.585 4.417 10 10 IICE CCOCc1nc(C)cc(NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1472776440 UOKLYVATUGXCQY-LJQANCHMSA-N 429.565 4.065 10 10 IICE COC1CCN(c2ccc(CN[C@@H](Cc3ccccc3)C(=O)OC3CCCC3)cc2)CC1 1473700084 RLKAIRVWMZWLRJ-SANMLTNESA-N 436.596 4.489 10 10 IICE COc1ccccc1[C@H](NC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)c1ccccn1 1478363620 GGTRMNZKYRIIPX-DFBJGRDBSA-N 432.568 4.484 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4ccc(C(F)(F)F)cc4C3)C2)cc1 1478860736 RJNPWGHBOBEJHL-MRXNPFEDSA-N 433.474 4.308 10 10 IICE C[C@H]1CN(c2nnc(C3CCC3)n2CCCSc2nccs2)C[C@@H](C(F)(F)F)O1 1494323963 TWIVINWSITTWGV-JSGCOSHPSA-N 447.552 4.341 10 10 IICE CC[C@H](CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)(C)C 1527966721 JOUYJCSSIYZTOV-LJQANCHMSA-N 427.568 4.021 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](C)SCc1nc(O)c2ccccc2n1 1529277951 LGRQVXYVLLYQTA-DLBZAZTESA-N 438.597 4.079 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Oc3ccc(Cl)cc3)C(C)C)CC2)c(OC)c1 1530967804 GQGGVVSXPSDBKD-QFIPXVFZSA-N 432.948 4.109 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccc([N+](=O)[O-])cc1 1538920214 QVERSCZUXUZQFI-UHFFFAOYSA-N 438.241 4.319 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)c2ccc(OC(F)(F)F)cc2)N(C)C)cc1 1539708046 VRPLTXCMEMATPM-HXUWFJFHSA-N 437.506 4.348 10 10 IICE CCC[C@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1546955561 YFXWXIIDBYWWQR-GMAHTHKFSA-N 441.620 4.072 10 10 IICE Fc1ccccc1Cc1nnc(N2CCC(F)(F)C2)n1CCCSc1nccs1 1555982810 GEIYPNOFHXMGQW-UHFFFAOYSA-N 439.532 4.492 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCC3(O)CCN(Cc4ccccc4)CC3)c2C)c1 1557045460 QXASQCYSVBCDBD-UHFFFAOYSA-N 445.607 4.468 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(Cc4ccccc4Br)CC3)C2)cc1 1584444129 GQOZVYLGFCPQJU-QGZVFWFLSA-N 443.385 4.423 10 10 IICE CC(C)c1nnc(N(C)CCc2cccs2)n1Cc1ccc(N2CCOCC2)cc1 1598445440 BNBBGMINFLRJGC-UHFFFAOYSA-N 425.602 4.027 10 10 IICE CCC[C@H](C)C(=O)NCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC 1614348275 VLDSZFVSRPPCHL-SFHVURJKSA-N 436.604 4.361 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1624535529 GTOVPEZRLZRWTB-HOCLYGCPSA-N 433.394 4.102 10 10 IICE COc1ccc(C(=O)Nc2ccccc2C(=O)N(C)CCN(C)c2ccc(OC)cc2)cc1 1628469115 QDTYLLMCOPPMLM-UHFFFAOYSA-N 447.535 4.165 10 10 IICE COC(=O)[C@]1(c2ccccc2)CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1628531806 UVLIEMXAEDCNJG-HHHXNRCGSA-N 444.531 4.172 10 10 IICE Cc1cc(C(=O)N[C@H](c2nc(=O)o[nH]2)C(C)(C)C)c(C)n1-c1cccc(Br)c1 1630795021 VQXJRRUWUBCKFN-MRXNPFEDSA-N 447.333 4.050 10 10 IICE Cc1cc(C(=O)NC2(c3ccccc3)CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1633012672 AIMKPJHWCMWZQB-UHFFFAOYSA-N 446.551 4.365 10 10 IICE Cc1cc(C(=O)NCc2nc(COc3ccccc3)n[nH]2)c(C)n1-c1cccc(Cl)c1 1633331811 KLTGLLUFCPSAAI-UHFFFAOYSA-N 435.915 4.375 10 10 IICE CNc1cc(Cl)ccc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634162568 MBAPDFVSJLTHKM-FQEVSTJZSA-N 446.979 4.444 10 10 IICE O=C(NCc1cccc(Br)c1O)c1ccc(NCCc2ccccn2)cc1 1634724638 DQQWIXDQRYCIKE-UHFFFAOYSA-N 426.314 4.134 10 10 IICE C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1653056941 SERFDGQHEOONQQ-GJZGRUSLSA-N 443.459 4.048 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@]23CCOC3)sc(C)c1-c1ccccc1 1660667179 DZHYTDGEEKQSHV-DEOSSOPVSA-N 442.581 4.484 10 10 IICE COCCN(Cc1ccco1)c1nnc(-c2cccnc2)n1Cc1ccc(N(C)C)cc1C 1698054411 FACQQOKJEJKIKI-UHFFFAOYSA-N 446.555 4.009 10 10 IICE Cc1cccc(-c2nnc(N3C[C@H](C)S[C@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1707591606 XUWMUFXWHUQZJH-KDURUIRLSA-N 436.629 4.401 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1sccc1C 1710647583 WYKLUSDAUMNOCK-UHFFFAOYSA-N 425.602 4.469 10 10 IICE CCOCc1nnc(N2CCC([C@@H]3CC3(F)F)CC2)n1CCCSc1nccs1 1710681657 ARIKVXKOEGCHCO-HNNXBMFYSA-N 443.589 4.325 10 10 IICE CN(Cc1ccccc1O)c1nnc(CNC(=O)c2cccs2)n1CCCC(C)(C)C 1729420258 KZNNLFYSCLWJJG-UHFFFAOYSA-N 441.601 4.438 10 10 IICE COC[C@H](C)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1730451523 SKIYOFLWCNPXQC-LJQANCHMSA-N 434.588 4.168 10 10 IICE CCC(CC)[C@H](Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccccc1O)N(C)C 1743992740 DUPVPCVHIHFFNW-QFIPXVFZSA-N 436.604 4.357 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CCCSC)CC2)cc1 1768704605 KYSGWYIOVDGINK-UHFFFAOYSA-N 429.634 4.414 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(COC)CC1 1771046719 JWEXITMWLPZSMF-UHFFFAOYSA-N 435.572 4.172 10 10 IICE COC(=O)c1c(NC(=O)c2ccc(S(C)(=O)=O)cc2)sc(C)c1-c1ccccc1 1866207915 XUOZMLKNUCBRNA-UHFFFAOYSA-N 429.519 4.166 10 10 IICE CSc1ccc(C=C2C(=O)NC(=S)N(c3ccc(Br)cc3)C2=O)cc1 2294253434 RUGSJVZQCVYYJK-UHFFFAOYSA-N 433.352 4.002 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1C=C1SC(=S)N(CCC)C1=O 2314414713 JRAGEIXBNVCPMJ-UHFFFAOYSA-N 430.599 4.216 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2)SC1=S)NCc1cc(-c2ccccc2)no1 2314913677 SGACXPSRCKYPIH-UHFFFAOYSA-N 449.557 4.249 10 10 IICE COc1cc(OC)cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c1 9526951 NDXFDUWKLSBVBN-SANMLTNESA-N 445.563 4.304 10 10 IICE COc1cc(/C=C2/SC(Nc3ccccc3Cl)=NC2=O)ccc1OCCC(=O)O 16912295 WKMBMWSSVUCTND-GZTJUZNOSA-N 432.885 4.285 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(Br)cc2)C(=O)/C1=C/c1cccc(O)c1 101508209 JJMAQMUHDMNFIU-LDADJPATSA-N 428.282 4.422 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1c(Br)c2ccccc2n1C 107917799 USHJWZBIMCYJLZ-UHFFFAOYSA-N 442.357 4.050 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1CC(F)(F)F)N1CCO[C@H]2CCCC[C@H]21 109624525 VMVGOWWTEZJVPQ-AEFFLSMTSA-N 439.503 4.375 10 10 IICE CCOc1cc(/C=C2\SC(Nc3cccc(OC)c3)=NC2=O)ccc1OCCC(=O)O 210469225 ZCJWIBFDZHEAOH-UNOMPAQXSA-N 442.493 4.030 10 10 IICE Cc1nnc(-c2cccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)c2)o1 435827429 PLHTYXBRSBLVDA-UHFFFAOYSA-N 429.524 4.405 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1c1ccc(Cl)nc1 727178123 SCJMEDHCWFSQNU-WEVVVXLNSA-N 448.694 4.338 10 10 IICE CC(C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)(c1ccccc1)c1ccccc1 729328282 QTTPOCZXRWPWST-JOCHJYFZSA-N 441.575 4.011 10 10 IICE Cc1c(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)oc2ccccc12 734525014 FPVXYMQHEYCDRX-IYBDPMFKSA-N 425.504 4.493 10 10 IICE COC(=O)c1nscc1S(=O)(=O)Nc1nc(-c2ccc3ccccc3c2)cs1 755736015 HCRJTPFGAAOFFE-UHFFFAOYSA-N 431.520 4.007 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CCCOc2c(Cl)cccc21)c1ccc(N2CCOCC2)cc1 775729247 SLRWEIDAPANYHA-IIBYNOLFSA-N 429.948 4.451 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc2ncsc2c1 776924080 YYXGTEXIEHYGKU-SFHVURJKSA-N 449.624 4.389 10 10 IICE COc1cccc(CNC(=O)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1O 777750256 HZPFXEKQRPSLJK-AZUAARDMSA-N 435.927 4.217 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3cccc(N4C(=O)N[C@H](C)C4=O)c3C)c2C)c1 811536965 JPWMSEAIDCTXNK-QGZVFWFLSA-N 430.508 4.408 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(OCC(F)(F)F)c3)cc2F)C[C@@H](C)O1 1125188239 OGKULHIKMHNGOS-HUUCEWRRSA-N 440.437 4.310 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)ccc2-n2c(C)ccc2C)C[C@H]1c1ccc(O)cc1 1141336722 SRICMEMZJWXCME-XZOQPEGZSA-N 432.520 4.137 10 10 IICE COc1ccccc1[C@](N)(C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)C(F)(F)F 1160645786 JGNKZZQHKYMKBU-QHCPKHFHSA-N 449.517 4.497 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@H](OCc4ccccc4)C3(C)C)CC2)cc1F 1235188086 VFWOKTHWHLTOBE-GOTSBHOMSA-N 441.547 4.050 10 10 IICE C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751310 ZTGBSDAVGMOQOZ-HLIPFELVSA-N 429.511 4.278 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1256231791 FGKBGGZXFCCXTI-DEOSSOPVSA-N 425.621 4.043 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(F)c(Oc4ccccc4)c(F)c3)cc2)CC1 1288334813 QZMUBGQUSXWSFC-UHFFFAOYSA-N 437.490 4.439 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCNc2ccc(C(F)(F)F)cn2)cc1 1292235816 DXMTWWVTNVOZHR-UHFFFAOYSA-N 444.457 4.091 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCC(F)(F)[C@H]2O)c(C)n1-c1cccc(Br)c1 1299285241 QERXQQTZXDDSRE-SJORKVTESA-N 427.289 4.135 10 10 IICE O=C(C[C@H]1CCC[C@@H](C(F)(F)F)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1360045353 CAISPXVGBLTRKW-SJORKVTESA-N 436.421 4.263 10 10 IICE C/C=C\COc1cccc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1445881595 IZGPDDCRBVOFGQ-KDMAQFSLSA-N 428.960 4.324 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCC(CN=[S@](C)(=O)N(C)C)CC3)c2C)c1 1457071116 UFWUNWWOLYFDKF-HKBQPEDESA-N 444.645 4.138 10 10 IICE Cc1cc(C(=O)COc2ccc(C(N)=O)cc2F)c(C)n1-c1cccc(Br)c1 1459294756 BZNSRHZFDRMMFX-UHFFFAOYSA-N 445.288 4.356 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@]34OCCC[C@H]3C4(F)F)cc2Cl)C1 1469961932 ZDTQUABNRZHJBB-QMIHWGKISA-N 427.923 4.190 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1 1478840984 MSLKMLZJDYUNHT-GOSISDBHSA-N 432.609 4.129 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@H]1COC(=O)NC1CCCC1 1478841079 OYKHSCAMJPLPTM-CVDCTZTESA-N 444.620 4.225 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C)nc4ccc(Br)cc34)C2)cc1 1528317168 AHFWAWUQZPFMIJ-MRXNPFEDSA-N 440.341 4.323 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)nn1-c1ncccc1Cl 1539188752 XKQSMCCPDPPYAP-UHFFFAOYSA-N 448.752 4.021 10 10 IICE Cc1cc(C)n([C@@H]2CCCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)n1 1543004339 SKFSFMPWDDDUPL-HXUWFJFHSA-N 439.583 4.310 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(I)c(Cl)c1 1545639115 CMOMQILTBPLLEC-UHFFFAOYSA-N 441.696 4.459 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(-c4noc(C(F)(F)F)n4)cc3)C2)cc1 1584438259 BBJFATJHUYFURX-CQSZACIVSA-N 446.429 4.020 10 10 IICE CCCCNC(=O)c1ccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1595898846 KNQIXOGQMBOQFX-UHFFFAOYSA-N 447.579 4.375 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](C[C@H](C)CC)NC(=O)OC(C)(C)C)CC2)cc1 1596732700 GDYGBPMNHAQHJS-NQIIRXRSSA-N 433.593 4.063 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2CON(C(=O)OC(C)(C)C)C2)cc1 1602813881 XAMJQTCHSUYHNU-QGZVFWFLSA-N 439.516 4.449 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)C[C@H]1CC=CCC1 1611964008 JKQDBHQGFZMSRA-NRFANRHFSA-N 430.600 4.479 10 10 IICE CCc1nc(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cs1 1616566773 NDKPKKQTXTUPLW-UHFFFAOYSA-N 442.342 4.359 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C 1622328056 KGHOHDVLTCJCAJ-MRXNPFEDSA-N 443.382 4.443 10 10 IICE CCN(C(=O)c1ccnc2c1CCN2C(=O)OC(C)(C)C)c1ccc(OC)c(OC)c1 1625262545 CHXVIEXFMLIXNU-UHFFFAOYSA-N 427.501 4.063 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1625794703 OAVJVMCUFHROGP-GOSISDBHSA-N 434.367 4.461 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NCc1c(O)ccc2c1CCCC2 1631438895 OMAAUTOOKYSKPV-QHCPKHFHSA-N 436.552 4.422 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H](OCC1CCCC1)c1ccccc1 1634423941 OXUNZMKUBMGZPZ-RUZDIDTESA-N 440.559 4.351 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(Cc4cccc(C)c4)CCO3)c2C)cc1 1635845226 NZMVVDLGYJWENL-RUZDIDTESA-N 447.579 4.042 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@@H](O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cn1 1635867984 OZIGXCFZSCUCBG-RNODOKPDSA-N 446.320 4.243 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](C(=O)NCc2ccc3cccnc3c2O)(c2ccccc2)C1 1638572927 AZLBNTMVAAMXEN-SANMLTNESA-N 447.535 4.135 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c(C)n1-c1cccc(Cl)c1 1640238716 FKCWKYMNHQGYAC-HNNXBMFYSA-N 441.881 4.278 10 10 IICE CC(C)(C)OC(=O)Nc1cnn(C(C)(C)C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 1641997572 RNGBTTSOFMZOPA-UHFFFAOYSA-N 443.331 4.294 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](COC)c2ccco2)sc(C)c1-c1ccccc1 1642665727 YLNBOYKVUJQHIW-QGZVFWFLSA-N 442.537 4.409 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2ccoc2)c(C)n1-c1ccc(Br)cc1 1643626784 RIJQBHUOHZXLFU-KRWDZBQOSA-N 431.330 4.031 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccc(F)cc1 1644440959 JEZFZSCXFGCEMA-UHFFFAOYSA-N 430.479 4.452 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1644808637 UHTWBULBFURASZ-IAGOWNOFSA-N 433.955 4.235 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CN2CCC(C)CC2)c(C)n1-c1ccc(Br)cn1 1645404651 ZJEFTQJOOOEWMZ-HNNXBMFYSA-N 433.394 4.102 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@@H](NCc3ccc(N4CCOCC4)cc3)C(C)(C)[C@@H]21 1655916519 WOWRKDJJBTWOGA-YPAWHYETSA-N 429.605 4.037 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](CCO)c1ccccc1Br 1683421610 UBXCTCMMLBYPPL-IERDGZPVSA-N 448.405 4.177 10 10 IICE COc1ccc2ccccc2c1CCNC(=O)NCc1cccc(Br)c1O 1683994029 RKBSRSLSHYXHLO-UHFFFAOYSA-N 429.314 4.358 10 10 IICE Cc1cc(CNC(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)c(C)n1-c1ccccc1 1686491380 CBHKSPGYZCOAFP-RTBURBONSA-N 430.552 4.260 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N2CCN(C(C)(C)C)CC2)cc1F 1696610059 IOXLWNGIPNTVOR-UHFFFAOYSA-N 428.600 4.110 10 10 IICE CC1(C)CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CC(C)(C)O1 1706956039 PGUJKSRRTZGVKI-OAHLLOKOSA-N 437.635 4.162 10 10 IICE CCOCc1nnc(N(Cc2cccs2)C2CC2)n1Cc1ccc(N(C)C)cc1C 1710658129 UPYWVHDJUJDAOY-UHFFFAOYSA-N 425.602 4.468 10 10 IICE CC[C@@H](C)c1nnc(N(CC)CCC2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726897650 DYRPGYOLQJUDIM-GOSISDBHSA-N 429.584 4.442 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC(CC)(CC)C2)cc1 1728380020 WQWGYYTVPSOJCR-UHFFFAOYSA-N 440.636 4.327 10 10 IICE CCN1C[C@H](C)N(c2nnc(C3CCCC3)n2CCCSc2nccs2)C[C@@H]1C 1746379898 OYBLQRWBGFAUIL-IRXDYDNUSA-N 434.679 4.494 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(-c2ccc[nH]2)n1CCCSc1nccs1 1751953843 GRKWVAANUJMCAQ-UHFFFAOYSA-N 429.575 4.153 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc2c(c1)CCCN2C 1771207714 LFOYVJNEODBPTO-UGKGYDQZSA-N 441.620 4.058 10 10 IICE CCC1=NN(Cc2cccc(F)c2)C(=O)/C1=C/c1cc(Br)cc(OC)c1O 1865672000 KIWMPZUPGRNFPM-CXUHLZMHSA-N 433.277 4.494 10 10 IICE CCN1C(=O)C(Nc2ccc(OC)c(OC)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422835 RPHYGSVXXYFPTE-UHFFFAOYSA-N 445.519 4.323 10 10 IICE O=C(CN1C(=O)C(=Cc2ccccc2)SC1=S)Nc1cccc(Br)c1 2296754035 USIIKMKRMPCCRR-UHFFFAOYSA-N 433.352 4.289 10 10 IICE COc1ccc(Br)cc1C=C1SC(=S)N(NC(=O)c2ccccc2)C1=O 2314764677 JLCCNPBBBWIDLU-UHFFFAOYSA-N 449.351 4.004 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc(O)cc2O)SC1=S)Nc1ccc(Cl)cc1 2314831216 GBPKTPBJHPXHIW-UHFFFAOYSA-N 448.953 4.371 10 10 IICE Cc1ccc(CNCc2ccc(I)cc2)c(O)c1Br 2352945542 XKWCNSVKFFWODJ-UHFFFAOYSA-N 432.099 4.358 10 10 IICE CCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N([C@@H](C)c2ccccc2)C1=O 33517576 DXNKHMVJBWDKLO-ZSRMJVKVSA-N 436.562 4.089 10 10 IICE CCN(CC)CN1C(=O)/C(=C2\SC(=S)N(c3ccc(F)cc3)C2=O)c2ccccc21 38204529 URKWZVBALHTDTR-HNENSFHCSA-N 441.553 4.248 10 10 IICE COc1ccc(/C=C2\SC(=S)N(c3ccc(C)c(C)c3)C2=O)c(C(=O)O)c1OC 210400649 WDRJETCKKUGJSJ-YBEGLDIGSA-N 429.519 4.425 10 10 IICE Cc1cc(F)cc2[nH]c(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cc12 303687812 UKAIEDZMVDHHKL-UHFFFAOYSA-N 435.421 4.401 10 10 IICE COC(=O)c1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526355038 PSGBOQVGDOVMFX-QFIPXVFZSA-N 431.444 4.250 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cc3ccc4c(c3)CCO4)no2)C1 685268056 IVVKVVHDBUVMKL-UHFFFAOYSA-N 428.536 4.365 10 10 IICE CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 745648673 TWYBUKKBBPPDRE-DEOSSOPVSA-N 445.554 4.335 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](C)CC(=O)c1ccc(OC)cc1 753837747 YUYKHPFQNWBYTQ-AWEZNQCLSA-N 434.330 4.421 10 10 IICE Cc1cc(CC(=O)Nc2ccc3c(c2F)CCNC3=O)c(C)n1-c1ccc(Cl)cc1 791355587 JABVXINCUVDLHJ-UHFFFAOYSA-N 425.891 4.354 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC[C@@H](c4ccccc4)O3)cc2F)C[C@@H](C)O1 811863938 GTIOCAXBTKJDAW-RFZFDZAKSA-N 441.547 4.159 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N3CCn4c(cc5ccccc54)C3)cc2F)C[C@@H](C)O1 812876484 FGPIDIKBNYYKLH-QZTJIDSGSA-N 436.531 4.119 10 10 IICE Cc1cc(C(=O)N2CC3(CCOCC3)[C@@H]2c2cnn(CC(C)C)c2)c(C)n1-c1ccccn1 849530240 SJWHOPOFICWWCT-DEOSSOPVSA-N 447.583 4.336 10 10 IICE COc1ccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1125861502 LZWUEJWWLMHEDM-QHCPKHFHSA-N 449.576 4.185 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccncc4)c(Cl)c3)cc2)CC1 1133123515 PAMMZEIZGWSVAV-UHFFFAOYSA-N 436.943 4.209 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)c1 1154608338 PMYKXQMCPSKTET-UHFFFAOYSA-N 434.511 4.256 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3ncon3)C2)c(C)n1-c1cccc(Br)c1 1156095938 ZTMMNSJEWYVAOT-HNNXBMFYSA-N 429.318 4.259 10 10 IICE CCOC(=O)c1sc2nc(C)nc(NC[C@H]3CCN(c4ccc(OC)cc4)C3)c2c1C 1163565769 BHSMTPSTPLBPCT-MRXNPFEDSA-N 440.569 4.432 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2[C@@H](C)O)sc(C)c1-c1ccccc1 1190865564 XKEIMISQLXNBSU-CRAIPNDOSA-N 430.570 4.074 10 10 IICE O=C(CN(Cc1ccccc1)CC(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1191426276 CSOGMNRXNICQQB-UHFFFAOYSA-N 434.442 4.168 10 10 IICE CCOC(=O)c1c(NC(=O)CNC2(CO)CCCCC2)sc(C)c1-c1ccccc1 1192390200 LBFVSSJTVXPTEY-UHFFFAOYSA-N 430.570 4.124 10 10 IICE C[C@H](NC(=O)NC[C@](O)(c1ccccc1Cl)C(F)(F)F)c1ccc(N(C)C)cc1 1234554788 FIQRFJQMVVAHHN-DJJJIMSYSA-N 429.870 4.216 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3C[C@@H](OCc4ccccc4)C3(C)C)CC2)cc1F 1235188090 VFWOKTHWHLTOBE-XZOQPEGZSA-N 441.547 4.050 10 10 IICE Cn1nc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1-c1ccc(F)cc1 1265567674 WUQUYHPJIGEZJD-KRWDZBQOSA-N 444.457 4.226 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1 1291361690 RCRXLDQPZNIVPQ-HHJKRLRDSA-N 437.588 4.127 10 10 IICE CC[C@H](C)CN(CC)c1nnc(C2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291747358 WKGLNNDTNIIOGD-IBGZPJMESA-N 425.621 4.285 10 10 IICE Cc1nc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)sc1Br 1292382619 UWGSAFDLHDHZJF-INIZCTEOSA-N 438.391 4.101 10 10 IICE CC(C)c1nnc(N2CCC[C@H](OC(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1302660586 NNSCWJXUTCBQHF-QFIPXVFZSA-N 441.620 4.070 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@H]3C)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1304197102 XQSAPQRUVGHWJM-UYAOXDASSA-N 448.615 4.456 10 10 IICE C[C@@]1(CCc2ccccc2)CCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1312833481 JRYGBVQOQSTHFI-RUZDIDTESA-N 443.538 4.356 10 10 IICE CCOc1ccc([C@]2(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2(Cl)Cl)cc1 1356250430 FQZHGSGOIXECLW-FQEVSTJZSA-N 425.331 4.422 10 10 IICE CC(C)Cc1nnc(N2CCN(C3CCC3)C[C@@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1359856177 WSINSPUYXCHVEI-LJQANCHMSA-N 442.627 4.041 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1CCC(F)(F)CC1 1435778839 UOGWVGHJDYMUOE-PTNGSMBKSA-N 428.501 4.111 10 10 IICE Cc1ccc(NC(=O)NC[C@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)cc1 1464699110 YUEJRMZZZDQQET-OAHLLOKOSA-N 439.537 4.295 10 10 IICE COC(=O)Cc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1469958837 HWNGUVFRLOQTEP-QGZVFWFLSA-N 443.975 4.291 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCc2ccncc2OCCC(C)(C)C)N(C)C)cc1 1470412124 CTBPJGLJZZXPPA-QFIPXVFZSA-N 441.620 4.065 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1470774216 XYOUBAVFXSPTIY-IRXDYDNUSA-N 429.948 4.140 10 10 IICE CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1470849161 DGHJCHSEKDXJSW-UHFFFAOYSA-N 438.459 4.072 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H](C)c3ccc(Br)cc3)C2)cc1 1478861382 ZRYLMPUSCAEPFM-SJORKVTESA-N 446.389 4.387 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)cc2F)C[C@@H](C)O1 1544675935 FMPYYVAOHGCVGC-TXEJJXNPSA-N 439.846 4.070 10 10 IICE Cc1ccc(C(=O)CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C 1545632761 VIKQCYKCFQDVGH-NRFANRHFSA-N 428.960 4.406 10 10 IICE CCc1nn(C)c(CC)c1Cn1c(-c2ccc(C)o2)nnc1N(C)Cc1ccccc1O 1546390246 KUSYUTTZODAZRG-UHFFFAOYSA-N 434.544 4.095 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)N[C@H](C)c2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1 1564427630 JRPAZZGNZBBDNG-LZHZSBQWSA-N 433.911 4.296 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccccc1N=S(C)(C)=O 1588193607 VLYUEOCUKRLXDO-UHFFFAOYSA-N 425.348 4.176 10 10 IICE CC(C)C1CCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1603057434 BREGWWFXQZBDBG-UHFFFAOYSA-N 436.579 4.390 10 10 IICE CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1624626118 MCDPIJHABBXARO-QHCPKHFHSA-N 439.625 4.105 10 10 IICE CN(C)c1ccc(CN(C(=O)/C=C/[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc1 1629697434 HFHSYSBZLARPLJ-JVVYVMHDSA-N 427.589 4.447 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CC[C@@H](C(=O)OC(C)(C)C)C2)cc1 1631608350 UNLZWKSAQZCGOQ-VWPQPMDRSA-N 430.589 4.018 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c(O)c1 1632692002 DJBHIMRDSUJNNB-UHFFFAOYSA-N 431.536 4.018 10 10 IICE Cc1cc(C(=O)NN2CCCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1633699513 DAGZQDJXINWWBB-UHFFFAOYSA-N 425.330 4.349 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C\C=C(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1634161692 BYOCUCPTWOQZGU-IOBAAEILSA-N 428.360 4.310 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCSc3nc4ccccc4s3)C2)cc1 1643346127 KBRBIROKEZGUKQ-MRXNPFEDSA-N 427.595 4.430 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(Br)c(CO)c2)cc1 1644096397 OSQNSQLBXSYAEO-UHFFFAOYSA-N 441.325 4.343 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H]3c3ccc(OC)c(OC)c3)C2)cc1 1673822497 DYAUCKOHKXOETL-XMSQKQJNSA-N 439.556 4.085 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)NCc3cc(C)n(-c4ccccc4)c3C)c2)CC1 1676415951 KKIHHVHNLPWYAK-UHFFFAOYSA-N 445.567 4.084 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H](c1ccc(F)c(F)c1)c1nccn1C 1676658805 NZERJQXOAUTFLA-JOCHJYFZSA-N 439.510 4.230 10 10 IICE CCn1c(CNC(=O)NCc2cc(Cl)ccc2O)nc2cc(Br)ccc21 1680899544 NGGKNTZKPDXKTN-UHFFFAOYSA-N 437.725 4.177 10 10 IICE CC[C@H](C)CN(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1708579604 DIMWLJKVELHMFN-IBGZPJMESA-N 425.621 4.285 10 10 IICE CCCN1CCC(N(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)CC1 1709778073 RQDNDBLMHOAVBU-UHFFFAOYSA-N 447.631 4.073 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCCOC2)n1CCOC(C)(C)C 1711080137 GYAHNMUZOMGREH-NRFANRHFSA-N 441.620 4.224 10 10 IICE C[C@H]1CCCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1726566905 CVGBGGDIVWKSLC-HNNXBMFYSA-N 428.943 4.483 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@@H](C(F)(F)F)O[C@H](C)C2)cc1 1746086210 JIUBATAFCAXPAG-APWZRJJASA-N 439.526 4.452 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CCCS3)CC2)cc1 1748848164 VVLYNTUHJBAJAX-NRFANRHFSA-N 443.661 4.488 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC[C@@H]1C 1749214233 CPKICXJFEGYOBJ-DOTOQJQBSA-N 449.671 4.431 10 10 IICE CCC1(Cn2c(CNC(=O)c3cccs3)nnc2N(C)Cc2ccccc2O)CCC1 1762543408 YTVSNOZHOUKEOJ-UHFFFAOYSA-N 439.585 4.192 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2noc3c2COCC3)n1Cc1ccc(N(C)C)cc1C 1763824014 WYKVMIIUVANKNN-KRWDZBQOSA-N 438.576 4.053 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763880478 JGSOXYSZZARYJW-GOSISDBHSA-N 429.584 4.442 10 10 IICE CSCCCn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1770612421 LPMNMWFAVDFEGK-UHFFFAOYSA-N 443.661 4.237 10 10 IICE COc1ccc(OC)c(/C=C2/SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)c1 1860087628 KPZRYRJKDKQZIN-GIJQJNRQSA-N 447.534 4.135 10 10 IICE O=C1NN(c2ccc(F)cc2)C(=O)C1=Cc1ccc(-c2ccc(Br)cc2)o1 2296666479 FYOGRPTVFSIXAA-UHFFFAOYSA-N 427.229 4.310 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3cccc(NC(C)=O)c3)C2=O)cc1OC 2321683248 MIVRUDWXFVXAMJ-UHFFFAOYSA-N 428.535 4.458 10 10 IICE C[C@H](NC(=O)Nc1ccc(OCc2cccnc2)cc1)c1ccc(N2CCOCC2)cc1 728693259 ONVKSRSGQCCGBU-IBGZPJMESA-N 432.524 4.380 10 10 IICE COc1ccc(N2CCN(C(=O)C[C@@H](O)c3ccc(OCc4ccccc4)cc3)CC2)cc1 780847751 AIGKPOCRXVOAGS-AREMUKBSSA-N 446.547 4.047 10 10 IICE C[C@@H]1CN(c2ccc(CNC[C@]3(C)CCN(C(=O)OC(C)(C)C)C3)cc2F)C[C@@H](C)O1 798947672 KHVGFPZKZXLACG-GGUMNFRJSA-N 435.584 4.176 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(O)cc(C(F)(F)F)c1 857473233 UVJDBJYGTGXTFG-INIZCTEOSA-N 428.838 4.164 10 10 IICE COc1cc(/C=C2/C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc(Cl)c1OC 1084038173 PMCUIKGUGDVZEZ-YBEGLDIGSA-N 436.851 4.177 10 10 IICE CCOC(=O)c1c(NC(=O)c2cnc(N(C)C)cn2)sc(C)c1-c1ccc(F)cc1 1124635326 VDKOOEJVFUMGKN-UHFFFAOYSA-N 428.489 4.148 10 10 IICE CCN(CCC(F)(F)F)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1125502413 NAZMIGZUWBDHOX-KAMYIIQDSA-N 434.480 4.218 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)OCc3ccccc3)cc2Cl)C1 1139137598 CBVWDTBWNAZSRE-KRWDZBQOSA-N 429.948 4.119 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1cccc2c1OC(F)(F)O2 1147885433 OGQIDTKRLRYHMC-UHFFFAOYSA-N 426.419 4.201 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC(=O)c4ccccc4O3)cc2Cl)C1 1235835839 WZHBLCISQYKUEZ-FUHWJXTLSA-N 441.959 4.410 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C/c3csc(C(F)(F)F)c3)cc2F)CC1 1265011911 GLKGVZXUZKFLNQ-GQCTYLIASA-N 441.494 4.378 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3COCc3ccccc3)CC2)c(OC)c1 1287485419 RTBVIQMRYCLMOX-UHFFFAOYSA-N 446.547 4.383 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CC[C@H](C)C2 1348721131 WVTNNZHFJCQRBP-RDJZCZTQSA-N 440.565 4.037 10 10 IICE CN(C)c1ccc(CNC(=O)c2nc(-c3ccccc3)n(-c3ccc(F)cc3)n2)cc1F 1356250255 CUXSRDRVLBIHKO-UHFFFAOYSA-N 433.462 4.209 10 10 IICE CC[C@H](C(=O)OC)N(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1360192201 PRWWUTRGLCJUPU-HSZRJFAPSA-N 447.579 4.393 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccnc2SCc2c(C)noc2C)cc1 1437385990 ROSOQTBMGKIKBR-UHFFFAOYSA-N 440.569 4.196 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2)c1C 1439960558 MRIDAPHCFSPBHI-VWLOTQADSA-N 433.600 4.150 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(Cl)c1 1447866290 OFZKTHNLCPIUQS-IBGZPJMESA-N 447.963 4.113 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2csc(C3CC3)n2)NC(=O)OC(C)(C)C)cc1 1465324322 CPOFOIDLQBELKE-IBGZPJMESA-N 444.601 4.011 10 10 IICE CCc1oc2ccccc2c1CN(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471369975 ODCMPDCQBYNLFE-UHFFFAOYSA-N 448.567 4.039 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](c3ccccc3)C3(CO)CCCC3)C2)cc1 1478859242 DBLDNNHNCWFOPW-YKSBVNFPSA-N 437.584 4.115 10 10 IICE C[C@H]1CCC[C@](Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1493505640 BHGFGPJUSZQIMZ-DFBJGRDBSA-N 436.604 4.136 10 10 IICE CCCCN(CC)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1500438091 CVHPXIVBMGDMPB-OAQYLSRUSA-N 443.661 4.400 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCC[C@@H](C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1510600401 CPYJQRFFOZODOI-GCJKJVERSA-N 448.615 4.456 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CC1(O)CCCCCC1 1517142350 HSMKUCJZTQNFOD-UHFFFAOYSA-N 441.963 4.421 10 10 IICE CC(C)c1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ccccc2n1 1527858717 ZDIAMAYKIAHFTO-UHFFFAOYSA-N 425.479 4.403 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@H]2CCOC[C@H]2OC)sc(C)c1-c1ccc(F)cc1 1531749818 NVLAHPQGFZBKBM-NVXWUHKLSA-N 435.517 4.419 10 10 IICE CS[C@@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C(C)(C)C 1538396763 ZEBJOUGCOINYKN-SFKKXYGYSA-N 440.631 4.311 10 10 IICE Cc1cc(CC(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c(C)n1-c1ccccc1 1540751822 LYIVJLFBSZVNPB-HHHXNRCGSA-N 444.623 4.132 10 10 IICE COc1c(Br)cccc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1544529987 RTRCYSLFVJGUDW-SFHVURJKSA-N 447.373 4.345 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)CCCC1 1558373375 RRIQEHBOCIVSHE-QGZVFWFLSA-N 441.572 4.044 10 10 IICE COC(=O)c1cnc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C(F)(F)F)c1 1559097706 HAYMDVDVANCOLF-HNNXBMFYSA-N 443.853 4.323 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](CCc3ccccc3)c3ccccn3)CC2)cc1F 1565213745 XYIFNLRDCVDSOD-XMMPIXPASA-N 448.542 4.435 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)Nc4cc(F)ccc43)cc2Cl)C1 1586081887 JYKINNBSAFBCLC-KBXCAEBGSA-N 429.923 4.458 10 10 IICE COC(=O)C1(C2(O)CCN(C(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)CC2)CCC1 1607272347 QYHUEZIUVUCPSQ-UHFFFAOYSA-N 444.959 4.058 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C(C)(C)C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935367 PEEUJKASVWCAGG-FQEVSTJZSA-N 448.615 4.313 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(NC(=O)c3ccsc3)CC2)c1 1626658979 JZEVNTDOLBGBFH-UHFFFAOYSA-N 435.549 4.003 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)N(Cc3ccccc3)[C@@H]2c2ccccc2)c1 1633282948 QJNFVZQKHBEBQI-JYFHCDHNSA-N 428.532 4.497 10 10 IICE Cc1cc(C(=O)NC[C@@H]2c3ccccc3CN2C)c(C)n1-c1ccc(Br)cn1 1635900842 BFNQZJGWSUVVGQ-HXUWFJFHSA-N 439.357 4.168 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1csc(NC2CCCCC2)n1 1637247216 ILYLMKIIYJQBGB-UHFFFAOYSA-N 437.949 4.062 10 10 IICE Cc1cc(C(=O)N2CC[C@@](C(N)=O)(c3ccccc3)C2)c(C)n1-c1ccc(C(C)C)cc1 1638066367 FLNIWRZUTCLAID-MHZLTWQESA-N 429.564 4.487 10 10 IICE COc1c(N)c(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc(Cl)c1Br 1638957898 ZTFWAUYMQRGIBQ-SNVBAGLBSA-N 426.742 4.250 10 10 IICE COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1639165631 DOZCXASKZOSXGR-DJJJIMSYSA-N 433.346 4.270 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(cnn3C(C)C)c2=O)c(C)n1-c1ccc(F)c(Cl)c1 1643795845 ULOVZJRYWPMUEX-UHFFFAOYSA-N 441.894 4.257 10 10 IICE CCC[C@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1=O 1652606963 OSKWJDVZZWMKQU-NRFANRHFSA-N 435.446 4.406 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N2CCc3sccc3[C@H]2c2ccccc2)cc1 1654947757 PVRVKEDSCQKXJE-AREMUKBSSA-N 449.620 4.299 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3cccc(F)c3)C[C@@H]3CCCO3)C2)cc1 1686854782 CWADVAHRGXJBOJ-YKSBVNFPSA-N 441.547 4.051 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](OC)C(C)C)C1 1697149624 XASWDFTUTQINIU-GMAHTHKFSA-N 437.588 4.249 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1698406375 JSDYQIBZJAJVKT-OXJNMPFZSA-N 435.613 4.351 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1710955826 KVRFJAOKBAJBBG-PKOBYXMFSA-N 449.640 4.393 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc(C)o4)n3C[C@@H](C)SC)CC2)cc1 1748846851 CXVADSKLXGCHBP-GOSISDBHSA-N 441.601 4.323 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1cccc(Br)n1 1760994679 KGBCGXMYKGYMAH-UHFFFAOYSA-N 430.350 4.024 10 10 IICE CC(C)CCn1c(-c2cc(Br)cn2C)nnc1N(C)Cc1ccccc1O 1761079873 JFZUGNJULVHLSP-UHFFFAOYSA-N 432.366 4.434 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763246303 DCXSWEBVKYKFTM-HYBUGGRVSA-N 439.648 4.358 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)C[C@H]2CCCOC2)cc1 1764935363 QLDZEWZRWYBOAE-JOCHJYFZSA-N 448.615 4.406 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CN3CCN(c4ccccc4F)CC3)cc2)c1 1872881579 FIBLAOVFBBOEMW-UHFFFAOYSA-N 432.543 4.466 10 10 IICE C[C@H](NCc1ccc(Br)cc1O)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116257368 SSLNKSHOPDGWJS-YVEFUNNKSA-N 425.323 4.492 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccco3)C2=O)ccc1O[C@H](CC)C(=O)O 2314933379 AWYNTZMLACJPCU-OAHLLOKOSA-N 447.534 4.322 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(CCc2ccc(O)cc2)C1=O)C(=O)O 2314933714 XDIWCGIYBMJCGS-KRWDZBQOSA-N 443.546 4.078 10 10 IICE COc1ccc(C=CC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)c(OC)c1 2325219646 WHISOGCCDYLSID-DEOSSOPVSA-N 437.584 4.126 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)C2=Cc2ccc(C(=O)O)cc2)cc1 2332139489 MCMUPSDFOLDVTM-UHFFFAOYSA-N 430.435 4.363 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1cc(Br)cc(F)c1O)[C@@H]2F 2358241763 UOMXYRQLWGYAND-OEAJRASXSA-N 447.320 4.262 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1)N2)N1CCOCC1 14460317 RUTXHTQTSSBPOE-CNNODRBYSA-N 430.957 4.187 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2ccc(OCCc3ccccc3)cc2)SC1=S 206835886 KRNPJMZCBDVXAM-XDJHFCHBSA-N 427.547 4.072 10 10 IICE Cc1ccccc1NC(=O)CCCN1C(=O)/C(=C\c2ccc(O)cc2O)SC1=S 210711971 NAWOYASGVZNTMF-WOJGMQOQSA-N 428.535 4.026 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccncc3)CC2)c(C)n1-c1ccc(Br)cc1 247842333 QNZNISMLPGJGGS-UHFFFAOYSA-N 439.357 4.214 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526229128 RWUWCIBEHDWTBW-HSZRJFAPSA-N 433.460 4.481 10 10 IICE Cc1cc(CCNC(=O)C2CCN(C(=O)c3ccccc3)CC2)c(C)n1-c1ccccc1 742040734 DHPRXDPZZAICGP-UHFFFAOYSA-N 429.564 4.305 10 10 IICE Cc1cc(CCNC(=O)CNC(=O)c2ccccc2C(F)(F)F)c(C)n1-c1ccccc1 755080779 KDSGDLBGJLXCOL-UHFFFAOYSA-N 443.469 4.202 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(Cn3cc(C)cn3)on2)cc1 755885654 VQTRQDKSUPHACP-UHFFFAOYSA-N 445.523 4.149 10 10 IICE C[C@H]1CN(c2ccc(CN[C@@H](C)c3cc(Br)cc(F)c3O)cn2)C[C@@H](C)O1 756418312 SIPSRCXIZALDTM-MJBXVCDLSA-N 438.341 4.153 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccc(N2CCCC2)c1 768883758 ZMCIJEMZBHXOFZ-UHFFFAOYSA-N 433.600 4.141 10 10 IICE COc1ccc(CNC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c(O)c1 794373836 MYYNDOVOIDNDAG-UHFFFAOYSA-N 442.541 4.166 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2CC(F)F)c(C)n1-c1ccc(Br)cc1 804723323 WGKOXTRMXHXCLJ-MRXNPFEDSA-N 427.289 4.353 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCn4c(cc5ccccc54)C3)cc2F)C[C@@H](C)O1 812876483 FGPIDIKBNYYKLH-HDICACEKSA-N 436.531 4.119 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3ccnn3C3CCCCC3)cc2F)C[C@H](C)O1 918220750 LSACNXGZKPHYBE-IRXDYDNUSA-N 429.540 4.463 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCCc2occc21 1126246954 XCERBITZQDPACG-UWCCDQBKSA-N 430.526 4.204 10 10 IICE COc1ccc(-n2ccc(CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)n2)cc1 1136402380 XYWOVRRJTPWQOD-UHFFFAOYSA-N 442.519 4.339 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)/C(F)=C/c1ccc(C(F)(F)F)cc1 1141926467 FCDGOIWJVZNTFI-NVMNQCDNSA-N 444.375 4.447 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCCN(C)c2ccccc2)C1 1142079006 CAGAJDXWELAGIF-UHFFFAOYSA-N 432.612 4.441 10 10 IICE Cc1cc(C(=O)N[C@H]2Cc3ccccc3NC2=O)c(C)n1-c1cccc(Br)c1 1151139757 KJWMYVFDABTYJM-FQEVSTJZSA-N 438.325 4.150 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)c([N+](=O)[O-])c1 1162949347 NBMJOESYGQDQLM-SIKDUDHDSA-N 439.516 4.331 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O)c1ccc(N(C)C)cc1 1234554998 HBYWFSFGUHAFMX-HOIFWPIMSA-N 426.536 4.004 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2COc3c(F)cc(F)cc3C2)c(C)n1-c1ccccc1 1253814151 NNQBYUSAIGUXQQ-HXUWFJFHSA-N 425.479 4.218 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1256231792 FGKBGGZXFCCXTI-XMMPIXPASA-N 425.621 4.043 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)[C@@H](C)C2)cc1 1264916032 SNMMBRKKXLSBJU-FQEVSTJZSA-N 445.563 4.161 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2CC2CC(C)(C)C2)c(C)n1-c1ccccc1 1289352359 FALHKZZTMFTSCY-QGZVFWFLSA-N 448.615 4.489 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C[C@H]1c1ccc(Cl)cc1 1300110711 LUZFCTAMJQXEMG-LEWJYISDSA-N 437.927 4.171 10 10 IICE C[C@H]1C[C@@H](C)CN(C(C)(C)Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1304913625 WPYRWUSMYPKXCH-BGYRXZFFSA-N 448.615 4.439 10 10 IICE CC[C@@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1306388338 VNOJKUYODIJGPJ-WIYYLYMNSA-N 429.634 4.007 10 10 IICE CCCCn1c(N)c(N(Cc2ccc(N3CCCCC3)c(C)c2)CC(C)C)c(O)nc1=O 1307541279 DRZIASPXGFNUDB-UHFFFAOYSA-N 441.620 4.293 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC[C@H]1CC[C@@H](C(F)(F)F)O1 1313268645 KPLVUKBKXXUCET-HIFRSBDPSA-N 439.272 4.186 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CC(=O)Nc2cccc(C)c2C)CCCC1 1357705509 IUYPSEFRCJSPTG-UHFFFAOYSA-N 433.552 4.243 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1cscn1 1361097755 HTYXSYUPWZMBTG-FQEVSTJZSA-N 426.590 4.035 10 10 IICE CSC[C@@H](C)C(=O)N1CCC(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1438293834 BLZZGBINGCTDAP-GOSISDBHSA-N 441.641 4.256 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1438305601 VCOPHFRWPSDTDG-UHFFFAOYSA-N 443.507 4.486 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cnc(-c2ccccc2)cc1=O 1446803833 LBEZOEGWRYYIAX-HXUWFJFHSA-N 439.515 4.406 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)Cc2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 1448803963 GEBOSCSZWKSWDW-LJQANCHMSA-N 445.332 4.329 10 10 IICE CO/C(=C/c1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324410 DSDOAJCNWSARSH-BCIXFCFJSA-N 439.556 4.122 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1coc(-c2ccc(Br)cc2F)n1 1469249023 LGGLPURMTMKTOT-UHFFFAOYSA-N 442.244 4.427 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCOCC2)c1C 1470164617 GNMBRIBJLNWFPX-UHFFFAOYSA-N 441.572 4.206 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(C)CCOCCN(C)C(=O)OC(C)(C)C)c2C)c1 1470196221 NXDWXICUVSPEQJ-UHFFFAOYSA-N 443.588 4.358 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(Oc2ccc(Cl)cn2)CC1 1478840364 AYUQCEDEJFIJRA-KRWDZBQOSA-N 430.980 4.293 10 10 IICE COC(=O)[C@H](C)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1515269000 HCRBLJUCFORHBD-NIYFSFCBSA-N 447.579 4.074 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1CCc2ccccc21 1521696652 XPQDNBHNDUGDOR-IZQLPPHKSA-N 440.565 4.263 10 10 IICE COc1cc(C)cc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1534464047 AMFNZQBHOCSWFY-XDHOZWIPSA-N 444.553 4.050 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@@H]2Cc3ccc(Br)cc3[C@H]21 1536551129 XCCYTRGBURDDQE-GZPVHCRCSA-N 427.386 4.457 10 10 IICE Cc1cc(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1539597861 LLRHAOIVUMQOIC-UHFFFAOYSA-N 448.586 4.171 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](CN1CCCC1)c1ccccc1 1545632928 YYAMDLZTPODUTD-PKTZIBPZSA-N 442.003 4.006 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCS[C@@H](C)[C@H]2C)cc1 1547446590 BRJQDOMRFHHCEA-SVFBPWRDSA-N 443.661 4.397 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCCc2nc(C(=O)OC)ccc21 1587323032 VQQMCECGFGCOAL-RAXLEYEMSA-N 431.492 4.198 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1 1596733604 VMKWCZIRRSSYPF-UXHICEINSA-N 434.458 4.436 10 10 IICE O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)NCc1c(O)cccc1F 1596912531 OFJCPSVTHKNVJI-UHFFFAOYSA-N 439.874 4.430 10 10 IICE CCCn1c(C)c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c2cc(OC)ccc21 1598266801 CPWUIJGWYFTYPZ-UHFFFAOYSA-N 434.584 4.050 10 10 IICE COc1cc(N2CCN(c3cc(C(C)(C)C)nc(C(C)(C)C)n3)CC2)cc(OC)c1OC 1612231172 IHJPSFGSORNPNZ-UHFFFAOYSA-N 442.604 4.424 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC[C@H]1C 1612829256 OOIWSFHCLFHDLH-QZTJIDSGSA-N 429.584 4.082 10 10 IICE Cc1ccccc1-c1nc(C)c(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)s1 1616601535 ZKUCLAFLSKOCQG-UHFFFAOYSA-N 448.592 4.059 10 10 IICE Cc1cccc(N2CCN(CCCNC(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)c1 1624803115 SMIJCFZBBADGPQ-UHFFFAOYSA-N 430.596 4.345 10 10 IICE CCc1c(C(=O)N(CC)Cc2cc(Br)ccc2O)nnn1Cc1ccccc1 1629968318 DYHIKOHNKKLCBJ-UHFFFAOYSA-N 443.345 4.019 10 10 IICE Cc1cc(C(=O)N(C)CCN2CCOC(C)(C)C2)c(C)n1-c1ccccc1Br 1634516662 STKZGMWWRKMRRQ-UHFFFAOYSA-N 448.405 4.039 10 10 IICE C[C@H](NC(=O)N1CCOc2ccc(NC(=O)OC(C)(C)C)cc2C1)c1ccccc1O 1638061385 PTEPOPYBIUUDQB-HNNXBMFYSA-N 427.501 4.404 10 10 IICE CCOc1ccc(NC(=O)CN2CCCc3cc(OC(F)(F)F)ccc32)c([N+](=O)[O-])c1 1657613062 NLBRLGGPMBSGHP-UHFFFAOYSA-N 439.390 4.283 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](C)CCCCNC(=O)OC(C)(C)C 1673244406 NHNQGGRBXDIVBO-MOPGFXCFSA-N 434.625 4.375 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@](O)(c2ccc(Cl)cc2)C1 1673745311 SWECTVJQGVDPMQ-KOSHJBKYSA-N 429.992 4.339 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1676549974 QRTSWKGBLZUSIZ-LOSJGSFVSA-N 431.584 4.034 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]1CN(C)C(=O)OC(C)(C)C 1683253277 GQGKLHIQVQWYMM-GHTZIAJQSA-N 432.609 4.033 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H](c4ccc(F)c(F)c4)C3)C2)cc1 1683504317 PVGKZVFYHUKPMO-PKOBYXMFSA-N 429.511 4.389 10 10 IICE CCOCc1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1696302459 OVMXLQMCXQCZQA-UHFFFAOYSA-N 429.634 4.043 10 10 IICE C=CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C#N)C1 1705941127 ZPILYVDUOFLYEJ-OAQYLSRUSA-N 448.596 4.001 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2C[C@@H](C)CC(C)(C)C2)cc1 1710023851 FRJKJRQFMWUXOZ-IBGZPJMESA-N 440.636 4.183 10 10 IICE C[C@H](c1ccccc1)N(C)c1nnc([C@@H]2CCC(=O)N2)n1CCCSc1nccs1 1723754601 KIKDIHATMGVIPC-WBVHZDCISA-N 442.614 4.066 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@](C)(OC)C1CC1 1727000470 DIHMKNRIGIOOPT-OSPHWJPCSA-N 445.583 4.081 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1CC(C)(C)NC(=O)OC(C)(C)C 1729420111 HIDCSXXHLRPFNX-UHFFFAOYSA-N 429.565 4.191 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CC[C@@H](F)C3)CC2)cc1F 1768704582 KCKSNADEJJUOFZ-QZTJIDSGSA-N 433.547 4.089 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC1(C)C 1769110359 SBXCYXDNSJJCPI-NRFANRHFSA-N 439.629 4.214 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])SC2=S)N(C)C)cc1 1858593860 ANTJXZCSOPUGEH-LSCADSNKSA-N 443.550 4.108 10 10 IICE Cc1ccc2c(C)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(=O)oc2c1 1866294623 OEQCDNSKBHUHJF-QHCPKHFHSA-N 447.579 4.433 10 10 IICE CCCN1C(=O)C(Nc2ccc3c(c2)OCO3)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873421833 TVNKEGQKKMYEFJ-UHFFFAOYSA-N 443.503 4.425 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@H](NCc1cccc(Br)c1O)C2 1878851821 UBSWLOMBQYRMCI-DRPJVOAASA-N 429.330 4.123 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)no2)cc1OC 1891665257 NNSIIKOCQFYZDW-PXNSSMCTSA-N 433.508 4.278 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(CNCc2cc(Br)cc(F)c2O)C1 2136105923 IIOVBIHYIDIIGC-DJJJIMSYSA-N 429.330 4.031 10 10 IICE CC1=CC2=NC(=O)C(=Cc3cn(CCOc4ccc(C)cc4)c4ccccc34)C(=N)N2O1 2297347432 MFWCPHPZOWCEER-UHFFFAOYSA-N 426.476 4.479 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3F)C2=O)ccc1O[C@H](C)C(=O)O 2314934381 ZHXWHMMDUCCIDF-LLVKDONJSA-N 433.482 4.092 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@@H](NCc1c(O)cccc1Br)C2 2333643773 NXRCYGUWHJYHKF-CPUCHLNUSA-N 425.367 4.280 10 10 IICE Cc1ccc(CNCC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(O)c1Br 2352948730 TUOCOFLYOLPLTO-ZBFHGGJFSA-N 427.383 4.446 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)c2C)cc1F 8634704 DNDJUISQHNVZGF-VWLOTQADSA-N 433.483 4.192 10 10 IICE COc1ccc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccc(F)cc3)C2=O)cc1 15039518 VHLBEBMUGWBNKO-AQTBWJFISA-N 430.526 4.454 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccc(F)cc3)=NC2=O)ccc1OCCC(=O)O 16920117 YTWBAGLZAHNSEK-LDADJPATSA-N 430.457 4.160 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cccc(Cl)c4Cl)c3N)CC2)cc1 40727741 ODUVPJGCZVVIHS-UHFFFAOYSA-N 445.354 4.444 10 10 IICE CCN(CC)c1ccc(CN(C[C@H](O)COc2cccc(C=O)c2)c2ccccn2)cc1 54120899 BLXKCORWHXLHAP-DEOSSOPVSA-N 433.552 4.187 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3ccc(F)cc3)=NN2C(=O)COc2ccc(C=O)cc2)cc1 72413285 SBYGXDNXCGOIBX-VWLOTQADSA-N 445.494 4.461 10 10 IICE COc1cc(/C=C2\C(=N)N3C(SC)=NSC3=NC2=O)ccc1OCc1ccccc1 96450516 HQSVPSPUNBYADA-BXODQFHZSA-N 438.534 4.214 10 10 IICE CC(C)(C)OC(=O)N1CC=C(CNCc2cc(Cl)cc(Br)c2O)CC1 708073065 KLEYASGZYHKLRT-UHFFFAOYSA-N 431.758 4.465 10 10 IICE C[C@H](NC(=O)N1CCC(N2c3ccccc3C[C@H]2C)CC1)c1ccc(N2CCOCC2)cc1 728747855 VFSALWYVIJHWMK-RTWAWAEBSA-N 448.611 4.209 10 10 IICE Cc1cc(C(=O)Nc2cnn(-c3ncccn3)c2)c(C)n1-c1ccc(Br)cc1 737984667 MKYNICMXMOHXGA-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741184258 BWUCKGGPNLYYIV-PMACEKPBSA-N 434.458 4.483 10 10 IICE Cc1ccncc1/C=C\C(=O)NCc1ccc(N(C)C(=O)/C=C/c2cnccc2C)cc1 765477922 IAMVHHNGOLYUMK-NAKBGQTNSA-N 426.520 4.099 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)C1 791191267 FJJXODUYRBPEOX-RBBKRZOGSA-N 434.411 4.450 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(CCN(C(=O)NCCCSc3nccs3)C2)C1 802244685 ZXUCNVNZJWLARQ-HXUWFJFHSA-N 440.635 4.058 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2nc(-c3ccccc3)no2)c(C)n1-c1ccc(Cl)cc1 804122285 BJJMLNCAONIAGZ-HXUWFJFHSA-N 436.899 4.261 10 10 IICE Cc1cc(C(=O)COC(=O)[C@@H](F)C2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 811432454 BWWAAMZSCKSRJJ-NRFANRHFSA-N 444.503 4.025 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)n1C1CCOCC1 1136480244 GNGIHLPFSCGVLT-DEOSSOPVSA-N 439.600 4.344 10 10 IICE COc1ccc(COCCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1137438837 WKXXWACZAFBKQB-NRFANRHFSA-N 446.975 4.132 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)s1 1140172734 ZKPCSNNGOPIZNO-HZPDHXFCSA-N 439.585 4.210 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1141737869 KYILLXLQGJVNIF-GFCCVEGCSA-N 439.286 4.208 10 10 IICE COc1ccc(Br)cc1C1(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 1142465889 VNSNUDJQWJWVGD-UHFFFAOYSA-N 429.358 4.188 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2ccccc2F)c(C)n1-c1ccc(Cl)cc1 1148561570 REMZHZUKUXUTSJ-UHFFFAOYSA-N 427.907 4.437 10 10 IICE Cc1cc(CC(=O)NCc2cnc(Br)cn2)c(C)n1-c1ccc(Cl)cc1 1157728596 QAQFSTVERMVISA-UHFFFAOYSA-N 433.737 4.159 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCN(C(C)=O)C1 1294418940 MQLIKRYIEUFBDD-QFIPXVFZSA-N 448.615 4.457 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C)n(-c3ccccc3Br)n2)c1 1294936110 CUXLDBFCOHVCKG-CYBMUJFWSA-N 430.302 4.148 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCOC1 1300958437 VZFJIUPHNCSTTL-WIYYLYMNSA-N 437.588 4.108 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1 1312789162 IYBCKZTWDUSAQA-UHFFFAOYSA-N 438.977 4.221 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)C2)cc1 1312818321 LSCLUUDKJYHMFE-RCZVLFRGSA-N 438.616 4.075 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@H](O)c3cc(F)c(F)c(F)c3)c2C)c1 1313132731 OYZYRRAYJSBQOZ-NRFANRHFSA-N 431.458 4.353 10 10 IICE FC(F)[C@@H]1CCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1316516171 IPDXOTFUSYNJSY-OAHLLOKOSA-N 436.557 4.461 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)[C@H](C)C2)cc1 1352391210 DFBJQEKNQKILEM-HXUWFJFHSA-N 431.536 4.232 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N(C[C@H]2CCCO2)c2ccncc2)C1 1360759281 NGKQYFBIDDTJHS-HXUWFJFHSA-N 437.540 4.201 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1ccc(Cn2cc(Cl)cn2)s1 1441631576 NLPFFKHQQFBWLZ-UHFFFAOYSA-N 433.002 4.130 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(Oc3cncc(Cl)n3)CC2)c1 1448167157 ZBDGRTCMWYKYNI-UHFFFAOYSA-N 438.915 4.034 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(I)c(F)c1 1452054233 VCDVPVSRKYLMEA-UHFFFAOYSA-N 438.284 4.351 10 10 IICE Cc1nn(Cc2ccccc2)c(N)c1C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1452612410 KLIILRMVFJRJTJ-UHFFFAOYSA-N 445.489 4.093 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1460978602 ACBNXYSJOWLGCU-WBVHZDCISA-N 448.394 4.468 10 10 IICE O=C(COc1ccc(F)cc1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1463208210 NECGOPNKMGDHKI-UHFFFAOYSA-N 441.260 4.315 10 10 IICE CO[C@@H](CNC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1466399248 PCSGJALXPIZLSW-UWJYYQICSA-N 428.529 4.022 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccnc(F)c4)CC3)cc2Cl)C1 1469961459 VTJMOEPXWQDYCO-QGZVFWFLSA-N 445.970 4.142 10 10 IICE C[C@@H]1C[C@H](c2ccccc2)N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1 1473455748 OQJVUZDSOSWLRE-KYCQWFEFSA-N 439.575 4.139 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CC1 1479088193 UYPTVDRZPXVJCF-KESTWPANSA-N 432.609 4.368 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)OC(C)(C)C 1479435447 STKXNYWJMQSHOS-FGZHOGPDSA-N 438.572 4.085 10 10 IICE CO[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CC[C@H]1C 1504516096 JVUSXABLCNMXNI-WZONZLPQSA-N 425.621 4.295 10 10 IICE COc1cccc(C[C@H](C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1516814604 KVYCIQFICGDKRJ-IPMKNSEASA-N 428.548 4.333 10 10 IICE CS(C)(=O)=Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1530287551 DOAUZFAIIYEXHF-UHFFFAOYSA-N 437.512 4.046 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(-c4ccccc4F)nc3C)CC2)c(OC)c1 1530968749 YICSRQKGPQUXOI-UHFFFAOYSA-N 441.528 4.237 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CSCN3C(=O)CC(C)(C)C)c2C)c1 1531612961 ZBMJCJWBZCVGAX-NRFANRHFSA-N 427.614 4.356 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1oc(C2CC2)nc1C(F)F 1534129376 AYTGHAUGEFIKSF-UHFFFAOYSA-N 445.388 4.275 10 10 IICE CC(C)c1nnc(N2CCN(CC(F)(F)F)[C@@H](C)C2)n1CCCSc1nccs1 1541365729 FOMSOQURIIEEGW-AWEZNQCLSA-N 448.584 4.113 10 10 IICE Cc1noc(C)c1[C@@H](C)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1543377818 PBIWSLNLACHMGX-INIZCTEOSA-N 432.528 4.014 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)N(CC)Cc1cc(Br)ccc1O 1545508464 CEGSXWFTNDHFJZ-CQSZACIVSA-N 426.742 4.442 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CO[C@@H](CN3CCCc4cc(OC(F)F)ccc43)C2)C1 1559605355 OSEDKYRYJZPGGA-JPYJTQIMSA-N 438.515 4.457 10 10 IICE CCOCCCN1CC[C@@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@H](C)C1 1565726639 XFLFFRFWNYKUHW-NTKDMRAZSA-N 439.600 4.082 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c2[nH]ncc12 1583707564 CXXDDPVEWNBUSA-LICLKQGHSA-N 440.525 4.240 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1584178290 JXVLCCHWVKSZNA-QFIPXVFZSA-N 425.573 4.495 10 10 IICE CC(C)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1586060257 DQNPGASAWOBSSP-RTWAWAEBSA-N 448.652 4.047 10 10 IICE CC(C)(C)[C@@H]1CN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CCO1 1597196041 LYHXYPRJAKLTPQ-INIZCTEOSA-N 432.619 4.163 10 10 IICE CCCCN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1614491463 VXUDTXJDMKXPDY-NRFANRHFSA-N 429.634 4.358 10 10 IICE CCO[C@H]1C[C@@](NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1616581954 UVOPUZQKYQCGQN-WMZHIEFXSA-N 432.948 4.224 10 10 IICE CC(C)(C)OC(=O)NCCCCCCC(=O)NCc1cccc(Br)c1O 1623363909 MKODLMPSDHFJBP-UHFFFAOYSA-N 429.355 4.246 10 10 IICE Cc1ccc(NCCCNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c([N+](=O)[O-])c1 1629581606 SOMAOMBXMOCYMH-UHFFFAOYSA-N 434.496 4.355 10 10 IICE COc1ccc(N2CCN(CCCNc3ccc([N+](=O)[O-])c(-c4ccccc4)n3)CC2)cc1 1639204916 YBFVIAMDMPQQGX-UHFFFAOYSA-N 447.539 4.290 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(C(=O)OC(C)(C)C)CCC23CCC3)c([N+](=O)[O-])c1 1640342685 AKYRTGCVMCPERQ-VQHVLOKHSA-N 445.516 4.151 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(Cl)c(Cl)c1 1644590920 VCMSJEVKYUCTJK-UGSOOPFHSA-N 427.715 4.188 10 10 IICE Cc1cc(CC(=O)N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C2)c(C)n1-c1ccccc1 1651311464 HBUNFSOBAJKAMC-UHFFFAOYSA-N 437.584 4.496 10 10 IICE CCCOc1ccc(CNC(=O)CN(CC)Cc2cc(Br)ccc2O)cc1 1652594659 CDQIXWCZRILOEP-UHFFFAOYSA-N 435.362 4.082 10 10 IICE CN1CC[C@H](CNC(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(Cl)c(F)c1 1681171546 ZQQAOXHLXUIDAH-ACJLOTCBSA-N 426.319 4.330 10 10 IICE Cc1ccc(C[C@@H]2CCCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1683195676 KFLCORAKMQYGOP-FQEVSTJZSA-N 443.538 4.274 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)N(C)C)cc1 1685013861 HANFFHXTGQSXCJ-PWRODBHTSA-N 434.506 4.229 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](c3ccc(C)cc3)c3ccccn3)C2)cc1 1686356409 YGSIZBVHUJAYFB-CPJSRVTESA-N 430.552 4.314 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(c2ccc(F)cc2)CC1 1686725857 YEVOHKHCJVJSLF-UHFFFAOYSA-N 433.474 4.030 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCC1(C)C 1698232982 XEUSBGLLVDBQBL-ZJOUEHCJSA-N 428.577 4.170 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1708574992 OQBTZDGXXMXXTD-KBMIEXCESA-N 443.636 4.224 10 10 IICE CCN(Cc1cccs1)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1710089190 NXFDXKMNOLTPOC-UHFFFAOYSA-N 439.564 4.020 10 10 IICE CCOCCN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1710810656 JVVMGVYIPGECLE-UHFFFAOYSA-N 434.588 4.097 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 1765237240 KQPAYSJTUBHPDQ-FUHWJXTLSA-N 427.524 4.104 10 10 IICE COCCN(c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@@H](C)C1 1771090783 KCCWFKUXQOCGJI-XLIONFOSSA-N 429.584 4.440 10 10 IICE COc1ccc(CCC(=O)NCc2ccc(C(=O)Nc3cccc(N(C)C)c3)cc2)cc1 1859102211 WAXGAGZPQQJWCR-UHFFFAOYSA-N 431.536 4.263 10 10 IICE CC1(C)C(=O)Nc2ccc(-c3csc(NS(=O)(=O)c4ccc(Cl)cc4)n3)cc21 1859572296 XOEYXKUKZPKEPT-UHFFFAOYSA-N 433.942 4.494 10 10 IICE CCc1sc(NC(=O)CN(C)C)c(C(=O)OC)c1-c1ccc(Br)cc1 1866208307 NRXJKSGPYMPPBD-UHFFFAOYSA-N 425.348 4.027 10 10 IICE COCCCN1C(=O)C(N[C@H]2CCCC[C@H]2C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873169448 AXKVAESJGNWJAA-JPYJTQIMSA-N 449.595 4.379 10 10 IICE C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)OCc1ccccc1)c1ccccc1O 2017513993 AHWOLHJUAUVNJE-FIKGOQFSSA-N 428.529 4.068 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2c(O)cccc2Br)[nH]1 2082938377 FMMSLRCLMJKVDI-JTQLQIEISA-N 428.352 4.231 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3cccc(Br)c3O)C(C)(C)[C@H]21 2119292226 AIFOSYHNWLZRCR-COXVUDFISA-N 425.367 4.278 10 10 IICE NCc1ccc(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(F)c1Br 2148937722 ZOTWUZFNMZEIRA-IEBWSBKVSA-N 432.381 4.395 10 10 IICE Oc1cc(Br)ccc1CN[C@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156290338 ZJWXMKMUVWLQJK-IFMALSPDSA-N 431.374 4.068 10 10 IICE COc1ccc(Br)c(CNCC[C@]2(C)CCN2C(=O)OC(C)(C)C)c1O 2227749002 DEQKPHSGYOBTRD-LJQANCHMSA-N 429.355 4.043 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2)SC1=S)NCCc1c[nH]c2ccccc12 2296323516 PBPOPDALLMVAMT-UHFFFAOYSA-N 435.574 4.118 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)C(=Cc3ccccc3F)SC2=S)cc1 2296756184 IQPIPMYNJJYNLZ-UHFFFAOYSA-N 430.526 4.454 10 10 IICE Cc1cc(C)cc(OCCOc2ccc([N+](=O)[O-])cc2C=C2SC(=S)NC2=O)c1 2297335250 GXSDIECSCYTMJX-UHFFFAOYSA-N 430.507 4.158 10 10 IICE CCCSc1nnc(-c2ccccc2N/C=C2\C(=O)N(c3ccccc3)N=C2C)c(O)n1 15015568 YMBOGHSYUNKTCU-JXAWBTAJSA-N 446.536 4.465 10 10 IICE O=C1N=C(N2CCN(c3cccc(C(F)(F)F)c3)CC2)S/C1=C/c1ccccc1O 27515511 JQZOSHRFWALBRH-LDADJPATSA-N 433.455 4.204 10 10 IICE COc1ccc(N2CCN(c3nccc4ccc(C(=O)NC5CCCC5)cc34)CC2)cc1 35512248 VCPXQZWDMTUGAR-UHFFFAOYSA-N 430.552 4.242 10 10 IICE CCOc1cccc([C@H]2CC(c3ccc(Cl)cc3)=NC3(CCN(C(C)=O)CC3)N2)c1O 65298363 XFCLSGWMBYUMLP-OAQYLSRUSA-N 441.959 4.307 10 10 IICE biogenic COc1ccc(/C=C2\SC(=S)N(c3ccc(C(C)=O)cc3)C2=O)c(C(=O)O)c1OC 210401659 UZKWNWNWGFPDQD-YBEGLDIGSA-N 443.502 4.010 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1 435521508 HQJNAOHDZCVSNW-UHFFFAOYSA-N 445.542 4.049 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cc(OC)ccc3OC)[C@@H]2c2ccc(O)c(O)c2)cc1 526227062 NTJLGLKEHTUWBR-HSZRJFAPSA-N 449.459 4.181 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)cc1 734073574 LKPXNAVZLGHXEB-DEOSSOPVSA-N 446.551 4.253 10 10 IICE COc1cc2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)[nH]c2cc1OC 735656468 PTSIXXPQKDNNIK-HXUWFJFHSA-N 437.540 4.073 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)nn(Cc4ccc(Cl)cc4)c3C)CC2)cc1 748690708 ANAYDQBUGJVOKY-UHFFFAOYSA-N 438.959 4.173 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N(C)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 752672434 VIATXPDRKSGBJP-WCRBZPEASA-N 430.593 4.133 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(C(=O)c3cc(C)n(-c4cccc(Br)c4)c3C)[C@@H]2C1 755202208 KDLZZTUHKTXBRI-HMXCVIKNSA-N 447.373 4.265 10 10 IICE Cc1ccc(Br)c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768915420 MRMFXMPHCSMXOA-UHFFFAOYSA-N 442.401 4.220 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@H]2CC[C@H](O)CC2)sc(C)c1-c1ccccc1 784395035 RTAJGZOLRYLWRJ-IYARVYRRSA-N 430.570 4.074 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1C[C@H]1c1ccccc1 797784150 RRVGPNDSIOBSGK-CVAFCFIJSA-N 428.604 4.402 10 10 IICE CCN(CC)C(=O)C1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC)CC1 801889279 YLAAGQNINXMUIN-UHFFFAOYSA-N 448.615 4.457 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4c(c3)nc(Cc3cccs3)n4C)CC2)cc1 804153109 VJTVLJMVLGAFLI-UHFFFAOYSA-N 446.576 4.197 10 10 IICE C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)C1 806457206 GPNVUJBMLGDJBN-MBSDFSHPSA-N 425.548 4.470 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)cc1 808116778 AHMWZWMPEWZPED-UHFFFAOYSA-N 429.423 4.304 10 10 IICE CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 931674878 KHTVJVWFYBNJOD-HXUWFJFHSA-N 435.634 4.282 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3cn(-c4ccccc4Cl)nn3)ccc21 1127315393 XXGPGNHBHSLGIZ-UHFFFAOYSA-N 438.915 4.496 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)CCCC1 1128220908 VJSFPNBKINWRMM-QGZVFWFLSA-N 441.572 4.044 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(-c4ccccc4C)nc3C)CC2)c(OC)c1 1131803868 BTYVPGZWQATSCM-UHFFFAOYSA-N 437.565 4.407 10 10 IICE Cc1cc(C(=O)N[C@H](C)CN2C[C@@H](C)C[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1136379363 XVBGXLIVROBBEI-HRCADAONSA-N 447.421 4.348 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@H](CC(F)(F)F)C3)cc2Cl)C1 1227208269 MZDDEWANPQPMSR-ZBFHGGJFSA-N 433.902 4.439 10 10 IICE CCOC(=O)C1(CC(F)F)CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251989587 PNLKTNNWHNNFTA-QGZVFWFLSA-N 439.547 4.002 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1252923717 NJJFDADCUOSWGX-PKOBYXMFSA-N 433.474 4.492 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@H]1CCC[C@@H](OC)C1 1277969458 CGVWMKYOIYADMI-AMHTUMDSSA-N 446.975 4.153 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccccc3Cl)cc2F)C[C@H](C)O1 1291755396 GYVZYCSTHSTRAF-GJZGRUSLSA-N 442.922 4.413 10 10 IICE CC(C)(C)OC(=O)COc1cccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 1298842854 ZAKDEHXFUXABSF-UHFFFAOYSA-N 426.296 4.350 10 10 IICE CCCCOc1ncccc1Cn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O 1306752433 SCFGSISBBKKDSL-UHFFFAOYSA-N 446.555 4.248 10 10 IICE CCn1c(O)nnc1C1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)CC1 1329531358 UJYMOBJTHBJAGT-UHFFFAOYSA-N 427.936 4.084 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N(C)CCc1cccs1 1361095829 PZFMTTCMBOIOHE-UHFFFAOYSA-N 434.613 4.447 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H](C[C@@H]1CCCO1)C(F)(F)F 1435064444 KORVTTIJIUDRKW-DLBZAZTESA-N 436.421 4.121 10 10 IICE COc1cc2c(cc1CNC(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)O[C@H](C)C2 1446384077 UQBQEMVTPNRCOC-QGZVFWFLSA-N 432.520 4.098 10 10 IICE COc1cccc(N(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)C(=O)OC(C)(C)C)c1 1447966655 HVNLJXIRJVBUFE-QGZVFWFLSA-N 427.545 4.380 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)O[C@H]([C@H]2CCCOC2)C(F)(F)F)CCCC1 1459759443 PZDLNXJKGGFAAP-LHSJRXKWSA-N 425.447 4.429 10 10 IICE C[C@H](COCC1CCCCC1)N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1460812718 DOHCVIOCPOGAKD-QZTJIDSGSA-N 448.563 4.364 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(O)c(Cl)c2)NC(=O)OC(C)(C)C)cc1 1465324874 JPPNQJBEWDJHBB-LJQANCHMSA-N 447.963 4.036 10 10 IICE CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1 1469838441 IYJRMBJYQBQRDV-OALUTQOASA-N 431.577 4.494 10 10 IICE CCN(CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)C(C)C 1502189745 MRYGIYPRDFYERP-UHFFFAOYSA-N 428.968 4.066 10 10 IICE CCOCc1nnc(N2CCC(OC(C)(C)C)CC2)n1Cc1ccc(N(CC)CC)cc1 1503068080 OSYBOFZDTPWXIL-UHFFFAOYSA-N 443.636 4.493 10 10 IICE CO[C@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC[C@@H]1C 1504501543 HGWQHPOKTLVNLZ-YJBOKZPZSA-N 444.630 4.149 10 10 IICE Cc1ccsc1Cn1c(N(C)Cc2ccccc2O)nnc1[C@@]1(OC(C)C)CCOC1 1510522906 UFDOPQNHQGSKDE-HSZRJFAPSA-N 442.585 4.079 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1F 1517002856 BJIFROAKLULEOL-HXUWFJFHSA-N 431.600 4.371 10 10 IICE Cc1ncc(/C=C\C(=O)N(CCc2ccccn2)c2ccc(Br)cn2)s1 1529811990 NZPSVCKPQKFWRT-VURMDHGXSA-N 429.343 4.293 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3cc(Br)ccc3C3CC3)c2)CC1 1532141625 XGJHLCRELXYIFT-UHFFFAOYSA-N 442.357 4.281 10 10 IICE CC(C)Oc1ncccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1534002283 GSTINZRRGCDIRC-SFQUDFHCSA-N 445.541 4.238 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C[C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2F)CC1 1537536134 XPPKCTKTJFEKEW-SJLPKXTDSA-N 429.502 4.343 10 10 IICE Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1539706328 JJWSCGGIRKZTNW-HXUWFJFHSA-N 444.551 4.495 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1S(C)(=O)=O 1539913010 NQYQVVZWQIUQIJ-HNNXBMFYSA-N 434.989 4.218 10 10 IICE CCN(CC(N)=O)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CCC2 1543983715 OJNZUORAVYZFHP-KNTRCKAVSA-N 442.563 4.125 10 10 IICE CC[C@H](C)c1nnc(N2CCC(c3ccnn3C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545413651 PDVKNLATEDRXSF-KRWDZBQOSA-N 439.583 4.163 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cnc4c(cnn4C(C)(C)C)c3=O)c2C)c1 1559381966 NGURGBSNFQXALL-UHFFFAOYSA-N 431.540 4.255 10 10 IICE O=C(COc1c(Cl)ccc2ccccc12)NCc1ccc(N2CCOCC2)c(F)c1 1559453691 RCOFAZVWNSESRI-UHFFFAOYSA-N 428.891 4.164 10 10 IICE C/C(=C\C(=O)N1CCOc2c1cc(Br)cc2C(F)(F)F)c1cnccn1 1585287801 LSADVALUAOIBSU-UXBLZVDNSA-N 428.208 4.087 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1 1587548072 WRYVNAPZNDOMSD-UHFFFAOYSA-N 449.576 4.360 10 10 IICE O=C(NCC1(c2ccccc2)CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1587816045 OZSKPGCTEBCYRK-UHFFFAOYSA-N 442.562 4.106 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccn(-c4cccc(C(F)(F)F)c4)n3)CC2)cc1 1596732910 KOKVPZLQAXFVRU-UHFFFAOYSA-N 444.457 4.252 10 10 IICE CCOC(=O)c1oc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)nc1C(F)(F)F 1602879289 ZLDUKNFDLJOFCN-UHFFFAOYSA-N 435.402 4.459 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCC(C)(C)CC2)cc1 1615374679 BRSUAKDMKKWAQP-UHFFFAOYSA-N 438.620 4.035 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C(F)(F)F)OC[C@@H]2C)c(C)n1-c1ccc(Br)cn1 1623755831 YGUMIUBLNOWJTL-NHYWBVRUSA-N 446.267 4.043 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cccc(N2C(=O)CCC2=O)c1 1623924210 HTBDADUKNDVWAM-SFHVURJKSA-N 428.488 4.449 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C1 1628627151 OJDOMALTCORHSB-IIBYNOLFSA-N 439.556 4.282 10 10 IICE COc1ccc(C(=O)CC(C)(C)CC(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1630619056 RKAXUSPUXCPADH-IBGZPJMESA-N 438.568 4.336 10 10 IICE Cc1ccc(OCC(=O)N2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)cc1 1632240960 ZIZPTRNPQYKODT-UHFFFAOYSA-N 445.563 4.074 10 10 IICE CC[C@H]1CN([C@@H](CC)C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CCO1 1633065801 CSDGIXOWIIYJOB-ZCYQVOJMSA-N 439.600 4.184 10 10 IICE Cc1cc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)ccc1N1C(=O)CCC1=O 1633702678 KONMWQAJJRCCBH-UHFFFAOYSA-N 443.503 4.429 10 10 IICE COc1ccc(N(C)Cc2cc(I)cc([N+](=O)[O-])c2)cc1Cl 1644867301 TXNWKDSZEJCIIX-UHFFFAOYSA-N 432.645 4.498 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)n1 1650933563 BAKIYIIVIXDWHH-FQEVSTJZSA-N 426.561 4.028 10 10 IICE COc1ccc(N(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)C(C)C)cc1F 1657770911 MFPQWNMIKZJFEP-UHFFFAOYSA-N 427.520 4.360 10 10 IICE Cc1cc(CCNC(=O)N2CCN(CCc3ccccc3)CC2)c(C)n1-c1ccccc1 1674923018 HMIKQBUILPOIRI-UHFFFAOYSA-N 430.596 4.207 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCc3ccccc3NC2=O)cc1 1682375635 UMCITKFAIQYELX-HSZRJFAPSA-N 432.524 4.011 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1C(C)C 1683253175 DMFJLXUOJDUJSL-UGKGYDQZSA-N 446.636 4.279 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4cc(Br)ccc4C3)C2)cc1 1683503879 DMJWWKBGRAYFGR-INIZCTEOSA-N 444.373 4.052 10 10 IICE C[C@@H](NC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)c1ccccc1O 1684950912 UAYUNLMWFCUNKW-APWZRJJASA-N 425.529 4.114 10 10 IICE CC(C)[C@@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1691987202 YLNJWNVVBNLVDD-NRFANRHFSA-N 440.592 4.171 10 10 IICE C=CCO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)COC)C1 1705916859 OUXGRKNRDKVVGO-WMZHIEFXSA-N 449.599 4.416 10 10 IICE C[C@@H]1CCC[C@@H]1Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1726540212 USXAABNEWWJBDC-TZIWHRDSSA-N 425.621 4.485 10 10 IICE Cc1nnc(N2CCO[C@H](c3ccc(F)cc3F)C2)n1CCCSc1nccs1 1751937850 LCHKEACZFJKLBF-KRWDZBQOSA-N 437.541 4.082 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1771446854 YYXHFGBNGDBWSL-HOTGVXAUSA-N 439.676 4.143 10 10 IICE CCN1CCc2cc([C@H](O)[C@@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044721163 ZPOYPJSTSPWEKD-VWNXMTODSA-N 439.600 4.128 10 10 IICE CC1(c2nn(Cc3c(O)cccc3F)c(I)c2C(F)(F)F)CC1 2079715983 QYRKVIDENUOJDJ-UHFFFAOYSA-N 440.178 4.451 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(CCNCc2cc(Br)cc(F)c2O)C1 2205241128 LWFDDKJSSLFSNH-JLTOFOAXSA-N 443.357 4.421 10 10 IICE CCN(CC)c1ccc(C=C2C(=N)N3N=C(COc4ccccc4)SC3=NC2=O)cc1 2294593182 BQVDWUFWKPYGSE-UHFFFAOYSA-N 433.537 4.231 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1cccc(Br)c1 2296885070 AIEOBIGUSZIBSN-UHFFFAOYSA-N 437.340 4.272 10 10 IICE CC[C@@H](C)N1C(=O)C(=Cc2cc3cccc(C)c3nc2N2CCOCC2)SC1=S 2314648144 QQFLWQGGWUVRCM-OAHLLOKOSA-N 427.595 4.380 10 10 IICE CC[C@H]1[C@@H](C(=O)NCc2ccc(C)c(Br)c2O)CCN1C(=O)OC(C)(C)C 2381139924 CNOPWUGHHDNGTG-GJZGRUSLSA-N 441.366 4.115 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(NC(=O)OC(C)(C)C)CCC[C@H]2C)c(O)c1Br 2381141884 FYAYIETURILUFQ-ZUOKHONESA-N 441.366 4.163 10 10 IICE O=C(Cn1c(=O)cnc2ccccc21)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 10909781 UWLMXIBTTWTALF-HHHXNRCGSA-N 435.483 4.161 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3cccc(OC)c3)C2=O)cc1 33417555 UMSRRDXDACYOMJ-CPNJWEJPSA-N 442.562 4.324 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccccc3OC)C2=O)ccc1OCC#N 34869962 CGMUONFVBFKORF-UYRXBGFRSA-N 426.519 4.402 10 10 IICE CC(C)NC(=O)c1ccc(NC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 586691878 KDRWYRPGDCOLAE-UHFFFAOYSA-N 427.460 4.244 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3CCC(NC(=O)c4ccoc4C)CC3)c2C)cc1 727437055 MBULIRQVRFBAGC-UHFFFAOYSA-N 433.552 4.381 10 10 IICE CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 745648681 TWYBUKKBBPPDRE-XMMPIXPASA-N 445.554 4.335 10 10 IICE C[C@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccncc1 749470622 QJPTUBGSTZLTDC-MTOJCTJASA-N 431.608 4.044 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1F 753737703 CAFJSPHQJDOKRO-SJORKVTESA-N 438.421 4.185 10 10 IICE CCOC(=O)c1c(NC(=O)CCN[C@H]2CCOC[C@H]2C)sc(C)c1-c1ccccc1 763921601 VGFMAKKUMOLXDB-QAPCUYQASA-N 430.570 4.243 10 10 IICE Cc1cc(Br)c(O)c(CNCc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c1 781629756 ZOBRSGZRGIHEET-IYBDPMFKSA-N 447.373 4.002 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc2onc(C(C)C)c2c1 791249596 XNGFPPRUOPGATE-UHFFFAOYSA-N 438.528 4.348 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 792784044 HQNYVVNJDNRPBR-AHWVRZQESA-N 444.579 4.483 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 798092589 GCEKJRMGQDCKFJ-AQYVVDRMSA-N 427.976 4.294 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cccc(NC(=O)c2cccs2)c1 804735339 VDZTXAKEQFFKAB-UHFFFAOYSA-N 431.311 4.399 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C(F)(F)F)ccc3F)cc2F)CC1 1125975861 CQQZVAYOLLSRTK-UHFFFAOYSA-N 427.417 4.056 10 10 IICE Cc1ccc(OCCCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1C 1127181964 QMNUQSCYFBCJED-UHFFFAOYSA-N 435.612 4.311 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1ccc(Cn2cc(Br)cn2)cc1 1128704741 WWPIZZBNDSUFSA-UHFFFAOYSA-N 432.665 4.136 10 10 IICE Cc1cc(C(=O)N(C)CCCNC(=O)C2CCC2)c(C)n1-c1cccc(Br)c1 1138197638 CYIBXRIRNQTQGP-UHFFFAOYSA-N 446.389 4.235 10 10 IICE CCc1c(C(=O)NCc2ccc(N(CC)CC)c(F)c2)nnn1-c1cccc(Cl)c1 1144978989 YLWQSVXIQOCFMW-UHFFFAOYSA-N 429.927 4.398 10 10 IICE Cc1cc(CC(=O)NC[C@H](O)COc2ccc(F)c(F)c2)c(C)n1-c1ccc(Cl)cc1 1149909540 WKYJVTSUSKWAEL-IBGZPJMESA-N 448.897 4.124 10 10 IICE Cc1cc(C(=O)NCc2nc3c([nH]2)CCCC3)c(C)n1-c1cccc(Br)c1 1156891631 MINFPJSRBVPYJQ-UHFFFAOYSA-N 427.346 4.389 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cc(C(=O)OCc4ccccc4)[nH]n3)c2C)cc1 1158338788 JBDPTQNMBBJHTA-UHFFFAOYSA-N 444.491 4.435 10 10 IICE COc1ccc(O)c([C@@H](C)NCC(=O)Nc2nc(C)c(Cc3ccc(C)cc3)s2)c1 1168713006 SGZQLBPGIHZUJN-OAHLLOKOSA-N 425.554 4.354 10 10 IICE COC(=O)[C@@](C)(Cc1ccc(Cl)cc1)NCc1ccc(N2CCC(OC)CC2)cc1 1175015970 MEHWOHPWATVEIN-XMMPIXPASA-N 430.976 4.219 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCN3CCc4ccccc43)cc2Cl)C1 1235832406 FHMNZKFAEFKYNY-GOSISDBHSA-N 426.992 4.438 10 10 IICE CC(C)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C1(CO)CCCC1 1300067336 UUTUFMKEMHEKQF-RUZDIDTESA-N 425.617 4.101 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)NC(C)C)C1 1306361714 LEMXMABNCPCGAS-HXUWFJFHSA-N 434.588 4.114 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N2CCN(C(C)C)CC2)cc1 1313677758 XQAXRSROZBUKSR-UHFFFAOYSA-N 436.604 4.271 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1c(C)noc1C 1314464198 AIERNBVNJQCPTG-UHFFFAOYSA-N 448.571 4.478 10 10 IICE Cc1cncc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1Cl 1320550593 PEXGAOWTKZKVSS-CYBMUJFWSA-N 448.862 4.003 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(OC(F)(F)F)c3)cc2F)C[C@@H](C)O1 1354657139 JWMOPBONJNEPLD-OKILXGFUSA-N 426.410 4.268 10 10 IICE CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1359816813 MZYNXPKUFVLZQW-VLIAUNLRSA-N 434.005 4.106 10 10 IICE Cc1cc(C)cc(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1360543669 LXSLANTUYTWIRL-XSFVSMFZSA-N 442.581 4.393 10 10 IICE Cc1cccc2c1CCN(C(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)C2 1435087256 INKBZDCXPNIKEN-DEDYPNTBSA-N 440.565 4.310 10 10 IICE COCCOC(=O)Nc1cccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1442163564 QRSUOVMEQCGTHS-UHFFFAOYSA-N 435.480 4.354 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)Nc1nc(CN2CCC(C)CC2)cs1 1459780896 WVAQJXUAZVAATA-UHFFFAOYSA-N 428.602 4.165 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)c1 1465328205 CCLRGUDITUXAEI-NRFANRHFSA-N 430.596 4.343 10 10 IICE COc1ccc(-c2nc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)n[nH]2)cc1OC 1465358540 CZDWQZSUOPTYQL-UHFFFAOYSA-N 431.496 4.078 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@H](Cc1cccc(OC)c1)NC(=O)OC(C)(C)C 1465845785 HRWUXBNHDVOUIU-NRFANRHFSA-N 442.556 4.275 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)c3c(F)ccc(O)c3O)cc2C(F)(F)F)C[C@@H](C)O1 1472501778 HDIHABWQSXYHBA-PHIMTYICSA-N 428.382 4.122 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3c4ccccc4C(=O)N3C)cc2Cl)C1 1478528102 LVIBEWPYHBTKMJ-KSFYIVLOSA-N 440.975 4.202 10 10 IICE CCCC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@]2(OCC)CCOC2)CCC1 1500202396 NIUJCLGMRWLJSH-DEOSSOPVSA-N 428.577 4.243 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1 1503135223 JHLBHFHSZSZTPP-FQEVSTJZSA-N 434.588 4.016 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CC[C@@H](C)[C@@H]2C)cc1 1515520954 BDPWPSLTUIUUFB-MOPGFXCFSA-N 447.587 4.055 10 10 IICE C[C@@H]1CN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CCCSc2nccs2)C[C@@H]1F 1520672661 OWIFIGNEYACOQR-CJNGLKHVSA-N 448.549 4.286 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)N(C)C)cc1 1537478212 XVVDFCOUBIFKKM-NRFANRHFSA-N 446.382 4.278 10 10 IICE O=C(Nc1cccc(S(=O)(=O)N2CCCCCC2)c1)c1cc2cc(O)c(O)cc2s1 1540278329 MNRFUUHWSMXNPF-UHFFFAOYSA-N 446.550 4.130 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(F)CCN(C(=O)OC(C)(C)C)CC2)cc1F 1543251589 UFHRYYCCKHCGLR-UHFFFAOYSA-N 425.520 4.027 10 10 IICE CC[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)[C@H](O)c1c(F)cccc1F 1545596735 YFSXLPNWMXPIAV-CPJSRVTESA-N 442.506 4.435 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1586832272 LMODEWRBAYGSTM-HXUWFJFHSA-N 447.482 4.022 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)NCC2CC2)c(C)n1-c1cccc(C(C)C)c1 1587593326 OTOQPEWJIIRLDL-JOCHJYFZSA-N 425.598 4.259 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CCCCSC)CC2)cc1F 1619302509 RYGIWYWUUNBYMF-UHFFFAOYSA-N 449.640 4.484 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccccc1SCC(=O)N1CCCC1 1623549991 PKYWBWJEVLVSTC-UHFFFAOYSA-N 437.609 4.274 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCCC[C@H]3COC(=O)N3CCCC3)c2C)cc1 1623655187 CBSHRISUYGKUAK-NRFANRHFSA-N 439.556 4.330 10 10 IICE COc1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)ccc1NC(=O)c1cccnc1 1625463322 YBAKCBAYPMBCQN-UHFFFAOYSA-N 435.461 4.221 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@](O)(c3ccccc3)C(F)(F)F)c2C)cc1 1628763064 CLHVOZVVPVJGEF-JOCHJYFZSA-N 432.442 4.283 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1 1630181034 RNCWKIUPYBCFHS-IBVKSMDESA-N 437.584 4.157 10 10 IICE COC(=O)[C@@H]1C[C@@H](C)CCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1634661649 UJMANYPKUNFXRK-DJJJIMSYSA-N 433.346 4.270 10 10 IICE CC(C)n1cc(C(C)(C)NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nn1 1634720186 QCFGDAICEPEQOF-MRXNPFEDSA-N 433.000 4.483 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Oc4ccc(F)cc4F)CC3)C2)cc1 1636354454 XWKUHWFLRXNKDA-KRWDZBQOSA-N 445.510 4.053 10 10 IICE COc1ccc(N2CCN(Cc3cccc(C(=O)Nc4ccccc4)c3)CC2)c(OC)c1 1648084004 BHWUAHULWADTSS-UHFFFAOYSA-N 431.536 4.278 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCC(=O)N1CCOC(C)(C)C1 1656130796 FMMNXNJGGQVMGN-UHFFFAOYSA-N 438.391 4.062 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)C[C@H]2CCCCO2)cc1 1695626392 UICRMJZBNUPYRV-FYYLOGMGSA-N 441.620 4.072 10 10 IICE COC1(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)CCC(C)CC1 1697235133 LULJEYKVNJFSQA-UHFFFAOYSA-N 435.572 4.201 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1708445083 DGTYYQKZJGPADD-FHWLQOOXSA-N 429.584 4.298 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(C)CC1 1708705807 DTDWFQBKEDUHDL-UHFFFAOYSA-N 438.620 4.233 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)CC[C@@H]1C 1728258764 XTMUAKKMWRYVAU-OALUTQOASA-N 448.615 4.456 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743493159 GLRRGLNJTDMEKB-UQBPGWFLSA-N 436.604 4.307 10 10 IICE COCC(C)(C)CCCn1c(C2CC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1749267157 SSQUJUHSFDZNDH-UHFFFAOYSA-N 445.583 4.083 10 10 IICE CCc1nnc(N2CCN(CC3CCCCC3)CC2)n1CCCSc1nccs1 1763132504 VQAVWGVRUOSHPR-UHFFFAOYSA-N 434.679 4.182 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1766611294 AQWLDAOLCDZHMU-LJQANCHMSA-N 436.604 4.182 10 10 IICE COc1cccc(-c2nnc(N3CCSCC3)n2CCCSc2nccs2)c1 1770347297 LMOWQWYRWRASHK-UHFFFAOYSA-N 433.628 4.146 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1771433581 LYWBKNDUVPDSBA-RTBURBONSA-N 447.624 4.147 10 10 IICE CN1CCc2cc([C@H](N)C[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536536 LLTAWPQMMLZRFE-FGZHOGPDSA-N 425.573 4.179 10 10 IICE CCc1nn([C@H](c2ccc(C)cc2O)C(C)(C)C)c(I)c1C(=O)O 2079123603 BUDZKFWVYADTGR-OAHLLOKOSA-N 442.297 4.398 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@H](CN[C@H]2CCc3cccc(O)c32)C1 2084722317 OUAOOGCWCULYKX-YADHBBJMSA-N 437.584 4.091 10 10 IICE Oc1c(Br)cccc1CN[C@@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156286472 ZIGRCWMSOSLXDM-IBGZPJMESA-N 431.374 4.068 10 10 IICE COc1ccc(Br)c(CNC2CC3(CCN(C(=O)OC(C)(C)C)C3)C2)c1O 2236052896 MXJYYYOGDBNYTR-UHFFFAOYSA-N 441.366 4.043 10 10 IICE CCn1cc(C=C2C(=O)N(CN3CCN(C)CC3)c3cc(Cl)ccc32)c2ccccc21 2297471693 RGAXKZNIFZHADQ-UHFFFAOYSA-N 434.971 4.407 10 10 IICE CSc1ncc(CNC2(C(=O)O)CCC(C)(NC(=O)OCc3ccccc3)CC2)s1 2371290152 SAJXNEJCGVSHAO-UHFFFAOYSA-N 449.598 4.037 10 10 IICE COc1cccc(/C=C2\SC(Nc3ccc(C)c(Cl)c3)=NC2=O)c1OCC(=O)O 4018921 RUNATZXXFPYQME-PXNMLYILSA-N 432.885 4.203 10 10 IICE O=S(=O)(Nc1nc2c(s1)CCc1ccccc1-2)c1cnn(-c2ccccc2F)c1 743045818 AHTCNFQLAWGTAP-UHFFFAOYSA-N 426.498 4.034 10 10 IICE CN(C)c1ccc(CNC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)cc1F 746752450 YNRMIBXWZFMMRR-UHFFFAOYSA-N 435.525 4.496 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H]4CC[C@H](C3)O4)n2C[C@@H]2CCCCO2)c(C)n1-c1ccccc1 752835464 JEVONUHCGREBPI-RJGXRXQPSA-N 447.583 4.289 10 10 IICE CCN(CC)c1ccc(CN(C)Cc2coc(-c3ccc(S(C)(=O)=O)cc3)n2)cc1 761639668 BVTOWEDOFZNKPH-UHFFFAOYSA-N 427.570 4.223 10 10 IICE Fc1cc(CN[C@H]2CC[C@H](c3ccccc3)C2)ccc1N1CCN(c2ncccn2)CC1 780511002 MKPPQALUCGPGDI-GOTSBHOMSA-N 431.559 4.368 10 10 IICE COCn1nc(C)c(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c1C 789728796 XZGGGUDRPBRUMK-UHFFFAOYSA-N 428.539 4.181 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)c(C)cc1F 794016894 NLQWYSPAGUVHBS-UHFFFAOYSA-N 438.477 4.293 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1nc([C@@H](C)OC)no1 801957085 CVSFOXFWINZSJW-QGZVFWFLSA-N 435.532 4.099 10 10 IICE CCCc1c(NC(=O)NCc2cc(Br)ccc2O)cnn1-c1cc(C)ccn1 806420267 HVWIUJXHJWVAKZ-UHFFFAOYSA-N 444.333 4.318 10 10 IICE C[C@H](NC(=O)c1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccc(N2CCOCC2)cc1 920881360 NGNPKDHTSGPWEP-SFHVURJKSA-N 439.556 4.039 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CCC(=O)N2C)sc(C)c1-c1ccc(Cl)cc1Cl 1124957285 ZKXGLHXKRXYRMC-CYBMUJFWSA-N 441.336 4.376 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(OC4CCCCC4)c(Cl)c3)CC2)cc1 1127275745 AIVFFXOYAQXKML-UHFFFAOYSA-N 429.948 4.418 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(C(C)(C)C)c3-c3ccccc3)CC2)c(OC)c1 1132032313 RSROUHXYIRQHIQ-UHFFFAOYSA-N 448.567 4.285 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Br)ccc1O 1137349322 OVLAVUSVUVQJLZ-UHFFFAOYSA-N 429.108 4.285 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)NCc1cccc(Br)c1O)O2 1156792482 NZRUIVYSOGNZTF-NRFANRHFSA-N 434.330 4.186 10 10 IICE COc1ccc(C[C@@H](C)CNC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1OC 1225337530 HSRBZCAFQKFFLN-IEBWSBKVSA-N 427.589 4.187 10 10 IICE Cc1cc(CC(=O)Nc2ccccc2N(C)S(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1265939227 BMDXYTLKNIKOGW-UHFFFAOYSA-N 445.972 4.325 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)C[C@@H](C)S1 1291250606 VXKGSHHRAWYMGX-OAGGEKHMSA-N 439.676 4.141 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(Oc2ccc(Cl)cn2)c1 1291755650 IVIOWOYFPPQNJL-UHFFFAOYSA-N 441.890 4.433 10 10 IICE CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1292583063 WLXDVCHREKMLMQ-XMMPIXPASA-N 445.051 4.165 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC=C(c4cn(C(C)C)nn4)CC3)ccc21 1298439062 VKZTVNDEVKFNCI-UHFFFAOYSA-N 435.572 4.397 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)NCc3cc(Cl)cc(Cl)c3O)CCC[C@H]12 1298841270 MPSJYJPOIWPCNV-MGPUTAFESA-N 429.344 4.495 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CCSCC(C)C)CC2)cc1F 1300246762 ILQUGOIFXSXYJG-UHFFFAOYSA-N 447.624 4.409 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 1354768307 VKQBWCSTCRFYEX-UIAACRFSSA-N 431.439 4.085 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1[C@@H]2CCCC[C@H]2CCN1C(=O)OC(C)(C)C 1435285136 BKXCCMIFWCPZFN-KPLVRAHFSA-N 443.588 4.294 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H](O)c2cccc(Br)c2)cc1 1441155326 WIVVYXYFOGPXGF-NRFANRHFSA-N 443.341 4.371 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CSC[C@H]3C(=O)Nc3ncc(C)s3)c2C)c1 1443281800 PATBXYOHCQSFBD-IBGZPJMESA-N 440.594 4.321 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)cc1F 1443767743 GWUGSUYKWQYTRG-JWGURIENSA-N 435.499 4.352 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1C[C@]1(F)c1ccccc1 1452000434 YJONZUSIVABWIC-UJCNWZBESA-N 446.594 4.483 10 10 IICE O=C(CN(CCC(F)(F)F)CC1CC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1459617393 XBZYZWXEVHXJCO-UHFFFAOYSA-N 430.426 4.065 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2nccc3ccsc23)NC(=O)OC(C)(C)C)cc1 1465325423 QFRPMKHYFIPXRT-GOSISDBHSA-N 440.569 4.358 10 10 IICE CC[C@@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@H](O)c1c(F)cccc1F 1465917565 DLEQFGKNLMVNLK-OFNKIYASSA-N 430.495 4.425 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)[C@@H]1SC 1478528348 NNFVNCYSZXXUFW-GVXRKXQCSA-N 426.026 4.285 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)N(Cc1ccccc1O)C1CCCCC1 1479366724 YLKRKPQJNIKWGN-YLJYHZDGSA-N 431.577 4.492 10 10 IICE CCN1C[C@@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1502250041 SXKWYGCOLKUCSD-DLBZAZTESA-N 440.567 4.019 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1C[C@H]1CCN(CC(F)(F)F)C1 1503488505 VEHORXYIIWTRDF-INIZCTEOSA-N 439.526 4.093 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@H](C(F)F)C2)cc1F 1517000772 XSODSAUEDVNUOJ-INIZCTEOSA-N 430.478 4.075 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CCCC4)n3C[C@@H](C)SC)CC2)cc1 1518309855 RWKLMZHSKPFCBK-LJQANCHMSA-N 443.661 4.488 10 10 IICE CCCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cccnc1 1524485121 BPOBFIXXALRAEK-AQTBWJFISA-N 429.542 4.255 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@]1(C)CC1(Br)Br 1525113579 KPOFSJBSMYMPME-INIZCTEOSA-N 430.184 4.141 10 10 IICE COc1ccc([C@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCCC2)cc1 1538454417 OXNCITHGQXWRJH-SANMLTNESA-N 445.563 4.482 10 10 IICE O=C(CN(Cc1ccco1)C(=O)c1cc(O)cs1)Nc1ccccc1Br 1540708989 XJTMKXOEOKDJEB-UHFFFAOYSA-N 435.299 4.090 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N(Cc1ccccn1)Cc1ccc(Br)cc1F 1542955912 CDZVQVOMLBIHGR-UHFFFAOYSA-N 445.288 4.166 10 10 IICE COc1ccc(Cl)cc1C(F)(F)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1546033674 CZZBAECGNYTBQT-MRXNPFEDSA-N 425.859 4.354 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)CC(C)C 1558487861 ZRZPPNZBRJBYIY-VWLOTQADSA-N 426.557 4.181 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(O)c(F)c1F 1569010622 HMOHAIYDKMMKGZ-NTEUORMPSA-N 438.452 4.040 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C)n1-c1cccc(C(C)C)c1 1595482217 CWNBXKMWFHLSPZ-UHFFFAOYSA-N 447.539 4.483 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@@H]2[C@H]2CCCCC2=O)c(C)n1-c1ccc(Cl)cc1 1597142201 QSYDJILKTAUECO-FGZHOGPDSA-N 428.960 4.277 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2cc(Br)ccc2F)cc1 1598292680 TWSOKTIMBKEXBK-HXUWFJFHSA-N 449.364 4.405 10 10 IICE O=C(Nc1cc(F)c(I)c(F)c1)c1cc2cc(O)c(O)cc2s1 1611051470 KBVBRGOKHDPGLS-UHFFFAOYSA-N 447.200 4.448 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1616668158 DMGUMFCDJZZYNU-DENIHFKCSA-N 443.661 4.431 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1624535528 GTOVPEZRLZRWTB-GOEBONIOSA-N 433.394 4.102 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1 1627263820 AWWBLPFRDBORIV-LJQANCHMSA-N 437.500 4.113 10 10 IICE COc1ccc([C@@H](CO)CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1629561888 MZLSCXOVSQNTJA-HXUWFJFHSA-N 426.944 4.191 10 10 IICE Cc1cc(C(=O)N2CCC(C3(C)OCCO3)CC2)c(C)n1-c1ccccc1Br 1629761082 WNXRTWPCJWJLIV-UHFFFAOYSA-N 447.373 4.472 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccccc2F)c(C)n1-c1ccc(Br)cc1 1630956808 FYEZBDWOFFLDNI-FQEVSTJZSA-N 431.305 4.459 10 10 IICE COCCOc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(Cl)c1 1631608359 UVALGADHXCQHGV-OAQYLSRUSA-N 446.975 4.253 10 10 IICE Nc1c(Br)cc(Br)cc1C(=O)NCc1cc(Cl)ccc1O 1632227596 DXPJUGLGTZFMLT-UHFFFAOYSA-N 434.515 4.083 10 10 IICE Cc1ccc(C2(CNC(=O)NCc3ccc(N4CCN(C)CC4)cc3)CCCC2)c(C)c1 1635707560 ACYQUXRSNPEZPG-UHFFFAOYSA-N 434.628 4.366 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3nc(Br)sc3C3CC3)CC2)cc1 1636702114 CQMYNLMZOQPUFX-UHFFFAOYSA-N 436.375 4.144 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C3CC3)C3CN(C(=O)OC(C)(C)C)C3)c2C)cc1 1639338814 IVDYMAXGXDUHLY-UHFFFAOYSA-N 439.556 4.327 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cccc(Nc2nccc(C(F)(F)F)n2)c1 1643284979 OMUMSHMWOSBBHQ-UHFFFAOYSA-N 439.397 4.423 10 10 IICE Cc1cc(C(=O)CN2C(=O)c3ccccc3C2=O)c(C)n1-c1cccc(Br)c1 1652431216 VOTMEQVTVXJHOE-UHFFFAOYSA-N 437.293 4.336 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc3cc(Br)ccc3o2)cc1 1675672212 CPWQPKMWCDFRNC-UHFFFAOYSA-N 446.345 4.482 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C)[C@@H](Cc3ccccc3)C2)c(C)n1-c1ccccc1 1683148888 FXUMHXPXLUNLML-SANMLTNESA-N 430.596 4.205 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694096438 SSANMZOKZRWGIP-WIYYLYMNSA-N 429.584 4.440 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)C1 1697209050 KEAMVIOPSMPPNM-DEOSSOPVSA-N 439.629 4.358 10 10 IICE CC(C)=CCCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1706207534 HVFBEQPMNIKIQC-UHFFFAOYSA-N 434.588 4.113 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727907569 LJLHJYUATAEUGJ-VWLOTQADSA-N 434.588 4.128 10 10 IICE COC1(CCn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CCC1 1729935494 BTWDOAXDRMHZIT-UHFFFAOYSA-N 427.936 4.295 10 10 IICE CCc1nnc(N2CCCN(Cc3ccccc3)CC2)n1CCCSc1nccs1 1744680751 XSAIJCSOPAYXGB-UHFFFAOYSA-N 442.658 4.192 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1745007103 VUJRVZLDMUIXLR-DENIHFKCSA-N 434.588 4.238 10 10 IICE CCN1C[C@@H](C)N(c2nnc(C3CCCC3)n2CCCSc2nccs2)C[C@H]1C 1746379897 OYBLQRWBGFAUIL-IAGOWNOFSA-N 434.679 4.494 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC=C(Br)C3)nnc2C(C)(C)C)cc1F 1747578633 YBFXFQCHAVJELN-UHFFFAOYSA-N 436.373 4.318 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@H]1CCCCC1(F)F 1747754615 UEVGDWKNVYEKAG-LJQANCHMSA-N 427.499 4.431 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC(C)(C)c3ccccn3)CC2)cc1 1748848167 VWGHVDPQNCJBAQ-UHFFFAOYSA-N 448.615 4.500 10 10 IICE CCN(CCn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)C(=O)OC(C)(C)C 1765271245 NRRAECOCKIWGJP-UHFFFAOYSA-N 431.581 4.175 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@@](=O)CC)C1CC1 1766433207 QAAGGADTDIEBAL-PMERELPUSA-N 425.602 4.110 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)[C@@H]2CCSC2)cc1F 1766909883 VXTCNGFVIFNZBS-MRXNPFEDSA-N 446.983 4.189 10 10 IICE CN(Cc1ccccc1)C(=O)c1c[nH]nc1[C@H]1CCCCN1Cc1ccc(N(C)C)cc1 1848357329 DPNXWVBFVCAWSP-XMMPIXPASA-N 431.584 4.475 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCC3)C(=O)N(Cc3ccncc3)C2=O)cc1 1873165467 KHZZIBWDMIRGPM-UHFFFAOYSA-N 440.547 4.301 10 10 IICE COCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N([C@@H]2CCCC[C@H]2C)C1=O 1873165715 QWCADKMMVRKGDJ-WZONZLPQSA-N 449.595 4.379 10 10 IICE C[C@]1(NCc2cc(Br)ccc2O)CCCN(C(=O)OCc2ccccc2)C1 1940888008 PSKYVYRUSCQBHP-NRFANRHFSA-N 433.346 4.436 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC3(CC3)C2)c1O 2236054328 HFHSHZXDSHURAG-ZDUSSCGKSA-N 441.366 4.043 10 10 IICE COc1ccc(Br)c(CN[C@@H]2[C@@H](C)CN(C(=O)OC(C)(C)C)C[C@H]2C)c1O 2236055953 SVFCXJGXMLSQSO-LAQFHYBYSA-N 443.382 4.144 10 10 IICE CC[C@H](C)NCc1ccc(N(CC(=O)N(C)C)Cc2ccccc2)cc1Br 2240018322 CDBHZCXWKNTITG-KRWDZBQOSA-N 432.406 4.432 10 10 IICE O=C1NC(=S)SC1=Cc1ccccc1OS(=O)(=O)c1ccc2ccccc2c1 2295172653 RQZQPWFKEYHUGK-UHFFFAOYSA-N 427.528 4.096 10 10 IICE CCCN1C(=O)C(=Cc2c(Oc3ccc(C)cc3)nc3ccccn3c2=O)SC1=S 2296731225 GEYPIJDZUNJKKO-UHFFFAOYSA-N 437.546 4.406 10 10 IICE CCn1c(C=Cc2ccc(N(C)C)cc2)nc2ccc(I)cc2c1=O 2296753929 BKAMOPWZDFUJRD-UHFFFAOYSA-N 445.304 4.257 10 10 IICE Cc1ccc(COc2ccc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)cc2)cc1 2297352818 ZKBSVCMPCKTYRP-UHFFFAOYSA-N 445.548 4.246 10 10 IICE CC(C)c1ccc(-c2ccc(C=C3SC(=S)N([C@H](CC(=O)O)C(=O)O)C3=O)o2)cc1 2297480331 VPIXSUOGJBWOPH-OAHLLOKOSA-N 445.518 4.199 10 10 IICE O=C1C(=CNCCc2ccc(O)cc2)C(c2ccccc2)=NN1c1nc2ccccc2s1 2297616226 FNLKKYVLBNKSHE-UHFFFAOYSA-N 440.528 4.469 10 10 IICE Cc1ccc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)C2CCCC2)c(O)c1Br 2380725816 MVGWARHESXOLKG-MRXNPFEDSA-N 441.366 4.163 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2380740647 YEYJULYZNIPIBQ-CQSZACIVSA-N 441.366 4.115 10 10 IICE CCCCOc1ccc(/C=C2\SC(=S)N(CCCC(=O)OCC)C2=O)cc1OC 40888431 URVXNGAFOBFFAU-JXAWBTAJSA-N 437.583 4.419 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCC(=O)Nc3ccccc3C)C2=O)ccc1O 210690747 BAHJMWBMJKRDQR-CPNJWEJPSA-N 442.562 4.329 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(OC)cc3OC)[C@@H]2c2ccc(O)c(O)c2)cc1 526328308 NHWDFNLKGCMPGP-HSZRJFAPSA-N 449.459 4.181 10 10 IICE COc1ccc(OC)c([C@@H](C)NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743565225 UXDXGUQZDDXFBY-CVEARBPZSA-N 449.498 4.334 10 10 IICE Cc1cc(CCNC(=O)c2ccc(CSc3nc[nH]n3)cc2)c(C)n1-c1ccccc1 746427433 WSLGKDUHGISUAG-UHFFFAOYSA-N 431.565 4.477 10 10 IICE CO[C@H](C)c1noc(CN(C)Cc2c(O)ccc3c(=O)c(-c4ccccc4)c(C)oc23)n1 748095140 UBVBFEURZHEEGN-OAHLLOKOSA-N 435.480 4.196 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC[C@@H](C)NC(=O)OC(C)(C)C 765423706 GXFWUEGLNUMTAF-CYBMUJFWSA-N 429.355 4.197 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F 782080261 CMRKOZQKDCTCMN-UHFFFAOYSA-N 447.457 4.434 10 10 IICE C[C@@H]1COCC[C@@H]1c1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 799672410 YIIAVJBRGKYUPE-ZVTCHVPKSA-N 435.596 4.105 10 10 IICE CCO[C@@H]1C[C@@]2(NC(=O)N(Cc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)C2=O)C1(C)C 804188245 KYDYUXSWMCHPFH-ZOUOIUENSA-N 433.980 4.202 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCn3c(cc4ccccc43)C2)c([N+](=O)[O-])c1Br 812486947 CYEDIJCBPAGIFA-UHFFFAOYSA-N 447.245 4.249 10 10 IICE CS(=O)(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c1 906372928 NCNKNMCWNJGTIZ-UHFFFAOYSA-N 444.559 4.168 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(C(=O)N4CCOCC4)cc3)c2C)c1 1136514779 SNCSTMPWGYJIMX-UHFFFAOYSA-N 445.563 4.113 10 10 IICE Cc1ccc(C(=O)N2CC[C@H](N(C)C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1137054012 NMVTYUPXNBEDTE-NRFANRHFSA-N 439.556 4.296 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1=Cc2ccccc2O[C@H]1C(F)F 1137440441 VRNVOWYOKSHXKA-LAUBAEHRSA-N 448.897 4.236 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CCC2)[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1149525910 ZTTAZSIGHDFMFA-ICSRJNTNSA-N 432.362 4.329 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3cccc4c3OCCO4)cc2Cl)C1 1227210328 ZNLAVMOKGRCORX-INIZCTEOSA-N 429.948 4.347 10 10 IICE CC(C)(C)O[C@H]1C[C@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1277661825 YQWRCCHNGYKKII-PGRIYTNPSA-N 438.640 4.192 10 10 IICE COc1ccccc1[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1noc(C)n1 1293634981 PBGHDINGZQUPKA-HSZRJFAPSA-N 444.491 4.126 10 10 IICE CCc1cnc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)s1 1294171482 JVYUFQUXTDEGER-UHFFFAOYSA-N 433.375 4.243 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 1297296959 GUVZPDJMRMVCHF-QZTJIDSGSA-N 432.524 4.168 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1 1301913763 LLXIKZUHQILNEE-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CC(C)(C)OC(=O)[C@H]1CC(C(=O)NCc2c(O)ccc3ccccc23)=NN1c1ccccc1 1304090145 YQIHFGZCTOHVFK-JOCHJYFZSA-N 445.519 4.138 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)N(C)C)cc1 1312510617 CVOZVXZTJBCEJN-OAQYLSRUSA-N 448.533 4.405 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1 1316428958 VYGCVXJJMYUYBI-NRFANRHFSA-N 436.629 4.485 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C2CC2)cc1 1353228611 KFULMPQCDVUUDU-INIZCTEOSA-N 429.923 4.089 10 10 IICE Cc1ccc(Br)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1361062647 BIXJVCWAKUATOS-CYBMUJFWSA-N 440.288 4.153 10 10 IICE C[C@H](NC(=O)Cc1cc(Br)ccc1Cl)c1ccc(N2CCOCC2)cc1 1434913237 YOPMXRHODANVMR-AWEZNQCLSA-N 437.765 4.359 10 10 IICE CC(C)N(CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)OC(C)(C)C 1435335340 YTTKXKKWWVZUHD-INIZCTEOSA-N 441.519 4.019 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(OC(F)F)c(Br)c3)C2)cc1 1437575655 IDWBEIJEYVFIRP-ZDUSSCGKSA-N 441.272 4.068 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)[C@H]1CC1(Cl)Cl 1439869994 IBDFLKZTPJAWMA-SNVBAGLBSA-N 426.101 4.291 10 10 IICE Cc1cc(C(=O)NCCN2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(Cl)cc1 1441103801 RECKUPBDPWKBHP-UHFFFAOYSA-N 436.987 4.300 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C[C@H](O)c2ccco2)c(C)n1-c1ccc(Br)cn1 1445498616 VMEJTOPWVIZWCT-SJCJKPOMSA-N 432.318 4.087 10 10 IICE O=C(/C=C/c1nc2ccccc2s1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880092 FNKKMPLRXDZTFQ-FVNWOWOISA-N 427.957 4.449 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)C)C(=O)[C@H]2C)c(C)n1-c1cccc(Br)c1 1448075710 KCDYAGCICDQHNZ-QGZVFWFLSA-N 446.389 4.186 10 10 IICE CCOc1cccc(N2CCC(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CC2)n1 1457146808 ZLLWNAIJYLKEGM-UHFFFAOYSA-N 448.567 4.295 10 10 IICE CCc1nc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)nn1-c1ccccc1Cl 1460980222 FEFLGIJMZZJSPI-INIZCTEOSA-N 425.964 4.219 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1 1460984885 SNXMMVMTFBYPLN-INIZCTEOSA-N 437.565 4.317 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)Cc2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1467690367 PNELETFBSSFDQK-LJQANCHMSA-N 445.332 4.329 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCCc4c3ccc(=O)n4C)cc2Cl)C1 1469959554 KSNTXDDKBWDHJI-JXFKEZNVSA-N 442.991 4.152 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C4CCCCC4)CC3)cc2F)C[C@H](C)O1 1473617139 FOASRERZHWGIBS-PMACEKPBSA-N 445.623 4.348 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1504820056 PNIGAXISAMGMBL-GOSISDBHSA-N 425.602 4.331 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@](C)(O)[C@H](C)CC 1513018126 LMITYLAKWNBWDO-HOOSLVGPSA-N 447.599 4.063 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](COC)OC)C1 1514090978 RSLVUZLHYCZBCV-RBBKRZOGSA-N 437.588 4.250 10 10 IICE COc1cc(N2CCN(C(=O)c3ccc(C)c(Cl)c3Cl)CC2)cc(OC)c1OC 1521501300 JYSKBTNROZVRFK-UHFFFAOYSA-N 439.339 4.290 10 10 IICE Cc1cc(C)c(Br)c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1527864171 LDCWKDKGADNKKL-UHFFFAOYSA-N 439.300 4.111 10 10 IICE COC(=O)[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(F)c(C)c1 1528173631 KWASTXTUNVIQBC-XMMPIXPASA-N 438.499 4.007 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@]12CCCC[C@@H]1N(C(=O)OC(C)(C)C)CC2 1532657319 YIZZWWMSJYAWHC-GBXCKJPGSA-N 429.561 4.048 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(=O)c2ccc(Cl)cc2o1 1533328162 HHIWBSRAQMJSCE-AWEZNQCLSA-N 448.853 4.447 10 10 IICE Cc1cc(CC(=O)N(C)CCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccc(Cl)cc1 1537574075 CPUMADNXGZHMSX-UHFFFAOYSA-N 449.938 4.045 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2ccsc2C1 1538958796 ASOGYNZXRKEMFW-WJDWOHSUSA-N 432.567 4.063 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)c1 1545370690 RXFLPMKEEANOFZ-OAQYLSRUSA-N 443.547 4.189 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CC(C)(C)SC)CC2)cc1 1554958847 HPCFCJGDNNAYEW-UHFFFAOYSA-N 431.650 4.344 10 10 IICE Cc1ccccc1C[C@@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1564895856 XGHPFZGXQPTOMK-FQEVSTJZSA-N 429.511 4.027 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1csc(NC(=O)OC(C)(C)C)n1 1564945806 FZKCPOCHLSJCMX-OAHLLOKOSA-N 447.605 4.295 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cc(Br)ccc3C)C2)cc1 1564962822 OYQIRNGLNGWSBQ-MRXNPFEDSA-N 432.362 4.092 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCCc3ccccc3OCc3ccccc3)C2)cc1 1565056408 UIOAQDFRFIEPCR-HSZRJFAPSA-N 445.563 4.395 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3cccc(-c4ccccc4)c3)CC2)c(OC)c1 1565130487 AJUSGFWYPXAWIL-UHFFFAOYSA-N 445.563 4.445 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3csc(C4CCCCC4)c3)cc2)CC1 1584512144 YNMAYKJSBOXFLE-UHFFFAOYSA-N 425.598 4.428 10 10 IICE Cc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1NC(=O)c1ccccc1 1586054332 FKUDJQCDXWGKGU-VWLOTQADSA-N 444.579 4.346 10 10 IICE CSc1cccc(N2C[C@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2=O)c1 1587886424 OQOCWMCWQLZYAW-HXUWFJFHSA-N 433.577 4.485 10 10 IICE CCOc1ccc(C(=O)c2ccccc2C(=O)NCc2c(O)cccc2O)cc1OCC 1597568569 GYUZTCCMDKTJDF-UHFFFAOYSA-N 435.476 4.056 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCCO[C@H](C)C1 1611963028 FKPYURHUYXCVKA-QGZVFWFLSA-N 440.979 4.031 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)CCc2cccs2)cc1F 1617667167 SNZHYBRWDJRHPG-UHFFFAOYSA-N 436.560 4.334 10 10 IICE O=C(CN1CCC2(CCC2)S(=O)(=O)CC1)Nc1ccc(N=Nc2ccccc2)cc1 1618582426 DNVRTHJRTKUUDD-UHFFFAOYSA-N 426.542 4.084 10 10 IICE Cc1cc(CNC(=O)CCCOc2ccc3c(c2)CCC(=O)N3)c(C)n1-c1ccccc1 1624075448 OQWSNPQOZIRPFL-UHFFFAOYSA-N 431.536 4.454 10 10 IICE C[C@@H](NC(=O)[C@@H]1C[C@H](C(F)(F)F)CN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1625544171 QPMZZIMRLMHGRS-KMFMINBZSA-N 429.483 4.118 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H](C(C)C)n3nnc(-c4ccccc4)n3)cc2)CC1 1627468655 ZIRFEQJFIUYPLW-QHCPKHFHSA-N 432.572 4.090 10 10 IICE CN(C)Cc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1628453468 HGXWABMJACSZHR-CPNJWEJPSA-N 443.569 4.117 10 10 IICE Cc1cc(C(=O)NC(C)(C)CCN2CCOCC2)c(C)n1-c1ccc(Br)cc1 1630025628 ILHFBQPSOONGKM-UHFFFAOYSA-N 448.405 4.087 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)C2)cc1 1630618668 DFRRQVBIJSFQST-NQIIRXRSSA-N 447.620 4.309 10 10 IICE COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1630884166 JMPKTKIPJASCTP-AREMUKBSSA-N 445.563 4.482 10 10 IICE Cc1cc(C(=O)NCc2nc(C(F)(F)F)no2)c(C)n1-c1cccc(Br)c1 1632648181 XYZGEZULTIHJDP-UHFFFAOYSA-N 443.223 4.188 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1C 1635113814 KJOVSACRBANQGL-UHFFFAOYSA-N 432.586 4.174 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)CC(=O)c2ccc(F)cc2)C1 1635622633 DKDFDVYSEGFIKL-SFHVURJKSA-N 435.543 4.325 10 10 IICE C[C@@H](NC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1)c1ccccc1O 1635793989 QWTHHMAYUGVYGX-GFCCVEGCSA-N 429.270 4.491 10 10 IICE Cc1ccc(-c2nnn(CC(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)n2)cc1 1637244002 QAGHYRNNCMGHOI-LJQANCHMSA-N 427.508 4.144 10 10 IICE Cc1cc(C(=O)N2CCN3CC(F)(F)C[C@H]3C2)c(C)n1-c1ccccc1Br 1640004025 VDKQJSJTIXQAGT-HNNXBMFYSA-N 438.316 4.022 10 10 IICE CC(C)(C)[C@@H](NC(=O)OCc1ccccc1)C(=O)NCc1cccc(Br)c1O 1640084240 OQFWELDEZYPOMR-SFHVURJKSA-N 449.345 4.112 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3ccccc3F)ccc2=O)c(C)n1-c1ccc(Cl)cn1 1640904665 REMKGISOPCHJPR-UHFFFAOYSA-N 436.874 4.388 10 10 IICE COc1ccc2c(O)nn(C(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)c2c1 1641804593 FEBRGTMLOSMFDK-UHFFFAOYSA-N 441.285 4.004 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(OC(F)(F)F)cc1 1642155140 GDJGGDSJDAOQND-UHFFFAOYSA-N 436.474 4.140 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCc3c(cccc3C(N)=O)C2)cc1 1646552962 NGFOPLSPSOSXIC-UHFFFAOYSA-N 427.508 4.465 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 1651222813 PYJHKCNYXVLFKZ-UHFFFAOYSA-N 445.319 4.251 10 10 IICE COC(=O)CN(CC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)Cc1cc(Cl)ccc1O 1652735253 VNNJVKSFMZRMGT-INIZCTEOSA-N 440.968 4.058 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc(S(=O)(=O)C(F)(F)F)cc1 1655255020 DABBROLYXRKDAL-UHFFFAOYSA-N 438.265 4.475 10 10 IICE CC(C)N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cccc(F)c1 1659506856 LDUXJNGSJIIZHB-ROUUACIJSA-N 431.527 4.110 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(=Cc2cccc(F)c2)CC1 1683018258 LDRQXKBWUJFQAH-UHFFFAOYSA-N 445.485 4.330 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@H]3C[C@H](O)c3ccccc3)c2C)c1 1684478902 MEWRCZIRWRVJEC-FTJBHMTQSA-N 447.579 4.437 10 10 IICE CC[C@@H](CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)C(=O)OC(C)(C)C 1687669162 JHKHFBKNIHGDSL-IBGZPJMESA-N 429.561 4.425 10 10 IICE CC[C@@H](C)NC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CC1 1694283209 NZPLYXWGRLIHER-QGZVFWFLSA-N 434.588 4.256 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](CC)C1 1705653802 QDHPACSJZBJVSW-JOCHJYFZSA-N 449.624 4.334 10 10 IICE Cc1nnc(N2CCN(CCC(C)(C)C)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1707915475 QIYMIFUADLHZAT-UHFFFAOYSA-N 438.664 4.429 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1709436908 HHZONVFXMNOVOV-PXDATVDWSA-N 437.588 4.129 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC([C@@H]3CCOC3)CC2)cc1F 1747572193 QLRBBWRTVZUUKB-HXUWFJFHSA-N 443.611 4.373 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC1CCOCC1 1749836180 LPGUXHVBZMGDBF-UHFFFAOYSA-N 437.588 4.252 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)cc1C 1750129305 BYKAJBBQFKOJHY-FAHLNCGFSA-N 441.620 4.050 10 10 IICE CCCN(CCC)c1nnc([C@@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1764345540 GHKYXPQRFHXXQV-QFIPXVFZSA-N 438.620 4.140 10 10 IICE CCCO[C@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1764642248 HNEYHMRARQHFDI-SIKLNZKXSA-N 445.583 4.169 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@H](C)O[C@@H](C4CC4)C3)nnc2C(C)(C)C)cc1 1764936161 CXYNGTGDRGXQQL-PGRDOPGGSA-N 425.621 4.474 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@]3(CCSC3)C2)cc1F 1768496990 VVFKLBDYMZFPAG-QHCPKHFHSA-N 431.625 4.454 10 10 IICE Cc1ccc([C@H](C)n2nc(C3CCC3)c(C(=O)O)c2I)c(O)c1 2079003327 ACZVJVKTMRZITM-JTQLQIEISA-N 426.254 4.077 10 10 IICE O=S(=O)(Nc1cc(Cl)c(O)c(Cl)c1)c1ccc(I)cc1 2145851590 TZOCQAUDBSKNSV-UHFFFAOYSA-N 444.077 4.104 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccccc4)c3C)C2=O)cc1Cl 2296598200 GAXJEQWDBUDMTL-UHFFFAOYSA-N 449.894 4.423 10 10 IICE COc1cc(C=C2SC(=S)N(CNc3ccccc3F)C2=O)cc(OC)c1OC 2296733613 DNPXIKNSEXGWRZ-UHFFFAOYSA-N 434.514 4.122 10 10 IICE CCCOc1cccc(C=C2SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)c1 2321582930 FYEWYHPELAZRLT-UHFFFAOYSA-N 443.502 4.278 10 10 IICE CN1CCN(c2ccc(N3C(=O)C(=Cc4ccc(Cl)cc4)SC3=S)cc2)CC1 2321683411 DRZYELUXDQBJPJ-UHFFFAOYSA-N 429.998 4.498 10 10 IICE Cc1ccc(CN[C@@H]2CN(Cc3ccccc3)C[C@H]2C(F)F)c(O)c1Br 2352680421 QCOVNILGBADWDS-IAGOWNOFSA-N 425.317 4.318 10 10 IICE CC(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)NC(=O)[C@H](C)O4)cs2)cc1 11857568 JQIIJOIMPJBMCX-ZDUSSCGKSA-N 443.550 4.454 10 10 IICE O=C(CNC(=O)c1ccc(F)cc1F)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 11968091 JCHWQRVCVSDVTO-RUZDIDTESA-N 446.453 4.459 10 10 IICE CSc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@H]32)cc1 14551911 MCXYKLOUFZBCQH-MIZPHKNDSA-N 442.606 4.256 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@H]2CCN(C)[C@@H](C)C2)sc(C)c1-c1ccccc1 741790128 CTDRERGNQPOQTH-LPHOPBHVSA-N 443.613 4.253 10 10 IICE O=C(Nc1ccc([S@@](=O)C(F)(F)F)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 750615422 CHNGWEGEKWOZLM-XHDOVSQSSA-N 442.459 4.233 10 10 IICE C[C@@H](NCc1ccc(CN2CCOCC2)cc1)c1cc(Br)cc(Cl)c1O 756365185 ZSUVYEQKEDETLQ-CQSZACIVSA-N 439.781 4.491 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3c(OC)cccc3OC)n2)c1C 775148942 ARLMNPOOKXHTJE-UHFFFAOYSA-N 435.571 4.456 10 10 IICE Cc1ccc(-n2cccn2)cc1NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 789404630 HLXCGKCCZVIGRN-HDICACEKSA-N 437.519 4.255 10 10 IICE CCn1cc([C@@H](O)CN(Cc2ccccc2)Cc2cc(C)cc(Br)c2O)cn1 792188190 NHMNNFVZEBPGQH-NRFANRHFSA-N 444.373 4.415 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)CCO1 802691248 DEWVGWYGDLZUAD-VXKWHMMOSA-N 435.572 4.147 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc3nnc(C(F)F)n3c2)c(C)n1-c1ccc(F)cc1 1116303539 NFRJASWBEZGSCJ-UHFFFAOYSA-N 442.397 4.253 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCCN2C[C@@H](C)C[C@@H](C)C2)C1 1136255380 RXICMRXYJHDLQE-SZPZYZBQSA-N 438.660 4.282 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(Cc3ccccc3)C(=O)C2(C)C)c1 1141486004 YJRJKDZGLBUWIP-UHFFFAOYSA-N 443.547 4.170 10 10 IICE O=C(Cc1c[nH]c2cnc(Cl)cc12)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1148444555 UMPOZDBRLWIJSC-CQSZACIVSA-N 434.874 4.145 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccccc2F)c(C)n1-c1cccc(Br)c1 1149550679 BGOWTTQLVIOCAC-HXUWFJFHSA-N 431.305 4.459 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCCN1Cc1ccc(N2CCOCC2)cc1 1167739303 BTLRPOREBMTPEC-GOTSBHOMSA-N 429.605 4.277 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](CC(C)C)c3ccc(Cl)cc3)CC2)cc1 1168623696 XKJZLRZPNMBPPO-UKILVPOCSA-N 446.035 4.209 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C 1191269867 YUNZSVADUGNTFM-GDBMZVCRSA-N 427.383 4.480 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)NCCc1ccc(OC(F)(F)F)cc1 1191654918 KLIKCSPQPLUKON-UHFFFAOYSA-N 444.400 4.298 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@@H](C(=O)OC(C)(C)C)[C@H](C2CC2)C1 1230200815 MANUQONEAWCYDZ-VOQZNFBZSA-N 429.605 4.001 10 10 IICE COc1ccc(Cl)cc1CN1CCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 1234556196 QCOXHTBKMNWJKO-QGZVFWFLSA-N 430.980 4.003 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)C2)cc1 1252922044 CWQCDOVUQXOZCT-MJBXVCDLSA-N 439.400 4.046 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)CC2)cc1 1264733196 QRPYVRJJSCYKHH-OAQYLSRUSA-N 445.604 4.160 10 10 IICE Cc1ccc(CC[C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1265461059 PXYYNTGDUFTBSD-NFECSFHCSA-N 446.569 4.456 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCCCc3ccc(OC)c(OC)c3)CC2)cc1 1295275359 PUSRMTWIBBYSJG-UHFFFAOYSA-N 426.557 4.164 10 10 IICE COc1ccc(N2CCN(Cc3noc(-c4cccc(Cl)c4Cl)n3)CC2)c(OC)c1 1308017953 YNRIFHLWSIWQIH-UHFFFAOYSA-N 449.338 4.383 10 10 IICE C[C@@H](NC(=O)N1CCC[C@@H](NC(=O)c2ccc(Cl)cc2)C1)c1ccc(N(C)C)cc1 1312534713 HAANBHVCBXTASC-OXQOHEQNSA-N 428.964 4.071 10 10 IICE CCc1nc(CN2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)cs1 1313132079 LNHVKIAQZGQGAC-UHFFFAOYSA-N 437.613 4.140 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)c1ccco1 1315045107 RXRNOPYDKZISLM-LJQANCHMSA-N 446.555 4.279 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1316172493 LEPHISUVSSCJET-NHCUHLMSSA-N 441.620 4.133 10 10 IICE Cc1cc(I)cc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 1349949079 OXKMPTIISCFOIL-UHFFFAOYSA-N 434.321 4.470 10 10 IICE CC(C)c1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 1350934038 WTVLFJRSZYXKQQ-HZPDHXFCSA-N 429.492 4.401 10 10 IICE CN(C)c1ccc(CN(C(=O)Cc2cccc(I)c2)C2CC2)cc1 1352744426 NJNRSXYKLHUZGF-UHFFFAOYSA-N 434.321 4.091 10 10 IICE CC(C)(C)n1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1353506073 ZBGLEJQAUDGUFM-MHWRWJLKSA-N 432.546 4.007 10 10 IICE CCc1ccc(N2C[C@@H](C(=O)Nc3sc4c(c3C(=O)OC)CCCCC4)CC2=O)cc1 1354176607 POZMNVSEHZQCHO-INIZCTEOSA-N 440.565 4.358 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(F)F 1440685034 QZBJGLPBZLFMBE-GOSISDBHSA-N 425.520 4.184 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCc3nc(O)ccc32)c(C)n1-c1ccc(Br)cn1 1463895638 SVMNEODXBCXHDL-SFHVURJKSA-N 441.329 4.160 10 10 IICE Cc1ccc(-n2nc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)cc2C)cc1 1464607085 RQFALSZDFSUIOO-DEOSSOPVSA-N 432.568 4.377 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](c2ccc(Cl)c(F)c2)c2nn[nH]n2)c1C 1466725547 SOMQCQSSFUSJJH-HXUWFJFHSA-N 438.894 4.228 10 10 IICE Cc1cc(CCNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCCO3)c(C)n1-c1ccccc1 1534550123 VCFJDLMWLJMNDC-UHFFFAOYSA-N 435.480 4.136 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N(C)CC1CC(F)(F)C1 1542226764 ISIFOOSRVAKQJS-UHFFFAOYSA-N 428.531 4.188 10 10 IICE Cc1cnc(NC(=O)[C@H]2CSCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)s1 1565574794 RBMCAXQNSQLFNE-GOSISDBHSA-N 426.567 4.013 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 1565679453 QASZRUZSBMYYPO-IBGZPJMESA-N 439.556 4.236 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CC=C(C(F)(F)F)CC1 1611963969 HGPUVRWCTKSHBD-LJQANCHMSA-N 435.494 4.251 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@]1(C)CCCO1 1613295227 CVRFFOUAMHWYJB-DVECYGJZSA-N 427.593 4.086 10 10 IICE CN(CCC(F)F)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1618163700 LQKYUGCWCCVFHP-UHFFFAOYSA-N 437.510 4.051 10 10 IICE C[C@H](Cc1ccsc1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1621329826 OOEPGRLUPRBBJT-CYBMUJFWSA-N 436.580 4.019 10 10 IICE O=C(NCc1cnn(-c2ccc(Br)cc2)c1)c1cc2cc(O)c(O)cc2s1 1626263069 CXZUKZVLMDUUGY-UHFFFAOYSA-N 444.310 4.191 10 10 IICE Cc1ccc(C(=O)N2CCC(CN3CCCCC3=O)CC2)cc1-n1c(C)cc(C=O)c1C 1628607897 IKOXHGHWEKGZRJ-UHFFFAOYSA-N 435.568 4.080 10 10 IICE CCOc1ccccc1C(=O)N1CCN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)CC1 1630342284 GEBMLBWASWLOAI-UHFFFAOYSA-N 445.563 4.399 10 10 IICE C[C@@H]1OC[C@]2(CC[C@H](CNC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)O2)[C@H]1C 1638513276 JWBYKOGIJGSXRU-NVNZTLJMSA-N 441.572 4.030 10 10 IICE COC(=O)[C@@H]1c2ccccc2OCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1639895985 FSJJQICOFPIELS-QFIPXVFZSA-N 438.911 4.496 10 10 IICE CCN(C)c1ccc(CN2CCC[C@@H](C(=O)Nc3ccc(Br)cn3)C2)cc1 1652865117 KYOSWBGWKWUCLV-QGZVFWFLSA-N 431.378 4.151 10 10 IICE C[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1660099531 ZBLNXCLJEOHITC-GJZGRUSLSA-N 443.459 4.048 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)cc1 1675779966 IGVCXBQQDGXPPR-ONTIZHBOSA-N 444.620 4.462 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(OCc4ccccc4F)cc3)C2)cc1 1679863724 HDNURTVIFAMVNR-NRFANRHFSA-N 449.526 4.491 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCCN(CC(F)(F)F)CC3)cc2Cl)C1 1682023080 ACXCRQAQTOCSHD-INIZCTEOSA-N 446.945 4.356 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](CCO)c1ccccc1Br 1683421611 UBXCTCMMLBYPPL-IIBYNOLFSA-N 448.405 4.177 10 10 IICE CCCCCCNC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 1686826288 FHJDRDFFWIMOEQ-UNMCSNQZSA-N 430.637 4.110 10 10 IICE C#C[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnn(CC)c1 1705478357 ADIREAZULFXWTK-GOSISDBHSA-N 427.556 4.075 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3cnc(C)s3)n2Cc2ccc(N(C)C)cc2C)n1 1707583689 VMZOWDZFGJOMBA-UHFFFAOYSA-N 447.612 4.473 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCCCO4)n3CCC(C)(F)F)CC2)cc1 1730181087 ZSFXFBFKOLLKHL-HXUWFJFHSA-N 449.546 4.290 10 10 IICE COCCCn1c(-c2ccc(Br)s2)nnc1N(C)Cc1ccccc1O 1730697414 NJUMLUIXDBYWBS-UHFFFAOYSA-N 437.363 4.148 10 10 IICE CC(C)(C)Cc1nnc(N2CCc3c(ccnc3O)C2)n1CCCSc1nccs1 1741191176 ZHGPGDUIDZUKBY-UHFFFAOYSA-N 444.630 4.169 10 10 IICE C[C@H]1CCCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1762860243 PCKUFEGXUBCSOG-FQEVSTJZSA-N 425.621 4.378 10 10 IICE CCN(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1764711233 WPCKPUXQTIFBIS-RUZDIDTESA-N 441.620 4.059 10 10 IICE CN(c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1)[C@@H]1CCSC1 1768556828 KBLWHPDXXYHMJA-HUUCEWRRSA-N 425.649 4.100 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(Br)c([N+](=O)[O-])c1 1891899595 ZMMGEIYKFXGUGG-YOEHRIQHSA-N 430.302 4.276 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)c1ccc(I)c(Br)c1 2163067463 XBZZCRFJABRUBQ-INIZCTEOSA-N 445.142 4.429 10 10 IICE [N-]=[N+]=N[C@@H]1CCCN(C(=O)c2ccc(Br)cc2I)CC1 2207275710 NWLOPLUCVBKYOX-SNVBAGLBSA-N 449.090 4.359 10 10 IICE CCCC1(NCc2c(Br)ccc(OC)c2O)CN(C(=O)OC(C)(C)C)C1 2227740885 HQBXGTAXHDWDRV-UHFFFAOYSA-N 429.355 4.043 10 10 IICE COc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3cc(Cl)ccc3O)SC2=S)cc1 2314836551 GPTABDIRCDLIAO-NSHDSACASA-N 448.953 4.283 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3ccc([N+](=O)[O-])s3)SC2=S)N(C)C)cc1 2323880181 ZWVFVHDTJLBIGE-HNNXBMFYSA-N 449.579 4.169 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457542 DCTOPAUENYQMDX-FHAGJXEFSA-N 435.568 4.299 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)C)cc3[C@H]3C=CC[C@@H]32)cc1OC 14479393 HVVPXQSGBOCGRG-BSRJHKFKSA-N 428.554 4.217 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccccc3Cl)C2=O)ccc1OCC(=O)O 16915007 JODRSUBFVOJBRP-CXUHLZMHSA-N 435.910 4.218 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(-c4ccc(F)cc4)o3)CC2)cc1 24750457 TVGIPHSUBVLXHF-UHFFFAOYSA-N 437.515 4.036 10 10 IICE COc1ccc(/C=C2\SC(=S)N(C(=O)c3ccccc3Br)C2=O)cc1 33413146 HDKJAPLBARAZDU-GDNBJRDFSA-N 434.336 4.499 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccc(F)cc3)=NC2=O)ccc1OCCC(=O)O 210469882 YTWBAGLZAHNSEK-PDGQHHTCSA-N 430.457 4.160 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@H](C(=O)NCc4ccc(F)cc4)[C@H]3C2)cc1 245280850 UQCHVMVWXYGEDZ-AZGAKELHSA-N 445.538 4.018 10 10 IICE Cc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)n1 742749268 FFHSXIMFDZRHGF-GOSISDBHSA-N 432.952 4.105 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(C(=O)C(C)C)cc3)n2)cc1OC 743045392 IGYBPMFDWLOLIJ-UHFFFAOYSA-N 446.550 4.467 10 10 IICE Cc1cc(Br)ccc1CN(C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 764766336 IJEROLUAYQASCX-QGZVFWFLSA-N 446.389 4.497 10 10 IICE O=C(c1cccc(O)c1O)N(Cc1ccccc1)C[C@H](O)c1ccccc1C(F)(F)F 790939529 DCIWLDGBEKUAFH-FQEVSTJZSA-N 431.410 4.493 10 10 IICE C[C@@H](NC(=O)N1CC[C@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 801763817 NQZCJPTXGAAPDZ-HOYKHHGWSA-N 430.593 4.246 10 10 IICE CCOC(=O)[C@@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccnc1 1128828276 DLRYZWPCMGCITP-DEOSSOPVSA-N 439.943 4.280 10 10 IICE Cc1cc(C(=O)N2CCc3ccc(O)cc3CC2)c(C)n1-c1ccc(Br)cn1 1182552479 YVBDKLQTOWABCX-UHFFFAOYSA-N 440.341 4.198 10 10 IICE Cc1ccc2[nH]c3c(c2c1)C[C@@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)CC3 1230852145 FMXMIXJZFJLTPE-DFBJGRDBSA-N 433.600 4.002 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccncc3)Cc3cccs3)C2)cc1 1252116492 SCZVJGXTVZOCQP-FQEVSTJZSA-N 436.581 4.390 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(c4ccc(C(F)(F)F)cc4)CCC3)cc2)CC1 1254716196 ILMRPJVXLHIMOU-UHFFFAOYSA-N 446.517 4.336 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2cccc(NC(=O)OC(C)(C)C)c2)cc1 1278287994 BIDZFYRYBFADJJ-UHFFFAOYSA-N 427.545 4.180 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(NCc4ccccn4)c3)cc2F)C[C@@H](C)O1 1291756369 PWXQBKKKWDDFJN-KDURUIRLSA-N 448.542 4.376 10 10 IICE CC/C=C\Cn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1306483514 CBIGJVWKLHBNRH-SREVYHEPSA-N 433.604 4.343 10 10 IICE CC(C)Oc1ccc2ccccc2c1CNC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1312466099 GPXFXCMGPWHKQX-UHFFFAOYSA-N 446.595 4.378 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(OC(F)F)cc1F 1352891872 KXSICZBACDPNCB-UHFFFAOYSA-N 430.373 4.427 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1CC[C@H](Cc2ccccc2)O1 1435064216 JDUHGGZFNYJFHI-YADHBBJMSA-N 430.495 4.163 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCC(=O)c2ccc3c(c2)CCC3)cc1 1442604086 UKJIYPQULPQAGW-RUZDIDTESA-N 434.580 4.412 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)C1(C)C 1445636400 AOYSQEQXXZEVOB-ICSRJNTNSA-N 428.529 4.453 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C/C=C/c2ccc(Br)cc2)N(C)C)cc1 1463279690 JNWULSCEAHBIFO-LYSGITKLSA-N 430.390 4.338 10 10 IICE CC(=O)NCc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1465031955 BGMKZLSOLNQZSG-UHFFFAOYSA-N 441.329 4.140 10 10 IICE Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1467674306 RTIVCWDPFOJFMF-HSZRJFAPSA-N 429.564 4.467 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H](C3CCCCC3)C3CCC3)CC2)cc(OC)c1OC 1470613860 YLVUKUSUYWPCMM-HSZRJFAPSA-N 445.604 4.293 10 10 IICE CCCN(c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1472689010 SOKYFFRVDVATAV-SECOEOQKSA-N 433.505 4.007 10 10 IICE CCN(CC)C1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1501896155 ZIBIDHRFYUFPFP-UHFFFAOYSA-N 444.643 4.431 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)c(F)c2)C1 1505209585 LQWFJKKBIFSWIL-GOSISDBHSA-N 442.608 4.259 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@H](C)[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1511540802 VGVVOEMBUSKNPZ-JKSUJKDBSA-N 442.608 4.370 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1516636326 AUJSOPBWNUNCTG-NZQKXSOJSA-N 441.620 4.195 10 10 IICE COCC1=CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC1 1518816821 DNAGKRFHJGVJIM-UHFFFAOYSA-N 431.587 4.268 10 10 IICE CC(C)CCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1541502638 FFAIZWLOEFBUJE-UHFFFAOYSA-N 448.615 4.173 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Cl)cc(F)cc3Br)CC2)cc1F 1545608093 JPIJPTIMOSHTKQ-UHFFFAOYSA-N 445.691 4.352 10 10 IICE CCN(C)c1nnc(-c2cc(-c3ccccc3)[nH]n2)n1CCCSc1nccs1 1547325491 RHMDVKUWVIVEIB-UHFFFAOYSA-N 425.587 4.430 10 10 IICE C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1CC(=O)NCc1ccc(N(C)C)cc1 1560061674 PRGVVLGVGCQCAF-APWZRJJASA-N 430.390 4.009 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 1564446732 YTEGWBKYPGLFKA-GOSISDBHSA-N 430.955 4.500 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1564589684 JBMXZMJVCCDUSB-ZIAGYGMSSA-N 432.348 4.334 10 10 IICE Cc1cccc([C@@H](C)CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1565897420 NQEHZRHMQBDEBG-HNNXBMFYSA-N 430.551 4.096 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CNC(=O)c1sc2ccccc2c1Cl 1570417190 XASUGTXJMSSTAN-HNNXBMFYSA-N 444.000 4.406 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2CCC(NC(=O)CC3CCCCC3)CC2)cc1 1586649689 PZAUSCUXPDDDDM-UHFFFAOYSA-N 443.632 4.235 10 10 IICE C[C@@H]1CN(C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)c2ccc(Br)cc2O1 1587043718 MMQMTLBXMSLNJG-IUODEOHRSA-N 437.334 4.177 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Oc2ccc(F)cc2)nc1 1596683471 CKGUCMBEUQJRBU-UHFFFAOYSA-N 443.425 4.058 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CNC(=O)OC(C)(C)C)C1CCCCCC1 1611430871 HTXOLROMDDEMSX-LPHOPBHVSA-N 434.577 4.256 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1613396474 GNELUDOKUNMERG-OAQYLSRUSA-N 448.615 4.021 10 10 IICE CCCCCN(c1nnc(C(=O)NC(C)C)n1Cc1ccc2c(c1)CCCN2C)C(C)C 1614458213 NRBJEIXOXSVTNQ-UHFFFAOYSA-N 440.636 4.252 10 10 IICE CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1617538607 GMENFQGBXICUEY-GAKIBJFNSA-N 445.554 4.182 10 10 IICE C[C@H](CN(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CCCCC1 1620486158 WNXUTIFCLDKBLJ-VAMGGRTRSA-N 433.612 4.204 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2Cc2ccccc2)cc1 1624401944 USZXKDQDLFJUEM-FYYLOGMGSA-N 437.584 4.095 10 10 IICE Cc1cc(C(=O)Nc2ccc([S@@](C)=O)cc2)c(C)n1-c1ccc(Br)cn1 1629045614 HOXBXUAVWRJTLA-AREMUKBSSA-N 432.343 4.241 10 10 IICE Nc1c(Br)cc(Cl)cc1C(=O)NCc1ccc(N2CCSCC2)cc1 1630351325 LTQNMWUHSXGNPG-UHFFFAOYSA-N 440.794 4.168 10 10 IICE O=C(NCc1c(O)cccc1O)c1c(C(F)(F)F)nn(-c2ccccc2)c1C(F)(F)F 1639288922 BKKRTWRWLUFULR-UHFFFAOYSA-N 445.319 4.251 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1cccc(OC)c1Cl 1639827325 PJLXHXBSUZXWQG-UHFFFAOYSA-N 432.948 4.280 10 10 IICE COc1ccccc1[C@](N)(C(=O)NCCc1cc(C)n(-c2ccccc2)c1C)C(F)(F)F 1648952763 OCOMCWCWZHHPGA-QHCPKHFHSA-N 445.485 4.178 10 10 IICE Cc1cc(C(=O)COc2cccc(F)c2C(N)=O)c(C)n1-c1ccc(Br)cc1 1656439716 MKRFLKOJHONASQ-UHFFFAOYSA-N 445.288 4.356 10 10 IICE CC(C)c1nnc(N(C)C[C@@H]2CC=CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1723142448 QHMFLMXVNUMWJK-OAQYLSRUSA-N 437.632 4.451 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCC[C@@H]1OC 1727004260 VWGCYDWLSNGLNO-UEXGIBASSA-N 445.583 4.081 10 10 IICE CSC[C@H]1CCCN1c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)cc1C 1731099532 QURQZDUMBWIFKW-JOCHJYFZSA-N 436.629 4.018 10 10 IICE CC[C@@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)C)C1 1744225595 RCVSMDQMANLEKU-VWLOTQADSA-N 434.588 4.067 10 10 IICE CC[C@H](C)c1nnc(N2CCN(C3CCC3)C[C@@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1761886041 LDFCDRJNDNSZCX-MOPGFXCFSA-N 442.627 4.356 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@H]1OC 1764228104 HFVZHUQHYXKYMO-NZQKXSOJSA-N 437.588 4.250 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1C[C@H](c1ccsc1)N(C)C 1768682096 SKQOVWQMDWYFSO-HXUWFJFHSA-N 434.569 4.047 10 10 IICE COc1ccc([C@@H](n2nc(C(C)(C)C)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2080039202 UXKPRGOHOOXQKE-MRXNPFEDSA-N 438.366 4.392 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cccc(Br)c2O)[nH]1 2082944906 PXSATFKIKCAKPT-JTQLQIEISA-N 428.352 4.231 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NCc2cc(Br)cc(F)c2O)C2(CCC2)C1 2264442354 MVTSRSSZXVTZGL-OAHLLOKOSA-N 429.330 4.173 10 10 IICE CCCOC(=O)CCN1C(=O)C(=Cc2ccc(OCCC)c(OCC)c2)SC1=S 2314759588 CWVTVGWRMVIKTF-UHFFFAOYSA-N 437.583 4.419 10 10 IICE CC(C)N1CCC2(CC1)N=C(c1ccc3c(c1)OCO3)C[C@H](c1cc(Cl)ccc1O)N2 2936531 OWSVNVZVWGZFTP-HXUWFJFHSA-N 441.959 4.499 10 10 IICE biogenic CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550797 WQXCMCBHUSCVAL-KNKQGSTJSA-N 427.526 4.452 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccc(Cl)cc1 15035501 QZIUICDSHOHZFQ-DHDCSXOGSA-N 433.898 4.088 10 10 IICE COc1ccc(Br)cc1/C=C1\C(=N)N2N=C(c3ccccc3)SC2=NC1=O 33419883 CBBZMWLZBNJMCX-JVDIEWMDSA-N 441.310 4.125 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 96748300 YKTUZKIBKBXTRO-OAHLLOKOSA-N 434.492 4.048 10 10 IICE O=C1/C(=C\NCCc2cccnc2)C(c2ccccc2)=NN1c1nc2ccccc2s1 101538827 OKVPPZFMZAEWDM-MNDPQUGUSA-N 425.517 4.158 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccccc3SC[C@@H]3CCCO3)CC2)cc1 110362683 REWMTTGHZHQCHV-NRFANRHFSA-N 426.582 4.365 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NCc1cc(Br)cc(F)c1O)C2 715810722 CJPHNMFTRRMRMM-GJZGRUSLSA-N 429.330 4.314 10 10 IICE CC[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1c(C)noc1C 742749532 HSKMRJMYNCOZMV-WOJBJXKFSA-N 444.576 4.233 10 10 IICE CN1CCC[C@H](CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)[C@@H]1c1cccs1 745847023 IDJSLBYKRNPDLU-QMHWCDLVSA-N 443.613 4.227 10 10 IICE Cc1cc(C(=O)CS(=O)(=O)Cc2cccc(-n3cccn3)c2)c(C)n1-c1ccccc1 758277806 VDWPSIUQUXMQFB-UHFFFAOYSA-N 433.533 4.078 10 10 IICE O=C(NCCCSc1nccs1)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 759600869 AVKIPMPCAZCRCE-HNNXBMFYSA-N 431.505 4.427 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769037383 MRWVNSSTAYNVQM-UHFFFAOYSA-N 449.643 4.016 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](C(F)(F)F)[C@H]3C)cc2F)C[C@@H](C)O1 773234303 AKSANXBJKCDQIP-DLTWYDFYSA-N 431.474 4.312 10 10 IICE COc1ccc(Cn2nc(C)c(CNCc3cccc(Br)c3O)c2C)cc1 775153816 USRFCPSWQWYSLH-UHFFFAOYSA-N 430.346 4.315 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cnc3ccccc3c2)NC(=O)OC(C)(C)C)cc1 784420402 DWBCFNSQMIBTHG-QHCPKHFHSA-N 448.567 4.226 10 10 IICE C[C@@H](Cn1ncc2ccccc21)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 790574265 KFZSIRKHZGNDND-WMZOPIPTSA-N 428.483 4.059 10 10 IICE Cc1c(NC(=O)NCc2ccc(N3CC=CC3)cc2)cc(Br)cc1[N+](=O)[O-] 797683019 BZBSOUYYFOHCIU-UHFFFAOYSA-N 431.290 4.364 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]([C@H](O)C(F)(F)F)C3)cc2Cl)C1 799994544 CUTPJOMXJVPAHM-OGWOLHLISA-N 447.929 4.421 10 10 IICE Cc1cc(-c2nnc(N3CCOC4(CCC4)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802693799 AESQIJHKCKKTOA-JOCHJYFZSA-N 447.583 4.291 10 10 IICE CCc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2)s1 917713650 MPQDMRAZLFXMNZ-UHFFFAOYSA-N 436.580 4.221 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)nc3)c2C)c1 918576162 QAKGGFDTZPZIEY-PMACEKPBSA-N 432.568 4.341 10 10 IICE CN(C)c1cccc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1126421412 BBHYJHGSNDWILI-UYRXBGFRSA-N 444.553 4.226 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(S(C)(=O)=O)c(Cl)c2)cc1 1136641689 SUOGNSZTOKPEGB-UHFFFAOYSA-N 444.940 4.145 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nc(-c3ccc(Cl)cc3)no2)cc1 1136833688 ZZTADGBKTKZOLB-UHFFFAOYSA-N 448.910 4.469 10 10 IICE COc1ccc(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)no2)cc1 1142713212 ROBBCEFNTPSUDA-QFIPXVFZSA-N 435.524 4.238 10 10 IICE CC1CCN(c2ccc(CNC(=O)CC(F)(F)CNC(=O)OC(C)(C)C)cc2)CC1 1144774370 SAQJLBSNMNTCBF-UHFFFAOYSA-N 425.520 4.089 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2c2cccc(Br)c2)c(C)n1-c1ccccn1 1147436843 LFDRCUCVQQANFC-HXUWFJFHSA-N 440.341 4.465 10 10 IICE Cc1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)nc2)cc1 1147837622 JDNGCXWTHZPPLO-UHFFFAOYSA-N 431.536 4.321 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)CCCC1 1149934343 FVTFDMIRTLWDAS-VWLOTQADSA-N 436.552 4.166 10 10 IICE Cc1cc(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c(C)n1-c1cccc(Cl)c1 1165980580 LAESZAUSBBEDJU-QHCPKHFHSA-N 437.971 4.244 10 10 IICE COC(=O)c1cc(OCc2cc(C)c(I)cc2C)ccc1N(C)C 1166714720 XDEBUYQYIOGUIL-UHFFFAOYSA-N 439.293 4.340 10 10 IICE COc1ccc(N(C)CCN(C)Cc2ccnc(-c3ccc(Br)cc3)n2)cc1 1195790681 VJNRNDQBXDQXOE-UHFFFAOYSA-N 441.373 4.483 10 10 IICE COc1cccc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1264440164 TVIBGSHDTMFUNG-VCRXTVNUSA-N 444.553 4.303 10 10 IICE COc1ccc(C)cc1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1264818748 RMQXAWZEDHGXPI-UNOMPAQXSA-N 444.553 4.050 10 10 IICE CCO[C@@H]1C[C@](CO)(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1296496708 QATYROVLMJONFZ-DENIHFKCSA-N 449.389 4.153 10 10 IICE Cc1cc(-c2nnc(N(C)CCC3CC3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1304191552 BSELCLBOVBIHSL-UHFFFAOYSA-N 434.588 4.114 10 10 IICE COC(=O)/C=C\c1ccc(N(C)C[C@H]2CCN(Cc3ccc(C)s3)C2)c([N+](=O)[O-])c1 1307156048 DRUZUVJMEMSZHN-OTIVFRFGSA-N 429.542 4.109 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](c3ccc(CC(C)C)cc3)N(C)C)C2)cc1 1312818326 LSCLUUDKJYHMFE-WIOPSUGQSA-N 438.616 4.075 10 10 IICE CCOc1ccc([C@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1312833754 NENDWGWHUCXASW-JOCHJYFZSA-N 445.510 4.247 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1Cc1ccsc1Br 1314751247 QLYSVBYIFMHUCL-UHFFFAOYSA-N 444.358 4.488 10 10 IICE COc1ccc(-c2cncc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)c2)cc1 1357836245 QOBJVWATDPTXNH-HDICACEKSA-N 449.526 4.440 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2c3ccoc3CCN2C(=O)OC(C)(C)C)C2CC2)cc1 1358207511 YJGPSQFOEZGAOR-JOCHJYFZSA-N 439.556 4.371 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3cccc4ccccc34)cc2F)CC1 1360091262 LJGJMUBSUVGMDZ-IBGZPJMESA-N 435.543 4.205 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1360214567 MKQBYMVDQNKDJI-FQEVSTJZSA-N 425.573 4.400 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1 1440679390 BZGJKLZRRJBFME-UHFFFAOYSA-N 440.487 4.243 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(Br)c([N+](=O)[O-])n3)c2C)cc1 1458917254 KNJIIQCKDHYRJV-UHFFFAOYSA-N 447.289 4.243 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)N(C)C)cc1 1463284608 LWHKIUVBAHMPNV-NRFANRHFSA-N 443.016 4.491 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3C[C@H]3c3cccc(C(F)(F)F)c3)C2)cc1 1470593204 KYRRJUFHHZVPFK-ONGXBYRLSA-N 433.474 4.396 10 10 IICE Cc1cc(CC(=O)N2CC3(CCOCC3)CC[C@@H]2CO)c(C)n1-c1ccc(Cl)cc1 1471987987 YQDTTXDKIQTAFC-JOCHJYFZSA-N 430.976 4.070 10 10 IICE Cc1ccc([C@@H]2CSCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1479534809 OSBUMGIFCGIIOL-GOTSBHOMSA-N 426.630 4.163 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1499724748 FFTGVZHLLGTJLV-JKSUJKDBSA-N 439.676 4.490 10 10 IICE CCN(CCc1cccs1)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)cc1C 1515694453 VYAYBZCDFZTOIQ-UHFFFAOYSA-N 449.628 4.232 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccco3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1542181303 QXMMDKWLDUAPQB-UHFFFAOYSA-N 446.555 4.060 10 10 IICE CCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1545632142 CYOJYOSUPWCANL-HXUWFJFHSA-N 444.959 4.188 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@@H](C)C1 1555537096 YHCKAUGXGUIKTJ-GCJKJVERSA-N 436.604 4.337 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)CCCC1 1556221731 KIKSOLVEYFOQHH-OYHNWAKOSA-N 438.490 4.129 10 10 IICE COc1ccc(Cl)cc1N1C[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)CC1=O 1556884229 RSIGKYLFSLMCBZ-NSHDSACASA-N 443.714 4.030 10 10 IICE COC1CCN(c2ccc(CN3CC[C@]34CCCN(C(=O)OC(C)(C)C)C4)cc2)CC1 1559746246 RVQDYFQSTOBTKR-VWLOTQADSA-N 429.605 4.277 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccoc3C3(O)CCOCC3)cc2Cl)C1 1568142158 ODTGDNXLAXMAEW-INIZCTEOSA-N 432.948 4.097 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCO[C@@H](C)C3)cc2)cc1 1570012193 AQEOSQLYBSLCKM-IBGZPJMESA-N 431.536 4.313 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CN(C(=O)c1ccccc1)c1ccccc1 1584096497 XRJKVOOEEDKZDC-OAQYLSRUSA-N 429.564 4.455 10 10 IICE O=C(C[C@@H](c1ccccc1)c1ncc[nH]1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1584356353 JPHWJSNHTYVKNM-NRFANRHFSA-N 440.494 4.318 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1ccc([N+](=O)[O-])cc1F 1597561024 MZXCTQYEUBCITD-UHFFFAOYSA-N 448.498 4.351 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1611254477 COZDTDAOKYDOIR-AWEZNQCLSA-N 427.559 4.164 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)CCS1 1614250923 JCQZCTMGRZKSBP-JOCHJYFZSA-N 436.629 4.018 10 10 IICE COC[C@@H](F)Cn1c(-c2ccc(C)o2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1619614596 MFKZIZIBCRZARF-IBGZPJMESA-N 427.524 4.068 10 10 IICE C[C@H]1COC(C)(C)CN1c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1620325037 LYHQXEUXHDEVJL-INIZCTEOSA-N 443.592 4.188 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4cccc(O)c4)CC3)c2C)c1 1631600539 ABZOOGKOVQYMNC-UHFFFAOYSA-N 431.536 4.015 10 10 IICE CCC(CC)(CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(=O)OC(C)(C)C 1636338619 IKKTWCBMOFVGMP-IBGZPJMESA-N 434.577 4.231 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](CCNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1636488420 RJLYUFMZTLFBGD-HXUWFJFHSA-N 425.573 4.400 10 10 IICE CCC[C@H]1CN(c2cccc(C(F)(F)F)c2)CCN1C(=O)c1c(F)ccc(O)c1O 1638518757 ZOALLRSIZAPNDC-HNNXBMFYSA-N 426.410 4.387 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2cnc(-c3ccc(Br)s3)nc2)cc1 1639832068 QFKBOUFSPSTCPH-UHFFFAOYSA-N 431.275 4.382 10 10 IICE CCOc1ccc(Nc2ncccc2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1640232460 QSDMVVGMGMWGNH-DEOSSOPVSA-N 447.583 4.323 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCOCCCNC(=O)OC(C)(C)C)c1 1643211632 OXVCXHDBTZRRMZ-UHFFFAOYSA-N 429.561 4.064 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(COc3ccccc3C(F)(F)F)CC2)cc1 1645340827 LTOFMYLWHJNWIO-UHFFFAOYSA-N 449.517 4.179 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCC[C@H]3C(C)(C)C)cc2F)C[C@@H](C)O1 1653758530 DJJAFOSOCRSQPF-RMEPHLEKSA-N 433.612 4.250 10 10 IICE CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1-c1ccccc1 1657596145 HGHZVNOSPPHIQH-UHFFFAOYSA-N 433.527 4.082 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC(C)(C)Cc3ccc(Br)cc3)C2)cc1 1674326162 HRPZTCAOMBVKEA-SFHVURJKSA-N 446.389 4.357 10 10 IICE Cc1cc(CCNC(=O)NCc2ccncc2OCC(F)(F)F)c(C)n1-c1ccccc1 1680548687 ZVFQVAPKGYORFA-UHFFFAOYSA-N 446.473 4.472 10 10 IICE Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684873810 JSVJTCKKRUVNGO-SFHVURJKSA-N 429.634 4.229 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1744820448 YGJWRVVXRIRWDV-UGKGYDQZSA-N 425.621 4.283 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)cc1C 1763608941 GLOFFNGYCGYXME-FPOVZHCZSA-N 426.653 4.382 10 10 IICE CCC1CCN(c2nnc(C(=O)NC(CC)CC)n2Cc2ccc(N(C)C)cc2C)CC1 1765158462 PYZMPOLWOQMCON-UHFFFAOYSA-N 440.636 4.246 10 10 IICE Cc1cc(=O)c(OCCOc2cccc3ccccc23)cn1CCOc1ccc(N)cc1 1857916693 IHOLMDKTKLPFCE-UHFFFAOYSA-N 430.504 4.429 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CN3CCN(c4ccc(F)cc4)CC3)cc2)c1 1872881566 DVOPKGOSXMZUPU-UHFFFAOYSA-N 432.543 4.466 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CC3)C(=O)N(CCc3ccc(F)cc3)C2=O)cc1 1873166552 CONVGKHEOFNFDJ-UHFFFAOYSA-N 443.522 4.308 10 10 IICE O=C(N[C@]1(c2c(O)cccc2F)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952772869 QITJOMIKHDDKDF-KBMIEXCESA-N 433.435 4.370 10 10 IICE CCN1CCc2cc([C@@H](NC)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044754978 RSVJHOMFXVIURK-LADGPHEKSA-N 439.600 4.440 10 10 IICE Cc1c(C(C)C)nn(Cc2cccc(Br)c2O)c1I 2079777254 OWQPFPROARAJHO-UHFFFAOYSA-N 435.103 4.436 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C(C)C)c(C(=O)O)c1I 2079992456 DHVIRILABSDSBE-LBPRGKRZSA-N 444.269 4.023 10 10 IICE CN(C)c1ccc([C@H](O)c2ccc(I)c(Br)c2)cc1 2106802050 RXKIUHFVPTZKAQ-HNNXBMFYSA-N 432.099 4.201 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@@H](NCc1cc(Br)cc(F)c1O)C2 2241053527 CLTRIGBHPLJMLF-GQGQLFGLSA-N 443.357 4.465 10 10 IICE O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 2293476739 AVXSNWOQUAJGIE-UHFFFAOYSA-N 437.795 4.175 10 10 IICE Cn1c(C=Cc2c[nH]c3ccccc23)nc2ccc(I)cc2c1=O 2296754067 YYPPCLZNVSYIBT-UHFFFAOYSA-N 427.245 4.190 10 10 IICE CCOc1cc(C=C2C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)cc(Br)c1O 2296908013 SYSVZFJWBHFZLC-UHFFFAOYSA-N 445.269 4.058 10 10 IICE CCOC(=O)c1cccc(-c2ccc(C=C3C(=N)N4C(SC)=NSC4=NC3=O)o2)c1 2297341017 DUGDWUDUOJPGIJ-UHFFFAOYSA-N 440.506 4.063 10 10 IICE Cc1ccc(CN[C@]23CCC[C@@]2(F)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2380791531 AFAZWLZRUBPCGW-UXHICEINSA-N 443.357 4.434 10 10 IICE CCN(CC)CCCN1C(=O)c2oc3ccccc3c(=O)c2[C@H]1c1ccc(N(C)C)cc1 35483363 PNWAQIFZSCNRNP-HSZRJFAPSA-N 433.552 4.136 10 10 IICE CCC1=NN2C(=N)/C(=C\c3ccccc3OCCOc3ccccc3C)C(=O)N=C2S1 38205099 SQGRARVLDXSCPQ-CNWYTCMHSA-N 434.521 4.482 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCNC(=O)Nc3ccc(Cl)cc3)C2=O)c1 62050137 MSYZMSMQKQNFHY-SFQUDFHCSA-N 447.969 4.372 10 10 IICE COc1cccc(CNc2ccc(I)cc2Br)c1O 381679110 SLZGTDNREKTDCV-UHFFFAOYSA-N 434.071 4.380 10 10 IICE Cc1cc(C(=O)[C@@H](C)N2CCC(C(=O)N(C)C)CC2)c(C)n1-c1ccc(OC(F)F)cc1 727237499 IDWYMKSSBNGUSX-QGZVFWFLSA-N 447.526 4.067 10 10 IICE Cc1cc(CCNC(=O)N2CCC(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 727599148 GLHNBVFUCBIHGE-UHFFFAOYSA-N 425.573 4.400 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](c1ccccc1)N1CCc2ccccc21 731866122 QZRJRZUEZNPTMG-MHZLTWQESA-N 441.575 4.286 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cc(C(=O)OC)c(C)o3)n2)c1C 751127248 JWVYBYQPSFPAJD-UHFFFAOYSA-N 437.543 4.127 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1occc1COc1ccccc1 768542005 CBXTVKINCBAYTN-UHFFFAOYSA-N 445.563 4.321 10 10 IICE Cc1nc(C(C)(C)NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)sc1C 769057471 UURJRVBUICBURG-UHFFFAOYSA-N 441.645 4.026 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccccc1C(=O)O 1081114105 CDKRJMMPLWRNCW-LGMDPLHJSA-N 444.534 4.378 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)cc1 1136643829 YMJWKHNZDZVEGU-RUZDIDTESA-N 443.591 4.130 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)c(F)ccc4[nH]3)CC2)cc1 1150072203 XQAWSKTYEJRSTQ-UHFFFAOYSA-N 432.293 4.041 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](c1cccc(Br)c1)N1CCCC1 1157102872 QKSSUZKDRWRAJA-LJQANCHMSA-N 438.362 4.094 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2CSC2=NCCS2)N(C)C)cc1 1158716467 FIOXKOYWJMZBJT-OAQYLSRUSA-N 442.654 4.121 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1164486329 SUMVDEVAHVSSEN-ZHRRBRCNSA-N 442.357 4.278 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OC4CCCC4)nc3)cc2F)C[C@@H](C)O1 1264689016 GXHIAIQFUWUTTQ-CALCHBBNSA-N 427.520 4.086 10 10 IICE Cc1nc(Cc2nnc(N3C[C@@H](C)C[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290403747 ATDFIHRUNOWKQD-HOTGVXAUSA-N 442.608 4.370 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)C[C@@H]2CC)n1Cc1ccc(N(C)C)cc1C 1292020489 HYSQEDUWJIGBBN-UTKZUKDTSA-N 440.636 4.244 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC[C@@H](C(F)(F)F)O2)c(C)n1-c1ccc(Br)cn1 1303441553 DGOLDMHGHMVCFJ-HIFRSBDPSA-N 446.267 4.091 10 10 IICE COC(=O)/C=C\c1ccc(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c([N+](=O)[O-])c1 1306983336 WZGAVASGRQAMAC-YLBKJFSISA-N 447.438 4.463 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cc(Cl)ccc1Cl 1312553089 ZRNJICKMCKAUFG-AWEZNQCLSA-N 449.382 4.256 10 10 IICE CCOc1ncccc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1439875539 VFYUSBTUOYCYJI-UHFFFAOYSA-N 438.285 4.205 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cn(-c4cccc(Cl)c4F)nn3)cc2)CC1 1443666290 QCICXPWDSASDNR-UHFFFAOYSA-N 427.911 4.226 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)cc1 1444141725 DRZXUHMNZGIDIQ-JOCHJYFZSA-N 449.938 4.024 10 10 IICE CCSc1cccnc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1444516889 ZDQQZKVRTXCOSA-SFHVURJKSA-N 444.601 4.255 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)c1c(F)cccc1F 1448687010 QUOKLXCTAYIABA-UHFFFAOYSA-N 446.494 4.316 10 10 IICE COC(=O)c1cnc(N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1C(F)(F)F 1458303710 LLAKBQGVWJOCRI-QGZVFWFLSA-N 437.462 4.139 10 10 IICE CC(C)CC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1459718814 DZXKOZPMANOSSL-VWPQPMDRSA-N 433.612 4.346 10 10 IICE C[C@H](Sc1nc2ccccc2s1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460742397 VZNRIOKHWYCMIS-ZDUSSCGKSA-N 449.548 4.208 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)CN(C)c2ccc(C(F)(F)F)cc2C=O)cc1 1463780358 WKDJLYYZOVYZAG-UHFFFAOYSA-N 435.490 4.459 10 10 IICE COC(=O)c1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)cc1 1464956215 JXUUIPBDISOMHP-UHFFFAOYSA-N 432.520 4.324 10 10 IICE Cc1ccc(CN(CCO)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1466345988 PPQFDTJCDWHUHL-UHFFFAOYSA-N 442.357 4.195 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCC3CN(C(=O)OC(C)(C)C)C3)c2C)c1 1478363220 ZWNGGWHCXGVSRX-UHFFFAOYSA-N 426.561 4.069 10 10 IICE CSC1(Cn2c(-c3cc(Br)c[nH]3)nnc2N(C)Cc2ccccc2O)CC1 1505188182 PUZDWKHTEKIWAS-UHFFFAOYSA-N 448.390 4.273 10 10 IICE CC(C)c1nnc(N2CCO[C@H](Cc3ccccc3)C2)n1CCCSc1nccs1 1509025254 NKXVVFIXCBGCHH-LJQANCHMSA-N 443.642 4.488 10 10 IICE CCc1csc([C@@H]2CCCN(c3nnc(C)n3Cc3ccc(N(C)C)c(F)c3)C2)n1 1513720637 NUGHUDAUSRSPKA-QGZVFWFLSA-N 428.581 4.243 10 10 IICE CCOCc1nnc(N2CC[C@@H](c3ccccc3)C2)n1CCCSc1nccs1 1516509385 NMKFXJNZKAUDPW-GOSISDBHSA-N 429.615 4.447 10 10 IICE Cc1cc(CC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1523924193 CGQSPOYQFORCDZ-QZTJIDSGSA-N 432.008 4.294 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)[C@H](Cc3ccccc3)C(=O)OC)ccc21 1525821938 KXGZVBSAPHQLJR-MBSDFSHPSA-N 436.552 4.055 10 10 IICE CC1(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)Cc2ccccc2C1 1535875521 XJZNZWPSKGZVCE-XDHOZWIPSA-N 440.565 4.091 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H](Cc2ccc(F)cc2)C(N)=O)cc1 1542354501 GXAPXZQMQZJPSD-SFHVURJKSA-N 447.514 4.381 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc2c(c1)CCCN2C 1552586869 INJSLTNPMVXETA-WIYYLYMNSA-N 443.661 4.181 10 10 IICE Cc1cc(C(=O)N[C@H]2CN(c3ccccc3)C2=O)c(C)n1-c1ccccc1Br 1556167464 HEXYOIKYRMMISH-IBGZPJMESA-N 438.325 4.002 10 10 IICE COC(=O)/C=C\c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)o1 1565656385 ZPWUUQPGFUQKLM-PEZBUJJGSA-N 434.492 4.387 10 10 IICE CCOC(=O)C(C)(C)n1cc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cn1 1622248073 NVEMFTFSWGZQJV-UHFFFAOYSA-N 442.947 4.423 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCC[C@H]2COC(=O)N2CCCC2)c1 1636141544 HMHHYQOVCZWWSO-QHCPKHFHSA-N 437.540 4.134 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2nccn2-c2cc(C)ccc2C)cc1 1644437646 FPMUWYOKPISAAX-UHFFFAOYSA-N 438.597 4.185 10 10 IICE C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1646131003 LLQSIBFIUNIQLP-SFHVURJKSA-N 438.549 4.037 10 10 IICE CN(C(=O)c1ccnc2c1CCN2C(=O)OC(C)(C)C)c1ccc(Br)cc1 1646178272 ZAUBRRJPIYDHGI-UHFFFAOYSA-N 432.318 4.418 10 10 IICE Cc1ccc(C2=NO[C@@H](CNC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1681765450 KEHBUDRUKTUORW-XMMPIXPASA-N 430.552 4.437 10 10 IICE Cc1cccc(-c2nnc(N(C)C[C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)n1 1693186147 RXRVBZLWQGTDGM-JOCHJYFZSA-N 434.588 4.077 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1695299942 WVLZTMNKABSQRU-FQEVSTJZSA-N 444.643 4.288 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1 1726798682 FMHVFKQDHLIKNH-PXDATVDWSA-N 437.588 4.129 10 10 IICE CCCCN(C)CC1CCN(c2nnc(CC)n2Cc2ccc(N(C)C)c(F)c2)CC1 1728036930 FTGQKCGMXMOXQM-UHFFFAOYSA-N 430.616 4.042 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCN(C)CC(F)(F)F 1741335160 XDIUQZOMVGFSMX-UHFFFAOYSA-N 438.542 4.132 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1761960128 DKIGXFXWXPVZTL-IRXDYDNUSA-N 440.592 4.232 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCSC1 1763497763 FDFMKKLGUHBNOW-TZIWHRDSSA-N 443.661 4.408 10 10 IICE COCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1770975732 PQIJVYCBOPEBKE-SANMLTNESA-N 449.599 4.297 10 10 IICE CC[C@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCCOC(C)C)C1=O 1873167913 CKWBYNDRFGOFOK-SFHVURJKSA-N 437.584 4.377 10 10 IICE CN(C)c1ccc(-c2nc3cc(C(=O)N4CCN(c5ccccc5F)CC4)ccc3[nH]2)cc1 1873506813 QTLAMECWZQBJJE-UHFFFAOYSA-N 443.526 4.397 10 10 IICE CCN[C@H](c1ccc(N(C)C)cc1)[C@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 2044747901 JXLVWOHESYVLBL-BJKOFHAPSA-N 440.632 4.429 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(CCNCc2c(O)cccc2Br)C1 2140328795 IGERNQWZVGFKDO-JLTOFOAXSA-N 425.367 4.282 10 10 IICE COCCNCc1ccc(N2CCC[C@@H](OCc3ccccc3)C2)cc1Br 2186369825 AYLDKJIQITZXRT-OAQYLSRUSA-N 433.390 4.371 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4C)o3)C2=O)cc1C 2294131009 SJUXJWFFNMLFMB-UHFFFAOYSA-N 445.431 4.446 10 10 IICE Cc1ccc(CNC(=O)C2(CNC(=O)OC(C)(C)C)CCCC2)c(O)c1Br 2381133777 SNEFQGQHWBMPFT-UHFFFAOYSA-N 441.366 4.164 10 10 IICE COc1ccccc1/C=C1\SC(=S)N(CCCC(=O)Nc2ccc(O)cc2)C1=O 15039845 QFQKRNOOYXNCEF-AQTBWJFISA-N 428.535 4.021 10 10 IICE O=C1C[C@@H](N2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C(=O)N1c1ccc(Cl)cc1 103657699 JTXFAFAIAQZWRA-INQNZLQJSA-N 446.912 4.012 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCCS(=O)(=O)c1ccccc1 108113443 DEHOXVYVSNLAQQ-UHFFFAOYSA-N 444.578 4.297 10 10 IICE Cc1cc(C(=O)CSc2nnc(N(C)C)n2C(C)C)c(C)n1-c1ccc2c(c1)OCO2 728789022 XSYTVRHIDAKINI-UHFFFAOYSA-N 441.557 4.036 10 10 IICE Cc1sc(NS(=O)(=O)c2ccccc2Cn2ccnc2)nc1-c1ccc(F)cc1 759478902 UUYFVGWKESTZOZ-UHFFFAOYSA-N 428.514 4.303 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(C)cc3C)cs2)c(OC)c1 777665530 IQZKZRWAHJYRAU-UHFFFAOYSA-N 434.539 4.254 10 10 IICE C[C@@H]1C[C@@H](COC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCO1 782676820 LRRXRPMXMFVJFR-WAWJYGGWSA-N 425.597 4.088 10 10 IICE COc1ccc(O)c(CNc2cc(NCc3cc(OC)ccc3O)c3ccncc3n2)c1 811804909 FRJRRXGQVCSKNJ-UHFFFAOYSA-N 432.480 4.282 10 10 IICE COc1ccc2ccc(O)c(CN3CCN(C(=O)C45CC6CC(CC(C6)C4)C5)CC3)c2c1 813128968 DPUVKDMXOJCYIB-UHFFFAOYSA-N 434.580 4.415 10 10 IICE Cc1ccccc1C(=O)NCC(=O)OCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 849197600 NBLMTCNFEREGPE-UHFFFAOYSA-N 430.464 4.322 10 10 IICE COc1ccc2c(/C=C3/SC(=S)N(c4ccccc4OC)C3=O)c(C(=O)O)[nH]c2c1 1081155447 MCROBIWWFDHODX-LICLKQGHSA-N 440.502 4.289 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc4c(F)c(Br)ccc4[nH]3)C2)cc1 1146948954 BOMGBLXGYBDIJX-GFCCVEGCSA-N 432.293 4.087 10 10 IICE CC1(C)C[C@H](C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc2O1 1150349046 VLZLNZXQQXQOLA-ICSRJNTNSA-N 428.960 4.471 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(SC(F)(F)F)cc1 1152400731 FHWHZINGSXMOTD-UHFFFAOYSA-N 433.835 4.473 10 10 IICE O=C1[C@@H](N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)CCN1CC(F)(F)F 1167680553 IBIFAKKDJHLMBP-OCTSTCLRSA-N 432.442 4.141 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3CCC[C@@H](c4ccccc4)CC3)cc2)CC1 1251104648 PCRNNTBLRANOKJ-VWNXMTODSA-N 448.611 4.304 10 10 IICE CCS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1287660304 GLBQIXLXICFATI-UHFFFAOYSA-N 430.957 4.471 10 10 IICE C[C@H]1CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C[C@H](C)S1 1291232526 NXVUTMOGDWGTPU-GJZGRUSLSA-N 432.644 4.309 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1 1292931969 ASYCXRSZPFIHRP-HSZRJFAPSA-N 429.564 4.201 10 10 IICE CCCN1CCC(N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)cc2C)CC1 1294674325 HCMSENHEDHGQRQ-UHFFFAOYSA-N 426.653 4.309 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NC(=O)C(C)(C)C)nc1 1294685442 QDQVOPBSVAOKNR-UHFFFAOYSA-N 434.334 4.197 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccn2)cc1 1295420123 MKKVHLIURWNNKC-UHFFFAOYSA-N 441.583 4.190 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCCC3CCOCC3)CC2)cc1F 1300247121 KRKOCIIARJOKII-UHFFFAOYSA-N 445.583 4.083 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](OC)C(C)C 1305503221 AFGJERCDMPCSLX-KNQAVFIVSA-N 429.609 4.188 10 10 IICE CN(C)c1ccc2c(c1)OCCN2Cc1ccc(I)cc1Cl 1307648228 LRZGQHJPBPSDQH-UHFFFAOYSA-N 428.701 4.410 10 10 IICE CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NCc2ccc(N3CCCCC3)c(Br)c2)C1 1308424370 SOMAPAIHWXZFDF-QKNQBKEWSA-N 434.422 4.176 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCOC(F)(F)F)CC2)cc1 1315515859 SWVUMJRJIJHMKC-UHFFFAOYSA-N 441.498 4.053 10 10 IICE Cc1cc(CC(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)c(C)n1-c1ccccc1 1351981740 QTTBEPZOBKOPKB-UHFFFAOYSA-N 439.562 4.289 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(OC)cc3OCCC(C)C)CC2)cc1 1358140169 IBHISXDLVKSCRN-UHFFFAOYSA-N 426.557 4.481 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2SCc2cc(C)no2)cc1 1437379960 ACNWGQSABQDNGI-UHFFFAOYSA-N 425.554 4.492 10 10 IICE Cc1ccc(C)c(C2=NO[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)C2)c1 1456089892 VCQKMWJCPBXVCD-NRFANRHFSA-N 433.474 4.454 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@@H](C(=O)OC(C)(C)C)CC[C@H]2C)CCCC1 1461021392 FTLJBPZVXDCXFM-MSOLQXFVSA-N 440.584 4.498 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(Cl)c(N)c2Cl)c1 1464956156 HLDYTLVFMWXLGR-UHFFFAOYSA-N 443.334 4.320 10 10 IICE Cc1cc(CC(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)c(C)n1-c1ccccc1 1468114329 PYVMDZUEQSUFIN-FQEVSTJZSA-N 447.526 4.398 10 10 IICE CC[C@H]1CC2(CCC2)CN1c1nnc(C(=O)NC(C)C)n1CCCSc1nccs1 1514032588 HFVQHIPVVZUAFC-INIZCTEOSA-N 448.662 4.214 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)C[C@@H]1C 1514402222 OODIMPKQUVFJEF-IBGZPJMESA-N 434.588 4.210 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1Br 1527481151 GBVQWRHKPYOHRZ-IYBDPMFKSA-N 449.364 4.369 10 10 IICE CCOC(=O)[C@](C)(NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1537966764 RMCXCYFMPWPXOQ-AREMUKBSSA-N 434.536 4.123 10 10 IICE CSc1ccccc1N(C)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1539485504 ROBSEMWCSGYVHA-UHFFFAOYSA-N 432.457 4.369 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cnnn2-c2cc(C(F)(F)F)ccc2Cl)c1 1545684513 ZOSVCOOADVDHQN-JTQLQIEISA-N 440.809 4.145 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2csc(-c3ncc[nH]3)n2)cc1 1565656114 PBDWETPFPCDBAP-UHFFFAOYSA-N 433.537 4.455 10 10 IICE Cc1cc(Cl)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1N 1565883933 DQASMTZMXODBMB-IBGZPJMESA-N 446.979 4.292 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)CCS1 1614250924 JCQZCTMGRZKSBP-QFIPXVFZSA-N 436.629 4.018 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@](O)(CC)c1cccc(Cl)c1 1622327867 DACDLHGZTDUEKK-LJQANCHMSA-N 426.738 4.454 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCC[C@@H]2NS(C)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1623726159 ZHTCJWZVICQHLN-OFNKIYASSA-N 445.629 4.055 10 10 IICE Cc1cc(CCNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C)n1-c1ccccc1 1623739624 VAWBOWAZXIEHHM-UHFFFAOYSA-N 429.480 4.161 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC=C(C(F)(F)F)CC1 1624624540 YLJFRWDPEGLGHY-PTNGSMBKSA-N 444.475 4.138 10 10 IICE COC(=O)C[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)cc1 1625531589 PWCGCOPUBKYUNO-JOCHJYFZSA-N 436.483 4.388 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(F)c1OC(F)(F)F 1631425416 FEBBWUCIVMLIEK-CQSZACIVSA-N 446.828 4.478 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3(NC(=O)OC(C)(C)C)CCC3)c2C)cc1 1632494867 JANXIYAAHHNXAV-UHFFFAOYSA-N 427.545 4.280 10 10 IICE O=C(CSc1ccccc1C(=O)NCc1c(O)cccc1F)NCC1CCCCC1 1635360171 CCEPWMZCUGLGCQ-UHFFFAOYSA-N 430.545 4.250 10 10 IICE CN(C)c1ccc([C@H](CNc2ncnc3cc(F)c(Br)cc23)N(C)C)cc1 1651498002 BQMRYBBIXPYJDE-IBGZPJMESA-N 432.341 4.312 10 10 IICE CCn1c(O)nnc1SCC(=O)c1cc(C)n(-c2ccc(OC(F)(F)F)cc2)c1C 1652420169 LUGHTQXJVQVWGX-UHFFFAOYSA-N 440.447 4.285 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cc(Cl)cc(Cl)c3F)C2)cc1 1683340503 UYMJMAGELZVWAI-CYBMUJFWSA-N 426.319 4.467 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(Cl)cc3OC(C)C)CC2)cc1F 1685021235 XCWZRPKOFFNVSN-UHFFFAOYSA-N 435.927 4.307 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@]3(CCO[C@@H]3C)C2)n1Cc1ccc(N(CC)CC)cc1 1708562708 QSOQMSQCWZZDNJ-DFIYOIEZSA-N 441.620 4.070 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709218852 WESGHVLGOVGGIC-KNQAVFIVSA-N 439.648 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCN(C(C)(C)C)CC2)cc1 1746089821 HUEPYGMOYUJQCL-UHFFFAOYSA-N 435.620 4.088 10 10 IICE Cc1c(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cnn1CC(C)C 1761636616 PCWVPUWNWSRIFQ-QFIPXVFZSA-N 438.576 4.071 10 10 IICE Cc1ccccc1Cc1nnc(N2CCOC[C@@H]2C)n1CCCSc1nccs1 1762118238 RMZMGYFMIUBPKL-KRWDZBQOSA-N 429.615 4.041 10 10 IICE CC[C@]1(C)CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)c(F)c2)C1 1764348511 PNBBQPJWCGWJRS-XMMPIXPASA-N 439.583 4.020 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccc[nH]4)n3CCCC(C)C)CC2)cc1F 1770257993 KKLYPTZOUGNZCH-UHFFFAOYSA-N 426.540 4.184 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(c3ccc(F)cc3)C2=O)cc1 1860074848 SLMLRINTUDBCBU-CPNJWEJPSA-N 444.553 4.479 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](NCc2c(O)cccc2Br)(C(F)(F)F)C1 2103578593 YTMUUYBKNNAJGS-INIZCTEOSA-N 439.272 4.186 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(CCNCc2cc(Br)ccc2O)C1 2140330474 QYNAJBNMKKFTFR-MGPUTAFESA-N 425.367 4.282 10 10 IICE OCc1ccc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)c(Br)c1 2153332579 BZCAAIOJUCDWES-GOTSBHOMSA-N 427.386 4.434 10 10 IICE CN1CCc2cc([C@@H](O)c3cc(Br)ccc3I)ccc21 2163076377 NHKOSPUKXOJCCV-MRXNPFEDSA-N 444.110 4.128 10 10 IICE COc1ccc(Br)c(CNCc2ccnc(NC(=O)OC(C)(C)C)c2)c1O 2240556654 RHILJGXNOFCSER-UHFFFAOYSA-N 438.322 4.195 10 10 IICE Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4C)o3)C2=O)c1 2294130703 BAWHZXAVGAFSAV-UHFFFAOYSA-N 431.404 4.138 10 10 IICE CCOC(=O)c1ccc(NCN2C(=O)SC(=Cc3ccc(N(C)C)cc3)C2=O)cc1 2313502111 QJKMDZADAPRNMN-UHFFFAOYSA-N 425.510 4.035 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)ccc1OCCC(C)C 2313548842 HBBKWODPVQHJBI-UHFFFAOYSA-N 436.508 4.403 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@H](Cc1cccc(Br)c1)NC(=O)OC(C)(C)C 2362981746 RYQZBZBLMFJUSV-HNNXBMFYSA-N 440.342 4.044 10 10 IICE CC[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NCc1ccc(C)c(Br)c1O 2380750469 DRDSQGZJTHPALH-AWEZNQCLSA-N 443.382 4.409 10 10 IICE O=C1/C(=C\c2cccc([N+](=O)[O-])c2)N=C(c2ccccc2)N1c1nc2ncccc2s1 15221126 BKJWHNJIRYQMSX-GHRIWEEISA-N 427.445 4.434 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccco3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 16401587 UEYVESQZTUCOTJ-VWLOTQADSA-N 433.508 4.460 10 10 IICE COc1ccc(O)c(C2=NN3[C@@H](C2)c2cccc(OC)c2O[C@@H]3c2ccc(O)c(OC)c2)c1 20071386 WPFQZSRAWPPQMV-UQBPGWFLSA-N 448.475 4.366 10 10 IICE O=C(CN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)NCCc1c[nH]c2ccccc12 33542118 QWNWOBZYKBYDSC-XNUQNZKJSA-N 447.585 4.284 10 10 IICE COC(=O)c1c(O)c(/N=N/c2ccc(Cl)cc2OC)c(O)n(-c2ccccc2)c1=O 39140214 NEEFOYMTNYOVDS-GHVJWSGMSA-N 429.816 4.113 10 10 IICE CC(C)SC1=NSC2=NC(=O)/C(=C/c3ccc(-c4cccc(C(=O)O)c4)o3)C(=N)N21 96450420 XGABSGFYKLEURL-ICZFKYGZSA-N 440.506 4.363 10 10 IICE CC[C@@H](NCC[C@@H]1CN(Cc2ccccc2)CCO1)c1cc(Br)ccc1O 312364346 YZMXFGVAKPZJJZ-TZIWHRDSSA-N 433.390 4.487 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cccc(C[S@](=O)C(C)(C)C)c3)CC2)cc1 734935765 AESUSDGLGQVXQW-PMERELPUSA-N 429.586 4.097 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccccc2OCC2CC2)c(C)n1-c1ccccc1 741094880 URSJPDAZLHKXOK-UHFFFAOYSA-N 431.536 4.180 10 10 IICE COc1cc(N(C)Cc2nnc(-c3ccccc3Br)o2)cc(OC)c1OC 741794777 AVTVVVJOGZLPHX-UHFFFAOYSA-N 434.290 4.161 10 10 IICE CCC1(CC)CN(Cc2cc(Br)cc(Br)c2O)CC[S@@]1=O 769557628 QVWQPXWRYBSIFT-NRFANRHFSA-N 439.213 4.040 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ncc(Br)cc1F 779041409 RLQOETKFMWFRFN-INIZCTEOSA-N 447.396 4.366 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)/C=C\c2ccc(Br)o2)cc1 916566484 ZQTSLFXTSGCHHP-LEVJEWGPSA-N 433.346 4.329 10 10 IICE COC(=O)/C=C/c1ccc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c([N+](=O)[O-])c1 917087284 WNQTTZSARQSLAK-MYNUTGAYSA-N 443.475 4.146 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1 1127837685 AFRISHXHBWTQPF-DQPIFXJKSA-N 428.554 4.337 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(c2cccc(Br)c2)CC(=O)C1 1136428774 MHVGXMOMWLBGQL-UHFFFAOYSA-N 429.358 4.165 10 10 IICE Cc1cccc(CC2(O)CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c1 1156451691 WEPOLIRCFFNTMW-UHFFFAOYSA-N 430.548 4.425 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC(Cc4cccc(C(F)(F)F)c4)C3)C2)cc1 1252115151 INOJVYZAWLFWFV-GOSISDBHSA-N 447.501 4.424 10 10 IICE CCOc1ncc(C)cc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1274119805 WYUYMVZDKVVVQK-WJDWOHSUSA-N 447.607 4.470 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1293295822 ARAGFLCOJVPLML-PKOBYXMFSA-N 429.584 4.224 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@H](CN3CCC(C)CC3)C2)cc1 1295410248 KDFWBBATVYSCQZ-XMMPIXPASA-N 438.664 4.429 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](C(F)(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1302651306 ZOKWHYSJJGCSEC-GOSISDBHSA-N 437.510 4.065 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3cc(F)cc(F)c3)CC2)N(C)C)cc1 1313409269 BMVSLPUMCKDYDP-XMMPIXPASA-N 444.570 4.298 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)N(C)C)cc1 1313410033 DAJFSMTVIOLOHF-VWLOTQADSA-N 433.600 4.426 10 10 IICE CCc1nnnn1-c1ccccc1NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1354005901 UOQOWTCLUFIPOQ-UHFFFAOYSA-N 434.931 4.467 10 10 IICE COc1ccccc1N1CC[C@@H](CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1442959784 PNURSANWGQTCMX-NRFANRHFSA-N 445.563 4.480 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(O[C@H]2CC2(F)F)cc1 1445879867 FFKLCKXKMARQTH-XLIONFOSSA-N 436.886 4.226 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(OC3CCN(C)CC3)cc2)c1 1449282203 CCVBBDCWUQXYBC-UHFFFAOYSA-N 445.563 4.310 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](OC(=O)N(C)C)C2)c(C)n1-c1cccc(Br)c1 1449846892 BZOYPSLYRUYNIP-GOSISDBHSA-N 448.361 4.159 10 10 IICE CCOc1ccc(N2CCN([C@@H]3CCN(c4ccc(C(F)(F)F)cc4)C3=O)CC2)cc1 1459794196 CDCZAMTULMQRCW-OAQYLSRUSA-N 433.474 4.032 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Cl)ccc1Br 1460742421 WMBHYVBXNVZAAK-UHFFFAOYSA-N 445.691 4.147 10 10 IICE CCOc1ccccc1CN1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@@H](C)C1 1467416835 BWSRCDIYRJQMNV-HNNXBMFYSA-N 426.538 4.058 10 10 IICE C[C@@]1(Cc2ccccc2F)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1470904703 HTDUCYOFTNOYEV-VWLOTQADSA-N 425.548 4.094 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCO[C@H]3c3ccc(Cl)cc3)CC2)cc1F 1479162948 GYAOWGKNTDFLQC-IRLDBZIGSA-N 447.938 4.240 10 10 IICE Cc1noc(C2CCN(c3nnc(CC(C)C)n3CCCSc3nccs3)CC2)n1 1493089692 ICTDMNCMUUCANQ-UHFFFAOYSA-N 447.634 4.191 10 10 IICE CCc1nnc(N2CC[C@@H](c3ccccc3OC)C2)n1CCCSc1nccs1 1498922082 FRSSJXVHGYVDES-MRXNPFEDSA-N 429.615 4.482 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1511928568 SHCQMDUAOGVNGC-UHFFFAOYSA-N 443.602 4.164 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(F)cc(Br)c1 1518325488 MCVQELALISWPSC-UHFFFAOYSA-N 446.364 4.050 10 10 IICE Cc1cc(CCNC(=O)c2cccn3ncc(Br)c23)c(C)n1-c1ccccc1 1530890547 VZYOQETUJMSAKV-UHFFFAOYSA-N 437.341 4.477 10 10 IICE O=C(/C=C/c1nccs1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1539360673 DZZGYDPKBAWVOK-VOTSOKGWSA-N 426.299 4.267 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC[C@@H](C2CC2)N1C(=O)OC(C)(C)C 1540488215 IWQURSQJBAMHJL-FCHUYYIVSA-N 427.589 4.423 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)C[C@@H](C)C1 1541084389 BZVPFUVRPJIVSZ-KDURUIRLSA-N 448.615 4.361 10 10 IICE Cc1cc(-c2nnc(N(CCC(C)C)C3CC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1542182682 QRQFBSQKYZCCSN-UHFFFAOYSA-N 448.615 4.456 10 10 IICE CSc1nc2nc(C)c(CC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)c(C)n2n1 1544081519 XUIGZAACLCVUBU-UHFFFAOYSA-N 448.596 4.038 10 10 IICE O=C(CCCOc1ccc(F)cc1F)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632732 UHJDMIVVRUSRAH-SFHVURJKSA-N 438.902 4.264 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCN(C(C)=O)CC1 1546781093 VGMHOFPDLBMSNG-POHAHGRESA-N 446.599 4.377 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1546876852 RKMLNLKYHFPWCW-QGZVFWFLSA-N 441.599 4.266 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H]2C2CCC2)n1Cc1ccc(N(C)C)cc1C 1555652653 AGKGKWTYRWPFPV-WMZHIEFXSA-N 441.620 4.194 10 10 IICE Cc1cc(C(=O)NCC[C@@H](N(C)C)C(F)(F)F)c(C)n1-c1ccccc1Br 1558263733 ZMLBUUWRKSXHIB-QGZVFWFLSA-N 446.311 4.469 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3CC(C)(C)Oc4cc(F)ccc43)CC2)cc1 1564405780 RACGNWAPFDLKGW-NRFANRHFSA-N 427.520 4.358 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC1(C)CCN(C(=O)OC(C)(C)C)CC1 1564421610 CDSQOJQWMITCNN-IBGZPJMESA-N 446.636 4.328 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCC(=O)C(C)(C)C)NC(=O)OC(C)(C)C)cc1 1565882262 ULAAUPZCYRSFAR-IBGZPJMESA-N 433.593 4.220 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCc3ccc4cccnc4c3O)cc2CC1 1570533476 DGVMNVJEAZXXLQ-UHFFFAOYSA-N 447.535 4.206 10 10 IICE CCOC(=O)c1cnn2c(C(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)ccnc12 1597567482 PEOYLPVROJSBAU-QGZVFWFLSA-N 444.491 4.015 10 10 IICE O=[N+]([O-])c1cnc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C(F)(F)F)c1 1611944687 AECAXYVMNBEILG-CYBMUJFWSA-N 430.814 4.444 10 10 IICE CCc1c(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cnn1C(CC)CC 1625090576 UOAYLSJADUCRIY-IRXDYDNUSA-N 430.568 4.489 10 10 IICE O=C(C[C@H]1CCc2sccc2C1=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635945740 AQWGNOCUXBVNBY-RHSMWYFYSA-N 432.973 4.023 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c1 1639700621 ARLZQGWZWLHOJU-HRAATJIYSA-N 439.556 4.424 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCc1ccccc1F 1641713947 CZRFXLMXAGNQAS-MRXNPFEDSA-N 430.479 4.103 10 10 IICE CON(C[C@@H]1CCC[C@H](C)C1)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1643308423 KGZILGHARFIPHL-RCCFBDPRSA-N 434.536 4.479 10 10 IICE Cc1ccc(Nc2ccccc2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1644863782 SFPFSXBMUAYGIL-UHFFFAOYSA-N 442.563 4.370 10 10 IICE COc1cc(N2C[C@@H]3CCCC[C@@]3(CNC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC 1652337276 VKXKRHILJXVSGJ-OYHNWAKOSA-N 435.521 4.133 10 10 IICE COC1CCN(c2ccc(CN[C@]3(c4ccc(Br)cc4)C[C@H](O)C3)cc2)CC1 1654721976 OHFHOFKKUHQFEV-DKXQDJALSA-N 445.401 4.204 10 10 IICE CCOc1cccc([C@@H](C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1657984166 AVJQAPGSDDKLQZ-MRXNPFEDSA-N 428.488 4.150 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC[C@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1676289067 UVQYMQBNVJDFIB-PKOBYXMFSA-N 443.544 4.390 10 10 IICE COc1ccc(CNC(=O)NCC2(c3cccc(Br)c3)CCCC2)c(O)c1 1680762906 CMVNBWZYONIXLW-UHFFFAOYSA-N 433.346 4.475 10 10 IICE COc1ccccc1C[C@](C)(CO)NC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1683304247 UPSLRWSYGPYPSX-AREMUKBSSA-N 435.568 4.204 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3nn(C)c4ccccc34)cc2Cl)C1 1686062278 OBFVNIMTGKWFKJ-INIZCTEOSA-N 425.964 4.462 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1707964511 DGASJKBBOSTHCK-WOJBJXKFSA-N 425.621 4.234 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CC[C@H](F)C1 1708396093 AYCMAIBEICBLSX-TYPHKJRUSA-N 429.584 4.403 10 10 IICE CCC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@]2(OC(C)C)CCOC2)CCC1 1708890698 HGPJWMUUJOAYAM-DEOSSOPVSA-N 428.577 4.241 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1Cc1cc(C(C)(C)C)no1 1711095674 UPFVMCQULOHEPG-IBGZPJMESA-N 425.533 4.196 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1726882697 VUQMXXAABMBROD-LJQANCHMSA-N 436.629 4.425 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1ccnn1 1728026860 JZXPENIFGBNUEI-UHFFFAOYSA-N 432.576 4.271 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@](=O)CC 1728028071 YPWLXTZMOXOCSE-SSEXGKCCSA-N 427.618 4.358 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(CC(F)F)CC2)cc1 1728382449 OCHQLOZZGDNSMW-UHFFFAOYSA-N 448.606 4.148 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)cc1C 1752742040 HUDOQIDPJQJWGK-UZLBHIALSA-N 437.592 4.290 10 10 IICE CCC[C@@H](Cn1c([C@@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1763859481 XFSTXCGYHBRMSC-UGKGYDQZSA-N 429.609 4.332 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1767706185 WZFKOWYYKVIHAV-UGKGYDQZSA-N 437.588 4.393 10 10 IICE CCOCc1nnc(N2CCc3c(C)cccc3C2)n1CCCSc1nccs1 1767864037 NEJOOQXRPXYUFK-UHFFFAOYSA-N 429.615 4.325 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4c(F)cccc4F)sc3C)CC2)cc1 1858106370 XZLVVLSJPMZSJK-UHFFFAOYSA-N 429.492 4.368 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010404982 WFFNKBFNXXTYDA-RBUKOAKNSA-N 431.537 4.178 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@]1(CN)CCCN(Cc2ccccc2)C1 2074363268 CKJNJNTTWJKAEE-SANMLTNESA-N 438.616 4.141 10 10 IICE NCc1cc(F)c(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)cc1Br 2186714444 HFLIPSUVZIGBRM-GOSISDBHSA-N 446.286 4.300 10 10 IICE CCOc1c(Cl)cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1OC 2294130823 KAHCVECNLJHZNJ-UHFFFAOYSA-N 428.872 4.031 10 10 IICE COc1cccc(OCCCOc2ccc(C=C3SC(=S)NC3=O)cc2OC)c1 2297347274 BSHXBDSLHKGEMF-UHFFFAOYSA-N 431.535 4.041 10 10 IICE N=C1C(=Cc2ccc(-c3ccc(Cl)cc3)o2)C(=O)N=C2SC(N3CCCC3)=NN12 2297352888 YYEPETIKXLLMGW-UHFFFAOYSA-N 425.901 4.272 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3ccccc3O[C@@H](C)C(=O)O)SC2=S)cc1 2314932027 SQIPLABVXUDYQI-ZDUSSCGKSA-N 427.503 4.147 10 10 IICE O=C(NC[C@H]1CCCO1)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1O)[C@H]1CC=C[C@H]21 14475975 WAVNCFHPGJQZAM-VBWKBDAESA-N 435.480 4.036 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cc(C)ccc4C)c3[N+](=O)[O-])CC2)cc1 40591776 VNEJYNMASHEZBA-UHFFFAOYSA-N 434.500 4.080 10 10 IICE O=C1C[C@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)C(=O)N1c1ccc(F)cc1 102908967 FZDZVXDSEUWJEK-WNLSXJKCSA-N 446.912 4.012 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3OCCN(C4CC4)[C@H]3c3ccccc3)cc2)CC1 169787320 JETWQEAODWZQGS-IZZNHLLZSA-N 433.596 4.144 10 10 IICE CCOc1cc(/C=C2\SC(Nc3cc(C)ccc3C)=NC2=O)ccc1OCC(=O)O 210461291 XSQWHCPYRAGLEU-ODLFYWEKSA-N 426.494 4.248 10 10 IICE CN1C(=O)/C(=C\c2ccc(OCC(=O)Nc3nc4ccccc4s3)cc2)SC1=S 211945447 KGVNTVUOWBEPMD-MHWRWJLKSA-N 441.559 4.145 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(O)c(OC)c1)N2 226711516 WYXNXVSMICNEOM-UMEGOILYSA-N 435.568 4.299 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 226742955 WRJUHDOLWODIRD-SXGZJXTBSA-N 433.917 4.325 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1nccs1 737670859 OODUWJKTROURPT-UROBUVALSA-N 437.637 4.454 10 10 IICE CN1CCC(CNC(=O)N(Cc2ccccc2O)C2CCCCC2)(N2CCCCC2)CC1 745878592 QCSBRHIBFQCFIW-UHFFFAOYSA-N 442.648 4.187 10 10 IICE COc1ccc(N2CCC(NC(=O)c3c[nH]c4cccc(Br)c34)CC2)cc1 758019292 UJPYXNHOEDJKBI-UHFFFAOYSA-N 428.330 4.338 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cccc(Cl)c1 761745552 KTLXLOJMACQRTO-HBGVWJBISA-N 426.944 4.478 10 10 IICE C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 763488151 VSUGFRTZYBGESF-IBGZPJMESA-N 447.583 4.053 10 10 IICE O=C(CCCOC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 785407116 DKSWUPROGRCIPC-UHFFFAOYSA-N 445.518 4.074 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)c1 812743754 IBFIYNLZIJQYEL-UHFFFAOYSA-N 443.352 4.090 10 10 IICE COCc1nc(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)c(-c2ccccc2)s1 1130185929 WNGJUAYDQZQVPU-QGZVFWFLSA-N 437.565 4.221 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2([C@H]3CCCCO3)CCC2)NC(=O)OC(C)(C)C)cc1 1136903828 MUDJFBONDKFKNT-LEWJYISDSA-N 445.604 4.174 10 10 IICE COc1ccc(NS(C)(=O)=O)cc1NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1141269474 IFFSTMSLVNYPMU-UHFFFAOYSA-N 447.944 4.380 10 10 IICE Cc1cc(C(=O)NCC[C@H]2CCC3(CCC3)O2)c(C)n1-c1ccc(Br)cn1 1156476099 JPHRXQZGICBXPG-QGZVFWFLSA-N 432.362 4.473 10 10 IICE CC1(C)[C@@H](C(F)(F)F)CCN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1169300398 NCFSDWYDQUMGOD-KRWDZBQOSA-N 430.426 4.063 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(C(C)(C)C)CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1175397885 JBIBNRYDBOITFQ-JOCHJYFZSA-N 431.537 4.252 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3cc(F)c(Br)cc3C2)c([N+](=O)[O-])c1 1187716092 HAQGAIVBGUDRTH-HWKANZROSA-N 435.249 4.245 10 10 IICE CCOC(=O)CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)Cc1ccccc1O 1195357804 HXTPIQJKTMYDBL-UHFFFAOYSA-N 434.492 4.188 10 10 IICE CC(C)C[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(=O)OC(C)(C)C 1230278438 NJINQMMIVUFHKF-PMACEKPBSA-N 434.577 4.087 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](OC)C(C)(C)C1 1297551620 IYIXIKPXZOHJQK-JOCHJYFZSA-N 437.588 4.250 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 1299477651 CYEVSEDSMSMWLJ-SFHVURJKSA-N 437.971 4.285 10 10 IICE CC[C@@H]1CCC[C@H]1Cn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccccc1O 1306306603 KSKFYXXJJOJWEE-MSOLQXFVSA-N 434.544 4.094 10 10 IICE C[C@@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCOc2cc(N(C)C)ccc21 1307648476 OUSLPMCDYWDDQS-AWEZNQCLSA-N 426.517 4.241 10 10 IICE COc1ccccc1-c1nnc(Nc2cnn(C)c2)n1CCCSc1nccs1 1315612132 VNOPNOVUHHEDDP-UHFFFAOYSA-N 427.559 4.070 10 10 IICE CCOC(=O)C1CCC(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 1435332121 JUOAYNOPKBJSAO-ABHNRTSZSA-N 438.515 4.133 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4C)c3C(C)C)CC2)cc1F 1445850457 YFRFXQGYKBYDSJ-UHFFFAOYSA-N 436.531 4.414 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c1 1456629899 CPFQLBSVMPQIDX-IIBYNOLFSA-N 439.556 4.139 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)c3ccc(C)c(F)c3)CC2)c1 1464300071 PYDYEGHPBJJAEK-UHFFFAOYSA-N 433.527 4.448 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1cc(Cl)ccc1N1CCOCC1 1469970717 YKGCBRSJSFDFTD-UHFFFAOYSA-N 442.991 4.118 10 10 IICE CCOc1ccc(N2CCN([C@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC2)cc1 1473296473 OVSHAAQNNWCIGQ-NRFANRHFSA-N 433.474 4.032 10 10 IICE CC1CCN([C@@H](C)Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CC1 1512265182 COYBJLAGLBMXIP-FQEVSTJZSA-N 425.621 4.473 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(-c2ccsc2)nc1 1516462030 OUZVZCORYOCTHX-UHFFFAOYSA-N 435.553 4.328 10 10 IICE COC(=O)[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(C)c(C)c1 1523710605 TZEPLYHSLSCZRC-RUZDIDTESA-N 434.536 4.176 10 10 IICE Cc1ccc2c(c1)OCCN2C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1524239586 KGMCRDAUNGSFGB-CPNJWEJPSA-N 442.537 4.151 10 10 IICE COCc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1525539501 IQILSPIDLJCVBB-LDADJPATSA-N 430.526 4.202 10 10 IICE CC[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)n1nnc(-c2ccc(Cl)cc2)n1 1526185599 LIJOCENMZPVKQI-OAQYLSRUSA-N 438.963 4.202 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CCCC2 1528728788 PZVOXEAOMOCEGM-AWEZNQCLSA-N 444.553 4.162 10 10 IICE Cc1cc(C(=O)N(CCO)Cc2ccccc2)c(C)n1-c1cccc(Br)c1 1540772973 UXLPHQKPDGDCAJ-UHFFFAOYSA-N 427.342 4.491 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[S@](=O)C(C)(C)C 1541427248 FWDWRHZDDZRVOZ-HKBQPEDESA-N 445.677 4.260 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)N(C)Cc3ccccc3)CC2)cc1 1543136139 SOYRWNXZCRQYKS-UHFFFAOYSA-N 430.552 4.104 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1545410182 GDAZKRWOIWWVOC-WAOWUJCRSA-N 429.584 4.440 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1Cc1cc(COC(C)(C)C)on1 1554175228 RONXQJWOVLFKDQ-UHFFFAOYSA-N 448.527 4.034 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Nc4nc(C)cs4)cc3)CC2)c(OC)c1 1557824581 UCCTVHBFDPXWIQ-UHFFFAOYSA-N 438.553 4.175 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1cc(F)cc(F)c1 1559811165 DYOFMWUKJJNJGU-AWEZNQCLSA-N 434.442 4.199 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1564554503 ZEGOAKSRMXJLOX-AZGAKELHSA-N 439.575 4.341 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3c(Cl)cccc3OC(F)F)CC2)cc1 1565219401 UVAOMSXWEQZPHQ-UHFFFAOYSA-N 439.890 4.372 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@](C)(CC)CNC(=O)OC(C)(C)C 1566306816 WFJYTLREEVPYMX-FQEVSTJZSA-N 443.382 4.444 10 10 IICE CSc1ccc(O[C@@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1566356463 FQMHWDPCFITVEN-YJBOKZPZSA-N 434.989 4.316 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](OC)c2ccc(Br)s2)cc1F 1585698669 VAAHXQLFDZJYLT-QGZVFWFLSA-N 429.355 4.500 10 10 IICE C[C@H](Cc1ccc(Br)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1586054452 ISSPTSZTQANQMX-IIBYNOLFSA-N 432.406 4.113 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1O 1587446989 FRXKUMCTMDSLAN-HTMJNSLASA-N 430.526 4.000 10 10 IICE COc1ccc2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c(C)nc2c1 1595574723 ZAHMFNFLLWIMSI-IBGZPJMESA-N 439.943 4.305 10 10 IICE CN(C)c1ccc(CNC[C@@H]2C[C@H]3CCN2C[C@@H]3c2cc(-c3ccc(F)cc3)nn2C)cc1 1616157297 ZZQCNNHAICPHEC-ZODMCCGTSA-N 447.602 4.260 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cccc(O)c1 1625101846 QGEKGVWHECIBMG-VBEHJTROSA-N 430.526 4.000 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Cl)cc3Br)CC2)cc1F 1631378113 YMWYVXYIAQHROX-UHFFFAOYSA-N 427.701 4.213 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1CCN(c2ccccn2)CC1 1631531165 JFZBTDZKYNSMIY-QFIPXVFZSA-N 444.579 4.089 10 10 IICE COc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1C 1634163235 WDZYQMAIVHCPBO-HXUWFJFHSA-N 427.545 4.065 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1 1636267042 LSFNJKJWGONTOO-AUSIDOKSSA-N 443.595 4.306 10 10 IICE CCOC(=O)C[C@@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccc(F)cc1F 1645575002 IQLFKWIAPISDDT-HXUWFJFHSA-N 427.451 4.192 10 10 IICE Cc1cc([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1=O 1652730464 UDWUTDVQJLRJHF-UHFFFAOYSA-N 444.285 4.118 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1653421063 HTOCTOCBSHJTEY-VWLOTQADSA-N 432.568 4.005 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N2CCN(Cc3ccsc3)CC2)cc1 1653679915 GBOXPWAAEVXLBR-UHFFFAOYSA-N 449.620 4.150 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)CCc3ccccc3)cc2Cl)C1 1672136505 BNOFEWNATOPHRE-GHTZIAJQSA-N 429.992 4.369 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1687217956 XSMTULBZXJQFCK-GOSISDBHSA-N 428.577 4.191 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 1687849028 YVVUIYSHLJKYIS-IBGZPJMESA-N 432.609 4.321 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)C[C@@H]1C 1693899291 YGDKLFCGCXJIPB-IBGZPJMESA-N 448.615 4.456 10 10 IICE CN(c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1)[C@@H]1CCSC1 1729361657 VQVRDMKLCDSWGB-HXUWFJFHSA-N 445.702 4.410 10 10 IICE CNC(=O)c1ccc(CN(C)c2nnc(C(C)C)n2CCCSc2nccs2)cc1 1748150730 AJCREPJBWUQPCI-UHFFFAOYSA-N 444.630 4.036 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CC(F)(F)CO1 1760994062 NUHVDJVYUNTZAX-FQEVSTJZSA-N 433.547 4.137 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC(Cn3cccn3)CC2)cc1 1766608950 UNBJUXAHMOTHQD-UHFFFAOYSA-N 435.620 4.409 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3cccc(OC)c3)SC2=S)N(C)C)cc1 1858594316 ULUZAKNTRQBKJN-XAJRUKRBSA-N 428.579 4.208 10 10 IICE COC(=O)CCC(=O)Nc1sc(C)c(-c2ccc(Br)cc2)c1C(=O)OC 1865957359 ASKGKLNOXFZTTI-UHFFFAOYSA-N 440.315 4.164 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Cc2ccccc2[N+](=O)[O-])sc(C)c1-c1ccccc1 1866062958 RJZFQRPZDIWJSW-UHFFFAOYSA-N 438.461 4.169 10 10 IICE CCCN[C@@H](c1ccccc1O)[C@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1942408364 OMNDHDVBWZQNJI-GMAHTHKFSA-N 427.589 4.458 10 10 IICE CC(C)(C)OC(=O)N1CCC(=O)[C@H]1c1cc(Br)cc(Br)c1O 1951860783 NHXJWZKJRIFAIV-GFCCVEGCSA-N 435.112 4.168 10 10 IICE Oc1cc(Br)ccc1CN[C@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156290339 ZJWXMKMUVWLQJK-IRLDBZIGSA-N 431.374 4.068 10 10 IICE CCN1C(=O)COc2ccc(-c3csc(NS(=O)(=O)c4ccc(Cl)cc4)n3)cc21 11857477 VFVPHIPTZSSLCO-UHFFFAOYSA-N 449.941 4.010 10 10 IICE CCCCC1(C)OC(=O)C(=Cc2cc(Br)c(OCC)c(OC)c2)C(=O)O1 58834380 DXAIQOQYPQGZHP-UHFFFAOYSA-N 427.291 4.246 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccc(C)cc1)C[C@@H](c1cccc(OC)c1O)N2 65298155 UVHCGPMZYCGOJZ-NRFANRHFSA-N 437.540 4.182 10 10 IICE biogenic O=C(CN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1nc2ccc(F)cc2s1 208740040 RVCNXBJEOCXVPF-NTUHNPAUSA-N 435.552 4.337 10 10 IICE CC(=O)Nc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526332187 ASRHKXYQDKEGDD-QFIPXVFZSA-N 434.423 4.253 10 10 IICE Cc1cc(Br)cc(C)c1NC(=O)CCCOC(=O)/C=C/c1ccc(O)c(O)c1 759598692 XPLKZPUDSJJPKI-SOFGYWHQSA-N 448.313 4.452 10 10 IICE NC(=O)c1ccc(N2C(=O)/C(=C/c3ccc(Br)c(F)c3)SC2=S)cc1 763110303 YXHLWHJGFKSJEB-ZSOIEALJSA-N 437.315 4.093 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2C)cc1 763565625 CLYANRGQSFFIJF-WIYYLYMNSA-N 432.609 4.320 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(Cl)cc3[N+](=O)[O-])n2)cc1 913072233 JLXCZEHTBUNHIC-UHFFFAOYSA-N 425.875 4.181 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c1C 918575944 MBMVLYPXCOQOQR-WOJBJXKFSA-N 432.568 4.341 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCCN2C[C@H](C)C[C@@H](C)C2)C1 1136255379 RXICMRXYJHDLQE-FGZHOGPDSA-N 438.660 4.282 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccccc3Nc3ccc(C)cc3)CC2)cc1 1136454171 NJFSNZHGNQAINR-UHFFFAOYSA-N 444.579 4.299 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(I)cc1NC 1142410863 SVBUZYCXMXLCNM-UHFFFAOYSA-N 437.325 4.061 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(SC)cc3)C2)cc1F 1144977100 AUHDZVFWXINEER-QGZVFWFLSA-N 429.561 4.063 10 10 IICE CCOc1cc(C(=O)OC)ccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1155721564 PZAUCASUZZQGCX-UHFFFAOYSA-N 434.492 4.273 10 10 IICE Cc1ccc2c(c1)CCN2C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1271488750 PZHPNKHBBJKQSS-CPNJWEJPSA-N 426.538 4.315 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1oc2ccccc2c1Br 1293975690 JDZMMKVQAYVPTE-UHFFFAOYSA-N 447.304 4.226 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C 1297793008 JJWQVVWFXCSLBA-ZOKDDAQRSA-N 425.602 4.110 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C1 1302667026 ANDFLGDLBSPCGF-SFHVURJKSA-N 440.592 4.315 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCSC3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1304188299 BASMWHNIZHGMBR-NQIIRXRSSA-N 438.645 4.244 10 10 IICE O=C(CN(Cc1cccs1)c1ccc2c(c1)OCCO2)NCCCOC1CCCCC1 1307527940 CGZQCWCEUDHVDJ-UHFFFAOYSA-N 444.597 4.382 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C\[C@]3(C)CC[C@H](C)C3(C)C)CC2)cc1 1353706658 JCAOKNBRYSWLBF-JYURKJFVSA-N 427.633 4.342 10 10 IICE C[C@@H](c1ccccn1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1356590409 PEMZKNXFPCSUHV-RVAQLADHSA-N 429.542 4.032 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@@H](C)[S@]1=O 1449309688 NXVMYUCJYKXLAE-SBTMGTPNSA-N 437.403 4.228 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C(F)=C/c3ccc(C(F)(F)F)cc3)cc2)C1 1464363646 RPLHWGICMCSSSW-BRLDDBHUSA-N 449.448 4.034 10 10 IICE CC[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1464656256 NMQWGTZUJMVGLK-HNNXBMFYSA-N 430.551 4.178 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSc3ccc(Br)cc3)CC2)cc1 1466209046 UJXXJDOLEOQGCU-UHFFFAOYSA-N 435.387 4.289 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(C2CCCCC2)c1 1467630830 FRDKOPIGGVZWSM-UHFFFAOYSA-N 426.561 4.391 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(O[C@H](C)c4ccccc4)nc3)CC2)c(OC)c1 1470859402 WOVPYZYBPVYSRK-LJQANCHMSA-N 447.535 4.201 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1512653755 TZTCARKOYMTSCL-MHECFPHRSA-N 439.629 4.455 10 10 IICE CC[C@@H](CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OC)cc1 1518324462 FERBEAYXISKSCL-QHCPKHFHSA-N 435.612 4.427 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccccc4OC)CCCCC3)CC2)c(OC)c1 1543632208 JIETTXPYJZPSTA-UHFFFAOYSA-N 438.568 4.263 10 10 IICE COC1(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CCN(C(=O)OC(C)(C)C)CC1 1544080056 JTAIPFRNTWSPAB-UHFFFAOYSA-N 441.572 4.126 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@@H](CC2CC2)c2cc(F)cc(Br)c2)cc1 1559771451 WUAUESZRAZYLHP-NRFANRHFSA-N 448.380 4.401 10 10 IICE CCCOC[C@H](Cc1cccc(Br)c1)NC(=O)N1Cc2cccc(O)c2C1 1564598606 IIOQVLDRIYZMDB-SFHVURJKSA-N 433.346 4.218 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CN(C(=O)OC(C)(C)C)c3ccccc3)C2)cc1 1570562926 AEEAFFHBCWWOHN-LJQANCHMSA-N 439.556 4.079 10 10 IICE CCn1c(SCC(=O)NCc2cc(Cl)ccc2O)nnc1-c1ccc(Cl)cc1 1583818352 ZXYPKDCAAHKUHU-UHFFFAOYSA-N 437.352 4.386 10 10 IICE Cc1ccc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)cc1-n1c(C)cc(C=O)c1C 1587838875 XDDUZYGYWPBNJH-UHFFFAOYSA-N 444.535 4.166 10 10 IICE C[C@@H](NC(=O)c1cc2cc(Br)sc2[nH]1)c1ccc(N2CCOCC2)cc1 1597908072 LKNVQGHGPLOHDF-GFCCVEGCSA-N 434.359 4.320 10 10 IICE Cc1cc(-c2nnc(N(C)C3CCC3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1611934221 ZHRWMCJEJPNUBJ-UHFFFAOYSA-N 434.588 4.114 10 10 IICE CC(C)(C)c1cnc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)s1 1620494677 PMMNHPXODOFXDG-UHFFFAOYSA-N 437.568 4.261 10 10 IICE CCCc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)[nH]c(C)c1C(C)=O 1622634754 HVMAQULKSGIPLR-SFHVURJKSA-N 431.964 4.232 10 10 IICE Cc1cccc(CS(=O)(=O)CCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1 1623739312 NJUUACBIQKWXID-UHFFFAOYSA-N 438.593 4.066 10 10 IICE COc1ccc(C[C@](C)(O)CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1OC 1625487307 FJZNPZXDATZXSG-SANMLTNESA-N 436.552 4.143 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1ccc(Cl)c(Cl)c1 1630280636 OTJJDQXOZMPNSV-UGSOOPFHSA-N 445.293 4.413 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NCCc2ccc(O)c(O)c2)c2ccccc21 1630334800 HNRQLHZORXWFKC-QGZVFWFLSA-N 426.513 4.076 10 10 IICE Cc1cc(C(=O)N2C[C@@]3(C)CN(C)C[C@]3(C)C2)c(C)n1-c1cccc(Br)c1 1630892100 CANTWQYJRIJTOG-FGZHOGPDSA-N 430.390 4.270 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2ccc(I)cc2Cl)cc1 1633693409 NTXFRTLHOACDHJ-UHFFFAOYSA-N 442.644 4.037 10 10 IICE Cc1cc(CC(=O)NC[C@@H](CO)Cc2ccncc2Cl)c(C)n1-c1ccc(Cl)cc1 1635602718 XMTJHGUBLJBMST-KRWDZBQOSA-N 446.378 4.306 10 10 IICE Cc1cc(C(=O)N2CC[C@](C(N)=O)(c3ccccc3)C2)c(C)n1-c1ccc(C(C)C)cc1 1638066366 FLNIWRZUTCLAID-HHHXNRCGSA-N 429.564 4.487 10 10 IICE CNC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccccc2C)c1C)Cc1ccc(F)cc1C 1638952248 JTCDENXJVCLYGU-NRFANRHFSA-N 435.543 4.185 10 10 IICE CNC(=O)CC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1640230051 VKGRADZLTXTQMS-GOSISDBHSA-N 446.389 4.378 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](n3ccnn3)CC2)c(C)n1-c1ccccc1Br 1642467754 OKOUDZAEVXOTRD-QGZVFWFLSA-N 442.361 4.316 10 10 IICE C[C@@H](NC(=O)c1cc(S(=O)(=O)Nc2ccccc2)ccc1Cl)c1ccccc1O 1642828045 XIBYGGUEMHKXIR-CQSZACIVSA-N 430.913 4.337 10 10 IICE Cc1cc(C(=O)Cn2ccnc2[C@@H](O)c2cccs2)c(C)n1-c1ccc(Cl)cn1 1643993679 WSYWUQAXRPSNGP-FQEVSTJZSA-N 426.929 4.365 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](c3ccccc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1653592776 IWYWFXHJIOSQEG-CEYNDMKZSA-N 441.591 4.433 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1COc2cccc(Br)c2C1 1683253605 IYHXYIIPBZZESM-RDJZCZTQSA-N 446.389 4.057 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@H]2CN(c3ccc(Cl)cc3)CCO2)cc1 1683874793 JYVPDPXYMJQNQF-QHCPKHFHSA-N 445.007 4.233 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)cc2Cl)C1 1686268237 ANDRLJYGWHABIH-KBXCAEBGSA-N 433.902 4.439 10 10 IICE CCN(C)c1nnc(-c2cc(Br)cn2C)n1CCCSc1nccs1 1745902056 IBFGDANXCHBFFY-UHFFFAOYSA-N 441.424 4.141 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@H](C(F)(F)F)C2)cc1 1746086211 JIUBATAFCAXPAG-LPHOPBHVSA-N 439.526 4.452 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@@H](OC)C2)cc1 1746091660 DOCJKQPLRQWOTH-FGZHOGPDSA-N 427.593 4.029 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1Cc1c(Cl)c(C(F)(F)F)nn1C 1750611321 URXCSZMBGJMIDJ-UHFFFAOYSA-N 442.873 4.198 10 10 IICE CC1(C)CN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC(C)(C)O1 1751296816 QXBJOYXAUCXYSP-UHFFFAOYSA-N 432.619 4.306 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@H]3C)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1761676343 GMBZWSULRNPUHZ-AZUAARDMSA-N 448.615 4.360 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H](Oc2ccccn2)C1 1761698719 VKWPLECQWCSSMD-JOCHJYFZSA-N 448.615 4.342 10 10 IICE CCC(CC)[C@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)N1CCOCC1 1764067345 RGQZHJDWEGVHPQ-NRFANRHFSA-N 443.636 4.055 10 10 IICE CC[C@H](C)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858596726 ZFVZIFLKSHBZAD-XTQFLBBASA-N 432.336 4.289 10 10 IICE COc1ccc(N2CCN(c3cc(N4C[C@H](C)Cc5ccccc54)nc(C)n3)CC2)cc1 1869292841 HREQBJMCOQRENK-LJQANCHMSA-N 429.568 4.451 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@H](NCc1cccc(Br)c1O)C2 2232282620 QFAWNNVFZYQQAK-GUDXXQAFSA-N 425.367 4.326 10 10 IICE O=C1C(=Cc2ccc(Br)cc2)SC(=S)N1C(=O)c1cccc([N+](=O)[O-])c1 2297188010 FESUJVSJRMGSNQ-UHFFFAOYSA-N 449.307 4.399 10 10 IICE Cc1cccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)c1 2314836137 AMHASEITIXXMAK-ZDUSSCGKSA-N 427.507 4.132 10 10 IICE CN1CCN(c2ccc(N3C(=O)C(=Cc4cc(Cl)ccc4O)SC3=S)cc2)CC1 2321684616 ADMSAJBTQRTTQS-UHFFFAOYSA-N 445.997 4.203 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(O)c1Br 2380759045 LCPKHIGHZSQHTC-HIFRSBDPSA-N 441.366 4.067 10 10 IICE COC(=O)c1ccc([C@@H]2Oc3c(OC)cccc3[C@H]3CC(c4ccccc4O)=NN23)cc1 20071062 JLBGWTJPMBEFJB-YKSBVNFPSA-N 430.460 4.430 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)/C=C/c1ccc(OCc2ccccn2)cc1 106009788 PGBJYRBUVDETBU-NTEUORMPSA-N 443.547 4.169 10 10 IICE Cc1cc(C)n(Cc2ccc(C(=O)Nc3cccc(N4CCN(CC5CC5)CC4)c3)cc2)n1 116175273 VIYRBQMBZWLDID-UHFFFAOYSA-N 443.595 4.333 10 10 IICE C[C@@H](Oc1ccc(Br)cc1)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 248378289 JDAGJBOSPYJZCZ-BEFAXECRSA-N 434.330 4.130 10 10 IICE COc1cccc(CN2CCOc3ccc(C(=O)NCc4ccc(C)cc4)cc3C2)c1O 581774927 ZWVLFDJLFMKSLN-UHFFFAOYSA-N 432.520 4.034 10 10 IICE COC[C@]1(CNCc2ccc(Br)cc2O)CCCCN1C(=O)OC(C)(C)C 691394616 FZEZEHRZZHQAFF-HXUWFJFHSA-N 443.382 4.051 10 10 IICE Cc1cc(-c2csc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)n2)c(C)o1 727251004 RXVZCGJKZQMFHU-UHFFFAOYSA-N 426.903 4.245 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC([C@@H]3CCCCCN3C(C)=O)CC2)c1O 738219440 IWRRZMUMAMEETE-DEOSSOPVSA-N 438.568 4.335 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)C2CC2)cc1 764511445 ICQZUTDXCZSOLE-PKTZIBPZSA-N 428.527 4.150 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C2CC2)cc1 768679617 ZNTGNLPJUKPYJU-SANMLTNESA-N 448.611 4.178 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(NC(=O)NC2CC2)cc1 773144291 DJYPGNJFSKDJIP-FQEVSTJZSA-N 447.627 4.353 10 10 IICE COC(=O)c1ccc([C@@H](NC(=O)NCCCSc2nccs2)C(F)(F)F)cc1 776019755 LGVIWDZWFCDDJE-CYBMUJFWSA-N 433.477 4.015 10 10 IICE COc1cc(O)c(CN[C@@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)cc1OC 783602280 CDPRMVWJIJAVRB-VGSWGCGISA-N 436.911 4.042 10 10 IICE Cc1n[nH]cc1-c1nnc(NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)s1 800567185 XCEFIXGLFRZTFJ-LBPRGKRZSA-N 445.980 4.448 10 10 IICE C[C@H]1CN(c2ccc(CNS(=O)(=O)/C=C/c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917918460 PFHANCNTECTUKM-WTBPUQPLSA-N 438.952 4.183 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1 1127737677 HRZVPNVZFQWZGF-NRFANRHFSA-N 425.891 4.422 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(-c4cccc(Br)c4)no3)C2)cc1 1130826905 MPIBCQHHEORQIB-MRXNPFEDSA-N 442.313 4.121 10 10 IICE Cc1cc(C(=O)N(C)CCn2cc(Br)cn2)c(C)n1-c1ccc(Cl)cc1 1141790872 CWAMDDAZVNVICR-UHFFFAOYSA-N 435.753 4.479 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccccc3NCC(F)(F)F)cc2F)C[C@@H](C)O1 1141901265 DJWJFWCZDUUSJW-HUUCEWRRSA-N 439.453 4.344 10 10 IICE CCN(CCCNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)C(=O)OC(C)(C)C 1144210053 LSGOYGBEGVAMPN-UHFFFAOYSA-N 427.545 4.284 10 10 IICE Cc1cccc(-c2nc(C)c(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)[nH]2)c1 1150349099 WJOTXESDZGMGJK-HXUWFJFHSA-N 438.959 4.447 10 10 IICE CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1160600739 YCUKQPPVGDNBRV-QGZVFWFLSA-N 442.318 4.122 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 1175648307 ODUGPRSCNGDYMX-XOPAWIAISA-N 442.556 4.139 10 10 IICE COC1CCN(c2ccc(CN[C@H](C)c3cc(F)ccc3N3CCC(O)CC3)cc2)CC1 1192557887 ZVUDXGYLNFMKTN-LJQANCHMSA-N 441.591 4.253 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1(c2cccc(F)c2F)CCCC1 1226271480 VSXCJYXZJLJURE-UHFFFAOYSA-N 443.538 4.237 10 10 IICE CC(=O)N[C@@H](CC(=O)NCc1cc(C)n(-c2ccccc2)c1C)c1c(F)cccc1F 1287660837 LZSVHAGLARKWSB-QFIPXVFZSA-N 425.479 4.256 10 10 IICE CCOc1ccc(CN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 1289976051 NZBUBMQHAUNSFJ-UHFFFAOYSA-N 449.595 4.474 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(N(CC)CC)cc2)[C@@H]1Oc1ccccc1 1312537585 VBKOYNAZFHVKQQ-VXNXHJTFSA-N 425.573 4.299 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cccc(F)c2I)C2CC2)cc1 1352744678 QCJOQUKVPYNDFD-UHFFFAOYSA-N 438.284 4.301 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 1356265928 FJUJLDNGUMHBHQ-UHFFFAOYSA-N 437.418 4.408 10 10 IICE C[C@@H](NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CCCC1(C)C)c1ccc(N2CCOCC2)cc1 1357128141 KJCSRWVETIRSQA-WIYYLYMNSA-N 445.604 4.126 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)N2CCN(C3CC3)c3ccc(F)cc32)C1 1448022758 RCFYIZDIBVPTTB-ACAQERRYSA-N 429.536 4.344 10 10 IICE COc1ccc(N2CCN(C(=O)CCCc3ccc(Br)cc3)CC2)c(OC)c1 1461978118 NIBOGMPFJPTJDD-UHFFFAOYSA-N 447.373 4.138 10 10 IICE COc1ccc(OC(F)F)c(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1466056561 OIXCHCLBQGZXGY-UHFFFAOYSA-N 428.435 4.447 10 10 IICE O=C(CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)CC1CCCCC1 1471455356 XBTCIZHPSDLTQK-UYRXBGFRSA-N 448.585 4.073 10 10 IICE CCN(CCOc1ccc(Br)cc1)c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1472723996 QTSLGOXBVDXCEY-WZUFQYTHSA-N 449.301 4.449 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1499727660 HPIUIMXULVHDLQ-PZJWPPBQSA-N 429.634 4.008 10 10 IICE C[C@H]1CCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)CC1(C)C 1512302964 KUVHWJFXDYNTCI-HNNXBMFYSA-N 431.635 4.190 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1 1515281069 ZTQICNUHODYBOL-GOSISDBHSA-N 434.588 4.067 10 10 IICE CN(C)c1cccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 1546150278 IXLHBOVXRMLQRR-UHFFFAOYSA-N 428.580 4.370 10 10 IICE COc1ccc(N2CCC(NC(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)CC2)cc1 1546188210 QQOLOAMOFKYTHK-FQEVSTJZSA-N 433.593 4.110 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)CCC2CCOCC2)cc1 1547444047 KQIITVLNHGAUTK-UHFFFAOYSA-N 448.615 4.488 10 10 IICE COC(=O)c1ccc(S[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559357550 CPFGVDWPBMFRKL-CQSZACIVSA-N 445.496 4.368 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)n[nH]2)cc1 1566154549 CGRFNSWHQFIUCB-MRXNPFEDSA-N 442.466 4.086 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](c3ccccc3C)C(C)(C)C)CC2)cc1 1566233169 VPBBHVDCIHYYDN-BUOWTUAJSA-N 449.595 4.112 10 10 IICE CCOc1ccc2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)[nH]c2c1 1566357222 ZCPPMKVNLOIEKS-SFHVURJKSA-N 427.932 4.320 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnc2ncc(Br)cc2c1 1585264071 LIVKXKLHFUJGMA-CQSZACIVSA-N 427.346 4.128 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1616599744 PWSSVERLWUANDT-KRWDZBQOSA-N 444.630 4.293 10 10 IICE CCC(CC)[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 1616683968 NZDCENSXFMIGAE-VWLOTQADSA-N 427.564 4.046 10 10 IICE COC[C@@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1619698209 AASQEYJSIPHBGK-SJORKVTESA-N 437.635 4.021 10 10 IICE Cc1nc(CN2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)cs1 1625019356 AUQVPBWNJGTTMN-UHFFFAOYSA-N 443.016 4.399 10 10 IICE Cc1ccc(C(=O)Nc2ncc(C3CCN(C(=O)OC(C)(C)C)CC3)s2)c(O)c1O 1627010485 WHUYHTATYMQRQH-UHFFFAOYSA-N 433.530 4.230 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(OCc2ccccc2)cs1 1627014076 QIUYDLDFLLSFKC-UHFFFAOYSA-N 425.506 4.238 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(Oc4ccccc4)cc3C)CC2)cc1 1627050135 JPZIFGNGQRRGFI-UHFFFAOYSA-N 445.563 4.348 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)cc1 1629596302 QICUESOFTVXLKM-GOSISDBHSA-N 442.519 4.300 10 10 IICE COCCn1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 1630256953 IRWROHCGRUMJCW-IBGZPJMESA-N 441.959 4.041 10 10 IICE Cc1cc(C(=O)NC[C@H](O)COc2ccc(F)c(F)c2)c(C)n1-c1cccc(Cl)c1 1631175793 HFGOVZFZHPBGAL-KRWDZBQOSA-N 434.870 4.195 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1coc2cc3c(cc12)CCC3 1631531160 JDRVULIYBYJZHW-UHFFFAOYSA-N 427.884 4.025 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3ccc(C)cc3Br)CC2)cc1 1632158128 RKJSAFSJLCYJFF-UHFFFAOYSA-N 431.374 4.438 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)Oc2ccccc2)c(C)n1-c1ccc(Br)cn1 1633775989 QGXQIPTVZZQRFV-OAHLLOKOSA-N 428.330 4.449 10 10 IICE O=C(NCCc1cccc(Br)c1)N(Cc1ccccc1O)C[C@H]1CCCO1 1635996977 UIWIMFRNFLAAQB-LJQANCHMSA-N 433.346 4.088 10 10 IICE COc1ccc([C@H](NC(C)C)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1641335325 TYURAARPNMYVBX-AVRDEDQJSA-N 447.526 4.121 10 10 IICE COC1CCN(c2ccc(CN(C)[C@H](CO)c3cccc(Br)c3)cc2)CC1 1642297018 KTWWRUYNLOTXRY-JOCHJYFZSA-N 433.390 4.230 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1 1643600531 PHSHBFDQXZBUGU-NRFANRHFSA-N 430.426 4.389 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cc(=O)n(-c4ccccc4)n3C)c2C)c1 1645067572 BKGZKEHXHRXJRT-UHFFFAOYSA-N 428.536 4.130 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@H]3CCC3CCCC3)cc2)CC1 1676126130 OWDJPLJKFXGBBS-QHCPKHFHSA-N 426.605 4.033 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(C)[C@@H](CO)Cc3ccccc3)cc2Cl)C1 1680562488 KXUYRMGZTOHVOO-GHTZIAJQSA-N 429.992 4.321 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@@H](Sc2cccc(Cl)c2)C1 1684280851 RDFWRWFJAAVNRH-JOCHJYFZSA-N 446.016 4.377 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCOC2)nnc1N(C)[C@@H](C)c1cccs1 1724235045 LWYMRRVAMVRVJZ-PKOBYXMFSA-N 425.602 4.464 10 10 IICE C[C@H]1CCC[C@@H](N(C)c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1726520845 MHPDLCACMIUGRT-DLBZAZTESA-N 448.662 4.168 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1746095734 VERRFANQUDAWRT-WIYYLYMNSA-N 427.593 4.028 10 10 IICE CCCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nnc1N(C)Cc1ccccc1O 1764386572 UYHXXBHETUGJCK-UHFFFAOYSA-N 429.565 4.145 10 10 IICE O=C(N[C@@]1(c2cccc(F)c2O)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952777028 XXYSIVIKWQCRTK-NBGIEHNGSA-N 433.435 4.370 10 10 IICE COc1cc(C=C2SC(NC(C)=O)=NC2=O)cc(Cl)c1OCc1ccc(F)cc1 2293682643 VLZOSASOKZOFAT-UHFFFAOYSA-N 434.876 4.173 10 10 IICE COCCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2cccs2)SC1=S 2296710746 YNLWSEKCHJQYSW-UHFFFAOYSA-N 427.576 4.448 10 10 IICE O=C1N=C(N2CCN(c3ccccc3[N+](=O)[O-])CC2)S/C1=C\c1ccc(Cl)cc1 33424595 QTKYMZFFZYMFMJ-AQTBWJFISA-N 428.901 4.041 10 10 IICE C=CCN1C(=O)/C(=C2/SC(=S)N(c3cc(OC)ccc3OC)C2=O)c2ccccc21 33783770 OKUVCLOBGLPEPH-VHEBQXMUSA-N 438.530 4.012 10 10 IICE Cc1cc(C)cc(Oc2nc3c(C)cccn3c(=O)c2/C=C2/SC(=S)N(C)C2=O)c1 39836038 KGJYWXOASWUTRV-GZTJUZNOSA-N 437.546 4.243 10 10 IICE Cc1cc(Br)c(N2C(=O)N=C(O)/C(=C\c3ccc4c(c3)OCO4)C2=O)cc1C 59859956 VXOIWSDTZKJDFA-NTUHNPAUSA-N 443.253 4.301 10 10 IICE Cc1c(NC(=O)c2cc(C)n(-c3ccccc3F)c2C)cccc1C(=O)N1CCOCC1 108875293 DPOIPTDODIBANV-UHFFFAOYSA-N 435.499 4.266 10 10 IICE CC(C)(C)OC(=O)N1CCc2cccc(CNCc3ccc(N4CCOCC4)c(F)c3)c21 236775736 VGPXWNJIFJGYGR-UHFFFAOYSA-N 441.547 4.250 10 10 IICE COc1ccc(-c2csc(N3N=C(C)[C@@H](N=Nc4ccccc4C(=O)O)C3=O)n2)cc1 575733367 FBTXRPYXQOVFMT-GOSISDBHSA-N 435.465 4.392 10 10 IICE Nc1ccc(F)c([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1O 687755721 DVSVMAUVWHCMKI-HXUWFJFHSA-N 436.439 4.168 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741184259 BWUCKGGPNLYYIV-UXHICEINSA-N 434.458 4.483 10 10 IICE CN(c1ccc(CNC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)cc1)C1CCCCC1 742416539 BEDROSYKRPYNBQ-ATVHPVEESA-N 441.597 4.157 10 10 IICE CCN(CC)CC1CCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 745903002 ATUSUKUBCWSMHY-IBGZPJMESA-N 438.563 4.020 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)cc1 751060330 ATCVVICAQYVKRS-PTUXOGIPSA-N 439.987 4.496 10 10 IICE NC(=O)c1ccc(N2C(=O)/C(=C\c3ccc(Br)c(F)c3)SC2=S)cc1 763110301 YXHLWHJGFKSJEB-RIYZIHGNSA-N 437.315 4.093 10 10 IICE O=C(CSc1ccc(C(F)(F)F)nn1)Nc1cccc2c1C(=O)c1ccccc1C2=O 777555484 BOZWDOVGNSHHPY-UHFFFAOYSA-N 443.406 4.002 10 10 IICE CC1=C(c2ccco2)CN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 800999376 XAFNEKHWHOMIEO-HDICACEKSA-N 427.520 4.421 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(Cl)c2)cc1F 1125535244 UHNMOHBFXDCTEU-JLTOFOAXSA-N 438.330 4.034 10 10 IICE CC(C)(C)O[C@@H](C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1 1127268071 QPVWIFAVDZKKBO-RUZDIDTESA-N 435.612 4.391 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(-c4ccc(F)cc4)c3C(C)C)C2)cc1 1129991769 XMPCCTMWOLSZJB-SFHVURJKSA-N 436.531 4.400 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(C(=O)CC3CCCCC3)CC2)cc1 1136537891 BFCKDRBGJNUKKX-UHFFFAOYSA-N 449.595 4.090 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1 1142418538 FZJJBKWEPSATIC-AWEZNQCLSA-N 432.446 4.491 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3ccnn3C)C2)c(C)n1-c1ccc(Br)cn1 1155481020 AAVDVYNSFOFOGN-MRXNPFEDSA-N 442.361 4.005 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(OC4CCCC4)nc3)cc2F)C[C@@H](C)O1 1264689017 GXHIAIQFUWUTTQ-IAGOWNOFSA-N 427.520 4.086 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCS[C@@H](C)[C@@H]1C 1289424544 XTCICKBOWRXDRW-WFXMLNOXSA-N 429.634 4.273 10 10 IICE COc1ccc(C(=O)C[C@@H](C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 1292381531 FFHHAGTUXDXDDA-DVECYGJZSA-N 438.568 4.178 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(N(C(=O)OC(C)(C)C)C4CC4)CCC3)CC2)cc1 1295275349 PQQANUTUJANNAD-UHFFFAOYSA-N 443.588 4.056 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C1 1304916775 IETXDVJJVJBLPV-CALCHBBNSA-N 428.631 4.385 10 10 IICE Cc1cccc(C)c1-n1nnnc1SCC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C 1307274243 LTHQVLDUNHWCSE-UHFFFAOYSA-N 436.516 4.196 10 10 IICE CCN(c1nnc([C@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C)C1CCCC1 1313579598 MVCLEVMXZZTLRH-IBGZPJMESA-N 441.620 4.202 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C(C)=C/c3ccc(Cl)cc3)CC2)cc1 1350976896 SIQDPTSCTUVTEO-VHEBQXMUSA-N 427.976 4.080 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3nc(-c4ccccc4)cs3)cc2F)C[C@@H](C)O1 1354657333 KPAUSDDDPYOWFZ-HZPDHXFCSA-N 425.529 4.493 10 10 IICE CCC(CC)(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(=O)OC(C)(C)C 1355129507 FEVKNJJVZJWQEO-IRXDYDNUSA-N 436.568 4.204 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](NC(=O)OC(C)(C)C)C3CCCCCC3)CC2)cc1 1435578470 SAJPCJPGYNWAHZ-JOCHJYFZSA-N 445.604 4.208 10 10 IICE Cc1ccc(CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c(-n2cc(Cl)cn2)n1 1435906497 IBZLSGDLNBXQJH-UHFFFAOYSA-N 433.943 4.496 10 10 IICE Cc1cc(C(=O)NCc2cc(C3CC3)nn2C)c(C)n1-c1ccccc1Br 1456184960 ADPFRJMXRQRCIT-UHFFFAOYSA-N 427.346 4.398 10 10 IICE Cc1nc2c(c(NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)n1)CCCC2 1458371195 YILKYQCXLOKCNU-NRFANRHFSA-N 425.577 4.408 10 10 IICE Cc1cccc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1C 1459860222 MFDFXBSRKWNFOQ-NSHGMRRFSA-N 427.564 4.023 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3nc(CN(C)C)cs3)cc2Cl)C1 1469958466 CZVCBKWTFQJFSO-HNNXBMFYSA-N 436.025 4.094 10 10 IICE CC[C@@H](C)c1nnc(N(C)C2CCC3(CC2)OCCO3)n1Cc1ccc(N(C)C)c(F)c1 1495067759 UTUUWNYZNDSPNG-QGZVFWFLSA-N 445.583 4.167 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C1CC(C(C)(C)C)C1 1503106266 ZBOUVGFGMQZGSY-UHFFFAOYSA-N 445.583 4.286 10 10 IICE CC(C)N(CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)C(C)C 1509543041 UPKOABAJKPSSRX-UHFFFAOYSA-N 442.995 4.454 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](OC)C1 1516727021 ITFFRVHNRXJHGG-JPYJTQIMSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3Cc3ccc(Cl)nc3)CC2)cc1 1518307698 GBFKUVOHPRLPTI-UHFFFAOYSA-N 440.979 4.224 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2cccc(F)c2C1 1520752524 BYQUUXKRCCOFAX-XDHOZWIPSA-N 444.528 4.141 10 10 IICE CC(C)(C)c1coc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1527051810 CGMRLKOZHSLANC-UVTDQMKNSA-N 433.530 4.341 10 10 IICE CCC(CC)(C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)c1ccc(OC)c(OC)c1 1528317169 AIFJXOHVRQZQMV-IBGZPJMESA-N 426.557 4.165 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CN(Cc3ccco3)c3cccc(Cl)c3)C2)cc1 1531729976 NVBISCKSCBDPBP-IBGZPJMESA-N 439.943 4.343 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3ccccn3)n2CCCSc2nccs2)o1 1542371829 UNCMXFPFDCTMKL-UHFFFAOYSA-N 440.598 4.441 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSc2nc(-c3ccc(C)cc3)n[nH]2)cc1F 1543250814 ABRQHMGRRHFIAJ-UHFFFAOYSA-N 427.549 4.174 10 10 IICE CCn1nnnc1-c1cccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1543989915 QPKPALCZXPMXTC-UHFFFAOYSA-N 428.496 4.141 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCC[C@@H](OC)C2)cc1 1547449405 VWMFCJMISUELSY-JOCHJYFZSA-N 439.629 4.440 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1548039077 XYHFBQBLRIELEH-NJDAHSKKSA-N 445.583 4.023 10 10 IICE CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1CN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1557379740 JZVZXUJBSNKKAR-FPTDNZKUSA-N 432.542 4.080 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)CCCN(C)C(=O)OC(C)(C)C)c2C)cc1 1570372284 GWWNGQYTIDFZNW-UHFFFAOYSA-N 429.561 4.432 10 10 IICE COC(=O)c1ccc(F)c2c1CN(C(=O)c1cccc(-n3c(C)cc(C=O)c3C)c1)CC2 1584640674 SBPZGEQWFVLZNW-UHFFFAOYSA-N 434.467 4.031 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)c2ccccc2O)cc1S(=O)(=O)Nc1ccc(F)cc1 1587447714 ZBZFTMXWBBEMHW-HNNXBMFYSA-N 428.485 4.132 10 10 IICE COC1CCN(c2ccc(CN(C)[C@@H]3CCN(c4ccccc4Cl)C3=O)cc2)CC1 1615500586 OWZGFGBZPKRUBE-HSZRJFAPSA-N 427.976 4.193 10 10 IICE Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1616858579 OKBDUUGQFQNXDY-NRFANRHFSA-N 440.588 4.280 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCC3(F)CCC3)CC2)cc1F 1619302321 NVZBQEKOTUPHQK-UHFFFAOYSA-N 433.547 4.332 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1624626624 UHPFQTUPUVWFSG-OAQYLSRUSA-N 427.589 4.282 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)NCc3cccc(Br)c3O)CC2=O)cc1 1626821766 FGRZPYHBWYESRA-QGZVFWFLSA-N 445.357 4.167 10 10 IICE O=C(N[C@H]1CCN(c2ccccc2Br)C1)c1cc2cc(O)c(O)cc2s1 1628174301 HTKQANVNGWOXJT-LBPRGKRZSA-N 433.327 4.084 10 10 IICE Cc1ccc(CN2CCCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)cc1 1629234552 ZNDUIKZIWLTUHY-UHFFFAOYSA-N 443.591 4.492 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 1636234142 RYHZGCYLNPVRFB-UXHICEINSA-N 430.593 4.122 10 10 IICE Cc1cc(C(=O)CS(=O)(=O)c2ccccc2Cl)c(C)n1-c1ccc2c(c1)OCCO2 1640963934 MKMRCJQSEULKOY-UHFFFAOYSA-N 445.924 4.175 10 10 IICE COc1cc(OC)c2c(c1)N(C(=O)/C=C\[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CCC2 1641445790 DKSKGQSDGQASEG-MQNTZWLQSA-N 430.545 4.186 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@]23CCCOC3)c(C)n1-c1ccc(Br)cn1 1653931720 VBNJAMHWJNJWBG-NRFANRHFSA-N 432.362 4.427 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H]1CCCc1ccccc1 1673472655 TZVOBOOMURWBPA-OAQYLSRUSA-N 443.538 4.498 10 10 IICE COc1ccc([C@@H]2CCCCCN2C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1675580158 JCQQOICIRDTFCQ-VWLOTQADSA-N 436.600 4.274 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCc1ccc(Cl)c(Cl)c1 1683018668 ZRCXTUPPUWAECH-UHFFFAOYSA-N 430.282 4.108 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NCC(F)(F)c2ccc(Br)cc2)c1 1684209422 XCEVSILOFDXHMS-LLVKDONJSA-N 429.261 4.316 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@]2(C)Cc2cccc(F)c2)N(C)C)cc1 1684606240 CURAMECFNLIAJR-NOZRDPDXSA-N 426.580 4.301 10 10 IICE Cc1ccc(C)c(OC2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CC2)c1 1685610406 XKTFQQUCOJOWOC-XMMPIXPASA-N 438.616 4.225 10 10 IICE C[C@@H](c1cccs1)N(C)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)c(F)c1 1706739559 PWKDTYMXFVKLOY-HNNXBMFYSA-N 437.548 4.247 10 10 IICE C[C@@H]1CCCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1726566906 CVGBGGDIVWKSLC-OAHLLOKOSA-N 428.943 4.483 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCn2cc(C(F)(F)F)nc2C1 1742140002 YTKAMAKIONSDEO-UHFFFAOYSA-N 447.509 4.060 10 10 IICE CN(CCN=[N+]=[N-])C(=O)c1ccc(NC(=O)OC(C)(C)C)c(I)c1 2010391147 NGXDWIRYWHIGFT-UHFFFAOYSA-N 445.261 4.021 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)[C@H](C)c1ccccc1O 2060123290 GZOUKNYHEFYYBB-KGVIQGDOSA-N 442.556 4.410 10 10 IICE CC(C)c1ccc(-c2ccc(C=C3SC(=S)N([C@@H](CC(=O)O)C(=O)O)C3=O)o2)cc1 2297480330 VPIXSUOGJBWOPH-HNNXBMFYSA-N 445.518 4.199 10 10 IICE CN1C(=O)C(=Cc2ccc(-c3ccc(I)cc3)o2)SC1=S 2297504566 PWBOKXMTBLQPBL-UHFFFAOYSA-N 427.288 4.382 10 10 IICE COc1cc(C=C2SC(=S)N(CCCC(=O)Nc3cccc(C)c3)C2=O)ccc1O 2314831779 RTROCKFTQLKNDX-UHFFFAOYSA-N 442.562 4.329 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccccc1Cl)N2)N1CCOCC1 14466048 VPUUIAYDDUFWLK-HOIFWPIMSA-N 430.957 4.187 10 10 IICE COCCCN1C(=O)/C(=C\c2cc3ccccc3nc2N2CCCCC2)SC1=S 97595359 ANSYNLBNAFBQRX-XDJHFCHBSA-N 427.595 4.463 10 10 IICE Cc1cccc(N2C(=O)C[C@H](N3C(=O)/C(=C/c4ccc(Cl)cc4)SC3=S)C2=O)c1 101973961 CDKWFMDEUHXLAP-IUPCOXQMSA-N 442.949 4.182 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2cccc(F)c2)N(C)C)c(C)n1-c1ccc2c(c1)OCCO2 106098617 XAAOHBVSTMMLLT-QFIPXVFZSA-N 437.515 4.037 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)ccc1OCCC(=O)O 210444353 VWKGRVPRYMCGIN-PDGQHHTCSA-N 429.519 4.263 10 10 IICE COc1ccccc1[C@H]1CCN(C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)C1 435863722 XRXKNEYDISQALZ-FQEVSTJZSA-N 431.580 4.433 10 10 IICE Cc1ccc(-c2nnco2)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 444027271 CQYMVWDAUSZJGK-UHFFFAOYSA-N 429.524 4.405 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(S(=O)(=O)C[C@H]3CCCO3)cc2)cc1 731336796 SNSFPEGCVZSGJV-JOCHJYFZSA-N 438.549 4.299 10 10 IICE COc1ccc(OCC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)c(C(N)=O)c1 748034865 YDUATGSAYSYZKS-UHFFFAOYSA-N 446.425 4.482 10 10 IICE Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)nc(C)n1 755167030 MRORUVPKUOTKMT-UHFFFAOYSA-N 442.313 4.303 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1cccc(Br)c1O)c1ccccc1 765754688 VXJDUNPWRDQLOD-UHFFFAOYSA-N 425.282 4.337 10 10 IICE C[C@@H](NCc1cc(Cl)ccc1N1CCOCC1)c1cc(Br)ccc1O 798935971 YLURNVSXLOEPTA-CYBMUJFWSA-N 425.754 4.496 10 10 IICE C[C@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)c1ccc(N2CCCCC2)c(F)c1 800993689 MSHJKKRVZQHDFB-FPOVZHCZSA-N 425.548 4.147 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)Nc2nnn(Cc3ccc(C(F)(F)F)cc3)c2C)c1 801796819 CAZPAFIUNQJFND-LBPRGKRZSA-N 449.433 4.251 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802683895 CHGYUKJTRMOOKU-IRLDBZIGSA-N 435.572 4.004 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 804732954 GMTDXUPGZBICOG-HNNXBMFYSA-N 432.362 4.278 10 10 IICE CCSc1cccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 1129558648 RDNLMGUJXNZTJO-UHFFFAOYSA-N 446.484 4.412 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(Cc3ccccc3)C[C@@H](O)C(F)(F)F)ccc21 1138152169 BPESIAFAWDIZCS-JOCHJYFZSA-N 448.485 4.470 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4ccc(F)cc4Cl)CC3)CC2)cc1F 1231397718 ZTZGQHPBTJAAEV-UHFFFAOYSA-N 435.902 4.190 10 10 IICE C[C@@H](CN(C)C(=O)OC(C)(C)C)C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1264452612 VRLXPTXRAVEMBG-SFHVURJKSA-N 429.561 4.377 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CSc3nc(C)nc4sc(C)c(C)c34)C2)cc1 1278861999 UIUSJGAXXCQZNH-MRXNPFEDSA-N 442.610 4.112 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCC23CCOCC3)c(C)n1-c1ccc(Br)cn1 1296880634 CJOXOMMWVYSKRQ-GOSISDBHSA-N 432.362 4.331 10 10 IICE CC1(C)CC[C@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)N(C(=O)OC(C)(C)C)C1 1302454148 KSTDWAWOMICXHD-CQSZACIVSA-N 434.558 4.468 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1C 1313548842 ZZDOSGBMGJIERM-HKUYNNGSSA-N 434.588 4.066 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(C)(C)COCc3ccccc3)cc2F)C[C@H](C)O1 1354660011 ZFBBOMZRRFGQRN-OALUTQOASA-N 428.548 4.299 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cccn2ncc(Br)c12 1440681565 HEQDTRMFMQVRIC-UHFFFAOYSA-N 427.346 4.359 10 10 IICE CC(C)c1cccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1444506025 LGOQDQYRTWDTMX-OAQYLSRUSA-N 426.561 4.267 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(COc4ccccc4)cc3)cc2F)CC1 1456131632 USAXXRAHGMGPIV-UHFFFAOYSA-N 447.554 4.477 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](C)COc2c(F)cccc2F)CCCC1 1461479740 RIXALDBLVNCUOX-OAHLLOKOSA-N 428.479 4.391 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1478375938 FGCCUSFIBMPFRW-IBGZPJMESA-N 433.911 4.302 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@@H]2CCSC2)n1Cc1ccc(N2CCSCC2)cc1 1495071639 ILJWAVSEDHYNSI-YLJYHZDGSA-N 431.675 4.335 10 10 IICE CCc1nnc(N2CC[C@H](c3ccccc3OC)C2)n1CCCSc1nccs1 1498922081 FRSSJXVHGYVDES-INIZCTEOSA-N 429.615 4.482 10 10 IICE C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528260906 AKPATOWNBMLXET-INIZCTEOSA-N 432.511 4.183 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(Br)=NN1c1ccc(C)cc1 1544093284 BOLBPGZCVWQCDF-FQEVSTJZSA-N 443.389 4.397 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cccc(-n2ccc(C(F)(F)F)n2)c1 1544408935 JYOUQBWCRGKQJE-UHFFFAOYSA-N 446.498 4.374 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OC2CCCC2)nc1 1545632584 PNBHZUFDVPRCAZ-LJQANCHMSA-N 429.948 4.156 10 10 IICE COc1ccc(-c2cnc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)n2C)cc1 1556820127 MRQCWVAURJNBBL-UHFFFAOYSA-N 442.519 4.497 10 10 IICE CC1(CC(F)(F)F)CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1557005082 FYHOGZBFSIGJHP-ZSOIEALJSA-N 446.491 4.218 10 10 IICE O=C(Nc1ccsc1C(=O)NCc1cccc(O)c1O)c1ccc(Br)cc1 1558159274 CSPXJSFLJMEKFZ-UHFFFAOYSA-N 447.310 4.104 10 10 IICE Cc1ccc(C[C@H](CO)NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)cc1 1567609836 JELDCCVUYDTPQI-HXUWFJFHSA-N 441.369 4.498 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc2c(c1)CCN(C(=O)OC(C)(C)C)CC2 1568737992 WETDSXCPCQEHLK-UHFFFAOYSA-N 445.556 4.144 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1nc(C(F)(F)F)co1 1583750003 DZGUDLZHDKLPGR-XFFZJAGNSA-N 445.419 4.063 10 10 IICE CC[C@H](C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1586061355 PLKYEVSEIPHHJV-SFTDATJTSA-N 432.406 4.428 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc2c(s1)CN(C(=O)OC(C)(C)C)CC2 1617047720 QVDJHANFCKKYOE-UHFFFAOYSA-N 429.586 4.346 10 10 IICE CCOC(=O)CN(Cc1csc(COc2ccc(C)cc2)n1)Cc1ccccc1O 1618720482 DTQMFYRXKNIPGV-UHFFFAOYSA-N 426.538 4.301 10 10 IICE Cc1cc(C(=O)N2CCOc3ccccc3C2)c(C)n1-c1ccc(Br)cn1 1626279185 KOBDQNVLHHUBNB-UHFFFAOYSA-N 426.314 4.286 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4cccc(F)c4)CC3)c2C)c1 1633422089 VRNBEBSXQMGVKV-UHFFFAOYSA-N 433.527 4.448 10 10 IICE COc1cc(OC)cc(N2CC[C@H](NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)c1 1634972059 GORDLLCHZDEELT-FQEVSTJZSA-N 433.552 4.428 10 10 IICE Cc1noc(Cc2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc2)n1 1639720009 MCLCKUHNYMFUPR-UHFFFAOYSA-N 428.492 4.370 10 10 IICE Cc1cc(C(=O)N2CCCNC(=O)[C@H]2Cc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1641595856 GFIJEXBQSKCSGD-HSZRJFAPSA-N 435.955 4.321 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N(C)C[C@]2(O)CCN(Cc3ccccc3)C2)c1C 1642593703 KDFIDLVJESWHKR-HHHXNRCGSA-N 431.580 4.112 10 10 IICE CCC[C@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1=O 1643644135 NYNKKWDXRUSDQG-NRFANRHFSA-N 446.345 4.150 10 10 IICE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@H](C)c1ccccc1O 1643741850 CDNGMUDDNXUAAZ-SJORKVTESA-N 430.504 4.497 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)N1Cc2cccc(O)c2C1)c1ccc(Br)cc1 1644088112 FWIWHZBPXACOSS-SFHVURJKSA-N 447.329 4.263 10 10 IICE Cc1cc(CC(=O)NCC[C@@H](NC2CC2)C(F)(F)F)c(C)n1-c1ccc(Cl)cc1 1651257709 GYSLDMNDDJMICZ-LJQANCHMSA-N 427.898 4.479 10 10 IICE Cc1cccnc1[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)(C)C 1655823842 NEANRBVBQBOCLL-AREMUKBSSA-N 441.531 4.481 10 10 IICE Cc1cc(CNC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)c(C)n1-c1ccccc1 1683307515 INIPJBRMGDIDCB-DEOSSOPVSA-N 430.552 4.431 10 10 IICE CCN(CC)[C@@H](C)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695609800 HEXQSNFVFUKMCW-FQEVSTJZSA-N 440.636 4.001 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC=CO1 1743723450 FKQDCXPTGQJGEF-KNQAVFIVSA-N 425.577 4.210 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1744820445 YGJWRVVXRIRWDV-DENIHFKCSA-N 425.621 4.283 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC[C@@H]3CCO[C@@H](C)C3)CC2)cc1 1748847991 OKIJYSOEEQOFJL-LEWJYISDSA-N 441.620 4.332 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1764086430 ZKQMUAPOSUUPAG-UHFFFAOYSA-N 432.576 4.156 10 10 IICE O=Cc1cnc(Sc2cc(I)ccc2Br)s1 1900817989 KEMGVLPHQFQVKN-UHFFFAOYSA-N 426.098 4.474 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](CNCc2ccc(Br)cc2O)(C2CC2)C1 1967777370 GPMLPWHDVLFTKE-FQEVSTJZSA-N 425.367 4.282 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@H](NCc3cccc(Br)c3O)[C@H]2C1 2092943088 HDCSSKJHYMIZMC-YQQAZPJKSA-N 425.367 4.280 10 10 IICE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCc1c(Br)ccc(OC)c1O 2236054299 HBODBDNQYUFMFK-XJKSGUPXSA-N 443.382 4.289 10 10 IICE COc1ccc(C=C2C(=N)N3N=C(Cc4ccc(Cl)cc4)SC3=NC2=O)cc1OC 2297468294 YMGHRZFWBCJQMV-UHFFFAOYSA-N 440.912 4.219 10 10 IICE Cc1ccc(CN(C)C(=O)CC2(NC(=O)OC(C)(C)C)CCC2)c(O)c1Br 2380760453 XTWDHHPMYAJPQH-UHFFFAOYSA-N 441.366 4.259 10 10 IICE CC(C)=CC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2381139016 ZGGURVPSXXQCGC-HNNXBMFYSA-N 441.366 4.329 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccccc3F)SC2=S)cc1 15047498 YZLRGYISSHDSDR-FDIDITGRSA-N 430.526 4.453 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(\C)NCc2ccco2)cc1 17097894 HWMKUGDLVJCHSB-RCCKNPSSSA-N 432.436 4.011 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@@H](c2ccncc2)c2ccc3cccnc3c2O)c1 54620941 IOQYMUINRZGNGX-NRFANRHFSA-N 443.459 4.110 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 226834427 OSCRUMCLLZLPJU-XFQAVAEZSA-N 427.526 4.498 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@H](NCc1c(O)cccc1Br)C2 706831865 QUEWKCNRPJRULF-DBVUQKKJSA-N 445.357 4.434 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3c(-c4ccc(F)cc4)noc3C)cc2F)CC1 730194495 JNVKTOKXBYVNBM-UHFFFAOYSA-N 440.494 4.000 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1c(O)ccc3c1CCCC3)O[C@@H](C)C2 743600238 SLBUEKXICUJSEG-WQFQCULDSA-N 436.552 4.348 10 10 IICE COc1ccc(Br)cc1[C@@H](NCc1cc(Cl)cc(Cl)c1O)C(=O)O 756379258 LTMLUUFSLGDDKV-CQSZACIVSA-N 435.101 4.386 10 10 IICE COC(=O)c1ccc(O)c([C@@H](C)Nc2cc(C(=O)N3CCCCCC3)ccc2OC)c1 757588921 CDHRANDXLSQRDV-MRXNPFEDSA-N 426.513 4.377 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)C1 766709731 CBPHVCLKVDVTKM-HXUWFJFHSA-N 446.595 4.272 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H](c1ccccc1)[C@@H]1CCOC1 772495017 PRFCVVGWMOZCPC-KNKQGSTJSA-N 445.510 4.334 10 10 IICE Cc1c([C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)nnn1-c1ccc(F)cc1 773143619 BPWSXPYKFNHEME-LJQANCHMSA-N 448.590 4.098 10 10 IICE CCCN(Cc1cc(C(C)=O)cc(CN2CCOCC2)c1O)[C@@H]1CCCc2cccnc21 774607553 SJQLVKJXLYAECD-XMMPIXPASA-N 437.584 4.112 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(CCN(C(=O)NCCCSc3nccs3)C2)C1 802244684 ZXUCNVNZJWLARQ-FQEVSTJZSA-N 440.635 4.058 10 10 IICE O=C(Cc1cscc1Br)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 814412974 ZDWOXDNHZXIUJZ-CYBMUJFWSA-N 445.329 4.440 10 10 IICE CCOC(=O)c1ccccc1N(C)C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2 1125897364 WUULHVLAMPCTRO-UHFFFAOYSA-N 438.524 4.433 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(C2CC2)ccn1 1129512272 NKJGBCFKPMWHGN-GZTJUZNOSA-N 427.526 4.328 10 10 IICE Cc1cc(CNC(=O)CCCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccccc1 1132048434 VCGPNNHSJZRGJP-UHFFFAOYSA-N 429.520 4.177 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 1142728127 MOBHPPQTTMWXGT-GOSISDBHSA-N 444.318 4.168 10 10 IICE CC(C)c1ccc(O[C@@H](C)CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1228060285 UMEJMZWDWDPCAB-KRWDZBQOSA-N 447.526 4.192 10 10 IICE CC[C@@H]1CN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC[C@@H]1NC(=O)OC(C)(C)C 1230194817 GBLUVIZBZWNXEG-JQVVWYNYSA-N 446.636 4.327 10 10 IICE O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1252903107 TZRPIIZLWNGSMQ-ICSRJNTNSA-N 443.975 4.263 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2C)c1 1253833603 IUGUUVDDBJYSDN-HXUWFJFHSA-N 426.561 4.211 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC[C@H](O)c2ccc(-c3ccccc3)cc2)N(C)C)cc1 1256236295 FLHAWPPBHKLBQR-FTJBHMTQSA-N 446.595 4.055 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N3CCCC3)cc2)cc1I 1290778372 QRCQPCTZPRVVIV-UHFFFAOYSA-N 434.321 4.438 10 10 IICE C[C@@H]1CCC[C@@](Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1291066148 KBYZLXQFBIEWSK-KBMIEXCESA-N 434.588 4.193 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cccn(CC)c1=O 1306786739 RJGZBTXDPQVGAP-UHFFFAOYSA-N 444.583 4.429 10 10 IICE CCc1csc(CC2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CC2)n1 1313410864 GPLZBKWNAJZZPY-JOCHJYFZSA-N 443.661 4.039 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 1358433162 JXPHAOJANWUNAG-FQEVSTJZSA-N 439.556 4.488 10 10 IICE Cc1c(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)nnn1CCOc1ccc(F)cc1 1436224895 HYDCDUHCDRIFHS-UHFFFAOYSA-N 433.487 4.464 10 10 IICE CCC(CC)[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)N1CCOCC1 1448445675 CASUKZCEEGDXFU-MBSDFSHPSA-N 436.040 4.330 10 10 IICE Cc1cc(C(=O)COc2ccc3c(c2)CCNC3=O)c(C)n1-c1ccc(OC(F)F)cc1 1459111796 LNJKZSMAZNGIDZ-UHFFFAOYSA-N 440.446 4.243 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(OCCCN3CCN(C)CC3)cc2)cc1 1461337735 YGTGDFAZBBGSGB-UHFFFAOYSA-N 446.595 4.363 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C[C@H]2NC(=O)c3ccccc32)cc1 1465014043 XAMOMBJRNUFQFL-XMMPIXPASA-N 429.520 4.169 10 10 IICE COc1ccccc1N1CC[C@@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1466034875 MGILOEMDKISNQL-JOCHJYFZSA-N 431.536 4.232 10 10 IICE CCc1c(C(=O)NCc2cc(Cl)cc(Cl)c2O)nnn1-c1cccc(Cl)c1 1468665931 COJCLZDJOVYWOH-UHFFFAOYSA-N 425.703 4.426 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC[C@H]1CCC[C@@H]1c1ccccc1 1478714101 ZARGAURIXATQGH-WOJBJXKFSA-N 429.511 4.185 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3[C@H]4CC[C@H]3CC(CC(F)(F)F)C4)C2)cc1 1478861225 WNRBZYJBCUMNNW-MNEFBYGVSA-N 425.495 4.427 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)O1 1479233071 UBFGYESWYYDSBQ-UKRRQHHQSA-N 439.272 4.186 10 10 IICE CCCN1CCC(N(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1500972944 RZFQUYAMRVQAHK-UHFFFAOYSA-N 428.600 4.110 10 10 IICE COCCOc1ccc(Cl)cc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1515924331 GAZQCHFILBUNOU-UHFFFAOYSA-N 435.863 4.393 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCc3nccs3)CC2)cc1 1518307009 BWCGFFKHYLVNOZ-UHFFFAOYSA-N 440.617 4.216 10 10 IICE COc1cccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1OC 1537657034 LGEZTTGPQFWOAW-VBKFSLOCSA-N 448.591 4.385 10 10 IICE Cc1cc(C(=O)NCCCN2CCCC[C@H]2C)c(C)n1-c1ccc(Br)cn1 1539017527 OLGYGLSSHAVRQG-OAHLLOKOSA-N 433.394 4.246 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccccc3S(=O)(=O)C3CC3)ccc21 1539069813 BKKVQQTVSMDWBQ-UHFFFAOYSA-N 426.538 4.093 10 10 IICE Cc1cc(C(=O)NCCC(=O)NC2CCCCC2)c(C)n1-c1ccc(Br)cc1 1543378423 QZMFMJPSMSVVSE-UHFFFAOYSA-N 446.389 4.425 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(CO)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1545429305 ILWJVSGWEWJPDI-HXUWFJFHSA-N 425.621 4.285 10 10 IICE Cc1onc(-c2ccccc2Cl)c1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1557640995 ZYSUWTFNTODPEN-UHFFFAOYSA-N 425.916 4.195 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)c1ncnc2ccc(I)cc12 1559135025 UBRSVZJDAWQDMK-UHFFFAOYSA-N 432.309 4.327 10 10 IICE CCOC(=O)c1c(C)nc(O)nc1SCC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 1559461197 MMLHTQPPZXCJPP-UHFFFAOYSA-N 443.500 4.189 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](c3ccc(C(C)C)cc3)C(C)C)CC2)cc1 1559708310 PQKWROBCYDJACR-AHKZPQOWSA-N 439.644 4.288 10 10 IICE COc1ccc(N2CCN(Cc3cccc(Cl)c3Br)CC2)c(OC)c1 1560082563 FUUHSFDSECWVGB-UHFFFAOYSA-N 425.754 4.442 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3c[nH]c4ccc(Br)cc34)C2)cc1 1570565571 TYCCEBWSFNEOMG-OAHLLOKOSA-N 442.357 4.124 10 10 IICE Cc1ccc(Br)c2[nH]c(C(=O)NCc3ccc(N4CCOCC4)cc3)cc12 1583334471 IPYHLQGIQLVUJQ-UHFFFAOYSA-N 428.330 4.005 10 10 IICE C[C@H]1CCC[C@H](N(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1612743094 GNTZWLSSIUTUAC-RDJZCZTQSA-N 431.635 4.332 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1612952351 DGLTXPDPPJNRQN-KDURUIRLSA-N 443.661 4.082 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@@H]3CC[C@@]32CNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1612988709 UACIUWCLKFWKLZ-WOOQXSNZSA-N 445.516 4.055 10 10 IICE Cc1cc(Br)ccc1[C@H]1CCCN1CC(=O)NCc1ccc(N(C)C)cc1 1620487863 HDVCNDODRSCVAX-OAQYLSRUSA-N 430.390 4.277 10 10 IICE Cc1cc(NC(=O)c2ccco2)sc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1627463691 CBVCGWSOHGPGJL-GOSISDBHSA-N 440.569 4.001 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1C1CCOCC1 1630262291 JWTIMQDPLHDCTR-HXUWFJFHSA-N 445.991 4.210 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(-c3cnn(C)c3)nc3c(C)c(C)ccc23)c1 1630374223 ZCPHGZIYYRRTJT-MRXNPFEDSA-N 430.508 4.457 10 10 IICE Cc1cc(C(=O)Nc2cncnc2-n2cccn2)c(C)n1-c1ccc(Br)cc1 1631420640 SICDYSOUAZANMG-UHFFFAOYSA-N 437.301 4.085 10 10 IICE Cc1ccc(C(=O)N2CCOC[C@H]2C[C@H](O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1635456804 VVADUVLLMDCDMD-RSXGOPAZSA-N 446.547 4.180 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)N[C@@H](C)c1ccccc1O 1642827699 PLSPLJSOVHXRRZ-HNNXBMFYSA-N 428.485 4.132 10 10 IICE CCOC(=O)c1cc([N+](=O)[O-])c(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1C 1650651776 YEHIGYFTTAAAEC-IYBDPMFKSA-N 445.491 4.445 10 10 IICE CC(C)[C@](C)(Cc1ccccc1)NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1673472504 ONVJVHGRWXISPR-DEOSSOPVSA-N 431.527 4.258 10 10 IICE C[C@H]1CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CCc2ccc(Cl)cc21 1683195924 SRDOEORSPZPQFJ-HNNXBMFYSA-N 449.929 4.326 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3Cc4cccc(Br)c4C3)C2)cc1 1686854885 IBWOXNAEWRFIMI-HNNXBMFYSA-N 430.346 4.009 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C)OC 1693974207 MOMJNQPNJTYVDA-DENIHFKCSA-N 443.636 4.362 10 10 IICE CC[C@H](C)c1nnc(N2CCN(C3CCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1694130189 RBCWWBIKCYLCGK-SFHVURJKSA-N 428.600 4.110 10 10 IICE CCO[C@@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1696221116 VTEQZBLHIYCXEE-LJQANCHMSA-N 443.592 4.189 10 10 IICE CO[C@]1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CC(C)C)CCOC1 1697226971 ORSUOIGQZODWEH-VWLOTQADSA-N 437.588 4.250 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CC1 1697823043 XGWFNGTZWUHNJD-LJQANCHMSA-N 435.572 4.170 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1=CCCOC1 1730682981 ZDAWNNYNWBLEGM-UHFFFAOYSA-N 435.572 4.172 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C)C3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1742118454 FOOJRNPKCXGKPU-IBGZPJMESA-N 448.615 4.361 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2Cc2ccc(Cl)s2)CCOC1 1765827162 CKMRNQKDDDLTAR-NRFANRHFSA-N 448.976 4.035 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3ccc([N+](=O)[O-])s3)SC2=S)N(C)C)cc1 1858594450 ZWVFVHDTJLBIGE-BMANGOCTSA-N 449.579 4.169 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3ccc(OC(=O)c4ccccc4)cc3)CC2)cc1 1874742774 FPCBSLJZCQOZFV-UHFFFAOYSA-N 444.531 4.309 10 10 IICE CCOC(=O)N1CCN([C@H](c2cc(C)ccn2)c2cc(Cl)c3cccnc3c2O)CC1 2059179316 WQEMSPVTIIIBEJ-NRFANRHFSA-N 440.931 4.161 10 10 IICE COc1ccc([C@@H](n2nc(C3(C)CC3)c(C(=O)O)c2Br)C2(C)CC2)c(O)c1 2080030275 KPBLHPYWGOJBMR-MRXNPFEDSA-N 435.318 4.499 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(NCc2cccc(Br)c2O)C[C@H]2CC[C@H]1C2 2131760043 HVBBSPORHRASOF-KPHUOKFYSA-N 425.367 4.328 10 10 IICE CC1=CC2=NC(=O)C(=Cc3ccc(OC(=O)c4ccc(F)cc4)c(Cl)c3)C(=N)N2O1 2297347671 RUGLICUPILMACG-UHFFFAOYSA-N 425.803 4.149 10 10 IICE COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(C=C2NC(=O)N(c3ccccc3)C2=O)c1C 2297357996 OHAVXDVESAJDJO-UHFFFAOYSA-N 432.436 4.108 10 10 IICE COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)NCCSc1ccc(C)cc1 2313681692 KZWXITXKHXTOIQ-UHFFFAOYSA-N 441.528 4.056 10 10 IICE COc1ccc(C=CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)c(OC)c1 2325219647 WHISOGCCDYLSID-XMMPIXPASA-N 437.584 4.126 10 10 IICE CCOc1ccccc1NC1=NC(=O)/C(=C2\C(=O)Nc3ccc(Br)cc32)S1 33930321 GUENVXIKSKJLKQ-FOCLMDBBSA-N 444.310 4.253 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccccc3SCc3noc(C)n3)CC2)cc1 108431913 CJZHVEPQVXCOEU-UHFFFAOYSA-N 438.553 4.031 10 10 IICE [N-]=[N+]=NCCC(=O)Nc1ccc2c(c1)C1(OC2=O)c2ccc(O)cc2Oc2cc(O)ccc21 202900651 DJFJQDSVINRLOC-UHFFFAOYSA-N 444.403 4.305 10 10 IICE CCc1ccccc1N1C(=O)/C(=C/c2ccc(OC)c(OC)c2C(=O)O)SC1=S 210401560 VVZQXGCGMGOPTE-WJDWOHSUSA-N 429.519 4.370 10 10 IICE Nc1ccc(CCC(=O)Nc2ccc(I)c(Br)c2)cc1 312758413 LTLBZBYOVGVNSB-UHFFFAOYSA-N 445.098 4.207 10 10 IICE COc1ccc(CNc2ccc(I)cc2Br)c(O)c1 388524839 KDYBJIIJWUYRQR-UHFFFAOYSA-N 434.071 4.380 10 10 IICE C[C@@H]1[C@H](NCc2cccc(Br)c2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709348203 VLYXEYUQGHTRQE-ODVANORSSA-N 425.367 4.421 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc(Br)cn2)c(C)n1-c1ccc(F)cc1 727552509 HBMIERYJLOTCAK-UHFFFAOYSA-N 431.261 4.430 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccc2nccn2c1 733969536 KOEJZJUPLJIJBN-RVDMUPIBSA-N 428.564 4.016 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 758179070 OJQQVZLYGWEKSV-FGZHOGPDSA-N 445.604 4.003 10 10 IICE COc1ccc(OC(F)F)c(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768671299 YVHCYBPUAAOERH-UHFFFAOYSA-N 431.527 4.118 10 10 IICE C[C@@H](NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(N2CCOCC2)c(F)c1 773082854 XCPZHNFFJLEPQK-SJLPKXTDSA-N 440.481 4.183 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(=O)N2CCCC2)C1 801843187 HUCSONTWECUUGV-NRFANRHFSA-N 446.599 4.211 10 10 IICE CCOc1c(Cl)cc(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1Cl 1084225109 CVXVVYZFBLOYDP-XFFZJAGNSA-N 439.295 4.363 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1 1125251093 LNFKDJCLUJTXCH-FYYLOGMGSA-N 443.385 4.474 10 10 IICE Cc1cc(C(=O)N2CCC(N3CCCCC3)CC2)c(C)n1-c1ccc(Br)cn1 1136418422 HOSPZLHJWPMLLY-UHFFFAOYSA-N 445.405 4.342 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2cc(Br)cc(C)c2o1 1142690189 IMXRKUAGZDELEG-UHFFFAOYSA-N 446.297 4.415 10 10 IICE FC(F)(F)Cn1c(-c2ccccc2)cnc1SCCn1cnc(Br)n1 1188692285 PGSACYSYUXWJHJ-UHFFFAOYSA-N 432.269 4.259 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)c1O 1191899131 JAFRMZKRLNDFQV-GOSISDBHSA-N 426.900 4.389 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1 1230200326 IIGADZKSXGEGLC-APWZRJJASA-N 432.971 4.363 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H]3CCN(c4ccccc4Cl)C3)C2)cc1 1230300644 HRDMBQVYQJKXEI-OALUTQOASA-N 442.991 4.001 10 10 IICE Cc1c(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cnn1C 1289250065 UYVCWZOBLNLLOK-UHFFFAOYSA-N 435.620 4.194 10 10 IICE Cc1cc2n[nH]cc2cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1296363003 PZUYLOCGCDYGSW-GIJQJNRQSA-N 440.525 4.240 10 10 IICE C[C@H](NC(=O)c1cc(I)ccc1Br)c1ccccc1O 1302538446 RGHKLYZRBPCEHJ-VIFPVBQESA-N 446.082 4.250 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(C)c3ccccc3Oc3ccccc3)CC2)cc1 1307541171 HECICGVREDUZDT-QHCPKHFHSA-N 447.579 4.107 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1312405839 XNEDFLWRZCLKAM-MJGOQNOKSA-N 447.023 4.309 10 10 IICE CC(C)(C)C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1(C)C 1313305527 QETFKDFZUVETEN-FQEVSTJZSA-N 428.621 4.135 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)Cc4ccc(C(N)=O)nc4)n3)c2C)cc1 1348292604 KEFKVUWQVAGEMD-UHFFFAOYSA-N 445.548 4.201 10 10 IICE CCOC(=O)[C@@]1(COC)CCCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1 1448192439 NRPQVUCICULWSZ-QHCPKHFHSA-N 432.948 4.179 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3ccccc3[C@H]2O)c(C)n1-c1ccccc1Br 1457015297 SACPHTVZQIJKQI-TZIWHRDSSA-N 425.326 4.245 10 10 IICE Cc1ccn(CC(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)c(=O)c1 1457527720 LNLIFAVPLZZRST-UHFFFAOYSA-N 436.512 4.466 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccc(Cl)c2)cc1 1463775120 GKOGMBUFTPWEGY-FYYLOGMGSA-N 427.976 4.364 10 10 IICE Cc1cc(C(=O)NCCC(=O)OC2CCCCC2)c(C)n1-c1ccc(Br)cn1 1467456471 MKIIVBFBORAIIT-UHFFFAOYSA-N 448.361 4.247 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1 1470465478 GSNGGOVTFMRQNA-YSIASYRMSA-N 431.577 4.349 10 10 IICE CC[C@H](NC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)[C@H](c1ccc(C)cc1)n1cncn1 1470556591 XZKNAHNHVWUTQD-YNJKOYDBSA-N 448.615 4.259 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3cccc(Br)c3)C2)cc1 1470592833 HULXUFWWQKXLDM-QGZVFWFLSA-N 432.362 4.126 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccccc3[N+](=O)[O-])cc2Cl)C1 1478528038 LERGYBODTREXSA-INIZCTEOSA-N 445.951 4.396 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCNC(=O)NCc1cccc(Cl)c1O)Cc1ccccc1 1479119589 GKARCMZNIFICKL-SFHVURJKSA-N 447.963 4.371 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccsc1 1510675074 RWPSTBPMAFGFFJ-HXUWFJFHSA-N 425.602 4.293 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c(C)nn(Cc4ccccc4)c3Cl)C2)cc1 1529705899 BURXVNXEZSXMJX-LJQANCHMSA-N 438.959 4.158 10 10 IICE Cc1cc(CC(=O)NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c(C)n1-c1ccccc1 1532035405 RHYONXHSIQGBHF-UHFFFAOYSA-N 438.959 4.039 10 10 IICE Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)NCc4cc(Cl)ccc4O)cc3C2=O)c1 1557385939 MSRFUMUCSMYFBC-UHFFFAOYSA-N 434.879 4.393 10 10 IICE COC(=O)[C@H]1C[C@@H](C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)C1 1558919658 XGILNAXZMCIERK-KHYOSLBOSA-N 434.458 4.497 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CC=C(c4ccc(F)cc4)CC3)CC2)cc1F 1564441775 WRUBMIDGAVXPBZ-HXUWFJFHSA-N 427.495 4.441 10 10 IICE CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)NCc1c(O)cccc1F 1564599782 XOXDVQBKQVKMNV-MRXNPFEDSA-N 439.325 4.131 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CC[C@H](c2cccc(Cl)c2)C1 1564908792 XGEQFFILFNPBRO-PZJWPPBQSA-N 427.976 4.437 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)OCc2ccc(Cl)cc2)CCCC1 1566810209 UBNAADVIUSVNKU-UHFFFAOYSA-N 440.927 4.042 10 10 IICE Cc1c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cnn1CCO[C@@H]1CCCCO1 1587027488 SVDSOOHRBLMPHF-XMMPIXPASA-N 436.556 4.072 10 10 IICE CC(C)(C)c1nnc(N2CCc3ccc(O)cc3C2)n1CCCSc1nccs1 1597083606 OEXGBJFQMXQMSW-UHFFFAOYSA-N 429.615 4.483 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(C(=O)c3ccc(F)cc3F)CC2)c1C 1611051497 KXRUNTFXEHOQQQ-UHFFFAOYSA-N 437.490 4.279 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H](CS(C)(=O)=O)c3ccccc3)cc2Cl)C1 1617899462 AAJJGWMUZNZYRP-FXAWDEMLSA-N 449.016 4.021 10 10 IICE C=CC(=O)Nc1ccc(O)c(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1617901957 VQJVTCIGOSDTCV-OAHLLOKOSA-N 427.932 4.336 10 10 IICE COc1ccccc1Nc1ccc(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 1618148482 KUPRWJBPKGSJRC-UHFFFAOYSA-N 444.535 4.393 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 1622664204 LHNVOBYFJXFPLQ-QFIPXVFZSA-N 436.552 4.422 10 10 IICE CCOC(=O)C1(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCC1 1628311977 GUWOELGPPWQVJF-UHFFFAOYSA-N 433.346 4.320 10 10 IICE CCN(C[C@H]1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)C1)CC(F)(F)F 1629505853 BVNSBSZEZCGKOW-GOSISDBHSA-N 435.490 4.253 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)[C@@H]1SC 1630905425 USHWAVRKVBBSQF-QRVBRYPASA-N 437.403 4.495 10 10 IICE CC[C@H](C)Oc1cc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccn1 1631551227 HZZBXKWUSOLVCY-IBGZPJMESA-N 434.584 4.297 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Oc2ccccc2Cl)nc1 1633789348 IJGPCJVJXLCMGV-UHFFFAOYSA-N 437.927 4.418 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC(C)(C)CC3CCCCCC3)CC2)cc1 1634231131 NFBMYXQEUUHXOX-PFONDFGASA-N 441.616 4.155 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ncccc4F)CC3)cc2Cl)C1 1634720228 REOFDAYHPRXVKK-QGZVFWFLSA-N 445.970 4.142 10 10 IICE CCOCCN(C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1CCc2ccccc21 1636353828 KOWUVCRITWSFKK-NLFFAJNJSA-N 437.584 4.257 10 10 IICE C[C@@H](N[C@H](C)c1cccc(F)c1F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1642514613 OTRJEWVWJNRSGW-ZIAGYGMSSA-N 434.442 4.418 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCN(CC(F)F)C2)c(C)n1-c1cccc(Br)c1 1650898921 UVQFRHXTUURDFQ-HNNXBMFYSA-N 440.332 4.173 10 10 IICE Cc1cc(C(=O)Cn2nnc3ccccc3c2=O)c(C)n1-c1cccc(C(F)(F)F)c1 1651653454 DNOXGQLCZXCUOB-UHFFFAOYSA-N 426.398 4.101 10 10 IICE COc1ccccc1N1CCCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CC1 1653651783 DWIDBKFAQMRBCQ-UHFFFAOYSA-N 445.563 4.197 10 10 IICE Cc1cccc(Cn2[nH]ccc2=NC(=O)CN(C)c2ccc(OCc3ccccc3)cc2)c1 1654172982 SFSSTODZFSSVMV-UHFFFAOYSA-N 440.547 4.316 10 10 IICE C[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1655549409 ZBLNXCLJEOHITC-HUUCEWRRSA-N 443.459 4.048 10 10 IICE COC(=O)c1cc(OCC(=O)Nc2ccc(N3CCc4ccccc43)cc2)ccc1N(C)C 1656825144 AUAWAVVCBZDATG-UHFFFAOYSA-N 445.519 4.251 10 10 IICE Cc1ccccc1CN1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 1687216765 IRLAGEZAMZYEMP-UHFFFAOYSA-N 430.596 4.472 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(N)=O)C1 1694979953 LPOCAODYIPDDRX-ZGNUIDRDSA-N 432.572 4.021 10 10 IICE CCOC[C@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1696380920 TXTVQIGIWAHUEB-FPOVZHCZSA-N 443.661 4.256 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1723318706 JGFRHSBCVWMMOS-OAQYLSRUSA-N 439.648 4.360 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)C)n2CCC2CC2)c(C)n1-c1ccccc1 1724203965 FJRUTYKNLXPTIK-UHFFFAOYSA-N 434.588 4.114 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@H]1CCO[C@@H](C)C1 1742940765 GVULNBWHYYLLDW-SFTDATJTSA-N 441.620 4.080 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1)C(C)(C)C 1748420305 IHIVMYNZEFAJOO-JOCHJYFZSA-N 437.588 4.250 10 10 IICE CCc1nnc(N(CCOC)[C@@H]2CC[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1762915398 BBAADGQUFSQKBN-SIKLNZKXSA-N 443.661 4.083 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N(C)CCC2CCOCC2)cc1F 1768495112 VGYOYDXXNYYFEP-UHFFFAOYSA-N 429.584 4.442 10 10 IICE COc1ccc(N2CCN(C(=O)CN(C(=O)C(C)(C)C)c3cc(C)cc(C)c3)CC2)cc1 1858112414 BASIFUDTWYVHMP-UHFFFAOYSA-N 437.584 4.040 10 10 IICE Cc1ccc(Cl)cc1NC(=O)COc1cccnc1NC(=O)Oc1ccc(N)cc1 1858682812 LLOKQUQXZAIVAB-UHFFFAOYSA-N 426.860 4.254 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(COc4ccc([N+](=O)[O-])cc4)c3)CC2)cc1 1872845996 HBPISLHVMQRTQZ-UHFFFAOYSA-N 447.491 4.145 10 10 IICE Cc1cc(-n2c(C)cc(C=C3NC(=S)N(Cc4ccccc4Cl)C3=O)c2C)no1 2040972145 WLZMPZVWLLBZDA-UHFFFAOYSA-N 426.929 4.302 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCC23CN(C(=O)OC(C)(C)C)C3)c1O 2236029565 BPPAFWMRSNFLPN-INIZCTEOSA-N 441.366 4.043 10 10 IICE Cc1cc(C=C2NC(=O)N(Cc3ccc(F)cc3)C2=O)c(C)n1-c1ccc2c(c1)OCO2 2296247667 ZUVDSLWWQFEICG-UHFFFAOYSA-N 433.439 4.055 10 10 IICE CCOc1c(C=C2SC(=S)N(CC(=O)OC3CCCCC3)C2=O)cccc1OC 2314739995 PIOZCXHLUXPVGK-UHFFFAOYSA-N 435.567 4.171 10 10 IICE Cc1ccc(CNC(=O)CCC2CC(NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380724799 CXKYITVNCRINNX-UHFFFAOYSA-N 441.366 4.163 10 10 IICE Cc1ccc(CNC(=O)C2(N(C)C(=O)OC(C)(C)C)CCCC2)c(O)c1Br 2380747076 RTQVCDLZHNFQDV-UHFFFAOYSA-N 441.366 4.259 10 10 IICE CCCOC(=O)CN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S 34781306 CQEXFBAMLFDPRG-CPNJWEJPSA-N 427.547 4.420 10 10 IICE O=c1[nH]c2ccc(-c3csc(NS(=O)(=O)c4ccc(Cl)c(Cl)c4)n3)cc2o1 71557509 CBNSRIOVPDKWBT-UHFFFAOYSA-N 442.305 4.352 10 10 IICE O=C(NN1C(=O)/C(=C/C=C\c2ccco2)SC1=S)c1ccc(Br)cc1 97492656 OKMQCLWZXYOPCX-CTPRGKITSA-N 435.324 4.145 10 10 IICE CCCCN1C(=O)/C(=C2/SC(=S)N(CCCCCC(=O)O)C2=O)c2ccccc21 206703002 WAQXPJCFTBQZMA-ISLYRVAYSA-N 432.567 4.050 10 10 IICE CCc1ccccc1NC1=NC(=O)/C(=C/c2ccc(OCCC(=O)O)c(OC)c2)S1 210449814 SLFZUPXKXCYGPA-UYRXBGFRSA-N 426.494 4.194 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 251331138 IPQSQFWUYLXWDV-XYHOUYMGSA-N 427.526 4.498 10 10 IICE CC(C)(C)OC(=O)N1CCC(OCCCNCc2c(O)cccc2Br)CC1 706846060 BAVFYDYDNMLAOQ-UHFFFAOYSA-N 443.382 4.051 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccccn3)cs2)c(Cl)cc1Cl 747857442 NCSHPQAPTBAZBM-UHFFFAOYSA-N 444.321 4.099 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(c2ccccn2)CC1 754351705 KWLVLMRKIQXMFF-QGZVFWFLSA-N 439.515 4.064 10 10 IICE O=S(=O)(Nc1nc(-c2ccc3c(c2)CCC3)cs1)c1ccccc1Cn1ccnc1 759473907 CECYFVWESZBALV-UHFFFAOYSA-N 436.562 4.344 10 10 IICE CCOc1ccc(O)c(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)c1 769221773 CTDIYIWDCWPRPP-UHFFFAOYSA-N 433.346 4.404 10 10 IICE CCOc1ccc([C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1[N+](=O)[O-] 773145102 ILGIHPHYOWVYNH-IBGZPJMESA-N 438.572 4.376 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(Br)cn1 794819057 XCJRQWZGEZEUTL-KRWDZBQOSA-N 429.406 4.227 10 10 IICE C[C@H](NC(=O)N1CC[C@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 801763820 NQZCJPTXGAAPDZ-MHECFPHRSA-N 430.593 4.246 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1ccc(Cl)o1 914439097 ABKGNOQZJGMMPP-LCYFTJDESA-N 426.972 4.292 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(-n4ccccc4=O)cc3F)ccc21 1130874227 RYSPFKFSQKYDIC-UHFFFAOYSA-N 433.483 4.447 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)s1 1141836800 UXFHTVKDGNJUHD-UHFFFAOYSA-N 437.565 4.213 10 10 IICE Cc1cc(C(=O)NC2CN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccc(Cl)cc1 1161547629 LRUHQUAWWMIJBN-UHFFFAOYSA-N 437.927 4.498 10 10 IICE C[C@H](N[C@@H](C)c1c(F)cccc1F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1176323220 SPBYCXXCASTAJN-KBPBESRZSA-N 434.442 4.418 10 10 IICE Cc1nc(CCC(=O)NCc2cccc(O)c2O)oc1-c1ccc(Br)cc1 1176564829 GBXOWCCKVUDBFC-UHFFFAOYSA-N 431.286 4.073 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H](CC(=O)OC(C)C)C2)c(C)n1-c1ccccc1 1253808400 RONLTLZZSSQRCV-NRFANRHFSA-N 425.573 4.400 10 10 IICE Cc1cn(C2CCOCC2)nc1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1270438745 BOTBSXQXBCOZCN-INIZCTEOSA-N 430.980 4.363 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCC2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291454622 FKGHPMLCPYCQLE-LJQANCHMSA-N 425.621 4.285 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C3CCC2(C)CC3)n1CCCSc1nccs1 1292014098 OYMPVGDXMKYWFR-UHFFFAOYSA-N 448.662 4.357 10 10 IICE Cc1ccc(N2N=C(Br)C[C@H]2C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1 1296647821 DGINQBROHPEPPX-KXBFYZLASA-N 429.362 4.226 10 10 IICE C[C@H](NC(=O)c1cc(Cl)cc(Br)c1O)c1ccc(N2CCOCC2)cc1 1306439937 SVUKNYGMTKGQQS-LBPRGKRZSA-N 439.737 4.136 10 10 IICE COC(=O)c1cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(F)cc1F 1352535961 GFDBWGCLOUMGNV-UHFFFAOYSA-N 428.435 4.232 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)nc(Br)c2)cc1 1354541071 MNVOLAROBXMLRU-UHFFFAOYSA-N 441.167 4.383 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)COc2ccc(Br)cn2)cc1 1355695853 GMIWAGJWDSPTKD-UHFFFAOYSA-N 444.329 4.111 10 10 IICE COc1ccc(N2CCCN(C(=O)C[C@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1441938653 XZAGAQOHASBXNC-IBGZPJMESA-N 433.593 4.063 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(N)c(OC(F)(F)F)c1 1445654435 MOMBUEQQSZMWIS-UHFFFAOYSA-N 433.224 4.298 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc([C@@]4(C)NC(=O)N(C)C4=O)cc3)c2C)c1 1452492052 ZQKHSPKUDUPWOD-RUZDIDTESA-N 430.508 4.052 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCOc2ccccc2Br)N(C)C)cc1 1463284220 RAMZODCXSDOKDJ-FQEVSTJZSA-N 448.405 4.093 10 10 IICE Cc1cc(CNC(=O)N[C@H]2C[C@H](C)S(=O)(=O)c3sccc32)c(C)n1-c1ccccc1 1478764503 VKGLIEVCHKTIQT-YWZLYKJASA-N 443.594 4.262 10 10 IICE CC[C@@H](C)N(C)CCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1496200986 ZKYISIYMPUOJSE-NFBKMPQASA-N 440.636 4.097 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC[C@@H]1C 1504501534 HGWQHPOKTLVNLZ-MAUKXSAKSA-N 444.630 4.149 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1510621641 YPTSGOQMWUFIGV-QGZVFWFLSA-N 425.602 4.065 10 10 IICE CCc1nnc(N2CCC[C@@H](OCC(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1513889079 KIBBHRNPTXFGEV-LJQANCHMSA-N 439.526 4.283 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@H](c1ccccc1)C(F)F)c2[N+](=O)[O-] 1533857805 KORGGSRKMDHCHT-GOSISDBHSA-N 436.370 4.106 10 10 IICE C[C@@H](NC(=O)c1cc2ccc(C(F)(F)F)cc2nc1O)c1ccc(N2CCOCC2)cc1 1542403174 MMYPEONRCDISEP-CQSZACIVSA-N 445.441 4.287 10 10 IICE O=C(Cc1csc(C2CCCC2)n1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632388 JXADKXFAEUNLKL-SFHVURJKSA-N 434.005 4.483 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C(N)=O)CCCC1 1547453570 OVBHRITZPOOMSM-UHFFFAOYSA-N 434.588 4.245 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc2c(c1)CCCN2C 1552586860 INJSLTNPMVXETA-NQIIRXRSSA-N 443.661 4.181 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1O 1557063672 VRTJEPFHFXKSBQ-MRXNPFEDSA-N 427.545 4.475 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC2(Cc3ccc(Cl)cc3)CCC2)N(C)C)cc1 1565452841 MOFGWYXACKCBIG-JOCHJYFZSA-N 429.008 4.473 10 10 IICE Cc1cc(C(=O)CSc2n[nH]c(CO)n2)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1 1613718058 CQXIIVSREMZVPA-UHFFFAOYSA-N 444.866 4.352 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CCc1ccn(C)n1 1617893601 RCNLTFUMKXDSPH-UHFFFAOYSA-N 435.620 4.080 10 10 IICE COC(=O)[C@H]1c2ccccc2OCCN1C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1627201880 NUVJMHCAHKDBRK-JOCHJYFZSA-N 438.911 4.496 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CCCCN1C(=O)OCc1ccccc1 1627209510 FODCYVFAEDUWER-DEOSSOPVSA-N 435.568 4.484 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)C(=O)N3c4ccccc4C[C@H]3C)c2C)cc1 1627730507 SHOXDTOWEOMZCQ-AEFFLSMTSA-N 431.536 4.199 10 10 IICE CCO[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCC1 1628496399 XMXJVYFSILNYCK-SFTDATJTSA-N 433.593 4.030 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](C)Cc3ccc(Br)cc3)CC2)cc1 1630992419 OSHCLLXJJBHFGZ-KRWDZBQOSA-N 431.374 4.375 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)c1 1634484283 SIPDTTDVSSXAKV-DEOSSOPVSA-N 430.483 4.299 10 10 IICE CC[C@H](C)c1nc([C@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n[nH]1 1634754523 IPGIXPRWGHXJFS-AAEUAGOBSA-N 445.365 4.374 10 10 IICE COC1(C(F)(F)F)CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1639357577 TVIIVGCBAJFQGF-UHFFFAOYSA-N 431.252 4.260 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCc1cccc(OCC)c1 1639827449 UXKZYDBNLSYQDG-UHFFFAOYSA-N 426.557 4.407 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)[C@@H](O)c1ccc(Cl)cc1 1641948696 QMAXGJACVQHQNN-VXKWHMMOSA-N 440.927 4.143 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCC3(O)CCN(c4ccccc4)CC3)ccc21 1643373085 HBXQWRGIHMIKEJ-UHFFFAOYSA-N 449.595 4.056 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(C)cc1C 1644804114 JINBPTWCTQMVKN-PMACEKPBSA-N 427.564 4.199 10 10 IICE Cc1ccc(F)c(CN(C)[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1653449029 MMAGRHIQIBRUSX-MRXNPFEDSA-N 430.479 4.369 10 10 IICE COCCn1ccc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1654253719 XMRZWXYYRNSVCT-LJQANCHMSA-N 446.473 4.455 10 10 IICE C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1(C)C 1693700939 GSDDDROAJLMISH-GOSISDBHSA-N 443.611 4.472 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC(COC)CC2)cc1 1695622930 AVTFUMZWARBVER-HSZRJFAPSA-N 441.620 4.277 10 10 IICE C#CCN(CC#C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)COCC 1705574864 PRCRZNXRGYYGKE-UHFFFAOYSA-N 443.595 4.488 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CCCc2cnn(C)n2)c(C)n1-c1ccccc1 1707252420 MCQULJDQSXNVDY-UHFFFAOYSA-N 446.603 4.206 10 10 IICE CC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)NC)C1 1709259723 CVWKGZWIKRFIBA-FQEVSTJZSA-N 434.588 4.115 10 10 IICE CCCO[C@H]1CCCN(c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1728239919 QCWZDEZQFKWPGS-FQEVSTJZSA-N 429.584 4.270 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 1742139769 UXJXFUBQUHQTFL-IBGZPJMESA-N 447.509 4.066 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCN(C(C)=O)CC1 1766389235 KIJPXXFTWPHXKK-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CCS(=O)(=O)c1ccc(O)c(N=c2cc(C)c3c(C)nn(-c4ccc(C)cc4)c3[nH]2)c1 1859832454 UNEZGWYZGTUFRI-UHFFFAOYSA-N 436.537 4.010 10 10 IICE CC[C@@H](C)NCc1ccc(N(C)C[C@H](O)COCc2ccccc2)cc1Br 2240022789 ALIKBXHPJJGQMU-UTKZUKDTSA-N 435.406 4.351 10 10 IICE Cc1cccc2cc(C=C3SC(=S)N(CC(C)C)C3=O)c(N3CCOCC3)nc12 2314648292 UAMVZTCZEGUREV-UHFFFAOYSA-N 427.595 4.237 10 10 IICE Cc1ccccc1C=C1SC(=S)N(CCCC(=O)Nc2ccc(C(=O)O)cc2)C1=O 2314832028 YCLBBQDITHZBOC-UHFFFAOYSA-N 440.546 4.313 10 10 IICE Cc1ccc(CNC[C@H]2C[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c(O)c1Br 2352947365 HVJYGLWSTYQGHD-BZUAXINKSA-N 425.367 4.341 10 10 IICE O=C(CCC1CCCCC1)NCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 12581739 RQBSFVJUHLOGDI-CPNJWEJPSA-N 446.594 4.093 10 10 IICE COc1ccc(CN/C(C)=C2/C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)cc1 19635840 UWYBEEDJMPQAOB-HAVVHWLPSA-N 442.475 4.418 10 10 IICE CCCCOc1ccc(/C=C2/SC(=S)N(CCC(=O)OCC)C2=O)cc1OCC 206841499 RNZGQHXGZCFOFU-NBVRZTHBSA-N 437.583 4.419 10 10 IICE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1cc(Br)c(CN)cc1F)C2 705881852 OKOWHSWJOTYIFJ-FGZHOGPDSA-N 432.381 4.395 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2cccc(N3CCCCCC3)c2)cc1)C(F)(F)F 741136070 BPURWEFGPHDTFW-UHFFFAOYSA-N 441.475 4.369 10 10 IICE COc1cccc(F)c1[C@H](C)NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 743554467 FTZUUDYEPZLZGT-OAGGEKHMSA-N 433.499 4.147 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cccc(OCC(F)(F)F)c3)CC2)cc1F 753878009 IRJBEQLGQLEFGF-UHFFFAOYSA-N 427.398 4.130 10 10 IICE C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769047756 QUMDBEPXHLAOOC-GOSISDBHSA-N 442.554 4.399 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCC[C@H](C(F)(F)F)[C@@H]2C)c([N+](=O)[O-])c1Br 775547465 PHBSDYGNYQCKAR-YUMQZZPRSA-N 442.188 4.441 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccccc3CCc3ccccc3)c2)CC1 781270004 ZCYABXRLHHCZAZ-UHFFFAOYSA-N 427.548 4.393 10 10 IICE COc1cc2c(cc1F)CC[C@H]2NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 802092058 AIUQBANGQBBQLX-HXUWFJFHSA-N 449.473 4.391 10 10 IICE C[C@H]1C[C@@H](NC(=O)NCc2cc(Br)ccc2O)CCN1Cc1ccccc1 805177327 YEHJTHBMKZERJE-KXBFYZLASA-N 432.362 4.007 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)Nc1ncc(Cc2ccc(F)cc2)s1 919772019 MDAZPMUNKYHABB-UHFFFAOYSA-N 426.517 4.031 10 10 IICE COc1ccc(Oc2ccc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)nc2)cc1 1125451945 SDWMPOOSMFEMNV-GOSISDBHSA-N 433.508 4.210 10 10 IICE CC[C@@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N(C)C(=O)OC(C)(C)C 1136546812 XZBCDHIFOXQIJV-SFHVURJKSA-N 441.519 4.019 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c(C)n1-c1cccc(Br)c1 1137377089 BOMAGGNRVVXMRY-UWJYYQICSA-N 430.390 4.413 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1cccc(OCc2cccc(C)c2)c1 1142687950 VTUWCAGLUDGOEF-UHFFFAOYSA-N 447.531 4.414 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 1162206117 PIMLLCXWBSMZRE-IYBDPMFKSA-N 430.524 4.142 10 10 IICE Cc1cc(CCNC(=O)[C@](C)(O)CSc2cccc(F)c2)c(C)n1-c1ccccc1 1169942078 DIOHUQLEYRBVAS-XMMPIXPASA-N 426.557 4.435 10 10 IICE COc1ccc(N(C)CCN(C)CCc2nc(N)c3c4c(sc3n2)C[C@@H](C)CC4)cc1 1195788210 GIVIDPCMFSULLI-INIZCTEOSA-N 439.629 4.018 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](CO)Cc3c[nH]c4ccccc34)c2C)c1 1254073503 ISEWVBPERUEVPZ-JOCHJYFZSA-N 430.552 4.287 10 10 IICE C[C@H]1CCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1291163721 LGDVRCMMYLGOQH-HKUYNNGSSA-N 429.584 4.298 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1293419468 YLQGKMRTHSCNIV-FQEVSTJZSA-N 434.588 4.210 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(C(=O)N3CCC(O)CC3)c2)c1C 1295916133 VFPLSQLDHHCMAJ-UHFFFAOYSA-N 431.536 4.252 10 10 IICE Cc1cc(C(=O)N=[S@]2(=O)CCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1303912365 KLTZBKYWHAKDTE-MHZLTWQESA-N 444.354 4.475 10 10 IICE O=C(N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1313149850 YMDUOKITOJEJTG-VWPQPMDRSA-N 430.932 4.266 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C2CC2)n1CC(F)(F)Br 1314737269 QDBAUEDVUVDEQK-UHFFFAOYSA-N 440.336 4.380 10 10 IICE COc1cc(C(=O)NCc2ccc(N(C)C)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 1350777307 ZZDJUAZAIAXHKR-UHFFFAOYSA-N 435.480 4.178 10 10 IICE COc1ccc(N2CCCN(C(=O)C(C)(C)c3ccccc3Br)CC2)cc1 1355031756 QHSHPQIBQVNIIY-UHFFFAOYSA-N 431.374 4.474 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(-n4nc(C)c(Cl)c4C)cc3)C2)cc1 1436972505 RIPPPRPXIWRHTH-GOSISDBHSA-N 438.959 4.407 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]2c2ccc(I)cc2)cc1 1447116931 XWVWECQYQAVEQO-MRXNPFEDSA-N 448.264 4.431 10 10 IICE COc1ccc(S(=O)(=O)CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)cc1 1459112154 MXLVJZUPYVVNBE-UHFFFAOYSA-N 449.475 4.361 10 10 IICE Cc1cc(CN2CCn3c(Cc4cccc(Br)c4)nnc3C2)ccc1N(C)C 1460016441 JKAFOKKDMREUJB-UHFFFAOYSA-N 440.389 4.022 10 10 IICE COc1cccc(C[C@@H](C)CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1465952205 XUSDBBVJDZMABJ-DYESRHJHSA-N 430.976 4.404 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1470248744 GGDNHQZIGRCHHO-GOSISDBHSA-N 439.510 4.051 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(-c4cc(OC)ccc4Cl)no3)C2)cc1 1529412175 WXBQDODAIPDYHD-OAHLLOKOSA-N 441.915 4.269 10 10 IICE Cc1csc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1529759308 LIDNFWAYTPHEID-CDCQXCROSA-N 435.571 4.059 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccnc(OC4CCCCC4)c3)cc2F)CC1 1530376237 GUEJQFJRIIEHRB-UHFFFAOYSA-N 440.563 4.004 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)N(C)Cc3ccc(N4CCCC4)cc3)cc2)c1C 1531693388 IWJUYLRYXPZCHU-UHFFFAOYSA-N 446.551 4.230 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Cl)c([N+](=O)[O-])cc2NC(C)=O)cc1 1539306621 ASQXGFHEMPEDRM-UHFFFAOYSA-N 432.908 4.325 10 10 IICE CO[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccccc1Br 1541080369 GSWNFOYSFDJCPW-IBGZPJMESA-N 435.387 4.006 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(NCCc4ccccn4)cc3)CC2)cc1 1542703890 GPPCKUIFDYRXGR-UHFFFAOYSA-N 430.552 4.144 10 10 IICE Cc1ccc(C(=O)NCc2cccc(Cn3ccnc3)c2)cc1-n1c(C)cc(C=O)c1C 1543467065 YKGUVCAKOXHALH-UHFFFAOYSA-N 426.520 4.390 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)cc1 1543640399 DAPAPXFWYFKMCJ-LJQANCHMSA-N 443.547 4.453 10 10 IICE COC(=O)C[C@@](C)(NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1cccc(OC)c1 1544911110 GZWWMBSDUKRQED-AREMUKBSSA-N 434.536 4.240 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1COc2ccc(Cl)cc2C1 1545632836 WZKRIWXQLHBOEE-APWZRJJASA-N 435.351 4.031 10 10 IICE CN1C(=O)C[C@H](C(=O)NCCCSc2nccs2)[C@@H]1c1ccc(Cl)c(Cl)c1 1565620347 PEXVCLXQMYFFPR-LRDDRELGSA-N 444.409 4.268 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(NCCc4ccccn4)cc3)CC2)cc1 1566563355 YQOUAOQKVKXVEM-UHFFFAOYSA-N 430.552 4.097 10 10 IICE Cc1cccc(-c2nc(CC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cs2)c1 1596684157 JTQNXDQNWIOLCG-UHFFFAOYSA-N 443.519 4.092 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nn(-c2cccc(F)c2F)c2c1CCC2 1597800885 RRPGJTOGCWHVHC-INIZCTEOSA-N 438.522 4.375 10 10 IICE CC(C)NC1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1610226934 RBDLEKSHWRHRBR-UHFFFAOYSA-N 428.600 4.156 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1C[C@H](C)S[C@H](C)C1 1611963141 IPRXRJGEFQVABF-LVCYWYKZSA-N 429.634 4.273 10 10 IICE Cc1cccc(C[C@@H](CO)NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c1 1616333929 WHNPCSWDJNXCBX-FQEVSTJZSA-N 441.369 4.498 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N[C@@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1616947299 VRVNKLMQJSYRED-MGPUTAFESA-N 434.005 4.423 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cnc(CNC(=O)OC(C)(C)C)s1 1623477385 XPCZEWPKOMDOPI-UHFFFAOYSA-N 444.601 4.430 10 10 IICE Cc1ccc(-c2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)cc2)nn1 1627204973 JDVRIXAYDQEARV-DEOSSOPVSA-N 430.552 4.339 10 10 IICE O=C(C[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1)NCc1ccc(F)cc1 1627502091 GBXXWSUWZYXRLG-HNNXBMFYSA-N 442.512 4.010 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(O)c(F)cc1F 1629319326 RUZKCVNLEDMFJO-FRKPEAEDSA-N 438.452 4.040 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)C(=O)OCc2ccccc2)c(C)n1-c1ccc(C(C)C)cc1 1632169341 RMJDAJUMNIZDIY-DEOSSOPVSA-N 434.536 4.052 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@@H]4CC[C@@H](N(C)C)C[C@H]4C3)cc2Cl)C1 1634720127 OOINAAVYYSLACE-BVOGOJNSSA-N 433.040 4.448 10 10 IICE Cc1ccc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)cc1-n1c(C)cc(C=O)c1C 1637043513 ZJIJPNCGHDXDTG-UHFFFAOYSA-N 439.556 4.392 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1F 1639327216 NEAJWGMVOHRFJK-HXUWFJFHSA-N 435.499 4.473 10 10 IICE COC(=O)c1ccc(F)c2c1CN(C(=O)c1cc(C)n(-c3ccc(OC)cc3)c1C)CC2 1640550089 WJLTYYJKEPEWBH-UHFFFAOYSA-N 436.483 4.227 10 10 IICE CCN(CC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1)c1ccc(OC)c(OC)c1 1653749131 BXZPYOYEUYFBNZ-AWEZNQCLSA-N 426.435 4.306 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H]1c1ccc(F)c(F)c1 1673472298 GHUWBZOYTAFYKD-HXUWFJFHSA-N 437.437 4.126 10 10 IICE C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1673472606 SGQQJAIMNNYKHP-BTYIYWSLSA-N 433.474 4.233 10 10 IICE CC(C)NC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1682023218 BYPCYEIIIPLXTF-HKUYNNGSSA-N 435.012 4.023 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCO[C@@H](c3ccccn3)C2)cc1 1682542269 UOQRFOCOTXPRPB-HYBUGGRVSA-N 434.540 4.373 10 10 IICE COC[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cccc(OC)c1 1683838157 LWRLCEVUAOHMBE-XMMPIXPASA-N 437.540 4.454 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H](C)C3)n2CCCSc2nccs2)n1 1693433129 NURPSVUVLRISIF-OAHLLOKOSA-N 431.635 4.015 10 10 IICE C[C@@H]1CCc2sc(-c3nnc(N(C)Cc4ccccc4O)n3CC(C)(C)O)cc2C1 1708022662 AGGKWKKYGMNNBP-OAHLLOKOSA-N 426.586 4.244 10 10 IICE CC(C)c1nnc(N2C[C@H](C)O[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1763061327 ZCWZWMHYMPPASZ-QWHCGFSZSA-N 435.541 4.196 10 10 IICE CC[C@](C)(N)C(=O)Nc1sc(C)c(-c2ccc(Br)cc2)c1C(=O)OC 1866112446 DOIXJQHMHQGAOQ-SFHVURJKSA-N 425.348 4.339 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c1O 2236054491 IWTNURINJQXCAF-BTTYYORXSA-N 441.366 4.183 10 10 IICE CN(Cc1ccccc1I)c1ccc(CO)c(Br)c1 2265547554 RYVHLUVMTXFBSW-UHFFFAOYSA-N 432.099 4.182 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)ccc1OC 2318756693 RFIPLRKNSAHOMM-UHFFFAOYSA-N 446.506 4.417 10 10 IICE Cc1ccc(CN(C)C(=O)C2(NC(=O)OC(C)(C)C)CC=CC2)c(O)c1Br 2381131051 IHUKBPJKYAVFRJ-UHFFFAOYSA-N 439.350 4.035 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/c1ccc(-c2ccc3c(c2)C(=O)NC3=O)o1 16312113 VNYOIGGGJNABRK-UDWIEESQSA-N 425.444 4.253 10 10 IICE COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/c1ccccc1[N+](=O)[O-] 33315619 JTORMBMAMZVOOP-MHWRWJLKSA-N 432.354 4.491 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)NCCC4=CCCCC4)cs3)CC2)cc1 96386299 GIAHLSLUQPHGAQ-UHFFFAOYSA-N 426.586 4.099 10 10 IICE Oc1ccccc1CN(C[C@@H](O)COc1c(Cl)cccc1Cl)C[C@H]1CCCO1 255133043 LEDOHLRWNCMPRN-IAGOWNOFSA-N 426.340 4.120 10 10 IICE CC(C)[C@@H](CNCc1cc(Cl)cc(Br)c1O)ONC(=O)OC(C)(C)C 708133929 OLYGOSLPTPGWEV-CQSZACIVSA-N 437.762 4.379 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N(CC(=O)OCC)c1ccc(F)cn1 744369247 RCQUTRHVFSLAFU-FMIVXFBMSA-N 437.471 4.167 10 10 IICE CCOC(=O)[C@H](Cc1ccccn1)NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 760629768 VIVHLFLDANRGKQ-NRFANRHFSA-N 425.916 4.047 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H](C)Oc2cccc(CO)c2)cc1 777395309 ZXTNQTRTTCVPAJ-IBGZPJMESA-N 434.536 4.254 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3ccc(C(F)(F)F)nc3)n2)c1 782260286 AYCIGBZJALRMRY-UHFFFAOYSA-N 445.444 4.042 10 10 IICE COc1ccc(OC)c(N2C(=O)/C(=C\c3cc(-n4ccnc4)cs3)SC2=S)c1 783699589 WLUXUNMSJQGDDD-RQZCQDPDSA-N 429.548 4.357 10 10 IICE Cc1cc(CC(=O)N(C)C2CCN(c3cnccn3)CC2)c(C)n1-c1ccc(Cl)cc1 790206761 SJVULXKACKTQEN-UHFFFAOYSA-N 437.975 4.207 10 10 IICE CC[C@@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1cc(Cl)cc(Cl)c1O 806159303 FYEHEEALZRGYOU-GOSISDBHSA-N 429.369 4.480 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c(C)n1-c1cccc(Cl)c1 919979175 UCIHLROYEUCUEJ-SFHVURJKSA-N 428.945 4.447 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1 1125692694 RLRLTHKHEFMVRB-HXUWFJFHSA-N 434.559 4.476 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4sccc4nc3Cl)cc2F)CC1 1125907888 OAOWMZAMSZFZSZ-UHFFFAOYSA-N 432.952 4.161 10 10 IICE Cc1cc(CNC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c(C)n1-c1ccccc1 1132048293 PNXQYTDNGGGPDP-UHFFFAOYSA-N 439.581 4.053 10 10 IICE CN1CCN(c2ccc(CNC(=O)C3(c4c(Cl)cccc4Cl)CCC3)cc2)CC1 1133123448 MGPNRMCNDYWINS-UHFFFAOYSA-N 432.395 4.483 10 10 IICE Cc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)N2CCOCC2)cc1 1136335397 XWIXAQONFNSZFT-RUZDIDTESA-N 435.543 4.345 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccccc2Cn2ccnc2)cc1 1141791327 KNVHXZXCNPIYEK-UHFFFAOYSA-N 426.520 4.010 10 10 IICE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C(=O)c1cc2cc(O)c(O)cc2s1 1153746938 KXBGMHXPIAKFEB-UHFFFAOYSA-N 442.537 4.480 10 10 IICE C[C@H](NC(=O)N1CCCC[C@@H]1COC(=O)NC1CCCCC1)c1ccc(N(C)C)cc1 1226647200 RCNKNPFGKQYDQO-PGRDOPGGSA-N 430.593 4.437 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(c4ccc(Cl)cn4)CC3)c2C)c1 1254072498 BNMPNOYCRXJEBT-UHFFFAOYSA-N 437.975 4.483 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1c2ccc(Br)cc2nn1C 1276284524 UPIPIYMTIPINDK-CQSZACIVSA-N 429.362 4.071 10 10 IICE Cc1cc(Br)c(N)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 1292381598 GPTIFLGYLAUPAU-GOSISDBHSA-N 446.389 4.227 10 10 IICE CCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)CC)CC1 1293455979 KYKVJCHRGBZMMI-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc3ccncc23)NC(=O)OC(C)(C)C)cc1 1293793945 UKCRASCJRIMYJO-QFIPXVFZSA-N 434.540 4.297 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1 1298840866 QZPGVOPMFRLYEK-QFIPXVFZSA-N 444.453 4.318 10 10 IICE COC(=O)[C@]1(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC[C@H](C)CC1 1300525839 QWBTZPSOAOAUIK-KIFPSNHUSA-N 448.361 4.103 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1c(C)noc1C 1301582716 WBUZHABCUKOCRS-UHFFFAOYSA-N 448.571 4.478 10 10 IICE COCCN(Cc1ccc(C)o1)c1nnc(C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1301777849 JYHMLFOURRLRCM-UHFFFAOYSA-N 443.567 4.383 10 10 IICE O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)NCc1cccc(O)c1O 1303192848 BMSZEPACPNSRCS-UHFFFAOYSA-N 433.895 4.463 10 10 IICE COc1ccc(C[C@@](C)(CO)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1OC 1303361255 JSSSOQPDRGFFKQ-SANMLTNESA-N 436.552 4.143 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C(C)C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1304197050 XFGUQOZZPZBEKJ-NRFANRHFSA-N 448.615 4.360 10 10 IICE CC(C)c1cnc(S[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1C 1307309420 NZZXAGPKGWGYTI-CQSZACIVSA-N 433.533 4.438 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1312028716 XONMRELCHOTSTG-OAQYLSRUSA-N 440.588 4.335 10 10 IICE COC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)s1 1312586134 NEXPHTGBCZELDL-AWEZNQCLSA-N 435.977 4.424 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3cccc(OC(F)(F)F)c3)C2)cc1 1312901439 GGNAOJVCHGNJEB-KRWDZBQOSA-N 437.462 4.262 10 10 IICE CC[C@H](Cc1ccccc1Br)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1438889091 YKOWPFUXHLGHRT-LJQANCHMSA-N 444.417 4.086 10 10 IICE Cc1ccccc1C1(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CCCCC1 1439324422 FMYDEQCCECMXOI-UHFFFAOYSA-N 433.596 4.215 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1[C@H]1CCCOC1 1444988615 QEAYRVACQCUTOH-ICSRJNTNSA-N 447.526 4.457 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cc(Cl)cc(Cl)c3)CC2)c(OC)c1 1461984821 VJJSHPOVVSDOAO-CQSZACIVSA-N 439.339 4.127 10 10 IICE Cc1ccc(N2CCOCC2)cc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1467644787 FZJNPPDFAYPODS-UHFFFAOYSA-N 431.536 4.233 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3C[C@H]3c3cccc(C(F)(F)F)c3)C2)cc1 1470593202 KYRRJUFHHZVPFK-GQWLDOHISA-N 433.474 4.396 10 10 IICE O=[N+]([O-])c1cnc(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(Br)c1 1472710977 JWSCZNXEJNSCCB-LLVKDONJSA-N 443.248 4.435 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(OC(C)C)nc1 1498659316 MSAZYJJGHKLYDU-UHFFFAOYSA-N 434.588 4.308 10 10 IICE CC(C)c1nnc(N(C)Cc2ccsc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1508916887 SAOZMQIBKMIUQW-UHFFFAOYSA-N 439.629 4.356 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(Cc3cccc(C(F)(F)F)c3)C2)cc1 1516598898 HOYFANYRTBATDK-LJQANCHMSA-N 447.501 4.217 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@H]1CCCCO1 1517147722 LOGJZAQHRBGHCY-QKNQBKEWSA-N 428.577 4.108 10 10 IICE CO[C@H](Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1517838118 JOKVTUWQHXSENM-DHIUTWEWSA-N 441.620 4.427 10 10 IICE COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1 1525559205 SFRCMRWXZKEKNF-LJQANCHMSA-N 428.838 4.315 10 10 IICE CCc1c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cnn1-c1ccccc1Cl 1527715599 ZQJCDNOCLDIJQH-UHFFFAOYSA-N 438.959 4.449 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3sc(NC(=O)OC(C)(C)C)nc3C)C2)cc1 1529708073 OVVGLYMFCWYXIH-OAHLLOKOSA-N 446.573 4.063 10 10 IICE CCC1(CC)CN(C(=O)/C=C/c2cncc(C(=O)NC)c2)c2ccc(Br)cc21 1532619573 LXJPMSDDVDCQOH-RMKNXTFCSA-N 442.357 4.322 10 10 IICE CC(C)c1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1541339459 BPKWINPXBAOWOI-SFHVURJKSA-N 429.584 4.298 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1555901827 UMNGACVIWRDFPK-SFHVURJKSA-N 431.650 4.038 10 10 IICE COc1ccc(OC(F)F)c(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1566405342 QWMGGIDZGLUPGS-UHFFFAOYSA-N 428.435 4.447 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC2(CC1)CC2(F)F 1586744335 DFABZQHGQOKVFT-RVDMUPIBSA-N 440.512 4.065 10 10 IICE CC(C)[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1603073297 ZOAOMDMWLOTZFL-OAQYLSRUSA-N 443.661 4.038 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCC[C@@H](O)C1 1603303959 XFEZSQKBLOCHCJ-JTHBVZDNSA-N 425.621 4.264 10 10 IICE C[C@@H]1CCC[C@H](N(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1612743095 GNTZWLSSIUTUAC-WBVHZDCISA-N 431.635 4.332 10 10 IICE CC[C@@]1(C)CC[C@@H](Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)O1 1613684100 FLVJRUXHFYRZGH-CVDCTZTESA-N 441.601 4.324 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1 1617002192 UNLTZAKEKUGMFX-HXUWFJFHSA-N 434.588 4.016 10 10 IICE Cc1cc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)ccc1N1CCN(C)CC1 1623853624 CVWKPZOTJNQESM-UHFFFAOYSA-N 430.552 4.219 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccn4)cc3)cc2F)C[C@H](C)O1 1625089671 DCMLHCBCGFYTKR-OALUTQOASA-N 449.526 4.343 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)cc2nc(O)[nH]c12 1626312660 VHGAQXYFYXMSRG-UHFFFAOYSA-N 431.334 4.148 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(NC(=O)CCN(C)C)cc2)c1 1626907139 FIDOMCMBZGRNPT-UHFFFAOYSA-N 432.524 4.049 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1627210375 QLDUHAWXXPFNSM-KRWDZBQOSA-N 429.923 4.139 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1c(Br)nc2n1CCCC2 1628873883 PEMREBZAMXMVDL-UHFFFAOYSA-N 431.378 4.244 10 10 IICE Cc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(O)c1C 1629679148 LVTNBFNNAWTRQA-HXUWFJFHSA-N 427.545 4.071 10 10 IICE COC(=O)c1cccc2nc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)[nH]c12 1637024435 IJCWATPBOYDWSL-UHFFFAOYSA-N 430.464 4.130 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1638700826 WSEVPACEHAAGMA-HHHXNRCGSA-N 446.547 4.466 10 10 IICE CC(C)(C)OC(=O)NCc1nc(CC(=O)NCc2ccc(N3CCCCC3)cc2)cs1 1643394350 FKHWDUBCNSLCTI-UHFFFAOYSA-N 444.601 4.017 10 10 IICE COC(=O)c1cccc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)c1 1643615196 BXSOTISBNOIZNG-FQEVSTJZSA-N 436.533 4.491 10 10 IICE Cc1ccc(Br)c2[nH]c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cc12 1647140401 MNTWGJWBGBYEQA-HXUWFJFHSA-N 443.389 4.338 10 10 IICE COc1ccc(CN[C@H](CNS(=O)(=O)c2ccc(C)cc2C)c2ccccc2)cc1C 1653936349 XQLOXLHOINVHSH-HSZRJFAPSA-N 438.593 4.430 10 10 IICE CC(C)N1C(=O)C[C@H](NCc2ccc(N3CCOCC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1654145492 BMXMHIKDHRCTQK-UPVQGACJSA-N 445.966 4.156 10 10 IICE CC(C)CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(C)(C)C 1657953497 XIJFYLRCVIBQQI-YYDVJCTNSA-N 435.628 4.496 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H]3CCN(c4ccc(F)cc4)C3=O)c2C)c1 1673676102 AVFKTHSQZKPQOA-HSZRJFAPSA-N 434.515 4.146 10 10 IICE Cc1cccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1682025047 ZNELMNMGKSYYDW-GHTZIAJQSA-N 429.992 4.288 10 10 IICE Cc1cc(CNC(=O)NC[C@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1 1683307300 CBRRYDGKYBYCNL-KRWDZBQOSA-N 439.581 4.101 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@@H](O)C3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1724197416 JDLRMMCMTHORLZ-KUHUBIRLSA-N 433.478 4.122 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1726882696 VUQMXXAABMBROD-IBGZPJMESA-N 436.629 4.425 10 10 IICE CC(C)[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1741407792 WUSIDNZWQSUGBL-OAQYLSRUSA-N 443.592 4.045 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ncccc1C 1743563213 HFDAFUDTMQKFNT-LJQANCHMSA-N 434.588 4.016 10 10 IICE C[C@H]1CCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C[C@@H]1C 1752244928 DAGHOAIPARDXJK-IRXDYDNUSA-N 428.631 4.385 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)CC(N)=O 1760822505 AHIYLSPJBNAIQZ-GOSISDBHSA-N 434.588 4.409 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1763139797 DWLRTPYBUDLZKK-SFHVURJKSA-N 445.702 4.410 10 10 IICE CCc1nnc(N(C)[C@@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764699988 BOFUGYCNHOIZTO-WMZHIEFXSA-N 425.621 4.112 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@H]2CCC[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1771166848 UKEVETFXRRNBML-NOXFTYBFSA-N 443.636 4.440 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@H](C)[C@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 1858588401 DABHEVGAQJTHJY-WTTUOHCKSA-N 434.539 4.335 10 10 IICE CN1CCN(c2ccc(N3C(=O)/C(=C\c4ccccc4Cl)SC3=S)cc2)CC1 1860085463 MOOFTOGHJAPQBR-XMHGGMMESA-N 429.998 4.498 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(CCc4ccccc4)C3=O)c2C)cc1 2296160369 MURVGUYEDGDJFW-UHFFFAOYSA-N 427.504 4.107 10 10 IICE CCOc1cc(C=C2SC(=S)N(CC(=O)O)C2=O)ccc1OCc1ccc(F)cc1 2296453314 MCUPVJRJNSWFLN-UHFFFAOYSA-N 447.509 4.089 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccc2nccnc2c1 2296594558 ZFKTZQQPINOYPK-UHFFFAOYSA-N 440.575 4.311 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2cccc(OCCC(=O)O)c2)SC1=S 2314930592 GJWXRYXJQBSACZ-UHFFFAOYSA-N 429.519 4.345 10 10 IICE Cc1ccc(CNC(=O)c2cnn3c(O)c(Cc4ccc(F)cc4Cl)c(C)nc23)cc1 8592932 KMOFBDXPPIUUIJ-UHFFFAOYSA-N 438.890 4.365 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)cc1)C1CCCCC1 109300369 TXZWPGMMHVWHQC-QHCPKHFHSA-N 439.625 4.367 10 10 IICE Cc1noc(C[C@@H]2CCOC3(CCN(C(=O)c4ccc(-n5c(C)ccc5C)cc4)CC3)C2)n1 575546759 ZDBBSMKDHIZCOT-NRFANRHFSA-N 448.567 4.430 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(C)cc1OC[C@H]1CCOC1 756080852 OCWBEVZKDHVKBA-NRFANRHFSA-N 425.573 4.208 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc([C@@H]2CCCOC2)c1 767087688 KQUFKWQQGDDPBN-KNQAVFIVSA-N 428.960 4.334 10 10 IICE Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 772881979 CPWIINNAKHPNMB-NRFANRHFSA-N 426.948 4.312 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3ccc4ncsc4c3)n2)c1 775139585 NAROAZFFZAESOL-UHFFFAOYSA-N 433.536 4.238 10 10 IICE COc1cccc(OC)c1S(=O)(=O)Nc1nc(-c2c(F)cc(F)cc2F)c(C)s1 775151869 FNXXKFBTPPWWQB-UHFFFAOYSA-N 444.456 4.354 10 10 IICE O=C(c1cccc(O)c1O)N(Cc1ccccc1)C[C@@H](O)c1cccc(OC(F)F)c1 790938314 VJDUZEFIJPCGRW-HXUWFJFHSA-N 429.419 4.075 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(Cc3ccco3)C3CCCC3)cc2F)C[C@@H](C)O1 917063641 LORPGNCGEWATNK-RTBURBONSA-N 443.563 4.093 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cccc4c3COC4=O)n2)c1C 918744191 RGSXVMUIUSOCPI-UHFFFAOYSA-N 431.539 4.110 10 10 IICE CCOc1cc(Cl)c(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1OCC 1084625705 XFZCXMXEULUWCE-LCYFTJDESA-N 448.903 4.108 10 10 IICE COc1ccc2c(c1)CC[C@@H](C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)C2 1125878814 VWNSUEWDBCERTD-GOSISDBHSA-N 430.495 4.187 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1 1127837687 AFRISHXHBWTQPF-SJPXOZHESA-N 428.554 4.337 10 10 IICE Cc1ccc(SCCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1136224872 LIBSMZWOLJLOEW-UHFFFAOYSA-N 448.591 4.085 10 10 IICE Cc1cc(CC(=O)NC2(CC(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccccc1 1141857481 CVZAAEJQODOASE-UHFFFAOYSA-N 426.557 4.034 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)c(C)n1-c1ccc(F)cc1 1146855505 WDMRXCVRAWOTQQ-FQEVSTJZSA-N 425.891 4.422 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C[C@H](NC(=O)c3cc(O)cs3)c3ccccc3O2)C1 1158594023 NNABKMBNLJYUID-AOMKIAJQSA-N 430.526 4.087 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](NC(=O)C(F)(F)F)[C@@H]2C)c(C)n1-c1cccc(Cl)c1 1163726414 OVYVQCSJKPYDBM-KSSFIOAISA-N 441.881 4.419 10 10 IICE CCOc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NCc2ccc(C)cc2)cc1 1175946383 JFNKEUKGXADWAN-UHFFFAOYSA-N 431.536 4.399 10 10 IICE CC(C)N(C)c1ccc(NC(=O)CCN[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1F 1192891471 UWZXFXGZRWZAFY-IBGZPJMESA-N 442.579 4.186 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)N(C)C)cc1 1256231860 HEJWXJWRHYKEPF-GMAHTHKFSA-N 445.007 4.262 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)cc1 1292382615 UTBIQERJVMVMLT-RSXGOPAZSA-N 435.612 4.172 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@@H]2CCC3(CCC3)CO2)NC(=O)OC(C)(C)C)cc1 1293802418 RZRXCVNVYQHDSK-LEWJYISDSA-N 445.604 4.174 10 10 IICE CC(=O)N(c1ccccc1)c1nc(CNC[C@H](c2ccc(N(C)C)cc2)N(C)C)cs1 1308972124 OIGQXMHBEWUPNF-HSZRJFAPSA-N 437.613 4.286 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(-c4cccs4)s3)CC2)cc1 1350976822 QYTQLFUFFCUPPI-UHFFFAOYSA-N 441.622 4.427 10 10 IICE COC(=O)Cn1nc(C)c(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)c1C 1447176143 PSRUVLXABMXERJ-UHFFFAOYSA-N 436.556 4.134 10 10 IICE CC[C@@H]1NC(=O)N(c2cccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)c2)C1=O 1448868019 VHBDUSDNNJJEHO-NRFANRHFSA-N 430.508 4.490 10 10 IICE COC(=O)C[C@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccc(OC)cc1OC 1457984752 PSOFQJBIJXPBSK-QFIPXVFZSA-N 436.508 4.146 10 10 IICE Cc1ccc(C)c(-n2cnc(=O)n2CC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)c1 1459004619 AUACCLDWQGLTTA-UHFFFAOYSA-N 432.499 4.389 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H]1C[C@H](OCC)C1(C)C 1459521459 BEYYVAONJMCWHW-PKTZIBPZSA-N 448.563 4.316 10 10 IICE CCc1ccccc1NC(=O)CN(C)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1463993448 AKFQKZHASOIQDO-UHFFFAOYSA-N 431.536 4.109 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)c1cccc(F)c1 1467630793 DZXFBMDVHBWDIT-UHFFFAOYSA-N 428.504 4.177 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)c1ccc(N2CCCNC2=O)cc1 1468514574 FONNAJAHDYGQGR-GOSISDBHSA-N 444.535 4.317 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1496089847 XNEFNALWBHKYQC-FQEVSTJZSA-N 448.615 4.406 10 10 IICE CCC1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1 1499603715 ZOLHNYRMCZGKAW-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC(=O)Nc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1Cl 1524070993 ULMUZAGQSDNPBS-OAHLLOKOSA-N 437.874 4.299 10 10 IICE Cc1cccc(C)c1CCNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1534550223 ACKDQUPJCNSEQV-XSFVSMFZSA-N 442.581 4.393 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CO[C@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1534550473 XHFOVCWFTJCWTC-JTHBVZDNSA-N 440.584 4.280 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 1537220638 DWSPXIJOKFRHJD-RNEAKCBISA-N 432.517 4.434 10 10 IICE CCn1cnnc1-c1cccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1540767813 FQPKXZOFLNEJIZ-UHFFFAOYSA-N 427.508 4.366 10 10 IICE CCc1nc2ccccc2n1CCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1544677088 PJMNFAVJBBMPPY-QZTJIDSGSA-N 438.547 4.058 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2c(F)cccc2F)c1 1545683910 DHOUQHWCRPEIDT-BLVKFPJESA-N 436.455 4.122 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)CCCC1 1556221729 KIKSOLVEYFOQHH-IVZQSRNASA-N 438.490 4.129 10 10 IICE CCCCN1C(=O)CC(=O)N=C1SCC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C 1559474679 UGNUMLAUMQQALF-UHFFFAOYSA-N 425.554 4.233 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(C2CCN(C(=O)OC(C)(C)C)CC2)no1 1587404089 CCABPSVDGKDSOT-UHFFFAOYSA-N 442.560 4.127 10 10 IICE Cc1cc(CCNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1-c1ccccc1 1595949989 LQOALCRTEZDIDZ-UHFFFAOYSA-N 429.480 4.161 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccnc(-c4ccccc4)c3N)cc2F)C[C@@H](C)O1 1596695248 OEJLLZWJTGEWMQ-IAGOWNOFSA-N 434.515 4.014 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1614226812 AOKLKCQKVMPLFV-DENIHFKCSA-N 436.604 4.182 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CCc3ccccc3C2)NC(=O)OC(C)(C)C)cc1 1618253111 KRWUBGGFLGBRJP-GGAORHGYSA-N 437.584 4.240 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CC(O)(c3ccc(Br)cc3)C2)cc1 1629539164 BANIQBJSHNRAKB-UHFFFAOYSA-N 425.326 4.200 10 10 IICE Cc1cc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)C2=O)c(C)o1 1640895158 SUMZSGLZZKERSL-XMMPIXPASA-N 437.471 4.093 10 10 IICE COc1ccc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nn1 1641202115 BENACEQHNRPOBA-QGZVFWFLSA-N 430.430 4.411 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](c3ccccc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1653592778 IWYWFXHJIOSQEG-MPCDZSKCSA-N 441.591 4.433 10 10 IICE C=CC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)CC1 1705776907 SVQLTHGMWWEWSS-UHFFFAOYSA-N 446.599 4.233 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1710596218 WWSAPZJQFLAJLU-SFTDATJTSA-N 431.600 4.370 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H](OC)C1 1712389959 KSUULAGOUKRJPD-MBSDFSHPSA-N 437.588 4.250 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@]2(C)CCCS2)cs1 1742565025 DXPWCRIHOSNNRQ-OAQYLSRUSA-N 429.615 4.262 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCOC1 1771047114 VJAARBZZWGBVDQ-NRFANRHFSA-N 437.588 4.252 10 10 IICE CCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C/c1cc(Br)cc(OC)c1O 1865672366 YUMVQNKKSZKZGU-MHWRWJLKSA-N 431.286 4.368 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)sc(C)c1-c1ccc(C)cc1 1865923191 QSCNJIBSUJEWFC-INIZCTEOSA-N 428.554 4.404 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2cc(Br)ccc2O)C12CCC2 2120832590 QSAXHFBZOCAUQD-OAHLLOKOSA-N 425.367 4.424 10 10 IICE COc1cc(C=C2SC(NC(C)=O)=NC2=O)cc(Cl)c1OCc1ccc(C)cc1 2293438549 JNZLFENXLMGLTP-UHFFFAOYSA-N 430.913 4.342 10 10 IICE CC[C@H](C)N1C(=O)C(=Cc2ccc3c(c2)CCCN3Cc2ccccc2)C(=O)NC1=S 2296342640 LYRIIAPEFWBJHG-KRWDZBQOSA-N 433.577 4.065 10 10 IICE CCN1C(=O)C(=Cc2c(Sc3ccccc3)nc3ccccn3c2=O)SC1=S 2296706648 DNYFXWFJGXUMEQ-UHFFFAOYSA-N 425.560 4.067 10 10 IICE CC(C)Cc1nnc(NC(=O)CCN2C(=O)C(=Cc3cccs3)SC2=S)s1 2296755568 MSXNICZQUNFFOJ-UHFFFAOYSA-N 438.625 4.028 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1c(C)cccc1C 2297499710 XALNJWUSGFEFJS-UHFFFAOYSA-N 447.491 4.220 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)NC(=O)C=Cc3ccc(C(C)C)cc3)CC2)cc1 2330418805 KOCFOBLXBWTMHG-UHFFFAOYSA-N 449.595 4.075 10 10 IICE Cc1ccc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2352636291 KVFDDKJDDOIEID-HNNXBMFYSA-N 429.355 4.019 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)CC23CC3)c(O)c1Br 2352679197 IOSMIKIOCDURCM-OAHLLOKOSA-N 425.367 4.342 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478332 FZHFETZVPJXVCI-KLMMPHRKSA-N 427.526 4.498 10 10 IICE CCOc1cccc(N2C(=O)N=C(O)/C(=C/c3cccn3-c3ccc(N(C)C)cc3)C2=O)c1 33316796 LOQIDFFACIIUFE-JWGURIENSA-N 444.491 4.449 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cc(C)cc(C)c4)c3[N+](=O)[O-])CC2)cc1 40582943 KEPVEOCTMGENBQ-UHFFFAOYSA-N 434.500 4.080 10 10 IICE Cc1cccc(N2C(=O)NC(=O)/C(=C/c3c[nH]c4ccc(Br)cc34)C2=O)c1C 103666387 HVFDYTKZCWXNTO-PXNMLYILSA-N 438.281 4.214 10 10 IICE COc1cc(C2(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)CC2)ccc1C 116382490 MCHMYXUBQCMRIF-QZTJIDSGSA-N 426.532 4.104 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccc(OC)cc3)C2=O)cc1 210717802 PARIIYNLHJFNFK-XMHGGMMESA-N 442.562 4.324 10 10 IICE CCOc1ccc(O)c(CNCc2ccccc2CN2CCN(c3ccccc3)CC2)c1 236974752 BYVCHKLPZJIJBM-UHFFFAOYSA-N 431.580 4.403 10 10 IICE COc1ccc(O)c([C@H](C)Nc2nc(CN3CCOCC3)nc3sc(C)c(C)c23)c1 301201281 PMVMLHAWZBBROZ-AWEZNQCLSA-N 428.558 4.028 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1c1ccc(Cl)nc1 727178120 SCJMEDHCWFSQNU-UITAMQMPSA-N 448.694 4.338 10 10 IICE COc1ccc2c(CC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)coc2c1 742799343 JQQKAPBADJGHIG-MRXNPFEDSA-N 430.451 4.371 10 10 IICE COc1ccc(C(=O)CCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1OC 746425842 JUXRYVSRYUNUGN-UHFFFAOYSA-N 434.536 4.433 10 10 IICE CCn1c(SCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nnc1-c1ccco1 746426472 PFFASRHZYCQSQS-UHFFFAOYSA-N 449.580 4.417 10 10 IICE C[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@H]1c1cccc(F)c1 746760472 XDWARJIVJCGFMP-WAIKUNEKSA-N 429.511 4.219 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N(C)Cc3nc4c(s3)CCCC4)cc2F)C[C@@H](C)O1 747495719 MPVFUGPITJTDQR-HZPDHXFCSA-N 446.592 4.116 10 10 IICE CO[C@@H](C)c1noc(CN(C)CC(=O)c2cc(C)n(-c3cccc(SC)c3)c2C)n1 747965523 AKXDSIAZEDFULM-INIZCTEOSA-N 428.558 4.221 10 10 IICE COc1ccc(C)cc1[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748009766 WSDWIYSJKTVAQZ-AWEZNQCLSA-N 446.550 4.063 10 10 IICE O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)c(Br)s2)s1 764533217 JTHSMVQLYAXJHH-UHFFFAOYSA-N 446.329 4.343 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCCc3cn(C(C)C)nc32)C1 766892984 UVLUGCOIMPLZQA-QFIPXVFZSA-N 433.600 4.379 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCCOc2c(Cl)cccc21 775727615 VJQDCPSYVLMGCO-IBGZPJMESA-N 433.911 4.029 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)c(OC)c1 777665123 DEVNIRDDBFUJID-UHFFFAOYSA-N 440.930 4.290 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 777808851 JZHWKRDWIKJKDP-OAQYLSRUSA-N 438.641 4.363 10 10 IICE O=C(Nc1ccccc1)C1(NCc2cc(Br)cc(Br)c2O)CC1 779226216 PNFAWUCXUNKLSW-UHFFFAOYSA-N 440.135 4.178 10 10 IICE Cc1cc(-c2nc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)co2)ccn1 857456834 QOSJPHXUCLTLQW-MRXNPFEDSA-N 428.439 4.045 10 10 IICE COC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)c1 914577158 IVODZVLAIBOIMW-UHFFFAOYSA-N 426.878 4.190 10 10 IICE COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 918567551 CBWAPXZTINQGFN-DEOSSOPVSA-N 447.535 4.355 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CCCCC2 1125113978 WGYQUQOGNHNDBZ-AWEZNQCLSA-N 444.528 4.324 10 10 IICE Cc1ccc(-n2nc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)cc2C)cc1 1125259275 ZFWAJRGTIHTYIV-KDURUIRLSA-N 436.531 4.172 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2CCC(C(=O)OC(C)(C)C)CC2)cc1 1137589825 VGJMFDMIJSLRQS-UHFFFAOYSA-N 438.568 4.466 10 10 IICE Cc1cc(CC(=O)N2CCn3ncc(Br)c3C2)c(C)n1-c1ccc(Cl)cc1 1147421410 QTFOXWGZLKFXTA-UHFFFAOYSA-N 447.764 4.291 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 1180420848 QUIUXWWFNZQYRN-QZTJIDSGSA-N 427.957 4.034 10 10 IICE COc1ccc2c(c1)OC[C@H](NC(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)C2 1225636827 MNYKMIYJJXNSBV-QFBILLFUSA-N 443.975 4.388 10 10 IICE CC(C)c1ccc(O[C@H](C)CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1228060286 UMEJMZWDWDPCAB-QGZVFWFLSA-N 447.526 4.192 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@]2(C)Cc2ccc(F)cc2)N(C)C)cc1 1256236650 JHTJNDVBVCCJHK-NOZRDPDXSA-N 426.580 4.301 10 10 IICE C[C@@H](NC(=O)C1(C(=O)OC(C)(C)C)CCCCCC1)c1ccc(N2CCOCC2)cc1 1264822456 RJURXRWENYNIGA-LJQANCHMSA-N 430.589 4.383 10 10 IICE COC(=O)c1ccc2nc(CNC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)[nH]c2c1 1298796814 URZKFUGLHFCTFR-UHFFFAOYSA-N 436.899 4.340 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1)C(C)C 1315188703 LBSRGTDCCVRZIZ-AUSIDOKSSA-N 437.588 4.249 10 10 IICE CC(C)(C)c1ccc(C(F)(F)C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 1355063799 BLAHALLUEDJVEI-GOSISDBHSA-N 443.538 4.094 10 10 IICE C[C@@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1357836533 XDAXIMZSNUJVBW-GCJKJVERSA-N 447.348 4.019 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccn(-c2c(Cl)cc([N+](=O)[O-])cc2Cl)n1 1360274157 VQDVOIGXHWDLOY-UHFFFAOYSA-N 448.310 4.392 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)C3)n2CCNC(=O)C(C)(C)C)c(C)n1-c1ccccc1 1361049143 UYVCSPKTIFPYHN-GOSISDBHSA-N 448.615 4.361 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)c4ccccc4c3O)cc2F)CC1 1443589103 BHVOTDZIIIKTPC-UHFFFAOYSA-N 441.934 4.410 10 10 IICE CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1445162476 PINBZQYEDXFCMM-AREMUKBSSA-N 433.596 4.298 10 10 IICE CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1448004743 LPMOLWVXNDAYBN-HKUYNNGSSA-N 427.545 4.090 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](N(C)CCc4ccccc4)C3)ccc21 1452973772 PASYBSCXULNSHJ-DEOSSOPVSA-N 433.596 4.294 10 10 IICE O=C(Nc1ccccc1C(=O)N1Cc2cccc(O)c2C1)c1ccc([N+](=O)[O-])cc1Cl 1455036920 LEQPUQPPJANWTC-UHFFFAOYSA-N 437.839 4.362 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3c4ccccc4CC[C@@H]3C(C)C)CC2)c(OC)c1 1469707160 GVXRMPNWMAQMTI-BWKNWUBXSA-N 437.584 4.495 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)Nc1ccc2c(c1)OC(F)(F)O2 1473236138 BEQXROKBCDNAMV-UHFFFAOYSA-N 430.329 4.298 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CC[C@H](CC(C)C)C2)cc1 1501831005 RVIILDMYPCLQTN-OAQYLSRUSA-N 440.636 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC[C@H](CCOC)C2)cc1 1515524628 GMPHADRGYQOQQV-OAQYLSRUSA-N 436.604 4.041 10 10 IICE CNC(=O)CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(C)C 1517559232 SENQHRVUONLWRX-UHFFFAOYSA-N 436.604 4.361 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@H](C)C1 1519135714 NIUVQOFPVNCKGU-PKOBYXMFSA-N 440.567 4.168 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4cc(F)cc(F)c4)CCCC3)cc2F)CC1 1521016676 PADJLZCCQDPHSE-UHFFFAOYSA-N 445.529 4.374 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(CS(=O)(=O)C(F)F)cc3)c2C)c1 1531612268 NPAQFWMHVPROPT-UHFFFAOYSA-N 446.519 4.470 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@]12CCC(=O)N1c1ccccc1S2 1545508572 GRSAWCHTLMQLFY-FQEVSTJZSA-N 447.354 4.132 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3csc(C)n3)nnc2Nc2cnn(C)c2)cc1 1547449032 SHHKZXOAYDADNA-UHFFFAOYSA-N 436.589 4.005 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@H]1CCN(c2ccccc2Cl)C1 1564945932 IFSZVLLMSOIYKB-RBUKOAKNSA-N 429.008 4.471 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCc4cc(C)cc(Br)c4C3)C2)cc1 1565055571 GEAMQYGKWZCVII-QGZVFWFLSA-N 444.373 4.113 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC2(Cc3ccc(Cl)cc3)CCC2)N(C)C)cc1 1565452842 MOFGWYXACKCBIG-QFIPXVFZSA-N 429.008 4.473 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1565797490 CSJYKWZTBFEWHS-ZWKOTPCHSA-N 432.362 4.329 10 10 IICE COc1cc(NC(=O)CN(C)C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc(OC)c1 1570016709 CGFKQXYLDWEJGI-UHFFFAOYSA-N 435.524 4.130 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CSCCS2)c(C)n1-c1ccc(Br)cc1 1587498471 OGUDRSVZMXZMKD-MRXNPFEDSA-N 425.417 4.435 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CCCN3Cc3ccc(Cl)cc3)CC2)cc1 1596732833 IPMBDQIKAIWCSY-HSZRJFAPSA-N 427.976 4.052 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)C1 1612775926 KJKJKBGMIINIMK-IBGZPJMESA-N 436.604 4.136 10 10 IICE CCc1nnc(N2CCC[C@H](C[C@@H]3CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613996501 GJCVMZPSSYNMIT-YADHBBJMSA-N 425.621 4.378 10 10 IICE CCc1cc(=O)oc2c(C)c(O)c(CN(CCOC)C[C@H]3CCCN4CCCC[C@H]34)cc12 1614472422 HUCOICWDMNKTBK-NFBKMPQASA-N 442.600 4.082 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](CO)c2ccc(C(F)(F)F)cc2)CCCC1 1624453052 JCGCHDSKPFYSBQ-HXUWFJFHSA-N 446.469 4.397 10 10 IICE Cc1cc(Cl)cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1N 1624914422 IAPKEMYONGXDRV-UHFFFAOYSA-N 427.854 4.016 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)c1ccc(N=NC(N)=O)cc1)NC(=O)OC(C)(C)C 1625699248 CVNKZQUROCHZPW-LJQANCHMSA-N 439.516 4.407 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(COc4cccc(C=O)c4)c3)C2)cc1 1630618913 NCJKKFCEEGHJSO-JOCHJYFZSA-N 444.531 4.343 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](C)N3CCC(Cc4ccccc4)CC3)CC2)cc1 1632154448 UZDOMEAULYJDJB-QFIPXVFZSA-N 435.612 4.077 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H](c1ccccc1)N(C)C 1634385247 VAHUQQFICIIYHC-HSZRJFAPSA-N 425.573 4.068 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)s1 1642157620 AZKAQHCPERRUFQ-UHFFFAOYSA-N 437.565 4.213 10 10 IICE COc1cccc(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)n[nH]2)c1 1644030447 LTDQZHLKPXAYAH-UHFFFAOYSA-N 432.446 4.356 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3cc(Cl)ccc3Cl)CC2)cc1F 1653749550 RPCVNSMHBUQJMN-ZDUSSCGKSA-N 426.319 4.290 10 10 IICE Cc1ccccc1[C@@H](C)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1655222690 CJOUHBSYLDRNSO-SLFFLAALSA-N 427.564 4.057 10 10 IICE Cc1cc(CNC(=O)N2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1675115899 SQBWRMJIIDDHNE-SZPZYZBQSA-N 438.572 4.387 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)c(F)c1 1692651239 DLKOBIJDLSPAHG-KRWDZBQOSA-N 434.519 4.308 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1692986067 PZFLRKJFHYRTQB-RBUKOAKNSA-N 448.615 4.360 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726968154 RQMJHYUDVOLCIA-UXHICEINSA-N 425.621 4.285 10 10 IICE CC(C)Cn1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1741553221 FENUCNQZTNLMQQ-SFHVURJKSA-N 429.565 4.348 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCO3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1761676218 BKNBEXJCSYSRRJ-OAQYLSRUSA-N 437.588 4.129 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N2CC(C)(C)OC(C)(C)C2)cc1 1766611598 LIOWXWYLTSLPDK-UHFFFAOYSA-N 449.603 4.023 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(CCCn3ccnc3)C2=O)cc1OCC 1858591020 UBXSXLKZSBOPTM-XMHGGMMESA-N 431.583 4.362 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](NCc1ccc(Br)cc1O)C2 1878876071 ZAPHLZQKQDAQHM-IVSAIRAKSA-N 429.330 4.123 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)ccc2O)C[C@H]1C1CC1 1895873458 GSHPMNVMBFVTHW-SJORKVTESA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(CCNCc2ccc(Br)cc2O)C1 2140332935 WWMNQUWPXGCNNN-YWZLYKJASA-N 425.367 4.282 10 10 IICE O=C1C(=Cc2ccc(N3CCCCC3)o2)SC(=S)N1Cc1ccc2c(c1)OCO2 2296175739 MVWFJRXUZLUBOW-UHFFFAOYSA-N 428.535 4.400 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc(Br)cc2)SC1=S)Nc1ccccc1 2314842154 CLMDWGGVKDICRI-UHFFFAOYSA-N 433.352 4.289 10 10 IICE CN1CCN(c2ccc(N3C(=O)C(=Cc4ccc(F)cc4F)SC3=S)cc2)CC1 2321684710 WUDIKDXMFIEGJB-UHFFFAOYSA-N 431.533 4.122 10 10 IICE CCOc1cc(C=C2C(=O)N(Cc3ccccc3)N=C2C)ccc1OCC(=O)N(CC)CC 2332139664 FYPICXKWUYWYNV-UHFFFAOYSA-N 449.551 4.134 10 10 IICE CCOC(=O)c1csc2ncnc(Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)c12 71529898 IAPUSAUOBVUOGJ-UHFFFAOYSA-N 429.457 4.387 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CCc3[nH]nc(C(F)(F)F)c3C2)cc1 749208724 NQRBBPDLKUMXPI-INIZCTEOSA-N 446.473 4.421 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2ccncn2)c(C)n1-c1ccc(OC(F)(F)F)cc1 754925055 QIJRETOCKFKBGD-FPYGCLRLSA-N 445.397 4.222 10 10 IICE CCOC(=O)c1csc(C2CCN(Cc3cc(Br)ccc3O)CC2)n1 763497651 IXBSKKQDTUTLSI-UHFFFAOYSA-N 425.348 4.168 10 10 IICE COc1ccc(NC(=S)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Cl 768296362 NOQBDQSOEOTXJA-UHFFFAOYSA-N 445.032 4.367 10 10 IICE COc1ccc(CNC(=O)C[C@@H](NC(=O)OC(C)(C)C)c2cc(C)nc(Cl)c2)c(O)c1 794380385 BGEIPWJGNOWUEF-QGZVFWFLSA-N 449.935 4.030 10 10 IICE CCCc1c(NC(=O)NCc2ccc(N(C)C)cc2)cnn1-c1cc(F)c(OC)cc1F 794906248 BLHWAOATMMMGAO-UHFFFAOYSA-N 443.498 4.499 10 10 IICE CCOc1ccc(-c2csc(NS(=O)(=O)c3cccnc3C(F)(F)F)n2)cc1 808529737 RCBOASGNKLRFBV-UHFFFAOYSA-N 429.445 4.423 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(F)c(NC(=O)OC(C)(C)C)c3)C2)cc1 1129991745 XCERDDALGCVHAO-INIZCTEOSA-N 443.519 4.438 10 10 IICE CCOC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1158170826 FJBNKCOPFJMGLK-MJGOQNOKSA-N 433.346 4.318 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H]4[C@@H]3CCN4C(=O)OC(C)(C)C)cc2)CC1 1197146310 PXPCKGUPGIURAJ-XZOQPEGZSA-N 429.605 4.276 10 10 IICE C[C@]1(NCc2cc(Br)cc(F)c2O)CCN(C(=O)OCc2ccccc2)C1 1202227072 KFERJAVCFCRYOV-FQEVSTJZSA-N 437.309 4.185 10 10 IICE C[C@@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(F)cc1OC(F)F 1225580814 ISDGJGKZMQERLF-KUHUBIRLSA-N 438.494 4.156 10 10 IICE COC(=O)[C@@H](Cc1cc2ccccc2o1)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1288740875 XTQOGVAHPFOMRE-HSZRJFAPSA-N 430.504 4.283 10 10 IICE Cc1cc(N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)nc(C(C)C)n1 1290320441 HIPSHKKORNULDO-UHFFFAOYSA-N 445.567 4.091 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC(C)C)C1CC1 1295152843 TYPHMDXMEPFEEG-UHFFFAOYSA-N 434.588 4.256 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCSC[C@H]2C)cc1 1295415235 OVZGINHWGVBANJ-WIYYLYMNSA-N 429.634 4.356 10 10 IICE COc1ccc2[nH]cc(C3=CCN(c4nc(C)ncc4I)CC3)c2c1 1306935267 MQVDRUPQSVBGSF-UHFFFAOYSA-N 446.292 4.173 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1 1312887104 ZFUQZQCXZFOMAM-GOSISDBHSA-N 448.571 4.026 10 10 IICE CCCCS(=O)(=O)CC(=O)Nc1sc(C)c(-c2ccc(F)cc2)c1C(=O)OCC 1353964416 GKRANSPGBTVMBE-UHFFFAOYSA-N 441.546 4.193 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NCc2ccc(N(C)C)c(F)c2)c1 1358004099 NCTDEXAXNKUWAI-UHFFFAOYSA-N 432.389 4.110 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)C1C[C@@H]2CCC[C@H](C1)C2NC(=O)OC(C)(C)C 1360847937 CWOKVYLPEHPRHF-RPIYSHSISA-N 443.588 4.198 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(-c3ccc(C=O)o3)cc2O)cc1 1442612216 JZUKZIFBFGHOMT-NRFANRHFSA-N 448.519 4.352 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 1444636441 IZIWMTYQHMGSQR-INIZCTEOSA-N 439.903 4.377 10 10 IICE O=C(C[C@@H](c1ccccc1)c1ncc[nH]1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444983478 FETGHSSPEYFUAV-NQIIRXRSSA-N 440.494 4.318 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CN(c2ccc(Br)cc2)C1=O 1450759420 CWKXICFJVKLZMK-MRXNPFEDSA-N 444.354 4.063 10 10 IICE CC(C)Cc1ccc(C(=O)CCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1451058989 RNMDGRNJEDDDNA-UHFFFAOYSA-N 444.522 4.279 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1456076735 QKSCWQRILCEYTI-OAHLLOKOSA-N 441.519 4.019 10 10 IICE Cc1cc(C(=O)Cn2nnc3cc(F)ccc3c2=O)c(C)n1-c1ccc(F)c(Cl)c1 1459176456 ZJJGCQANZZVMMH-UHFFFAOYSA-N 428.826 4.014 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CC=C(c2ccc(F)cc2)CC1 1469554342 YFBQQVMRQWDQAR-FQEVSTJZSA-N 445.485 4.376 10 10 IICE Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)o1 1470449057 GTJLMQSNDAVDPE-MGPUTAFESA-N 433.499 4.386 10 10 IICE CCOCc1nnc(N(CC)CCc2cccs2)n1Cc1ccc2c(c1)CCCN2C 1503025280 UEZODGUALIKQBW-UHFFFAOYSA-N 439.629 4.376 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1516370782 BVDQKTIRJZGWAP-DHIUTWEWSA-N 448.615 4.403 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H](OC)C(C)C)CC2)cc1 1518309701 RGRVCBWMWIBRHV-QFIPXVFZSA-N 443.636 4.263 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1[N+](=O)[O-] 1520120525 OOPQZLFDFNJOEM-GZTJUZNOSA-N 445.497 4.272 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)ccc21 1526200174 LDIPFIKPCHTWMP-WMZOPIPTSA-N 433.552 4.001 10 10 IICE CCOc1ccc(N2C[C@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1534761010 YDQSHWJGQVBZGM-OAQYLSRUSA-N 431.536 4.162 10 10 IICE CC(C)(C)Cc1nnc(N2CCSCC2)n1Cc1ccc(N2CCSCC2)cc1 1541189121 QMJGUYOLQLQQBZ-UHFFFAOYSA-N 431.675 4.021 10 10 IICE COc1ccc(N2CCC(NC(=O)C3(N(C(=O)OC(C)(C)C)C4CC4)CCC3)CC2)cc1 1542704314 YTBZMRLIQJWOPU-UHFFFAOYSA-N 443.588 4.102 10 10 IICE CCC(=O)c1ccccc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1543733753 SJQBHJZHXTYGKL-UHFFFAOYSA-N 428.400 4.215 10 10 IICE CCOC(=O)[C@H](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)Cc1ccccc1 1544101206 VKGLAQIDAWQXIJ-FQEVSTJZSA-N 448.563 4.067 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](CN3CCC(C)CC3)C2)cc1 1544462773 XBKAGYKFUXPOJO-DEOSSOPVSA-N 435.612 4.420 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1547444189 LKMRDGFBBWSCJO-CVDCTZTESA-N 436.604 4.039 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cnc(C4(C)OCCO4)s3)cc2Cl)C1 1568141842 GVSIJHCGUQJUHX-AWEZNQCLSA-N 435.977 4.182 10 10 IICE CC[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N(C)C(=O)OC(C)(C)C 1587150111 AHSPMVDBIHXMLH-CRAIPNDOSA-N 441.519 4.019 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCNC(=O)c1ccc(Br)cc1 1597252083 HDDRTDWXYBMCJA-UHFFFAOYSA-N 446.370 4.078 10 10 IICE CCOC(=O)c1c(C)oc2ncn(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)c(=O)c12 1613389458 UNSGPLTVNJDLKL-UHFFFAOYSA-N 447.491 4.073 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N(C)C2CC2)c(C)n1-c1cccc(C(C)C)c1 1624648180 BQQMCUHLUUUGEP-JOCHJYFZSA-N 425.598 4.353 10 10 IICE C[C@@H](NC(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1)c1ccc(N(C)C)cc1 1625544711 WRUBHTWXAKTZPA-QGZVFWFLSA-N 427.504 4.040 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCc2c(F)cccc21 1626109742 NZCCEOXXDFBVNA-IZILLXMLSA-N 444.528 4.360 10 10 IICE Cc1cc(C(=O)NCCSCC(F)(F)F)c(C)n1-c1ccc(Br)cn1 1631796661 SASLYMXMUZRUTQ-UHFFFAOYSA-N 436.297 4.277 10 10 IICE O=C(Cc1noc2ccc(Br)cc12)NCc1ccc(N2CCCCC2)cc1 1638694047 NXAIROQHUOMRLQ-UHFFFAOYSA-N 428.330 4.440 10 10 IICE O=C(NCc1c(O)cccc1O)c1ccccc1Sc1ccc(Br)cn1 1639289819 XPGMPHTZOLCYJQ-UHFFFAOYSA-N 431.311 4.337 10 10 IICE COc1ccc([C@H](NC(C)C)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1641335326 TYURAARPNMYVBX-GCJKJVERSA-N 447.526 4.121 10 10 IICE CSc1nc2ncn(CC(=O)c3cc(C)n(-c4ccc(C)c(F)c4)c3C)c(=O)c2s1 1651766007 ZLNDOJOEPMGSSZ-UHFFFAOYSA-N 442.541 4.313 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C2CCC(CO)CC2)sc(C)c1-c1ccccc1 1653813227 ZEQFBEWIPQWRNO-UHFFFAOYSA-N 444.597 4.322 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](CC3CCCC3)c3ccccc3)CC2)cc1 1653967382 GOZAVBRAQHOTKD-AHKZPQOWSA-N 437.628 4.089 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C[C@@H](O)c1cccc(Br)c1 1673745228 RKQMQXCSGORJBG-IIBYNOLFSA-N 448.405 4.130 10 10 IICE Cn1cc(CCNC(=O)NCc2cccc(Br)c2O)c2ccc(Cl)cc21 1681397808 PUXAKTTWQHIIRH-UHFFFAOYSA-N 436.737 4.342 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(OCC4CCCCC4)CC3)C2)cc1 1683336803 LTLXYARASNDIIQ-NRFANRHFSA-N 429.605 4.292 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCc2cc(Cl)cc(Cl)c2F)N(C)C)cc1 1683436586 ACQUUNKSRFHYSM-GOSISDBHSA-N 427.351 4.301 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC([C@H]4CCCO4)CC3)nnc2C(C)(C)C)cc1F 1729330035 QFOBJQOLDVNNLY-OAQYLSRUSA-N 429.584 4.224 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1)OC 1744118157 CUOYPMJLLRQVIZ-FCHUYYIVSA-N 437.588 4.393 10 10 IICE COC[C@@H]1CCCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1749477285 JOLWJRUUKSNQPJ-LJQANCHMSA-N 431.600 4.373 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N(C)CCc1cccs1 1751432554 JJULLGNUTXWVGV-OAQYLSRUSA-N 425.602 4.293 10 10 IICE Cc1nc(Cc2nnc(N(C)CC3CC(F)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1762265653 MZPVHAWSQLKWDM-UHFFFAOYSA-N 446.571 4.072 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CCC1 1766225448 ULPRXDPZPXEJDE-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CNC(=O)C1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)CC1 1769218115 DETHVKLZPCERAS-UHFFFAOYSA-N 448.615 4.361 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3nc(-c4cccc(Cl)c4)oc3C)CC2)cc1 1858084131 STXANKBNULXTPV-UHFFFAOYSA-N 425.916 4.203 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(F)cc2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2C 1859571491 KDWJWUDAJAUZMQ-UHFFFAOYSA-N 445.541 4.312 10 10 IICE Cc1cc(O)nc2ccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc12 1866228140 FZDTUICOCYKJTC-DEOSSOPVSA-N 432.568 4.272 10 10 IICE Cc1ccc(-n2nc(C(=O)Nc3ccc(Oc4ccc(N)cc4)cc3)c(=O)cc2C)cc1 1866284072 LXVHLVPOMDTOTK-UHFFFAOYSA-N 426.476 4.476 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3cccc(OC(=O)C4CCCC4)c3)CC2)cc1 1874737235 PMXOOTPWJPLODU-UHFFFAOYSA-N 436.552 4.186 10 10 IICE C[C@H](c1ccccc1O)N(C)C(=O)C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2060163212 CVELSKQIHZRWGZ-UYAOXDASSA-N 442.556 4.412 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)cc1 2296940644 RLSQUEGSYIDKHH-UHFFFAOYSA-N 443.503 4.468 10 10 IICE O=C1N=C(N2CCN(Cc3ccc(F)cc3)CC2)SC1=Cc1ccc(OC(F)F)cc1 2297110528 IZRARXWSSDNCHD-UHFFFAOYSA-N 447.482 4.215 10 10 IICE COc1ccc(C2=NN(c3ccccn3)C(=O)C2=Cc2cc(Cl)c(O)c(OC)c2)cc1 2332139779 RBIZCUDSEDPHBT-UHFFFAOYSA-N 435.867 4.292 10 10 IICE CSc1ncc(Cl)c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)n1 11571902 IOSMIIQYKACDGG-UHFFFAOYSA-N 433.892 4.438 10 10 IICE COc1ccc(/C=C2\C(=O)N(c3ccc(I)cc3)N=C2C)cc1OC 16694347 WZZHSOYVPKRTPQ-YBEGLDIGSA-N 448.260 4.115 10 10 IICE CC(C)CNC(=O)Nc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 586610429 PDTIEEFZSOSESH-UHFFFAOYSA-N 441.487 4.492 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)NC(=O)OC(C)(C)C)cc1 742752233 FLGGGOWRZZVUMY-VSKRKVRLSA-N 441.547 4.377 10 10 IICE COc1ccc(N2CCC(NC(=O)NC[C@H]3CCCN(C)[C@H]3c3cccs3)CC2)cc1 745795670 IBXUMZBRAUTXNR-WZONZLPQSA-N 442.629 4.108 10 10 IICE O=C1NN(c2ccccc2)C(=O)/C1=C/c1cnc(-c2ccc(Br)cc2)s1 751536697 XFITVVWXGVABHK-MHWRWJLKSA-N 426.295 4.034 10 10 IICE O=C(CCCc1cc(F)ccc1F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 761340771 BCMHBFPCFBVNPB-UHFFFAOYSA-N 442.428 4.459 10 10 IICE COCCn1c(C)c(C)c2cc(-c3nc(CC(=O)N(C)Cc4ccccc4)no3)ccc21 771644376 BTYXSVURRAROSD-UHFFFAOYSA-N 432.524 4.156 10 10 IICE CNC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc4ccccc34)c(C)s2)cc1 777695035 OIZIFBTXIDNIIM-UHFFFAOYSA-N 437.546 4.432 10 10 IICE C[C@@H](NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccc(N2CCOCC2)cc1 779873230 IXQBVRAQWXYGLJ-CQSZACIVSA-N 429.492 4.416 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 802286409 SGOLUZPBKGXZGU-HXUWFJFHSA-N 437.519 4.117 10 10 IICE O=C(NCCCSc1nccs1)N1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1 812154730 VNJARTGWHFRWTR-LLVKDONJSA-N 435.497 4.050 10 10 IICE COc1ccc(C)cc1[C@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 823327580 SJIZBWTZGMYPCY-AWEZNQCLSA-N 444.443 4.178 10 10 IICE O=C(NCc1cccc(COc2ccccc2)c1)NCc1ccc(N2CCOCC2)c(F)c1 918131478 HABLWEKPAAOLMW-UHFFFAOYSA-N 449.526 4.241 10 10 IICE C[C@@H]1CCC(F)(F)CN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1135067275 PIZQRZUVQKSJBL-JXCQQFQQSA-N 428.501 4.063 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)n1C1CCOCC1 1136480245 GNGIHLPFSCGVLT-XMMPIXPASA-N 439.600 4.344 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(Br)c(CO)c2)CCCC1 1144131719 RLZIKNPSFDUZKI-UHFFFAOYSA-N 443.341 4.422 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1[nH]c2ccc(F)cc2c1Cl 1152401830 PYVNWECBBURHGY-UHFFFAOYSA-N 425.243 4.135 10 10 IICE C[C@@H](Oc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cn1)c1ccccc1 1158716699 HEYAPNGDORNQEV-NTKDMRAZSA-N 432.568 4.320 10 10 IICE COc1ccc(CN(C)[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1167325456 BQYWLJCHVOWXIK-QGZVFWFLSA-N 442.515 4.238 10 10 IICE CN(C)c1ccc2c(c1)OCCN2CC(=O)N(C)[C@H](c1ccccc1)c1ccc(F)cc1 1192940075 YYKZSRBEFKLNEG-AREMUKBSSA-N 433.527 4.339 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3[C@H](O)C(F)(F)F)cc2Cl)C1 1235834059 NAZQKHOBUSHRSG-XWIAVFTESA-N 433.902 4.174 10 10 IICE COc1ccc(OC(C)(C)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1265566059 GPZKGMJVMLNBIN-INIZCTEOSA-N 434.483 4.239 10 10 IICE CN(CC(F)(F)F)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1298241444 ZKIUZMDZWPPAEK-UHFFFAOYSA-N 427.540 4.176 10 10 IICE Cc1c(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc(CNC(=O)OC(C)(C)C)n1C 1298841304 NSRVGZBBXXZMAB-UHFFFAOYSA-N 442.343 4.301 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2cccs2)cc1F 1314661922 VHLAURMHGUTYFM-KRWDZBQOSA-N 429.565 4.123 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)CCN1CCN(c2cccc(Cl)c2)CC1 1448441590 VBLSEZVUAIFIBQ-UHFFFAOYSA-N 429.992 4.387 10 10 IICE COc1ccc(Cl)cc1[C@H](O)CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1449493564 ZXWCMBXUQJWHAB-OAQYLSRUSA-N 426.900 4.032 10 10 IICE Cc1cc(CC(=O)NCCNC(=O)OCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1457327959 OKWCNXMESPELJO-UHFFFAOYSA-N 439.943 4.333 10 10 IICE Cc1cc(CC(=O)Nc2cc(=O)n(C)cc2Br)c(C)n1-c1ccc(Cl)cc1 1463042946 QAVLQDMXXJXLAY-UHFFFAOYSA-N 448.748 4.390 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1496706638 HYNJVBKBWUYHQQ-UHFFFAOYSA-N 440.636 4.110 10 10 IICE CC(C)CN(c1nnc(C(=O)NC(C)C)n1Cc1ccc(N(C)C)c(F)c1)C1CCCC1 1509381520 YSYBTMBETXYLHB-UHFFFAOYSA-N 444.599 4.075 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCSC(C)(C)C1 1510675718 UNUIMXLDKOFCQS-UHFFFAOYSA-N 436.629 4.018 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC(c3ccnn3C)CC2)cc1 1515531655 JRYSOFDXZIQFJO-UHFFFAOYSA-N 449.647 4.489 10 10 IICE COc1ccc([C@@H]2C[C@H]2CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 1527481806 RJSLIPKKLAZLOH-TZLLFPAYSA-N 426.532 4.258 10 10 IICE COC(=O)c1ccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(Cl)c1 1529495255 UXYHWYHNQABBQG-UHFFFAOYSA-N 440.927 4.453 10 10 IICE COC[C@@]1(C(=O)OC)CCCCN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1533734391 JDRGZRSEKKQGIR-XMMPIXPASA-N 438.528 4.352 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2c(F)cccc21 1538193106 NZCCEOXXDFBVNA-GEBKJHSDSA-N 444.528 4.360 10 10 IICE COC(=O)c1ccc(S[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559357549 CPFGVDWPBMFRKL-AWEZNQCLSA-N 445.496 4.368 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCC[C@H]1Cc1ccccc1F 1565126653 AWMNWSPQAFVZCH-QFIPXVFZSA-N 425.548 4.094 10 10 IICE CCOCCCN1CC[C@@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@@H](C)C1 1565726640 XFLFFRFWNYKUHW-YADARESESA-N 439.600 4.082 10 10 IICE CCCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1583920130 WRJZEXBKTHAMEY-UGKGYDQZSA-N 447.620 4.296 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(Br)c(OC(C)C)c2)cc1 1586649122 HHQDEUCQQLBOKZ-UHFFFAOYSA-N 435.362 4.453 10 10 IICE CC(C)c1nnc(N2CCC(n3cc(Cl)cn3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1598601827 HUXDVHZLHSBCRH-UHFFFAOYSA-N 445.974 4.346 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2CCCCC2)CCOC1 1610359372 GSNAQFDCMBKGAR-XMMPIXPASA-N 428.577 4.241 10 10 IICE CCC[C@@](C)(O)Cn1c([C@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1614323706 HSMSLUVBMLMWQU-NTKDMRAZSA-N 429.609 4.068 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CCC(C)(C)C2CC2)CCOC1 1616151281 BCBSQEJBLDEHHN-XMMPIXPASA-N 428.577 4.099 10 10 IICE COCCN(Cc1ccc2c(c1)OCO2)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1617615297 JPTKKGZRKKWLHP-UHFFFAOYSA-N 436.508 4.120 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](O)c3ccccc3Br)ccc21 1626430918 KVSBXRCYEKWLIP-OAQYLSRUSA-N 445.357 4.130 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 1629602145 GIXQKDPMZCWMRP-NRFANRHFSA-N 435.911 4.095 10 10 IICE CC(C)C[C@@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N(C)C(=O)OC(C)(C)C 1631219028 LBFIWHOLVIYUOK-PMACEKPBSA-N 434.577 4.181 10 10 IICE O=C(C1=Cc2cc(Br)ccc2OC1)N(Cc1ccccc1O)C[C@H]1CCCO1 1636950517 BDJLQOJTLYTZSJ-LJQANCHMSA-N 444.325 4.138 10 10 IICE CC(C)C[C@H](CNC(=O)OC(C)(C)C)CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1636951451 SOOOJZVMXIKIDR-PZJWPPBQSA-N 448.604 4.477 10 10 IICE CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1637410504 ODDKVIOSRGBQHC-VWLOTQADSA-N 425.573 4.257 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccc2cncc(Br)c2n1 1638305939 RHKQVUVUWZZODS-UHFFFAOYSA-N 427.085 4.335 10 10 IICE CC[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc2ccccc12 1638485017 QWDKGFMIGQWXOB-VWLOTQADSA-N 444.579 4.492 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1c[nH]cc1-c1ccc(Cl)s1 1638688250 GPCIRGSFGUEYQR-UHFFFAOYSA-N 437.899 4.441 10 10 IICE CC(C)(C)OC(=O)NCc1nc(CC(=O)NCc2cc(Cl)cc(Cl)c2O)cs1 1641997740 XBRUYCVMLIPKNC-UHFFFAOYSA-N 446.356 4.039 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Cn3c(-c4cccc([N+](=O)[O-])c4)noc3=O)c2C)c1 1643868045 CSKAIAFYUJZSOY-UHFFFAOYSA-N 432.436 4.010 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)N(Cc3ccccc3O)C3CCCCC3)C2)cc1 1681946241 VMCAWKPVLAEEEE-QFIPXVFZSA-N 437.540 4.438 10 10 IICE COC(=O)c1ccc2cc(CCNC(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)oc2c1 1683255146 YLNSUODIJLXIJP-KRWDZBQOSA-N 437.540 4.067 10 10 IICE C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1684168844 GQEBBULUSUHMTK-CYFREDJKSA-N 434.584 4.071 10 10 IICE CN(CCCc1cc(-c2ccccc2)no1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684606627 HTGRWTJURGDAQA-VWLOTQADSA-N 449.599 4.285 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCc3c(OC)ccc4ccccc34)CC2)cc1 1687559602 AHYMIMWTCOCAFZ-UHFFFAOYSA-N 433.552 4.321 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C1 1741584515 JVNOCDULAJJUKH-KRWDZBQOSA-N 446.646 4.174 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746942368 NCOAFJYWTOLQHB-RTWAWAEBSA-N 429.584 4.124 10 10 IICE Cc1cc(C)c(NC(=O)CN(C)c2nnc(C)n2CCCSc2nccs2)c(C)c1 1751391890 BNEYHRQJJZJNSB-UHFFFAOYSA-N 444.630 4.226 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(C(C)(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1761842956 OTNZMNPNENGFFM-GOSISDBHSA-N 430.616 4.356 10 10 IICE CC[C@@H](C)CN(CC)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763886187 IBKMVWCETUBJHH-XMSQKQJNSA-N 445.583 4.026 10 10 IICE CCCN(CCC)c1nnc([C@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1764345539 GHKYXPQRFHXXQV-JOCHJYFZSA-N 438.620 4.140 10 10 IICE CCc1cccc(CC)c1NC(=O)COc1cccnc1NC(=O)Oc1ccc(N)cc1 1858681131 ZGKITQUJDYBYSC-UHFFFAOYSA-N 434.496 4.417 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1OC 1860085540 QPPHFQPGYITPTK-VCHYOVAHSA-N 445.518 4.294 10 10 IICE Cn1nc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1-c1ccc(F)cc1 1861849983 BVNSZBNBOWHGBN-UHFFFAOYSA-N 425.419 4.254 10 10 IICE Cc1cc(O)nc2ccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc12 1866228141 FZDTUICOCYKJTC-XMMPIXPASA-N 432.568 4.272 10 10 IICE O=C(O)[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@@H]1c1ccc(O)c(O)c1 1894482688 GAUJAKYPDCXJKP-NHCUHLMSSA-N 445.471 4.147 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H](NCc2cc(Br)cc(F)c2O)C1 1962885064 TZUJVLOERPYHBO-IUODEOHRSA-N 431.346 4.467 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C[C@H]2NCc2cc(Cl)cc(Br)c2O)C1 1965931894 KNSKGXFSJCCLNL-NJZAAPMLSA-N 431.758 4.153 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010404793 VJMOMDRUCRPOLA-RTBURBONSA-N 431.537 4.036 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(C)(C)C)c(CN)c1I 2079037118 DBNHPYHDWUKWCQ-AWEZNQCLSA-N 427.330 4.257 10 10 IICE CCc1nn([C@H](c2ccc(C)cc2O)C2CCC2)c(I)c1C(=O)O 2079124793 JPMQYKXTSGRPOI-INIZCTEOSA-N 440.281 4.152 10 10 IICE CC[C@@H](NC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)c1cc(Br)ccc1O 2119085633 ZMYHVLIPPBDIGL-YYIAUSFCSA-N 425.367 4.308 10 10 IICE CCOc1cc(C=C2C(=O)NN(c3ccccc3)C2=O)ccc1OCc1ccccc1C 2293628322 LCWSYRBJKCGSFK-UHFFFAOYSA-N 428.488 4.434 10 10 IICE CCCCCN1C(=O)C(=Cc2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 2296546157 QJVPNVNJVMYJAU-UHFFFAOYSA-N 444.626 4.462 10 10 IICE O=C1C(=Cc2ccccc2)SC(=S)N1CCC(=O)N1CCCC[C@@H]1c1cccnc1 2297474092 HOLVBYSBRGUJTL-LJQANCHMSA-N 437.590 4.427 10 10 IICE Cc1ccccc1NC(=O)CCCN1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S 15039195 NAWOYASGVZNTMF-WQRHYEAKSA-N 428.535 4.026 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C\c2ccc(OC)c(O)c2)cc1 27550376 FTLFFLGUNHPJEK-MOSHPQCFSA-N 445.431 4.152 10 10 IICE Cc1cccc(N2C(=O)/C(=C\c3ccc(OS(C)(=O)=O)c(Cl)c3)SC2=S)c1 33457100 XMWQFNQAICFFBD-MHWRWJLKSA-N 439.967 4.393 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3ccc(OCC(C)C)c(OC)c3)CC2)cc1 108430372 QBESFOIBFRCCHM-NTUHNPAUSA-N 438.568 4.491 10 10 IICE Cc1cc(NC(=O)COc2ccc(/C=C3\SC(=S)N(C)C3=O)cc2)ccc1Cl 111845844 VWYKUTYUUZSVNA-YVLHZVERSA-N 432.954 4.497 10 10 IICE COc1cccc(CNC(=O)Nc2cc(Br)ccc2Br)c1O 729550514 HTBXTYGCQTZCEQ-UHFFFAOYSA-N 430.096 4.248 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC[C@H](CC(F)(F)F)C1 764766054 XRHZHWSEUSMZIV-CYBMUJFWSA-N 439.400 4.026 10 10 IICE COc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1OC(F)F 768670993 WBDOEAOAJBKERM-UHFFFAOYSA-N 431.527 4.118 10 10 IICE Cc1cc(Br)cc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c1O 779001801 BSRWSKRBQSCZBJ-OAGGEKHMSA-N 434.378 4.323 10 10 IICE COc1ccc(N2CCN(CCNC(=O)Nc3cc(-c4cccnc4)ccc3C)CC2)cc1 797653645 DBBMWWYBYWMFOU-UHFFFAOYSA-N 445.567 4.009 10 10 IICE Cc1cc(F)cc([C@@]2(F)CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)C2)c1 799893765 WPDRHOYESYZKIP-MHECFPHRSA-N 429.511 4.312 10 10 IICE CN(CC(C)(C)C)C(=O)c1cccc(C(=O)NCc2cc(Br)ccc2O)c1 804739414 FTXVGDARCFNCJM-UHFFFAOYSA-N 433.346 4.203 10 10 IICE CC(=O)C(=O)COC(=O)c1cc(/C=C\c2ccc(C)o2)nc2ccc(Br)cc12 808508615 GMHDVFRYHILGDW-ALCCZGGFSA-N 442.265 4.384 10 10 IICE CC(=O)N1CCC[C@@H]1C(=O)OCC(=O)c1cc(C)n(-c2cc(Cl)cc(Cl)c2)c1C 917242946 FBPFEZKFKSITCN-LJQANCHMSA-N 437.323 4.138 10 10 IICE CC[C@@H](C)c1nc(C)c(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 1125256478 IIEXGOIPNSAFHH-ZACQAIPSSA-N 442.579 4.219 10 10 IICE COc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)ccc1OC1CCCC1 1134682024 QHNKKGNYPZCTGG-QFIPXVFZSA-N 425.573 4.115 10 10 IICE O=C(NCCCSc1nccs1)c1ccc(Cn2cc(Br)cn2)cc1 1136661719 NWBUGBLBHSBTDD-UHFFFAOYSA-N 437.388 4.063 10 10 IICE COc1ccc(C(=O)Nc2ccc(C(=O)NCc3ccc4cccnc4c3O)s2)cc1 1142728248 PEMYKRJBIHRHAY-UHFFFAOYSA-N 433.489 4.193 10 10 IICE Nc1ccc(C(F)(F)F)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150352852 AVUIDGRRQIDUNP-OAHLLOKOSA-N 427.854 4.041 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(Cl)cc3)c3ccccc3)nc12 1167853181 XHYWZIUUVVUMGY-UHFFFAOYSA-N 436.899 4.472 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1 1235490356 YMZCIFABJNSMOL-HXUWFJFHSA-N 446.389 4.269 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)COc1cccc(NC(=O)c2ccco2)c1 1264286953 DXDKOZKZBPLNNH-UHFFFAOYSA-N 433.508 4.170 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@H](C(F)(F)F)CN2C(=O)OC(C)(C)C)cc1 1291710648 KAGIUBNTZVZEDC-WMZOPIPTSA-N 443.510 4.337 10 10 IICE CCc1nnc(N2CCCC[C@@H](SC)C2)n1Cc1ccc(N2CCSCC2)cc1 1293061315 ZNHIIPFJLLGPMS-HXUWFJFHSA-N 431.675 4.164 10 10 IICE COCC(C)(C)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1300945641 QPXIQZHHADATOB-UHFFFAOYSA-N 448.615 4.173 10 10 IICE Cc1cnc([C@@H](C)Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)s1 1304610336 NTIBTMQNPBKRIN-MAUKXSAKSA-N 427.574 4.083 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)Nc1cccc(CN2CCSCC2)c1 1307591532 OTXVTQOKEYZEJC-UHFFFAOYSA-N 425.598 4.025 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1C[C@]12CCCN(C(=O)OC(C)(C)C)C2 1356267698 RVDLTMDRAFAHND-BWKNWUBXSA-N 427.589 4.282 10 10 IICE COCc1nn(C)cc1C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1 1357975326 KLYUCBPWPUKTBF-UHFFFAOYSA-N 439.516 4.489 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ncnc(O)c1Br 1446801384 HTPFMABUINDNLH-ZDUSSCGKSA-N 428.286 4.054 10 10 IICE CCN(CC)c1ccc2cc(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)c(=O)oc2c1 1455933664 QXAGMRWXXDFZED-UHFFFAOYSA-N 449.551 4.047 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCNC(=O)c1cccc(Br)c1 1464709297 VXLCGTNTJHLBNA-UHFFFAOYSA-N 446.370 4.078 10 10 IICE COC(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1OC 1466085302 VIWKKOBYJDZXGS-UHFFFAOYSA-N 426.900 4.473 10 10 IICE COC(=O)N1CCC(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CC1 1467827480 ZLDAQEVVXDDVQP-UHFFFAOYSA-N 448.361 4.065 10 10 IICE CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)N(Cc2ccccc2O)C2CCCCC2)C1 1469838439 IYJRMBJYQBQRDV-MOPGFXCFSA-N 431.577 4.494 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(C)C 1501395228 ZAFWDZAMDOIYFY-UHFFFAOYSA-N 436.604 4.313 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@@H](C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1510621702 ZEDHOFWDWPXUEG-IBGZPJMESA-N 439.629 4.457 10 10 IICE Cc1csc([C@@H](C)Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)n1 1511449032 RZDREABGJFVFCL-HNAYVOBHSA-N 427.574 4.430 10 10 IICE C[C@@H]1CCC[C@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1512115590 YBDCJHQCHFFPOW-KNQAVFIVSA-N 425.621 4.475 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)CC2CCCCC2)cc1 1515520972 BEWGWIVMHJHQGN-UHFFFAOYSA-N 440.636 4.327 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C)C(C)C 1517811145 CIMLQWNMYPQVKO-CVDCTZTESA-N 437.588 4.249 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CSc3nnnn3C3CCCC3)cc2Cl)C1 1519551389 MMSRYUJBSLIJRK-OAHLLOKOSA-N 449.024 4.086 10 10 IICE CCN(Cc1ccccc1)c1ccc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1536524285 PTJIRFHHIYGJAX-UHFFFAOYSA-N 442.607 4.395 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@@H](C)c3ccc(F)c(Br)c3)C2)cc1 1538745529 FCRDAXAIHULCJD-ZBFHGGJFSA-N 435.337 4.486 10 10 IICE Cc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1N1CCN(C)CC1 1540001825 VWJNAYMYWFXRKB-UHFFFAOYSA-N 444.579 4.148 10 10 IICE CC(C)(C)[C@H]1CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CCO1 1541167280 CIUUCMSDXPPNDH-QGZVFWFLSA-N 444.630 4.230 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)N(C)Cc3ccccc3)CC2)c(C)n1-c1ccccc1 1543136168 TZSUMLKAONGMQK-UHFFFAOYSA-N 444.579 4.033 10 10 IICE COc1cccc([C@H](NC(=O)OC(C)(C)C)C(=O)NCc2ccc(N3CCCC3)cc2)c1 1543591606 PHDIKYYYVWGTLW-QFIPXVFZSA-N 439.556 4.178 10 10 IICE CCCN(C)c1nnc(-c2ccc3c(c2)OCCO3)n1CCCSc1nccs1 1547086999 ZCUIHXKPWFXWSW-UHFFFAOYSA-N 431.587 4.201 10 10 IICE COC[C@H](C)Cn1c(CC2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1555240436 BMEJNOVBECFHJZ-HXUWFJFHSA-N 441.620 4.019 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2cccc(Br)c2)c(C)n1-c1ccc(F)cc1 1556343178 LMZSEZSBNOZIGB-FQEVSTJZSA-N 431.305 4.459 10 10 IICE O=C(Nc1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1)c1ccc(Br)o1 1558036510 UNJKCHNDRYDRDY-UHFFFAOYSA-N 427.254 4.156 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@@H](Oc1ccc(Br)cc1)c1ccccc1 1558174991 XDGCGJMDWDGHPV-FQEVSTJZSA-N 428.282 4.297 10 10 IICE CC[C@H](c1ccccc1)N1CCN(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1 1564962685 NDUVIIJZSKPACR-SQJMNOBHSA-N 436.600 4.000 10 10 IICE Cc1ccc(C(=O)N2CCN(c3cc(F)ccc3F)CC2)cc1-n1c(C)cc(C=O)c1C 1566247590 OABLHGHLHFPGTJ-UHFFFAOYSA-N 437.490 4.456 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(CN2CCCCC2)o1 1566356590 IYDXYASJQBKPGT-IBGZPJMESA-N 431.964 4.019 10 10 IICE O=C(NCc1nc(-c2cccc(Br)c2)no1)c1cc2cc(O)c(O)cc2s1 1568593833 OJVCQTBQUFPUPP-UHFFFAOYSA-N 446.282 4.055 10 10 IICE Cc1cc(C(=O)NC[C@H]2N(C)CCCC2(C)C)c(C)n1-c1ccc(Br)cn1 1568640599 HEXQTMBUSRTBQA-GOSISDBHSA-N 433.394 4.102 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](C)Cc2ccc(F)c(Br)c2)cc1 1586648821 COVALFWUZCNBLB-HNNXBMFYSA-N 437.353 4.370 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccccc2C)c1C)Cc1ccccc1OC 1596996594 OTDXLQRDDYSMMZ-OAQYLSRUSA-N 434.536 4.173 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)c1 1630135072 NUYCSTCEEBPDMU-JOCHJYFZSA-N 439.556 4.378 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C[C@](O)(c2nc3ccccc3s2)C(F)(F)F)c1 1630366879 YOSFNQLFPSABEG-WYRIXSBYSA-N 440.443 4.028 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCSc1nccs1)c1ccc(F)cc1F 1632807227 QWNLUKZKKHZMBU-HNNXBMFYSA-N 443.541 4.286 10 10 IICE Cc1cc(CNC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1633970941 LCIIXWPBPUKZKD-FQEVSTJZSA-N 426.561 4.293 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2Cc3ccc(Cl)cc32)NC(=O)OC(C)(C)C)cc1 1634161858 DXBQGUIRKISXAK-NHCUHLMSSA-N 443.975 4.428 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cccc(NCc4ccccn4)c3)c2)CC1 1637939414 FCYXUHIGRCWPBR-UHFFFAOYSA-N 429.568 4.476 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCCCC3)cc2)cc(CNC(=O)OC(C)(C)C)n1C 1643394830 XWEXLCPSFQVHDC-UHFFFAOYSA-N 440.588 4.279 10 10 IICE Cc1c([N+](=O)[O-])cnc(N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1Br 1655340915 JBNBLAMFSPTZMM-KRWDZBQOSA-N 449.349 4.312 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H]1CN(C)C(=O)OC(C)(C)C 1683253280 GQGKLHIQVQWYMM-WIYYLYMNSA-N 432.609 4.033 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@H]2c3ccccc3C(=O)N2Cc2ccccc2)c1 1683996164 JQLFSKZXEYYVIC-HXOBKFHXSA-N 445.519 4.158 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694024501 HSIZZLIPFCMVHY-PKOBYXMFSA-N 429.584 4.176 10 10 IICE CC[C@H](C)c1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCOCC2)cc1 1694078094 OEXHTPSKMFLVCH-INIZCTEOSA-N 425.499 4.065 10 10 IICE CCCCN(C)CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1695205431 BBBWHDNMAFNAQT-IFMALSPDSA-N 443.636 4.271 10 10 IICE CC[C@@H](C)[C@H](Cn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1726860236 OZPZAMIVQLPHDI-XXBNENTESA-N 441.620 4.017 10 10 IICE COc1ccc(N2CCN(c3nnc([C@@H]4CCCOC4)n3CCC=C(C)C)CC2)cc1F 1768705215 ZAEFAYBVTAVIQO-LJQANCHMSA-N 443.567 4.003 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccnc(NC(=O)c2ccccc2)c1 1860502726 YDNGUUAUWLWCEA-UHFFFAOYSA-N 447.450 4.362 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)[C@@H](C)C(=O)NC2CCCC2)sc2c1CC[C@H](C)C2 1866236149 DFOXYRBDPSRGDV-RRFJBIMHSA-N 434.602 4.319 10 10 IICE COCCNCc1ccc(N(CCC(C)(C)O)Cc2ccccc2)c(Br)c1 1915786300 PVJAZMJINVPSBT-UHFFFAOYSA-N 435.406 4.353 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)C1NCc1cc(Br)cc(F)c1O 2103912742 WRMXMUQLARPANN-RYUDHWBXSA-N 431.346 4.275 10 10 IICE CN(Cc1cccc(I)c1)c1ccc(CN)cc1Br 2265613817 KTZMAEUMAKEUAF-UHFFFAOYSA-N 431.115 4.149 10 10 IICE Cc1cccc(C)c1OCCOc1ccccc1C=C1C(=O)NN(c2ccccc2)C1=O 2293391496 JLWPSJUEKWCCRS-UHFFFAOYSA-N 428.488 4.223 10 10 IICE COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)C1=Cc1ccc(Br)cc1 2313510808 SZNAQLORODFKDX-UHFFFAOYSA-N 442.309 4.331 10 10 IICE CCN(CC)CCCCN1C(=O)C(=Cc2cc(OC)c(OC)c(OC)c2)SC1=S 2323831822 HXZUYDUHWCIFOT-UHFFFAOYSA-N 438.615 4.036 10 10 IICE Cc1ccc(CN(C)C(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)o1 11642718 QUIMTJHDNJGVIX-LJQANCHMSA-N 425.554 4.381 10 10 IICE CCOc1cccc(CN2CCC[C@H](c3ccnc(SCCN4CCCC4)n3)C2)c1O 12281204 PWJFGULUYDTZEM-IBGZPJMESA-N 442.629 4.148 10 10 IICE COC[C@@H](C)NC(=O)CSc1ncc(-c2ccc(Br)cc2)n1CC(C)C 32881366 ZDJGQPTYWFTHOC-CQSZACIVSA-N 440.407 4.212 10 10 IICE O=C(N[C@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@H]1CCCN(C(=O)C2CC2)C1 109915414 OKNFPPDLNZZEFR-SQJMNOBHSA-N 428.532 4.400 10 10 IICE O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@@H]32)cc1 226802333 ZZUZOJCBIFQLHI-DXIQSLLYSA-N 425.510 4.206 10 10 IICE COc1ccccc1CC1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 726613680 JGBOETSHNDUQTA-HXUWFJFHSA-N 437.584 4.257 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H](C)NC(=O)c2ccccc2)cc1 733155440 OTQMOQHVVFCQGF-IBGZPJMESA-N 431.536 4.113 10 10 IICE Cc1cc(C(=O)N[C@H](C)Cn2ncc3ccccc3c2=O)c(C)n1-c1ccc(Cl)cc1 765259358 WLLZQWASALGWQV-OAHLLOKOSA-N 434.927 4.276 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)CCCc3ccc(C(C)(C)C)cc3)cc2)CC1 786254750 HMWVARWSJZPLAP-UHFFFAOYSA-N 435.612 4.292 10 10 IICE C[C@@H](Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1ccc(N2CCOCC2)cc1Cl 797144988 POVBXQCDWNVWHL-CQSZACIVSA-N 431.895 4.142 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC([C@H](F)c2ccccc2F)CC1 804970610 YHMCSZTWNKUARK-QHCPKHFHSA-N 447.501 4.434 10 10 IICE Cc1ccccc1[C@H](C)N(C)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918023556 CJOUHBSYLDRNSO-AQNXPRMDSA-N 427.564 4.057 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1coc(-c2ccccc2Cl)n1 1129661426 MILIKVPCQAVTOE-UHFFFAOYSA-N 433.842 4.040 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(-c4noc(C(F)(F)F)n4)c3)C2)cc1 1129991590 SASDUIFBWJKGDY-AWEZNQCLSA-N 446.429 4.020 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3nc(C(C)C)n(-c4ccccc4Cl)n3)C2)cc1 1131030736 UTJGZYWSNUESEU-INIZCTEOSA-N 439.947 4.061 10 10 IICE CC(=O)c1ccc(N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c(F)c1 1135915493 OAHBZKKTNKGAFJ-UHFFFAOYSA-N 433.527 4.327 10 10 IICE O=C(c1ccc2c(Br)cnn2c1)N(Cc1ccco1)Cc1ccccc1O 1137343463 QLNLDNROKNMKAD-UHFFFAOYSA-N 426.270 4.238 10 10 IICE Cc1cc(C(=O)NCc2nc(C(C)(C)C)n[nH]2)c(C)n1-c1ccccc1Br 1161344492 VDLOVPDQXBWSPL-UHFFFAOYSA-N 430.350 4.202 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCSC[C@H]1C 1289424365 VQTJDIXZMBNJTA-QGZVFWFLSA-N 427.643 4.295 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@H]3c3ccc(Cl)c(Cl)c3)nc12 1307417400 CRZLNTLYIVJMTJ-QGZVFWFLSA-N 435.311 4.256 10 10 IICE CC(C)[C@@H](Cc1ccc(F)cc1)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307636472 IIXFIZCDBRAEFV-XMMPIXPASA-N 444.506 4.397 10 10 IICE CC[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccccc1OCC(=O)N(C)C 1354575933 SRHKULAJFVAVOI-DEOSSOPVSA-N 447.579 4.371 10 10 IICE Cc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1Br 1356036367 FRDSSALDLKZNBU-HOTGVXAUSA-N 449.364 4.369 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(Cl)c(Cl)c3N)cc2F)C[C@H](C)O1 1441788142 SFHGKDSZFBUWQU-RYUDHWBXSA-N 426.319 4.258 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc3c(s2)CN(C(=O)OC(C)(C)C)CC3)c1 1445966846 JFVZVMHHRHGXSF-ZDUSSCGKSA-N 432.542 4.247 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@H]1C[C@@H]1c1ccccc1 1461158632 PMPOCPPBGMAVIQ-BGMVTJORSA-N 440.565 4.337 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4cc(C)ccn4)cc3)CC2)c(OC)c1 1461976146 FZVGJNVPJVBQLF-UHFFFAOYSA-N 433.508 4.162 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1cc(Cl)cc(Cl)c1 1465532371 AVNIUEBGUWFDDC-MAUKXSAKSA-N 445.293 4.413 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCCN(C(=O)OC(C)(C)C)CC3)ccc21 1466953082 IJCYOIJUTFVFOQ-HXUWFJFHSA-N 443.588 4.424 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 1469104656 QUOJZXCCWWQBRT-GKJHBJHPSA-N 429.605 4.144 10 10 IICE COC[C@]1(C(=O)OC(C)(C)C)CCN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)C1 1471024669 WZOPJMVVUQYBSY-VWLOTQADSA-N 426.557 4.223 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@@H]1C 1502259099 IIJYZGPSPHSWFN-LEWJYISDSA-N 438.664 4.352 10 10 IICE CC(C)C1(Cn2c(CNC(=O)c3cccs3)nnc2N(C)Cc2ccccc2O)CC1 1508874743 KDLVRXJJZCXGOT-UHFFFAOYSA-N 439.585 4.048 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1512810576 WOIRGMQWGFYHRF-HXUWFJFHSA-N 448.615 4.080 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccn(S(=O)(=O)c3ccc(C)cc3)c2)cc1 1540538037 VVEBJASCIREESK-UHFFFAOYSA-N 439.581 4.152 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(Nc3ccccc3)CC2)NC(=O)OC(C)(C)C)cc1 1544269602 UCEMGZIYFOBMSA-OAQYLSRUSA-N 438.572 4.079 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c1 1544343262 VIJDRSYJQVPKSY-GJZUVCINSA-N 431.580 4.422 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](n3cncn3)C2)n1Cc1ccc(N(CC)CC)cc1 1545484628 UESPDPGDOIMTQB-DENIHFKCSA-N 436.608 4.119 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)cc2)CC1 1565270689 BZAAZAAGEPPHLX-UHFFFAOYSA-N 446.517 4.331 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cccc(OCCN(C)C(=O)OC(C)(C)C)c2)c1 1566374692 QSACQLQMXSJJDD-MRXNPFEDSA-N 444.528 4.138 10 10 IICE CCN(C)C(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C(C)C 1569365676 CSJMDYPPSYMKPY-IBGZPJMESA-N 434.378 4.089 10 10 IICE Cc1nc([C@H]2CCCCN2C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)no1 1586491568 WGTUTQWKVBXGDB-QGZVFWFLSA-N 444.333 4.310 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)c(C)n1-c1ccccc1 1586776467 ZQUIYAAPVRISGH-UHFFFAOYSA-N 434.515 4.152 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)c1C 1587653914 DRYBGPZKAMVCAK-XMMPIXPASA-N 429.564 4.366 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1 1595710143 RTRWBXBUBDATSK-SFHVURJKSA-N 435.568 4.017 10 10 IICE CCO[C@@H]1C[C@](NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1616581955 UVOPUZQKYQCGQN-XXBNENTESA-N 432.948 4.224 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)Cc1cccc2ccccc12 1627721522 SGGPEPFIINHCGH-KRWDZBQOSA-N 435.501 4.227 10 10 IICE COc1cc(N2CCN(c3nc4c(F)cc(Cl)cc4s3)CC2)cc(OC)c1OC 1639757045 CNDSMDAIJRDOAZ-UHFFFAOYSA-N 437.924 4.441 10 10 IICE COc1ccc(N2CCN(c3ncc(Br)cc3C(F)(F)F)CC2)cc1F 1650857297 VSTHDBTVBLSVPA-UHFFFAOYSA-N 434.231 4.337 10 10 IICE Cc1cnn([C@H]2CCCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)c1 1693297295 LHIPJDWSECPQAH-IBGZPJMESA-N 425.556 4.001 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@H](C)[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1694324402 OFOBAZJGAQBPPT-PKOBYXMFSA-N 440.636 4.102 10 10 IICE CCc1nnc(N2CCC(CN3CCCCCC3)CC2)n1Cc1ccc(N(C)C)cc1C 1694689102 BICJXZNCSFBBFN-UHFFFAOYSA-N 438.664 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2scnc2C)cc1 1695624959 LWDJBQRRRKNIER-LJQANCHMSA-N 440.617 4.078 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1727046110 RBUBLKGJIUZHOQ-KOSHJBKYSA-N 447.599 4.054 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1cnc(C(C)C)nc1 1751431819 NDQSUIADBOICCY-UHFFFAOYSA-N 444.587 4.246 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C(C)C)C1CC1 1766431756 FEKXPNNJTAMVJB-UHFFFAOYSA-N 434.588 4.114 10 10 IICE CCc1cccc2c(=O)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c12 1866414784 RLICPUDILVXXSQ-DEOSSOPVSA-N 446.595 4.114 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C(F)(F)F)c(N)c1I 2080047838 JYDXNDRKRGWCDA-JTQLQIEISA-N 439.219 4.411 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC(NCc3cc(Br)cc(F)c3O)C[C@@H]2C1 2102638194 QLRJXCFEZWVGPU-CHWSQXEVSA-N 429.330 4.029 10 10 IICE O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(-c2ccccc2)o1 2293191903 BCVYNBUZXJFXJG-UHFFFAOYSA-N 437.249 4.376 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NC=C2C(=O)N(c3ccc(Cl)cc3)N=C2C)cc1 2297321619 OXPHCRNBOYHDLR-UHFFFAOYSA-N 446.960 4.089 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccc(OCc2ccccc2F)cc1 2313557716 KJRLUHGLKACGAB-UHFFFAOYSA-N 434.398 4.210 10 10 IICE COc1cc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)cc(OC)c1OC 2321736641 HWXBAWBNSVTSRF-UHFFFAOYSA-N 432.479 4.026 10 10 IICE Cc1ccc(CNC(=O)CN(C(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2352942617 HVVMSVXVSAVRTI-UHFFFAOYSA-N 429.355 4.115 10 10 IICE CCOC(=O)[C@H](C)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S 33378449 YZWSXCZHKCEIFU-SJPXOZHESA-N 427.547 4.418 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OCCC)c(OC)c2)SC1=S 40938926 FWXURLANTXDFIY-JXAWBTAJSA-N 437.583 4.419 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)c3ccccc3F)CC2)c(C)n1-c1ccc(F)cc1 62694535 WKLYJRWSRSNLDG-UHFFFAOYSA-N 437.490 4.013 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@@H]3c3nnc4n3CCCCC4)c2C)cc1 106017008 LBSLRDYVPLJWEX-JOCHJYFZSA-N 433.556 4.398 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccc(-c4noc(C(F)F)n4)cc3)CC2)cc1 727032055 LYUIOXACNIYRNS-UHFFFAOYSA-N 443.454 4.427 10 10 IICE COc1ccccc1CCN(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729610668 AKJDPWCCOXLYKS-UHFFFAOYSA-N 433.499 4.150 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2/SC(=S)N(CCCCCC(=O)O)C2=O)cc1 764889073 VSZHQGIJRMXKDF-DTQAZKPQSA-N 435.567 4.488 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)C[C@H](O)c2cccs2)C1 768099777 YYAVHPADFOFMMN-VGSWGCGISA-N 425.598 4.098 10 10 IICE C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 771544387 IDFVPGXTYOUNQU-KSFYIVLOSA-N 445.510 4.290 10 10 IICE O=C1[C@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CCN1Cc1ccc(F)cc1 790674257 WVCMIYKPDDZUMX-JOCHJYFZSA-N 439.531 4.177 10 10 IICE COc1c(C)cc(C)cc1S(=O)(=O)Nc1nc(-c2ccc(NC(C)=O)cc2)cs1 800925655 UTHQBUYOIOAJFL-UHFFFAOYSA-N 431.539 4.195 10 10 IICE CCN1CCN(c2ccc(CN[C@H](CCc3ccccc3)c3ccccc3O)cn2)CC1 815560486 IZIYJORUSAEHLG-RUZDIDTESA-N 430.596 4.393 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 1084008179 RPPHJUSTEMGXQZ-GZTJUZNOSA-N 437.795 4.175 10 10 IICE CC(C)CCN(C)c1ccc(/C=C2/C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1 1084244843 SMFGJOIZNXXDTO-MOSHPQCFSA-N 425.916 4.489 10 10 IICE CCNC(=O)c1cc(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)nc2ccccc12 1127275345 JLFVEQFNBLGUDV-UHFFFAOYSA-N 444.535 4.455 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCCc3ccc(Br)cc3)C2)cc1 1129992940 CCEQTIAHEFQGKI-GOSISDBHSA-N 431.374 4.423 10 10 IICE COc1ccc(/C(C)=C\C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 1136284973 KUZWSMNXJSTBDE-SSZFMOIBSA-N 434.458 4.270 10 10 IICE Cc1ccc([C@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)N2CCOCC2)cc1 1136335398 XWIXAQONFNSZFT-VWLOTQADSA-N 435.543 4.345 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(CC(F)(F)C(F)F)CC2)c1 1146889576 YGLORIOLLSLLBR-UHFFFAOYSA-N 431.861 4.406 10 10 IICE COc1ccccc1-c1noc([C@@H](C)NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1148561157 HKQCOWGJONWFMX-MRXNPFEDSA-N 444.491 4.456 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1sccc1S(=O)(=O)NC1CCCCCC1 1159034573 XRYXJGPNSXTVIH-UHFFFAOYSA-N 442.990 4.038 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](CC)c1ccc(Br)cc1 1162539320 APQAZLRFEXUGSI-SFHVURJKSA-N 434.330 4.240 10 10 IICE Cc1cc(CNC(=O)c2cccc(NC(=O)CCn3ccnc3)c2)c(C)n1-c1ccccc1 1287662378 ZSFJXYLMNZKGQO-UHFFFAOYSA-N 441.535 4.249 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ncoc3-c3cccc(C(F)(F)F)c3)cc2)CC1 1288335062 XNVMDPBHMBVDQW-UHFFFAOYSA-N 444.457 4.042 10 10 IICE COc1ccc(C(=O)C[C@H](C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 1292381534 FFHHAGTUXDXDDA-YADARESESA-N 438.568 4.178 10 10 IICE Cc1ccc(-n2nc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2C)cc1 1294859610 MZMKAIWHWYUNOW-FQEVSTJZSA-N 438.959 4.243 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](COCC)C1 1297551131 CQBWHLVCOHNOFF-NRFANRHFSA-N 437.588 4.252 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC1(N2CCSCC2)CCCCC1 1302580258 XEVCHYOQIWRHDA-UHFFFAOYSA-N 443.661 4.495 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Sc3ccccc3Cl)cc2F)CC1 1456127757 JOPKKEMWPJYXEI-MRXNPFEDSA-N 435.996 4.418 10 10 IICE Cc1cc(CC(=O)NCCCNC(=O)c2ccccc2F)c(C)n1-c1ccc(Cl)cc1 1457153891 GUJGYXKJVKDSKW-UHFFFAOYSA-N 441.934 4.365 10 10 IICE CCN(C)c1ccc(CN2CCOc3c(Br)cc(C(=O)OC)cc3C2)cc1 1460972867 BIXLRQBVBSNYKW-UHFFFAOYSA-N 433.346 4.086 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2c(O)ccc3ccccc23)[C@H]1c1ccc(Cl)c(F)c1 1472085257 NVBGCYZAZHWYAI-KSFYIVLOSA-N 426.875 4.174 10 10 IICE CC(C)c1cccc(N(CCO)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1473614207 POKSNFRIMUCSNF-UHFFFAOYSA-N 442.515 4.023 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1 1479083171 DLWBNGYRKJAONQ-ZDUSSCGKSA-N 442.716 4.025 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(C)(C)COC 1495642867 YZDWIPCQONZBDK-IBGZPJMESA-N 429.609 4.190 10 10 IICE CCC[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1500279497 QEWGEDOQMDPGHN-HXUWFJFHSA-N 429.584 4.270 10 10 IICE CC[C@@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1514120382 GVSQVNMVFKOKGB-WIYYLYMNSA-N 429.634 4.008 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1[C@H]1CCC[C@@H](C(F)(F)F)C1 1517143218 YHKUUVOTEVRQQN-SJORKVTESA-N 434.466 4.314 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4ccccn4)n3CCC(C)C)CC2)cc1 1518308193 ITTURYMERVIWSL-UHFFFAOYSA-N 434.588 4.035 10 10 IICE COc1cc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc(Br)c1OC 1525762135 LFXRVQXOIMKJSF-CQSZACIVSA-N 435.362 4.202 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(Cl)cc1 1527735497 ULVQCILEUXZAST-SIKLNZKXSA-N 427.976 4.242 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(C(=O)c4cccc(OC)c4)cc3)C2)cc1 1529708033 OKILRLOVTXSLPX-IBGZPJMESA-N 444.531 4.191 10 10 IICE O=C(Cc1ccc(F)c(Cl)c1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1534129713 KXDRLXSWMXIQOV-UHFFFAOYSA-N 430.829 4.193 10 10 IICE CC(C)(C)c1ncc(/C=C/C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1535568613 GWAXQKNAXFTKJX-ZHACJKMWSA-N 438.641 4.302 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1 1536549150 BMEUMNQHBVQDOC-NZIDHHNMSA-N 433.596 4.060 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3csc(Cc4ccccc4F)n3)C2)cc1 1537110015 UFVWQVXEQKEUHZ-INIZCTEOSA-N 425.529 4.138 10 10 IICE Cc1cc(CSc2ccccc2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)on1 1537484547 XOAJPFFSOWQGSE-QFIPXVFZSA-N 438.597 4.374 10 10 IICE COC(=O)CCN(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1C 1537913699 SVDRYJHCVGVCAB-UHFFFAOYSA-N 447.579 4.313 10 10 IICE Cc1c(Cl)c(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)nn1C 1538918903 HZXHEODTLQTTLK-UHFFFAOYSA-N 445.708 4.106 10 10 IICE CC(C)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541356582 XCUPPYIGCQSQGO-HSZRJFAPSA-N 425.621 4.283 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCN1CCc2sccc2C1 1545337222 QGSUJMRNQKICFV-QGZVFWFLSA-N 425.602 4.253 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccoc1 1547249354 GQBUBMMRSNMXMD-UHFFFAOYSA-N 446.555 4.108 10 10 IICE Cc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)cc1-n1c(C)cc(C=O)c1C 1556052008 CHURMFAKSWUSST-OAQYLSRUSA-N 439.556 4.248 10 10 IICE Cc1cc(=O)c(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)nn1-c1ccccc1 1583700586 UPTZIMJVLOVMLD-UHFFFAOYSA-N 430.552 4.240 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@@H]2CCc3sccc3C2=O)cc1 1583919323 NXBKDPXDKGEUKR-ICSRJNTNSA-N 426.582 4.157 10 10 IICE Cc1cc(C(=O)Nc2cccc([S@](C)=O)c2)c(C)n1-c1ccc(Br)cn1 1585433393 CJYSSMVTWABSDE-SANMLTNESA-N 432.343 4.241 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cc1 1595419297 UPHOHSGIYZLIMP-FQEVSTJZSA-N 431.305 4.459 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)cc1 1617139098 FEAZFKNIVLZVLA-QHCPKHFHSA-N 438.568 4.336 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(COc4ccccc4)cc3)CC2)c(OC)c1 1623760474 VSEQOXHPLSAFKJ-UHFFFAOYSA-N 432.520 4.245 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1 1626312854 YGKHXMHDBRLVMC-RUZDIDTESA-N 441.547 4.240 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)Nc2ccccc2)c(C)n1-c1ccc(Br)cn1 1628813890 LZVYXCIONAMXBY-AWEZNQCLSA-N 441.329 4.009 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1NCC(F)(F)F 1631425582 JIRAFISDVFKNIW-MRXNPFEDSA-N 441.881 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 1636262650 IURGXBYXXGIMKX-KOSHJBKYSA-N 427.564 4.286 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)[C@H]1Oc1ccccc1 1639222167 PAKJWKITAXKOBE-UBFVSLLYSA-N 434.536 4.458 10 10 IICE COc1cc(N2CCC(Oc3ccc(C(F)(F)F)cn3)CC2)c([N+](=O)[O-])cc1OC 1651406460 VKFCLHZPQCGFDW-UHFFFAOYSA-N 427.379 4.074 10 10 IICE Cc1ccc(C)c([C@@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1653167434 XGXDSYCWBSTXHH-HSALFYBXSA-N 427.564 4.023 10 10 IICE COc1ccc(N2CCN(CCCN3CCC(Cc4ccccc4)CC3)CC2)c(OC)c1 1659861526 WGSHJTUMKZRPHY-UHFFFAOYSA-N 437.628 4.171 10 10 IICE CCOC(=O)C1(C(F)(F)F)CCN(Cc2ccc(N3CCC(OC)CC3)cc2)CC1 1660417219 XCQDDLUUJVIAQR-UHFFFAOYSA-N 428.495 4.009 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC3(c4ccccc4Br)CCC3)C2)cc1 1674326448 JPLYVYYVKJSFLB-MRXNPFEDSA-N 444.373 4.415 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)N(C)C)cc1 1685610223 WDBPWVCTJLLJFY-QHCPKHFHSA-N 439.991 4.258 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](C)Cn3ncc4ccccc4c3=O)c2C)c1 1685748232 QXZBRLXLFJTZTD-SFHVURJKSA-N 443.551 4.000 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1c2ccccc2CC[C@@H]1n1ccnc1 1686826705 NQLFMVYLFOQLTO-LQGLAIQGSA-N 431.584 4.417 10 10 IICE CCC[C@H](Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1709516080 MARSUMQWAQYXSI-JTHBVZDNSA-N 441.620 4.224 10 10 IICE CO[C@](C)(Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)C1CC1 1711499132 MATVMRQEIVFFBT-DZRGJMJISA-N 442.604 4.354 10 10 IICE COC[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1712256743 LNKXTUKDAXSOCI-NRFANRHFSA-N 425.621 4.333 10 10 IICE CCCN(CC1CC1)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1728105968 JEYXKXBRQXYFDM-UHFFFAOYSA-N 439.583 4.020 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C)[C@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742697358 HWHOCVCGJOWRKA-PKOBYXMFSA-N 435.620 4.045 10 10 IICE CC(C)[C@H]1OCCC[C@H]1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1750692078 CBHCCKVWGKXIQH-XUZZJYLKSA-N 435.572 4.057 10 10 IICE COCCCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1769667462 JHLQWIJZYGMDQG-QFIPXVFZSA-N 427.593 4.183 10 10 IICE CC(C)C[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858592716 VJUHHEFIENWXPU-GKWYLQRDSA-N 432.336 4.289 10 10 IICE COC(=O)c1c(NC(=O)c2cccc(C(=O)O)c2O)sc(C)c1-c1ccc(C)cc1 1866223465 GUOYONKCPHLGFE-UHFFFAOYSA-N 425.462 4.475 10 10 IICE COCCN1C(=O)C(=Cc2cc3cc(C)ccc3nc2N2CCCCC2)SC1=S 2040503167 KFBJPUHVRFCJEW-UHFFFAOYSA-N 427.595 4.381 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3ccc(Cl)cc3)nc3ccccn3c2=O)SC1=S 2296731268 KLRLOFSMFMNKOI-UHFFFAOYSA-N 443.937 4.361 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 226831586 BPZKKQIBBYQNHW-DJPHASSASA-N 443.525 4.204 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@H](c3cccc(Br)c3)C2)c([N+](=O)[O-])c1 748793818 NDPVHQBCLPXXOK-QJSCKGPTSA-N 447.285 4.121 10 10 IICE Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)nc(C)n1 755164321 PUCRSAWRSJIGIA-UHFFFAOYSA-N 442.313 4.303 10 10 IICE COc1ccc(O)c(CNC(=O)NCc2ccc(Br)cc2C(F)(F)F)c1 764406115 GRRLLEVFLIWKRM-UHFFFAOYSA-N 433.224 4.182 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)C2CC2)cc1 764511447 ICQZUTDXCZSOLE-XZOQPEGZSA-N 428.527 4.150 10 10 IICE O=S(=O)(/C=C\c1ccccc1Br)NCc1cccc(Br)c1O 766200793 ODXFIXKOQHFTEO-HJWRWDBZSA-N 447.148 4.008 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 766444384 AYFUVMOMPJMBIG-LEWJYISDSA-N 443.513 4.056 10 10 IICE COc1cc(Br)ccc1CCC(=O)NCc1cc(Br)ccc1O 804735445 ZFVPLYFZGHCSTR-UHFFFAOYSA-N 443.135 4.175 10 10 IICE O=C(CC(F)(F)F)Nc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1 806528324 BCHQJTTUHNYFIV-UHFFFAOYSA-N 446.223 4.367 10 10 IICE COc1cc(/C=C2/SC(=S)N(CNc3ccccc3C)C2=O)cc(OC)c1OC 1084246628 VCOQCJLJPPCGMP-WOJGMQOQSA-N 430.551 4.292 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2CCC(OC[C@@H]3CCCO3)CC2)cc1 1125893418 MBDLTARFGCXRJE-MNLRITNHSA-N 442.522 4.398 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(Br)cc1F 1127182008 RJELIVRPGSPDKM-UHFFFAOYSA-N 446.364 4.050 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)c2cccc(O)c2O)[C@H](c2ccccc2Cl)C1 1138981235 VYHMANQGPIURTL-KRWDZBQOSA-N 432.904 4.185 10 10 IICE Cc1cc(C(=O)N[C@H](CC(N)=O)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1141444084 CXROSWKHHIPELG-HXUWFJFHSA-N 440.341 4.203 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C(=O)OC(C)(C)C 1142996274 ULLYMGVQKUCQIF-INIZCTEOSA-N 436.350 4.102 10 10 IICE Cc1cc(C(=O)NCCc2nc3ccccc3o2)c(C)n1-c1ccc(Br)cn1 1160458211 HJHPXWJQTXXNCU-UHFFFAOYSA-N 439.313 4.365 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(Br)cc(N)c3N)c2C)c1 1170856533 AHPSVTGMPRXGHC-UHFFFAOYSA-N 427.346 4.259 10 10 IICE Cc1cccc(CN2CCO[C@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)c1 1171793627 MQWGCXUDAUSQST-XMMPIXPASA-N 435.543 4.172 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CC[C@H]2C(=O)OC(C)(C)C)sc2c1COCC2 1289843108 LGIQXAMOLBSDIH-CHWSQXEVSA-N 437.558 4.083 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2CN(c3ccc(F)cc3)C2=O)cc1 1296247821 XXFMVUYBLSEEGH-JOCHJYFZSA-N 431.471 4.452 10 10 IICE CCCCn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1306712790 CUTHDNACGPCBOR-UHFFFAOYSA-N 425.602 4.204 10 10 IICE CC[C@@H](C)N[C@@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccco1 1306840154 PHQBUVRZOQSNIU-KNQAVFIVSA-N 436.600 4.246 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(CCO)CCc3ccccc3)cc2Cl)C1 1312586162 OFSWIXKNGTXKIB-LJQANCHMSA-N 429.992 4.323 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1315240004 QMPPNFAILSNJJI-QHCPKHFHSA-N 427.524 4.105 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1351257282 SSZVXOTUWZYWLM-UHFFFAOYSA-N 439.581 4.055 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C(C)(C)COCc3ccccc3)cc2F)C[C@@H](C)O1 1354660014 ZFBBOMZRRFGQRN-RTBURBONSA-N 428.548 4.299 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cc2ccccc2O[C@H]2CCOC2)cc1 1359897219 RGDVWENHQWRDPX-FQEVSTJZSA-N 436.474 4.054 10 10 IICE C[C@@H](NC(=O)c1cc(Br)nn1-c1ncccc1Cl)c1ccc(N(C)C)cc1 1435954043 PCZFCNHATNWARN-GFCCVEGCSA-N 448.752 4.240 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)N(C)C)cc1 1439960582 NDGMWADGOFNHAT-OAQYLSRUSA-N 426.561 4.132 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ncc(Cl)s1 1443963240 NYYDMHLRZAOKOE-XFFZJAGNSA-N 427.935 4.166 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccccc2CO)sc(C)c1-c1ccccc1 1460302809 BWWXVUCIQSCMKU-UHFFFAOYSA-N 438.549 4.467 10 10 IICE CCO[C@@H]1CN(Cc2ccc(N3CCCCC3)c(C)c2)C[C@H]1CNC(=O)OC(C)(C)C 1460353556 ZCNNBHSYBGLVRE-FYYLOGMGSA-N 431.621 4.347 10 10 IICE C[C@H]1c2ccc(C(=O)NCc3c(O)ccc4c3CCCC4)n2CCN1C(=O)OC(C)(C)C 1465958038 DDPDRRUJSCZLPP-INIZCTEOSA-N 439.556 4.314 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC2(CCCC2=O)CC1 1470549818 DVJPABSBRRRYSD-PEZBUJJGSA-N 448.635 4.091 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(F)(c3ccccc3C(F)(F)F)CC2)cc1 1473427200 URKLWOMOBAXWPM-UHFFFAOYSA-N 437.481 4.348 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4oc(O)nc4c3)cc2Cl)C1 1478527813 IDKMENRTNCUJQU-AWEZNQCLSA-N 428.920 4.423 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@@H](CSc4ccccc4)C3)C2)cc1 1478859016 AGGKPGPRCQJWNI-VQTJNVASSA-N 425.598 4.345 10 10 IICE CC(C)[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c2ccccc21 1479107247 IFXFNWREEKMAPU-ZEQRLZLVSA-N 434.584 4.072 10 10 IICE Cc1cc(-c2nnc(N3CCN(C(C)C)CC3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1510621462 VRWYHNNQFLEETR-UHFFFAOYSA-N 446.521 4.445 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4cc(OC)ccc4nc3Cl)C2)cc1 1526246450 MLRRCJXVSORXNV-HNNXBMFYSA-N 425.916 4.162 10 10 IICE CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)N(C)CCN(C)c2ccc(OC)cc2)CC1=O 1527594367 AOJXWVMHYILWDP-WOJBJXKFSA-N 437.584 4.156 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccccc3-c3ccccc3)CC2)cc1 1531518371 QGXWGZVCXDSLDZ-UHFFFAOYSA-N 429.564 4.304 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCOc3ccc(C)cc3C)cc2F)CC1 1537536138 XPUUTNDVDXOEDZ-UHFFFAOYSA-N 427.564 4.060 10 10 IICE COC(=O)N1CCC([C@H](C)NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 1538966710 SXUVIXGEIPIUMJ-INIZCTEOSA-N 431.964 4.273 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1ccsc1 1541427578 RIVZNQSOIPKTQU-UHFFFAOYSA-N 439.629 4.254 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CCOc4ccc(Br)cc43)CC2)cc1 1545931522 LEKKAEOUNQXYCB-IBGZPJMESA-N 445.357 4.063 10 10 IICE COc1ccc(Oc2ccc(C(=O)NCc3cccc(Br)c3O)nc2)cc1 1556481149 MTKOWXPOXMBKEP-UHFFFAOYSA-N 429.270 4.281 10 10 IICE COc1ccc(N(CC2CC2)C[C@@H](O)c2ccc3c(c2)CN(C(=O)C(F)(F)F)CC3)cc1 1559848106 JVYFAIHXKGWITF-JOCHJYFZSA-N 448.485 4.092 10 10 IICE CO[C@@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(Br)s1 1566685783 DXNFPKRTWHRSRR-KBXCAEBGSA-N 440.359 4.112 10 10 IICE Cc1cc(C)c(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1 1597403578 UZYLINYJLQEIRI-YVLHZVERSA-N 431.608 4.058 10 10 IICE Cc1cc(C(=O)Nc2ccnn2[C@H]2CCOC2)c(C)n1-c1ccc(Br)cc1 1598116186 KJJUEDXCDRVANS-KRWDZBQOSA-N 429.318 4.267 10 10 IICE CC(C)N(Cc1ccc(N2CCOCC2)cc1)C[C@@H](O)COc1cccc2ccccc12 1615444870 IYVLQFLTRUMXLY-RUZDIDTESA-N 434.580 4.327 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccn4)cc3)cc2F)C[C@@H](C)O1 1625089670 DCMLHCBCGFYTKR-KDURUIRLSA-N 449.526 4.343 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3O)c2)CC1 1625671647 UJVIORPLMWRIMA-UHFFFAOYSA-N 440.544 4.133 10 10 IICE Cc1cc(C(=O)N2NC(=O)CC23CCCCC3)c(C)n1-c1cccc(Br)c1 1627002784 OKUNWGFOAHKVFE-UHFFFAOYSA-N 430.346 4.437 10 10 IICE Cc1ccc(C(=O)NCCc2ccc(OCCN(C)C)cc2)cc1-n1c(C)cc(C=O)c1C 1627574218 PFMOGINRLNFTEL-UHFFFAOYSA-N 447.579 4.128 10 10 IICE CCO[C@@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCC1 1628496397 XMXJVYFSILNYCK-NHCUHLMSSA-N 433.593 4.030 10 10 IICE COCc1cc(O)ccc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1629689040 UMRILNLMIVVFKG-BOPFTXTBSA-N 448.591 4.220 10 10 IICE C[C@H](CC(=O)c1ccc(F)cc1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1632040587 VZHSOIXFQAANCD-OAHLLOKOSA-N 434.458 4.421 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cccc4c3O[C@@H](C)C(=O)N4)cc2Cl)C1 1635126152 JJEPHTROOVGNER-GJZGRUSLSA-N 427.932 4.226 10 10 IICE COc1cc(OC)cc(OCCCNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1636030400 FBDBDNUIOSLZKZ-UHFFFAOYSA-N 436.508 4.123 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c[nH]cc1-c1cc(Cl)c2c(c1)OCCO2 1636058802 RGRURARXJNKRRI-UHFFFAOYSA-N 433.888 4.228 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)N2CCCC[C@H]2C)c1 1639522059 FXXIETXDBAZOED-LJQANCHMSA-N 444.597 4.398 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC=C(CCN3C(=O)c4ccccc4C3=O)CC2)c1O 1642952908 QVGSKVHEZUFBHG-UHFFFAOYSA-N 438.911 4.067 10 10 IICE CCOC(=O)C1([C@H](C)NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)CCOCC1 1648075266 UMANTUVQPHJUOS-KRWDZBQOSA-N 432.948 4.226 10 10 IICE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1c(O)cccc1O 1652628607 HIJDCGNHMMLWLY-UHFFFAOYSA-N 446.503 4.031 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCCCCN(Cc3ccccc3)C2)cc1 1675151241 SEPVZKPVXXOXIH-QHCPKHFHSA-N 438.616 4.218 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOc4cc(O)ccc4C3)cc2Cl)C1 1682024356 RAEFPUVKTKOVAU-MRXNPFEDSA-N 429.948 4.386 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(CCN4CCCC[C@@H]4C)CC3)C2)cc1 1686854727 AOHGBOVRAXUWTD-GMAHTHKFSA-N 442.648 4.208 10 10 IICE CC(C)c1nnc(N(Cc2ccco2)C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1691709995 UCYHWFKYYNYGEV-UHFFFAOYSA-N 441.551 4.434 10 10 IICE CC(C)CCCn1c(C2CCN(c3ncccn3)CC2)nnc1N(C)Cc1ccccc1O 1692309073 MHSQOWNKZZLFHZ-UHFFFAOYSA-N 449.603 4.230 10 10 IICE C[C@@H]1C[C@@H](C)CN(C(C)(C)Cn2c(CC3CC3)nnc2N(C)Cc2ccccc2O)C1 1707962272 UYTAHFDBRMKGSY-RTBURBONSA-N 425.621 4.329 10 10 IICE CN(Cc1ccon1)c1nnc(Cc2ccccc2F)n1CCCSc1nccs1 1711126340 PFUQUFVFPSBMQJ-UHFFFAOYSA-N 444.561 4.271 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1741585646 VUGAERMAGRKDFS-DENIHFKCSA-N 445.583 4.024 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)Cc1scnc1C 1742139471 PNOUUAHGRMMLOJ-UHFFFAOYSA-N 433.585 4.164 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@](C)(OC)CC2)cc1 1746095146 KYXKLXYLARSMHP-RDGATRHJSA-N 441.620 4.420 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCS[C@@H](C)C2)cc1 1764935838 BKNWOMRCIMIBMO-IBGZPJMESA-N 436.629 4.100 10 10 IICE CCN(c1nnc(C(=O)N2CCCC2)n1CCCSc1nccs1)[C@H](C)C1CCC1 1766416279 JIZHPTAABGHMTE-MRXNPFEDSA-N 448.662 4.168 10 10 IICE COCC[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1769611572 YWSSWQUQLXUADO-HXUWFJFHSA-N 443.661 4.040 10 10 IICE COc1ccc(OCCNC(=O)c2ccc3[nH]c(-c4ccc(N(C)C)cc4)nc3c2)cc1 1872740318 FGMSTQBNMUQUBJ-UHFFFAOYSA-N 430.508 4.113 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(Cc5ccccc5F)[nH]c4c3)CC2)cc1 1872798490 YIXMTNXSHABXHK-UHFFFAOYSA-N 444.510 4.264 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@]1(C)CNCc1c(O)cccc1Br 2102785353 IZHIMUWNJYQQQK-QGZVFWFLSA-N 435.309 4.279 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1cn(Cc2cccc(F)c2)c2ccccc12 2296135877 GCTADRSAJQBNRB-UHFFFAOYSA-N 443.434 4.084 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1ccc(Br)cc1 2313682843 LVZGSMCNNCIVOL-UHFFFAOYSA-N 428.286 4.101 10 10 IICE O=C(O)c1cc(N2C(=O)C(=Cc3ccccc3Br)SC2=S)ccc1O 2321681366 WEEXXAUAAFVUAJ-UHFFFAOYSA-N 436.308 4.259 10 10 IICE CSCC1(NC(=O)OC(C)(C)C)CC(NCc2ccc(C)c(Br)c2O)C1 2352685074 CQJCBPCDBBIGCY-UHFFFAOYSA-N 445.423 4.342 10 10 IICE CC[C@H]1SC(=S)N(CCC(=O)Nc2ncc(Cc3ccccc3Cl)s2)C1=O 11635793 FJUWHDPOTPSJQY-CQSZACIVSA-N 440.015 4.355 10 10 IICE O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@H]32)cc1 20756446 ZZUZOJCBIFQLHI-KNKQGSTJSA-N 425.510 4.206 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 97043451 RRRQNKDXOZOBJO-FQEVSTJZSA-N 441.597 4.292 10 10 IICE CC(C)(C)OC(=O)Nc1n[nH]cc1CNCc1cc(Cl)cc(Br)c1O 708073199 MJULAVCWZYIIRH-UHFFFAOYSA-N 431.718 4.168 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cccc(CNC(=O)OC(C)(C)C)c3)CC2)cc1 731898444 FYTIXVNMALPWDA-UHFFFAOYSA-N 440.544 4.074 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 741212398 OEAXJULXVFJKFW-VQTJNVASSA-N 434.458 4.184 10 10 IICE C[C@@H](NCCOc1ncccc1F)c1cc(Br)cc(Br)c1O 756759047 HUGTWXOMWGUMTC-SECBINFHSA-N 434.103 4.181 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)c1O 769508655 ZYGPQLPSPPLMKK-YSGRDPCXSA-N 442.943 4.144 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)c1 769529494 CMVROKPTHWFITH-DQLDELGASA-N 442.943 4.144 10 10 IICE COc1ccc(F)cc1-c1csc(NS(=O)(=O)c2cnccc2C(F)(F)F)n1 785548000 IFPLTASCLGWCGH-UHFFFAOYSA-N 433.408 4.172 10 10 IICE C[C@H](NC(=O)N1CCC[C@]2(CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 805311156 YKQHCSKSJLDCES-UUOWRZLLSA-N 430.593 4.246 10 10 IICE Cc1cc(=O)oc2cc(N(C)C(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)ccc12 805349634 WSUQEQQEOAPCDO-UHFFFAOYSA-N 443.547 4.486 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CCC(c4ccc(OC(F)(F)F)cc4)CC3)cc2N1 814948184 BYKLNOULYVSOTF-UHFFFAOYSA-N 437.374 4.208 10 10 IICE COc1ccc(N(C)CN2C(=O)/C(=C\c3cc(OC)ccc3OC)SC2=S)cc1 1083915727 PKGVJHYSCULHDQ-XDHOZWIPSA-N 430.551 4.008 10 10 IICE CNC(=O)c1ccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c(OC)c1 1131248491 GXRINKRWFAORQJ-UHFFFAOYSA-N 425.916 4.297 10 10 IICE Cc1ccc(C(=O)Nc2ccccc2CN2CCOCC2)cc1-n1c(C)cc(C=O)c1C 1136335527 BYTLWXAPQWKXGT-UHFFFAOYSA-N 431.536 4.300 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3nc4ccc(Br)cn4c3F)cc2)CC1 1136705139 CGQTXVPTOCKELL-UHFFFAOYSA-N 445.336 4.402 10 10 IICE Cc1cc(CC(=O)NCc2cccc(NC(=O)[C@@H]3CCCO3)c2)c(C)n1-c1ccccc1 1142179043 DXMZZKHJHIUPHY-DEOSSOPVSA-N 431.536 4.071 10 10 IICE O=C(NCc1c(O)cccc1O)c1cccnc1SCc1cccc(Br)c1 1156881007 LLLQEMOHSUXMPO-UHFFFAOYSA-N 445.338 4.478 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1162114538 NMXMFVZVURUTQR-JTSKRJEESA-N 441.572 4.236 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(O)nc2c(Br)cccc12 1162115856 UQAUJJPNSXEXDT-AWEZNQCLSA-N 442.357 4.438 10 10 IICE Cc1cc(CNC(=O)c2cccc(I)c2N)c(C)n1-c1ccccc1 1170857122 HIOYAVWYBULRFE-UHFFFAOYSA-N 445.304 4.211 10 10 IICE O=C(CN[C@@H](c1ccccc1)C(F)(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1191839720 RKXBDDHNWULXGV-QHCPKHFHSA-N 438.405 4.294 10 10 IICE CCN(C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)[C@H](C)Cc1ccc(OC)cc1 1251501082 NHUASMCHSBEYSR-DVECYGJZSA-N 426.605 4.027 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccnc3OCc3ccccc3F)C2)cc1 1276832437 USNFHBWBJNEJSL-SFHVURJKSA-N 435.499 4.065 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC[C@H]1C 1287363535 JLXKHFQFGFJUOA-IRLDBZIGSA-N 425.621 4.386 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2OC2CC2)NC(=O)OC(C)(C)C)cc1 1293792440 HRJAWHUZFFZHPL-NRFANRHFSA-N 439.556 4.290 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC2(c3ccc(C(F)(F)F)cc3)CC2)N(C)C)cc1 1312510616 CVOZVXZTJBCEJN-NRFANRHFSA-N 448.533 4.405 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCCN1CCCCC1 1314753651 UIKKZCTZVFBUQV-UHFFFAOYSA-N 425.602 4.148 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C4CCOCC4)cc3)cc2F)C[C@@H](C)O1 1357835634 HTDBURBVSOXATK-HDICACEKSA-N 426.532 4.263 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Oc1ccccc1 1435184241 JOWINGGAMKGVCH-SJPXOZHESA-N 444.553 4.001 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)c1 1460434884 VXVNJBCUJLPCEV-INIZCTEOSA-N 425.891 4.422 10 10 IICE CC(C)(Oc1ccc(Br)cc1)C(=O)NCc1cccc(Br)c1O 1467763048 AQMOZPAULIAMHN-UHFFFAOYSA-N 443.135 4.391 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCN(C)C)c3cccnc3)cc2Cl)C1 1469960607 QMZPVOLRUYKXFT-GCJKJVERSA-N 444.023 4.464 10 10 IICE Cc1ccc(CN2CCO[C@H](CNC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)cc1 1471223433 SUVWXTFDFGGALR-XMMPIXPASA-N 431.580 4.342 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1C[C@H]1CCCN1C(=O)OC(C)(C)C 1517148692 QTAJWHSGCWEBSF-LJQANCHMSA-N 441.576 4.287 10 10 IICE Cc1c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cccc1[N+](=O)[O-] 1530526073 XWLBYICTZJYEER-BOPFTXTBSA-N 445.497 4.272 10 10 IICE CCc1ccccc1N1C[C@H](C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1534242271 MDNCCIOBCHCOJK-HSZRJFAPSA-N 429.564 4.368 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1542704064 NZNBVDVLMLPVHX-NRFANRHFSA-N 447.620 4.452 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)N3CCC[C@H](C)C3)CC2)c1 1543808805 IRQUNUVGDDDUCZ-SFHVURJKSA-N 435.568 4.017 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@]1(O)CCC[C@@H]1C 1545503945 LHAWXDQNXWQNRJ-ZYLNGJIFSA-N 441.620 4.068 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)cc1 1547443890 GBYRNPPRTAYFBN-ZYLNGJIFSA-N 441.620 4.069 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(Cl)ccc1O 1566639372 VRCQKSXNZZLTHJ-CXUHLZMHSA-N 436.917 4.415 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CC(c4ccc(OC)c(C)c4)=NO3)ccc21 1567999499 PUIKGFPEFHSGRU-NRFANRHFSA-N 449.551 4.145 10 10 IICE Cc1[nH]nc(NC(=O)c2sccc2-n2c(C)ccc2C)c1I 1570848473 LTEAKZXCCVCIJP-UHFFFAOYSA-N 426.283 4.044 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Cl)c(Br)c3)CC2)c(OC)c1 1595996848 LUTPOEQMIYOFMF-UHFFFAOYSA-N 439.737 4.082 10 10 IICE CC(C)c1nnc(N2CCC(CN(C)C(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1598580894 DYWRTUWXOKTXPE-UHFFFAOYSA-N 430.616 4.212 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC(c3ccccc3)(N3CCCC3)CC2)c([N+](=O)[O-])c1 1612994212 OMVZIMMHNCDVPB-ZRDIBKRKSA-N 435.524 4.373 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1 1619573298 FXBJFVHBEONTFK-GOSISDBHSA-N 447.587 4.005 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(F)c(Cl)c3)CC(C)C)nc12 1620455365 PQRZDMFXOMPLQU-UHFFFAOYSA-N 434.899 4.062 10 10 IICE COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1 1625905205 MDPNAJFXANTLBD-VWLOTQADSA-N 449.595 4.385 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(-c3ccc(OC)c(OC)c3)n(C)n2)cc1F 1628769878 NEDSXAFZCRFYND-UHFFFAOYSA-N 440.519 4.020 10 10 IICE CCOCn1nc(C)c(C[C@@H](C)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1C 1628873647 HGRPQBGBGCJQIN-LJQANCHMSA-N 426.605 4.321 10 10 IICE CO[C@@H]1CCC[C@@H]([C@@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1632687480 HZENRWFIWABNPR-OZOXKJRCSA-N 449.389 4.153 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cnn(-c2ncccc2Cl)c1C(F)(F)F 1638573149 LDAZCWJEQHTQRA-UHFFFAOYSA-N 447.804 4.123 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCSc3nc4ccccc4s3)C2)cc1 1643346126 KBRBIROKEZGUKQ-INIZCTEOSA-N 427.595 4.430 10 10 IICE CS(=O)(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1Cl 1655371986 UPMLGWDCTHOOBD-UHFFFAOYSA-N 444.896 4.495 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](c1ccc(OC)nc1)C1CC1 1683158235 XSOAEANRSIGBAQ-LJQANCHMSA-N 434.334 4.241 10 10 IICE CC(C)Cn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1706498705 DAYAOZQHRHJAAN-HDICACEKSA-N 429.565 4.047 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1723356220 JTUWPOACMZXGJP-INIZCTEOSA-N 429.619 4.246 10 10 IICE C[C@@H](CN(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1761391680 YEBPIVGNIZSLHD-HNAYVOBHSA-N 444.580 4.079 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)OC 1763443563 IVCHQKXRIYLHCH-DNVCBOLYSA-N 429.952 4.397 10 10 IICE Cc1cc(C)c2c(C)c(C(=O)N[C@H](c3ccc(N(C)C)cc3)c3nccn3C)c(=O)oc2c1 1866294370 CZWPILFHIYCJOJ-HSZRJFAPSA-N 444.535 4.037 10 10 IICE Oc1cccc(Br)c1CN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878709113 DGBYKTACPPLKJT-DOTOQJQBSA-N 429.280 4.307 10 10 IICE COc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3Br)C2=O)cc1 2296879981 OKXCHESEHSFJPR-UHFFFAOYSA-N 449.351 4.004 10 10 IICE COCCCN1C(=O)C(=Cc2cc3ccccc3nc2N2CCCCC2)SC1=S 2297482100 ANSYNLBNAFBQRX-UHFFFAOYSA-N 427.595 4.463 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccccc3OC)SC2=S)cc1 2314837412 RZZZXNNEWGAARH-AWEZNQCLSA-N 442.562 4.322 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)cc(Br)c1OC 34201505 APWUVIRUSVMRIL-RIYZIHGNSA-N 445.269 4.281 10 10 IICE CCOc1nonc1/N=N/N(Cc1ccc(Cl)cc1Cl)c1nonc1OCC 105449647 INEHUISMWOHBLS-PTGBLXJZSA-N 428.236 4.262 10 10 IICE O=C(/C=C/c1ccc(Br)o1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566624 WVLALAGTMGHQBO-SOFGYWHQSA-N 441.272 4.442 10 10 IICE O=S(=O)(Nc1nc(-c2ccccc2F)cs1)c1cc2c(cc1Cl)OCCO2 727250711 PYBHEMJSLWLWRL-UHFFFAOYSA-N 426.878 4.175 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H](C(=O)N3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 732176196 QELVWEYHHPZLNV-LJQANCHMSA-N 427.976 4.151 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCCCSc1nccs1)O[C@@H](C)C2 759581282 SMFHKEKCGWMFBE-JLJPHGGASA-N 433.599 4.203 10 10 IICE COc1cc(OC)cc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c1 767714707 IZSUJRWBJVEZIH-UHFFFAOYSA-N 444.456 4.354 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCCC[C@@H]2CN2CCOCC2)cc1 772141913 JIQQKZXUFKLMAE-JOCHJYFZSA-N 435.572 4.495 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc2ncsc2c1 776924078 YYXGTEXIEHYGKU-GOSISDBHSA-N 449.624 4.389 10 10 IICE CCOC(=O)c1c(NC(=O)CCN[C@H](C)c2cn[nH]c2)sc(C)c1-c1ccccc1 778141883 MZFHICYLHCQAIM-CQSZACIVSA-N 426.542 4.303 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[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)cc1 787682352 FUSBWYKLCYWCQP-MUDLDCJDSA-N 442.563 4.407 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)n1-c1ccccc1 789918220 LNNPZRAMIJFBCM-UHFFFAOYSA-N 446.595 4.315 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 792745095 ZPPHSANAVCPKPL-ZCYQVOJMSA-N 432.568 4.291 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)c(F)cc1Cl 795546944 HGWAQZXNHXCKRC-UHFFFAOYSA-N 426.878 4.190 10 10 IICE COC(=O)c1cc2ccccc2c(CN(CCc2ccccn2)Cc2cccnc2)c1O 797422225 UCFMCFNCGZAZKU-UHFFFAOYSA-N 427.504 4.367 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)CCO1 802691246 DEWVGWYGDLZUAD-FCHUYYIVSA-N 435.572 4.147 10 10 IICE C[C@H](Oc1ccccc1F)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCO1 812298012 GBPSEBXIVBUGOS-WMZOPIPTSA-N 426.492 4.078 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cccc(N4C(=O)N[C@H](C)C4=O)c3C)c2C)cc1 813852295 APJWUMLDQGNJPG-MRXNPFEDSA-N 446.507 4.108 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1 917512413 CQPUYVADZNXDGX-UHFFFAOYSA-N 429.492 4.032 10 10 IICE CN(C)C(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c1 917845605 BYHHRWGZFHWPTG-UHFFFAOYSA-N 437.546 4.466 10 10 IICE CN(C)c1ccc(/C=C/c2nc3ccccc3c(=O)n2NC(=O)Nc2ccccc2)cc1 1088707413 LWFIOQVSEMYSHT-SAPNQHFASA-N 425.492 4.409 10 10 IICE Cc1nc(CC(C)C)c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 1125130979 DUZZZPITOKFVEF-UHFFFAOYSA-N 441.519 4.435 10 10 IICE Cc1ccc(C(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1146305536 BACAKPMXSATPRF-QGZVFWFLSA-N 427.545 4.200 10 10 IICE CC[C@H](COCC(F)(F)F)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1159228799 CDRZLFHZLRMGQE-CQSZACIVSA-N 448.283 4.339 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1164486321 SUMVDEVAHVSSEN-KSFYIVLOSA-N 442.357 4.278 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccccc1OC 1165498309 LOPQMIGYYABOLJ-XXBNENTESA-N 444.959 4.450 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cc(Br)c([N+](=O)[O-])n3)c2C)c1 1165562816 RFTYTMLCDXUWHP-UHFFFAOYSA-N 431.290 4.461 10 10 IICE CC[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cc(F)ccc1F 1168632995 HWPUHBUTGMBOEQ-QFIPXVFZSA-N 434.442 4.420 10 10 IICE Cc1cc(C(=O)NC2(CC(N)=O)CCCCC2)c(C)n1-c1cccc(Br)c1 1180248991 SWQNWMSYTCSZFT-UHFFFAOYSA-N 432.362 4.165 10 10 IICE C[C@@H](Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])c1ccc(N(C)C)cc1 1186176009 SMZAHQRYACNPKC-QGZVFWFLSA-N 446.573 4.399 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCC4(CCOCC4)O3)cc2Cl)C1 1235832785 GWWQRMVJFAHJAN-HKUYNNGSSA-N 435.996 4.104 10 10 IICE C[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1nc(C(F)(F)F)no1 1251659364 DNVWPDZHHMAUJG-CYBMUJFWSA-N 437.422 4.220 10 10 IICE C[C@@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1264849985 RYNOOIFAOIKYFS-RAOBZKRQSA-N 429.542 4.032 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c(OC)c1 1287483971 BJTWBCVZFKONSS-UHFFFAOYSA-N 433.552 4.003 10 10 IICE Cc1cc(C(=O)NC[C@](C)(O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cn1 1295923984 SCJJPPKAYFFANA-NRFANRHFSA-N 446.320 4.028 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(CC)c1 1297551619 IWUZSHQEXXQBED-UHFFFAOYSA-N 447.587 4.242 10 10 IICE CN(C)c1ccc([C@@H](CNc2ncnc3[nH]c(Cl)cc23)NC(=O)OC(C)(C)C)cc1 1307110829 FBKHQGBKPRMMLS-MRXNPFEDSA-N 430.940 4.355 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cc(C)cc(C)c1 1307535176 LKVYDAZOGLWKBO-WOJBJXKFSA-N 427.564 4.199 10 10 IICE CCOC[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1314434864 BLONLHUMDARPID-HXUWFJFHSA-N 425.621 4.160 10 10 IICE CO[C@H](Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1315206117 WUFROFODVYKADH-HSZRJFAPSA-N 434.588 4.248 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(COc2ccc(F)cc2)o1 1436625311 YHZVUBQNKYRANT-UHFFFAOYSA-N 446.425 4.043 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](C(F)(F)F)C[C@H]1C(=O)NCc1c(O)ccc2c1CCCC2 1445898402 AMOHKCAZLQCYAG-YOEHRIQHSA-N 442.478 4.075 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4cc(Br)ccc4[nH]3)C2)cc1 1452029237 NRAGQFMZTBSXBK-AWEZNQCLSA-N 428.330 4.195 10 10 IICE CCS(=O)(=O)c1ccccc1CCNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1458598334 RIZFAZCQLUIRHI-UHFFFAOYSA-N 438.505 4.274 10 10 IICE CCCNC(=O)OC[C@H]1CCCCN1C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1459861892 AQEJGZBWPUTHCT-HXUWFJFHSA-N 429.561 4.035 10 10 IICE Cc1cc(CCNC(=O)C2(NC(=O)OCc3ccccc3)CC2)c(C)n1-c1ccccc1 1461970047 UAEJWJHFSRZLBG-UHFFFAOYSA-N 431.536 4.212 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1CCc2cc(OC)ccc2C1 1467630673 DHKRBPBSWAVIOV-HXUWFJFHSA-N 438.568 4.189 10 10 IICE CCN(Cc1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1)C(C)C 1518326354 RXXAIRLCEDHTHP-UHFFFAOYSA-N 448.655 4.379 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCOc3ncccc3C(F)(F)F)ccc21 1518984194 DWWPIEBQKLHRIR-UHFFFAOYSA-N 435.446 4.127 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)sc2c1CCCCC2 1526893245 JUGJGECQHUYFOU-HNNXBMFYSA-N 430.501 4.397 10 10 IICE COc1ccc(N2C[C@H](NC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)CC2=O)cc1 1528203442 WPWDUQUSKRAOFW-QGZVFWFLSA-N 437.927 4.291 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)sc2c1CCCC2 1528728201 MXXJFHWWJOGDSC-AWEZNQCLSA-N 432.586 4.312 10 10 IICE Cc1ncc(/C=C/C(=O)N(CCc2ccccn2)c2ccc(Br)cn2)s1 1529811988 NZPSVCKPQKFWRT-SOFGYWHQSA-N 429.343 4.293 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCC(=O)N3CCc4sccc4C3)c2C)c1 1534760063 QJUVEISZRPQJGE-UHFFFAOYSA-N 435.593 4.445 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(C)n(-c3cccc(Cl)c3)c1C)C[C@H]2O 1543434528 DXCNQBWNHAHQLW-HXUWFJFHSA-N 440.927 4.454 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOCC23CCCC3)sc(C)c1-c1ccccc1 1559720921 YDLYTFCGTNZFFM-UHFFFAOYSA-N 442.581 4.484 10 10 IICE C[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1560119735 RBKVYKQKIUUXKR-CABCVRRESA-N 443.459 4.048 10 10 IICE CC(C)(CCNC(=O)N(Cc1ccco1)Cc1ccccc1O)NC(=O)OC(C)(C)C 1565280327 HMHNVWQMGTWVLZ-UHFFFAOYSA-N 431.533 4.390 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CN(Cc4ccccc4)CC[C@H]3CO)c2C)c1 1566358121 VHLMOWGQIFIPJJ-OZXSUGGESA-N 431.580 4.015 10 10 IICE COc1nsc(CNC(=O)c2sccc2-n2c(C)ccc2C)c1Br 1585256864 NAMGHPHOXJDMIC-UHFFFAOYSA-N 426.361 4.313 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)C[C@H]2CCCO2)c(C)n1-c1ccc(Br)cc1 1585441607 UXWMGVZWPUOOEP-HXUWFJFHSA-N 448.405 4.039 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)NCc2ccc(N3CCCC3)cc2)cc1 1595436042 QSVNRUIEXVRYBE-UHFFFAOYSA-N 439.357 4.473 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Br)c1Cl 1596684031 HFXQQZHUNHRSRL-UHFFFAOYSA-N 445.691 4.147 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(Cl)c4c(c3)OCCCO4)c2)CC1 1610961246 YCGNEQWJYYEJKA-UHFFFAOYSA-N 429.948 4.284 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1623452542 YBMVAFQKVLIBQV-UHFFFAOYSA-N 425.529 4.366 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCNc1ncc(Cl)cc1Cl 1630139277 XTKRRQDYNTVWMB-UHFFFAOYSA-N 431.323 4.450 10 10 IICE Cc1ccc(Br)c2[nH]c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc12 1630550863 XDFUSUMFQZUZGG-UHFFFAOYSA-N 446.320 4.145 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3n[nH]c4cnc(Br)cc34)c2C)cc1 1631721366 PVFAUJLDQOUPLK-UHFFFAOYSA-N 440.301 4.389 10 10 IICE C[C@H]1CC[C@@](C)(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1(C)C 1632417297 CUJKYIWSLHIHSD-QKKBWIMNSA-N 436.599 4.447 10 10 IICE COC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1634720246 RWNPAQPCVAEKPQ-INIZCTEOSA-N 429.948 4.362 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3ccc(OC(F)(F)F)cc3)CC2)cc1F 1634986232 FGTPKGXQXNTTML-CQSZACIVSA-N 441.425 4.326 10 10 IICE C[C@@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)cc1Cl 1635639156 RRQOTPGTKFZOLL-GFCCVEGCSA-N 427.854 4.154 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(COc2cccc(F)c2)c1 1638529828 XFVMBSOWSUANAM-UHFFFAOYSA-N 437.467 4.316 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C 1638570223 WSSDLHPFCBGEAY-LEWJYISDSA-N 439.556 4.328 10 10 IICE Cc1cc(CC(=O)N2CCN(Cc3ccc(O)c(Cl)c3)CC2)c(C)n1-c1ccccc1 1642984273 IQAJFMLOQKGSRE-UHFFFAOYSA-N 437.971 4.340 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N(C)[C@@H](c2ccccc2)c2ccc(F)cc2)cc1 1643684685 LALIZXMCOMXDND-MHZLTWQESA-N 449.570 4.450 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C2)c1O 1648351338 IRIXJEOFSQTCGL-JKSUJKDBSA-N 434.430 4.011 10 10 IICE CCn1nc(C)c(C(=O)CSc2ncc(-c3ccc(Br)cc3)n2CC)n1 1652517762 IJIMMEXDOVLJRC-UHFFFAOYSA-N 434.363 4.227 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(c3ccccc3)C3CCC3)cc2F)C[C@@H](C)O1 1655309312 JRUMMQZFYHSCCJ-RTBURBONSA-N 425.548 4.115 10 10 IICE Cc1cc(CCNC(=O)NC[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1674929807 BHNCKUXIHTYNJY-XUTJKUGGSA-N 440.588 4.239 10 10 IICE Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1681899072 FACGQRALQYSVDS-OAQYLSRUSA-N 435.490 4.449 10 10 IICE CO[C@](C)(CNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)COCc1ccccc1 1687011494 YQAZOKFKMGKZSJ-AREMUKBSSA-N 439.600 4.440 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@](C)(CC)C1 1696424320 GLJHTUOHGLHMQV-RUZDIDTESA-N 437.588 4.394 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CCC1 1696508522 GWFJQWCVZBPVAQ-SSEXGKCCSA-N 425.602 4.110 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1710025524 CUWBNISYSBVVRV-IBGZPJMESA-N 436.604 4.182 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@H]2[C@@H]2CCCO2)cc1F 1711006460 JMFZUDNMKRKCJD-SFTDATJTSA-N 429.584 4.268 10 10 IICE CSC1(Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CCN(C)CC1 1712760770 JOMQNGOLLAARKC-UHFFFAOYSA-N 443.661 4.180 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@H]1CCC[C@@H](O)C1 1729419944 ABNKMNMGUZFSOU-RJJVWVDVSA-N 442.604 4.090 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCc3cccc(C)n3)CC2)cc1 1730181327 IYOHNPWSFGJNND-UHFFFAOYSA-N 448.615 4.463 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C)C(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742697607 QTUNLDBPXZDKPP-LJQANCHMSA-N 449.647 4.435 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743782357 GRAJESYJRVFZLP-UGKGYDQZSA-N 443.661 4.254 10 10 IICE COCCO[C@H](C)c1nnc(N(C)C2CCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1749918786 BEDIPCOTASHJNY-HXUWFJFHSA-N 441.620 4.275 10 10 IICE Cc1cccc(OCc2nnc(N3CCSCC3)n2CCCSc2nccs2)c1 1751652649 YIZSWPOVYKLJCW-UHFFFAOYSA-N 447.655 4.358 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1765062009 AICONCYVHAAZGR-TZIWHRDSSA-N 425.621 4.376 10 10 IICE O=C(O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)c(O)c(O)c1 1951649171 HTYGLWQGKIIURA-HXUWFJFHSA-N 449.459 4.248 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NCc3cc(Cl)cc(Br)c3O)[C@H]21 1965929877 QAPQKGRPJWILQN-SNPRPXQTSA-N 431.758 4.296 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(NCc3cccc(Br)c3O)CCC[C@@]2(F)C1 2126058763 UUSQEPMGGJIGQE-MOPGFXCFSA-N 429.330 4.126 10 10 IICE COCC[C@]1(NCc2ccc(Br)cc2O)CCCN(C(=O)OC(C)(C)C)C1 2157552337 AXNJAFJBHBYKGI-HXUWFJFHSA-N 443.382 4.051 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2c(O)cccc2Br)C[C@H]2CCC[C@@H]21 2335127959 OPIJJOWCZLNPJK-KEYYUXOJSA-N 425.367 4.422 10 10 IICE Cc1ccc(CNC[C@@H]2CN(C(=O)OC(C)(C)C)CC23CC3)c(O)c1Br 2352676380 OUXRMZASXPDVTF-OAHLLOKOSA-N 425.367 4.200 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3CC[C@@H]([C@@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2381141526 AHCNGDHBGVHAQJ-WBTNSWJXSA-N 443.357 4.431 10 10 IICE COc1ccc(-c2ccc(/C=C3\C(=N)N4N=C(C(C)C)SC4=NC3=O)o2)c([N+](=O)[O-])c1 20238960 GDKNRRSGTDEGAT-TVJXHFOGSA-N 439.453 4.139 10 10 IICE C[C@]12C(=O)N(c3ccc(Cl)cc3)C(=O)[C@H]1ON(c1ccccc1)[C@H]2c1ccccc1O 34771400 GDRSKIHXMKXIFJ-YZUZCNPQSA-N 434.879 4.487 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)c3cc(C)cc(C)c3)c3ccco3)CC2)cc1 38605926 AKZIZYWUJSABEA-XMMPIXPASA-N 433.552 4.198 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(CC(F)(F)F)c2ccccn2)C1 435528470 OTQQVOYUPVZTQH-UHFFFAOYSA-N 430.474 4.398 10 10 IICE Cc1ccc(C)n1C1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1 726706396 JZNLFUYEGVBQKT-PMACEKPBSA-N 442.579 4.404 10 10 IICE CCOc1cccc(N2C(=O)/C(=C/c3cc(OC)c4c(c3)OCCO4)SC2=S)c1 743285834 YHEUPTZBOSWCSS-WQRHYEAKSA-N 429.519 4.271 10 10 IICE COC(=O)[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)c1c(F)cccc1Cl 751931138 MMLTXBCJRWRHOL-GOSISDBHSA-N 434.876 4.180 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 764537217 LIPOVBLEQPEDRV-DYESRHJHSA-N 430.593 4.072 10 10 IICE Cc1c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cnn1C1CCOCC1 766992014 PERGQIZTOMDNIO-UHFFFAOYSA-N 439.487 4.129 10 10 IICE O=C(CCc1ncc(-c2ccccc2)o1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768544092 OXUJWNHRJPKPBG-UHFFFAOYSA-N 444.579 4.123 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)n1-c1nccs1 768911037 LHGSOODEGHJDFN-UHFFFAOYSA-N 449.624 4.013 10 10 IICE Fc1cc(CNc2ccc(-c3nnc(Br)o3)cc2)ccc1N1CCOCC1 784573273 YBGGPRYRDLLCOE-UHFFFAOYSA-N 433.281 4.087 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@H]1CCNC(=O)CC1 815041987 GYCRFQPPJBDJPY-DNVCBOLYSA-N 433.474 4.214 10 10 IICE CN(CCc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 919907831 VEJUJOSAFGURBV-UHFFFAOYSA-N 439.453 4.065 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C 1129820244 SEUCWJZAZJRXSP-AUSIDOKSSA-N 439.600 4.449 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OC(F)(F)F)cc1Br 1154026802 OBUYMQKWWZWULD-SECBINFHSA-N 434.208 4.120 10 10 IICE Cc1ccc(C[C@@H](C)N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1167453903 OLUGAWCKVHHFRP-GOSISDBHSA-N 426.516 4.272 10 10 IICE CC(C)[C@@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1287162447 MRODVMXXTKIZGT-LJQANCHMSA-N 443.592 4.437 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N(C)Cc1cnc(C(C)C)nc1 1304240615 LMZPVYWJFSWQQO-JOCHJYFZSA-N 449.603 4.102 10 10 IICE CC[C@H](C)c1nnc(N(C)CC(F)(F)F)n1Cc1ccc(N2CCSCC2)cc1 1305378584 XWTHROKVEKROHB-HNNXBMFYSA-N 427.540 4.392 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)C(=O)N(CCC3=CCCCC3)C2=O)c1C 1307272196 FUKDKDBSFYQEDE-UHFFFAOYSA-N 447.535 4.267 10 10 IICE CCOCC(C)(C)Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1314285637 JFJXBKZGZJPYKH-UHFFFAOYSA-N 441.620 4.081 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C(C)(C)c3cccc(Cl)c3F)CC2)cc1 1351456375 HHRBNOJZXHVDSC-UHFFFAOYSA-N 447.982 4.094 10 10 IICE CC[C@@H](c1ccc(F)cc1F)N1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1444104280 YMHWWBMWYBZWDO-KRWDZBQOSA-N 432.492 4.500 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](Cn2ccnc2)c2ccc(C)cc2C)cc1 1469503335 XIHZPDHOQOHIAT-XMMPIXPASA-N 435.572 4.028 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1509163161 YLAUXEMEBITYLY-IBGZPJMESA-N 443.661 4.082 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@H](C)N(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1514491964 GPTXHVAAISGOMI-SIKLNZKXSA-N 440.636 4.002 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCOCC(C)C)CC2)cc1 1518308182 IPBDIAYCFKHGSC-UHFFFAOYSA-N 429.609 4.190 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCN(C(C)C)C(C)C)CC2)cc1 1518310616 ZWQSKAHYVGNRLE-UHFFFAOYSA-N 442.652 4.246 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1524851219 HUSLPIYHJUTYSB-UHFFFAOYSA-N 447.482 4.078 10 10 IICE COC(=O)C(C)(C)CN(CC(C)C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1533609223 FIFGWYDKQOCQMX-UHFFFAOYSA-N 441.616 4.092 10 10 IICE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1534309762 YFAJAZNSZAIHHI-NTCAYCPXSA-N 438.421 4.281 10 10 IICE COC[C@@]1(CNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)OCCc2ccccc21 1564860648 YNGAUGPPCJAKMJ-HHHXNRCGSA-N 447.579 4.316 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3ccnc(Oc4ccccc4)c3)C2)cc1 1564962890 PWCNLHGHCXHUKE-FQEVSTJZSA-N 432.524 4.208 10 10 IICE C[C@H](NC(=O)[C@H]1Cc2ccc(O)cc2N1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1567777343 SXDRWSJBPMUHNW-YCRPNKLZSA-N 425.529 4.002 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC[C@@]2(C1)CC2(F)F 1583444428 GIZXIQRPSMVIPH-MDNBWPLSSA-N 442.578 4.377 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC(C)(C)N2CCc3ccccc3C2)cc1 1583533964 PQDLCCFCUVFADW-UHFFFAOYSA-N 443.591 4.402 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CCCC1 1625673698 DAOVGMRACDLDKL-JOCHJYFZSA-N 446.469 4.397 10 10 IICE Cc1ccc(CN2C[C@@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)cc1 1627002191 ZDRVUXQCWQSLCH-QHCPKHFHSA-N 433.596 4.429 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2 1628954796 RYUOZPMVAXKXAD-SQJMNOBHSA-N 427.589 4.425 10 10 IICE COc1cccc(CNC(=O)[C@H]2CN(Cc3ccccc3)C[C@]2(C)c2ccccc2)c1O 1630366324 ORUYFGCDXIMGTB-YIXXDRMTSA-N 430.548 4.107 10 10 IICE CCS(=O)(=O)c1ccc(C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)c(N)c1 1631531102 HHLGBDMIAMXZFA-KRWDZBQOSA-N 438.549 4.172 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@]2(O)CCCC(C)(C)CC2)C1 1632013568 TWEYKSOSLAGUAI-AREMUKBSSA-N 425.617 4.245 10 10 IICE CCCCN(Cc1cc(C)n(-c2ccc(OC)cc2)c1C)c1nc(O)c2cnn(C)c2n1 1639594155 NWLQLYAZAZRKPK-UHFFFAOYSA-N 434.544 4.292 10 10 IICE Cc1ncc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)c(N)n1 1641203053 TXXQGOOBQXWPQN-SFHVURJKSA-N 429.446 4.293 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Cl)cc1Br 1643245491 PWQDVCWBHZZOGG-UHFFFAOYSA-N 426.694 4.014 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1cc(O)ccc1O)c1ccccc1Br 1644752439 FPQRDUXWXNXGFV-UHFFFAOYSA-N 441.281 4.043 10 10 IICE Cc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NCc2cccc(Cl)c2O)c1 1653564094 ZUEWFNRRCXYDLJ-UHFFFAOYSA-N 444.940 4.393 10 10 IICE Cc1ccsc1CNC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1657293884 RGGVTMDARPCCEX-UHFFFAOYSA-N 429.586 4.150 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4c(Br)cccc43)C2)cc1 1673822736 GPZRSSLTZYKBKA-OAHLLOKOSA-N 430.346 4.056 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3Cc4cc(Br)ccc4C[C@H]3C)C2)cc1 1682646601 UQWUJVYWOOKYRZ-BEFAXECRSA-N 444.373 4.193 10 10 IICE CCN(CCNC(=O)OC(C)(C)C)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1683303559 NHNAGMMDFPMUAW-UHFFFAOYSA-N 428.577 4.459 10 10 IICE CC(C)[C@@](C)(O)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706252020 RPBDFYSLXYNXDK-RDGATRHJSA-N 441.620 4.163 10 10 IICE CC(C)C[C@H]1CCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1723358401 QXQRBRLEWBWETL-UXHICEINSA-N 429.584 4.298 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1730665149 VPRPMPYTWSDISF-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCCO[C@H]1CCCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1764632957 IHQYTIQQOPAFLW-IBGZPJMESA-N 440.567 4.312 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCO[C@](C)(C(C)(C)C)C2)cc1F 1766909877 VQQNPINRESJPDH-DEOSSOPVSA-N 440.567 4.168 10 10 IICE COc1ccc(C2=NN(C)C(=O)/C2=C/c2ccc(OC(=O)c3ccccc3)c(OC)c2)cc1 1865676108 QPZFDVCJZFMDHF-RCCKNPSSSA-N 442.471 4.183 10 10 IICE Cc1c(C2CC2)nn(Cc2ccc(Br)cc2O)c1I 2079783365 KONVKWJSOPREKD-UHFFFAOYSA-N 433.087 4.190 10 10 IICE CC(C)(C)OC(=O)N1CCCC2(CC(NCc3c(O)cccc3Br)C2)C1 2103372197 LPRNVZOGFNKPDA-UHFFFAOYSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)c1O 2220462564 NIKFVTVZRYIUNJ-MRXNPFEDSA-N 449.345 4.054 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C(C)C)c1O 2236054347 HMDWVFBXBNEYRS-NVXWUHKLSA-N 443.382 4.287 10 10 IICE Cc1ccccc1N1C(=O)C(=Cc2ccc(-c3cccc(C(=O)O)c3C)o2)C(=O)NC1=S 2293769102 ZGPMVNXNXXNCRQ-UHFFFAOYSA-N 446.484 4.093 10 10 IICE CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=Cc1cc(OC)c(OC)c(OC)c1 2294311806 BMZVJULHHKHPPE-UHFFFAOYSA-N 425.441 4.207 10 10 IICE CCOc1cccc(C=C2C(=O)NC(=O)N(c3ccc(OCc4ccccc4)cc3)C2=O)c1 2297340398 LBKMANUARCRHEH-UHFFFAOYSA-N 442.471 4.331 10 10 IICE CC[C@H]1CCCCN1C(=O)CCCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S 2297349698 JEMUTZMUJIQXJD-INIZCTEOSA-N 446.594 4.188 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4ccco4)SC3=NC2=O)c(C)n1-c1cccc(F)c1 2297469920 CAKKCFXJEYVOAQ-UHFFFAOYSA-N 433.468 4.494 10 10 IICE COc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2c(C)cc(C)cc2C)C1=O 2313507678 BJAIJBACYWKQFL-UHFFFAOYSA-N 443.297 4.049 10 10 IICE CC(=C1SC(=S)N(NC(=O)Cc2ccccc2)C1=O)c1ccc(Br)cc1 2314541316 JOSAQSCJOTUPPO-UHFFFAOYSA-N 447.379 4.314 10 10 IICE CC(C)CN1C(=O)C(=Cc2ccc(OCC(=O)NCc3ccccc3)cc2)SC1=S 2331592529 UODCZFBBOMKTQE-UHFFFAOYSA-N 440.590 4.239 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@H](c2ccccc2Cl)N3)CC1 14466114 JNCQFZUXRIAJTR-IUKKYPGJSA-N 444.000 4.103 10 10 IICE COc1ccc(N2CCCN(C(=O)c3c(C)nn(-c4ccc(F)cc4F)c3C)CC2)cc1 108577577 MUDJDIZDZQZOCD-UHFFFAOYSA-N 440.494 4.128 10 10 IICE CC[C@@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(C)nn(C)c1C 743695166 VIXRXGYCBVFUNA-QFBILLFUSA-N 435.519 4.058 10 10 IICE C[C@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)ccc1O 757638911 SVMBZVQLSPXKEH-BLLLJJGKSA-N 431.309 4.218 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)c4nn(C)cc4[N+](=O)[O-])n3)c2C)cc1 772907141 UTNJDXWBEPZCAE-UHFFFAOYSA-N 436.497 4.420 10 10 IICE CCn1c(CCCc2cccs2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 801871402 SVSOYNFZQQOEGR-UHFFFAOYSA-N 425.602 4.008 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cnccc2C(F)(F)F)C1 1131484240 FQPSQUXQWBHDCG-UHFFFAOYSA-N 430.474 4.138 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1133626588 QLSIIYASVVWXKE-INIZCTEOSA-N 447.501 4.217 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C1C[C@@H]2CCCC[C@H](C1)C2=O 1156287720 QOTUVBPMNPNYDO-DFNIBXOVSA-N 428.573 4.161 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)/C(F)=C/c1ccc(F)c(C(F)(F)F)c1 1167763097 XINOCZCCWNDNGL-NDENLUEZSA-N 440.412 4.432 10 10 IICE C[C@H](C1CC1)N(C(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21)C1CC1 1190933086 BLWFGDSRIQCBMY-QGZVFWFLSA-N 427.589 4.253 10 10 IICE Cc1ccc(Br)c(CNC(=O)NCc2cccc(Br)c2O)c1 1230181344 ISCFTMKCQDFUSH-UHFFFAOYSA-N 428.124 4.225 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(Cc4c(F)cccc4Cl)C3)C2)cc1 1230300057 AYPNXLJTZPRQTD-INIZCTEOSA-N 431.939 4.198 10 10 IICE CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1251980675 CNAHKESUPPDVBW-KNQAVFIVSA-N 446.636 4.423 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(CC(F)(F)F)C3)cc2Cl)C1 1270439130 JRLMPSHQVMNGJK-WBVHZDCISA-N 431.930 4.467 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CC(C)(C)OC(C)(C)C1 1289424105 RORRNDBFDBDEMI-UHFFFAOYSA-N 434.588 4.157 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)c1 1295774443 JJOKMPMFSCMVCQ-ZWKOTPCHSA-N 439.556 4.377 10 10 IICE COCCN(c1nnc(-c2cccnc2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@@H](C)C1 1316080423 MECKWSPRELNAIW-DVECYGJZSA-N 448.615 4.404 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC(C)(C)CN(C)Cc2ccccc2)C1 1435778546 OZCZEVFLXKYMNK-UHFFFAOYSA-N 446.639 4.435 10 10 IICE COc1c(Br)ccc(F)c1C(=O)NCc1ccc(N2CCSCC2)cc1 1441632756 SFWIPEFCWCZMIU-UHFFFAOYSA-N 439.350 4.080 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)cc1C 1448246729 XQCGCRCLHZSJCB-NRFANRHFSA-N 435.499 4.473 10 10 IICE COc1cc(N2CCN(C(=O)/C=C\c3ccc(C(C)(C)C)cc3)CC2)cc(OC)c1OC 1458760159 CWHNIOPPROFHCG-XFXZXTDPSA-N 438.568 4.372 10 10 IICE CC(C)[C@H](c1ccccc1)N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1459576477 WOYURKCCXWJTJK-BVFVYWQFSA-N 441.591 4.385 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)CSc1nncn1-c1cccc(Cl)c1 1463815360 ZEUADLWDCSQVJT-UHFFFAOYSA-N 441.988 4.272 10 10 IICE O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)c1cc2cc(O)c(O)cc2s1 1465366696 IWUBNIKWDKQMMI-UHFFFAOYSA-N 432.807 4.189 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)C1(F)F 1505283443 OWTCVGHVLONCQU-HDICACEKSA-N 447.574 4.188 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1515526239 NBLLUAMHKGJQPS-RUZDIDTESA-N 434.588 4.240 10 10 IICE COC(=O)N1CCC([C@@H](C)NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 1538966711 SXUVIXGEIPIUMJ-MRXNPFEDSA-N 431.964 4.273 10 10 IICE CCCCNC(=O)c1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1540814111 RCNIRJBPEIPNFI-UHFFFAOYSA-N 431.536 4.367 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccsc2NC(=O)c2ccc(Cl)cc2O)cc1F 1542430394 SYXSRRIYYCEAAK-UHFFFAOYSA-N 447.919 4.495 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1NCC(F)(F)F 1545832999 IJRRVYUVNVLHGY-UHFFFAOYSA-N 446.517 4.123 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)c2cccc(Br)c2)c1 1556319565 ZUTWOLNNXDTVCP-OAQYLSRUSA-N 441.325 4.133 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)CC1 1558641468 WGQFODLTUJWEDT-FUKPKEADSA-N 444.572 4.387 10 10 IICE Cc1ccc(CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C2CC2)cc1C 1564895531 LNXFAPHDGKWQFC-UHFFFAOYSA-N 429.511 4.292 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccc(N(C)C)cc2C)cc1 1565701780 MKXQFULXZFUDQE-UHFFFAOYSA-N 437.565 4.100 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CO[C@@H]1C[C@@H](C)CC[C@@H]1C(C)C 1566848917 CTKDKGOCDIWAED-QKYXUNIQSA-N 425.953 4.025 10 10 IICE CCON(Cc1ccccc1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1570143683 ZWALEIPLQRWCBY-XMHGGMMESA-N 444.553 4.397 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3c[nH]c4ccc(Br)cc34)C2)cc1 1570565570 TYCCEBWSFNEOMG-HNNXBMFYSA-N 442.357 4.124 10 10 IICE Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)nc1 1596578950 VFZHOGFSZBCQBY-NRFANRHFSA-N 444.535 4.101 10 10 IICE CN(C)c1ccc(CN(C)c2ncc(C(F)(F)F)cc2I)cc1 1611737790 GNJPLABGJYNTIU-UHFFFAOYSA-N 435.231 4.407 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613195444 AUUBPKMLJFLKGS-SLFFLAALSA-N 425.621 4.141 10 10 IICE C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F)c1ccc(N(C)C)cc1 1616834631 KUIPNUNRTGEAJF-VBKZILBWSA-N 433.499 4.474 10 10 IICE COc1ccccc1[C@@H](C)N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)OC 1620597982 MGFQICJEJFRJTL-MRXNPFEDSA-N 444.487 4.034 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)ccc(C)c4[nH]3)CC2)cc1F 1622578643 BUFXDSGCEMCJQI-UHFFFAOYSA-N 446.320 4.349 10 10 IICE COc1ccc(OC)c(C2=NO[C@@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2)c1 1624070257 QJYRHCWCPUGEFM-RUZDIDTESA-N 447.535 4.229 10 10 IICE Cc1nn(-c2ccccc2)c2sc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cc12 1627463731 DQPAKXPUXHKYOH-JOCHJYFZSA-N 447.608 4.494 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COc3ccc(S(=O)(=O)N(C)C)cc3)c2C)cc1C 1640904476 OQKKBRRIVBHMQL-UHFFFAOYSA-N 440.565 4.223 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N[C@H](c3ccc(F)cc3)C3CCCC3)CC2)cc1 1642354563 OKLAFXWIBFEKIM-SANMLTNESA-N 439.575 4.394 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC[C@H](S(=O)(=O)Nc2ccccc2)C1 1645437317 VBLZHQRMHXRJJM-IBGZPJMESA-N 443.594 4.202 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccccc1OC(F)(F)F 1645512070 AGKZPJDJVVKXSR-IBGZPJMESA-N 447.413 4.032 10 10 IICE C[C@@H](NC(=O)c1c(F)ccc(O)c1O)c1cccc(NC(=O)Cc2ccccc2F)c1 1648464922 JYWHPTBPQJDLMK-CYBMUJFWSA-N 426.419 4.048 10 10 IICE Cc1cc(CN2CCC[C@H]([C@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)C2)ccc1N(C)C 1659304097 YBFSIGKGUSRACC-QZNHQXDQSA-N 431.621 4.345 10 10 IICE Cc1ccc2c(c1Br)CN(C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)C2 1676653662 UMNBZSYVVCTCJN-HXUWFJFHSA-N 445.405 4.152 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@@H](c4ccc(Cl)s4)C3)C2)cc1 1683504106 KXLWZYZTRGTMNY-MAUKXSAKSA-N 435.977 4.020 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2cscn2)n1Cc1ccc(N2CCSCC2)cc1 1694004826 HWJKETJTLZWJHI-KRWDZBQOSA-N 442.658 4.486 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1695093706 USJMDHXOACSIAW-DENIHFKCSA-N 438.620 4.139 10 10 IICE C=CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(N)=O)CC1 1705801364 CDBIHQQKLYFPHX-UHFFFAOYSA-N 446.599 4.411 10 10 IICE Cc1nc(C)c(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)s1 1707740955 PBPVDHFVVAEZSW-UHFFFAOYSA-N 425.583 4.394 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1712798956 DIEZTYFNFPMASP-GHTZIAJQSA-N 443.661 4.181 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1726463554 KBXHYXRHTTYOOE-NHCUHLMSSA-N 448.615 4.440 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](COCCOC)C1 1764371763 RSXJOCRXTUZATP-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CCOc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)ccc1OCC(=O)N(CC)CC 1865674890 CTZTUKCKFWTROV-RCCKNPSSSA-N 435.524 4.139 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCC4)nc(Cc4ccccc4)n3)CC2)cc1 1867942073 SOPXXKXEVBJRCK-UHFFFAOYSA-N 429.568 4.003 10 10 IICE CCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccncc2)C1=O 1873164883 XGDHYLMOEJFRIC-UHFFFAOYSA-N 428.536 4.159 10 10 IICE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1scc(Br)c1Br 1912198650 JDNVXVVZKRRPRO-VIFPVBQESA-N 426.134 4.167 10 10 IICE O=C(O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc([N+](=O)[O-])c1O 1951378774 YPMBIDCXILYMMM-FQEVSTJZSA-N 448.431 4.355 10 10 IICE CCN(CC)c1ccc(C=C2C(=O)NC(=S)N(c3cccc(Cl)c3C)C2=O)cc1 2294208483 IRFPBIFZSUJZSW-UHFFFAOYSA-N 427.957 4.326 10 10 IICE COc1ccc(N2C(=O)C(=Cc3ccc(Sc4ccccc4)o3)C(=O)NC2=S)cc1 2294279974 MOWLUPGRECSTBR-UHFFFAOYSA-N 436.514 4.271 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1c[nH]c3ccccc13)N2 14545097 BMMHOFXNJOFTPA-BKNYKGDCSA-N 449.576 4.452 10 10 IICE COc1ccccc1C(=O)Nc1cccc(N2CCC(N[C@@H]3CCOC(C)(C)C3)CC2)c1 14996604 SYPIFEJOCFXHAH-OAQYLSRUSA-N 437.584 4.464 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c(C)n1-c1cccc(F)c1 16455659 WHCMPPXNTYNDQY-XMMPIXPASA-N 437.446 4.022 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2ccccc2OCc2ccccc2C)SC1=S 40937993 XQESAEACHUUTLT-CPNJWEJPSA-N 427.547 4.338 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)/C2=C(\C)NC[C@H]2CCCO2)cc1 205962587 YWYVEMBZYCRXLA-ISPGYRLHSA-N 448.548 4.098 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1ccc(N3CCCC3)cc1)O[C@@H](C)C2 730823771 OVMWXJHUOWXADB-JWNTYJGQSA-N 435.568 4.364 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(c3ccc(F)cc3)CC2)NC(=O)OC(C)(C)C)cc1 742750525 DIKHDNJWEIXSDL-NRFANRHFSA-N 441.547 4.306 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cccc(F)c3)cs2)cc1Cl 749738075 QFGHZFFHIFMGLZ-UHFFFAOYSA-N 426.878 4.190 10 10 IICE C[C@H](CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)NC(=O)OC(C)(C)C 764981560 IZEXWPSXDOPBBF-OAHLLOKOSA-N 441.519 4.066 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 768237136 KUGHVQPUAOGSCU-GMAHTHKFSA-N 429.605 4.135 10 10 IICE Cc1ccc([C@@H](CCn2cncn2)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 783266666 XSEDKEGKJOZPPY-HHHXNRCGSA-N 444.627 4.040 10 10 IICE C[C@H](Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1cc(Br)cc(F)c1O 797146467 WNHSDPBJPJOTNY-VIFPVBQESA-N 425.229 4.259 10 10 IICE CNC(=O)C[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)c1ccccc1 800717784 RNHUSYMETNFQJQ-UWJYYQICSA-N 442.991 4.253 10 10 IICE O=C(NCCc1cccc(OCC(F)(F)F)c1)NCc1cc(Br)ccc1O 805416547 ARMCUTGIWBVJME-UHFFFAOYSA-N 447.251 4.138 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cccnc3C(F)(F)F)n2)cc1OC 808526585 RLXJUPWYPDAKMW-UHFFFAOYSA-N 445.444 4.042 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C 1129820246 SEUCWJZAZJRXSP-WMZHIEFXSA-N 439.600 4.449 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cc(Cl)c3c(c2)OCCO3)cc1 1142379809 YLRKJSSREGBFIS-UHFFFAOYSA-N 438.911 4.190 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3sccc3-n3c(C)ccc3C)[C@@H](C)C2)cc1 1143423681 XMOSUAOBEKYAPZ-SFHVURJKSA-N 437.565 4.293 10 10 IICE Cc1cccc([C@H](CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)NC(N)=O)c1 1155727414 RDFPRQSPKSFNOE-UTKZUKDTSA-N 442.991 4.301 10 10 IICE CSCC1(CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 1278765690 NAIKZMDAZIHINL-NTCAYCPXSA-N 440.681 4.379 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1296440034 VHCPPRLTGIKCEU-NRFANRHFSA-N 437.588 4.393 10 10 IICE CCO[C@H]1C[C@](CO)(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1296496710 QATYROVLMJONFZ-SIKLNZKXSA-N 449.389 4.153 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1)C(C)C 1299642856 JFLLLHZAPONUEJ-GMAHTHKFSA-N 437.588 4.249 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 1307473230 NVCYFWQCQQZGBA-SFHLNBCPSA-N 433.612 4.204 10 10 IICE CCN(CC(C)C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1313628608 FFYQGLSYXYQKDQ-UHFFFAOYSA-N 436.629 4.424 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)N2CCCC2)n1C[C@H]1CCCCC(F)(F)C1 1314751518 USZCKUDXXULWMC-KRWDZBQOSA-N 447.530 4.072 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)C(=O)Nc2cccc(N3CCCC3)c2)c(C)n1-c1ccccc1 1352011369 RQBZUBARSRAYQW-FQEVSTJZSA-N 444.579 4.380 10 10 IICE C[C@](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)(C1CC1)C(F)(F)F 1354755263 POCQQQJEMXUMGH-MDNBWPLSSA-N 446.491 4.264 10 10 IICE CN(C)c1ccc(N(Cc2ccccn2)C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 1435961433 BJMCZYLEJSPZHT-IBGZPJMESA-N 436.556 4.294 10 10 IICE Cc1cc(C(=O)N2C[C@H]3C[C@H](N(C)C)CC[C@H]3C2)c(C)n1-c1ccc(Br)cn1 1457145010 MHPAXNYGAHKWTJ-YQVWRLOYSA-N 445.405 4.054 10 10 IICE CN(Cc1ccccc1O)C(=O)NCc1cccc2c1CCN(C(=O)OC(C)(C)C)C2 1479091462 OTAPUXCTSQXSGR-UHFFFAOYSA-N 425.529 4.027 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)cc2Cl)C1 1519551821 PUFGHTXYLJSIHX-OAHLLOKOSA-N 430.936 4.481 10 10 IICE COc1cc(OC2CC2)ccc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1524058761 PIHAGUUMIFKTME-HNNXBMFYSA-N 432.467 4.237 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC3(CCCC3)OC[C@H]2CN(C)C)c1 1539398126 QYLPNDFZXYZECZ-HXUWFJFHSA-N 429.992 4.463 10 10 IICE Cc1ccc(C(=O)NCc2cccc(N3CCOC3=O)c2)cc1-n1c(C)cc(C=O)c1C 1543150265 OHXGALHYKAUNEO-UHFFFAOYSA-N 431.492 4.102 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)CC[C@H]1C 1544425880 HPTLNJDQHPGDAI-IAGOWNOFSA-N 428.631 4.385 10 10 IICE CC[C@H](C)[C@@H](Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C)OC 1545306807 XCZXHLGWBAJMRB-SIKLNZKXSA-N 443.636 4.110 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1sc2cccc(F)c2c1COC 1557113719 GTFPXJDMUVQWOW-UHFFFAOYSA-N 431.485 4.098 10 10 IICE Cc1cc(CCNC(=O)NC[C@]2(CO)C[C@H]2c2ccc(F)cc2)c(C)n1-c1ccccc1 1565162094 LSHJDDCQJDBXNL-AHWVRZQESA-N 435.543 4.241 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)cc1F 1585697835 DKFMWOLAGPJAPQ-GBXCKJPGSA-N 433.568 4.468 10 10 IICE CC[C@H](C)N(CC)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1587197166 NTOXHZSUAZLWOO-XBUHWIKASA-N 441.416 4.297 10 10 IICE Cc1cc(C)cc([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1616786239 FULPORZIWXNZPW-UFYCRDLUSA-N 427.564 4.023 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CC(F)(F)CO1 1617893930 WCNIMERTPFYCTF-LJQANCHMSA-N 433.547 4.236 10 10 IICE COc1cccc(OCCN2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)c1 1631144067 JWGJJJWKVZQMOI-UHFFFAOYSA-N 447.579 4.248 10 10 IICE C[C@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Cl)c(F)c1 1633358877 NDRPBUGMRKCWDI-LBPRGKRZSA-N 427.854 4.154 10 10 IICE CCCN(CCNC(=O)N(Cc1ccco1)Cc1ccccc1O)C(=O)OC(C)(C)C 1633800334 OVZABUQWPWBMTH-UHFFFAOYSA-N 431.533 4.344 10 10 IICE Cc1ccc(C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1635456802 VVADUVLLMDCDMD-AZGAKELHSA-N 446.547 4.180 10 10 IICE O=C(NCCC1CCC(F)(F)CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1640364735 IXLWUAYWCWEIHU-UHFFFAOYSA-N 444.525 4.200 10 10 IICE Cc1ccc(C(=O)N2CCCC[C@@H]2COC(=O)NC2CC2)cc1-n1c(C)cc(C=O)c1C 1642093025 OOMOWXALCMIOAM-JOCHJYFZSA-N 437.540 4.098 10 10 IICE C[C@@H](C1CC1)N(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1644153392 FKDPKOIMHNQVOB-AQNXPRMDSA-N 439.575 4.361 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOCC3(CCC3)C2)sc(C)c1-c1ccccc1 1645243589 KUXKWMZXOHPZOR-UHFFFAOYSA-N 442.581 4.341 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1 1647830334 SAPQAFWCYGENSF-QGZVFWFLSA-N 429.731 4.042 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](Cn3ccnc3)c3ccc(C)cc3C)C2)cc1 1680875446 ANDLEZBPVXJZNV-PXDATVDWSA-N 447.583 4.076 10 10 IICE COC(=O)c1ccccc1CCNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1686269660 VQTWFBHLXWKBRO-KRWDZBQOSA-N 443.975 4.405 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1694176779 ZFETTYCKLJINLF-KRWDZBQOSA-N 432.576 4.012 10 10 IICE CC[C@]1(C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCO1 1694455730 MMYXLMWGCQKEHY-RUZDIDTESA-N 425.621 4.303 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](COC)OC)C(C)C 1695536146 QBKOOQSDMPQELF-OAQYLSRUSA-N 425.577 4.249 10 10 IICE CC(C)Cc1nnc(N2CCC([C@H]3CCCO3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1706396474 CVJPSBPXGOVEHJ-JOCHJYFZSA-N 429.584 4.125 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N(CCC#N)CCC(C)C 1707304758 FEWBXZWEDIRWBG-QFIPXVFZSA-N 438.620 4.361 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC(c3cnn(C)c3)CC2)nnc1C(C)(C)C 1707305697 IMOPPARNOCXDSM-UHFFFAOYSA-N 435.620 4.116 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2noc3c2COCC3)n1CCCSc1nccs1 1709487715 JTHBCYHTWFCDDP-AWEZNQCLSA-N 448.618 4.270 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CCC=C(C)C2)cc1 1710027636 IYZKCPOZSCJUOM-UHFFFAOYSA-N 433.604 4.191 10 10 IICE COc1ccc(-c2nnc(N(C)C[C@@H]3CCOC3)n2CCCSc2nccs2)cc1 1711738723 RWCGHWYEBXAJPQ-INIZCTEOSA-N 445.614 4.065 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCc3cccs3)CC2)cc1F 1711866457 ZCIDWOOOCANRPT-UHFFFAOYSA-N 429.565 4.180 10 10 IICE CNC(=O)CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC1(C)C 1729698252 QYOMWLPFAUPCLE-HXUWFJFHSA-N 448.615 4.361 10 10 IICE Cc1cc(-c2nnc(Nc3ccn(C)n3)n2C[C@](C)(O)C(C)C)c(C)n1-c1ccccc1 1742120253 SZRLVYHWLVQARM-DEOSSOPVSA-N 433.560 4.237 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CC[C@H](Oc3ccccn3)C2)nnc1C(C)(C)C 1742141772 OCVPDTJHGSGTOZ-NRFANRHFSA-N 434.588 4.051 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1744820447 YGJWRVVXRIRWDV-SIKLNZKXSA-N 425.621 4.283 10 10 IICE COCCC(C)(C)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1749593111 HARNHTVDFRWNIO-UHFFFAOYSA-N 441.620 4.334 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)C2CCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1749918783 BEDIPCOTASHJNY-FQEVSTJZSA-N 441.620 4.275 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@@H]3C)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1751408810 OFWLYBQZGOEAER-MJGOQNOKSA-N 434.588 4.112 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)c(F)c1 1763557151 DPCSDQODZOLHJO-PMUMKWKESA-N 443.489 4.201 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@H](C4CC4)O[C@H](C)C3)nnc2C(C)(C)C)cc1 1764936164 CXYNGTGDRGXQQL-XMSQKQJNSA-N 425.621 4.474 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1765272843 OGQNIKZJZBQFAQ-FXAWDEMLSA-N 433.597 4.105 10 10 IICE CC(C)Oc1cccc(/C=C2/SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 1858591797 ALQCDHMXHXMVNB-LPGQDOADSA-N 443.546 4.077 10 10 IICE CCCn1cc(OCc2ccccc2)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870465621 ISGUOVLQMPFQKO-UHFFFAOYSA-N 447.579 4.168 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCOC(C)C)C(=O)N(C3CCCC3)C2=O)cc1 1873165447 OSMVEYYMKHQNJM-UHFFFAOYSA-N 435.568 4.131 10 10 IICE COc1cccc(NC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(C3CC3)C2=O)c1 1873422213 LSKXQZHFLWDAKS-UHFFFAOYSA-N 427.504 4.457 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2(NCc3ccc(Br)cc3O)CC2)C1 1967775420 LCIWGEARGCCGHN-HNNXBMFYSA-N 425.367 4.424 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)C(=Cc3ccc(OC)cc3)SC2=S)cc1 2053467488 GRLNPXATFVLLDR-UHFFFAOYSA-N 442.562 4.324 10 10 IICE Cc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]3CC[C@H]23)c(O)c1Br 2352949938 LDKJXXRSNRLQQI-OWCLPIDISA-N 425.367 4.341 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2381136113 AVSFAIGMDSLOAT-DZGCQCFKSA-N 441.366 4.163 10 10 IICE COc1ccccc1N/C=C1\SC(=S)N(CCc2ccc(OC)c(OC)c2)C1=O 6151010 SCBLZGGJIKJHTI-UYRXBGFRSA-N 430.551 4.069 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\c3ccc(OCCC(=O)O)cc3)SC2=S)cc1 16907831 APPYEQOQTZNMLF-QGOAFFKASA-N 429.519 4.345 10 10 IICE CN1C(=O)c2ccc(C(=O)N[C@@H](c3ccccc3)c3c(O)ccc4ccccc34)cc2C1=O 69260846 XXUPIHCXJBOAIB-DEOSSOPVSA-N 436.467 4.291 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NCc1cc(Br)cc(F)c1O 715828015 NKBYZWDLLPBZAG-OAHLLOKOSA-N 429.330 4.173 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H](COCc1ccccc1)c1ccccc1 740910333 WAJBCKNZDXICMP-AREMUKBSSA-N 445.563 4.281 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NCc1ccc(N3CCCCC3)cc1)CC2 758464238 LYFRZJWIZQMDPI-QGZVFWFLSA-N 432.490 4.215 10 10 IICE Cc1cc(CCNC(=O)Nc2ccc(F)cc2CS(C)(=O)=O)c(C)n1-c1ccccc1 760062611 BUTVBMKIZWJOCE-UHFFFAOYSA-N 443.544 4.142 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 760167345 OJWSLHGGAUSHQA-HXUWFJFHSA-N 447.583 4.393 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 766444387 AYFUVMOMPJMBIG-SFTDATJTSA-N 443.513 4.056 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nc(-c3ccccc3F)no2)C1 769665955 YJEGZXYHYVZSKE-UHFFFAOYSA-N 448.498 4.340 10 10 IICE COc1ccc(N2CCC(NC(=O)Nc3nc(-c4sccc4C)ns3)CC2)cc1 771271226 ADUPCVKGUDVRKZ-UHFFFAOYSA-N 429.571 4.374 10 10 IICE Cc1nc2c(s1)[C@@H](NC(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CCC2 780832187 RCSARBKWMRQKSQ-SFHVURJKSA-N 436.528 4.399 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 792276555 WTQHNLFXSCFRFW-UHFFFAOYSA-N 440.554 4.480 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)c3nnc4n3CCCCC4)cc2Cl)C1 799860520 CEZSLLTUIGIKDH-DLBZAZTESA-N 445.011 4.455 10 10 IICE COc1cccc([C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 1128247105 MPXOISSRVSNVJP-IERDGZPVSA-N 427.545 4.204 10 10 IICE CCc1onc(-c2ccccc2Cl)c1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1133123570 RJOCIHYBJYWHLE-UHFFFAOYSA-N 438.959 4.239 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3ccncc3)nc3ccccc23)N(C)C)cc1 1134681794 ILAWTERUUFTUGY-SANMLTNESA-N 439.563 4.396 10 10 IICE CCCCOc1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(O)c1 1161005947 ZQSHVLTWAQSWNN-UHFFFAOYSA-N 437.584 4.033 10 10 IICE Cc1cc(CN(CC(C)C)c2c(O)nc(=O)n(CC(C)C)c2N)ccc1N1CCCCC1 1168035260 SDAAQWABOQTMIL-UHFFFAOYSA-N 441.620 4.148 10 10 IICE Cc1cc(C(=O)N2CCC(Cc3ncon3)CC2)c(C)n1-c1ccc(Br)cc1 1178378397 WGUBCDZBHUFYJS-UHFFFAOYSA-N 443.345 4.335 10 10 IICE C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1248501017 CKNZBRNOMAQFHZ-SFHVURJKSA-N 446.478 4.474 10 10 IICE CC(C)(C)OC(=O)Nc1nc(CNC(=O)NCc2c(O)ccc3c2CCCC3)cs1 1251488786 DWANNXLDZZNDJA-UHFFFAOYSA-N 432.546 4.074 10 10 IICE Cc1cccc(-n2cnc3cc(C(=O)NC[C@@H](c4ccc(N(C)C)cc4)N(C)C)ccc32)c1 1289602735 WVIGJYGXSBKDRR-SANMLTNESA-N 441.579 4.433 10 10 IICE CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1296341897 SBQHRZKEQUCUFD-HSZRJFAPSA-N 425.506 4.093 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H]2CCOC2)c(C)n1-c1ccccc1Br 1304201352 ZWESKFUFJGDGTP-ROUUACIJSA-N 447.373 4.124 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NCc3cccc(Cl)c3O)cc2)cc1 1305069327 DIFUTIKRVXVCPY-UHFFFAOYSA-N 430.913 4.085 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4c(c3)ncn4C)cc2Cl)C1 1312588925 AOSQTWGJPMYXND-MRXNPFEDSA-N 425.964 4.462 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](c3nccn3C)C(F)(F)F)cc2Cl)C1 1312590604 MSRFUQBLVIHALU-CXAGYDPISA-N 443.901 4.413 10 10 IICE CCSCCCn1c(Cc2cn3ccccc3n2)nnc1N(C)Cc1ccccc1O 1314622682 USYWXWOHIMZHLP-UHFFFAOYSA-N 436.585 4.002 10 10 IICE COc1ccc(C)cc1N1C[C@H](C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1438303260 OEWBPHJRNCKSQZ-OAQYLSRUSA-N 431.536 4.080 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nnn(-c3ccc(F)c(Cl)c3)c2C)cc1F 1443776094 YPLUDOBUROUAIA-UHFFFAOYSA-N 433.890 4.284 10 10 IICE Cc1cc(CN2CCC(c3ccc(S(N)(=O)=O)cc3)CC2)ccc1N1CCCCC1 1460856780 JYTNKPKXJMCTNS-UHFFFAOYSA-N 427.614 4.012 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cnc(F)c(F)c1 1463388773 CBKLGQXCVNFOMR-MDWZMJQESA-N 425.507 4.041 10 10 IICE Cc1cc(CN2CCNC(=O)[C@@H]2c2ccc(Br)cc2)ccc1N1CCCCC1 1473419952 WIFZUJJNWNLVAQ-QFIPXVFZSA-N 442.401 4.421 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NC(=O)NCc1cc(Cl)ccc1O 1479435158 OJIISRCHFARNOA-IEBWSBKVSA-N 431.920 4.036 10 10 IICE CCC[C@H](C)N(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1500066265 YHBUPJIZTRYWOT-SFHVURJKSA-N 449.578 4.395 10 10 IICE Cc1cnn([C@H]2CCCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)cc3C)C2)c1 1511400432 FEJADAAESMNSDB-QFIPXVFZSA-N 435.620 4.345 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCCC1(F)F 1513904965 WZDPPZHEIOWYBG-SFHVURJKSA-N 433.547 4.391 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@@H]2Cc3c(Br)cccc3[C@H]21 1525761648 FGKSUOMGLVZHLN-IHDNQRHQSA-N 427.386 4.457 10 10 IICE Cc1cc(OCCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1Cl 1528261776 QWGJQRKJFZZMGK-UHFFFAOYSA-N 438.902 4.239 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(C(=O)C3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1535114157 FADMLJMFZYGZSW-NRFANRHFSA-N 427.976 4.197 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H]2c2cccs2)cc1F 1535620032 SZCRJPOOKOJBRB-NHCUHLMSSA-N 437.584 4.485 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C/c1cncc(C)c1)CCC2 1537024013 IJRPPBIYQORPLG-CMDGGOBGSA-N 432.476 4.341 10 10 IICE CCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1cccc(Cl)c1 1539236360 SKYTYBKCENVRFQ-QHCPKHFHSA-N 439.991 4.187 10 10 IICE Cc1ccc(CCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Cl 1544722236 ZGNZGUGJJWJIFI-UHFFFAOYSA-N 426.004 4.429 10 10 IICE CCc1ccc(C(=O)N2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1565193359 WIFDNOBJGXUNBI-UHFFFAOYSA-N 444.579 4.324 10 10 IICE CCN(CCCNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)C(=O)OC(C)(C)C 1565608635 MAMLOPONDSLAGK-UHFFFAOYSA-N 431.577 4.281 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCOc1ccc(C(F)(F)F)cn1 1566390156 UZZYVNDNBSSXSY-UHFFFAOYSA-N 431.414 4.129 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)c(C)o1 1583245054 QEHUPWCTZVKSAI-UHFFFAOYSA-N 447.535 4.023 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1587552585 VQZVSZYPUAOSPB-XLIONFOSSA-N 431.577 4.006 10 10 IICE C[C@@H]1SCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)[C@H]1C 1613037471 JSMCRPPUTIPOSY-OALUTQOASA-N 443.661 4.082 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(OC)c(I)c1 1617880448 XVINNCYZKXATGE-UHFFFAOYSA-N 439.293 4.448 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1)OC 1619593566 KODIVOLJPIWAIR-XMSQKQJNSA-N 437.588 4.250 10 10 IICE Cc1nc(C)n(Cc2cccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)c2)n1 1621251974 ARTPAQRFFONQHJ-UHFFFAOYSA-N 427.508 4.416 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc(CC)n(-c2c(Cl)cccc2Cl)n1 1623574629 UYVAZYPIFWTTFZ-UHFFFAOYSA-N 440.327 4.258 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ccccc32)c(C)n1-c1ccc(Br)cn1 1626999578 DNPTYSAEEPAPEC-UHFFFAOYSA-N 425.330 4.348 10 10 IICE Cc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(O)c1C 1629679147 LVTNBFNNAWTRQA-FQEVSTJZSA-N 427.545 4.071 10 10 IICE CCn1cc(Cl)cc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1629685996 UTTKLVDXEIALJS-GOSISDBHSA-N 434.968 4.223 10 10 IICE Cc1ccc(C(=O)N(C[C@@H]2CCCO2)[C@H]2CCSC2)cc1-n1c(C)cc(C=O)c1C 1632984478 JWSSBTHBAMSVHT-VXKWHMMOSA-N 426.582 4.342 10 10 IICE CCCN(Cc1c(F)cccc1Cl)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1638003676 CIQIMHWLCCUFDL-UHFFFAOYSA-N 432.971 4.353 10 10 IICE O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1639551419 OHOYNZZYARMMKA-LBPRGKRZSA-N 443.248 4.435 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(Nc3ncccn3)c2)cc1 1644030895 PSUWEUGONPJUAI-UHFFFAOYSA-N 429.446 4.491 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]([C@@H]3CCCO3)C2)sc(C)c1-c1ccccc1 1648269566 BXTKFVYAZFSNJC-OALUTQOASA-N 442.581 4.340 10 10 IICE Cc1cc(C(=O)N2CC[C@@](CO)(C(F)(F)F)C2)c(C)n1-c1cccc(Br)c1 1651583602 GHZKTWVNRZYCLP-GOSISDBHSA-N 445.279 4.244 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1ncc(Br)cc1Cl 1653611212 CJTSXZMZULKCAP-UHFFFAOYSA-N 434.117 4.032 10 10 IICE CC(C)N1C(=O)C[C@H](NCc2ccc(N3CCOCC3)cc2)[C@H]1c1ccc(Cl)c(F)c1 1654145491 BMXMHIKDHRCTQK-LADGPHEKSA-N 445.966 4.156 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](c4cccc(Cl)c4)C3(C)C)nc12 1660022763 PZFNUGIUDYXREK-SFHVURJKSA-N 428.920 4.033 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C[C@H]1C 1683252998 CHRBJQIWEOCXAY-NSHGMRRFSA-N 432.609 4.079 10 10 IICE COc1ccc(C[C@@H]2CCCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)C2)cc1 1684606308 DXJGXFWPBPQCGS-OFVILXPXSA-N 438.616 4.028 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(O)CCCCC1 1694106832 AIFKPWLUPAYIFE-FQEVSTJZSA-N 441.620 4.212 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCC[C@@H]3OC)CC2)cc1 1697470145 CTFWZIQNEWWBFM-UGKGYDQZSA-N 441.620 4.116 10 10 IICE Cc1cccc(-c2nnc(N3CCC(C)(C#N)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1707591826 HIDZQNWOADEOGZ-UHFFFAOYSA-N 429.572 4.201 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1710025488 BGXZAUIUBHJTOD-QFIPXVFZSA-N 434.588 4.096 10 10 IICE CC/C=C\Cn1c(CC2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1745104797 CBMGPMZZBSLTHC-DAXSKMNVSA-N 427.568 4.451 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4C)cs2)c(C)c1 1859572529 ORRPBFZJOUCHQE-UHFFFAOYSA-N 427.551 4.137 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCCCNC(=O)C(C)(C)C)N2CCCCC2)cc1 1866168528 GTTLHAMCHUFVIL-HSZRJFAPSA-N 444.664 4.119 10 10 IICE O=C(O)C=C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951381071 HDVMCZNOBAPQAM-KRWDZBQOSA-N 445.471 4.188 10 10 IICE O=C(O)C[C@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc(O)c1O 1951420567 NSTUZJDGJRUZFG-OAHLLOKOSA-N 433.460 4.195 10 10 IICE O=C(N[C@@]1(c2ccc(OCc3ccccc3)cc2O)C[C@@H]1C(=O)O)OCc1ccccc1 1952841122 PRXJYIWOTKZQNI-PXDATVDWSA-N 433.460 4.197 10 10 IICE CC[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cc(Br)cc(F)c1O 2093491192 ABLBESCHLJYUHJ-BLLLJJGKSA-N 431.346 4.419 10 10 IICE C[C@H]1C[C@H](CNCc2cc(Br)cc(F)c2O)CN(C(=O)OC(C)(C)C)C1 2115922174 GWDNWXWXELEIGB-QWHCGFSZSA-N 431.346 4.277 10 10 IICE COc1ccc(Br)c(CN[C@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1O 2227748127 KDFRDYCMKROHLM-LJQANCHMSA-N 431.371 4.192 10 10 IICE CSC1=NSC2=NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C(=N)N12 2297333801 TZYMUYHRLVNMIO-UHFFFAOYSA-N 426.498 4.344 10 10 IICE COC(=O)C1=C(C)N(Cc2ccc(OC)cc2)C(=O)C1=Cc1cccc(Br)c1 2313510683 DRQRPUBBWZUCLZ-UHFFFAOYSA-N 442.309 4.331 10 10 IICE Cc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C2CC2)c(O)c1Br 2352687412 GQYNIUMMIORWMZ-RDJZCZTQSA-N 425.367 4.341 10 10 IICE Cc1ccc(-c2noc(-c3ccccc3S(=O)(=O)NCc3ccc(N(C)C)cc3)n2)cc1 33175651 JEMDCOCEQXBFSA-UHFFFAOYSA-N 448.548 4.257 10 10 IICE COc1ccc2nc(NC(=O)CN3C(=O)/C(=C/c4cccs4)SC3=S)sc2c1 39875016 XVMPWKPQBFQCGU-ZSOIEALJSA-N 447.588 4.206 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(F)c(F)c(F)c3)n2)cc1OC 743045377 HNQRKNDGGYRMGL-UHFFFAOYSA-N 430.429 4.045 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@@H]3CCc4ccccc4C3)C2=O)cc2c1OCCO2 743284988 RLKHCBZGNQRYCI-XNHPLOEXSA-N 439.558 4.225 10 10 IICE CSc1ccc(N2C[C@H](C(=O)N(Cc3ccco3)Cc3ccccc3O)CC2=O)cc1 743428367 VBETWJOLDXVYOQ-GOSISDBHSA-N 436.533 4.289 10 10 IICE CCOC(=O)c1nc(-c2ccccc2)oc1CN(C)c1cc(OC)c(OC)c(OC)c1 745985417 HGTPNBDUHXLIFE-UHFFFAOYSA-N 426.469 4.181 10 10 IICE COc1cc(N2CCN(Cc3cc4ccccc4nc3Cl)CC2)cc(OC)c1OC 759879393 UQAWGDCWMJXPBU-UHFFFAOYSA-N 427.932 4.236 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)Cc2ccn(-c3ccccc3)n2)C1 766424314 IRPJOONSQYTYMK-UHFFFAOYSA-N 441.579 4.252 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](C)c2nc3ccccc3o2)C1 766764945 MLAJJWKMCJPCPQ-GOSISDBHSA-N 430.552 4.469 10 10 IICE Cc1nn(C(C)(C)C)cc1[C@H](C)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 767029360 ICTVWKXJLQGJOB-HNNXBMFYSA-N 444.535 4.011 10 10 IICE Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 784146548 SRZFGOISGRFPHG-UHFFFAOYSA-N 442.947 4.019 10 10 IICE Cc1cc(C(=O)NCCNC(=O)Cc2cccc(F)c2)c(C)n1-c1cccc(C(C)C)c1 1143402162 IRGARVHSYGGEMJ-UHFFFAOYSA-N 435.543 4.445 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccccc3[S@](=O)C(F)(F)F)c2)CC1 1153553091 XFKGHFCDHAYMKB-PMERELPUSA-N 439.503 4.097 10 10 IICE COc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1C(F)(F)F 1264688846 BEFRZEDHCRRPMQ-OKILXGFUSA-N 440.437 4.397 10 10 IICE CC(C)C[C@@H](CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)OC(C)(C)C 1295406880 YOKYCZTUBYIAKN-VQTJNVASSA-N 434.577 4.229 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1296438680 KSIAZMOEQGSCCV-LJQANCHMSA-N 437.588 4.393 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(Cl)c(F)c1 1305083784 CLRSOSKAUCVIGK-AUUYWEPGSA-N 439.314 4.453 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H](c3ccco3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305553366 BWIVQMHOAQXVRK-HRAATJIYSA-N 427.524 4.216 10 10 IICE CC(=O)N1C[C@@H]2CCC[C@@H](NCc3ccc(N4CCCCC4)c(Br)c3)[C@H]2C1 1308424369 SOMAPAIHWXZFDF-IRFCIJBXSA-N 434.422 4.176 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](OC)C(C)(C)C1 1316031931 BRLZVTUSKCLYDQ-JOCHJYFZSA-N 437.588 4.250 10 10 IICE CCOC(=O)c1c(NC(=O)c2cncc(-n3ccnn3)c2)sc(C)c1-c1ccc(C)cc1 1355888963 RVZKIORWXNOEMC-UHFFFAOYSA-N 447.520 4.437 10 10 IICE Cc1ccc(OCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cc1 1439872801 KHMOAHAXVSZMSF-UHFFFAOYSA-N 437.297 4.485 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](c1ccncc1)C1CCCCC1 1460742431 WPCANIWTQWOSDT-JOCHJYFZSA-N 429.511 4.177 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](C)Oc2ccc(C)cc2Br)cc1 1461344342 IALFVWLTNCOXKA-INIZCTEOSA-N 435.362 4.128 10 10 IICE CN(C)[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Cl)cc1 1465952249 YVCVCTVBZPPQRF-CTNGQTDRSA-N 436.383 4.083 10 10 IICE C[C@@H](Nc1ncnc(C(F)(F)F)c1Br)c1ccc(N2CCOCC2)cc1 1472673296 KRXJUAACHBEXOB-LLVKDONJSA-N 431.256 4.268 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC1=CCCCC1 1503105025 HOBDKMARFZZEAF-UHFFFAOYSA-N 443.567 4.179 10 10 IICE CCSCC[C@@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1523667029 DGTXAGSPPFDJHX-MLDYKZIASA-N 426.604 4.065 10 10 IICE CCN(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1C(=O)OC 1529117914 WMVDRRCXFJWJDR-UHFFFAOYSA-N 433.552 4.248 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1nn(-c2ccc(Cl)c(F)c2)c2c1CCC2 1540440832 VTZBZCWAKQYWKK-UHFFFAOYSA-N 426.923 4.492 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1 1544094200 OTPIHYLBBNGVPU-HAVVHWLPSA-N 442.523 4.046 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(Cl)c1 1546034199 QHCAHWNVWQCNJG-QGZVFWFLSA-N 432.904 4.435 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CC4)n3CCCCSC)CC2)cc1 1554959112 IUMXNGRZYPIKET-UHFFFAOYSA-N 429.634 4.099 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(C(F)(F)F)cccc3c2=O)c(C)n1-c1ccc(F)cn1 1559464199 TZNLCGVRMHFMGA-UHFFFAOYSA-N 444.388 4.240 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1 1568137233 KBWZUHCUDJRFMB-KRWDZBQOSA-N 445.357 4.337 10 10 IICE COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)C1 1583504268 DOJGRDZNSMYWOG-AVRDEDQJSA-N 439.600 4.221 10 10 IICE Cc1cc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c(C)n1-c1ccccc1 1584677629 VTVQQMCVCWRDMW-UHFFFAOYSA-N 431.536 4.416 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C3CCC(NC(=O)CC4CCCCC4)CC3)C2)cc1 1585988654 OFTUAHSMQRLUPE-HRTMPFAESA-N 441.616 4.036 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]3NC(=O)OC(C)(C)C)cc2)CC1 1616694886 JLPHUUNQINBEKB-RLBLXZPPSA-N 441.616 4.479 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccc(O)cc4)CC3)c2C)c1 1622312226 BRCSEAMPSTWJOW-UHFFFAOYSA-N 431.536 4.015 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1623946996 DMQRXXXBHFESBC-NTKDMRAZSA-N 446.547 4.365 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H]3CCCCN3C(=O)C(F)(F)F)c2C)c1 1627381112 HCFPQHLNJPGOLO-SFHVURJKSA-N 435.490 4.384 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCCc1ccsc1 1627962194 ZIAPCHSCUATQAA-SFQUDFHCSA-N 434.583 4.228 10 10 IICE COc1ncc(Br)cc1CNC(=O)c1cc(C)n(-c2ccccc2C)c1C 1629557162 IZIBOZTZZBQTHR-UHFFFAOYSA-N 428.330 4.499 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccccc4Cl)[nH]n3)cc2F)C[C@@H](C)O1 1630549976 FJBHZZRVCLBVOZ-HUUCEWRRSA-N 442.922 4.413 10 10 IICE Cc1cc(CCNC(=O)C2CC(N(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1631356233 FZXCWPIUXAAWLT-UHFFFAOYSA-N 425.573 4.398 10 10 IICE COC(=O)c1ccc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)cn1 1632615387 QUMALXKGNQNJHU-UHFFFAOYSA-N 428.286 4.291 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)CC3)cc2Cl)C1 1634720586 XQFXKBHTKGIAPY-SFHVURJKSA-N 427.980 4.003 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](CC(=O)O[C@H]2CCOC2)CC(C)C)cc1 1640201503 ABFRWNVZUOKDMD-REWPJTCUSA-N 426.557 4.208 10 10 IICE C[C@H](NC(=O)[C@@H](NCC(F)(F)F)c1cc(Br)cs1)c1ccccc1O 1648894321 KZECJNVFEKCEAP-XPTSAGLGSA-N 437.281 4.287 10 10 IICE Cc1cc(C(=O)N[C@H](C2CCC2)[C@@H]2CCOC2)c(C)n1-c1ccc(Br)cn1 1648998448 GTQVTDBNGVLCJH-OXQOHEQNSA-N 432.362 4.187 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]2[C@@H]2CCCO2)sc(C)c1-c1ccccc1 1653594123 DCTHKWIFXVOXFQ-OALUTQOASA-N 442.581 4.482 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)N(c3nccs3)C3CCCCC3)CC2)cc1 1653841319 ZELWOBWWHAKJPS-IBGZPJMESA-N 442.629 4.418 10 10 IICE COc1ccc(N(C)CCN(C)Cc2cc3c(cc2Br)OCCCO3)cc1 1659281142 OWEDZFAIFOVMQQ-UHFFFAOYSA-N 435.362 4.187 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1 1682071634 NZFZCGOLFUHDOJ-VQTJNVASSA-N 432.609 4.368 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C 1682881149 HCUQAQBFOWQFCM-XMMPIXPASA-N 426.605 4.374 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)cc2)CC1 1683701637 FTZYSWUANCSISA-FQEVSTJZSA-N 446.517 4.156 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@@H](C)c3ccc(Br)cc3)CC2)cc1 1685448062 VVMZYRTYYITOOG-QGZVFWFLSA-N 446.389 4.483 10 10 IICE CC(C)Cc1nnc(N(C)C[C@H](C)c2nccs2)n1Cc1ccc(N(C)C)c(F)c1 1692073072 MLDONKUNQVHNHM-INIZCTEOSA-N 430.597 4.426 10 10 IICE CCN(Cc1ccc(Cl)s1)c1nnc(C)n1Cc1ccc(N2CCOCC2)cc1 1695673664 ZBDUCFGMVWJUFQ-UHFFFAOYSA-N 431.993 4.213 10 10 IICE CSCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCC1 1698424554 UDZHZRCEXZSNTL-UHFFFAOYSA-N 439.629 4.457 10 10 IICE CCN(CC1CCC1)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1710111741 CZXOFYRUFMYMCP-UHFFFAOYSA-N 435.620 4.189 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1727986785 KVDJLJUOJWOZJX-HSZRJFAPSA-N 434.588 4.240 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1743533634 YWJODWXTPWRVMV-NFBKMPQASA-N 443.636 4.263 10 10 IICE CS[C@H]1CCCCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1750280178 WCKBTBAYGZNBBH-INIZCTEOSA-N 449.675 4.039 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)c1O 1860087505 BXIKQSJPHFTVKY-RQZCQDPDSA-N 447.534 4.223 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C(C)C)c(N)c2I)c(O)c1 2080005232 DLNWDQRHIBBAAO-MRXNPFEDSA-N 429.302 4.153 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1O 2236050946 MILLPPJMCGGETF-CQSZACIVSA-N 443.382 4.290 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)c1 2296775452 IMOCWIUPCKLPPU-UHFFFAOYSA-N 431.404 4.138 10 10 IICE COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)C1=Cc1cc(Br)ccc1OC 2313510834 XXYCBHOEDWDQEV-UHFFFAOYSA-N 442.309 4.331 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2cn(Cc3ccccc3)c3ccccc23)SC1=S 2314761705 XMTVJLGPSRESIY-UHFFFAOYSA-N 436.558 4.454 10 10 IICE CCOc1cc(C=C2SC(=S)N(Nc3ccccc3)C2=O)ccc1O[C@@H](C)C(=O)O 2314933415 BEJLYMJJQNAWNA-ZDUSSCGKSA-N 444.534 4.166 10 10 IICE O=C(CC1(c2ccccc2)C(=O)c2ccccc2C1=O)OC[C@H]1CCCN2CCCC[C@H]12 2107457 BMCUFBYPLYBZRH-AUSIDOKSSA-N 431.532 4.201 10 10 IICE biogenic COc1cc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)ccc1O 14459046 XYSAVTXIARQLBC-YZZKKUAISA-N 426.538 4.012 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478331 FZHFETZVPJXVCI-IUTNIJSXSA-N 427.526 4.498 10 10 IICE Cc1cc(C(=O)N2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c(C)n1-c1ccccc1 24286246 KDTNYEWGJUXMGL-UHFFFAOYSA-N 445.519 4.314 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccc(-c2ccc3c(c2)C(=O)NC3=O)o1 33795515 VNYOIGGGJNABRK-NDENLUEZSA-N 425.444 4.253 10 10 IICE CCN(CC)c1ccc(/C=C2\C(=N)N3N=C(COc4ccccc4)SC3=NC2=O)cc1 35044716 BQVDWUFWKPYGSE-VKXGLNTFSA-N 433.537 4.231 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 40846657 IQOODZMLCVDRDE-GDNBJRDFSA-N 433.352 4.304 10 10 IICE CC(=O)c1ccc(N2C(=O)/C(=C/c3ccc(OCCC(=O)O)cc3)SC2=S)cc1 210413844 LGLUTUWNDKPPBF-PDGQHHTCSA-N 427.503 4.149 10 10 IICE CC(C)CNC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 586704206 OEJZVPMSPCBTSW-UHFFFAOYSA-N 441.487 4.492 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)CSCc2ccc(Br)cc2F)c1 728978830 PTCROKTZGITYDL-NSHDSACASA-N 428.323 4.413 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCSc2nccs2)C[C@@H]2CCCC[C@@H]21 733975014 VIWPXQCYGWEGMD-JYJNAYRXSA-N 425.620 4.310 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1ccc2ccccc2n1 745784986 FPXVCMQQYPIABH-UHFFFAOYSA-N 428.330 4.477 10 10 IICE Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773994443 NOSHQUWMDQFMGR-AWEZNQCLSA-N 445.489 4.389 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)N(C)Cc2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1 783320170 LZICWBOSIRTONL-GHTZIAJQSA-N 433.911 4.077 10 10 IICE Cc1cnn(Cc2cc(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)no2)c1 800048620 GVVVOJVZCQEMDP-HNNXBMFYSA-N 427.936 4.048 10 10 IICE O=C1CCc2cc(Cl)c(S(=O)(=O)Nc3nc4c(s3)CCc3ccccc3-4)cc21 800925744 XHSJLWRAIRZQBB-UHFFFAOYSA-N 430.938 4.492 10 10 IICE COc1ccccc1[C@@H](CNC(=O)NCc1cc(Br)ccc1O)OC(C)C 805298959 WZWFBNUMUGMQCZ-LJQANCHMSA-N 437.334 4.129 10 10 IICE CCOCc1cc(CNC[C@@H]2CN(Cc3ccccc3)CC23CCOCC3)ccc1OC 815149754 YRFJMAXKSDWIQN-RUZDIDTESA-N 438.612 4.250 10 10 IICE CSCC[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1nnc2ccccn12 1135786067 ORAAVTWERRGYBD-NRFANRHFSA-N 447.564 4.174 10 10 IICE CCc1ccc([C@H](CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)N(C)C)cc1 1135926702 PPMKIODGQBXLPY-SANMLTNESA-N 431.580 4.431 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(C)n1-c1ccc(Br)cc1 1141274299 MWHUIDAMSZVQQV-SFTDATJTSA-N 431.374 4.384 10 10 IICE O=C(NC[C@H]1CCN(c2ccc(Br)cc2)C1)c1cc2cc(O)c(O)cc2s1 1142052332 QQWLPLDMXYEWNH-GFCCVEGCSA-N 447.354 4.331 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1142713317 SWZXOFLRPWRZHF-MBSDFSHPSA-N 426.532 4.308 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4cccs4)C3=O)c2C)cc1F 1165401288 NBHBMKLQVFRKTE-HSZRJFAPSA-N 439.512 4.253 10 10 IICE Cc1cc(CN(C)Cc2cccc(N3C[C@@H](C)CS3(=O)=O)c2)ccc1N1CCCCC1 1193898063 ILDHXJQYLDONGL-HXUWFJFHSA-N 441.641 4.403 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N=[S@@](C)(=O)c2cccc(F)c2)C1 1289035885 MQCVAOQURQUYJR-PMERELPUSA-N 427.545 4.230 10 10 IICE Cc1cccc(-c2nnc(N3CCSC[C@@H]3C)n2CCCSc2nccs2)n1 1289993576 LXBYRVYQVADOHH-HNNXBMFYSA-N 432.644 4.229 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2Cc2ccc(Cl)s2)n1 1290597146 ABGNDBSKJOBXTG-UHFFFAOYSA-N 442.976 4.245 10 10 IICE CCOc1ccc(CCCC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1OCC 1294824790 WGGFUIBDKQTDBH-UHFFFAOYSA-N 444.547 4.303 10 10 IICE Cc1cc(C(=O)NC[C@@]2(C)CCO[C@@H]2C2CC2)c(C)n1-c1ccc(Br)cn1 1296126400 QPUVUKRORLWQQD-TZIWHRDSSA-N 432.362 4.187 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCOc2ccc(Cl)c(F)c2)cc1 1297983735 ZWKCTLAIJKXECR-UHFFFAOYSA-N 428.891 4.437 10 10 IICE COCC[C@@H]1CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1301507776 VSHAFJGULZKIQM-INIZCTEOSA-N 433.603 4.348 10 10 IICE FC(F)[C@@H]1CCCN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)C1 1302950401 SVUXPFHVKPLMQN-HUUCEWRRSA-N 443.589 4.293 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCN(C(=O)OC(C)(C)C)CC2)n1C1CC1 1314753682 VRTNGMFOVFJWNZ-UHFFFAOYSA-N 427.549 4.070 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)s2)cc1 1351133811 DNVVRUMIFMCEEV-FQEVSTJZSA-N 448.592 4.059 10 10 IICE C[C@H](NC(=O)CCc1cccc(F)c1Br)c1ccc(N2CCOCC2)cc1 1351695708 BJLIGKFLACCKQU-HNNXBMFYSA-N 435.337 4.235 10 10 IICE Cc1cc(CC(=O)N[C@H](C)C(=O)Nc2cccc(N3CCCC3)c2)c(C)n1-c1ccccc1 1352011372 RQBZUBARSRAYQW-HXUWFJFHSA-N 444.579 4.380 10 10 IICE COC(=O)c1cc(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)ccc1OC 1352139755 GNJOIRRIBPKEQZ-UHFFFAOYSA-N 440.927 4.402 10 10 IICE Cc1cc(CC(=O)NCCc2cnc3c(Cl)cnn3c2)c(C)n1-c1ccc(Cl)cc1 1436539673 FPXQIDYCKLBHSI-UHFFFAOYSA-N 442.350 4.345 10 10 IICE CC(=O)c1cccc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1 1450161049 YLKMGSWFFQKPBY-PDGQHHTCSA-N 444.603 4.249 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](c3c(F)cccc3Cl)N3CCCCC3)C2)cc1 1461496119 OIELHJTVGADREB-UZUQRXQVSA-N 445.966 4.410 10 10 IICE CC[C@@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 1464701996 FZGLSLSZXYLXPF-DYESRHJHSA-N 433.593 4.110 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](NC(=O)CC)C1 1514790328 QYQJLWXXUPTTQH-FQEVSTJZSA-N 434.588 4.258 10 10 IICE COC(=O)[C@H](C)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1525189280 ZDHFLJDIQWPIHJ-GOSISDBHSA-N 433.552 4.323 10 10 IICE COC(=O)c1ccccc1-c1ccccc1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1532105664 NRFGJHPDUHSPKY-GOSISDBHSA-N 430.504 4.158 10 10 IICE Cc1cc(Cn2c(CC(C)C)nnc2N(C)Cc2ccccc2O)cc(N2CCCC2)n1 1542208800 JWFMFMRLHFZVBY-UHFFFAOYSA-N 434.588 4.171 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(OCC2CC2)c1 1543233144 FIFRXTWDRGQUOS-CALCHBBNSA-N 442.531 4.167 10 10 IICE CC[C@H](C)CN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1545635631 HFGFLAKRBLJTPI-SFHVURJKSA-N 449.578 4.252 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCN([C@@H](c2ccccc2)c2ccccc2Cl)CC1 1546216381 PSXOFZFDSOZOKO-VWLOTQADSA-N 436.939 4.228 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](C)[C@@H](OC)C2)sc(C)c1-c1ccccc1 1559757312 YJKOATAEXZARAP-YJBOKZPZSA-N 430.570 4.196 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC/C=C\CNC(=O)OC(C)(C)C)c2C)c1 1564856627 RPODFEPANQYRPR-FPLPWBNLSA-N 426.561 4.283 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC[C@@H](NC(=O)OC(C)(C)C)C(C)C 1564946949 ZBYQDSFWIBLWBW-GHTZIAJQSA-N 434.625 4.231 10 10 IICE Cc1cc(C(=O)Nc2cccnc2-n2cccn2)c(C)n1-c1ccc(Br)cn1 1595656516 ZZCVITBGQAQDGM-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CC[C@@H](C)[C@H]2C)cc1 1615381991 JLITZYGKKACQTK-WIYYLYMNSA-N 435.620 4.269 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@H]2CC[C@H]2C(=O)OC(C)(C)C)sc2c1COCC2 1617617227 LGIQXAMOLBSDIH-QWHCGFSZSA-N 437.558 4.083 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCCO[C@@H](CNC(=O)OC(C)(C)C)C2)c1C 1626015068 QEYHGKIYJRJDPO-FQEVSTJZSA-N 441.572 4.158 10 10 IICE CCC(CC)(C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)OC(C)(C)C 1630262838 QCIVGVQQYCOIFC-GOSISDBHSA-N 438.996 4.274 10 10 IICE Cc1cc(C(=O)NCC2(OCCO)CCC(F)(F)CC2)c(C)n1-c1ccc(Cl)cc1 1640763581 UPLRWYJBLDCGLQ-UHFFFAOYSA-N 440.918 4.434 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Cl)cc1NCC(F)(F)F 1641204283 QBVHJUKGFSERPS-UHFFFAOYSA-N 441.881 4.205 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCc1ccc(Br)s1 1643245190 LAOWHNQHNGSPPM-UHFFFAOYSA-N 440.359 4.131 10 10 IICE CCC[C@H](O)CCCS[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1644147596 PZOPFADIRLSRJZ-WBVHZDCISA-N 425.550 4.463 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@H]1C[C@H]1CN(C(=O)c2cc(O)cs2)c2ccccc21 1652447836 LTTMZOIVZJOUAE-JKSUJKDBSA-N 444.553 4.224 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(SC(F)(F)F)cc3)CC2)cc1 1652827711 HHBARDQAYALQLK-UHFFFAOYSA-N 426.460 4.035 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1 1682071635 NZFZCGOLFUHDOJ-WOJBJXKFSA-N 432.609 4.368 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 1683166001 INFKWVCVYFMSOS-TZIWHRDSSA-N 427.976 4.437 10 10 IICE C[C@@H](c1cc2ccccc2o1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686724226 OWLTZVFWDRSARK-HNNXBMFYSA-N 429.467 4.450 10 10 IICE CCc1nnc(N2CCO[C@](C)(c3ccccc3)C2)n1CCCSc1nccs1 1694756789 UJECIPFVSNYTBY-NRFANRHFSA-N 429.615 4.231 10 10 IICE CO[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC[C@@H]1C 1712065604 CQLLAPVVQRDAAH-GHTZIAJQSA-N 443.661 4.038 10 10 IICE CC[C@@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1744970273 ZZHVXIXEOVUJEZ-HXUWFJFHSA-N 431.675 4.335 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(=O)OC)C1 1745077208 YOAIZCJZSQAHRL-GFWYJJLOSA-N 433.556 4.318 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCCC3)C(=O)N(C[C@H]3CCCO3)C2=O)cc1 1873165687 PMZPCNFVQVIHMM-HSZRJFAPSA-N 447.579 4.275 10 10 IICE Cc1ccc(C)c(N2C[C@@H](C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2=O)c1 1874179216 UHMGSHGPIRKPPK-KRWDZBQOSA-N 438.483 4.070 10 10 IICE C[C@@H](NC(CCNC(=O)OC(C)(C)C)CCNC(=O)OC(C)(C)C)c1ccccc1O 2025360285 PADFEUCQSOWHSG-MRXNPFEDSA-N 437.581 4.241 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cccc(Br)c2O)[nH]1 2082942347 PXSATFKIKCAKPT-JTQLQIEISA-N 428.352 4.231 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@@H](N(C)C(=O)OC(C)(C)C)CC2)c1O 2236048195 AANHBQVAHQOJKD-OKILXGFUSA-N 443.382 4.431 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)c1O 2236054165 FLHORVQKSWGJFJ-CYBMUJFWSA-N 443.382 4.289 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@H](CCNC(=O)OC(C)(C)C)C2)c1O 2236056176 UOPSYWCOXLEHJG-ZIAGYGMSSA-N 443.382 4.336 10 10 IICE CCC1=NN2C(=N)C(=Cc3ccc(OCCOc4ccccc4C)cc3)C(=O)N=C2S1 2293692920 PLPZVLWDSMRPQS-UHFFFAOYSA-N 434.521 4.482 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1ccccc1OC(F)(F)F 2313682885 MXYBFVPYXZTBLO-UHFFFAOYSA-N 433.386 4.237 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2314722653 NKNLWBFKVIEDAS-UHFFFAOYSA-N 433.352 4.304 10 10 IICE CCC[C@@H](CNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380760564 YQFBPCMCHFVJTF-AWEZNQCLSA-N 443.382 4.363 10 10 IICE O=C1N=C(O)/C(=C\c2c[nH]c3ccc(Br)cc23)C(=O)N1Cc1cccs1 1161114 NWODJNUEGYODNT-MKMNVTDBSA-N 430.283 4.494 10 10 IICE Cc1cccc(C)c1-n1c(SCC(=O)c2ccc(O)c(O)c2)nc2ccccc2c1=O 23646134 IQFXCJUHQOYZTJ-UHFFFAOYSA-N 432.501 4.389 10 10 IICE COc1ccc(/C=C2/C(=O)N(c3ccc(Cl)c(Cl)c3)C(=O)N=C2O)cc1C(=O)O 33449161 IPDGYHMKMOICBK-KPKJPENVSA-N 435.219 4.207 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@H](C)c3ccccc3)C2=O)c(C(=O)O)c1OC 210824245 MXHCUPKQUMRYQM-COOUDCDJSA-N 429.519 4.364 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(F)c3)[C@@H]2c2ccc(O)c(O)c2)c1OC 526150438 BCHALAWVVOYERH-OAQYLSRUSA-N 437.423 4.311 10 10 IICE C[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1nnc2n1CCCCC2 729615491 KDHHQGWDFKNOHD-GOSISDBHSA-N 436.560 4.137 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 731479855 YVZLTHMGQALPSP-LHOVZLELSA-N 430.888 4.384 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@H](NC(=O)c3ccc4ccccc4c3)C2)cc1 755865114 BJUZHDNOYKGBJN-QHCPKHFHSA-N 430.552 4.010 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2CCC(F)(F)CC2)NC(=O)OC(C)(C)C)cc1 759188192 YGTDMXWMJAQZSG-GOSISDBHSA-N 425.520 4.260 10 10 IICE C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 776173364 RYWRBWNVQIWPAS-LAUBAEHRSA-N 438.538 4.091 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N[C@@H]3CCCc4ccccc43)ccc21 1125198163 RDFNWTUDOSJLLL-HSZRJFAPSA-N 434.536 4.255 10 10 IICE CC(C)(C)OC(=O)[C@@H]1CC[C@H](C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 1126583787 UGWUYDZELOJHND-BBWFWOEESA-N 438.515 4.131 10 10 IICE COc1ccc([C@@H]2[C@@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CCC(=O)N2C)cc1 1132267857 PIUKULANNAUEEL-AZGAKELHSA-N 445.563 4.329 10 10 IICE COCCN(C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccc(OC)c(OC)c1 1147179246 ZGYZDFDAERMBPP-UHFFFAOYSA-N 436.508 4.217 10 10 IICE C[C@H](NC(=O)c1cc(Br)ccc1I)c1ccccc1O 1151892090 INPBBIWKEJSDDY-VIFPVBQESA-N 446.082 4.250 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](c1ccc(F)c(F)c1)c1nccn1C 1251503973 AVAOIYAKKKJHEA-QFIPXVFZSA-N 441.526 4.474 10 10 IICE CCOCc1nnc(N2CCS[C@@H](CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1297344333 MENONCROXIITGX-QFIPXVFZSA-N 443.661 4.431 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cccc2c(Br)cccc12 1301354258 XUDKDPHJTDACRE-UHFFFAOYSA-N 439.353 4.493 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@H](C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1304195870 HTRAGFDBPHOLGN-BGYRXZFFSA-N 437.588 4.129 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccoc1C 1304237851 FFGUHUIIZBBTAR-UHFFFAOYSA-N 430.556 4.224 10 10 IICE CC(=O)N1CCN(c2ccc(NCc3cc(Cl)cc(Br)c3O)cc2)CC1 1308498457 XLMHAADDGIXSJQ-UHFFFAOYSA-N 438.753 4.089 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1COCCO1 1313625734 BPANUXHKUWDQQN-JOCHJYFZSA-N 437.588 4.250 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(SC)c3)C2)sc2c1CCCC2 1351742549 FRVCARCGIQLONO-CYBMUJFWSA-N 444.578 4.127 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCc1ccccc1Cl 1358161753 UTJDGKQKTUPCNP-QGOAFFKASA-N 448.972 4.429 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CCCCN3C(=O)OC(C)(C)C)ccc21 1434929444 YBCDEYPDABTTIN-FQEVSTJZSA-N 443.588 4.424 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Oc1ccccc1 1435184236 JOWINGGAMKGVCH-JPVKTXQWSA-N 444.553 4.001 10 10 IICE O=C(Cc1cc(Cl)cc(Cl)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1435574680 XIZIMAGKJXVTKJ-UHFFFAOYSA-N 432.395 4.384 10 10 IICE CCCCN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccn1 1438172701 YDNDPFGOQPBDMG-UHFFFAOYSA-N 429.432 4.212 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCCOc3cccc4ccccc34)cc2)CC1 1439331437 RDQMLWOJDUNGPT-UHFFFAOYSA-N 445.563 4.017 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](Oc3ccccc3)C(C)(C)O)cc2Cl)C1 1448445368 ANOPKGKFHHZMOD-HTAPYJJXSA-N 430.976 4.411 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccco3)c3ccc(C)c(C)c3)CC2)cc1 1459721003 CIOJPDWTNHVXSM-VWLOTQADSA-N 449.595 4.095 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 1465446544 KDMPXYSOGFRGPN-UHFFFAOYSA-N 447.491 4.498 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CCCOc2cc(Cl)ccc21 1469542259 HRGRUDMFYKPUHB-NRFANRHFSA-N 429.948 4.014 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCC3(CCCC3)O2)c(C)n1-c1ccc(Br)cn1 1469668095 IOPORUMEFITLCN-QGZVFWFLSA-N 432.362 4.473 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cn(-c3ccccc3)nc2-c2cccnc2)cc1 1469806443 RGHGRACHOVTCSD-UHFFFAOYSA-N 441.535 4.151 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](C(N)=O)[C@H](C)c3ccccc3)cc2Cl)C1 1469960136 OLXJNVQQICVHAO-YVHKJVDXSA-N 442.991 4.033 10 10 IICE Cc1ccc(C(=O)N[C@H]2CC[C@H](c3nccc(O)n3)CC2)cc1-n1c(C)cc(C=O)c1C 1472289023 PALLIWDYSRYNQM-XGAFWQRZSA-N 432.524 4.167 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cccn4C)n3CCCC(C)C)CC2)cc1 1504292975 WMWKROFGTYIRCP-UHFFFAOYSA-N 436.604 4.445 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C)C(C)C 1517811155 CIMLQWNMYPQVKO-XXBNENTESA-N 437.588 4.249 10 10 IICE COc1cc(N2CCN(C(=O)[C@](C)(Cc3ccccc3)C(C)C)CC2)cc(OC)c1OC 1521836440 GNAFDPRSEHZJSJ-AREMUKBSSA-N 440.584 4.266 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(C)c1I 1525762767 UGBXQIBHMSSJIY-HNNXBMFYSA-N 436.337 4.335 10 10 IICE COc1ccc(N2CCCN(C(=O)CCc3cccc(F)c3Br)CC2)cc1 1526237873 ULOYKSYGWWOJOC-UHFFFAOYSA-N 435.337 4.268 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(CN2CCCCC2)o1 1533330489 XXCWYUKVJUGLQZ-KRWDZBQOSA-N 433.499 4.266 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)cc1 1547443888 GBYRNPPRTAYFBN-RLSLOFABSA-N 441.620 4.069 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(C)=O 1547533356 LSPWWNRAACIBKE-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CN(C)c1ccc(Cn2c(N3CCN(CCC(C)(C)C)CC3)nnc2C(C)(C)C)cc1F 1552838591 YDHLGDHEAPHOHW-UHFFFAOYSA-N 444.643 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 1557063147 GPUWBLBHXCMICB-FQEVSTJZSA-N 445.563 4.331 10 10 IICE COC(=O)[C@@H](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)C1CCCCCC1 1558482464 DGZMATHIHFNDTG-QFIPXVFZSA-N 440.584 4.405 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2n[nH]c(C)c2Br)cc1 1565656224 SZIYNRGFMBOFSS-UHFFFAOYSA-N 443.345 4.402 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)n[nH]2)cc1 1566154548 CGRFNSWHQFIUCB-INIZCTEOSA-N 442.466 4.086 10 10 IICE COCCO[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1568055857 LHOTUTJICRRSSA-LJQANCHMSA-N 435.362 4.124 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(NC(=O)OC(C)(C)C)c(C)c1 1570514723 MPFCZXNLZMTRFY-UHFFFAOYSA-N 442.512 4.253 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1Br 1585536089 PTLYOGQVBJITLX-UHFFFAOYSA-N 431.374 4.004 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOc1ccc(Cl)cc1Cl 1597567332 KDRLUDHCUQQMHM-UHFFFAOYSA-N 446.714 4.323 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1 1613075588 XUVIHMIHUWUQDO-BWKNWUBXSA-N 437.588 4.129 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1ccc(C)nc1 1613295605 KVAMYKMMWLQJLP-LJQANCHMSA-N 434.588 4.269 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CC3CCOCC3)CC2)cc1 1619301455 LJMIXIIJVJYHQY-UHFFFAOYSA-N 441.620 4.019 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H](OC)C(C)(C)C)CC2)cc1 1619301692 VCFJTFIEPQYHQL-OAQYLSRUSA-N 443.636 4.362 10 10 IICE COc1ccc(OC)c(CN(CCO)C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)c1 1624290396 AJYOTGJKTJXXGX-UHFFFAOYSA-N 442.943 4.399 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc(S(=O)(=O)NC4CC4)c3)c2C)c1 1629111711 WYASHUGDZBCKJV-UHFFFAOYSA-N 437.565 4.404 10 10 IICE CC(C)(C)OC(=O)c1ccccc1CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1631219190 OUWGBHFUCQBYJK-HXUWFJFHSA-N 425.525 4.098 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)c2c1 1631608336 TYHKNWLDLLCMOF-IBGZPJMESA-N 437.515 4.275 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3cccc(Br)c3)C2)c(C)n1-c1ccccn1 1634081091 CHUSHXZCQWCLIX-SFHVURJKSA-N 439.357 4.260 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H](C)N3CSCCSC3)cc2Cl)C1 1635126502 MFNCZZBQCLARNP-HOTGVXAUSA-N 428.067 4.278 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@](C)(COCc3ccccc3)OC)c2C)cc1 1640171003 FFCJTLMDIQQBQY-SANMLTNESA-N 436.552 4.454 10 10 IICE Cc1cc(Br)cc(C)c1N1CCC[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 1651005847 OGCUIQJJIRFPPL-AWEZNQCLSA-N 437.309 4.015 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)[C@H](C)C(=O)OCC)sc(C)c1-c1ccccc1 1653194179 HWHXQTYITVHXMG-GJZGRUSLSA-N 446.569 4.016 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3nc(C)c4cc([N+](=O)[O-])ccc43)c2C)cc1 1656378687 URSADJAUNLTISG-UHFFFAOYSA-N 446.463 4.330 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(C)n1-c1ccccc1 1674922563 BKEQPPJSCMENCQ-IBGZPJMESA-N 440.588 4.287 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3ccc(F)c(Cl)c3)C3CC3)CC2)c(OC)c1 1682460330 HRIHBODALBEPPR-QFIPXVFZSA-N 447.938 4.479 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4O)CC3)cc2Cl)C1 1686269718 XASDLEVMPIGEOA-SFHVURJKSA-N 442.991 4.314 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)[C@@H](C)c3ccco3)n2Cc2ccc(N(C)C)cc2C)n1 1693410232 PBJIHGUKTCVLSI-FQEVSTJZSA-N 447.587 4.353 10 10 IICE Cc1nnc(N2CCC[C@H](c3noc(C(C)C)n3)C2)n1CCCSc1nccs1 1693494904 KHZADAZDWZLFBY-HNNXBMFYSA-N 433.607 4.116 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1727815159 GBIWEWIDKWCBFW-UNWVZKJWSA-N 441.620 4.070 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)CC[C@H]1C 1728258768 XTMUAKKMWRYVAU-RTBURBONSA-N 448.615 4.456 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1728383042 RCNQVCKRFLJUCS-UGKGYDQZSA-N 441.620 4.418 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743803102 LJEGSKMQNIZUKV-ROUUACIJSA-N 431.675 4.335 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3cscn3)n2Cc2ccc(N(C)C)c(F)c2)o1 1761740016 CARFZGDCNKQFMS-UHFFFAOYSA-N 426.521 4.193 10 10 IICE CCc1nnc(N(Cc2ccco2)C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764752291 FVNBWLKWDLYRMO-UHFFFAOYSA-N 437.588 4.106 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CC[C@H](C(C)(C)C)C2)cc1F 1768496225 CVYXVDHLABOAAL-IBGZPJMESA-N 436.579 4.390 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCSCC(C)C)CC2)cc1F 1768704568 JSAAZZIVWUFSSY-UHFFFAOYSA-N 435.613 4.265 10 10 IICE CCN(CC)c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc(Cc2ccccc2)n1 1867945893 CCEOUOZAQHEUHO-UHFFFAOYSA-N 431.584 4.249 10 10 IICE Cc1cc(O)c([C@@H](n2nc(C)c(C(=O)O)c2I)C(C)(C)C)cc1C 2079935126 WCCOENSZIYCBFM-OAHLLOKOSA-N 442.297 4.452 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@H]2CNCc1cc(Cl)cc(Br)c1O 2082897965 JWCRJHKMXDQYQT-KYOSRNDESA-N 431.758 4.153 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@@H](NCc1c(O)cccc1Cl)CO2 2160179990 GBRMFXPEPBJQND-GOSISDBHSA-N 430.932 4.096 10 10 IICE COc1ccc(Br)c(CNC[C@@]23CC[C@@H]2CN(Cc2ccccc2)C3)c1O 2236054007 CWRQIKYJDXYYAZ-VGOFRKELSA-N 431.374 4.165 10 10 IICE Oc1cc2c(cc1CNc1ccc(Br)cc1I)OCO2 2240326989 DZCIYIUGYQUNEO-UHFFFAOYSA-N 448.054 4.100 10 10 IICE CCC[C@@H](NC(=O)c1cccc(N2C(=O)C(=Cc3ccccc3)SC2=S)c1)C(=O)O 2297580234 HPUAGKJYLMMMQK-QGZVFWFLSA-N 440.546 4.076 10 10 IICE Cc1cc(/C=C2\SC(=O)N(CC(=O)OC(C)C)C2=O)c(C)n1-c1ccc(N(C)C)cc1 1006049 KLTIEFBWOBEBKF-NDENLUEZSA-N 441.553 4.148 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccccc3OC)SC2=S)cc1 15047463 RZZZXNNEWGAARH-RMENWYJGSA-N 442.562 4.322 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccccn2)SC1=S)c1ccc(OCc2ccccc2)cc1 27533737 OZCXTBFHYOSLPW-XSFVSMFZSA-N 447.541 4.207 10 10 IICE COc1ccc(-n2cccc2/C=C2\C(=N)N3N=C(C(C)C)SC3=NC2=O)cc1Cl 32964375 BCYHKQOBKNOYKT-BQLOJNAPSA-N 427.917 4.414 10 10 IICE Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C)C3=O)c(N[C@@H](C)c3ccccc3)nc12 33721259 ZMLFJDIBEMEMGQ-IQGJIOQQSA-N 436.562 4.007 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccccc3F)C(=S)N=C2O)c(C)n1C[C@@H]1CCCO1 59109286 AGUWVFOZAQIISY-FDIDWWNZSA-N 427.501 4.095 10 10 IICE O=[N+]([O-])c1c(NCCN2CCOCC2)ncnc1Nc1ccc(N=Nc2ccccc2)cc1 256017977 WRNQXDNKNLETRE-UHFFFAOYSA-N 448.487 4.288 10 10 IICE C[C@H](NC(=O)N1CCC(N2c3ccccc3C[C@@H]2C)CC1)c1ccc(N2CCOCC2)cc1 728747858 VFSALWYVIJHWMK-SFTDATJTSA-N 448.611 4.209 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](c1nnc2ccccn12)C(C)C 745796053 OCYBQIDZPBIGTH-SFHVURJKSA-N 446.349 4.126 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCO[C@@H]1c1c(C)nn(-c2ccccc2)c1C 753101796 JKGRTNMEROYRLS-ZCYQVOJMSA-N 432.568 4.258 10 10 IICE O=S(=O)(Nc1nc(-c2cc(F)ccc2F)cs1)c1ccccc1Cn1ccnc1 759476160 JICGTXPTBHCTFY-UHFFFAOYSA-N 432.477 4.134 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H](c1cccc(F)c1F)C(F)(F)F 776018154 APPBHIAWWXUSDE-GOSISDBHSA-N 447.379 4.043 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)c1 782081735 KAHKWMWMBQVZQK-GFCCVEGCSA-N 437.418 4.125 10 10 IICE Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)NCc1cc(Br)ccc1O 804737467 RYQIBDIBVFZYGS-UHFFFAOYSA-N 434.721 4.291 10 10 IICE CN(C)c1ccc(CNS(=O)(=O)c2ccc(Br)cc2C(F)(F)F)cc1 917860651 YWMGYXIGAWYDFZ-UHFFFAOYSA-N 437.281 4.012 10 10 IICE CCc1ccc(S(=O)(=O)Nc2nc(-c3ccc(CCCNC(C)=O)cc3)cs2)s1 917872994 SZYVFZXZHSMDRH-UHFFFAOYSA-N 449.623 4.304 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3ccnn3C3CCCCC3)cc2F)C[C@@H](C)O1 918220748 LSACNXGZKPHYBE-CALCHBBNSA-N 429.540 4.463 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 1124621367 GYPILKXPTNIZLY-OAQYLSRUSA-N 439.987 4.451 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cc(F)ccc1F 1126038711 HVMLXGMRWDGBIR-RQZCQDPDSA-N 436.480 4.012 10 10 IICE COC(=O)CN(Cc1csc(CCc2ccccc2)n1)Cc1cc(Cl)ccc1O 1191681594 DXYIKHQMMCCTKL-UHFFFAOYSA-N 430.957 4.463 10 10 IICE Cc1cc(CNC(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)c(C)n1-c1ccccc1 1234325150 ANAMDNGIXHENLT-UHFFFAOYSA-N 448.542 4.337 10 10 IICE Cc1ccc(C)c([C@@H]2CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1251103231 CEHAKGGRQWJTTP-DEOSSOPVSA-N 434.584 4.052 10 10 IICE Cc1cc(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1292056432 HLVGPAFTDGOYFN-LSDHHAIUSA-N 433.394 4.102 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2COc3ccc(Cl)cc3C2)cc1 1292381718 HSGAGZPDUCGMSU-SIKLNZKXSA-N 428.960 4.165 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)c1C 1293827949 SPXWZTCXPAZNLF-NRFANRHFSA-N 430.596 4.343 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cc(C)ccc1C 1307535755 QANGFUOLJJPNRE-PMACEKPBSA-N 427.564 4.199 10 10 IICE CC[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1312994931 PZNUATAPCVFYSI-MOPGFXCFSA-N 446.389 4.357 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1 1313679296 QWLDWJVGAYZVTD-QFIPXVFZSA-N 425.621 4.376 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](OCC)[C@@H]2CCOC2)sc(C)c1-c1ccc(F)cc1 1352684893 ZLRTWUIAVOPVJY-DNVCBOLYSA-N 435.517 4.419 10 10 IICE COC(=O)c1cc(Cl)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1354650714 NYXOOCWHERWXHR-UHFFFAOYSA-N 439.943 4.487 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)c(F)c1 1360458584 LKMKRIUKENWQHE-QGZVFWFLSA-N 434.519 4.308 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cccc2[nH]ccc12 1438773971 AEEGCCZSBAMFQE-UNOMPAQXSA-N 439.537 4.215 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C[C@H](NC(=O)OC(C)(C)C)C(F)F 1440685036 QZBJGLPBZLFMBE-SFHVURJKSA-N 425.520 4.184 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)NCc1cccc(OC)c1O)NC(=O)OC(C)(C)C 1445966722 IWLSCXRCOYDHSZ-GOSISDBHSA-N 444.528 4.072 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1456078305 VZODYCRURJHTFS-UHFFFAOYSA-N 437.468 4.317 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(O[C@H](C)C(=O)OC)c(F)c3)ccc21 1461639629 QZBOTQJGFPKTIC-MRXNPFEDSA-N 442.487 4.236 10 10 IICE COc1ccc(C(=O)CNC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)cc1[N+](=O)[O-] 1471039982 NTGLJLIXXZLICR-UHFFFAOYSA-N 441.871 4.277 10 10 IICE CCC1CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)cc2C)CC1 1499615892 IIKYLHXYUJXOIB-UHFFFAOYSA-N 435.620 4.189 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1 1505051257 BDAFHPVOPMXLML-IBGZPJMESA-N 437.588 4.252 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCS[C@@H](C(C)C)C1 1510683993 VXDLLWSWPDQZHT-NHCUHLMSSA-N 429.634 4.130 10 10 IICE CC1CCN(CCCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CC1 1512345898 JTAQDQMSDNOWRH-UHFFFAOYSA-N 439.629 4.394 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)CSCc3ccccc3)cc2F)CC1 1530376723 MSOBFLWXCSYASX-LJQANCHMSA-N 429.605 4.153 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)cc2Cl)C1 1530426828 WETCEKSVNJUWFA-CYBMUJFWSA-N 431.876 4.143 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cc1 1540399930 CEAUUTOHGJEREX-UHFFFAOYSA-N 449.982 4.447 10 10 IICE Cc1nc([C@H]2CCCN(c3nnc(C)n3Cc3ccc(N(C)C)c(F)c3)C2)sc1C 1542046426 AQQKFIUXHFMSFW-SFHVURJKSA-N 428.581 4.297 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCOc2cccc(F)c2)NC(=O)OC(C)(C)C)cc1 1544268428 LPURQFSALULZAV-OAQYLSRUSA-N 445.535 4.043 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)c1 1544871369 YIHIMMPVDWCDGF-QFIPXVFZSA-N 439.556 4.378 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CC(=O)c2ccccc21 1546230044 HPHJIXDGXLMJQR-GYXHFJGISA-N 442.587 4.173 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 1558174059 CTRCUNQHQZCPDV-UHFFFAOYSA-N 441.281 4.043 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(Br)c(F)ccc3[nH]2)N(C)C)cc1 1558722808 CPBNXVSHEZMXJF-LJQANCHMSA-N 447.352 4.168 10 10 IICE Cc1cc(C(=O)CSc2nnc(-c3cccnc3)n2C)c(C)n1-c1ccc(Cl)cn1 1559334495 LJYCUQSJRJULRR-UHFFFAOYSA-N 438.944 4.308 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Cn2c(-c3ccc([N+](=O)[O-])cc3)noc2=O)c1C 1559366328 RRKDWEBRORHCTH-UHFFFAOYSA-N 432.436 4.010 10 10 IICE COC(=O)[C@H](c1cc(OC)ccc1Br)N(C)Cc1ccc(N(C)C)c(C)c1 1559853849 LEHMWTVZYZKROO-FQEVSTJZSA-N 435.362 4.178 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC[C@@H](C3CC3)N2C(=O)OC(C)(C)C)cc1F 1565688490 ZEFRDFIWZSNEMB-FPOVZHCZSA-N 433.568 4.466 10 10 IICE CC[C@@](C)(CCCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C1OCCO1 1566094806 PRIJOFMRNCMDEK-SANMLTNESA-N 441.616 4.093 10 10 IICE CCOc1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)ccc1C 1568959540 RFNSHQWRYLYYQS-UHFFFAOYSA-N 432.523 4.214 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)/C=C/c1ccc(I)o1 1584095982 RXQGLDMEFIVJMM-QSYFUGGGSA-N 438.309 4.019 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1c(Cl)cccc1Cl 1584506642 DZEZFWVYWWFOTL-CQSZACIVSA-N 434.367 4.115 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1coc(-c2ccnc(C)c2)n1 1618427589 VVBKWZHPVGEHFG-UHFFFAOYSA-N 436.512 4.047 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(-n2nc(C)c(Br)c2C)cc1 1623574652 VYQGZEKLZTWAOM-UHFFFAOYSA-N 449.345 4.373 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]2C)c(C)n1-c1ccccc1 1624064401 FMVJPEJGOYMKBW-OALUTQOASA-N 425.573 4.493 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(Br)cc2F)cc1 1626106630 QAVWLGGIBYNOFP-HXUWFJFHSA-N 449.364 4.405 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1(C(=O)OC(C)(C)C)CCSCC1 1628873577 DZYUZMYSXZAVPD-UHFFFAOYSA-N 432.630 4.490 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1630698070 JOWHAHPJCQQULP-LJQANCHMSA-N 437.531 4.185 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(n2)CCCC3)c(C)n1-c1ccc(Br)cn1 1634183434 XWTYTXPNOBZUGG-UHFFFAOYSA-N 439.357 4.455 10 10 IICE CCS(=O)(=O)c1ccc([C@H](C)NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1635150594 VIHLVEDONOPXME-KRWDZBQOSA-N 438.549 4.191 10 10 IICE COc1ccc(N(C)CCN(C)C[C@@](C)(O)c2ccc(Br)cc2Cl)cc1 1643684328 FYXVSQQHYUKXKP-HXUWFJFHSA-N 441.797 4.387 10 10 IICE COC(=O)c1c(NC(=O)CN2CCCCc3cc(OC)ccc32)sc2c1CC[C@@H](C)C2 1644968795 HMDTVRVSXDZBHD-OAHLLOKOSA-N 442.581 4.450 10 10 IICE C[C@@H]1N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c2ccccc2C1(C)C 1647754719 NTRPBGMVFXJTDW-QRVBRYPASA-N 439.575 4.242 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](c2nccc(C(F)(F)F)n2)C1 1648027576 DZOHUEIWDUVCPF-MRXNPFEDSA-N 442.441 4.345 10 10 IICE Cc1cc(C(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c(C)n1-c1cccc(F)c1 1652735654 KHJYHLLFVJPVSK-HUUCEWRRSA-N 425.504 4.163 10 10 IICE CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)NCc1cccc(Cl)c1O 1681018440 GUCJLIUPDYHVTB-GTNSWQLSSA-N 427.726 4.384 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)CCOc3ccccc3C(C)(C)C)C2)cc1 1682645579 HGJDHPVFPVDDRB-IBGZPJMESA-N 425.573 4.292 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(CCNC(=O)OC(C)(C)C)CC1 1683424631 GTJWWKZOEUESJR-LJQANCHMSA-N 446.636 4.328 10 10 IICE C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1684168845 GQEBBULUSUHMTK-DVECYGJZSA-N 434.584 4.071 10 10 IICE CCc1noc([C@H]2CC[C@H](NC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)n1 1684438041 ZRTWVVRYCMRKKC-OALUTQOASA-N 437.544 4.339 10 10 IICE O=C(NCc1cc(C(F)(F)F)cc(Cl)n1)N(Cc1ccccc1O)C[C@H]1CCCO1 1687505007 WONISJRIECNFPR-MRXNPFEDSA-N 443.853 4.350 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)CCc1nccs1 1693005948 NRUADFJHCBPQOY-HXUWFJFHSA-N 440.617 4.078 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(CC2CCCC2)n1Cc1ccc(N(C)C)cc1C 1695697211 JPINRHSUQRCJLB-UHFFFAOYSA-N 435.620 4.194 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3Cc3occc3C)CC2)cc1F 1730180059 JUQNITUXYWPCHE-UHFFFAOYSA-N 441.551 4.291 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC[C@@H](OCC3CC3)C2)nnc1C(C)(C)C 1742142037 RIPZYGNQUWOHBK-JOCHJYFZSA-N 425.621 4.394 10 10 IICE CC[C@@H](Cn1c([C@@H](C)CC)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1744114588 LUIWIFVPRZEQQH-WMZOPIPTSA-N 431.581 4.437 10 10 IICE CC(C)c1nnc(N(C)CCOC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1750615574 MZIBJQMGQQYESK-UHFFFAOYSA-N 431.650 4.254 10 10 IICE CC[C@@H](C)c1nnc(N2CCCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763706256 HPPLFUSOLHHEHW-HXUWFJFHSA-N 425.621 4.429 10 10 IICE CCC[C@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1765582504 YDFQHXRJOKZTPQ-FGZHOGPDSA-N 427.593 4.181 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCCO1 1769713193 IDFGMSRWULLACK-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCN1C(=O)C(Nc2ccc3c(c2)OCCO3)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422913 VVAODRBOYKPHMZ-UHFFFAOYSA-N 443.503 4.077 10 10 IICE COc1ccc(O)c(Cn2nc(C3(C)CC3)c(C(C)C)c2I)c1 2079747507 SZHYPMRECPJLTB-UHFFFAOYSA-N 426.298 4.425 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)ccc2O)C(F)(F)CC1 2093435692 DETBKFMUACOMPK-OAHLLOKOSA-N 435.309 4.279 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CC3(CC3)CN2C(=O)OC(C)(C)C)c1O 2236055916 SLYTVUQWSUECSZ-CYBMUJFWSA-N 441.366 4.043 10 10 IICE COc1cc(C=C2SC(=S)NC2=O)cc(Cl)c1OCc1ccccc1[N+](=O)[O-] 2297356976 XFJOKBSWCRHWQS-UHFFFAOYSA-N 436.898 4.325 10 10 IICE Cc1cc(C=C2C(=O)N(C)C(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc([N+](=O)[O-])c1 2313560542 XESUFSJOWMGICT-UHFFFAOYSA-N 444.447 4.011 10 10 IICE CCCCCOC(=O)CN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S 33413763 WOESNNSKQOLSAY-GXDHUFHOSA-N 428.373 4.384 10 10 IICE CCCCOC(=O)CN1C(=O)/C(=C/c2ccc(OCCCC)c(OC)c2)SC1=S 40888436 RMKPOXCFBXWMIK-AQTBWJFISA-N 437.583 4.419 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCNC(=O)/C=C/c3ccc(C)cc3)C2=O)c1 62060400 QOZSLGWRSFHUHN-KADIPVPISA-N 438.574 4.034 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1 96956691 XNPLJGJJEYJZLI-UHFFFAOYSA-N 449.555 4.274 10 10 IICE CC(C)n1ncc2c(C(=O)Nc3ccnn3Cc3ccc(N(C)C)cc3)cc(C3CC3)nc21 98080466 HPWLETNSTQRBCU-UHFFFAOYSA-N 443.555 4.453 10 10 IICE Cc1cc(NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)n(C2CCN(C)CC2)n1 751009350 ATPPPXKWJIBEKM-UHFFFAOYSA-N 434.588 4.230 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc3c(c2)OCO3)nc1-c1c(F)cc(F)cc1F 778078145 AFJYPLVPHHQPMO-UHFFFAOYSA-N 428.413 4.065 10 10 IICE Cc1csc(C2(N[C@@H](C)C(=O)Nc3ccc4c(c3)C(=O)c3ccccc3C4=O)CCC2)n1 778128074 NIYVTENRPBUHET-HNNXBMFYSA-N 445.544 4.223 10 10 IICE COCCNC(=O)c1cccc(N[C@@H](C)c2cc(Br)cc(Cl)c2O)c1 797035880 APCYTMSULDYZLI-NSHDSACASA-N 427.726 4.357 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1cc(Br)ccc1O)c1cccs1 804736617 WAEIKFBMLJENIZ-UHFFFAOYSA-N 431.311 4.399 10 10 IICE O=C(COc1ccccc1C(F)(F)F)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657059 DIMQOAXKANUYEN-AWEZNQCLSA-N 444.400 4.471 10 10 IICE COC(=O)c1c[nH]c(C(=O)OC)c1NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1269486299 KSGQADQCRLFHSM-UHFFFAOYSA-N 449.467 4.322 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4c(Br)c(F)ccc4[nH]3)CC2)cc1 1292593563 HARHSKDTZGKDCY-UHFFFAOYSA-N 446.320 4.477 10 10 IICE CCOC[C@@H]1CCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1297416821 YCIUHXLMQIRJKU-FYYLOGMGSA-N 441.620 4.277 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2CCCC2)n1CCC(C)(F)F 1298315235 QZQZKGBBDKWAHG-UHFFFAOYSA-N 433.547 4.454 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](CO)c2ccc(Br)c(F)c2)cc1 1298595262 QDVRMAJISVBJAF-FQEVSTJZSA-N 431.305 4.459 10 10 IICE COC(=O)[C@H](NCc1cc(Cl)cc(C(C)=O)c1O)c1ccccc1OC(F)(F)F 1308081862 BEPAYRSVRIUVPW-MRXNPFEDSA-N 431.794 4.151 10 10 IICE COc1ccc([C@@H]2CCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1F 1313417035 QHCIAGYDQPKUHR-VXKWHMMOSA-N 428.552 4.050 10 10 IICE C[C@H](Cc1ccsc1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1357156277 BZEGHRZQIBDZKT-GPLLRDDGSA-N 434.583 4.226 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cccc(OC)c1 1358433070 IZVATJYKUJDGLI-CPNJWEJPSA-N 444.553 4.479 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)C[C@@H]3C)n2CCC(C)C)c(C)n1-c1ccccc1 1361048938 NQDFEDGMQZTGRK-IBGZPJMESA-N 434.588 4.066 10 10 IICE Cc1nc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)sc1Br 1464692163 FVEZODRVGJLAPL-UHFFFAOYSA-N 446.317 4.214 10 10 IICE CCO/C=C/[C@](O)(CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468481146 LUGAODOGKDEENJ-YXBWYFRISA-N 430.854 4.321 10 10 IICE CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1469852959 CYNLXHJLTDXYMD-PIBDYAPNSA-N 437.632 4.459 10 10 IICE Cc1cc(C(=O)N[C@H]2CON(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(C(C)C)cc1 1472208202 MLDGAXBVYUATAP-LJQANCHMSA-N 427.545 4.498 10 10 IICE C[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C[C@@H](C)S1 1494328120 LOCWJDHGZFCYDV-XHSDSOJGSA-N 439.676 4.489 10 10 IICE CCOCc1nnc(N2C[C@@H](C)[C@H](C(F)(F)F)C2)n1CCCSc1nccs1 1503132613 RRMBQOQRLWUNHN-CHWSQXEVSA-N 435.541 4.088 10 10 IICE CC[C@H]1CCN(c2nnc(C(=O)Nc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1514085007 NTRIGGWYLWKUAN-IBGZPJMESA-N 447.587 4.056 10 10 IICE CN(CCOCC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1517346742 XEBYMEBCVMUFTJ-UHFFFAOYSA-N 443.661 4.040 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1C(F)F 1526003386 OPDUGQQGYPSOIA-UHFFFAOYSA-N 444.457 4.024 10 10 IICE O=C(CCCCc1nc2ccccc2s1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261174 IOSWGVNBDQECTD-UHFFFAOYSA-N 445.535 4.440 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2cnc3ccccc3n2)C1 1535503741 XVHDMADKSNSKFS-SQVRQVGWSA-N 444.535 4.373 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccn1 1556931092 BLZOFVAFZQCTFD-SUCHYCSPSA-N 431.608 4.392 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1565797488 CSJYKWZTBFEWHS-QZTJIDSGSA-N 432.362 4.329 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)nc(Br)c1 1583569760 RPIPSCWZUIBTLI-UHFFFAOYSA-N 441.167 4.335 10 10 IICE CCc1c(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)nnn1-c1ccc(OC(C)C)cc1 1585264528 TUPLDBUPCKYGRO-IBGZPJMESA-N 449.599 4.352 10 10 IICE CCOc1ccccc1C(=O)N1CCN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 1596346112 FZYBCWASLLVYNG-UHFFFAOYSA-N 445.563 4.399 10 10 IICE C[C@]1(C(F)(F)F)CCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1597098520 CIONALUZSQGPTF-MDNBWPLSSA-N 446.491 4.218 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cccc2c1OCCN(C(=O)OC(C)(C)C)C2 1617046494 DBRYRTZWFGSRQY-UHFFFAOYSA-N 439.556 4.121 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)c2)CC1 1624595250 GFBMGXDRGBOYAS-UHFFFAOYSA-N 433.512 4.113 10 10 IICE CC(C)c1oc(-c2ccccc2)nc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1626090708 SMVLNAWTWZLYDQ-UHFFFAOYSA-N 446.551 4.097 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@H]2CCC[C@H](C(F)(F)F)O2)cc1 1627204650 DNIPPQOXPMAREC-HSALFYBXSA-N 428.495 4.150 10 10 IICE COc1ccc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1F 1628105116 NUMJOOKJQAJYSK-UHFFFAOYSA-N 446.320 4.372 10 10 IICE Cc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(F)c1F 1628496341 WNWOFYIUZJFSRK-SFHVURJKSA-N 433.499 4.335 10 10 IICE O=Cc1ccc(F)c(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1 1631526442 CHXJXQVQHAYOJN-UHFFFAOYSA-N 431.511 4.255 10 10 IICE COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1632958627 RJSLCNMRRPAEMO-UHFFFAOYSA-N 447.535 4.278 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)cc1C 1633759745 NRPWRICNLIPDBB-HSZRJFAPSA-N 445.519 4.147 10 10 IICE C[C@H]1C[C@H](CCNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC(C)(C)C1 1634872280 ZPYXFKYGZVQOSZ-ICSRJNTNSA-N 428.621 4.040 10 10 IICE C[C@H](NC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1)c1ccccc1O 1635799334 ZJBUBTQCWODIPK-INIZCTEOSA-N 431.521 4.004 10 10 IICE O=C(N[C@@H]1c2ccccc2CC[C@@H]1F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1636613336 OUHKWSQOVBTPNQ-FXAWDEMLSA-N 446.525 4.010 10 10 IICE O=C(CCCc1ccc2c(c1)OCCCO2)N(Cc1ccccc1O)C[C@@H]1CCCO1 1636951772 XTWNSVGQSYDJRV-NRFANRHFSA-N 425.525 4.084 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccn(Cc2ccccc2)c1C 1637247664 SECRSRLWRKZWGO-UHFFFAOYSA-N 426.900 4.019 10 10 IICE Cc1cccc(C[C@@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1 1638631187 HFUBQHGZQGDRDA-FQEVSTJZSA-N 441.369 4.498 10 10 IICE C[C@@H]1CCCN(c2ccc(CNc3ccc4nnc(Br)n4n3)cc2Cl)C1 1639841888 UYJPNUSDFODBPW-GFCCVEGCSA-N 435.757 4.389 10 10 IICE Cc1cc(C(=O)NC(c2nccn2C)c2nccn2C)c(C)n1-c1cccc(C(C)C)c1 1640734152 HCCPDVQGNPYXKZ-UHFFFAOYSA-N 430.556 4.204 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@@H](Oc1cccc(Br)c1)c1ccccc1 1643100888 NUNZYFBDQUAGQN-FQEVSTJZSA-N 428.282 4.297 10 10 IICE CCOC(=O)C[C@@H](SCC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C)C(=O)OCC 1652817009 ZCNBRZZWKWXJPF-OAQYLSRUSA-N 431.554 4.203 10 10 IICE Cc1cc(C(=O)Nc2ccnn2C2CCOCC2)c(C)n1-c1ccc(Br)cn1 1653425035 ULENWEVPQQZURR-UHFFFAOYSA-N 444.333 4.052 10 10 IICE COc1cc2c(cc1CNC(=O)NCCc1cc(C)n(-c3ccccc3)c1C)O[C@H](C)C2 1670734538 UAYIDNKVBOKIGX-GOSISDBHSA-N 433.552 4.468 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3ccc(F)cc3F)cc2Cl)C1 1680561660 CTYSCSXXDFXMER-VBKZILBWSA-N 437.918 4.387 10 10 IICE CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NCc1cccc(Cl)c1O 1681018439 GUCJLIUPDYHVTB-DIFFPNOSSA-N 427.726 4.384 10 10 IICE CCc1nnc(N2CCC(c3cnn(CC)c3)CC2)n1Cc1ccc(N(CC)CC)cc1 1694676177 WZUAQCHRABNYPM-UHFFFAOYSA-N 435.620 4.335 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1695621446 XOCGHJJHIITOCQ-RUZDIDTESA-N 434.588 4.240 10 10 IICE CCCN1CCC(N(C)c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)c(F)c2)CC1 1709773979 ORCFOAHFIZQBFZ-SFHVURJKSA-N 430.616 4.356 10 10 IICE CCOCc1nnc(N2CCO[C@H](c3ccccc3)C2)n1CCCSc1nccs1 1710750303 ZVZAGACGQDDAKS-SFHVURJKSA-N 445.614 4.031 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)CC2CC(F)C2)cc1 1746094543 ZYVRUDQJPRCDGT-UHFFFAOYSA-N 436.579 4.343 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@](C)(OC)C1 1748382355 YTMYHMWWEYSMEF-KBMIEXCESA-N 437.588 4.393 10 10 IICE CO[C@H](Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)C 1748434314 ARRSDSVEXGKGQT-HSZRJFAPSA-N 441.620 4.080 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCSC1 1764229086 QEXQFIIFZWXHBX-HSZRJFAPSA-N 425.602 4.067 10 10 IICE CC[C@@H](C)[C@H](C(=O)O)N1C(=O)/C(=C\c2c(Cl)nc3scc(C)n23)SC1=S 1858595602 DUGHPUQGNHMQQQ-GFLRZIDMSA-N 429.976 4.058 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4ccccc4OC)cc3)CC2)cc1 1872884043 IIDHIUHYGVUDLT-UHFFFAOYSA-N 431.536 4.278 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCC[C@H]2NCc2cc(Br)ccc2O)C1 1918889235 VOPKVCAIDNUVIO-YLJYHZDGSA-N 425.367 4.424 10 10 IICE C[C@]1(NCc2ccc(Br)cc2O)CCCN(C(=O)OCc2ccccc2)C1 1940888021 PWHOSIDNDPJWJQ-NRFANRHFSA-N 433.346 4.436 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C2(C)CC2)c(N)c1I 2080005816 NKFUKZPTYNVLMB-ZDUSSCGKSA-N 425.314 4.443 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2ccc(Br)cc2O)C12CCC2 2120832084 MQHQLZORPGVERO-OAHLLOKOSA-N 425.367 4.424 10 10 IICE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2cc(Br)ccc2I)CC1 2155565384 VYQOBDGUIFYFER-JTQLQIEISA-N 449.090 4.359 10 10 IICE Oc1c(Br)cccc1CN[C@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156277240 ISUFCJTYSQOJSM-DENIHFKCSA-N 431.374 4.068 10 10 IICE O=C1C(=Cc2cn(-c3ccccc3)nc2-c2ccncc2)SC(=S)N1C[C@H]1CCCO1 2314457901 MZXDEUDHFSWEKN-LJQANCHMSA-N 448.573 4.315 10 10 IICE COc1cc(C=C2SC(=S)N(CCCN(C)C)C2=O)ccc1OCc1ccccc1 2318683991 LNAMAWXNOSQCAC-UHFFFAOYSA-N 442.606 4.427 10 10 IICE O=C(CNc1ccc(Br)cc1C(=O)c1ccccc1)Nc1ccccc1O 35549348 XWQSKXFWTAYSIS-UHFFFAOYSA-N 425.282 4.436 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)c3ccc(C)cc3C)c3ccco3)CC2)cc1 38605960 FGQZBLKCHIDQJC-DEOSSOPVSA-N 433.552 4.198 10 10 IICE Cc1nc(-c2ccco2)cc([C@H]2CN3CC[C@H]2C[C@@H]3CNCc2ccc(N(C)C)cc2)n1 39960765 MLYXHGNGICMIJC-WWNPGLIZSA-N 431.584 4.079 10 10 IICE biogenic CCOC(=O)COc1ccc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)cc1OC 97071464 WJYUWCPIOWPZCW-UNOMPAQXSA-N 443.546 4.039 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(\C)Nc2ccccn2)cc1 205963485 AFQKESOVKJRGMA-RCCKNPSSSA-N 429.436 4.135 10 10 IICE CSc1ccc(S(=O)(=O)Nc2nc(-c3ccc(CCNC(C)=O)cc3)cs2)cc1 727246027 GUVFPGCQIUMGPD-UHFFFAOYSA-N 447.607 4.011 10 10 IICE Cc1ccc(/C=C/C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(Br)c1 736195320 FFKAMXNAZOBRHC-RMKNXTFCSA-N 443.385 4.296 10 10 IICE Cc1nccn1-c1ccc([C@@H](C)NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 754913180 BNBRDBBCCXXVOW-RTBURBONSA-N 433.556 4.139 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NCc2ccc(N(C)C)cc2)cc1 763264513 DDGHTRAGIUCVHE-QGZVFWFLSA-N 426.561 4.338 10 10 IICE O=c1c(Cl)c(NCc2cc(Br)ccc2O)cnn1-c1ccc(F)cc1F 804827134 HYFNVFOUKORTHJ-UHFFFAOYSA-N 442.647 4.244 10 10 IICE CC[C@@H]1N[C@](N=Nc2ccc([N+](=O)[O-])cc2)(P(=O)(OC(C)C)OC(C)C)OC1=O 1088716038 OBJIVGDTIWTEFE-DOTOQJQBSA-N 428.382 4.258 10 10 IICE C[C@@H](CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)n1cc(Br)cn1 1125089787 HVJNZCIBTCSDEO-LBPRGKRZSA-N 438.281 4.011 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)c2c1 1125188214 NQKTUJZMIWMMLS-GASCZTMLSA-N 441.478 4.071 10 10 IICE Cc1cc(CC(=O)N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)c(C)n1-c1ccccc1 1127294502 GUCZGZRKFAOEJT-SFHVURJKSA-N 439.918 4.351 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])N(C)C)cc1 1134882806 VAOSKRFTCUDWKV-KRWDZBQOSA-N 425.316 4.000 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](CC(=O)OC(C)(C)C)C2)cc1 1137255611 JYOQJAOANKWQJH-OAQYLSRUSA-N 438.568 4.420 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCCN(C(=O)CC3CCCC3)CC2)cc1 1144511284 BZNMOAZKMOQMPB-UHFFFAOYSA-N 449.595 4.090 10 10 IICE CCOC(=O)[C@H](Cc1cccc(Cl)c1)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1156009465 PYPSFZKPWKAFEM-FQEVSTJZSA-N 425.916 4.047 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cc(F)c(F)cc1I 1179032234 BQYFAUZNJWKACL-UHFFFAOYSA-N 439.199 4.358 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N1CCCCc2cccnc21 1288202339 DSTAXVDYTJEICX-VKAVYKQESA-N 443.619 4.494 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N=[S@@](C)(=O)c2ccc(F)cc2)C1 1289028223 RAMIPMKNDYRMOY-PMERELPUSA-N 427.545 4.230 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](NC(=O)NCc2ccc(F)cc2)C(C)C)cc1 1290323671 FICZYDHCZHOYDA-QHCPKHFHSA-N 442.579 4.154 10 10 IICE C[C@H]1COCC[C@H]1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1291300014 HPSCJGBMWJBSCX-FPOVZHCZSA-N 425.621 4.485 10 10 IICE CS(=O)(=O)Cc1ccc(F)cc1CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1306986082 DKXYGPWWKYKNSJ-UHFFFAOYSA-N 442.468 4.122 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H]1F 1316490151 OMLCGIZWWCWDBQ-XLIONFOSSA-N 431.625 4.262 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cc2ccccc2O[C@H]2CCOC2)cc1 1350087471 LVFAPRLBFLOSFJ-DEOSSOPVSA-N 434.536 4.285 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)CN(Cc1ccco1)c1cccc(Cl)c1 1354370453 BVOKKQPTPNKJHZ-UHFFFAOYSA-N 425.916 4.431 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](c2c(C)nn(C)c2C)C(F)(F)F)CCCC1 1435380462 JXAZVTLHECVLNG-JOCHJYFZSA-N 448.489 4.299 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(NS(C)(=O)=O)cc3)c2C)c1 1441492233 FUFIJGQYBGDHPK-UHFFFAOYSA-N 425.554 4.012 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1cnc(N(C)C)cn1 1457576361 RRUDBPJOCYZRAY-GOSISDBHSA-N 443.473 4.468 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)N(C)C)cc1 1463284617 LWHKIUVBAHMPNV-OAQYLSRUSA-N 443.016 4.491 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 1464505993 LNJBOSBJIHCMDT-QHCPKHFHSA-N 425.573 4.442 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@H](O)C(F)(F)F 1466536736 OUCLQDCRPVOXJS-HOCLYGCPSA-N 433.268 4.288 10 10 IICE CC(C)(C)OC(=O)N1c2ccccc2CC[C@@H]1CCNC(=O)NCc1c(O)cccc1F 1470711897 ZBMJACKUQLRAJD-QGZVFWFLSA-N 443.519 4.477 10 10 IICE Cc1cc(CNC(=O)N(C)Cc2ccc(C(=O)NC3CC3)cc2)c(C)n1-c1ccccc1 1479099532 LBBGYUDSNZOGHY-UHFFFAOYSA-N 430.552 4.328 10 10 IICE Cc1csc(CN(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)c1 1492646687 ORPHEXNQDJEZIS-UHFFFAOYSA-N 443.627 4.380 10 10 IICE CCc1nnc(N2CCO[C@H](c3cccc(F)c3)C2)n1CCCSc1nccs1 1499215940 IZTYVHQLXLCTKD-KRWDZBQOSA-N 433.578 4.196 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CC1 1517883838 LDEWHPJCCXKDJQ-SANMLTNESA-N 448.615 4.467 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(F)cc(N4CCOCC4)c3)cc2Cl)C1 1524702775 DUCDFEPMKVXHED-QGZVFWFLSA-N 445.966 4.482 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@H](c2ccccc2)C1 1535474860 POMQOCKBRDSHJS-HJHGFDQJSA-N 440.565 4.433 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnc(Cc4ccccc4F)s3)C2)cc1 1537109371 NBRRFUVJXZCVKW-MRXNPFEDSA-N 425.529 4.138 10 10 IICE Cc1cn2ccc(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)cc2n1 1540176875 DPJAQJGJAINSGE-YVLHZVERSA-N 440.525 4.012 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)c(C)n1-c1ccccc1 1543594140 OXCCEQCCCWBINC-IBGZPJMESA-N 437.490 4.084 10 10 IICE C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632880 YBJPMXFCCHEESX-HRAATJIYSA-N 428.960 4.082 10 10 IICE COC(=O)[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)C1 1554527849 PEGCPLRZWOUIIS-FQEVSTJZSA-N 435.572 4.398 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1557063803 ZXNOYRBMILHLGT-BEFAXECRSA-N 448.394 4.468 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC(Cc2ccoc2)C1 1558704758 BZRQAKUVOJJKSX-YVLHZVERSA-N 432.592 4.024 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(Br)c2nccnc2c1 1584094706 HLGQLOREXRSENL-AWEZNQCLSA-N 427.346 4.128 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(C(F)(F)F)c1 1584507563 PINBLKDRCCNSRC-MRXNPFEDSA-N 447.501 4.217 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(Br)cnc1C1CC1 1596358570 GDXQLDHEHFUGPU-UHFFFAOYSA-N 432.387 4.205 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCNC(=O)c1n[nH]c2ccccc12 1597567462 ORAZFNZDUDCDOC-GOSISDBHSA-N 442.519 4.178 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CC=CCC2)CCOC1 1610362210 WVFJXMQJADSXAB-DVECYGJZSA-N 426.561 4.017 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C[C@H](O)C(Cl)(Cl)Cl)cc2Cl)C1 1617900949 NIJHSXDZSKBURS-ABAIWWIYSA-N 428.187 4.314 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)c1 1624910173 XMOQRQJAGSTTBM-UHFFFAOYSA-N 433.527 4.394 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)c1cc(Cl)cc(Cl)c1 1630261891 FSGBHTJNTYCOHH-KRWDZBQOSA-N 441.742 4.316 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(-c2ccccc2C(F)(F)F)on1 1630481272 RNYVOFOSPUIFNB-UHFFFAOYSA-N 448.397 4.272 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@@H](C(=O)NCc2ccc3cccnc3c2O)C1 1630532096 GXNMTBOPKLKBAM-FQEVSTJZSA-N 433.508 4.091 10 10 IICE COc1cccc(CNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H]2c2cccc(C)c2)c1O 1631542631 KBCUFKYGMZMKDR-BJKOFHAPSA-N 430.548 4.241 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(Br)n[nH]2)cc1 1633065780 BLNBKSBDWCCHTQ-UHFFFAOYSA-N 429.318 4.094 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)NCc2ccc(N(C)C)cc2C)[C@@H]1c1ccc(OC)cc1 1633340150 CDHNYFGMFZREAS-ZCYQVOJMSA-N 437.584 4.076 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 1636239998 VUGBAZANRYIYNW-PMACEKPBSA-N 432.609 4.366 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 1642997770 MQYOHARQSBQZHY-NQIIRXRSSA-N 429.605 4.288 10 10 IICE O=C(N[C@@H](C1CCCC1)C1CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1643521184 ANDVKFYOKWGWNO-FQEVSTJZSA-N 434.583 4.343 10 10 IICE CCC[C@@H](O)CCCS[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1644147594 PZOPFADIRLSRJZ-NVXWUHKLSA-N 425.550 4.463 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2[C@H](C)CO)sc(C)c1-c1ccccc1 1654194444 PRSBUNHKDVZAPZ-APWZRJJASA-N 444.597 4.322 10 10 IICE CCO[C@@H](C)c1noc(CN(C)C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)n1 1675107901 HPJOEVYUEWJLKY-SFHVURJKSA-N 425.533 4.225 10 10 IICE CC(C)(C)O[C@@H]1C[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@@H]1n1cccn1 1682610123 ZWIPZLFKUHRBMJ-FCEUIQTBSA-N 438.528 4.091 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)c(C)n1-c1ccccc1 1683149329 OUAGLNDUSMMGPD-NRFANRHFSA-N 431.458 4.087 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC(c1cccs1)c1cccs1 1687155558 QOPURDFVRRNERZ-UHFFFAOYSA-N 427.595 4.360 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@]2(C)COc3ccccc3O2)cc1 1687165602 HXQKWFMOFKRPCQ-RUZDIDTESA-N 435.524 4.288 10 10 IICE COCCC1(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCCC1 1697943250 MBYRGWZMEPIDFH-FQEVSTJZSA-N 428.577 4.111 10 10 IICE C[C@H]1CN(c2nnc(CC3CC3)n2CCCSc2nccs2)C[C@@H](C(F)(F)F)O1 1726715025 OGRUBCDCQSCNHN-JSGCOSHPSA-N 447.552 4.026 10 10 IICE CCN(CCc1cccs1)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1728488129 MOGHKSJBJPSSKD-FQEVSTJZSA-N 439.629 4.335 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1 1749662015 BDEYTCHRLRETQW-FQEVSTJZSA-N 437.588 4.394 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@@H](C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1761678269 DCESRUQSHVECDX-FQEVSTJZSA-N 437.588 4.130 10 10 IICE CCN(c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1)C1CC1 1764827262 NIWUYDYCGWWHIY-WIYYLYMNSA-N 429.584 4.439 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)CCCOc2ccccc2Cl)c2nccn2C)cc1 1865935058 OUDYFXAIBUMXAW-JOCHJYFZSA-N 426.948 4.204 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3cccc(NC(=O)c4cccs4)c3)CC2)cc1 1874725796 PNPCLOLPEHQXOX-UHFFFAOYSA-N 449.576 4.404 10 10 IICE CCCN[C@@H](c1ccccc1O)[C@@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1942408363 OMNDHDVBWZQNJI-GGAORHGYSA-N 427.589 4.458 10 10 IICE CN[C@@H](C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccc2c(c1)CCN2C 2044754547 MOMUDPASGRTKCQ-PKTZIBPZSA-N 439.600 4.440 10 10 IICE CN(C[C@@H](O)COCc1ccccc1)c1ccc(CNC2CCC2)c(Br)c1 2240042917 KYCKDTALSRNLIJ-OAQYLSRUSA-N 433.390 4.105 10 10 IICE CCCCOC(=O)CN1C(=O)C(=Cc2ccc(OC)c(Br)c2)SC1=S 2314740331 HRADCQKRQCIHKF-UHFFFAOYSA-N 444.372 4.002 10 10 IICE COc1cccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)c1O 14459698 LVGUFMFPNVUCGP-HOIFWPIMSA-N 426.538 4.012 10 10 IICE COc1cccc(CN/C(C)=C2/C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)c1 19635844 QIBQDDIJKYFKCG-HAVVHWLPSA-N 442.475 4.418 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C\c3ccc(-c4cccc([N+](=O)[O-])c4)o3)C(=N)N12 32945418 UAMABTSGQLLRPB-CXHQGSNTSA-N 427.467 4.185 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccc(F)cc3)C2=O)ccc1O 210714851 INOPYHOYXKNSQH-LDADJPATSA-N 446.525 4.160 10 10 IICE O=C(COC(=O)CNC(=O)c1ccccc1F)Nc1ccc(N=Nc2ccccc2)cc1 254478246 RHUTWOQUMFUPCM-UHFFFAOYSA-N 434.427 4.153 10 10 IICE CCN(C(=O)c1ccc(I)c(Br)c1)c1ccc(N)cc1 721607702 AHVOTJBFLCJVQP-UHFFFAOYSA-N 445.098 4.303 10 10 IICE CC(C)c1noc2ncc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc12 726564950 XXBVVJBOECCLAC-UHFFFAOYSA-N 430.455 4.346 10 10 IICE CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 729174922 QYZVQACDEWZYKR-RUZDIDTESA-N 433.596 4.243 10 10 IICE COc1ccc(OC)c([C@@H](C)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743565227 UXDXGUQZDDXFBY-HZPDHXFCSA-N 449.498 4.334 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(C)s3)cs2)c(OC)c1 777667339 OIRHCLDYMWKUQH-UHFFFAOYSA-N 426.541 4.007 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(F)c(C)c3)cs2)c(OC)c1 777669408 MYVMPCMJUROCCT-UHFFFAOYSA-N 438.502 4.084 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N[C@H]1CCOc2c(Br)cccc21 799884659 RCGQJSRTPFARIL-IBGZPJMESA-N 430.346 4.372 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC(F)(C2CC2)CC1 1134691361 OYHJKCQEJGWOJC-SSZFMOIBSA-N 438.615 4.470 10 10 IICE O=C(Cc1c[nH]c2nccc(Cl)c12)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082415 YRIMTBVSJIQNCB-AWEZNQCLSA-N 434.874 4.145 10 10 IICE Cc1cc(C(=O)Nc2nc3c(s2)COCC3)c(C)n1-c1ccc(Br)cn1 1143378858 PFGVOHZTQHYXTJ-UHFFFAOYSA-N 433.331 4.033 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1[C@H]2CCCC[C@@H]2CCN1C(=O)OC(C)(C)C 1146196495 LQUSAPJDPNFCAU-COPCDDAFSA-N 429.605 4.493 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1(Cc2ccccc2Br)CC1 1148706232 SXLGTTUWAALCJH-UHFFFAOYSA-N 443.385 4.049 10 10 IICE Cc1cc(C(=O)Nc2ccc(OCCO)cc2)c(C)n1-c1ccc(Br)cc1 1150348302 ORELDBYMYJUSRZ-UHFFFAOYSA-N 429.314 4.480 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2N(C(=O)OC(C)(C)C)CCCC2(C)C)cc1 1164596640 ARQDTSMGLYFATN-FQEVSTJZSA-N 433.593 4.016 10 10 IICE C[C@H](c1cc(F)ccc1F)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1190382535 IXQKBUCRLDQXAP-CQSZACIVSA-N 434.442 4.372 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2coc3c2C(=O)NCC(C)(C)C3)cc1 1264452709 YVHJBGYGODHZTD-UHFFFAOYSA-N 435.524 4.093 10 10 IICE COc1ccc(-n2cnnc2SCC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1287660616 JQVGQJMRASKMIT-UHFFFAOYSA-N 447.564 4.092 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](c1cccc(Br)c1)N1CCCC1 1290288758 AIWAOSQNYNDUMG-OAQYLSRUSA-N 430.390 4.311 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)C[C@H](C)CC)n1Cc1ccc2c(c1)CCCN2C 1305577020 MVBYENXQDQXGFU-GOSISDBHSA-N 440.636 4.110 10 10 IICE Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1352634113 BZMZJCVALOPXDX-LICLKQGHSA-N 445.497 4.272 10 10 IICE COc1ccc(C)cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1352854617 DJOZSGWKDJYCCB-PDGQHHTCSA-N 430.526 4.373 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ncoc1CCC(F)(F)F 1352891418 GCQOCMHQPGHNCQ-UHFFFAOYSA-N 433.377 4.170 10 10 IICE Cc1cc(C(=O)N2CCC(C3(C)OCCO3)CC2)c(C)n1-c1ccc(Br)cc1 1445527654 DRQKVZPFCXCZIS-UHFFFAOYSA-N 447.373 4.472 10 10 IICE O=S1(=O)N=C(Cl)c2ccc(N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc21 1458222342 VPYGLTSPNXFFOL-CYBMUJFWSA-N 441.887 4.057 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCCC[C@@H]2CS(C)(=O)=O)cc1 1460224265 YEEVJARFFYWENL-LJQANCHMSA-N 428.558 4.207 10 10 IICE Cc1ccc(NC(=O)C2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)nc1 1464289015 ACKLZLVDFCOYDF-UHFFFAOYSA-N 444.535 4.101 10 10 IICE COc1cc(OC)cc(Oc2ccc(CNC(=O)NCc3c(O)cccc3F)cc2)c1 1478624188 JFVDHXXFLZJCNE-UHFFFAOYSA-N 426.444 4.340 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1 1478969227 ADKZLLPYNGANKB-RUZDIDTESA-N 442.563 4.291 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1Cc1ccncc1Cl 1503487873 OUGQWKLFKOOAEE-UHFFFAOYSA-N 425.945 4.369 10 10 IICE COc1ccc(CN(C)c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)cc1 1504259905 UZFSRNZKBILZSV-GOSISDBHSA-N 445.614 4.414 10 10 IICE CCc1onc(-c2ccccc2)c1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1521009805 MLNDXAIAHDHGLB-UHFFFAOYSA-N 436.531 4.115 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1 1528924102 IYUBGQVBRNQYJW-YGWXTMFKSA-N 427.633 4.364 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sc4ccc(OC)cc4c3C)cc2F)CC1 1537536175 YILQUTGZUFMIMQ-UHFFFAOYSA-N 441.572 4.429 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(Nc3ccccc3)CC2)NC(=O)OC(C)(C)C)cc1 1544269598 UCEMGZIYFOBMSA-NRFANRHFSA-N 438.572 4.079 10 10 IICE CSCCCN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1555928116 ICMHEHZOVNGASA-UHFFFAOYSA-N 433.622 4.373 10 10 IICE Cc1cc(C(=O)NC[C@](C)(O)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1556190715 MFWIRLZFHDPKEF-NRFANRHFSA-N 434.378 4.313 10 10 IICE C[C@H](NC(=O)NCc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccc(N(C)C)cc1 1564596253 AYTATEOHJDUSAE-KRWDZBQOSA-N 426.561 4.338 10 10 IICE C[C@H](NC(=O)N(C)C[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc(N(C)C)cc1 1564597376 LNPPIXDUVKUWBA-IFXJQAMLSA-N 440.371 4.202 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CO[C@@H](CCC(=O)OC(C)(C)C)C3)cc2)CC1 1565663588 IKDNHNFNRUCBAU-UNMCSNQZSA-N 430.589 4.066 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)c(C)n1-c1ccc(F)cc1 1566290470 GNXYZBBKGLZASA-HXUWFJFHSA-N 427.426 4.047 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2c(F)cncc2F)c(C)n1-c1ccc(Br)cn1 1568787171 BQSVUHPTBURULQ-NSHDSACASA-N 435.272 4.416 10 10 IICE CSC[C@@H]1CCCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1569556313 SNTKHNINDXFRAA-QAEAHILHSA-N 438.615 4.019 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@@H](C)C[C@H](C(=O)OC(C)(C)C)C2)CCCC1 1570425966 NPLYHOHSULHGCU-ROUUACIJSA-N 440.584 4.355 10 10 IICE Cc1cc(Cl)c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1[N+](=O)[O-] 1583281545 XCJBUJODRSJSTC-UHFFFAOYSA-N 428.920 4.341 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccc(Cl)cc2)[nH]n1 1595571657 HCPFAMLLVBKXCE-GOSISDBHSA-N 445.350 4.484 10 10 IICE Cc1ccc(-n2nnc(CC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)c2C)cc1 1596472562 SKFVNKBJGJREEE-UHFFFAOYSA-N 427.552 4.459 10 10 IICE Cc1nc(CCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)oc1-c1ccccc1 1596683393 ABCBBQKFZXHKMC-UHFFFAOYSA-N 441.478 4.014 10 10 IICE Cc1ccc(I)c(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c1 1597801165 YMVMIJUOIXYSQX-HNNXBMFYSA-N 436.337 4.335 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCN(CC(F)(F)F)C1 1613169728 GZFPONHMOGSWGN-JKSUJKDBSA-N 425.499 4.018 10 10 IICE COc1cc(OC)cc(OCCCNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c1 1622760526 YFZFFLBGRZKTGL-UHFFFAOYSA-N 426.488 4.449 10 10 IICE CN(CCOc1ccccc1C(=O)N(C)Cc1ccc(N(C)C)cc1)C(=O)OC(C)(C)C 1623387194 STMJJFQHCFWAMS-UHFFFAOYSA-N 441.572 4.271 10 10 IICE CC(C)[C@H]1N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC12CC=CC2 1627338466 YBHQCVNDXRGJEK-LJQANCHMSA-N 432.567 4.071 10 10 IICE Cc1cccc(OCCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1628491885 ZWYAAVKOTBZFNR-JOCHJYFZSA-N 441.572 4.212 10 10 IICE CSc1ccc(N2C[C@@H](C(=O)NCc3cc(Cl)cc(Cl)c3O)CC2=O)cc1 1629133088 VLUDUYXEURMOQC-LBPRGKRZSA-N 425.337 4.090 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)CN3CCN(c4ccccc4)CC3)c2C)cc1 1629690377 SRTZARVUJBEINZ-FQEVSTJZSA-N 446.595 4.043 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCC(c2ccon2)CC1 1629769604 VSFCGOKTQGJTJR-LGMDPLHJSA-N 447.607 4.124 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(C(C)C)cc1 1630762954 HVEMVGRNXKWVDJ-QFIPXVFZSA-N 426.557 4.400 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F 1635964996 IFRWTHONJLFHAB-UHFFFAOYSA-N 430.361 4.214 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@@](CO)(Cc2ccccc2)C1 1636717043 WSHLXAGUEPQBDO-HHHXNRCGSA-N 430.548 4.364 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCO[C@H](C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1637018436 VAEBHYDFBCEELH-APWZRJJASA-N 434.378 4.433 10 10 IICE CCN(CC)c1ccc2cc(C(=O)NCc3cccc(Br)c3O)c(=O)oc2c1 1640083556 CDCVLQQJPGFMHD-UHFFFAOYSA-N 445.313 4.037 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2cccc(Br)c2)c1 1641733438 VZTCVMJVQFUECM-SFHVURJKSA-N 449.345 4.345 10 10 IICE CN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1Oc1ccccc1 1642092118 KAXSFSVPUDLESX-UHFFFAOYSA-N 449.526 4.207 10 10 IICE Cc1c([N+](=O)[O-])cnc(N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1Br 1655340917 JBNBLAMFSPTZMM-QGZVFWFLSA-N 449.349 4.312 10 10 IICE NC(=O)c1c(NC(=O)CCN(Cc2ccccc2O)C2CCCC2)sc2c1CCCC2 1657276817 KMSJFBQDVVOGEM-UHFFFAOYSA-N 441.597 4.205 10 10 IICE COc1ccc(N(CCOc2ccc(S(C)(=O)=O)cc2)CCc2ccccc2)cc1 1657676006 PBQUMYVEZZODQD-UHFFFAOYSA-N 425.550 4.227 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3C[C@H]3c3ccccc3Br)C2)cc1 1680604770 HZWCILONZRTFDR-PAXLWEDBSA-N 444.373 4.139 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CCc3ccccc3)c3ccccn3)C2)cc1 1687025044 LJPMPGCUOICNIQ-BWKNWUBXSA-N 430.552 4.342 10 10 IICE Cc1cc(CNC(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1687286241 AHFUKVPFDSEJML-JOCHJYFZSA-N 444.579 4.446 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC[C@H](COC)C2)n1Cc1ccc2c(c1)CCCN2C 1708501147 CIMJYSXKOSFLCI-CTNGQTDRSA-N 425.621 4.475 10 10 IICE COc1ccc(-c2nnc(N(C)C[C@H]3CCOC3)n2CCCSc2nccs2)cc1 1711738724 RWCGHWYEBXAJPQ-MRXNPFEDSA-N 445.614 4.065 10 10 IICE COCCO[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CCC(F)(F)CC1 1730815576 BEBBRLVZRSSEJE-MRXNPFEDSA-N 438.519 4.170 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)(C)O)CCO1 1765220143 AKVBZTFNPFHESQ-OAQYLSRUSA-N 437.588 4.129 10 10 IICE CN1CCCc2cc(Cn3c(N4CCC=C(Br)C4)nnc3C(C)(C)C)ccc21 1769068669 HGEHHHUDXIOPHG-UHFFFAOYSA-N 444.421 4.495 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(F)(F)Br 1771312316 FZCZFBLNTGJSLG-UHFFFAOYSA-N 440.292 4.338 10 10 IICE C[C@@H]1CN(c2nnc(CCOc3ccccc3)n2CCCSc2nccs2)C[C@@H]1F 1771495750 UCXPJFXGMNVBRH-AEFFLSMTSA-N 447.605 4.333 10 10 IICE CCn1cc(OCc2ccccc2C)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870627566 VWGNXRCKEPAHJX-UHFFFAOYSA-N 447.579 4.086 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCCC3)C(=O)N(C[C@@H]3CCCO3)C2=O)cc1 1873165689 PMZPCNFVQVIHMM-QHCPKHFHSA-N 447.579 4.275 10 10 IICE CSc1ncc(CNC(=O)c2csc(Br)c2Br)s1 2257099134 ZCAFLDISHKBUNT-UHFFFAOYSA-N 428.196 4.382 10 10 IICE O=C(NN1C(=O)C(=Cc2cccs2)SC1=S)c1ccc(Br)cc1 2296763997 VSOUFLOOPDNVOV-UHFFFAOYSA-N 425.354 4.057 10 10 IICE CC(C)(C)OC(=O)N[C@H]1[C@H]2C[C@H](CN(c3ccc(OCc4ccccc4)cc3)C2)[C@H]1CO 2314471477 MJGDTIYRNXXENL-JDBUVZGPSA-N 438.568 4.224 10 10 IICE CC(C)c1nc2c(Cl)cc(C(F)(F)F)cn2c1C=C1SC(=S)N(CCO)C1=O 2323676473 YQAKWZJTEIWZOM-UHFFFAOYSA-N 449.907 4.323 10 10 IICE COc1ccc(N2N=C(c3ccccc3)C(=Cc3cc(OC)c(O)c(OC)c3)C2=O)cc1 2332147539 JSPKAMBPEHBWAF-UHFFFAOYSA-N 430.460 4.253 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H](CNC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352940326 DDOBQJRIWADFMX-LSDHHAIUSA-N 427.383 4.492 10 10 IICE O=C1NC(=O)N(CCc2ccc(F)cc2)C(=O)/C1=C\c1ccc(OCc2ccccc2)cc1 2276168 KLPFHOWWQPCFHN-KQWNVCNZSA-N 444.462 4.109 10 10 IICE CCCNS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(OC)c1)N2 14479432 GTEMQVYYVWFXHU-STSQHVNTSA-N 428.554 4.219 10 10 IICE CCCNS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(OC)c1)N2 14479433 GTEMQVYYVWFXHU-BSRJHKFKSA-N 428.554 4.219 10 10 IICE O=C(COC(=O)/C=C\c1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 33504766 BDUICEDTTJVYMY-GHXNOFRVSA-N 445.858 4.311 10 10 IICE O=C1/C(=C\c2ccc(Cl)cc2Cl)SC(=S)N1N1C(=O)[C@H]2CCCC[C@H]2C1=O 33562696 FBHINWQNCQTZNB-HSWNBIMASA-N 441.361 4.285 10 10 IICE COc1cccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc3C2)c1 35349266 FMHAEGAWAKEKOL-SANMLTNESA-N 429.564 4.291 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)NC12CC3CC(CC(C3)C1)C2 35640727 BNARYTXZHQIGRA-ZDLGFXPLSA-N 430.595 4.346 10 10 IICE COc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(OC)c1OC 435731715 LMTGRNBAQHBZHA-UHFFFAOYSA-N 437.540 4.072 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NCc1cc(Br)cc(F)c1O 715812480 KQMAACBNJIRVBR-LRDDRELGSA-N 431.346 4.467 10 10 IICE Cc1ccccc1C(=O)NC1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731049562 BUGKILJBWKMEFE-UHFFFAOYSA-N 448.611 4.335 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N(C)[C@@H](C)Cc3ccc(C)cc3)cc2F)CC1 739002908 DEGDXNDVIRXRRI-FQEVSTJZSA-N 426.580 4.049 10 10 IICE CCN1CCN(c2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)cc2)CC1 743305961 ZZRQSOMHVQQLPD-UHFFFAOYSA-N 446.595 4.330 10 10 IICE CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3ccccc3F)cs2)c1 747763346 CUAVDBAHIJDJAZ-UHFFFAOYSA-N 439.921 4.105 10 10 IICE CN(c1ccc(CNC(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)cc1)C1CCCCC1 756684836 NFRVYTVHIYLQMQ-DHIUTWEWSA-N 441.572 4.083 10 10 IICE C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1ccc(N2CCOCC2)cc1Cl 764945581 IVPHLIQTOTZZBB-QRVBRYPASA-N 445.007 4.036 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc(-c3ncco3)cc2)c(C)n1-c1ccccc1 766578807 WBHAQXWGVHOVDQ-UHFFFAOYSA-N 428.492 4.047 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)C[C@H](O)c2ccc(F)cc2)C1 768070183 FYXUMVVMJQHORV-CJAUYULYSA-N 437.559 4.175 10 10 IICE c1ccc(-c2cnc(SCCc3nnnn3-c3ccccc3)n2C[C@H]2CCCO2)cc1 917206757 WCURUAMYWZCIKC-HXUWFJFHSA-N 432.553 4.040 10 10 IICE Cc1cc(=O)c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)nn1-c1ccccc1F 1132263565 FSJLGILWAKLKSM-UHFFFAOYSA-N 430.483 4.018 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)Cc3ccccc3F)CC2)c1 1136482065 QSSGEGIWLMWKMY-UHFFFAOYSA-N 433.527 4.069 10 10 IICE CC[C@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Br)cc1 1136984145 JBKXDYHOJURBOF-IBGZPJMESA-N 449.364 4.359 10 10 IICE Cc1cc(OCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1Br 1137727345 GYFMBZURDIQPRM-SFHVURJKSA-N 434.330 4.050 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C(=O)OC(C)(C)C 1149735800 ULLYMGVQKUCQIF-MRXNPFEDSA-N 436.350 4.102 10 10 IICE COc1ccc(N2CCN(C(=O)/C(C)=C\c3ccc(OC(F)(F)F)cc3)CC2)cc1F 1150240394 PTACQTAUHRGKPV-SQFISAMPSA-N 438.421 4.485 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccccc1OC 1165498302 LOPQMIGYYABOLJ-CVDCTZTESA-N 444.959 4.450 10 10 IICE COc1ccc(N2CCN(CCCNc3ccc(C(F)(F)F)c(Cl)n3)CC2)cc1 1184658737 KPTZOKPLBSEYOV-UHFFFAOYSA-N 428.886 4.387 10 10 IICE CC(C)N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccc(F)cc1 1190581999 MBPHFGIZDLQZTJ-UHFFFAOYSA-N 430.479 4.450 10 10 IICE Cc1cc(CNC(=O)N[C@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccccc1 1235454514 FMMYGPXQJKZBTR-DEOSSOPVSA-N 444.579 4.127 10 10 IICE COC(=O)c1ccc2c(c1)CN(C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)CC2 1254073490 IMNKUWGWGUUZMQ-UHFFFAOYSA-N 431.536 4.457 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(C(=O)N[C@@H](C)C(C)C)CC3)c2C)c1 1254073538 IZSOXIZWNMSYSW-FQEVSTJZSA-N 438.616 4.485 10 10 IICE COc1cc(Cl)c(Cl)cc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1275224345 DVOVRPCCBVGPDI-UHFFFAOYSA-N 431.266 4.047 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc2c1OCCN(C(=O)OC(C)(C)C)C2 1290289886 HBJUVRYELJJXSQ-UHFFFAOYSA-N 439.556 4.154 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](CCOC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291500476 YCNYLDWQDGRCQK-FPOVZHCZSA-N 443.661 4.256 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)Cc2scnc2C)cc1 1295415148 ODSUKLZDZSELET-UHFFFAOYSA-N 448.600 4.031 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC(C)(C)CC3)n2Cc2ccc(N(C)C)c(F)c2)n1 1304752667 ZGUCGHYXDSWDQQ-UHFFFAOYSA-N 439.583 4.020 10 10 IICE C[C@@H](NC(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)c1ccc(N(C)C)cc1 1312534852 HUWBDGUQNGDLJX-NVXWUHKLSA-N 440.535 4.005 10 10 IICE C[C@@H](c1cccnc1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1434936164 BCCMXOWEYDFFKU-QCUKBLKESA-N 429.542 4.032 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC(=O)N(c2cccc3ccccc23)C1 1436853516 LMNHVYMWTYGBJX-UGKGYDQZSA-N 429.564 4.315 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3sc(N4CCCC4)nc3s2)N(C)C)cc1 1439960204 KWFCGUJTGGLGHR-KRWDZBQOSA-N 443.642 4.057 10 10 IICE CC[C@](O)(C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1441783691 MXUZUGJSRBZSTL-CKNGIIGNSA-N 434.939 4.007 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(Br)cnc1Br 1445904353 SQPLMKHABWUQDQ-UHFFFAOYSA-N 440.135 4.121 10 10 IICE COCCN(CCOc1ccc(F)cc1)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1465090647 USSQKGIOLGNJCM-UHFFFAOYSA-N 440.515 4.409 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@H]1Oc1ccccc1 1467367746 QHYITCAJVDWATM-RGSZASNESA-N 446.547 4.190 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccncc3OC[C@@H]3CCOC3)c2C)c1 1468628644 AHAVNYUQTIKREK-OAQYLSRUSA-N 433.552 4.451 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@@H]1CC(=O)NCc1ccc2cccnc2c1O 1469249139 MHLQBBZRIAFMDX-FQEVSTJZSA-N 433.508 4.439 10 10 IICE Cc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2=O)cc1 1472773602 BJDSHYZYUBJKPO-HSZRJFAPSA-N 429.476 4.347 10 10 IICE CC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cccc([N+](=O)[O-])c1 1473334014 SHUPURIHGJZUFB-FQEVSTJZSA-N 443.459 4.050 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]2c2cc[nH]n2)sc(C)c1-c1ccccc1 1473426322 VGVNROZBOABVHM-SFHVURJKSA-N 438.553 4.399 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C(C)(C)C1 1479437622 MVAGXYDLENOGTH-FQEVSTJZSA-N 443.544 4.343 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)[C@@H]1C 1504891931 KPVXTDYVXIBIKG-HKUYNNGSSA-N 425.602 4.329 10 10 IICE C[C@@H]1CCC[C@@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1512115584 YBDCJHQCHFFPOW-DENIHFKCSA-N 425.621 4.475 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCCOc2ccc3c(c2)OCO3)cc1 1524936665 DVNWZEWWCZXYBE-UHFFFAOYSA-N 436.508 4.462 10 10 IICE COc1cc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1C 1528193390 UYAKQIQGIORQND-XDHOZWIPSA-N 444.553 4.050 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCC2(CS(C)(=O)=O)CC2)cc1 1528496326 UXDAUPZPQJKZKX-UHFFFAOYSA-N 428.558 4.113 10 10 IICE CC(C)c1nnc(N(C)CC2CC(F)(F)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541327676 HJRINSFVSRSDNZ-UHFFFAOYSA-N 447.574 4.140 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3cnn(C)c3C)n2CCCSc2nccs2)o1 1542298936 RTENLNHVIAIFFR-UHFFFAOYSA-N 443.602 4.164 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@@H]2CSc3ccccc3O2)cc1 1544523407 BIKRASULFITZDO-NHCUHLMSSA-N 426.582 4.204 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)C3CCCCC3)CC2)cc1-n1c(C)cc(C=O)c1C 1544536035 MQZKOLYGHOJTRE-UHFFFAOYSA-N 435.568 4.080 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](NC(=O)OC(C)(C)C)c2c(F)cccc2F)c1 1545683912 DHOUQHWCRPEIDT-CWTRNNRKSA-N 436.455 4.122 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](NC(C)=O)C1 1547019789 FJXZEGKOFTYQAV-OAQYLSRUSA-N 434.588 4.258 10 10 IICE CC(C)(C)OC(=O)NCc1cc(NC(=O)Cc2ccc(O)c(O)c2)cc(C(F)(F)F)c1 1556394823 CWJJVYMSQHKANH-UHFFFAOYSA-N 440.418 4.323 10 10 IICE CCCCOC(=O)C(C)(C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1557244738 LKVVOOWPWZMUGR-UHFFFAOYSA-N 436.350 4.103 10 10 IICE CC1(C)Cc2c(cnn2-c2ccccc2F)CN(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1557714756 KBCRQFIFRBRCKJ-UHFFFAOYSA-N 434.475 4.399 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CSCc3c(F)cccc3F)cc2F)C[C@@H](C)O1 1559420804 HLPTUGOLEXQPCV-GASCZTMLSA-N 438.515 4.267 10 10 IICE Brc1cc(CNCc2ccnc(-n3cccn3)c2)ccc1N1CCCCC1 1560261154 RJAQTPUFJYXGND-UHFFFAOYSA-N 426.362 4.310 10 10 IICE CC(C)Cc1nc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cs1 1565882381 XEXWOPNQWZCVDG-SFHVURJKSA-N 446.617 4.403 10 10 IICE Cc1cc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)c(C)n1-c1ccc(Br)cn1 1568640603 HEXQTMBUSRTBQA-SFHVURJKSA-N 433.394 4.102 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1scnc1C1CC1 1584148663 AQEDMUYPDCAQDW-NTEUORMPSA-N 433.555 4.390 10 10 IICE Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1597799540 CWAACZUHUWUWBM-FYYLOGMGSA-N 435.612 4.277 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3ccc(Cl)cc3)C(=O)C2)c(C)n1-c1ccc(F)cc1 1617983490 YDPWXGAHJFQQPN-UHFFFAOYSA-N 439.918 4.371 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)c2ccc(OC)c(OC)c2)sc2c1CCCC2 1625375082 LGDSJFRCRSSUOU-UHFFFAOYSA-N 445.537 4.422 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H](C)C(=O)c1cccc(F)c1 1626511396 MDUITXIBDNNGQR-QGZVFWFLSA-N 442.531 4.423 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C[C@H](C)C(=O)c1ccc(Cl)cc1 1632701338 BNMWIVRQSQVQBJ-ZDUSSCGKSA-N 438.307 4.110 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccccc2C(=O)N2CCC[C@@H](O)C2)c1C 1634177126 XKCIPBYXPMUERW-HXUWFJFHSA-N 431.536 4.252 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C[C@@H](O)c1ccccc1Br 1636262677 JBTXVTKZEUNBEZ-IIBYNOLFSA-N 448.405 4.130 10 10 IICE COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1637577829 IYNNZYGOISLQHG-MHZLTWQESA-N 445.563 4.429 10 10 IICE Cc1cc(CC(=O)NC[C@@H](O)c2ccccc2Br)c(C)n1-c1ccccc1 1639098056 QODBTHZQMXCGTG-OAQYLSRUSA-N 427.342 4.249 10 10 IICE Cc1cc(C(=O)Nc2cc([C@@H]3CCCO3)[nH]n2)c(C)n1-c1ccc(Br)cn1 1643743544 SENMUSMJRGSUPE-INIZCTEOSA-N 430.306 4.079 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@H](C)c3ccc(SC(C)C)cc3)CC2)cc1 1653010971 HFWOTMDYXGACNO-NFBKMPQASA-N 443.657 4.029 10 10 IICE COCCn1ccc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1654253718 XMRZWXYYRNSVCT-IBGZPJMESA-N 446.473 4.455 10 10 IICE CN(CCCc1cc(-c2ccccc2)no1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684606626 HTGRWTJURGDAQA-RUZDIDTESA-N 449.599 4.285 10 10 IICE C[C@@H](CNC(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccc(S(C)(=O)=O)cc1 1684791655 IWSPLBCXXCNDLS-SFHVURJKSA-N 444.597 4.444 10 10 IICE Cc1ncsc1CN(C)c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1707017282 RZTHWOKNJLQNBD-CQSZACIVSA-N 436.632 4.170 10 10 IICE Cc1cc(C)n(CCCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)n1 1707841369 IPIVTQMEKSJNAU-UHFFFAOYSA-N 436.585 4.176 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)C[C@@H]2CCOC2)cc1 1710025700 KAVZIXINBHUGCT-NRFANRHFSA-N 434.588 4.016 10 10 IICE CCCN1CCC(N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(CC)CC)cc2)CC1 1728132699 GPDNPBNBKRVQEM-UHFFFAOYSA-N 449.647 4.478 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])SC2=S)c1 1860085307 CKRUKFUXZPVDDP-OQLLNIDSSA-N 434.882 4.441 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2c(F)c(F)c(F)c(F)c2F)N2CCCCC2)cc1 1866171818 PTEIZJDHHAGPLL-HNNXBMFYSA-N 441.444 4.405 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)[C@@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1999535872 BUNXCSNFVSAASL-PKTZIBPZSA-N 426.605 4.038 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC(CN=[N+]=[N-])CC1 2010405413 HVJWTQQXPIIADW-LJQANCHMSA-N 431.537 4.036 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(F)F)c(C(=O)O)c1I 2079049070 GZRCWVZSZYEVOZ-SECBINFHSA-N 436.196 4.137 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3ccc(Br)cc3O)C[C@@]2(C)C1 2116294340 MTRINBYFJUUOML-UVFQYZLESA-N 425.367 4.280 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3F)C2=O)ccc1O[C@@H](C)C(=O)O 2314933733 CTQJBWPCSAYMKB-LBPRGKRZSA-N 447.509 4.482 10 10 IICE Cc1ccc(CNCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C)c(O)c1Br 2352948728 TUOCOFLYOLPLTO-GOEBONIOSA-N 427.383 4.446 10 10 IICE CC[C@@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)C1=O 11636328 GNRSFNXMPNCQNS-HNNXBMFYSA-N 437.587 4.231 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3cccc(C)c3)C2=O)cc1OC 15045684 LOPYDHBOTABOJA-VCRXTVNUSA-N 442.562 4.241 10 10 IICE CCCCN1C(=O)/C(=C\c2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 33351604 REWOWSXLIHQCNJ-MHWRWJLKSA-N 430.599 4.072 10 10 IICE Cc1ccc2ccc([C@@H](Nc3ccc(S(N)(=O)=O)cc3)c3cccs3)c(O)c2n1 54621253 QFKZQGWEEIDESC-HXUWFJFHSA-N 425.535 4.159 10 10 IICE O=S(=O)(/C=C\c1ccccc1)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 97994575 WIHRGDWDKLGVMQ-PFONDFGASA-N 432.498 4.039 10 10 IICE CCN(CC)c1ccc(CN(C(=O)/C=C\c2ccc(C)cc2)[C@H]2CCS(=O)(=O)C2)cc1 213218278 XDSDLUFSFZETIT-INYRMVIESA-N 440.609 4.070 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@@H](c3ccccc3Br)C2)c([N+](=O)[O-])c1 221853941 BEIPTSQJQITLCS-GXVATQTDSA-N 447.285 4.121 10 10 IICE Cc1c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cccc1NC(=O)N(C)C 471649422 RFVDBZBVINIARG-UHFFFAOYSA-N 447.583 4.448 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3cccc(F)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526151240 NYDJXVZYLDGJMQ-JOCHJYFZSA-N 437.423 4.311 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1nc(-c2ccccc2C(F)(F)F)cs1 735607819 QJBPFIHRJQRHQS-UHFFFAOYSA-N 436.868 4.325 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1nnc(-c2ccccc2)n1C 746465774 BAGOJJHJDPLZCW-UHFFFAOYSA-N 433.537 4.429 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C(=O)Nc2ccccc2C(=O)OC(C)(C)C)cc1 775136277 FNQAPSBKYUWJLL-UHFFFAOYSA-N 439.556 4.085 10 10 IICE CCC(CC)[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 778748801 MMMAJIJMDGVYLK-NOZRDPDXSA-N 442.648 4.002 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)C[C@@H]3C[C@@H](C(C)C)c4ccccc43)cc2)CC1 785033607 ZQBSZVDQCZCBBG-NVQXNPDNSA-N 433.596 4.289 10 10 IICE CC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)c1ccccc1 800048516 DBZFYGSNJIQMFI-VGSWGCGISA-N 427.976 4.460 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3cscc3Br)cc2F)C[C@@H](C)O1 814405686 DMYKPPRTZLJDKS-BETUJISGSA-N 441.366 4.122 10 10 IICE CCOc1ccc([C@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 824261085 YMMZKVPDTLJJTJ-AWEZNQCLSA-N 444.443 4.260 10 10 IICE Cc1cc(Br)cc(CN2CC[C@@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c1O 856558234 DFJVIXBKIIUWLK-OAQYLSRUSA-N 448.405 4.352 10 10 IICE Cc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1C 917381004 QKZWNBOFFLKMED-UHFFFAOYSA-N 448.485 4.438 10 10 IICE Cc1nc([C@@H]2CCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1124951518 IAFKZTQPGJESHU-GOSISDBHSA-N 425.554 4.457 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CN(C(=O)OC(C)(C)C)C2CC2)cc1 1124952579 WHHATEUHNJZKQK-UHFFFAOYSA-N 427.545 4.274 10 10 IICE C[C@H]1CN(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c2ccccc2NC1=O 1126351371 LYFYXWPZIICYFB-INIZCTEOSA-N 435.524 4.215 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cccc(-c4noc(CC(C)(C)C)n4)c3)C2)cc1 1130826599 DTRNBIHTERYRKW-IBGZPJMESA-N 434.540 4.343 10 10 IICE CC(C)(C)OC(=O)N1CCC(OC(=O)c2cccc(NC(=O)c3cc(O)cs3)c2)CC1 1136532707 WPPQRLOYDCPWHB-UHFFFAOYSA-N 446.525 4.262 10 10 IICE Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NCc3cc(Cl)ccc3O)cc2)cc1 1146231790 HZCLZZISFGKJJJ-UHFFFAOYSA-N 444.940 4.109 10 10 IICE COc1ccc(N2CCN(Cc3cccc(NC(=O)OC(C)(C)C)c3)CC2)c(OC)c1 1175522926 NCWJPHSMDJHDCO-UHFFFAOYSA-N 427.545 4.373 10 10 IICE Cc1cccc([C@@H]2CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1C 1255508846 GOVBMFGIJFUTJI-DEOSSOPVSA-N 434.584 4.052 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1c(Cl)cccc1Br 1264688111 XRWJQARANUNXRD-UHFFFAOYSA-N 427.701 4.008 10 10 IICE CC[C@H](C)c1nnc(N2CCC(Cn3cccn3)CC2)n1Cc1ccc(N(C)C)cc1C 1291501055 ITHZGPWRLIHMDF-IBGZPJMESA-N 435.620 4.327 10 10 IICE CCc1nnc(N2CCN(c3ccccc3F)C[C@@H]2C)n1CCCSc1nccs1 1293104816 TYVNLZNWPYVMLD-INIZCTEOSA-N 446.621 4.334 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc2[nH]cc(I)c2c1 1294870692 ZYIBVEFSUVLGED-UHFFFAOYSA-N 446.288 4.287 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCC[C@@H](COC)C2)cc1 1295418174 BMXPHBWGENQGNF-HSZRJFAPSA-N 448.615 4.021 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1306426818 CVEVOSAUMJDWLL-FGZHOGPDSA-N 427.593 4.029 10 10 IICE COC[C@@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1315897377 CZNQZDCPUUMNMO-OAQYLSRUSA-N 425.621 4.296 10 10 IICE Cc1cc(CC(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)c(C)n1-c1ccccc1 1350115334 PMAMHYNUSIOWON-UHFFFAOYSA-N 431.536 4.277 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1F 1350662752 JJWLALUKZJYIKF-YVLHZVERSA-N 434.489 4.203 10 10 IICE CC(C)Cn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C(F)F)n1 1356036379 FTBGVMJEZBGYRT-GASCZTMLSA-N 438.494 4.159 10 10 IICE CN(C)c1ccc(CNC(=O)C2(C(F)(F)F)CCN(C(=O)OC(C)(C)C)CC2)cc1F 1357200222 JHHFSLMYWXQMKH-UHFFFAOYSA-N 447.473 4.088 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)ccc1C 1440538474 NESSDXNGRIPVQJ-UHFFFAOYSA-N 425.554 4.180 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)cc1)C1CCCCC1 1442452987 URIMGFUKGNNXJV-GOSISDBHSA-N 441.522 4.403 10 10 IICE CC1CCN(c2ccc(CNC(=O)Cc3ccc([N+](=O)[O-])cc3Br)cc2)CC1 1443664029 KUKOUELHNVGKHD-UHFFFAOYSA-N 446.345 4.453 10 10 IICE CCOc1cccc(CNC(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)c1 1459662123 JYQSZSDHVMQMOW-UHFFFAOYSA-N 438.549 4.241 10 10 IICE C[C@H](Oc1cccc(Cl)c1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460739746 IAHZIORNQJVEPR-LBPRGKRZSA-N 445.293 4.192 10 10 IICE Cc1ccc(C(=O)N2CCN(CCOc3ccccc3)CC2)cc1-n1c(C)cc(C=O)c1C 1463613774 WWGKHFOCOSXAKC-UHFFFAOYSA-N 445.563 4.052 10 10 IICE Cc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1N1CCOC1=O 1465670132 BLOXMVCMSWZRRT-UHFFFAOYSA-N 431.492 4.353 10 10 IICE CC(=O)NCCN(Cc1ccsc1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1467389365 WEFLSYPZWSVUOO-UHFFFAOYSA-N 437.565 4.055 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H](CCc2ccccc2)c2ccccn2)N(C)C)cc1 1471081675 FZBQBIYLJOTFCM-IZZNHLLZSA-N 445.611 4.424 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@H]1CCC2(CCOCC2)CO1 1473158085 FINLVAXHPLIYBA-OAQYLSRUSA-N 430.589 4.440 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O 1478690518 ICTWOZUQBYZMGC-MBSDFSHPSA-N 440.563 4.175 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)c(C)n1-c1ccccc1 1479064615 VERQSYHGTHPXQD-RUZDIDTESA-N 444.579 4.474 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1500534642 GTJSGXNBUKZEGI-FGZHOGPDSA-N 441.620 4.169 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)CCC1CCOCC1 1510674922 REFBGBXFXFCUCY-UHFFFAOYSA-N 434.588 4.016 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1513096520 AEJMHHVSVCPTNX-QGZVFWFLSA-N 432.576 4.012 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(=O)c(OCc2ccc(F)cc2)co1 1525762504 QXPIEIHZJNWIEV-KRWDZBQOSA-N 438.499 4.093 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccc4)cn3)cc2F)C[C@@H](C)O1 1526002568 FJRBCFSHDCFSQN-RTBURBONSA-N 449.526 4.343 10 10 IICE CN1CCN(c2ccc(CNC(=O)Cc3csc([C@H]4CC[C@H](C)CC4)n3)cc2)CC1 1533685107 VNVZTGADXVCZRR-KESTWPANSA-N 426.630 4.048 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cc1ccc(I)cc1 1540464963 ZNMRSUYPEHXPCN-UHFFFAOYSA-N 448.348 4.483 10 10 IICE CCN(CC)CCOc1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)ccc1OC 1542757710 RHAAUXNMLFGYNU-UHFFFAOYSA-N 430.526 4.294 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3c(c2)OCCN(C(=O)OC(C)(C)C)C3)c1 1545684155 LTVYEIMRLWWQEX-OAHLLOKOSA-N 442.512 4.021 10 10 IICE CCN(CC(C)C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1547394233 XDLSEDBEZNLEGC-VWLOTQADSA-N 443.636 4.224 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)Cc1cc(F)cc(F)c1 1559811166 DYOFMWUKJJNJGU-CQSZACIVSA-N 434.442 4.199 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)CC(C)C)cc1 1559919149 AMNNDDXNNXIDMV-WOJBJXKFSA-N 425.573 4.410 10 10 IICE Cc1cc(C(=O)NCc2cc(F)ccc2CS(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1566197632 CFIAQNAJPSPUCK-UHFFFAOYSA-N 448.947 4.361 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2[C@H]3CCCC[C@@H]3CCN2C(=O)OC(C)(C)C)c1 1595806527 NUSRYVNNJOUKOL-HPNQWNLUSA-N 432.561 4.394 10 10 IICE C[C@@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1612814575 YHFNCANJFIIUAO-LJQANCHMSA-N 425.621 4.112 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC3(CCOCC3)CO2)c(C)n1-c1ccccc1Br 1635878227 VTRKGTXPHZGNQK-KRWDZBQOSA-N 447.373 4.172 10 10 IICE Cc1cc(C(=O)NCC2(OCCO)CCCCC2)c(C)n1-c1ccc(Br)cc1 1639987269 OMDVNWZJKGHAPQ-UHFFFAOYSA-N 449.389 4.298 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3c(Br)ccc(F)c3C2)c([N+](=O)[O-])c1 1650950520 MOFOAJSDSVWYRO-XVNBXDOJSA-N 435.249 4.245 10 10 IICE COC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(Cl)cc1 1654308231 FWJWSLDYSYAOSJ-OAQYLSRUSA-N 448.906 4.031 10 10 IICE COC(=O)c1cc(OCc2csc(-c3ccc(OC)c(OC)c3)n2)ccc1N(C)C 1656825883 JBEMMUQBZKBKOJ-UHFFFAOYSA-N 428.510 4.259 10 10 IICE CC(=O)N(C)c1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cn1 1672991640 QLAOJMQFDUFWJM-HNNXBMFYSA-N 429.952 4.276 10 10 IICE CCc1cnc(CN(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)s1 1694560898 IYPKDTLPGUOHPZ-UHFFFAOYSA-N 428.581 4.139 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCS[C@H](C)[C@@H]2C)cc1 1710028180 RPAPMTNYLUXFEF-WAOWUJCRSA-N 429.634 4.354 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3Cc3sc(C)nc3C)CC2)cc1 1711865461 WLUYUCOEEOKACQ-UHFFFAOYSA-N 440.617 4.248 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)C[C@H]2CCCOC2)cc1 1728384272 MLKRCESABOGFKW-JOCHJYFZSA-N 448.615 4.021 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCO[C@](C)(C(C)(C)C)C2)cc1F 1729330222 VDUDEBVXIHBGNZ-YKSBVNFPSA-N 445.583 4.024 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C1CC1 1746012801 YSJYFBLTRQOHGA-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CCOC(C)(C)Cn1c(C2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1746606917 XDVVEBBMBXIYIW-UHFFFAOYSA-N 445.583 4.225 10 10 IICE CCOCc1nnc(N(C)[C@@H](C)c2ccco2)n1Cc1ccc(N2CCSCC2)cc1 1767758424 QKOFSGYPUQMLCE-SFHVURJKSA-N 441.601 4.207 10 10 IICE COC(=O)[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1769384022 VGPOADSZUQFXOV-OAQYLSRUSA-N 439.604 4.076 10 10 IICE CCCCC(=O)Nc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccn1 1860501375 CKYOMGHCHIGUKJ-UHFFFAOYSA-N 427.460 4.238 10 10 IICE COc1ccc(/C=C/C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1OC 1865909705 LUIUARRHCVLPTP-ARKLPKAPSA-N 437.584 4.126 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3cc(Br)cc(F)c3O)[C@H]2C1 1962831810 XSPBZPZBGYWMMR-PJODQICGSA-N 429.330 4.029 10 10 IICE CCN1CCc2cc([C@H](O)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999501441 AZNVCPJMWFXVGJ-GGAORHGYSA-N 426.557 4.213 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C3CC3)c(CO)c2I)cc1C 2079980367 CRXJJZBTIJBJGJ-GOSISDBHSA-N 438.309 4.179 10 10 IICE Oc1cccc(Br)c1CNCCc1cccc(I)c1 2273830923 HYBAEKOEGHEILY-UHFFFAOYSA-N 432.099 4.092 10 10 IICE CN(Cc1ccc(I)cc1)c1ccc(CN)c(Br)c1F 2280313530 ACXVYVDFYVYSMK-UHFFFAOYSA-N 449.105 4.288 10 10 IICE CCC1=NN2C(=N)C(=Cc3cccc(OCCOc4ccc(C)cc4)c3)C(=O)N=C2S1 2296660220 OZUOXBGREMWXCJ-UHFFFAOYSA-N 434.521 4.482 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)cc1C 2297330228 YAAXUHJNAMBOHV-UHFFFAOYSA-N 431.404 4.138 10 10 IICE O=C(NN1C(=O)/C(=C/c2cccc(Br)c2)SC1=S)c1cccs1 33337586 GUHDVOMISXYDKK-WQLSENKSSA-N 425.354 4.057 10 10 IICE CC1=NN2C(=N)/C(=C\c3cccc(OCCOc4cc(C)ccc4C)c3)C(=O)N=C2S1 33432419 LJXRTOXUYWJUCI-YCWTWADVSA-N 434.521 4.400 10 10 IICE COc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1NC(C)=O 435520575 CXTNKSDPIOANSO-UHFFFAOYSA-N 434.540 4.014 10 10 IICE CCn1cc(Br)c(=O)c(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)c1 544417336 AOVJMSDKRNWMTB-UHFFFAOYSA-N 446.345 4.101 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](C)C[C@H]3c3ccco3)cc2F)C[C@@H](C)O1 743876197 VXSJTAZSHQILHT-GBPOLFSSSA-N 443.563 4.122 10 10 IICE C[C@@H]1C[C@@H](c2noc(CCCN3C(=O)/C(=C\c4cccs4)SC3=S)n2)CCO1 762289110 NGHKFVIYOJYLFZ-XFUXPEIASA-N 435.596 4.248 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]3C)ccc21 762600666 ZTIGQYXIFSFFLC-KKSFZXQISA-N 443.588 4.280 10 10 IICE COc1cccc([C@H]2CCCN2C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 769037495 MYOKJPXYPSTYOG-AREMUKBSSA-N 448.611 4.274 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2ccc(O)c(-c3nc4ccccc4s3)c2)cc1 776744617 YGTRREMVRDMJKD-UHFFFAOYSA-N 440.502 4.256 10 10 IICE CCOC(=O)[C@H](NCc1cc(C)cc(Br)c1O)c1ccc(OC)c(F)c1 779186456 PKZGMJJMPBHOCL-QGZVFWFLSA-N 426.282 4.005 10 10 IICE COc1ccc(Cl)c(N2C(=O)/C(=C/c3c(Br)cnn3C)SC2=S)c1 779221184 QFXWAZCEIFZAHF-MLPAPPSSSA-N 444.763 4.250 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 798091939 UYJNJJJLHVAFCQ-UAPYVXQJSA-N 431.939 4.186 10 10 IICE Cc1c([C@H](C)NC(=O)NCc2cc(Br)ccc2O)cnn1-c1ccc(F)cc1 806432891 WEMOTQHYVHKADN-LBPRGKRZSA-N 447.308 4.348 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@H]1CCNC(=O)CC1 815041986 GYCRFQPPJBDJPY-BEFAXECRSA-N 433.474 4.214 10 10 IICE C[C@H]1c2ccsc2CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916631154 DBVAJMNPEVHYHJ-AWEZNQCLSA-N 439.503 4.432 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@H]1CCCCO1 1130494073 AZHSBDYDZLGACO-LMGNYNBYSA-N 438.640 4.193 10 10 IICE COc1nc(C)c(Br)cc1C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1132268045 RYEKADKWJUHUBQ-UHFFFAOYSA-N 428.330 4.499 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2c(Cl)cccc2Br)N(C)C)cc1 1134686549 OIQLQBWOTWXMAR-IBGZPJMESA-N 438.797 4.130 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)CC2)cc1 1136546611 ONOPCXWZQFVVLR-UHFFFAOYSA-N 442.274 4.448 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)cc1)C1CCCCC1 1142528227 NGKVTCMEDXLLPD-HXUWFJFHSA-N 433.618 4.382 10 10 IICE Cc1cc(C(=O)N2CC(=O)Nc3ccccc3C2)c(C)n1-c1ccccc1Br 1143396286 OZAGLNMYHOUAIZ-UHFFFAOYSA-N 438.325 4.451 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Br)c(F)c1C 1152401037 JBUGJFCNJPKNHH-UHFFFAOYSA-N 444.684 4.071 10 10 IICE C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1254716902 WFXQFKWWMTUZJI-QGZVFWFLSA-N 434.506 4.360 10 10 IICE Cc1cc(CC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1293168197 SGAATIUYMKZXGC-FQEVSTJZSA-N 425.573 4.400 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CC3)nnc2N2C[C@@H](C(F)(F)F)O[C@H](C)C2)cc1 1295414377 GSEKPXYYJIIVFM-BEFAXECRSA-N 437.510 4.206 10 10 IICE CSCCCCn1c(-c2cnn(C)c2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1302764858 RKFXVPYYNHNUSB-UHFFFAOYSA-N 439.633 4.058 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3c(=O)sc4ccccc4c3=O)c2C)cc1 1307328873 WTMMSDDCULLQRL-UHFFFAOYSA-N 434.517 4.112 10 10 IICE CC(C)CCOC1CCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1307443953 IQGYYHDWAZETCT-SFHVURJKSA-N 448.563 4.316 10 10 IICE CCCN(CCc1cccs1)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1307661559 VYSCNEZYDIGBKA-OALUTQOASA-N 447.620 4.072 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3C(=O)N(C)Cc4ccccc43)cc2Cl)C1 1312591578 YELWZIVDGLXFGE-AOMKIAJQSA-N 440.975 4.089 10 10 IICE CN(Cc1ccon1)c1nnc(Cc2ccsc2)n1CCCSc1nccs1 1314778956 BUFGCVPDLCADAL-UHFFFAOYSA-N 432.600 4.194 10 10 IICE COCC1(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)CCCCC1 1315850070 RMRVFRUWBOEKSV-UHFFFAOYSA-N 435.572 4.203 10 10 IICE CS(C)(=O)=Nc1ccccc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354769138 ZAKMDBBOMBNQLZ-OAHLLOKOSA-N 437.512 4.046 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(F)cc1F 1355706991 BSVORJZGTVFVRJ-UHFFFAOYSA-N 442.428 4.414 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cc(Cl)ccn2)n1Cc1ccc(N(C)C)c(F)c1 1359779253 HKSKYFQHNQAOIN-UHFFFAOYSA-N 430.959 4.415 10 10 IICE C[C@H](c1cccnc1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1434936162 BCCMXOWEYDFFKU-IIMQCXAKSA-N 429.542 4.032 10 10 IICE CC[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccc(F)cc1 1435649301 RFVQRQYXZKJJQQ-LJQANCHMSA-N 432.407 4.390 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCCC[C@H]2COC(=O)NC(C)C)CCCC1 1436171084 NRJTWAHHRKCAIF-SFHVURJKSA-N 441.572 4.044 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c(C)n1-c1ccc(Br)cc1 1448920785 JOPOBNSJAUVDNI-LBUQITIBSA-N 447.373 4.265 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C/C=C\c2ccc(Br)cc2)N(C)C)cc1 1463279694 JNWULSCEAHBIFO-QEVIJRNUSA-N 430.390 4.338 10 10 IICE COc1ccc(N2CCN(C(=O)CCC(=O)c3ccc(CC(C)C)cc3)CC2)cc1F 1465930561 WPQSAIIFKNQMGS-UHFFFAOYSA-N 426.532 4.345 10 10 IICE CC(C)c1nnc(N(C)Cc2nccs2)n1Cc1ccc(N2CCSCC2)cc1 1508916119 OCFGEPFXCYYJJF-UHFFFAOYSA-N 428.631 4.096 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1CCC=C(Br)C1 1510675617 SYXQPMHXKNTPGE-UHFFFAOYSA-N 441.377 4.185 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)Cc1cc(Cl)ccn1 1510675892 VVEYGRMEFLZHRS-UHFFFAOYSA-N 447.974 4.448 10 10 IICE CC[C@@H](C)c1nnc(N(C)C[C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1512823902 ZREZYQMMUNGUAL-KNQAVFIVSA-N 443.661 4.398 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cncn1 1514447922 LRYBLNJKNXLTIY-UHFFFAOYSA-N 432.576 4.271 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1Cc1cscc1C(F)(F)F 1517148523 PKWJAVMZPSZRBG-UHFFFAOYSA-N 446.458 4.206 10 10 IICE Cc1ccc([C@H](NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)[C@H](C)S(C)(=O)=O)cc1 1519787732 UKAZJXGKZRKGDF-NBGIEHNGSA-N 438.593 4.236 10 10 IICE CS[C@@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1520125823 SSDHNSDNEKKKAN-OAQYLSRUSA-N 429.634 4.008 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)c1 1540956068 MLOIRICLBWCXTI-UHFFFAOYSA-N 439.556 4.378 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1[C@H]1CCC[C@@H](C(F)(F)F)C1 1541639193 ZANWSWYRTNEJAZ-CVEARBPZSA-N 439.482 4.052 10 10 IICE CCCN(C(=O)c1cccs1)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1545522759 ZHDNJBLYAIQMTN-UHFFFAOYSA-N 427.530 4.068 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@]3(C)CCCS3)CC2)cc1F 1554960163 BFTQMRWRMZPUAS-HSZRJFAPSA-N 447.624 4.237 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C(C)C)c(C)n1-c1ccc(Br)cc1 1559349633 FSGHIXBHZHGSRS-UHFFFAOYSA-N 434.363 4.399 10 10 IICE CC(=O)N1CC[C@@H](C)c2ccc(S(=O)(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)cc21 1561150272 AZUIJPYBFPOMOE-GOSISDBHSA-N 443.613 4.212 10 10 IICE COc1cccc([C@H]2CN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CCO2)c1 1566291466 MOBZAFJGGZZCJG-RUZDIDTESA-N 432.520 4.058 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)C[C@@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1611935467 RSNXFPXDTOJGPI-RTBURBONSA-N 448.615 4.313 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613375957 PNOOYJXHATYDKT-HXUWFJFHSA-N 448.615 4.079 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCOCC2)cc1 1614362722 QCIZFHCQOGZWHF-HXUWFJFHSA-N 436.604 4.041 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccccn3)CC2)c(C)n1-c1ccccc1Br 1618155360 AWKRPLVWFOAZEU-UHFFFAOYSA-N 439.357 4.214 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC[C@@H]2CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1618252212 BCXQJONKUJHWCG-NVXWUHKLSA-N 444.403 4.409 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1628667634 YVRNSJVLYVWYOV-NJGYHNCTSA-N 433.335 4.410 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1 1630497964 ZCGWNXRPKKMDCU-JOCHJYFZSA-N 435.955 4.498 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1cccc(Cl)c1 1633290382 JBHDFSSRWALTCU-HXUWFJFHSA-N 425.891 4.422 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c(C)n1-c1cccc(Br)c1 1634690516 ZPHOLRTZUPCQRB-YHEJKZAPSA-N 447.373 4.265 10 10 IICE Cc1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c(O[C@H]2CCOC2)c1 1636156429 UNIGJPYXMUWXHW-QFIPXVFZSA-N 432.520 4.313 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c[nH]nc3-c3cccc(OC(F)F)c3)CC2)cc1 1636702223 IGKOMABZVIKSGB-UHFFFAOYSA-N 442.466 4.039 10 10 IICE CCOC(=O)Cc1cccc(N(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1640506886 CHXYESMUQZHBIT-UHFFFAOYSA-N 432.520 4.218 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCCN2C(=O)C(F)(F)F)c(C)n1-c1ccc(Cl)cc1 1643544208 LDWQCHYGLSZWOD-KRWDZBQOSA-N 441.881 4.421 10 10 IICE CCOC(=O)[C@@](C)(NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1644930490 WMYCIBYCLIKGAA-SANMLTNESA-N 432.520 4.044 10 10 IICE Cc1ccc(F)c(CN(C)[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1653449028 MMAGRHIQIBRUSX-INIZCTEOSA-N 430.479 4.369 10 10 IICE Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1683195819 PGNDOTIQTDDASO-IEBWSBKVSA-N 429.511 4.197 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](c1nc(-c2ccncc2)no1)C(C)C 1683421289 LIBDOERTDACGJX-UTKZUKDTSA-N 436.560 4.134 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(Cc2ccncc2)n1CCOC(C)(C)C 1696685043 SXBRPGCMBLASNO-UHFFFAOYSA-N 448.615 4.316 10 10 IICE CC(C)c1nnc(N(C)[C@H]2CCCc3c2cnn3C)n1CCCSc1nccs1 1706278994 YXGXEKJYYCMKPF-INIZCTEOSA-N 431.635 4.288 10 10 IICE CC(C)CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1706486568 ZXWLQQRJUJXGDU-OAQYLSRUSA-N 429.634 4.213 10 10 IICE CCCN(C)c1nnc([C@@]2(OCC)CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1709682469 JAXQLTZHEKPTCJ-RUZDIDTESA-N 441.620 4.061 10 10 IICE COCC(C)(C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1712123478 WIALQBHVRKBDOR-UHFFFAOYSA-N 441.620 4.081 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)[C@H]1C 1726777059 ZOOZDFCAINRSKD-SOUVJXGZSA-N 425.649 4.099 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1726902894 AWIYDXAYEJPJCA-CEXWTWQISA-N 429.584 4.440 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnc(C)s1 1730718438 QRZHBGLVRUEXLW-UHFFFAOYSA-N 436.585 4.248 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)C[C@H]2CCCOC2)cc1 1746089597 DALPKUJCZNRNMC-OAQYLSRUSA-N 434.588 4.097 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1Cc1cscc1C(F)(F)F 1747750112 LMZNXJISKMEDEX-CQSZACIVSA-N 438.475 4.253 10 10 IICE CN(C[C@@H]1CCCCO1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1767223229 CQJCGZZCNCWIHH-IRXDYDNUSA-N 437.635 4.164 10 10 IICE COc1cc(/C=C2/SC(=S)N(C(C)(C)C(=O)O)C2=O)ccc1OCc1ccccc1 1858593997 GTUHDHSKOSJPEZ-LDADJPATSA-N 443.546 4.339 10 10 IICE COc1ccc(CC(=O)N(c2cccc3c2C(=O)c2ccccc2C3=O)C(C)C)c(OC)c1 1859889469 LEVHOJKOKIBWNO-UHFFFAOYSA-N 443.499 4.463 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@@H](CNCc2cc(Br)cc(F)c2O)C1 2102324974 JVSKDBDIEJXJSR-ZDUSSCGKSA-N 431.346 4.421 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(OC)c2)C(=O)C1=Cc1ccc(SC)cc1 2294037455 HIBSYAHMJJWYIM-UHFFFAOYSA-N 425.506 4.303 10 10 IICE COCCN1C(=O)C(=Cc2cc(C(C)C)c(OC)cc2C)C(=O)N(c2ccccc2)C1=O 2294516829 JBDPEMPCTRPVOJ-UHFFFAOYSA-N 436.508 4.152 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H]2CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2381129239 HHAZJVFVCXDWLJ-OAHLLOKOSA-N 441.366 4.211 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381130401 YKZUJFYISKUXOY-CTYIDZIISA-N 441.366 4.115 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)c2C)cc1C 8634493 XAMZSNUGDJNBBX-AREMUKBSSA-N 429.520 4.361 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CC=C[C@H]21 14471235 AVPLTBQWZCPHJR-BXTJHSDWSA-N 427.888 4.451 10 10 IICE CCN(C)c1ccc(/C=C2\C(=O)N(c3ccc(Br)cc3)C(=O)N=C2O)cc1 33410909 ILJDYQDNOGQZRK-ATVHPVEESA-N 428.286 4.412 10 10 IICE Cc1ccccc1/C=C1\SC(=S)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 47152199 REZIFLTXQMUFFR-ATVHPVEESA-N 427.507 4.133 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3ccc(C(C)C)cc3)n2)cc1 731059181 ZOWAHPRWZMZCRS-UHFFFAOYSA-N 443.594 4.413 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCC(NC(=O)c3ccccc3C)CC2)cc1F 731364377 YXBOXPCZYLFDHJ-UHFFFAOYSA-N 440.563 4.084 10 10 IICE Cc1cc(C(=O)CN2CCn3c(Cc4ccccc4)nnc3C2)c(C)n1-c1ccc(F)cc1 741796106 VCMHPZQXXSKGKX-UHFFFAOYSA-N 443.526 4.114 10 10 IICE CC(=O)NCc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(C)c(C)c3)c2C)s1 743154069 SZESYGQKPKJGKY-UHFFFAOYSA-N 438.549 4.448 10 10 IICE COc1ccc(N2CCC(NC(=O)NC[C@@H]3CCCN(C)[C@@H]3c3cccs3)CC2)cc1 745795669 IBXUMZBRAUTXNR-MBSDFSHPSA-N 442.629 4.108 10 10 IICE COC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)cc1 747857445 NDAWFQIQFIEHRN-LFYBBSHMSA-N 432.498 4.245 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 763774208 UHHKZJYAKKMEHS-TZIWHRDSSA-N 428.916 4.305 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)Cn2ncc3ccccc3c2=O)c(C)n1-c1ccc(Cl)cc1 764237392 POKZIWVXPKKQOS-INIZCTEOSA-N 448.954 4.205 10 10 IICE COc1cc(O)c(CN[C@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)cc1OC 783602277 CDPRMVWJIJAVRB-JTSKRJEESA-N 436.911 4.042 10 10 IICE Cc1nc2ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)cc2o1 792200319 WIFMOSZQKTWGQT-FQEVSTJZSA-N 438.528 4.198 10 10 IICE O=C(c1cnn(Cc2ccccc2)c1Cl)N(Cc1ccccc1O)C[C@H]1CCCO1 802840080 RUQKBUCQYKOVQR-LJQANCHMSA-N 425.916 4.112 10 10 IICE C[C@H]1CN(c2ccc(CNS(=O)(=O)Cc3ccc4ccccc4c3)cc2F)C[C@@H](C)O1 809808973 DLDIEFCYSQOTRA-HDICACEKSA-N 442.556 4.212 10 10 IICE CN(Cc1ccccc1O)c1nnc(COc2ccc(Cl)cc2)n1C[C@H]1CCCO1 812295436 YHGNLJSAQHMSSM-LJQANCHMSA-N 428.920 4.032 10 10 IICE COc1ccc(N2CCCN(c3nnc(CCC(C)C)n3C[C@H]3CCCCO3)CC2)cc1 812430847 SPBVELNKXPTEFC-HSZRJFAPSA-N 441.620 4.161 10 10 IICE COc1ccc(N2CCC(NC(=O)CC[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1125816638 PFKMZKMIYYPCKN-IBGZPJMESA-N 445.604 4.208 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1c(Cl)cccc1OCC1CC1 1129660059 HGKSHYDUPHXCAM-UHFFFAOYSA-N 436.886 4.174 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(F)cc4)CCCCC3)CC2)c(OC)c1 1132032069 IUPXGJKHCYOKPF-UHFFFAOYSA-N 426.532 4.394 10 10 IICE CN1CCN(c2ccc(CNC(=O)C(F)(F)c3cc(Cl)ccc3Cl)cc2)CC1 1133127507 RLCCONMFCVPJTG-UHFFFAOYSA-N 428.310 4.153 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H](c1ccccn1)C1CC1 1133947819 ZCBTYRIHRIBMAP-XEYRCQSKSA-N 443.619 4.392 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](c3cccc(C)c3)c3ccccn3)C2)cc1 1225430771 QOIGTKJSILDXHJ-CJFMBICVSA-N 430.552 4.314 10 10 IICE CC(=O)N1CCCCC[C@H]1C1CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251980947 DTCMUGOUYJKYOL-CPJSRVTESA-N 442.648 4.205 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@]12CCN(C(=O)OC(C)(C)C)C2 1251990021 RARNKIXCJVUDPM-KBMIEXCESA-N 444.620 4.177 10 10 IICE Cc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1-c1cnn(C)c1 1264992691 IQOMOUAERNGXLX-UHFFFAOYSA-N 440.494 4.396 10 10 IICE Cc1ccc(F)c(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1293793523 QKEHEILUPVXTJQ-NRFANRHFSA-N 429.536 4.125 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(C(=O)OC)ccc1Cl 1294684062 DBVVZGFKJXODQF-UHFFFAOYSA-N 426.694 4.257 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@@H](Cc3ccccc3)c3ccccn3)CC2)cc1 1313423132 CADPBAFQBGCEQP-HSZRJFAPSA-N 444.579 4.338 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1 1313679295 QWLDWJVGAYZVTD-JOCHJYFZSA-N 425.621 4.376 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1[C@H]1CCC[C@@H](C(F)(F)F)C1 1314750900 MTYQFLKEXALDKQ-CVEARBPZSA-N 432.450 4.371 10 10 IICE COC(=O)c1cnn(CC(=O)Nc2nc(-c3cc(C)n(-c4ccc(C)cc4)c3C)cs2)c1 1350110182 FPYNRVMMGXRIMY-UHFFFAOYSA-N 449.536 4.148 10 10 IICE CN(C)c1ccc(CNC(=O)COc2ccc(C(=O)c3ccc(Cl)cc3)cc2)cc1F 1351737510 CSHOJQDITMXHSC-UHFFFAOYSA-N 440.902 4.471 10 10 IICE C[C@@H]1[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 1352925812 HDWJTRABWBNAFE-CRAIPNDOSA-N 443.510 4.289 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)N[C@H](C)c1ccc(N3CCOCC3)cc1)O2 1442408216 GHUYMJUOUUPTSK-BCHFMIIMSA-N 438.568 4.115 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)C(=O)NCC3)c(C)n1-c1ccccc1Br 1450707498 JLAZOZQBLMGHPU-UHFFFAOYSA-N 438.325 4.395 10 10 IICE COc1ccc(O)c([C@H](C)N[C@@H]2CCCN(c3ccc(Br)c(C)c3)C2=O)c1 1459850546 NEYFFBBZFWLYMZ-IFXJQAMLSA-N 433.346 4.318 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(Cc3cnn(Cc4ccccc4)c3)C(C)C)C2)cc1 1470774218 YBPAMYBUSYNPNU-HSZRJFAPSA-N 447.583 4.139 10 10 IICE Cc1cc(C(=O)Nc2ccnn2[C@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1472261648 KPZCUAPUKWOGNH-INIZCTEOSA-N 444.333 4.052 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@H](CCc2ccccc2)C(F)F)N(C)C)cc1 1479535635 XWHSZCNFRKYYMI-YADHBBJMSA-N 432.559 4.263 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1509039485 SHKQRMAYBMCTML-OAQYLSRUSA-N 425.621 4.333 10 10 IICE COCOc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1520056682 NPCLPXJFZSMMQT-LDADJPATSA-N 446.525 4.038 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)c1 1542323553 FRVWGTJYXMVIMG-UHFFFAOYSA-N 439.515 4.047 10 10 IICE CN1CCCc2cc(CNC(=O)C3(C4CCN(C(=O)OC(C)(C)C)CC4)CC3)ccc21 1542389580 HITOUAPVLKRBRN-UHFFFAOYSA-N 427.589 4.113 10 10 IICE CC[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)[C@@H](O)c1c(F)cccc1F 1545596734 YFSXLPNWMXPIAV-CJFMBICVSA-N 442.506 4.435 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc(Cl)cc1Cl 1546152165 VLDVWLARMNNADL-UHFFFAOYSA-N 430.715 4.487 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCN1CCOCC1 1546780958 RTQGPXKHZXOUNL-UXBLZVDNSA-N 448.615 4.087 10 10 IICE Cc1cc(C(=O)NC[C@@](C)(O)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1556190716 MFWIRLZFHDPKEF-OAQYLSRUSA-N 434.378 4.313 10 10 IICE Cc1cc(C(=O)NCC2CCN(C3CC3)CC2)c(C)n1-c1ccccc1Br 1556435214 HGZLPPOCNZZACU-UHFFFAOYSA-N 430.390 4.461 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CN3CC[C@@H](c4ccccc4)NC3=O)c2C)c1 1557887705 LERBCYZUFNNTND-DEOSSOPVSA-N 430.552 4.175 10 10 IICE Cc1cc(C(=O)N2CC(C(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(Br)c1 1558807445 DYDHRRJYPHTLCV-UHFFFAOYSA-N 433.346 4.270 10 10 IICE COc1ccc(CNC(=O)c2nc(C(C)C)n(-c3c(Cl)cccc3Cl)n2)c(O)c1 1568097570 MFMLSUMZVINTIT-UHFFFAOYSA-N 435.311 4.342 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3OCCO[C@@H]3c3ccccc3)cc2Cl)C1 1586082367 OXKDYUCIUSTWJA-JJEOQYAHSA-N 428.960 4.349 10 10 IICE Cc1cc(C(=O)N[C@@H](Cc2ccccc2)c2nc(O)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1587153440 BDZBZAABLKWWCK-FQEVSTJZSA-N 435.915 4.285 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3nccn3CCc3ccccc3)c2C)cc1 1587830127 FZCIRBPMEYGJOJ-UHFFFAOYSA-N 428.536 4.472 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C/c1ccsc1C(F)(F)F 1597567598 SWBRMFMBBBOIKI-GORDUTHDSA-N 433.835 4.341 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(N(C)C)ncnc32)c(C)n1-c1ccc(C(C)(C)C)cc1 1613527642 SOQQRHVFOAOJCZ-UHFFFAOYSA-N 430.556 4.480 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(Cl)cc([N+](=O)[O-])c3=O)c2C)cc1 1613623236 MTQQCBPTDVYTOM-UHFFFAOYSA-N 429.860 4.099 10 10 IICE COc1ccc(N2CCCN([C@@H](C)C(=O)Nc3ccc(Br)c(C)c3)CC2)cc1 1615219909 UTAOJZBWBCTRHR-KRWDZBQOSA-N 446.389 4.305 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCC[C@H]2NS(C)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1623726156 ZHTCJWZVICQHLN-NFBKMPQASA-N 445.629 4.055 10 10 IICE Cc1ccc(C(=O)NCc2ccnc(OCC(F)(F)F)c2)cc1-n1c(C)cc(C=O)c1C 1624672435 IYCVYVXPPUWBRP-UHFFFAOYSA-N 445.441 4.481 10 10 IICE Cc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1C 1626169771 ZZRIPQYHEVVUSR-INIZCTEOSA-N 427.976 4.239 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cccc(S(=O)(=O)C(F)(F)F)c3)cc2)CC1 1633110932 MILJYYYTLWIIPJ-UHFFFAOYSA-N 440.487 4.146 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 1648606771 XYAZFDWTGPNZOB-MRXNPFEDSA-N 427.715 4.273 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CC2(CCOCC2)Oc2ccccc21 1682101724 VCOIIHLVTZMIKR-XXBNENTESA-N 437.584 4.364 10 10 IICE CO[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1(C)C 1697687795 YFXHJVGZTOAGDS-NRFANRHFSA-N 425.621 4.159 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H](C)C1 1709839283 BERIFMFOQKBBDK-OALUTQOASA-N 448.615 4.361 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1741585648 VUGAERMAGRKDFS-SIKLNZKXSA-N 445.583 4.024 10 10 IICE CN(OC1CCCC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1748003383 SHHSDXRGHJZEFN-UHFFFAOYSA-N 445.583 4.201 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](OC)C(C)(C)C 1749750672 UVAVHWPYIVGLST-QFIPXVFZSA-N 439.604 4.496 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N(C)CC1COC(C)(C)OC1 1751433132 SYUGTYXGGMPBLG-UHFFFAOYSA-N 443.636 4.125 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1Cl 1858074400 ISUOEYKGJPIWEN-QFIPXVFZSA-N 436.021 4.220 10 10 IICE CCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1-c1ccc2c(c1)CCCC2 1862358943 XAYZDZMQTAMJHP-UHFFFAOYSA-N 444.579 4.420 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C(C)C)c(C(=O)O)c1I 2079992455 DHVIRILABSDSBE-GFCCVEGCSA-N 444.269 4.023 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3cc(Br)ccc3O)C(C)(C)[C@H]21 2119292864 HDTZMWICRWJDEE-PVAVHDDUSA-N 425.367 4.278 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](C2CC(NCc3ccc(Br)cc3O)C2)C1 2265430162 ZTTILVOWPISMTL-UQPPLGOBSA-N 425.367 4.280 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccccc3F)C2=O)ccc1OCc1ccccc1 2297339114 OAIOEOFXQOIUIS-UHFFFAOYSA-N 446.434 4.080 10 10 IICE Cc1ccc(CN[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)c(O)c1Br 2307569073 HCVHIVFMVLDKPT-OAQYLSRUSA-N 433.346 4.354 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352674827 ZTOFXESAYVEVHX-CYBMUJFWSA-N 429.355 4.115 10 10 IICE CCCCCNC(=O)c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc2ccccc12 23329754 VXFXGWVIJYDCLK-UHFFFAOYSA-N 432.568 4.490 10 10 IICE CCCN1C(=O)/C(=C2/SC(=S)N(CCCCCC(=O)OCC)C2=O)c2ccccc21 206718625 XMIWCBTXUKKNNM-VHEBQXMUSA-N 446.594 4.138 10 10 IICE Nc1c(C(=O)OCc2csc(-c3ccoc3)n2)ccc2c1C(=O)c1ccccc1C2=O 731059715 KQUJCQYTBWIMHM-UHFFFAOYSA-N 430.441 4.118 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ncc(Br)cc1Br 759621545 MZISWFLWZDSUIK-UHFFFAOYSA-N 441.167 4.335 10 10 IICE C[C@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@H](C[C@@H]2CCCc3ccccc32)C1=O 761160110 OTGSPODCEMIDCY-UTSGNWPNSA-N 433.552 4.015 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C)ccc21 805269370 SRQQTMWTMZEDLM-PXNSSMCTSA-N 429.561 4.032 10 10 IICE COC(=O)c1coc(-c2noc(-c3cc(C)n(-c4ccc(Br)cn4)c3C)n2)c1 904955011 OFSHTHPTCNLQEC-UHFFFAOYSA-N 443.257 4.348 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccncc1 1126373566 FJTVEQBRGPPXRB-NAVNFMRLSA-N 429.542 4.080 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCN2CCN(c3cccc(Cl)c3)CC2)cc1F 1136730075 BEPUFJDNKIEHEU-UHFFFAOYSA-N 446.998 4.154 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1 1137047194 IXZNSDOEPWTKOA-UHFFFAOYSA-N 445.563 4.045 10 10 IICE Cc1noc(COc2ccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)cn2)n1 1142528280 POHRYJFPQPZHDV-UHFFFAOYSA-N 435.528 4.051 10 10 IICE Cc1ccc(C(=O)N[C@H](CC(N)=O)c2ccc(Cl)cc2)cc1-n1c(C)cc(C=O)c1C 1148869476 UFVDIRGCHVIFCM-OAQYLSRUSA-N 437.927 4.215 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCc2c(O)ccc3c2CCCC3)cs1 1150385719 CRMFFGMCPQPWQI-CYBMUJFWSA-N 431.558 4.243 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H](C)NC(=O)c3ccccc3)cc2Cl)C1 1155726752 MCWRUHSFNQJGRG-ZWKOTPCHSA-N 427.976 4.401 10 10 IICE C[C@]1(NC(=O)C(F)(F)F)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1175577205 HQLGEFYHJJMDBW-FQEVSTJZSA-N 433.434 4.183 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C1 1230196293 XUKWGHMLIRARSE-SLYNCCJLSA-N 446.636 4.184 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ncccc1Br 1256384593 RGTRZADIOQIFTE-UHFFFAOYSA-N 443.139 4.044 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(CC)C2CCCC2)cc1 1295411934 ZISZAEOTJRKCGP-UHFFFAOYSA-N 426.609 4.080 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1305285089 IBJCYHOXZBXKNB-NRFANRHFSA-N 441.620 4.081 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@@H]2CCCCO2)c(C)n1-c1ccc(Br)cn1 1452671627 OJURNLJKMMQMBH-AZUAARDMSA-N 432.362 4.329 10 10 IICE CCc1cc2c(=O)n(CC(=O)c3cc(C)n(-c4ccc(C(=O)OC)cc4)c3C)ccc2o1 1459130278 CPIRKWQBYHWIHQ-UHFFFAOYSA-N 432.476 4.234 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc2cncc(Br)c2n1 1460980096 CXVIDIHROHSGEM-AWEZNQCLSA-N 427.346 4.128 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSc2nc(-c3cccc(C)c3)no2)cc1F 1465003415 BSPHQWMZTYHEON-UHFFFAOYSA-N 428.533 4.439 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(C(=O)OC(C)(C)C)CCCCCC3)CC2)cc1 1466210090 CYNBDMMXQBZPAV-UHFFFAOYSA-N 430.589 4.416 10 10 IICE COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)NCc1c(O)ccc2ccccc12 1472086022 IMPFETCQJAPNKQ-FQEVSTJZSA-N 438.911 4.128 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC2(c3ccc(C(F)(F)F)cc3)CC2)N(C)C)cc1 1479535549 WKDMIHLVEJCPPQ-FQEVSTJZSA-N 434.506 4.363 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)COC)CC1 1518812623 IMIFYTOUTACQKA-IBGZPJMESA-N 449.599 4.418 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1nn(-c2cc(Cl)ccc2F)c2c1CCC2 1530833912 WWQPLXPPCJRARQ-UHFFFAOYSA-N 426.923 4.458 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccccn1 1556308453 WDEXCYLHWXTPEK-HSZRJFAPSA-N 425.916 4.351 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H]2CCCO2)c(C)n1-c1ccc(Br)cc1 1558607678 YBEWJZYWNUTEMY-WOJBJXKFSA-N 447.373 4.267 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 1564446434 SXNJDDHJENASSW-FUHWJXTLSA-N 432.971 4.363 10 10 IICE CC1(C)CC[C@@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)N(C(=O)OC(C)(C)C)C1 1565210180 VYPOUAZJDDJZHF-SFHVURJKSA-N 445.604 4.496 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N1CCSC[C@@H]1C1CC1 1583270360 NZJORSNASLSUHJ-YLQKULKDSA-N 438.665 4.084 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C[C@@H](O)C(Cl)(Cl)Cl)cc1 1585493603 WICXHWHDFXTYGO-GOSISDBHSA-N 445.774 4.416 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1cc(C(F)(F)F)ccn1 1626510832 BGAJVTMFJCJJNB-UHFFFAOYSA-N 437.462 4.032 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-c2ccccn2)nc1 1626511363 LIZYPZWILUISLK-UHFFFAOYSA-N 432.524 4.146 10 10 IICE Cc1cc(C(=O)N2CC(Oc3ccncc3)C2)c(C)n1-c1ccccc1Br 1627065040 PLFXMLRVKBGIFW-UHFFFAOYSA-N 426.314 4.155 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(C3CC3)c(C)cc2=O)cc1 1627421322 OIRVMPFBMYNUOH-UHFFFAOYSA-N 431.536 4.413 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc3cc(Br)cnc3n2C)cc1F 1627604968 WJZQEYXIFOGTPF-UHFFFAOYSA-N 433.325 4.251 10 10 IICE CCNC(=O)COc1cccc(CNC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c1 1630612597 WYODPXKNXJVUEL-UHFFFAOYSA-N 433.552 4.156 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc3cnccc3c2)NC(=O)OC(C)(C)C)cc1 1634161604 ACKDUQRAOWAZFD-QFIPXVFZSA-N 434.540 4.297 10 10 IICE C[C@@H](NC(=O)[C@@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)c1ccccc1O 1635793725 FHUIIVVPBBHHIT-ACJLOTCBSA-N 449.320 4.166 10 10 IICE O=C(C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)N1Cc2cccc(O)c2C1 1643169317 QJWVMDUDDIUQCH-UHFFFAOYSA-N 425.838 4.218 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)NCc1ccc(Cl)cc1 1644584513 OGXLTFVYKWPGQM-UHFFFAOYSA-N 443.975 4.434 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)c1cn(C)nn1 1652502556 JKRXNAXMPPFVPZ-UHFFFAOYSA-N 434.363 4.072 10 10 IICE COc1cc2c(c(OC)c1)N(CC(=O)NCC1(c3ccc(F)cc3)CCCC1)CCC2 1654741441 HNQVCYGNMFWVEE-UHFFFAOYSA-N 426.532 4.224 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCO[C@H](c2ccc(Cl)s2)C1 1693004492 QXAVFHBITXTXGU-SFHVURJKSA-N 431.993 4.302 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C[C@@H](C)S1 1693824028 PGQFUEZWVMGFKR-HZPDHXFCSA-N 446.671 4.233 10 10 IICE CC(C)Cc1nnc(N2CCC([C@@H]3CCOC3)CC2)n1CCCSc1nccs1 1741451689 MDOFGTXWDYUWAZ-GOSISDBHSA-N 435.663 4.368 10 10 IICE CC[C@@H](C)c1nnc(N2CCS[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743803101 LJEGSKMQNIZUKV-QZTJIDSGSA-N 431.675 4.335 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1F 1747572906 QYPWIUDNRVSNIF-NRFANRHFSA-N 429.584 4.440 10 10 IICE CN(CCOC(C)(C)C)c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1747980336 GZNLXDOGXRCYOY-INIZCTEOSA-N 439.651 4.062 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752742261 JIEBKHIBZNYLQC-MOPGFXCFSA-N 429.584 4.442 10 10 IICE C[C@H]1CN(c2nnc(-c3cccc(Cl)c3)n2CCCSc2nccs2)CCO1 1763073238 CGDLZWQETZHQMO-AWEZNQCLSA-N 436.006 4.463 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)Cc2ccoc2C)cc1 1764934862 KLRYUZCYVLUJQT-UHFFFAOYSA-N 433.560 4.111 10 10 IICE CCCCCN(c1nnc([C@@H]2CCC(=O)N2)n1Cc1ccc(N(C)C)cc1C)C(C)C 1765666213 JAQWKRVGOXZRFZ-NRFANRHFSA-N 426.609 4.057 10 10 IICE CCSCCCn1c([C@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1768400392 XKLWLVPSFGWSDM-QGZVFWFLSA-N 435.613 4.409 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)cc1OC 1860084366 MGXJPFKVTPDNGY-RQZCQDPDSA-N 432.479 4.026 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(O)c3cccc(F)c3n2)N2CCCCC2)cc1 1866484837 DHKBUIZWWAIIFO-QFIPXVFZSA-N 436.531 4.103 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(NCc3cc(Br)cc(F)c3O)C[C@@H]2C1 1967824120 FIIOIFJZHLWZBW-BFUOFWGJSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(NCc2cc(Cl)cc(Br)c2O)C1 2033965975 DJPZQJXKATZNSV-XIKOKIGWSA-N 431.758 4.297 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2(NCc3cc(Br)ccc3O)CC2)C1 2097027669 PEYFEHZBWRILJU-HNNXBMFYSA-N 425.367 4.424 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=C(C)Nc2cccc(C)n2)cc1 2313683100 RRNXFFNOHKRJOX-UHFFFAOYSA-N 443.463 4.444 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CNC(=O)OC(C)(C)C)CC2CC2)c(O)c1Br 2381137410 NRBWBOZXGFQXPL-OAHLLOKOSA-N 441.366 4.020 10 10 IICE O=C1N=C(O)/C(=C/c2cc3c(cc2Br)OCO3)C(=O)N1c1cccc(Cl)c1 59860103 BCYDWSYQVBGTOL-QCDXTXTGSA-N 449.644 4.338 10 10 IICE O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCCOc1ccccc1-c1ccccc1 97553967 QXVNSDXETLQGGK-NTCAYCPXSA-N 428.532 4.399 10 10 IICE C[C@]12C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1ON(c1ccccc1)[C@H]2c1ccccc1O 103561156 GDRSKIHXMKXIFJ-AWRGLXIESA-N 434.879 4.487 10 10 IICE CC[C@H](C)Sc1ccc(NC(=O)NCc2ccc(N3CCNC(=O)C3)cc2)c(C)c1 109676693 ZALFMHDTUDYLMN-KRWDZBQOSA-N 426.586 4.144 10 10 IICE O=C(c1c(-c2cccnc2)cc(=O)n2c1CCCC2)N1CCC(Cc2ccccc2)CC1 581799759 VYYXOJJLYSQXTM-UHFFFAOYSA-N 427.548 4.342 10 10 IICE C[C@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@H](c2ccccc2)O1 726720651 ZAABRHCFAIRIPT-HTAPYJJXSA-N 445.510 4.428 10 10 IICE Brc1ccc(C2(NCc3ccc(N4CCOCC4)cc3)CCOCC2)cc1 742372863 JIBDZLGLKTZVSB-UHFFFAOYSA-N 431.374 4.081 10 10 IICE O=C(CCOc1cccc(Cl)c1Cl)NCc1ccc(N2CCC(O)CC2)c(F)c1 749405167 DFIWYWPZRDVLGF-UHFFFAOYSA-N 441.330 4.179 10 10 IICE CCOC(=O)c1c(NC(=O)CCN[C@H]2CCOC[C@@H]2C)sc(C)c1-c1ccccc1 763921604 VGFMAKKUMOLXDB-YJBOKZPZSA-N 430.570 4.243 10 10 IICE COc1ccc(C(=O)CCC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Cl)c1 779891011 UJCGRFLOSNKIPQ-MRXNPFEDSA-N 430.932 4.026 10 10 IICE O=C(CCC(=O)Nc1nnc(C2CCCCC2)s1)NCc1ccc(N2CCCC2)cc1 786957721 YRPXZLIFWFXAPE-UHFFFAOYSA-N 441.601 4.221 10 10 IICE Cc1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)c(C)s2)c(C)s1 799187626 XKVXYRDXKJWDQW-UHFFFAOYSA-N 433.580 4.482 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2csc(-c3cnn(-c4ccccc4)c3)n2)cc1 1130745511 ZGKZUIMNFCRTSD-UHFFFAOYSA-N 447.564 4.213 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc(C4CC(=O)NC(=O)C4)c3)c2C)c1 1159017011 ZFHFBNVKJJUYBM-UHFFFAOYSA-N 429.520 4.483 10 10 IICE CCC1(CC)CCCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 1169301726 XRWPCEHVUVDOAN-WOJBJXKFSA-N 433.612 4.348 10 10 IICE CCC(CC)NC(=O)[C@@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2O)c2ccccc2O1 1192129157 KTWAUCQVTVIRCZ-NRFANRHFSA-N 430.932 4.321 10 10 IICE CC[C@@H](NC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(=O)NCc1cccs1 1254073530 IZLJLEZDUJNHBB-JOCHJYFZSA-N 438.597 4.358 10 10 IICE C[C@@H](CN(C)c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1288591977 VRSVFMZUOLLYIL-HNNXBMFYSA-N 428.581 4.495 10 10 IICE CCc1nnc(C)cc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1289510822 MNEFOFXTHWYBMZ-UHFFFAOYSA-N 437.301 4.072 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(CC2CC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1291401068 GBTYLLFLIFGDNR-DFBJGRDBSA-N 425.621 4.264 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccccc3C(=O)c3ccc(OC)cc3)c2)CC1 1296725346 NUKQNBTWSDXSHI-UHFFFAOYSA-N 443.547 4.320 10 10 IICE COC(=O)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(C)c(C)c1 1436001421 VHBAEPIQAUDVIS-AREMUKBSSA-N 447.579 4.055 10 10 IICE Cc1cc(C(=O)NCCCN2CCCCCC2)c(C)n1-c1ccc(Br)cn1 1440671321 KEIASAXKYXKTQK-UHFFFAOYSA-N 433.394 4.248 10 10 IICE Cc1cnc(Cl)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1444498953 CVWHRXLFEPKXOD-GOSISDBHSA-N 432.952 4.105 10 10 IICE C/C=C/COc1cccc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1445881588 IZGPDDCRBVOFGQ-GMKGHPLGSA-N 428.960 4.324 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1459303803 GKDVOQWWBIMJAK-VWLOTQADSA-N 448.563 4.162 10 10 IICE Cc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)nnn1Cc1ccc(F)cc1F 1461964334 BAMBRJAVUHNMLV-UHFFFAOYSA-N 449.505 4.293 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(c2)CCO3)c(C)n1-c1ccc(Br)cn1 1464655576 INCZSESNYLQCGF-UHFFFAOYSA-N 426.314 4.117 10 10 IICE Cc1c(NC(=O)c2sccc2-n2c(C)ccc2C)cccc1S(=O)(=O)NC1CC1 1468660907 NIVRVPRLOSGMNX-UHFFFAOYSA-N 429.567 4.157 10 10 IICE Cc1cc(CNC(=O)NCC[C@@H]2CCC3(CCOCC3)CO2)c(C)n1-c1ccccc1 1471037607 PLKBDTLAMYJESI-QHCPKHFHSA-N 425.573 4.259 10 10 IICE CC[C@@H]1c2ccccc2CCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1473168155 ORCJMOXDJQUIQF-YDIMBITNSA-N 439.575 4.065 10 10 IICE Cc1cc(CCNC(=O)NCc2ncc(Br)s2)c(C)n1-c1ccccc1 1479063112 AQKNLDOXQLYWNN-UHFFFAOYSA-N 433.375 4.355 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(O)(C(F)(F)F)CC2)n1Cc1ccc(N(C)C)cc1C 1495489003 FEGBGXAJPGKVGJ-OAHLLOKOSA-N 439.526 4.108 10 10 IICE COc1cccc(CO[C@@H]2CCN(c3nnc(C)n3CCCSc3nccs3)C2)c1 1504357776 BLSKGXUSJAPGQS-LJQANCHMSA-N 445.614 4.030 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC[C@](C)(OC)C2)cc1 1515526242 NBLLUAMHKGJQPS-VWLOTQADSA-N 434.588 4.240 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1519268667 PRYBMHMALULASY-HKUYNNGSSA-N 447.599 4.128 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1519268675 PRYBMHMALULASY-MJGOQNOKSA-N 447.599 4.128 10 10 IICE COc1cc(N2CCN(C(=O)/C=C\[C@]3(C)CC[C@@H](C)C3(C)C)CC2)cc(OC)c1OC 1521501237 JUTDRNXAAYTARX-GUUQCTINSA-N 430.589 4.380 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C(/C)c3ccccc3OC(F)F)cc2F)CC1 1537535703 TXBSGSNPCMRMGN-VKAVYKQESA-N 447.501 4.289 10 10 IICE C[C@@H]1CCCN(c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccn2)C1 1539583074 XZSLUMUCIYMYRB-IEBWSBKVSA-N 444.526 4.318 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCC2)nnc1N1CCC=C(Br)C1 1542226478 ADPGXWVBDWQZQX-UHFFFAOYSA-N 430.394 4.457 10 10 IICE Cc1nn(C)c(C)c1[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C(F)(F)F 1545132794 WNDSXXBMOWXDPU-JOCHJYFZSA-N 446.473 4.219 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@](C)(O)[C@@H](C)CC 1545503423 ABEHNBVKCHUIOX-ZYLNGJIFSA-N 443.636 4.314 10 10 IICE CC(=O)N1CC[C@@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ccccc21 1545816204 CLQAPSPRPUSLIM-XMMPIXPASA-N 429.520 4.063 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCS[C@@H](C)C2)cc1 1547447979 JINLRNPPGNRYTC-IBGZPJMESA-N 436.629 4.100 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCNc2ncnc3ccc([N+](=O)[O-])cc23)c1C 1556429642 WBDDVXQCNBYDHS-UHFFFAOYSA-N 444.495 4.096 10 10 IICE CC(=O)c1ccc(N2CCN(Cc3cc(Cl)cc(Br)c3O)CC2)c(F)c1 1560722116 PKCHGQGTDQVISV-UHFFFAOYSA-N 441.728 4.472 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4cc(F)cc(Br)c4)CC3)C2)cc1 1585664804 GMFUYVGMUAIZPI-OAHLLOKOSA-N 447.348 4.271 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC[C@@H]1C[C@H]2C=C[C@H]1C2 1586171531 SYNROQSUJKADML-KLDOFURSSA-N 432.636 4.448 10 10 IICE CCn1cc(-c2nn(C)cc2C(=O)N2CC(C)(C)c3ccc(Br)cc32)cn1 1587536651 UQHSLJWZLWCAIP-UHFFFAOYSA-N 428.334 4.004 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)c1C 1587653913 DRYBGPZKAMVCAK-DEOSSOPVSA-N 429.564 4.366 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cc(Cl)cc(Cl)c3)CC2)cc1F 1595483674 YVKJWAOTMBNCLQ-ZDUSSCGKSA-N 427.303 4.257 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(CCN(C)C)Cc2ccsc2)C1 1596851960 HFPXYDARDQLZJP-UHFFFAOYSA-N 438.641 4.060 10 10 IICE CC(C)(C)OC(=O)c1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 1597431748 GHAJKRQJRHKPAM-UHFFFAOYSA-N 435.568 4.426 10 10 IICE COCCN(CC(C)C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N(C)C)cc1C 1619893984 OMYVSSDLBSAAAC-UHFFFAOYSA-N 425.577 4.378 10 10 IICE CCn1cc(Br)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635940299 BJJPZOIPWIPAAW-INIZCTEOSA-N 440.769 4.024 10 10 IICE CCc1cc(=O)c2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)ccc2[nH]1 1637587700 NALASTXUMVWIAA-UHFFFAOYSA-N 427.504 4.492 10 10 IICE Cc1ccc(N2C(=O)C(=O)N(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)C2=O)c(C)c1 1651754716 SHHNMOXFCLYJIP-UHFFFAOYSA-N 447.466 4.028 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(c2cccc3cnccc23)C[C@@H]1C 1673743378 CYFOOAPAAJBPBR-SFTDATJTSA-N 445.611 4.461 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3ccc(OC)cc3Br)C2)cc1 1680922001 PHHWXIDCDVHXMX-LSDHHAIUSA-N 448.361 4.105 10 10 IICE Cc1cc(CCNC(=O)N(C)C[C@H]2CCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1683150053 WBFHQRYTOLGDGK-JOCHJYFZSA-N 440.588 4.287 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3Cc4ccc(Br)cc4C3)C2)cc1 1686854828 FVGHHGFJDHMDLR-HNNXBMFYSA-N 430.346 4.009 10 10 IICE CC(C)C[C@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)N(C)C 1692054829 LFRHMQWOZJQFQX-HXUWFJFHSA-N 427.618 4.249 10 10 IICE Cc1cc(-c2nnc(N3CC=CCC3)n2CCNC(=O)C(C)(C)C)c(C)n1-c1ccccc1 1692986559 SJMXSKNCUHDLFZ-UHFFFAOYSA-N 446.599 4.281 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](OCC(F)(F)F)C2)n1Cc1ccc(N(C)C)c(F)c1 1723178551 YRTVIANPDFDJMO-MRXNPFEDSA-N 443.489 4.203 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CC=CCC1 1729718929 SFMWYPSYLVTZMP-NRFANRHFSA-N 446.599 4.281 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)CCC(C)C)n1Cc1ccc2c(c1)CCCN2C 1762197975 DPEILNBJBZCBOH-UHFFFAOYSA-N 440.636 4.110 10 10 IICE CC[C@@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1763471438 ZHGLJKBGJOPUHQ-WIYYLYMNSA-N 429.634 4.008 10 10 IICE CCN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1764964986 YGLIQYZSNZXIAA-UHFFFAOYSA-N 435.620 4.271 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccncc4)nc4cc(F)ccc34)CC2)cc1 1873831696 CJJBHMLNRLKSAU-UHFFFAOYSA-N 442.494 4.407 10 10 IICE COc1cccc(O)c1CNCCCONC(=O)OCC1c2ccccc2-c2ccccc21 1976859193 UGIHQAUMAYVFTC-UHFFFAOYSA-N 448.519 4.351 10 10 IICE COc1ccc([C@@H](n2nc(C(F)F)c(N)c2I)C2(C)CC2)c(O)c1 2079881840 YCTZRPHATBHSCR-CYBMUJFWSA-N 449.239 4.111 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C3CC3)c(C=O)c2I)c(O)c1 2080001931 PMJZCWRFPYYTNJ-KRWDZBQOSA-N 440.281 4.137 10 10 IICE CC[C@H](NC[C@@H](F)C1CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2112915572 HQWLCYXKJTYFBW-CVEARBPZSA-N 431.346 4.400 10 10 IICE COCCOCCN(Cc1ccccc1)c1ccc(C=CC(=O)O)cc1Br 2152223866 QPUPKZYOAIWZDY-UHFFFAOYSA-N 434.330 4.217 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@@H](C)N(C(=O)OC(C)(C)C)C2)c1O 2227748503 AWLCMEHCNSAIOL-OLZOCXBDSA-N 429.355 4.041 10 10 IICE COc1ccc(Br)c(CNC[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c1O 2236050158 BGIAROGKQJKGDG-WBMJQRKESA-N 443.382 4.192 10 10 IICE COCCN1C(=O)C(=Cc2nc(-c3ccc(C)cc3)nn2-c2ccccc2)SC1=S 2297456255 CXGQNAWWPZLBJJ-UHFFFAOYSA-N 436.562 4.090 10 10 IICE CC=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135956 YOEYHQXPUUPJRC-HNNXBMFYSA-N 441.366 4.281 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)Nc1cc(F)cc(F)c1 22068720 WLKNMDRLMRLYFW-UHFFFAOYSA-N 431.464 4.350 10 10 IICE CCN(CC)c1ccc(CN(C[C@H](O)COc2ccc(C=O)cc2)c2ccccn2)cc1 54120896 NYNFTDCLEHVAGQ-DEOSSOPVSA-N 433.552 4.187 10 10 IICE C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)/C=C/c2ccc(N3CCOCC3)cc2)C1 97553937 HOMUMYYXWQZAEU-LGQHIAMJSA-N 447.579 4.293 10 10 IICE Oc1ccccc1CN(C[C@H](O)COc1c(Cl)cccc1Cl)C[C@H]1CCCO1 98072160 LEDOHLRWNCMPRN-DLBZAZTESA-N 426.340 4.120 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 226850129 USBAQQJDZNTAJR-XFQAVAEZSA-N 427.888 4.451 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 741212396 OEAXJULXVFJKFW-PMACEKPBSA-N 434.458 4.184 10 10 IICE Cc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1N1CCOCC1 766875782 JAJMKACLYNDKKR-UHFFFAOYSA-N 446.595 4.192 10 10 IICE CC(C)Oc1ccc([C@H](O)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 768047417 SQURDWOFVCPDDO-AREMUKBSSA-N 449.595 4.045 10 10 IICE COc1cc(Br)cc(CNC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)c1O 769420970 UWUDTKVLAFDIFK-ZDUSSCGKSA-N 448.279 4.123 10 10 IICE COc1cc(Br)ccc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 781634958 BOCLGUJVOXTFJM-UHFFFAOYSA-N 444.417 4.280 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(C(=O)N(C)[C@H]3CCCN(C)C3)cc2)c1 789891394 WEUPRMKAIRLAGE-IBGZPJMESA-N 446.389 4.241 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c(C)n1-c1ccc(Cl)cc1 919710422 OUEVJKUXNNWFPL-SFHVURJKSA-N 428.945 4.447 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 1124621366 GYPILKXPTNIZLY-NRFANRHFSA-N 439.987 4.451 10 10 IICE COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1ccc(-n2c(C)ccc2C)cc1 1127109340 YRDSYNKBOPJYEP-OAQYLSRUSA-N 430.426 4.498 10 10 IICE CN(C)c1ccc(CNC(=O)c2cccn2-c2cccc(I)c2)cc1 1135642928 NFBQMUWNTMJIOI-UHFFFAOYSA-N 445.304 4.078 10 10 IICE O=C(CN1CCCCCC1)Nc1cccc(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1136539884 SHNRFMVWIGRXQQ-UHFFFAOYSA-N 439.537 4.379 10 10 IICE CCOC(=O)[C@H](CC1(OC)CCC1)NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1144913090 KLKVLJDXLFWSQD-FQEVSTJZSA-N 432.948 4.368 10 10 IICE Cc1cc(Br)cc2cc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)oc12 1148701403 WRIINQUOOVDNMO-UHFFFAOYSA-N 443.341 4.395 10 10 IICE COc1cc(CN2CC[C@H](NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)cc(OC)c1 1149777590 YCHNTEHFRAEYNP-QFIPXVFZSA-N 447.579 4.424 10 10 IICE Cc1cc(C(=O)OC(C)(C)C)cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 1151903693 RNHIYFCAWSRROC-NRFANRHFSA-N 425.525 4.477 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCOc1ccc([N+](=O)[O-])cc1 1165276416 ZAGXTLUZNOXGRG-UHFFFAOYSA-N 427.482 4.421 10 10 IICE CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H](C)Cc1ccsc1 1169605623 UKTMTXOMUWKUCE-INIZCTEOSA-N 432.545 4.415 10 10 IICE CC[C@@H]1CN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC[C@H]1NC(=O)OC(C)(C)C 1230194819 GBLUVIZBZWNXEG-NNMXDRDESA-N 446.636 4.327 10 10 IICE COc1cc(OC)cc(N2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1266119154 XRQJZXPPKASAPW-UHFFFAOYSA-N 447.579 4.393 10 10 IICE CC[C@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCO1 1289510802 LYDKTZHCKXINIW-HIFRSBDPSA-N 429.318 4.303 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(C)CCOCC1 1291562186 DXPXZKWZUAMKSQ-FQEVSTJZSA-N 441.620 4.334 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(-c3ccc(F)cc3)n(C)n2)cc1 1292382611 UQPDPXGWEMFKDK-QFIPXVFZSA-N 436.531 4.114 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@H](C1CCCCC1)N(C)C 1298363595 HNONFRLYUYIPDS-FYYLOGMGSA-N 441.620 4.372 10 10 IICE O=C(N[C@@H]1CCCC12CCCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1300770882 VJWORXMPBQTKLI-GOSISDBHSA-N 434.583 4.487 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@H]1C 1301684279 UVGHHPGJPIAGTL-WIYYLYMNSA-N 437.588 4.108 10 10 IICE CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)N[C@@H](C)c3ccccc3O)cc2)cc1 1302532529 HHLIMPCOZLZOTR-INIZCTEOSA-N 440.521 4.083 10 10 IICE CSC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)O 1302698378 VVSUGFGFNSWYSW-HXUWFJFHSA-N 439.629 4.455 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 1313150706 VNIOGMKSQNCKSB-WBVHZDCISA-N 425.710 4.138 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(=O)C(C)C 1313683494 DNYGJQVJZZAHBT-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCN(C(C)C)C1 1316302666 QGXYGICRXBGSHK-NRFANRHFSA-N 436.604 4.471 10 10 IICE Cc1cc(C(=O)COC(=O)c2cc(=O)n(C)c3ccccc23)c(C)n1-c1ccc(F)cc1 1321915679 DKCJMXBZWQQQFB-UHFFFAOYSA-N 432.451 4.125 10 10 IICE Cc1cccc(-c2cccc(C(=O)NCc3ccc(N4CCC[C@H](C(N)=O)C4)cc3)c2)c1 1351133430 BVIICLADBDATIB-DEOSSOPVSA-N 427.548 4.294 10 10 IICE COc1cccc(C(=O)c2ccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cc2)c1 1439962176 VXMAGJLHTOYJSY-RUZDIDTESA-N 445.563 4.025 10 10 IICE O=C(NCCCSc1nccs1)c1cc(-c2ccc(OC(F)(F)F)cc2)[nH]n1 1443495091 YDCICIFAAPKBQG-UHFFFAOYSA-N 428.461 4.344 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCN(C)C(=O)OCc1ccccc1 1445655601 PJGORPVGDXBDJM-UHFFFAOYSA-N 449.345 4.162 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1460978567 ACBNXYSJOWLGCU-DOTOQJQBSA-N 448.394 4.468 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1 1470555832 ITYVENRMUYUUOT-LJQANCHMSA-N 446.636 4.328 10 10 IICE Cc1cc(CN(C)C2(CNC(=O)OC(C)(C)C)CCOCC2)ccc1N1CCCCC1 1473838092 UNQFEMURVVLKMY-UHFFFAOYSA-N 431.621 4.491 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(N(C)C)cc1 1478325272 WNLPNGOMHZVGLC-BFUOFWGJSA-N 435.355 4.225 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCN1CCCC1 1495638978 JEBGJOAIMDXQKF-NRFANRHFSA-N 440.636 4.003 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512878445 ZDIRQSNQPXITRB-ICSRJNTNSA-N 429.584 4.298 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)OC)C1 1518868975 MMTQMKWTMIUOSV-HXUWFJFHSA-N 437.588 4.250 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1534309494 SRXSSSSEQOWCGU-NTMALXAHSA-N 449.526 4.329 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCS[C@H](C)[C@@H]1C 1542227182 VKNMHOAZFNRJQF-RBUKOAKNSA-N 436.629 4.017 10 10 IICE Cc1cccc2c1N(C(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)CC2 1543667212 WFBSXLUBWGXXKH-QGOAFFKASA-N 426.538 4.315 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2coc(C(C)(C)C)n2)NC(=O)OC(C)(C)C)cc1 1544268347 KWCMCDUUSKUEOU-QGZVFWFLSA-N 430.549 4.034 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3cc(Br)ccc32)c(C)n1-c1ccccn1 1556557039 XXKHHHGVYVVGHZ-UHFFFAOYSA-N 425.330 4.348 10 10 IICE O=C(CCCCc1ccc(I)cc1)NCc1c(O)cccc1F 1558454768 LYQFWCNOUGPNLU-UHFFFAOYSA-N 427.257 4.165 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cc1 1558607675 YBEWJZYWNUTEMY-PMACEKPBSA-N 447.373 4.267 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](c1ccc(Cl)cc1)N(C)C 1566306442 KZLXVCXRCYTYRV-SFHVURJKSA-N 425.754 4.460 10 10 IICE COc1ccc(C=O)cc1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1566846191 OSROWOMCKRFDSM-UHFFFAOYSA-N 443.547 4.125 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1586832271 LMODEWRBAYGSTM-FQEVSTJZSA-N 447.482 4.022 10 10 IICE CC(C)CN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1607297924 YMHXJQFOXHJJQX-UHFFFAOYSA-N 427.637 4.216 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC(c4ccc(C(F)(F)F)cc4)CC3)nc12 1616676332 AYAOQZNWKAHWHT-UHFFFAOYSA-N 448.445 4.010 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cccc(N2C(=O)CCC2=O)c1 1623924208 HTBDADUKNDVWAM-GOSISDBHSA-N 428.488 4.449 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NC(C)=O)c(Cl)c1 1635677167 YUWMQUQNHJIUGF-UHFFFAOYSA-N 425.710 4.429 10 10 IICE Cc1ccc(N2N=C(Br)C[C@H]2C(=O)NCc2c(O)ccc3ccccc23)cc1 1635964813 AERVFNSPUMLRQT-IBGZPJMESA-N 438.325 4.457 10 10 IICE COc1ccc(N(CCc2ccccc2)Cc2noc(CNC(=O)OC(C)(C)C)n2)cc1 1644865883 KSRBTBAWSBIXJP-UHFFFAOYSA-N 438.528 4.352 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)Cc3ccccc3F)cc2Cl)C1 1682024094 OLZLDYQHDWTSEL-LPHOPBHVSA-N 433.955 4.118 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCOc3ccccc3C(C)(C)C)C2)cc1 1682645580 HGJDHPVFPVDDRB-LJQANCHMSA-N 425.573 4.292 10 10 IICE CN(CCc1ccc(Br)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684607516 RFMQCNPXAWUZQI-OAQYLSRUSA-N 447.421 4.002 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](CC)C1 1705653803 QDHPACSJZBJVSW-QFIPXVFZSA-N 449.624 4.334 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3nccs3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1724197662 ILGDEALASIHRGZ-GOSISDBHSA-N 449.628 4.396 10 10 IICE CCO[C@]1(c2nnc(N(C)C3CCCCC3)n2Cc2ccc(N(C)C)cc2C)CCOC1 1728753847 GGGOUGMYUDDKPB-RUZDIDTESA-N 441.620 4.122 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1761010364 UZMPXWQICRHTRP-HXUWFJFHSA-N 425.621 4.234 10 10 IICE CC[C@@H](C)CN(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1761968545 BLANLLRJBZZZNH-HXUWFJFHSA-N 427.637 4.216 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC[C@@H](C)C3)n2CCCSc2nccs2)n1 1762449099 VGHFQMJWRPBLFY-MRXNPFEDSA-N 445.662 4.405 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C(C)C)CC1 1769298902 HLZLAOWIRKYPDF-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CC[C@@H](NC[C@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]12)c1cc(Br)ccc1O 2087331295 ZMYHVLIPPBDIGL-WCXIOVBPSA-N 425.367 4.308 10 10 IICE O=S(=O)(Nc1ccc(O)c(Cl)c1)c1cc(Br)sc1Br 2089614515 VJSLHXAKORBRPS-UHFFFAOYSA-N 447.557 4.433 10 10 IICE COc1ccc(Br)c(CNc2ccccc2I)c1O 2227747716 FGGFZNXBPRRXPP-UHFFFAOYSA-N 434.071 4.380 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(C)C)c1O 2236050878 LPIXMRPHLBSOGK-MRXNPFEDSA-N 443.382 4.289 10 10 IICE CCc1ccccc1N1C(=O)NC(=O)C(=Cc2c[nH]c3ccc(Br)cc23)C1=O 2297312933 APTZZSGCTNCJHI-UHFFFAOYSA-N 438.281 4.159 10 10 IICE CCN1C(=O)C(=Cc2ccc(OCc3ccccc3[N+](=O)[O-])c(OC)c2)SC1=S 2297500130 LJPBBXAGNVZHJQ-UHFFFAOYSA-N 430.507 4.404 10 10 IICE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352637785 MDFSGXNGIXVSGB-NHYWBVRUSA-N 429.355 4.019 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2C[C@@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380747860 YBGNRYJHLWHYJR-WFASDCNBSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C2(C(=O)O)CC(OCc3ccccc3)C2)c(O)c1Br 2381129803 PFPAXZJXUMNYSQ-UHFFFAOYSA-N 434.330 4.098 10 10 IICE C[C@H](CCCCC(=O)Nc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1ccc(O)c(O)c1 13887719 ZRBLJEGNAJFUPE-VLIAUNLRSA-N 440.462 4.327 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@H](c2ccc(Cl)cc2)N3)CC1 14465082 NTFMATRYGUUETK-JTAQYXEDSA-N 444.000 4.103 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCCC(=O)Nc3cccc(C)c3)C2=O)ccc1O 15039218 RTROCKFTQLKNDX-UYRXBGFRSA-N 442.562 4.329 10 10 IICE O=C1N=C(O)/C(=C\NNc2ccc(Br)cc2)C(=O)N1c1cccc(Cl)c1 38176061 WJHHAIAJQSKUMH-NTEUORMPSA-N 435.665 4.026 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)sc2c1CCCC2 59239308 CKWRBUMNISMTCY-OAHLLOKOSA-N 426.538 4.104 10 10 IICE CCOc1c(Cl)cc(C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cc1OC 98080403 XONIYRLGZSREEU-UHFFFAOYSA-N 428.920 4.310 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3cc(Br)ccc3F)CC2)cc1 110356801 AMSLYQGLABPGEG-XNWCZRBMSA-N 433.321 4.395 10 10 IICE CC(=O)c1cccc(N2C(=O)/C(=C/c3cccc(OCCC(=O)O)c3)SC2=S)c1 210420814 YFTIGDOYKPPJLN-WQRHYEAKSA-N 427.503 4.149 10 10 IICE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@@H](O)COc1c(Cl)cccc1Cl 216396869 LEDOHLRWNCMPRN-SJORKVTESA-N 426.340 4.120 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3ccc(OC)cc3OC)[C@@H]2c2ccc(O)c(O)c2)c1 526145555 UETOYBQOXQNYDC-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CCC(=O)Nc1cccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 575861024 ZMHPULIMFYDCPL-UHFFFAOYSA-N 432.568 4.073 10 10 IICE O=C1c2ccccc2C(=O)c2c1cccc2N(CCF)S(=O)(=O)c1cccc(Cl)c1 586223517 OSSVWHXFTJIRAA-UHFFFAOYSA-N 443.883 4.280 10 10 IICE CC[C@@H](NCCOCCN(C)C(=O)OC(C)(C)C)c1cc(Br)ccc1O 705970820 COEXYWIJFRVRPT-MRXNPFEDSA-N 431.371 4.079 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1F 727602020 JGZHYCYFNMIJTP-NRFANRHFSA-N 444.938 4.203 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCc2cccc(COC3CCOCC3)c2)cc1 732242337 XKUMQLNSRUDZGI-UHFFFAOYSA-N 425.573 4.228 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 742140970 ZHNANXHWODLCJF-LJQANCHMSA-N 435.490 4.357 10 10 IICE Cc1ccc(-c2nn(-c3ccccc3)cc2/C=C2/SC(N3CCOCC3)=NC2=O)c(C)c1 747147964 JTQKMNDHNRDAKO-PXLXIMEGSA-N 444.560 4.459 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(C(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)[C@H]2C1 754877973 JVIJNIHHDBFZET-HLAWJBBLSA-N 447.373 4.265 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 772558066 NFHHLOJBPZCMFS-JXFKEZNVSA-N 433.346 4.464 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC[C@H](c4ccccc4)O3)cc2F)C[C@@H](C)O1 808237806 GTIOCAXBTKJDAW-YVXPOVKHSA-N 441.547 4.159 10 10 IICE CCN(CC)c1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)N[C@H](C)C(N)=O)cc1 914718457 ONFMPGWCMWEXGA-KAKMCVKYSA-N 442.563 4.171 10 10 IICE CCOc1ccccc1CN(C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918219922 QYOLUJLFQQNYGV-QZTJIDSGSA-N 429.536 4.180 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N3CCc4[nH]c5ccccc5c4C3)cc2F)C[C@@H](C)O1 918223367 ZZZHJGDKNRQUFL-IAGOWNOFSA-N 436.531 4.189 10 10 IICE COc1cccc(N2C(=O)/C(=C\c3c(C(=O)O)[nH]c4cc(OC)ccc34)SC2=S)c1 1081155417 IGDSIPKHUAWPGX-LICLKQGHSA-N 440.502 4.289 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCc3ccc(CC(C)C)cc3)cc2F)CC1 1125975982 GQAOGHHYFCLNTO-UHFFFAOYSA-N 425.592 4.415 10 10 IICE C/C=C\c1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(OC)c1 1136480433 MLFSVPKUZFVLDM-BLAQYMCESA-N 438.568 4.381 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 1142352142 SKHZUYFRBQCKKB-QUCCMNQESA-N 439.556 4.330 10 10 IICE COC1([C@@H](C)NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCOCC1 1142471317 KHPDYICSUJYJOS-MRXNPFEDSA-N 435.362 4.171 10 10 IICE CCc1cc(N2CCC[C@@H](NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2)ncn1 1144650470 IIEMIJIHBDQXII-JOCHJYFZSA-N 431.584 4.462 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3ccc(SC)cc3)C2)cc1F 1144977099 AUHDZVFWXINEER-KRWDZBQOSA-N 429.561 4.063 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@@H]1CCCOC1 1178048394 UBTYZNMEEMIXKD-VQIMIIECSA-N 435.362 4.028 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@@]3(C2)CN(Cc2ccccc2)C[C@@H](C)O3)c1O 1197272708 DGMZCLKPJORRTA-MZNJEOGPSA-N 428.960 4.114 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@]12CCC[C@H]1CN(C(=O)OC(C)(C)C)C2 1230199426 BOCYJMOAUPJJQZ-AOUJKTHWSA-N 444.620 4.081 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC(Cc3ccccc3C(F)(F)F)C2)N(C)C)cc1 1251500209 CVDIELGQERLMLK-JOCHJYFZSA-N 448.533 4.258 10 10 IICE CCCCN(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H]1CCC[C@H](C)C1 1298617591 NGBOJIJEPAHIJZ-HIVRRZQESA-N 441.616 4.107 10 10 IICE C[C@@H]1CCCCN1CCCCn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1O 1305013948 OAUGXYDLKBEPAV-HXUWFJFHSA-N 434.588 4.337 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(Oc4ccc(F)cc4)n3)C2)cc1 1312966559 GEHRFKVOGGPGOP-IBGZPJMESA-N 436.487 4.100 10 10 IICE COCc1nn(C)cc1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OC(C)C 1352999471 JRKGBDLCRKKGRL-UHFFFAOYSA-N 427.526 4.421 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 1452627873 CBVZLIVRPUUNJP-DUXPYHPUSA-N 427.715 4.420 10 10 IICE CCCN(CC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)Cc1ccccc1O 1459559444 YYZBMGNTUWNDEK-QFIPXVFZSA-N 429.992 4.211 10 10 IICE COc1ccc(N2CCN([C@H]3CCN(c4ccc(Cl)cc4Cl)C3=O)CC2)cc1F 1459746625 GLUPWUTZMPXGCW-IBGZPJMESA-N 438.330 4.069 10 10 IICE COc1ccc(N2CCN(C(=O)C(F)(F)c3cc(Cl)ccc3Cl)CC2)c(OC)c1 1461975120 BOPFFVBEJBIMHN-UHFFFAOYSA-N 445.293 4.451 10 10 IICE Cc1cc(C(=O)NCC(=O)N(C)C2CCCCC2)c(C)n1-c1ccccc1Br 1466071745 DCGUOHGAHRILQT-UHFFFAOYSA-N 446.389 4.378 10 10 IICE CCOC(=O)C1(CC(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)CCOCC1 1466398255 FKTULZHOIPHZDL-IBGZPJMESA-N 425.525 4.232 10 10 IICE Cc1cc(Br)cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1N 1466650248 NYAPRZBDMKRWBI-UHFFFAOYSA-N 431.378 4.122 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1ccncc1 1495638918 IGPCZKRQDLIUNH-HXUWFJFHSA-N 434.588 4.155 10 10 IICE CCCCN1CCCC[C@H]1Cn1c(-c2ccccn2)nnc1N(C)Cc1ccccc1O 1500532701 UYCPGJMAKZDXBI-NRFANRHFSA-N 434.588 4.337 10 10 IICE CCCN(CCC)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1500841973 QZVPMAMJFXMPLA-OAQYLSRUSA-N 443.661 4.400 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(C)s1 1503011320 CXUVLVWEZSZZFI-UHFFFAOYSA-N 425.602 4.469 10 10 IICE COCC1(CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCC1 1504624551 BXIIUJPSEPZJNJ-UHFFFAOYSA-N 426.586 4.479 10 10 IICE COc1ccc(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1OC(F)F 1515927406 QQQRGKABGDKNNL-UHFFFAOYSA-N 437.398 4.253 10 10 IICE CCN1C[C@@H](CN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)Oc2ccccc21 1539443874 JQHHTAVFSRAATK-XMMPIXPASA-N 445.563 4.195 10 10 IICE CCN(CC)[C@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccco1 1542433456 GARMAYUSMZRNKF-XMMPIXPASA-N 436.600 4.200 10 10 IICE Cc1csc(CCCCn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)n1 1542857094 JIYCHFMQOIIKLW-UHFFFAOYSA-N 448.596 4.394 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccn(Cc3ccccc3)c2=O)cc1 1545457683 NWXZWOAZCMCRRF-UHFFFAOYSA-N 439.515 4.298 10 10 IICE O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1)N1Cc2cccc(O)c2C1 1558036227 QNCYKNFLLXVQIY-UHFFFAOYSA-N 446.887 4.142 10 10 IICE Cc1cc(CC(=O)NCCCc2nc3ccc([N+](=O)[O-])cc3[nH]2)c(C)n1-c1ccccc1 1558314513 FZRNLDGCDFKYTJ-UHFFFAOYSA-N 431.496 4.170 10 10 IICE COc1ccc(CNC(=O)c2c(Nc3ccc4c(c3)CCCC4)cc(C)nc2O)c(O)c1 1568099996 HEZUDFLGGMYKGH-UHFFFAOYSA-N 433.508 4.362 10 10 IICE CNC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Cc1ccc(F)cc1C 1570692179 TXXOVLITGOLCKL-JOCHJYFZSA-N 449.570 4.493 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc(C(=O)OC(C)(C)C)cn3)cc2Cl)C1 1586083105 WFNPLCUENAZIBO-OAHLLOKOSA-N 444.963 4.252 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2c(F)cccc2OC(F)F)C1 1586554916 CYZHKWLEHSQMPP-UHFFFAOYSA-N 445.485 4.465 10 10 IICE CN(C)c1ccc(CNC[C@@H]2C[C@H]3CCN2C[C@H]3c2cc(-c3ccc(F)cc3)nn2C)cc1 1616157287 ZZQCNNHAICPHEC-IEZKXTBUSA-N 447.602 4.260 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)n2)cc1 1616534615 PTSXAHCEGBKUJT-UHFFFAOYSA-N 446.473 4.417 10 10 IICE COCN1C(=O)CCc2cc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)ccc21 1616678381 NMHHQSUJXXUWIW-UHFFFAOYSA-N 431.492 4.042 10 10 IICE COc1cccc(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)on2)c1 1631612353 MVYXCONMHCTWLK-JOCHJYFZSA-N 435.524 4.238 10 10 IICE CN(CCc1ccccc1C(=O)NCCCSc1nccs1)C(=O)OC(C)(C)C 1632807094 NALUUHADWNYTJK-UHFFFAOYSA-N 435.615 4.465 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cnn(CC(=O)NC2CCCC2)c1 1637244118 UDLFUXGHBIRMTM-LJQANCHMSA-N 446.551 4.051 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCc4cc(Cl)ccc43)cc2F)C[C@H](C)O1 1642843210 UHJHPJVZAOEVBD-IRXDYDNUSA-N 445.966 4.162 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C3)ccc21 1643590033 PDMGPXBGQBIZDD-HRAATJIYSA-N 428.573 4.344 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)cc1C 1644804113 JINBPTWCTQMVKN-BGYRXZFFSA-N 427.564 4.199 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@@H]2C(=O)Nc3ccccc32)CC1 1673744585 NVXVJJSTRPQSSV-KOSHJBKYSA-N 434.584 4.150 10 10 IICE Cc1ccnc(-c2noc(CC3CCN(C(=O)N[C@@H](C)c4ccc(N(C)C)cc4)CC3)n2)c1 1681553056 USXGJDYRFVLVJW-SFHVURJKSA-N 448.571 4.231 10 10 IICE CO[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C 1697691682 DKNNUANBMHNLAN-JTSKRJEESA-N 429.584 4.125 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1C 1706057310 FFVCKKWUKPKJTK-HKUYNNGSSA-N 434.588 4.114 10 10 IICE CC[C@@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1709316020 FZAVNYOSZSJIDV-XQBPLPMBSA-N 443.661 4.397 10 10 IICE CC[C@H](C)c1nnc(N(CC)CCC2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726897651 DYRPGYOLQJUDIM-SFHVURJKSA-N 429.584 4.442 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2CC(C)(C)C2)CCOC1 1761278118 XFQNNLFEDFYPNZ-XMMPIXPASA-N 428.577 4.097 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)/C2=C/c2ccccc2C(=O)O)cc1 1865673996 JKHHNLGSYPTAOB-HYARGMPZSA-N 430.435 4.363 10 10 IICE CCN(CC)c1ccc(-c2nc3cc(C(=O)NC4CCC5(CC4)OCCO5)ccc3[nH]2)cc1 1872739373 JNXMAPNGIUVGOS-UHFFFAOYSA-N 448.567 4.492 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C(F)F)c(C(=O)O)c2Br)c(O)c1 2079863708 UDZRSPKBAVGTFO-AWEZNQCLSA-N 431.233 4.385 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C(C)(C)C)c(CO)c2I)cc1C 2080006053 OQCNUPHUDPRYSM-GFCCVEGCSA-N 428.314 4.209 10 10 IICE COc1ccc([C@H](n2nc(C3(C)CC3)c(C(=O)O)c2Br)C2(C)CC2)c(O)c1 2080030274 KPBLHPYWGOJBMR-INIZCTEOSA-N 435.318 4.499 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1O 2227747999 ILNQOOBAQZUFFT-CYBMUJFWSA-N 429.355 4.043 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2ccc(OCc3ccc(C)cc3)c(Br)c2)S1 2293417969 FQOQXFLHXROERE-UHFFFAOYSA-N 445.338 4.443 10 10 IICE CCOc1ccccc1C=C1C(=O)NC(=O)N(c2ccc(Br)c(C)c2C)C1=O 2313548063 KOUCNODHWCJNBB-UHFFFAOYSA-N 443.297 4.131 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(Nc3ccccc3)C2=O)cc1OC)C(=O)O 2314933658 WVUNJVNVVCOFOJ-OAHLLOKOSA-N 444.534 4.166 10 10 IICE CCOc1ccc(-n2cccc2/C=C2/C(=N)N3C(SCC)=NSC3=NC2=O)cc1 20211059 OVFVMLMZODNOBW-PSPCYXPKSA-N 425.539 4.206 10 10 IICE C/C(=C1/SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O)c1ccc(C)c(C)c1 39861782 JXOCNRFZDQLSEJ-ATVHPVEESA-N 427.503 4.496 10 10 IICE COc1ccc(N2CCN(Cn3nc4cc(C)c5ccc(OC)cc5n4c3=S)CC2)cc1 58592249 RUUVGGQZEVRMEE-UHFFFAOYSA-N 449.580 4.124 10 10 IICE CCC1(CC)C(=O)N(C(=O)c2ccc(Cl)cc2)N(C(=O)c2ccc(Cl)cc2)C1=O 138737920 FMHSBOCVYNNODE-UHFFFAOYSA-N 433.291 4.366 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@H](O)COCc1ccccc1 731106712 CLSMAKOBVCTIOB-QFIPXVFZSA-N 426.557 4.042 10 10 IICE C[C@H]1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)[C@@H]1c1cccc(F)c1 746760456 XDWARJIVJCGFMP-HJPURHCSSA-N 429.511 4.219 10 10 IICE Cc1ccc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1-c1ncco1 766297881 JJEKEKSTJAFACO-UHFFFAOYSA-N 442.519 4.355 10 10 IICE Clc1ccc(-n2cc(CNCc3ccc(N4CCN(CC5CC5)CC4)cc3)cn2)cc1 768670070 LSFRMTTVUFEBGS-UHFFFAOYSA-N 436.003 4.348 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)c1 769753030 LNTWDEKJKABWHR-KRWDZBQOSA-N 442.459 4.150 10 10 IICE Cn1c(Cc2cccs2)nc2cc(C(=O)Nc3cccc(N4CCOCC4)c3)ccc21 804278267 SAZLCBDETBAFDD-UHFFFAOYSA-N 432.549 4.315 10 10 IICE CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2cc(C)n(-c3ccc(F)cc3)c2C)C1=O 1084115990 AYCZMCKJHSKCII-STZFKDTASA-N 431.467 4.462 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)COC(c2ccccc2)c2ccccc2)N(C)C)cc1 1134881588 AIPGRUWVCMCZKG-VWLOTQADSA-N 431.580 4.278 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)cc1F 1142566147 YUEHWESGZGKKPM-KRWDZBQOSA-N 427.520 4.437 10 10 IICE C[C@H](NC(=O)c1ccc(I)c(Br)c1)c1ccccc1O 1151892540 RRSOXHVJOLYUCV-VIFPVBQESA-N 446.082 4.250 10 10 IICE CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1235188715 XUPDIHHQJCQXLQ-QTJGBDASSA-N 438.568 4.467 10 10 IICE COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1267202763 PLCSLOQBASDOCD-XMMPIXPASA-N 429.520 4.018 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@](C)(O)c1ccc(F)c(Br)c1 1290373577 AWEGSEYHRYAYSQ-OAQYLSRUSA-N 435.337 4.055 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 1297228294 DTWYMNNPZKFPJU-UHFFFAOYSA-N 449.454 4.075 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 1298407421 ODMDMQWWSYKZKZ-HXUWFJFHSA-N 431.305 4.459 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C)[C@@H]3C)n2CCCSc2nccs2)n1 1304752541 XMWCTNRGAGTNTO-PBHICJAKSA-N 431.635 4.013 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1312405840 XNEDFLWRZCLKAM-PKOBYXMFSA-N 447.023 4.309 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC2(CC1)CN(C(=O)OC(C)(C)C)C2 1312884644 LDYOETQRJXQVAK-LJQANCHMSA-N 444.620 4.035 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](CO)Cc2ccc(F)c(F)c2)c(C)n1-c1ccccc1 1313101862 ZWUQPNBOYJVKNZ-FQEVSTJZSA-N 441.522 4.065 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](CO)Cc2ccc(F)c(F)c2)c(C)n1-c1ccccc1 1313101863 ZWUQPNBOYJVKNZ-HXUWFJFHSA-N 441.522 4.065 10 10 IICE CCC(CC)(C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC(C)(C)C 1355129298 FEVKNJJVZJWQEO-IAGOWNOFSA-N 436.568 4.204 10 10 IICE COc1ccc2c(c1)[C@@H](C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CCC2 1445885551 RKYXZDUDXACYSQ-FPOVZHCZSA-N 428.960 4.255 10 10 IICE COc1ccc(CN(CCO)C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c(OC)c1 1447053229 HYZJQILLIWUOME-UHFFFAOYSA-N 442.943 4.399 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccn(-c3cc(F)cc(F)c3)n2)cc1 1464603060 ITFGKNWCLMLTII-QFIPXVFZSA-N 440.494 4.038 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc(CCn3cc(Br)cn3)cc2)cc1 1465238590 JFDLYMHWGFJEKV-UHFFFAOYSA-N 441.289 4.303 10 10 IICE CC[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)cc1 1466320439 ASUZJQZWGRSBIG-QGZVFWFLSA-N 434.514 4.275 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N(C)c1c(OC)cccc1C(=O)OC 1537500069 ASDTYFVDGSTVAC-BUHFOSPRSA-N 434.492 4.495 10 10 IICE CC[C@@H](Cc1ccccc1Br)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1538747694 UKPJLKZJZBCTEF-WMZOPIPTSA-N 431.374 4.422 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1 1544343260 VIJDRSYJQVPKSY-ATIYNZHBSA-N 431.580 4.422 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)CC2CCOCC2)cc1 1547445121 YPXWIMLLEWTEMG-UHFFFAOYSA-N 436.604 4.041 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H]3[C@@H](COC)[C@@H]3C2)cc1 1547447155 PQZAUPSIMQQIRM-YTFSRNRJSA-N 425.621 4.090 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)C[C@@H]2CC=CCC2)cc1F 1552833334 PHCXHEFQUOMMLH-UYAOXDASSA-N 427.568 4.218 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CNC(=O)Nc1cccc([N+](=O)[O-])c1 1566846399 UUQXFZDPBCPXBP-KRWDZBQOSA-N 448.479 4.212 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccc(S(C)(=O)=O)c(Cl)c3)c2C)c1 1567578819 OBIKWUJUBIKSSQ-UHFFFAOYSA-N 430.957 4.389 10 10 IICE COc1ccc(C=O)c(OCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1568141922 IZHBXOPCLDJVAR-INIZCTEOSA-N 430.932 4.093 10 10 IICE COCCN(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccc1 1587467860 DKDRBWWOFPVYOQ-OBGWFSINSA-N 446.619 4.409 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c(C)n1-c1ccc(Br)cc1 1588308930 ZLEWAQCPPYKLCF-LEWJYISDSA-N 425.326 4.245 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)nn2C)cc1OC 1596490220 BEDNDZLASOXSMH-UHFFFAOYSA-N 444.535 4.442 10 10 IICE COc1cccc2c1CC[C@]2(NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Cl)c1O 1606868431 OEWBBISXPAWWPA-HSZRJFAPSA-N 446.931 4.037 10 10 IICE Cc1ccc(C(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1617797584 QUUISEUXJGDMAB-MRXNPFEDSA-N 441.572 4.448 10 10 IICE CC(C)[C@@H]1N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC12CC=CC2 1627338465 YBHQCVNDXRGJEK-IBGZPJMESA-N 432.567 4.071 10 10 IICE Cc1cc(C(=O)NC[C@]2(O)CCc3ccccc32)c(C)n1-c1cccc(Br)c1 1631213574 GDJRHEIKTBZIOF-HSZRJFAPSA-N 439.353 4.420 10 10 IICE CN(c1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)cc1)C1CCCCC1 1631385805 JFZSAIZEOQZKNN-UHFFFAOYSA-N 433.512 4.479 10 10 IICE CCS(=O)(=O)c1ccc([C@@H](C)NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1635150601 VIHLVEDONOPXME-QGZVFWFLSA-N 438.549 4.191 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CS(=O)(=O)c3ccc(OC)cc3)c2C)cc1 1652876299 RQFXPRRDLXRLOZ-UHFFFAOYSA-N 427.522 4.158 10 10 IICE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(C(=O)c1ccc(N=NC(N)=O)cc1)CC2 1653639872 IMWIIOKYPNTGPG-GOSISDBHSA-N 443.548 4.347 10 10 IICE CCOC(=O)CN(CC(=O)Nc1ccccc1Oc1ccccc1)Cc1ccccc1O 1653970305 XLCSGOIPIGALIS-UHFFFAOYSA-N 434.492 4.188 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](c4ccc(F)c(F)c4)C3(C)C)cc2)CC1 1684878548 VNOMKGIIBNSNIJ-NRFANRHFSA-N 442.554 4.194 10 10 IICE Cc1cc(-c2nnc(Nc3ccn(C)n3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1692982724 BEJDXIHUHFNIGJ-UHFFFAOYSA-N 441.486 4.111 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc([C@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1694821297 FLRRTKULUKPAQO-CNNODRBYSA-N 441.620 4.058 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CCC[C@@H]3OC)CC2)cc1 1697470143 CTFWZIQNEWWBFM-KNQAVFIVSA-N 441.620 4.116 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1706434923 KBSVCXNUHVZQTB-QGZVFWFLSA-N 448.662 4.025 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1728382886 QSGKBBPBORATLH-XZOQPEGZSA-N 441.620 4.420 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3CCCSC)CC2)cc1F 1730179787 DTDNGWRLNYZSHL-UHFFFAOYSA-N 433.597 4.163 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CC[C@H](F)C1 1747719887 DEBZSBYOSNTCTF-UXHICEINSA-N 429.584 4.187 10 10 IICE C[C@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)/C(=C/C=C\c2ccccc2)SC1=S 1772759489 XEQBBNFFVROLEV-SLHQOVNMSA-N 438.530 4.169 10 10 IICE COc1ccc(N2CCN(C(=O)CCN(C(=O)c3ccccc3)c3ccccc3)CC2)cc1 1858112592 KKDVWNBLUHUTFB-UHFFFAOYSA-N 443.547 4.081 10 10 IICE CCc1sc(NC(=O)[C@H](N)CC)c(C(=O)OC)c1-c1ccc(Br)cc1 1865951385 PRLMOGYHFRPCQR-GFCCVEGCSA-N 425.348 4.202 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(Oc2ccccn2)cc1 1891519635 DEZTYZYBVUORKO-FPOVZHCZSA-N 435.549 4.341 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(C)(C)C)c(CO)c1I 2079032737 JCQADZFPUQOYJU-AWEZNQCLSA-N 428.314 4.291 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@@H]3NCc1cc(Br)cc(F)c1O 2169561416 KVOAHMNXCUBTAE-BFOVYPLBSA-N 441.341 4.027 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc(C)n(C4CCCCC4)c3C)C(=O)NC2=S)cc1 2294235368 HINZGEOOKYVPGI-UHFFFAOYSA-N 437.565 4.450 10 10 IICE COc1ccc2[nH]cc(C=C3SC(=S)N(c4cc([N+](=O)[O-])ccc4OC)C3=O)c2c1 2321635576 QMBREPCUJOJCDW-UHFFFAOYSA-N 441.490 4.499 10 10 IICE Cc1ccc(CNC2([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c(O)c1Br 2352945251 SVLXAEAUXZXGAW-HNNXBMFYSA-N 425.367 4.342 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccccc2OC(F)F)SC1=S)Nc1cccnc1 6189809 SIDJXJGZXANCIW-LFIBNONCSA-N 449.504 4.303 10 10 IICE CCOC(=O)c1ccccc1NCN1C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)SC1=S 8426827 FOQVWSCHUZBFGN-GZTJUZNOSA-N 443.506 4.042 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 14544780 LIVRQJJFONDDEK-WVMBUTMQSA-N 435.549 4.015 10 10 IICE Cc1cc([N+](=O)[O-])cc2c1N(C)C(=O)/C2=C1/SC(N(C)c2ccc(Cl)cc2)=NC1=O 15016810 MXYXHEJXOIDGNF-BMRADRMJSA-N 442.884 4.010 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccccc2F)SC1=S)Nc1ccc([N+](=O)[O-])cc1 15040193 TYXLHRGFBPADOZ-ATVHPVEESA-N 445.497 4.354 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@H]32)cc1O 20690289 RCGJMINTISAEHC-PNCHPQGNSA-N 426.538 4.012 10 10 IICE COc1ccc(-n2cccc2/C=C2/C(=O)N(Cc3ccco3)C(=O)N=C2O)cc1Cl 96462435 HYGZENVSUFMBSO-MHWRWJLKSA-N 425.828 4.235 10 10 IICE Cc1cc(C(=O)N2CCC(CN3C[C@H](C)O[C@H](C)C3)CC2)c(C)n1-c1ccccc1F 110417598 HGFNLUCSIVBECS-KDURUIRLSA-N 427.564 4.195 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CSc3ccc4ccccc4c3)CC2)cc1 115336194 YKZBQVKEUSJWJQ-UHFFFAOYSA-N 449.620 4.269 10 10 IICE COc1cc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c([N+](=O)[O-])cc1F 301631394 UCFFCUHAZMVVQA-UHFFFAOYSA-N 429.370 4.210 10 10 IICE O=C(/C=C\c1ccc2ccc(Cl)cc2n1)NCc1ccc(N2CCC(CO)CC2)cc1 736196232 PKLRLAQWOHEWKS-YFHOEESVSA-N 435.955 4.427 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1CCN(C(=O)c2ccccc2)CC1 743809465 XIQMOHQGAGXJMS-UHFFFAOYSA-N 445.357 4.056 10 10 IICE COc1cccc(-c2ccc(CNC(=O)NCc3ccc(N4CCOCC4)c(F)c3)cc2)c1 745649792 YBCSUCRHRKLSBP-UHFFFAOYSA-N 449.526 4.337 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)N[C@H](C)Cn1cncn1 749212990 NUBLOYJLQCPERL-AUUYWEPGSA-N 446.477 4.161 10 10 IICE C[C@]1(c2ccccc2)CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 755867538 RYXQIJKOFBLMJS-QFIPXVFZSA-N 442.562 4.058 10 10 IICE C[C@@H]1CC[C@]2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)C2)C1 781796495 KXXSAVREYMHPFQ-IERDGZPVSA-N 425.495 4.264 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(C)c(C)c3)cs2)cc1 917844759 FRTVIOWVOYBSAR-UHFFFAOYSA-N 436.580 4.021 10 10 IICE CC1(C)C[C@H](NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CCS1 1134406229 NWELEKKBVVDKIA-YLQKULKDSA-N 438.615 4.207 10 10 IICE Cc1cc(C(=O)NCC(=O)OC2CCCCC2)c(C)n1-c1cccc(Br)c1 1137231207 QQLLFJNUNZDAST-UHFFFAOYSA-N 433.346 4.462 10 10 IICE O=C(Nc1n[nH]c2c(Cl)cccc12)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1137691674 PKQZZSCXKJCJIX-UHFFFAOYSA-N 448.913 4.037 10 10 IICE COc1ccc2c(=O)n(CC(=O)c3cc(C)n(-c4cccc(SC)c4)c3C)cnc2c1 1189013469 IJVZBSXGSLRQLC-UHFFFAOYSA-N 433.533 4.417 10 10 IICE Cc1cc(CCNC(=O)N[C@H](CC(N)=O)c2ccc(Cl)cc2)c(C)n1-c1ccccc1 1233974862 SXKVLRVEOIXPGO-JOCHJYFZSA-N 438.959 4.206 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)OCc1ccc(C)cc1 1297228589 OUVGTIIMJTYYEN-LJQANCHMSA-N 426.557 4.289 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(C)(C)c3ccc(Br)cc32)cc1 1307713511 UWSUBFRLIBQEJA-UHFFFAOYSA-N 430.390 4.319 10 10 IICE CCN(CC)[C@H](C)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1313660759 VCRFRINHHUIINN-OAQYLSRUSA-N 449.647 4.251 10 10 IICE CCN1CCN(c2ccc(CN[C@H](c3ccccc3Cl)c3nccn3C)cc2F)CC1 1321277106 LTRNDWAJLJINJM-HSZRJFAPSA-N 441.982 4.234 10 10 IICE CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357613343 YRTQKYOSLABFGC-WXTAPIANSA-N 437.559 4.439 10 10 IICE CC(C)N(Cc1ccco1)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1360119500 CWDRJUKCVSGPPJ-INIZCTEOSA-N 433.603 4.429 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3csc(C4CCCCC4)n3)cc2F)CC1 1435073867 HKPYSARITWWNFP-UHFFFAOYSA-N 430.593 4.402 10 10 IICE Cc1cccc(N2C[C@@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)c1C 1438179549 OSWXLCOOLPXMDO-QHCPKHFHSA-N 429.564 4.423 10 10 IICE O=C(CCC(=O)c1ccc2c(c1)CCC2)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1465951559 NLFGDBNKZBAEAK-QFIPXVFZSA-N 440.971 4.278 10 10 IICE Cc1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(C)c(O)c2O)c(Br)c1 1467620713 RFLODSXOHWZCGJ-MRXNPFEDSA-N 434.330 4.299 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](C)[C@@H]1CNC(=O)OC(C)(C)C 1470556400 UFFXMBIDWYMNNS-JLMWRMLUSA-N 446.636 4.327 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)S1 1512458150 NXFQHKREMSUDNT-JXXFODFXSA-N 433.597 4.103 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2C[C@H](C)O[C@H](C)C2)cc1 1515532872 SYLXQXDQRCUNJR-JQVVWYNYSA-N 427.593 4.028 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(F)cc2ccncc12 1516257236 VVYVHROYDHEJTO-UHFFFAOYSA-N 433.405 4.159 10 10 IICE COC1(C)CN(c2nnc(COc3cccc(C)c3)n2CCCSc2nccs2)C1 1517912279 PRMZYQHTAHHBJC-UHFFFAOYSA-N 445.614 4.030 10 10 IICE COc1c(Br)ccc(C)c1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1526968288 QGDCPANCAPESBA-OAHLLOKOSA-N 433.346 4.094 10 10 IICE CSCC[C@H](C)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1538625516 GABAFCRJFOJRND-WIOAZZGGSA-N 426.604 4.017 10 10 IICE COC(=O)c1ccc(F)c(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1538911857 YKGSGUFGUHUWNM-UHFFFAOYSA-N 446.276 4.430 10 10 IICE Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1538975325 CBVPYYMJONHOFP-RBUKOAKNSA-N 443.613 4.115 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(Cl)c1 1539708289 YTLUZWYZDIMXAS-FQEVSTJZSA-N 432.952 4.007 10 10 IICE Cc1ccc(C(=O)NCCNC(=O)c2ccc(Cl)cc2)cc1-n1c(C)cc(C=O)c1C 1540636278 VRKVKNWYYADJDF-UHFFFAOYSA-N 437.927 4.028 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H](Cc2ccc(F)cc2)C(N)=O)cc1 1542354500 GXAPXZQMQZJPSD-GOSISDBHSA-N 447.514 4.381 10 10 IICE Cc1cc(C(=O)N[C@H](C)COc2ccccc2)c(C)n1-c1ccc(Br)cn1 1542624453 DHYRJVPBEQIYMI-CQSZACIVSA-N 428.330 4.449 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCNc1ncccc1C(F)(F)F 1544542445 RFGSUPLUSBMDTG-UHFFFAOYSA-N 430.430 4.162 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CCCSC)CC2)cc1F 1554960204 CIOKASLBVPNNNU-UHFFFAOYSA-N 435.613 4.094 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C(=O)Nc1ccccc1 1564649435 CNKRYICESYPXKB-SJORKVTESA-N 428.964 4.403 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 1564945565 RMPYCHSPPNEGKU-SFHVURJKSA-N 432.559 4.044 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(NC(=O)c4cccs4)c3)C2)cc1 1585664597 DCAODBIIRTVRTG-KRWDZBQOSA-N 435.549 4.265 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(OCc3ccccc3)cc2)N(C)C)cc1 1618643734 NFDICRAIDBBZDB-AREMUKBSSA-N 431.580 4.293 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC3(OC)CCCCC3)CC2)cc1F 1619302021 GHMFICCURUIRKQ-UHFFFAOYSA-N 445.583 4.225 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccccc1Br 1623757218 ISCIGAHFXMRLFB-CALCHBBNSA-N 448.405 4.086 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COC1CN(C(=O)OC(C)(C)C)C1 1623923962 FDZBRQIZSUCPKB-SFHVURJKSA-N 440.540 4.118 10 10 IICE Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1627464071 IVKQPMUUZOSLGF-RUZDIDTESA-N 444.579 4.346 10 10 IICE COc1ccc(CN2CCCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2=O)cc1 1633463686 HDGKOMRFNRGJCU-UHFFFAOYSA-N 445.563 4.286 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CN(Cc4cccc(C)c4)CCO3)c2C)cc1 1635845227 NZMVVDLGYJWENL-VWLOTQADSA-N 447.579 4.042 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1 1637227759 BWBUOLHATHBHAZ-IBGZPJMESA-N 447.501 4.366 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnn(-c2cccc(Cl)c2)c1C 1637243796 JOCAARLWRYWKDK-UHFFFAOYSA-N 448.306 4.009 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)[C@@]12CCCO2 1638250239 JCQDPNSWITVUAA-VWPQPMDRSA-N 447.373 4.313 10 10 IICE CCSc1nc(C)c([C@H](CC)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)s1 1651024565 XMMZBGJNAMNBAU-IBGZPJMESA-N 432.659 4.125 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)[C@@H](C)C(=O)OCC)sc(C)c1-c1ccccc1 1653194178 HWHXQTYITVHXMG-CABCVRRESA-N 446.569 4.016 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)CC2 1673743360 CSJZEZMGLVYMSI-VCOUNFBDSA-N 444.620 4.175 10 10 IICE CN(C)[C@H](CNC(=O)NCc1c(O)ccc2c1CCCC2)c1cccc(C(F)(F)F)c1 1680362106 QHUCPBGNQHZMBM-HXUWFJFHSA-N 435.490 4.392 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H](O)c3ccc(-c4ccccc4)cc3)C2)cc1 1683504149 LWYWXZQFKQMXLX-FNZWTVRRSA-N 445.563 4.221 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)CC1 1697823042 XGWFNGTZWUHNJD-IBGZPJMESA-N 435.572 4.170 10 10 IICE CCOC(=O)N[C@@H](CC(C)C)Cn1c(C2CCCC2)nnc1N(C)Cc1ccccc1O 1746565421 BWGVOVFWHVJBAK-FQEVSTJZSA-N 443.592 4.439 10 10 IICE CC(C)=CC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1860567644 FNRCGHSSWJVJCG-UHFFFAOYSA-N 425.444 4.014 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3cccc(Oc4ccc(F)cc4)c3)CC2)cc1 1892111006 GRLPZSFBYHGSRP-UHFFFAOYSA-N 442.512 4.138 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3cc(Br)ccc3O)CCC[C@@H]12 2087290596 WRHGHJHGIXZORY-YLJYHZDGSA-N 425.367 4.424 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1 2188889732 ZLRPUUOQDZZVLW-WMZHIEFXSA-N 426.402 4.412 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1cccn1Cc1ccc(Cl)c(Cl)c1 2293606210 MBBOVJSMSZSEMQ-UHFFFAOYSA-N 444.274 4.098 10 10 IICE CCN(CC)c1ccc(NC=C2C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc1 2296400296 OQYZHPHYUOCPAN-UHFFFAOYSA-N 428.492 4.265 10 10 IICE C[C@@H](C(=O)Nc1ccc2oc(=O)ccc2c1)N1C(=O)C(=Cc2ccccc2)SC1=S 2296552766 NZHKEBGQYPZAGL-ZDUSSCGKSA-N 436.514 4.021 10 10 IICE Cc1ccc(COc2ccc(C=C3C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2)cc1 2297338437 BTHYJDMUNKOULX-UHFFFAOYSA-N 430.435 4.380 10 10 IICE COc1cc(C=C2SC(=S)N(c3cc(OC)c(Cl)cc3OC)C2=O)ccc1O 2321629418 HESKGBJZMNTUFP-UHFFFAOYSA-N 437.926 4.477 10 10 IICE Cc1ccc(CNC(=O)CCC[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352638867 TXKFBTGMFMDHFP-ZDUSSCGKSA-N 429.355 4.163 10 10 IICE COc1cc(/C=C2\SC(Nc3cccc(C)c3C)=NC2=O)ccc1OCCC(=O)O 210449597 GMIISPUDRONJQH-UNOMPAQXSA-N 426.494 4.248 10 10 IICE CCOC(=O)c1ccc(NC(=O)CN2C(=O)/C(=C\c3ccccc3C)SC2=S)cc1 210675736 OTPXAIXFBJYIEO-LDADJPATSA-N 440.546 4.012 10 10 IICE Oc1cc2c(cc1CNc1ccc(I)c(Br)c1)OCO2 312782918 OLERLKXMKPDMJN-UHFFFAOYSA-N 448.054 4.100 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526280161 YONUGNVQUPOKLX-JOCHJYFZSA-N 449.434 4.471 10 10 IICE COc1ccccc1N1CCC(NC(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 726249447 FYJJAIIDVRZGGZ-UHFFFAOYSA-N 435.524 4.375 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726567307 GWOTXCRUVGURKX-QVKFZJNVSA-N 443.494 4.281 10 10 IICE O=C(Nc1ccc(-c2ncon2)cc1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 727031248 FMHPVVLUFYVEPY-UHFFFAOYSA-N 429.427 4.129 10 10 IICE NC(=O)c1ccc(N2C(=O)/C(=C\c3ccc(-c4ccncc4)cc3F)SC2=S)cc1 751527290 SNQGDOQYRFGSLH-XDHOZWIPSA-N 435.505 4.392 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCC[C@@H]2COc3ccccc3O2)cc1 767186404 ZVQIQOYBFSFEMQ-JOCHJYFZSA-N 435.524 4.288 10 10 IICE CN(Cc1ccccc1O)C(=O)CSc1nnc(-c2ccco2)n1C1CCCCC1 767880390 CUBFWZAUSGDMPR-UHFFFAOYSA-N 426.542 4.500 10 10 IICE O=S(=O)(Nc1ccc(O)c(-c2nc(-c3ncsc3Cl)no2)c1)c1cccs1 812816523 JGSJQGDKQBBOLF-UHFFFAOYSA-N 440.915 4.081 10 10 IICE O=C1COc2ccc(N[C@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)cc2N1 913098487 ACEDLGQNNYSMJN-FQEVSTJZSA-N 441.447 4.177 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1[C@H]1C[C@H]2CC[C@H]1C2 917643804 KOXGNURCFBKZNN-CRFRJAQVSA-N 431.320 4.274 10 10 IICE O[C@H](CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)CN1CCc2ccccc2C1 920091591 JPLSALVPSCYZRY-BJKOFHAPSA-N 449.620 4.240 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)CCOc4ccccc43)cc2Cl)C1 1128488806 UXJRJNLQWAIYLO-KRWDZBQOSA-N 441.959 4.008 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3c(Cl)cc(Cl)cc3Cl)CC2)cc1 1136454348 URTDGHQLSLRECF-UHFFFAOYSA-N 442.774 4.207 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H]2CCCN(CCc3ccccc3)C2)cc1 1136480602 RQAQPVNHTVRRMA-BDYUSTAISA-N 449.639 4.215 10 10 IICE COc1ccc(OC)c(CN(CCO)C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1137933921 ADPSWNBKOVHCFM-UHFFFAOYSA-N 442.943 4.399 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NN1Cc2ccc(Br)cc2C1=O 1147872233 BVXWBESESDHGAJ-UHFFFAOYSA-N 430.327 4.219 10 10 IICE Cc1cc(C(=O)N(CCO)CCOCC(F)(F)F)c(C)n1-c1ccc(C(C)C)cc1 1151412835 IOTKZMMSMQVFSS-UHFFFAOYSA-N 426.479 4.231 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(-n4nc(C)c(CC)c4C)c3)CC2)cc1 1151503481 WXGPLCIQRSWYLG-UHFFFAOYSA-N 432.568 4.413 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2CSC2=NCCS2)N(C)C)cc1 1158716456 FIOXKOYWJMZBJT-NRFANRHFSA-N 442.654 4.121 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCCCC[C@@H]2NC(=O)OC(C)(C)C)cc1 1300281491 RZSADVMPWHWNTC-YADHBBJMSA-N 447.620 4.454 10 10 IICE O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1cc(Cl)ccc1O)OCc1ccccc1 1306869607 DZNXLHHRXRHBSS-NRFANRHFSA-N 438.911 4.200 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)CCOC(C)(C)C)cc1 1313679946 KYRXXSOXTJZJGJ-OAQYLSRUSA-N 443.636 4.318 10 10 IICE CCOC(=O)[C@@]1(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)CCc2ccccc21 1360686592 BOHGQLXCHTZIJE-AREMUKBSSA-N 434.536 4.039 10 10 IICE CCOC(=O)C1CCC(CC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1 1435332124 JUOAYNOPKBJSAO-DAWZGUTISA-N 438.515 4.133 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C(F)F)cc1 1436586604 PRNGSSGULPYGNI-IBGZPJMESA-N 433.499 4.421 10 10 IICE Cc1ccccc1CC(=O)N1CCN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 1443004009 HRPUPYNXLDBMQV-UHFFFAOYSA-N 433.527 4.069 10 10 IICE Cc1cc(N2CCC[C@@H](N3CCOc4cc(N(C)C)ccc43)C2=O)ccc1Br 1459878214 XZJLOZUQCGINBU-HXUWFJFHSA-N 444.373 4.218 10 10 IICE CC[C@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1464656261 NMQWGTZUJMVGLK-OAHLLOKOSA-N 430.551 4.178 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](C)c3cc(Cl)cc4c3OCC4)C2)cc1 1470592194 AIHNQRWIYUCUIN-CVEARBPZSA-N 429.948 4.170 10 10 IICE Cc1cc(C(=O)N2C[C@]3(C)CN(C)C[C@@]3(C)C2)c(C)n1-c1ccc(Br)cc1 1470674216 LFJOHHUCGIJSLK-VXKWHMMOSA-N 430.390 4.270 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(c2=O)CCCC3)c(C)n1-c1cccc(C(F)(F)F)c1 1473012038 QLRRXHQFCIPUKR-UHFFFAOYSA-N 429.442 4.431 10 10 IICE Cc1cc(C)n(-c2ccc(Cn3c(CC(C)C)nnc3N(C)Cc3ccccc3O)cn2)n1 1492727873 KRNUUGDDBJPOKK-UHFFFAOYSA-N 445.571 4.064 10 10 IICE CN(CCOC(C)(C)C)c1nnc(C2CC2)n1Cc1ccc(N2CCSCC2)cc1 1503625723 YVPKBFYJRGSQGE-UHFFFAOYSA-N 429.634 4.008 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCC3(OC)CCC3)CC2)cc1 1504292605 OHOZHYDRNOJLKI-UHFFFAOYSA-N 441.620 4.161 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)C1 1505221483 YSGUSBJVNQIATK-HZPDHXFCSA-N 439.676 4.143 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@](C)(O)CCC(C)C)cs1 1511518268 JAMTYVGKDOCGOW-HSZRJFAPSA-N 443.617 4.163 10 10 IICE COC(=O)COc1ccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1515114150 SIADILGZEDKQBO-UHFFFAOYSA-N 426.900 4.481 10 10 IICE CC(=O)Nc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1Cl 1524070992 ULMUZAGQSDNPBS-HNNXBMFYSA-N 437.874 4.299 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCOCCc2ccccc2)C1 1527604861 MMFLPBXETOSTCL-UHFFFAOYSA-N 433.596 4.173 10 10 IICE CSc1cncc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1529417194 APRZKVKNYXNTRM-PXNMLYILSA-N 433.555 4.173 10 10 IICE CN(C)CCOc1ccc(/C=C/C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1 1530325187 QRURWYSINGMSOE-NTEUORMPSA-N 449.517 4.297 10 10 IICE CCOc1ccccc1N1C[C@@H](C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1531612326 PRNBJSDALKPEOV-NRFANRHFSA-N 431.536 4.162 10 10 IICE Cc1cc(CCNC(=O)CC2(CNC(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1534247540 MYPUSBLLINAQLA-UHFFFAOYSA-N 425.573 4.448 10 10 IICE COC(=O)c1c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc(C)c1C 1537372032 UDXBVVKQDCFYOP-UHFFFAOYSA-N 433.552 4.450 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3Cl)cc2)CC1 1537840075 UUQLKTHVFPXGKN-VQTJNVASSA-N 446.378 4.115 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 1539581740 IVPLTFATGSNZNC-QGZVFWFLSA-N 445.466 4.403 10 10 IICE Cc1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC2CCCC2)c(C)n1-c1ccccn1 1545629308 CQSJNIXLRRUUBY-QHCPKHFHSA-N 431.536 4.316 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cc(Cl)cc(Cl)c3)CC2)cc1F 1595483673 YVKJWAOTMBNCLQ-CYBMUJFWSA-N 427.303 4.257 10 10 IICE CCSCCCn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1617544278 CUGIXRZMLUULMD-FQEVSTJZSA-N 429.634 4.162 10 10 IICE COc1ccc(-c2nc(NC(=O)c3cc(C)n(-c4ccccc4C)c3C)n[nH]2)cc1OC 1618397074 VKUWUBMBWYTYHQ-UHFFFAOYSA-N 431.496 4.457 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1620290253 ZKCIJQJFICHMSV-SFHVURJKSA-N 425.602 4.331 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1cc(Br)cc(Br)c1O 1628667097 PBHXKXFPCGOFNQ-UHFFFAOYSA-N 435.499 4.206 10 10 IICE Cc1cc(C(=O)NCc2c(C3CC3)cnn2C)c(C)n1-c1cccc(Br)c1 1633138444 AXLIMXCJFBPAOC-UHFFFAOYSA-N 427.346 4.398 10 10 IICE COc1ccc(C(=O)CC(C)(C)CC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 1635891108 UEVDXDIQBGPCKK-UHFFFAOYSA-N 442.531 4.181 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1ccc2c(c1)N(C(=O)OC(C)(C)C)CC2 1636058486 DSZKEWCGPSRNJT-UHFFFAOYSA-N 431.529 4.034 10 10 IICE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)c3cc(C)n(-c4ccccc4Br)c3C)[C@@H]2C1 1639700302 NOIYZZYZAWGTDM-GFIVTLFCSA-N 445.357 4.174 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1cccc(O)c1O)c1ccccc1Br 1643809165 GFOKKPBEXIHCIZ-UHFFFAOYSA-N 441.281 4.043 10 10 IICE COc1ccc([C@H](CNC(=O)OC(C)(C)C)CN(C)c2ccc(OC)c(OC)c2)cc1 1644464366 JCUUCSMNEZJPBG-GOSISDBHSA-N 430.545 4.457 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCc2ncn(C)c2Br)c1 1645592582 GCWPOZCLXNBWFW-UHFFFAOYSA-N 435.753 4.216 10 10 IICE COC[C@@H]1CC[C@H]([C@H]2COCCN2C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)O1 1646250561 JEYOHJCFTQHILQ-ICDZXHCJSA-N 440.584 4.253 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2C[C@]3(CO)CCCC[C@]3(CO)C2)cc1 1648267510 HGJCEGMBEDQJOC-PLQXJYEYSA-N 436.556 4.155 10 10 IICE CC(=O)c1nn(C)cc1OCC(=O)c1cc(C)n(-c2ccc(OC(F)(F)F)cc2)c1C 1652265505 RANLAHHYJZUITC-UHFFFAOYSA-N 435.402 4.191 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(Cl)cc1 1660293553 BLEONXXNGRXMNS-IRXDYDNUSA-N 433.955 4.235 10 10 IICE COc1cc(OC)c(C[C@@H](C)NC(=O)NCc2cc(Cl)cc(Cl)c2O)c(OC)c1 1672868195 XVACBXDHTRGALR-LLVKDONJSA-N 443.327 4.155 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@]3(C)Cc3cccc(F)c3)C2)cc1 1682188148 HUGWBKSQUKAOIC-NLFFAJNJSA-N 425.548 4.467 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)N(C)C)cc1 1685682285 XVTIKCFZFYDPLS-SGNDLWITSA-N 442.579 4.056 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)C3CCCCC3)CC2)c(C)n1-c1ccccc1 1687216704 GOBHVVCRSWCNEO-UHFFFAOYSA-N 436.600 4.071 10 10 IICE Cc1nc(Cc2nnc(N3CCC(F)(F)C3)n2CCCSc2nccs2)cs1 1693351079 GEKVQNSYVFKBQG-UHFFFAOYSA-N 442.586 4.118 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1OCCC1(C)C 1708526975 IVKFALLJWBYTCO-UWJYYQICSA-N 445.583 4.081 10 10 IICE CCc1nnc(N(CCOC)[C@H]2CC[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1762915396 BBAADGQUFSQKBN-KNQAVFIVSA-N 443.661 4.083 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NCc2c(O)cccc2Br)C12CCC2 2118412396 AYMXHGLTJBRQFC-CXAGYDPISA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)NC(C)(C)c1csc(=NCc2cc(Br)ccc2O)[nH]1 2267671695 XGQWWVWDMSNGRP-UHFFFAOYSA-N 442.379 4.405 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccc(Br)cc34)C2=O)cc1C 2293803474 BCQVDFWLIVLGLG-UHFFFAOYSA-N 438.281 4.214 10 10 IICE N=C1C(=Cc2ccc(OCc3ccccc3)cc2)C(=O)N=C2SC(c3cccnc3)=NN12 2296056370 NUUOSYNZTUZQHK-UHFFFAOYSA-N 439.500 4.328 10 10 IICE CN(C)c1ccc(C=C(NC(=O)c2ccccc2F)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 2297297873 CTRXAIHBNJLVQK-UHFFFAOYSA-N 448.454 4.210 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCC(=O)Nc1ccc(Cl)cc1 2314835644 NVIOEYZGTSUYHC-UHFFFAOYSA-N 448.953 4.245 10 10 IICE CCN(CC)c1ccc(N2C(=O)C(=Cc3cccc(OCC(=O)O)c3)SC2=S)cc1 2314930995 KOHXBCFGLJEPFC-UHFFFAOYSA-N 442.562 4.402 10 10 IICE O=C1/C(=C/c2ccc(Br)cc2)SC(=S)N1C(=O)c1cccc([N+](=O)[O-])c1 3087494 FESUJVSJRMGSNQ-ZSOIEALJSA-N 449.307 4.399 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@@H]3C=CC[C@@H]32)c1O 14459728 BNXIVOFWWPVMKY-VWKPWSFCSA-N 428.554 4.304 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S)NCc1ccccc1 15045203 BLFCNRPKWYQKHY-HKWRFOASSA-N 440.590 4.470 10 10 IICE Cc1cc(C(=O)CSc2nc3ccccc3c(=O)n2CCCO)c(C)n1-c1ccccc1 23596124 CLGLEPMYAOHDSZ-UHFFFAOYSA-N 447.560 4.161 10 10 IICE CCOC(=O)CCCCCN1C(=O)/C(=C/c2ccc(OCC)c(OC)c2)SC1=S 40928311 BFIYEYDUZTYRNM-JXAWBTAJSA-N 437.583 4.419 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2(c3ccccc3)CCOCC2)C1 574830490 LMGSBJZMLHAHLC-UHFFFAOYSA-N 431.580 4.230 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NCCc3ccc4ccccc4n3)cc2F)C[C@@H](C)O1 744305425 PWSRSMHLUGJTET-QZTJIDSGSA-N 436.531 4.029 10 10 IICE Cc1ncc(/C=C\C(=O)NCc2ccc(N(C)C(=O)/C=C/c3cnc(C)s3)cc2)s1 765483036 TWFGHCIABNNSOM-PNQPDEHRSA-N 438.578 4.222 10 10 IICE Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 772449871 XTUJAPRHJDGGGE-HSZRJFAPSA-N 439.604 4.089 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)[C@H](O)c1ccc(OCc2ccccc2)cc1 773766447 MAYYXSZATXKYGK-AVRWGWEMSA-N 449.547 4.484 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)NCCCSc1nccs1 778288166 CXXVGUUNVWVBNW-UHFFFAOYSA-N 446.392 4.235 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC(F)(c2ccc(Cl)cc2)CC1 798371852 FNGPITZPLRZIEO-UHFFFAOYSA-N 449.929 4.486 10 10 IICE Cc1ccc(C(=O)CCC(=O)CCC(=O)NCc2cc(Br)ccc2O)s1 804735742 DUJCSZBQDWQYGM-UHFFFAOYSA-N 438.343 4.153 10 10 IICE Cc1c(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cccc1N1C(=O)N[C@@H](C)C1=O 811538574 XNXBWLTWNCNCQP-HNNXBMFYSA-N 434.471 4.239 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCCN2Cc2ccc(N3CCOCC3)cc2)C1 816658543 OOFLJVKVBUJMIK-FYYLOGMGSA-N 429.605 4.135 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cccc(C(=O)OC)c3)n2)c1C 818787283 AHXVVEYOSJLXNJ-UHFFFAOYSA-N 433.555 4.226 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)Nc1nc(CN2CCCCC2)cs1 916670908 SZIVVWMUKYBRNR-UHFFFAOYSA-N 431.631 4.004 10 10 IICE O=C(Nc1ccc(N2CCCCC2)cc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 918293747 GBACYCRXHFPUKA-UHFFFAOYSA-N 433.508 4.143 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](C)[C@@H]3C(=O)OC(C)(C)C)ccc21 1129949598 ABZISCVDVRXXCC-OPAMFIHVSA-N 428.573 4.487 10 10 IICE CCCc1nc(C(=O)N(C)CCN(C)c2ccc(OC)cc2)nn1-c1ccccc1Cl 1130745505 ZAHJTTBXVLXIHG-UHFFFAOYSA-N 441.963 4.090 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CC(=O)N(CCOc4ccccc4)C3)c2C)c1 1136944526 IWICFDOBSRKJCI-QFIPXVFZSA-N 445.563 4.121 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1C 1137669012 WULUDTKRRUZREQ-UHFFFAOYSA-N 431.536 4.497 10 10 IICE COCCCn1cc(C)c(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1141080483 OGVHZABSTOTHDS-UHFFFAOYSA-N 446.349 4.045 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)OC(C)(C)C 1142419988 YFXQHHVKKBYKSP-YWMIEGDOSA-N 429.605 4.048 10 10 IICE CCC(CC)[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1147517085 CLFKBXFUMRZXIC-QLWPUQSHSA-N 449.595 4.194 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cnc(-c2c(F)cccc2F)s1 1147838487 YVECDTGQUUZJGH-UHFFFAOYSA-N 443.519 4.227 10 10 IICE Cc1cc(C(=O)N[C@H](C2CCC2)[C@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1149525915 ZTTAZSIGHDFMFA-UYAOXDASSA-N 432.362 4.329 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Br)cc1F 1150347154 GJNNNRNEHDBSSI-OAHLLOKOSA-N 441.728 4.342 10 10 IICE CCOC(=O)[C@@H](Cc1cccc(Cl)c1)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1156009467 PYPSFZKPWKAFEM-HXUWFJFHSA-N 425.916 4.047 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1234325371 CVMPIPGHWGXTDY-UHFFFAOYSA-N 426.561 4.247 10 10 IICE CC(C)(C)c1nnc(N2C[C@H](O)CC3(CCCC3)C2)n1CCCSc1nccs1 1286997010 HDGJQHAHHVZSSF-MRXNPFEDSA-N 435.663 4.346 10 10 IICE CC[C@H](C)[C@@H](Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1291419621 NSYDCRQRGYUIQH-IEIRFRATSA-N 441.620 4.080 10 10 IICE CCC1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)[C@@H](C)CC(N)=O)CC1 1292411830 XRSRFGGKQHPPMO-KRWDZBQOSA-N 434.588 4.243 10 10 IICE CCc1nnc(N(C)Cc2ccc(Cl)s2)n1Cc1ccc(N2CCOCC2)cc1 1292831678 OXBDUBNNUWWRRT-UHFFFAOYSA-N 431.993 4.077 10 10 IICE CC[C@H]1CCCCN1CCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1293374949 ZLJQEWYQDZHTOI-RBBKRZOGSA-N 427.593 4.126 10 10 IICE COc1cc(F)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(Cl)c1 1294860199 RWIDNYHTDSRMGG-CQSZACIVSA-N 427.303 4.241 10 10 IICE Cc1cc(C(=O)N[C@H](CO)[C@@H](C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1295512443 KHFIRIGQQDAICV-MGPUTAFESA-N 442.357 4.146 10 10 IICE CCC1CCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)CC1 1306365606 XFMZAMFRYOFOOM-LJQANCHMSA-N 441.620 4.059 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3ccc(OC)cc3Br)C2)cc1 1312368406 PHHWXIDCDVHXMX-CABCVRRESA-N 448.361 4.105 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@H]3c3ccc(O)nc3)cc2Cl)C1 1312590759 PWCBPXILMFAUBD-LYLBAIIYSA-N 444.963 4.006 10 10 IICE O=C(Cn1nc(C(F)F)cc1C1CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1360045590 MYLBFJQXTBSUJI-UHFFFAOYSA-N 440.441 4.085 10 10 IICE CC[C@@H](Cc1ccccc1Br)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1438889086 YKOWPFUXHLGHRT-IBGZPJMESA-N 444.417 4.086 10 10 IICE Cc1ccccc1Oc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)nc1 1444660349 CXPYMPCWJURBKO-UHFFFAOYSA-N 431.536 4.321 10 10 IICE Cc1cccc(C)c1OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324742 HXDIIMPEJKGLNA-NRFANRHFSA-N 441.572 4.130 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1470969040 OWHZHCHVWCLBKH-DYESRHJHSA-N 440.588 4.334 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4c3ccc(F)c4Br)C2)cc1 1478634045 CYZFNSQBYDXXQH-ORAYPTAESA-N 448.336 4.162 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cccc(Oc3ccc(F)cc3)n2)cc1 1478928767 LASGJRBLLYYMEW-UHFFFAOYSA-N 438.503 4.299 10 10 IICE Cc1cnn([C@@H]2CCCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)cc3C)C2)c1 1511400431 FEJADAAESMNSDB-JOCHJYFZSA-N 435.620 4.345 10 10 IICE Cc1cc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cc(C)n1 1529385028 OQHAOXOEROJWDH-BOPFTXTBSA-N 431.608 4.058 10 10 IICE CN(C)[C@@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(Cl)cc1 1533327067 ASSHHLOKHSVAMZ-YLJYHZDGSA-N 437.918 4.329 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccccc1F 1533844525 ZKHZGKFCESQXAT-QFIPXVFZSA-N 428.891 4.460 10 10 IICE Cc1ccccc1NC(=O)[C@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1537396441 BGEZYMYJNBUGEP-HSZRJFAPSA-N 433.577 4.485 10 10 IICE Cc1cc(CC(=O)NCc2cc(Cl)ccc2N2CCOCC2)c(C)n1-c1ccccc1 1540012067 ZXVNCLONKOREJS-UHFFFAOYSA-N 437.971 4.443 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CC2([S@@](C)=O)CC2)c(C)n1-c1ccccc1 1542181141 LLBGKSKBCLJOFV-WJOKGBTCSA-N 439.629 4.356 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N1CCC[C@H]1C 1542226964 OEXXHYRAGFJNJK-OAHLLOKOSA-N 443.393 4.447 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1547043767 OJZPACUIIOGCMH-HSZRJFAPSA-N 448.615 4.261 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cc(C)on1 1548263941 IENRTJRWMHQMMS-UHFFFAOYSA-N 434.544 4.322 10 10 IICE C[C@H](NC(=O)[C@@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)c1ccccc1O 1557967499 FHUIIVVPBBHHIT-UGSOOPFHSA-N 449.320 4.166 10 10 IICE O=C(Nc1cc(-c2ccc(Cl)cc2)nn1CCO)c1cc2cc(O)c(O)cc2s1 1558926117 PTPWWRWOADBBJC-UHFFFAOYSA-N 429.885 4.074 10 10 IICE Cc1cccc2c1C[C@@H](C(=O)N1CCOc3cc(N(C)C)ccc31)N2C(=O)OC(C)(C)C 1586831948 FNFDDOTWCOXVGZ-NRFANRHFSA-N 437.540 4.153 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCCc2nc(C(=O)OC)ccc21 1587323029 VQQMCECGFGCOAL-JLHYYAGUSA-N 431.492 4.198 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccc(F)cc1 1587345645 XUEOMYQKVCTABJ-NRFANRHFSA-N 425.891 4.422 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cc(F)ccc2CS(C)(=O)=O)c1 1587412798 DFVDFKQKMCLVTJ-UHFFFAOYSA-N 428.529 4.016 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)COc2cccc3c2OC(C)(C)C3)cc1 1598290817 DZKKFRGIJDMYHT-QFIPXVFZSA-N 438.568 4.053 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@]2(CO)CC[C@@H](C)C2)sc(C)c1-c1ccccc1 1617443847 POVYYLAWORCRAY-GYCJOSAFSA-N 444.597 4.322 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(Br)=NN1c1ccc(C)cc1 1622319787 ZNPKLIXDQNQQRT-SFHVURJKSA-N 430.346 4.427 10 10 IICE Cc1cc(CCNC(=O)[C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)c(C)n1-c1ccccc1 1623739217 LWYJQKMUJMNLIH-OAQYLSRUSA-N 425.573 4.398 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCCOC3)C2)c(C)n1-c1cccc(Br)c1 1626294823 YTIWJZSDFWFXCH-AOMKIAJQSA-N 447.373 4.267 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(C[C@@H]2C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1627209348 CQFSVAKDYDFCAQ-BWKNWUBXSA-N 427.589 4.330 10 10 IICE Cc1cc(C(=O)NC[C@@]2(N(C)C)CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1630863405 NGPDNJCLVNMAAM-OYHNWAKOSA-N 447.421 4.492 10 10 IICE CCOC(=O)c1cc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n[nH]1 1633246251 ZVKMWJBNLVBELI-UHFFFAOYSA-N 431.290 4.009 10 10 IICE CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1634398106 COOFJLBREUEDOB-UGKGYDQZSA-N 440.588 4.193 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nn(-c2cc(F)cc(F)c2)c2c1CCC2 1634725180 QOGRKGQBZLXKNJ-UHFFFAOYSA-N 448.267 4.037 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CS(=O)(=O)c3ccccc32)c(C)n1-c1cccc(Cl)c1 1637373577 CYAAEPZXMBKACW-MRXNPFEDSA-N 428.941 4.048 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H]2CCOC2)c(C)n1-c1ccc(Br)cc1 1645743118 GZFWFGNUTQHPJR-YLJYHZDGSA-N 447.373 4.124 10 10 IICE CCN(C)c1ccc(CN2CCC([C@@H]3OCCC[C@H]3NC(=O)OC(C)(C)C)CC2)cc1 1658889618 MZUNTTUQAPHTGC-PKTZIBPZSA-N 431.621 4.427 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 1679394601 JCWOKRDSFORNAT-RUZDIDTESA-N 444.620 4.465 10 10 IICE C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684873447 HDZGJXDEODWYEP-OALUTQOASA-N 429.008 4.425 10 10 IICE CC[C@H](C)[C@H](Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1693965789 NRPDZICTGBCCNY-UGKGYDQZSA-N 429.609 4.188 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1694821298 FLRRTKULUKPAQO-NNMXDRDESA-N 441.620 4.058 10 10 IICE CCCCN(CC)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1695210119 UTYYAAMUTMELPU-UHFFFAOYSA-N 448.615 4.224 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC[C@H]1CC 1696322680 VTVSSYCDGXXOIT-NHCUHLMSSA-N 441.620 4.366 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](OC)C(C)C)C1 1697149625 XASWDFTUTQINIU-JTHBVZDNSA-N 437.588 4.249 10 10 IICE C[C@H](CNC(=O)OC(C)(C)C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O 1706829133 RNZBRLJBHOOMIY-QGZVFWFLSA-N 445.608 4.370 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1710026105 XIBPWUSHBCYQKC-XXBNENTESA-N 434.588 4.096 10 10 IICE CCOCc1nnc(N2CCc3ccc(F)cc3C2)n1CCCSc1nccs1 1710699873 PFFIOTVFSXPCTR-UHFFFAOYSA-N 433.578 4.155 10 10 IICE COCCCCCn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1712362311 PCLDWHBVRSWUDG-UHFFFAOYSA-N 447.599 4.158 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N(CC)CC2CCC2)cc1 1746086022 HEUYIDLXDSFVTA-UHFFFAOYSA-N 438.620 4.035 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1CCC(F)(F)CC1 1762869768 NIZAJNMTJZEXBK-UHFFFAOYSA-N 433.547 4.139 10 10 IICE COCCN(c1nnc(C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@@H](C)C1 1769799918 FYSXKXOIXPIPBC-MJGOQNOKSA-N 431.600 4.470 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)sc(C)c1-c1ccc(C)cc1 1860646333 MRQAXEQYUWLDLD-SFHVURJKSA-N 440.565 4.406 10 10 IICE COCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N([C@@H]2CCCC[C@@H]2C)C1=O 1873165712 QWCADKMMVRKGDJ-FDDCHVKYSA-N 449.595 4.379 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(OCCOc4ccccc4)cc3)CC2)cc1 1892052313 NSUBBJNFTMXVDT-UHFFFAOYSA-N 432.520 4.115 10 10 IICE CC[C@@H](NCCO[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2165422728 ORNVESKWYKENGR-NVXWUHKLSA-N 443.382 4.221 10 10 IICE CCCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc(O)c(OC)c3)SC2=S)cc1 2321586597 YKUCXOMBHWCJEH-UHFFFAOYSA-N 429.519 4.373 10 10 IICE COc1cc(C=C2C(=O)N(Cc3cccc(F)c3)N=C2c2ccccc2)cc(OC)c1O 2332147533 JMXNYOSJVWAESC-UHFFFAOYSA-N 432.451 4.379 10 10 IICE O=C1N=C(N2CCN(c3ccc(Cl)cc3)CC2)S/C1=C\c1cccc([N+](=O)[O-])c1 1181677 GPCPEIBKHRNSQX-AQTBWJFISA-N 428.901 4.041 10 10 IICE COc1ccc(/C=C2\C(=O)N(c3ccc(NC(C)=O)cc3)N=C2c2ccccc2)cc1OC 13914283 XCVJIORFIQUOGL-JCMHNJIXSA-N 441.487 4.497 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(C(C)=O)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526437856 QBQGFIVVGLSFKB-HSZRJFAPSA-N 431.444 4.366 10 10 IICE CCC[C@H](NC(=O)c1cccc(N2C(=O)/C(=C/c3ccccc3)SC2=S)c1)C(=O)O 606671965 HPUAGKJYLMMMQK-KMTKGMGQSA-N 440.546 4.076 10 10 IICE O=C(O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(C(=O)O)cc1O 687755767 IOWHXBOYFUHMLO-OAQYLSRUSA-N 447.443 4.145 10 10 IICE COc1cc(Br)cc(CN[C@H]2CCc3nc(-c4ccccc4)ncc3C2)c1O 725851772 XKWQGAXVMVEOCA-SFHVURJKSA-N 440.341 4.267 10 10 IICE COc1ccc(N(Cc2nnnn2-c2ccccc2Br)[C@@H](C)C2CC2)cc1 732202956 JVKFOIORNVPQBY-AWEZNQCLSA-N 428.334 4.239 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2cnccn2)c(C)n1-c1ccc(Br)cc1 740966225 RTJTWRIXNPZUDE-YVMONPNESA-N 440.297 4.086 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1c(F)cc(Cl)cc1F 775380459 OFLGXBVNSZSMGQ-UHFFFAOYSA-N 434.918 4.472 10 10 IICE COc1cc(C)cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1C 785762908 CYHHYERVRVKQAD-UHFFFAOYSA-N 430.416 4.248 10 10 IICE COc1cccc(CNC(=O)C[C@@H](NC(=O)OC(C)(C)C)c2cc(C)nc(Cl)c2)c1O 788516014 LUDSAGPQDKZABM-MRXNPFEDSA-N 449.935 4.030 10 10 IICE Cc1ccccc1-n1nccc1[C@H]1OCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 792783937 GFILHJBKZHGTGY-DHLKQENFSA-N 430.552 4.175 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(Oc4cnccn4)CC3)cc2Cl)C1 799993769 FGVXZKZNIRXFLI-QGZVFWFLSA-N 443.979 4.119 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCOC3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802683045 CTECZVJJODPXAS-RBBKRZOGSA-N 435.572 4.004 10 10 IICE CCOC(=O)c1cnn(C2CCN(Cc3ccc(OCc4ccccc4)cc3O)CC2)c1C 809687032 BQESBUJVUWDLSQ-UHFFFAOYSA-N 449.551 4.490 10 10 IICE CCN1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)CC1 812308570 QRKFEMHBZJRDCO-QHCPKHFHSA-N 448.615 4.064 10 10 IICE Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)c(C)n1-c1ccccn1 914903165 HRCLRMBQDZFXQK-IBGZPJMESA-N 432.524 4.273 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)/C=C\c2ccc(-n3ccnc3)cc2)cc1 917115122 WHHUPOKEVGHUGC-AIPUNRDYSA-N 430.552 4.159 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(CNC(=O)C(C)(C)C)ccc3Cl)C2)cc1 1131030527 RREMXGMLSSBQMX-QGZVFWFLSA-N 443.975 4.020 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1 1135689565 HVAOHEJCGINQNR-QFIPXVFZSA-N 439.625 4.224 10 10 IICE CCOc1ccccc1[C@H](CC(=O)N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1137345597 OTAKCGGRZJCTHF-IBGZPJMESA-N 428.529 4.405 10 10 IICE Cc1nnc2n[nH]c(NC(=O)c3cc(C)n(-c4ccccc4Br)c3C)c2c1C 1140401758 NREOQEOWSPMECN-UHFFFAOYSA-N 439.317 4.392 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@@H](C)C[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1141736550 RXHBZKMJRRGWOS-HOTGVXAUSA-N 447.421 4.349 10 10 IICE Cc1cc(C(=O)N2CCCC3(CCN(C)CC3)C2)c(C)n1-c1ccc(Br)cn1 1155859130 UCTBVWPOVIMEIB-UHFFFAOYSA-N 445.405 4.200 10 10 IICE Oc1ccccc1CN(Cc1cc2c(cc1Br)OCCCO2)C[C@H]1CCCO1 1167983965 PTFHDFNWWMJJLF-GOSISDBHSA-N 448.357 4.497 10 10 IICE Cc1cc(C(=O)Cn2nnnc2CCCc2ccccc2)c(C)n1-c1ccc(Cl)cn1 1188864457 XBQVRCKYSMVRCH-UHFFFAOYSA-N 434.931 4.187 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1COc2cccc(Br)c2C1 1235756891 UNRBGAJOQJOMQH-INIZCTEOSA-N 433.346 4.470 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(OCC(F)(F)F)o1 1265564224 GCMCYTYPHCTVGX-LBPRGKRZSA-N 434.361 4.221 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](COC)C1)OC 1292174887 OUJAFEVHLJQVPB-RBBKRZOGSA-N 437.588 4.250 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1293621029 JSJPYYKEBUCLHG-JOCHJYFZSA-N 439.629 4.440 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc([C@@H]3CCCC(=O)N3)c2)cc1 1303729705 HYAPKRGEUMOFGB-DEOSSOPVSA-N 429.520 4.429 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1)OC 1305806293 FLIZDSKDEGJLFJ-VXKWHMMOSA-N 437.588 4.393 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)sc2c1CCCC2 1349326641 AOZOJBOCYKSIPF-CQSZACIVSA-N 444.528 4.243 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1CCC(F)(F)CC1 1435778840 UOGWVGHJDYMUOE-RVDMUPIBSA-N 428.501 4.111 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnn2c1N[C@H](C)C[C@@H]2C(F)F 1445657447 VJJCRCOLVZOHFJ-QMTHXVAHSA-N 443.292 4.024 10 10 IICE COC(=O)Nc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)ccc1F 1456090883 ZCISYWRQSBKINP-UHFFFAOYSA-N 427.398 4.275 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)C)C(=O)[C@@H]2C)c(C)n1-c1ccccc1Br 1467323709 LFYCPMOIELZTHJ-KRWDZBQOSA-N 446.389 4.186 10 10 IICE Cc1cc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc(N2CCCC2)n1 1468671275 YKGJLHQEPZUHRT-UHFFFAOYSA-N 430.552 4.449 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)c2C)c1 1473007001 DXEWMOZPNHAMMY-UHFFFAOYSA-N 446.463 4.319 10 10 IICE COc1cc2c(cc1OC)CCN(C(=O)NCc1cc(C)n(-c3ccccc3)c1C)CC2 1479101377 ZHQSXISNKSNXJA-UHFFFAOYSA-N 433.552 4.422 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1496021349 ARGGEXPAECDPSM-FPOVZHCZSA-N 443.661 4.256 10 10 IICE CC(C)(C)Cc1nnc(N2CC[C@@H]([C@@H]3CCOC3)C2)n1CCCSc1nccs1 1508556101 BWPQWBCHSANIAU-IAGOWNOFSA-N 435.663 4.368 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)c1ccc2c(c1)CCO2 1518472139 ZUQWQIVYOPPLMA-JOCHJYFZSA-N 438.911 4.327 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)COc3ccc(C(C)(C)C)cc3)cc2F)C[C@@H](C)O1 1527481388 KYTKHLOJBRNCGO-QZTJIDSGSA-N 428.548 4.432 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC(C)(C)c3ccc4c(c3)OCCO4)ccc21 1535528481 NTEWXYYQYRJNIK-UHFFFAOYSA-N 436.552 4.383 10 10 IICE CCOc1ccccc1N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1535562009 WULGKMYGRMQEPZ-XMHGGMMESA-N 444.553 4.479 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@@H]2CCCC[C@H]2C1 1538543667 ZRMXEPKFYANIKG-XGSMPBFLSA-N 432.586 4.456 10 10 IICE CCc1ccc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)cc1 1540681443 UZFYGRVSQUSLIS-UHFFFAOYSA-N 433.527 4.394 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCCN(C(=O)Cc3cccc(F)c3)CC2)c1 1566261216 YWHRKWINKULJEQ-UHFFFAOYSA-N 447.554 4.459 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)cc1-n1c(C)cc(C=O)c1C 1566320220 CENXQARLRPKPED-HXUWFJFHSA-N 436.943 4.272 10 10 IICE COc1cccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c1F 1566845315 CAPURJPUUCERDV-UHFFFAOYSA-N 433.527 4.451 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1ccc(Br)cc1=O 1566850064 VSHUAZSNSJUTDP-INIZCTEOSA-N 441.325 4.106 10 10 IICE Cc1cc(C(=O)N[C@@H](C(C)C)C2(CO)CCC2)c(C)n1-c1ccc(Br)cn1 1569644074 GEIKWKPYKWQJAM-IBGZPJMESA-N 434.378 4.169 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cc(Br)cc4cccnc34)c2)CC1 1585586397 FMWPZCVTXUSRSQ-UHFFFAOYSA-N 439.357 4.392 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3c(C)nc4c(c(O)nn4C)c3C)c2C)c1 1586348420 GSIUAJGQHRGFTD-UHFFFAOYSA-N 431.540 4.245 10 10 IICE Cc1c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cnn1CCO[C@H]1CCCCO1 1587027487 SVDSOOHRBLMPHF-DEOSSOPVSA-N 436.556 4.072 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1 1595885610 XTFCVFYPJUEKPK-UHFFFAOYSA-N 430.957 4.341 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1615422642 HEBOMTGWIIYGSB-NRFANRHFSA-N 438.664 4.174 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCCNc1ccccc1 1616249443 KFEHKIXNGTWILC-XDJHFCHBSA-N 443.569 4.035 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC2CC(OC(C)(C)C)C2)NC(=O)OC(C)(C)C)cc1 1618253246 LMPWVRDHCAGXKU-JITJBCMDSA-N 447.620 4.418 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1625657523 RPKGIRFGPCTBGO-IAGOWNOFSA-N 435.528 4.228 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(-n3ccnc3)ccc2O)cc1 1627421516 RSWZYIAMGUFVMI-UHFFFAOYSA-N 442.519 4.500 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)cc3Cl)CC2)cc1F 1631377039 GJWQPORTCLQRJZ-UHFFFAOYSA-N 427.701 4.213 10 10 IICE Cc1cccc(NC(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1635125299 COTXVRJWVZHPKP-QGZVFWFLSA-N 428.964 4.323 10 10 IICE CC(C)N(CC(=O)NCCOc1ccc(C(F)(F)F)cc1)Cc1ccc(N(C)C)cc1 1641554842 VHHBSWHXJSRGFY-UHFFFAOYSA-N 437.506 4.177 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(Cl)cc(Br)c3O)C2)cc1 1641656768 MUUGEQBHAVXQQZ-LBPRGKRZSA-N 439.737 4.073 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2[C@H](O)CC)sc(C)c1-c1ccccc1 1644679199 QNQGKCHZBJJVNU-RBUKOAKNSA-N 444.597 4.464 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccccc1Cl 1645412283 BNTSVRQBJJQBKZ-IRXDYDNUSA-N 433.955 4.235 10 10 IICE COc1ccc(N(CCOCCN2C(=O)c3ccccc3C2=O)Cc2cccs2)cc1 1657566717 FTNUIEFRSRBSJP-UHFFFAOYSA-N 436.533 4.076 10 10 IICE CCCCN(Cc1ccc(N2CCCCC2)c(C)c1)c1c(O)nc(=O)n(CC(C)C)c1N 1657745671 JGSBYHRKOSGWJF-UHFFFAOYSA-N 441.620 4.293 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(Cc2nc([C@H]3C[C@H]3C)no2)CC1 1673743153 AYSLYNQJCJOKJU-FGSXEWAUSA-N 439.604 4.163 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3cc(Br)ccc3F)C2)cc1 1674327006 OAJHPDCVYGGUTI-INIZCTEOSA-N 436.325 4.017 10 10 IICE CC(C)(C)OC(=O)C1(CNC(=O)N(Cc2ccccc2O)C2CCCCC2)CCOCC1 1682225859 VUVJFVBJLNYIHM-UHFFFAOYSA-N 446.588 4.375 10 10 IICE CN(C)CC[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cccnc1 1685324877 NIHHXAJVFRQDGW-XMMPIXPASA-N 435.572 4.145 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCc2ccc3c(c2)OCCCO3)cc1 1685336220 HTVRCCOHYWZYCM-UHFFFAOYSA-N 449.551 4.461 10 10 IICE CCN(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1686826807 PWEIUYCZBDSHPH-WIYYLYMNSA-N 432.609 4.033 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(OC4CCC(C)CC4)CC3)C2)cc1 1686855231 ZAUVETGDNUTWEC-KQVJYAISSA-N 429.605 4.291 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(c2ccccc2)C[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1 1687696112 HQVGAFAUWGNBQL-KJDSRRNHSA-N 437.540 4.043 10 10 IICE CCOCc1nnc(N2CCc3sccc3C2)n1Cc1ccc(N(CC)CC)cc1 1696299548 GYZBZKWRUZUMDJ-UHFFFAOYSA-N 425.602 4.333 10 10 IICE CCN(CCC1CC1)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1710139472 WNWRHDLEFCXFIN-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2c(C)nn(C)c2C)n1CCCSc1nccs1 1726874195 CEFNSLRWXGQHQR-CQSZACIVSA-N 433.651 4.417 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccco2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726880982 NIPOIEGILMYAPX-LJQANCHMSA-N 437.588 4.278 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCO[C@H]1C 1728026849 JOGGHDNVCQRQRD-NBGIEHNGSA-N 437.588 4.129 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1C[C@H](C1CCCCC1)N(C)C 1729420217 JXNMBQKXRNNJNM-FCHUYYIVSA-N 441.620 4.025 10 10 IICE CCC[C@H](Cn1c([C@@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1763859480 XFSTXCGYHBRMSC-SIKLNZKXSA-N 429.609 4.332 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CCOC)CC1 1765326560 YEBVPAOZKNHCIE-POHAHGRESA-N 448.615 4.087 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CCC(F)(F)C2)cc1F 1766909399 CVQBKXMJXICORA-UHFFFAOYSA-N 436.869 4.092 10 10 IICE Cc1c(Cl)ccc2c(O)cc(C(=O)N[C@H](c3ccc(N(C)C)cc3)c3nccn3C)nc12 1866508185 ADSUXXQHDZFWIT-JOCHJYFZSA-N 449.942 4.221 10 10 IICE CCCCCCn1cc(OCC)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870366403 SIODCLGZCIQIJW-UHFFFAOYSA-N 427.589 4.158 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C(C)C)c(CN)c1I 2079971860 MTGRNMZUMZEWHJ-HNNXBMFYSA-N 427.330 4.392 10 10 IICE COC(=O)c1c(C2CC2)nn([C@H](c2ccc(OC)cc2O)C2CCC2)c1Br 2080005149 CPPNNBQSGGKRGR-SFHVURJKSA-N 435.318 4.413 10 10 IICE Cc1ccc(CNC(=O)[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2381135466 QTAOMXRGYQLOIL-KGLIPLIRSA-N 441.366 4.019 10 10 IICE CCc1ccc(N2C(=O)NC(=O)/C(=C\c3cc(C)n(-c4ccc(OC)cc4)c3C)C2=O)cc1 1163338 SRIADOJFJFHCPC-HZHRSRAPSA-N 443.503 4.332 10 10 IICE COc1cc2c(cc1NCC(=O)N1CCN(C(=O)c3cccs3)CC1)oc1ccccc12 14709059 SRUWKMAKIQKZFM-UHFFFAOYSA-N 449.532 4.053 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3cccc(C)c3)C2=O)cc1OC 15045681 LOPYDHBOTABOJA-YQNUULROSA-N 442.562 4.241 10 10 IICE CCOC(=O)Cc1sc(NS(=O)(=O)c2ccc(C)c(C)c2)nc1-c1ccccc1 71556432 COLUFKKVGBOJQO-UHFFFAOYSA-N 430.551 4.333 10 10 IICE COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 72117191 USIKTNMBTARXIX-QHCPKHFHSA-N 433.483 4.229 10 10 IICE O=C1N=C(O)/C(=C/c2cccn2CCOc2ccccc2Cl)C(=O)N1Cc1ccco1 102512378 HJQSWDZQPUOCLG-LGMDPLHJSA-N 439.855 4.316 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1c[nH]c3ccccc13)N2 250520845 BMMHOFXNJOFTPA-ZASNGOMBSA-N 449.576 4.452 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3C)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526495598 KADLOZDIWYWUPP-QHCPKHFHSA-N 433.460 4.481 10 10 IICE COc1cc(/C=C2\SC(=S)N([C@H]3CCc4ccccc4C3)C2=O)cc2c1OCCO2 743284981 RLKHCBZGNQRYCI-BRLDDBHUSA-N 439.558 4.225 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1 756753584 HVVPJZUKVGJTSZ-CQSZACIVSA-N 444.333 4.028 10 10 IICE O=C1[C@@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CCN1Cc1ccc(F)cc1 790674258 WVCMIYKPDDZUMX-QFIPXVFZSA-N 439.531 4.177 10 10 IICE Cc1cc(=O)oc2cc(OCc3ccc(C(=O)NCCc4ccc(O)c(O)c4)cc3)ccc12 917355901 MUOWXGAIEJWBAG-UHFFFAOYSA-N 445.471 4.064 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NCCSCc3ccccc3)cc2F)C[C@@H](C)O1 918187042 QHKNAXRWCRDYAL-QZTJIDSGSA-N 431.577 4.172 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCc3cc(-c4ccccc4)no3)cc2F)C[C@@H](C)O1 918214618 GRHYXFBQDKGUPL-CALCHBBNSA-N 438.503 4.094 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/C(=O)NC(=S)N(c3ccccc3)C2=O)o1 1084615351 RFOJQYVZPWVSQA-UYRXBGFRSA-N 447.472 4.249 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnc(-c4ccc(F)c(F)c4)s3)C2)cc1 1130185528 KQQKGQUWTZFKBC-CQSZACIVSA-N 429.492 4.353 10 10 IICE COc1ccccc1NC(=O)C1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)CC1 1191712178 RUKMZXVQOBMPMD-UHFFFAOYSA-N 437.584 4.161 10 10 IICE CCc1c(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccc(Cl)cc1 1276832498 WKAFBXQHONNMSU-KRWDZBQOSA-N 438.959 4.353 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)C[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1292016517 GFOQGVJSQROTHA-QZTJIDSGSA-N 440.636 4.102 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860483 UGKCCWDHTDOXAO-OAHLLOKOSA-N 435.933 4.070 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1295420892 ZAQYVHCLKLRATL-SANMLTNESA-N 448.615 4.164 10 10 IICE CC(C)Cc1nnc(N2CCN(C(C)C)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1302949371 YUZXBFNVPZKVSU-UHFFFAOYSA-N 438.664 4.292 10 10 IICE Cc1csc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)n1 1304632884 YSHNSNSFLIEVKT-UHFFFAOYSA-N 426.933 4.149 10 10 IICE CC(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1446563462 GAUCFGVEUSDRQT-WOJBJXKFSA-N 434.577 4.229 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 1446795906 BWHYWGYIKYRRRL-YUXAGFNASA-N 434.536 4.047 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1c1ccc(Cl)c(F)c1 1450723079 UZEBLIBLPKVEPU-SJKOYZFVSA-N 445.705 4.327 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3nccs3)C2)c(C)n1-c1ccc(Br)cn1 1455223612 RZIWUQFIDLYQSW-CQSZACIVSA-N 431.359 4.338 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3)cc2)cc1 1464304138 XYWYZKVJAPXSIB-UHFFFAOYSA-N 437.565 4.264 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H]3C[C@H](c4ccc(Cl)c(Cl)c4)C3)cc2)CC1 1478523102 UFESLDIXUTWHQD-WGSAOQKQSA-N 447.410 4.491 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1 1478957431 ORUXKRFUUYPSDT-QFIPXVFZSA-N 432.568 4.489 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC2(C(=O)OC(C)(C)C)CCCC2)CCCC1 1522872455 RAERNGFJBYVDIP-UHFFFAOYSA-N 426.557 4.299 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1cccnc1C 1524952301 IDAZFOOVGFTBMS-QGOAFFKASA-N 429.542 4.174 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3nc4cc(Cl)ccc4s3)CC2)c(OC)c1 1534586689 HGBTZWFPMVLBJU-UHFFFAOYSA-N 445.972 4.248 10 10 IICE Cc1ncc(/C=C/C(=O)N2C[C@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)s1 1538218513 NOJNIQHZFIGRLT-VFADXPBXSA-N 431.533 4.334 10 10 IICE Cc1cc([C@](C)(O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(C)o1 1544667692 VWTMCWZUWYOTNE-OAQYLSRUSA-N 446.345 4.099 10 10 IICE CO[C@@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 1554652072 UQKQLJRAQJRVNN-QFIPXVFZSA-N 441.620 4.080 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](C[C@@H]3COCCO3)C(F)(F)F)cc2Cl)C1 1556369223 JAEIKASHOFFLFV-OIISXLGYSA-N 448.913 4.177 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1csc(NC(=O)OC(C)(C)C)n1 1564945804 FZKCPOCHLSJCMX-HNNXBMFYSA-N 447.605 4.295 10 10 IICE CCN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCC(C)CC3)cc2)[C@@H]1c1cccc(C)c1 1585545418 RLJFOMGCILSRLG-AHWVRZQESA-N 433.596 4.457 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C2)cc1 1585664805 GNALMSYXRBIWGN-HNNXBMFYSA-N 445.350 4.444 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3OCCO[C@@H]3c3ccccc3)cc2Cl)C1 1586082368 OXKDYUCIUSTWJA-NLSFWIRASA-N 428.960 4.349 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1Cc1ccc(N(C)C)cc1C 1613174010 RCTOHVJDAKXIPU-OAHLLOKOSA-N 430.000 4.238 10 10 IICE O=C(CN(CCc1ccccc1)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 1615958012 RIKLSGKNIBUWCP-UHFFFAOYSA-N 447.554 4.028 10 10 IICE COC(=O)c1sc2[nH]c(CN(CCC(C)C)c3ccc(OC)cc3)nc(=O)c2c1C 1617713613 UPTBCDIKYRPLQY-UHFFFAOYSA-N 429.542 4.141 10 10 IICE CCOc1ccccc1[C@H](CC(=O)NCc1cccc(OC)c1O)NC(=O)OC(C)(C)C 1622779078 IWLSCXRCOYDHSZ-SFHVURJKSA-N 444.528 4.072 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1 1623307639 YUFCNPBXLOENPC-FQEVSTJZSA-N 438.553 4.146 10 10 IICE CCO[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)c1ccc(OC)cc1)C1CCOCC1 1627426037 SVROPJBYYHPLIH-DEOSSOPVSA-N 426.557 4.126 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C(=O)OCc2ccccc2)CC1 1631021945 RQMPJCHIVJUNOR-UHFFFAOYSA-N 445.519 4.001 10 10 IICE Cc1ccc([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1634104669 FSJMBFKHNPGIAO-LJQANCHMSA-N 428.330 4.023 10 10 IICE CC(C)(C)OC(=O)NCCN(CCc1ccccc1)C(=O)c1ccc(N=NC(N)=O)cc1 1635296779 BKUISGYMQTYCDF-UHFFFAOYSA-N 439.516 4.059 10 10 IICE CCN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1636063278 FASNXBBSZJYBNB-VWLOTQADSA-N 445.563 4.116 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@](C)(COCc3ccccc3)OC)c2C)cc1 1640171002 FFCJTLMDIQQBQY-AREMUKBSSA-N 436.552 4.454 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@]3(C)c3ccccc3)cc2F)C[C@@H](C)O1 1654648212 YCGFDNLXASHZIY-UNVFRBQDSA-N 439.575 4.067 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1 1654921504 RGSZBEFBLBFBLX-UITAMQMPSA-N 449.429 4.122 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)c3c(F)cccc3F)cc2Cl)C1 1680561291 BGURJWSLVAUAJM-JLTOFOAXSA-N 437.918 4.387 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2cc(NC(=O)OC(C)(C)C)ccn2)C2CC2)cc1 1685349929 PFDDXNOBCRBBNR-UHFFFAOYSA-N 439.560 4.369 10 10 IICE CCO[C@H]1CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1696221115 VTEQZBLHIYCXEE-IBGZPJMESA-N 443.592 4.189 10 10 IICE CCOCc1nnc(N2CCC([C@@H]3CC3(F)F)CC2)n1Cc1ccc(N(C)C)cc1C 1729015561 WIQFGBYAIRZSIC-FQEVSTJZSA-N 433.547 4.109 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC(NC(C)C)CC2)cc1 1746090342 VKEYNPRJBHEOFT-UHFFFAOYSA-N 447.631 4.201 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](CC(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1750728136 VGDZBXDEOTWAJZ-OAQYLSRUSA-N 443.611 4.373 10 10 IICE CN(C)c1ccc(Cn2c(N3CCCN(C(C)(C)C)CC3)nnc2C(C)(C)C)cc1F 1766914759 WKRKMJJZEBSHEA-UHFFFAOYSA-N 430.616 4.140 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1 1767539982 XLMLPJNJTLQHII-GOSISDBHSA-N 448.615 4.361 10 10 IICE COc1ccc(N2CCN(C(=O)C=Cc3ccc(OCc4ccccn4)cc3)CC2)cc1 2042451607 GPNZRALZLHRULZ-UHFFFAOYSA-N 429.520 4.031 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(O)c1)C(=O)N(Cc1ccccc1)C(C)(C)C 2080887758 OODIJNJVOKBEAE-IBGZPJMESA-N 442.556 4.361 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](NCc2cc(Cl)cc(Br)c2O)C1 2219130358 QULYZCLDFMSRKE-STQMWFEESA-N 437.737 4.245 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccc2oc(=O)ccc2c1 2296571238 KGJOOUWJDGVCQD-UHFFFAOYSA-N 442.543 4.085 10 10 IICE CSCC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc3cccc(Cl)c3n2)SC1=S 2296604946 LDNSTQMFGXNENZ-ZDUSSCGKSA-N 438.983 4.296 10 10 IICE COc1ccc(CN2C(=O)C(=Cc3ccc(OCC(=O)O)c(Cl)c3)SC2=S)cc1 2297534699 MLIOTTCODCWAGJ-UHFFFAOYSA-N 449.937 4.213 10 10 IICE O=C1C[C@@H](N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)C(=O)N1c1ccc(F)cc1 2204273 FZDZVXDSEUWJEK-INQNZLQJSA-N 446.912 4.012 10 10 IICE CCOc1cc(/C=C2\C(=N)N3N=C(SCc4ccccc4)SC3=NC2=O)ccc1O 4648372 KWBHEQRVPLZDLG-BXODQFHZSA-N 438.534 4.301 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3CC)C2)sc2c1CCCC2 20371992 FACKFCBGBZTQFQ-INIZCTEOSA-N 440.565 4.358 10 10 IICE COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)/C2=C\NC2Cc3ccccc3C2)cc1 21345089 KISFHWMNGPTKBY-JLPGSUDCSA-N 427.479 4.226 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)cc(Br)c1O 38166253 WVRNVJRZQNNLLN-ZSOIEALJSA-N 445.269 4.369 10 10 IICE COc1ccc(N2CCN(c3ccc(-c4nc(-c5cccc(F)c5)no4)cn3)CC2)cc1 65097919 AVKXFVSHSBTXFS-UHFFFAOYSA-N 431.471 4.273 10 10 IICE Cc1nc(-c2ccc(NCc3ccc(N4CCN(CC5CC5)CC4)cc3)nc2)nc(O)c1C 301944470 ZAZDXLXFZQBIHG-UHFFFAOYSA-N 444.583 4.005 10 10 IICE Cc1cc(C(=O)Nc2cnn(-c3ncccn3)c2)c(C)n1-c1cccc(Br)c1 303794586 VNMZSYNFQHCJRO-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(OC)cc3OC)[C@@H]2c2ccc(O)c(O)c2)cc1 526217005 RZGMGWQTXXUETL-QHCPKHFHSA-N 449.459 4.181 10 10 IICE COc1ccc(-c2nc3c(s2)[C@@H](NC(=O)NCc2cc(OC)ccc2O)CCC3)cc1 734070634 XOIVVHYDWLXVEN-IBGZPJMESA-N 439.537 4.410 10 10 IICE CCC1(NC(=O)CN2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)CCC1 752373917 LWVDPNRSQYHPLL-UVTDQMKNSA-N 439.400 4.099 10 10 IICE Cc1cc(C)cc([C@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)c1 753113523 QGXXMTALHCMMSE-FQEVSTJZSA-N 425.548 4.103 10 10 IICE CCN1CC[C@H](NCc2ccc(N3CCOCC3)c(F)c2)[C@@H]1c1cc(F)c(F)c(F)c1 782391249 JYBHWYWWQCAPDL-REWPJTCUSA-N 437.481 4.005 10 10 IICE Cc1nc2ccc(S(=O)(=O)Nc3nc(-c4ccc5c(c4)OCCO5)cs3)cc2s1 794002744 PQFZNUVGFKGXDL-UHFFFAOYSA-N 445.547 4.300 10 10 IICE Cc1cc(CCNC(=O)N2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)c(C)n1-c1ccccc1 801969680 OYLFGTOLBCHJKR-ZEQRLZLVSA-N 431.584 4.490 10 10 IICE Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)NCc1cc(Br)ccc1O 806465476 UCLVUUUEOMAUKW-UHFFFAOYSA-N 437.244 4.155 10 10 IICE COc1ccccc1[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccccn1 807036266 YCXOGTMZJOCXOH-FQEVSTJZSA-N 442.313 4.147 10 10 IICE COc1cc(Br)ccc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1125089618 FZEMRGRXUIGDKR-UHFFFAOYSA-N 436.261 4.485 10 10 IICE CCCCNC(=O)C1(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCCCC1 1125614800 POJBOJPRDWMSPD-UHFFFAOYSA-N 439.600 4.264 10 10 IICE Cc1ccc(C(=O)NC2CCN(Cc3ccccn3)CC2)cc1-n1c(C)cc(C=O)c1C 1136288515 XPNYVJMDUYVXLL-UHFFFAOYSA-N 430.552 4.004 10 10 IICE O=C(CCCOCCc1ccccc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137437804 DFANFIVZYJCQBE-JOCHJYFZSA-N 430.976 4.166 10 10 IICE O=C(N/C(=C/c1cccnc1)C(=O)N1CCc2c(Br)cccc21)c1ccccc1 1162451701 UCCGYPPGXCRSCR-XSFVSMFZSA-N 448.320 4.204 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1165498075 LBLYIZYFWXOUKX-QRWLVFNGSA-N 439.314 4.453 10 10 IICE COc1cccc2c1CN(C(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)C2 1171643357 HSAAJTWCWJOHDK-UHFFFAOYSA-N 426.314 4.416 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@]3(C2)CN(Cc2ccccc2)C[C@H](C)O3)c1O 1197272713 DGMZCLKPJORRTA-XDHUDOTRSA-N 428.960 4.114 10 10 IICE Cc1ccc(CCC2CCN(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)CC2)cc1 1246300553 AFPMNXBRQSZORH-UHFFFAOYSA-N 434.628 4.301 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CC2(NC(=O)OC(C)(C)C)CC2)cc1 1264452348 KSNOJJRBUZWYSC-UHFFFAOYSA-N 427.545 4.322 10 10 IICE Cc1cccn2c(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)cnc12 1279232943 WHWOKORZJORDHF-WJDWOHSUSA-N 440.525 4.012 10 10 IICE COC(=O)Cc1c(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)[nH]c2ccccc12 1300091978 JLSQXXYDLBTGCH-UHFFFAOYSA-N 447.457 4.154 10 10 IICE CS[C@H](C)Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1302551976 BJMPUWOONZEJBY-QUCCMNQESA-N 429.634 4.160 10 10 IICE CN(CCc1ccccc1F)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1352769157 VCISXQZGMRBVOZ-RGEXLXHISA-N 446.544 4.257 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccn(-c3cc(F)cc(F)c3)n2)cc1 1435074156 HODKIQUEQNAOBD-UHFFFAOYSA-N 438.400 4.421 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Br)cc3nc(O)[nH]c23)cc1 1440675812 VEDVZSPXRDQWSG-UHFFFAOYSA-N 431.334 4.149 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cc(Cl)c(F)c([N+](=O)[O-])c1 1442187950 HTHBMCZWOPDXLP-UHFFFAOYSA-N 432.883 4.172 10 10 IICE CC(C)(C)OC(=O)COc1ccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 1450720343 HMUNKDUMEIPPBV-UHFFFAOYSA-N 426.296 4.350 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCCc4c3ccc(=O)n4C)cc2Cl)C1 1469959561 KSNTXDDKBWDHJI-OXQOHEQNSA-N 442.991 4.152 10 10 IICE Cc1cc(-c2nnc(N3CCN(C)C(=O)[C@@H]3C)n2CCC(C)C)c(C)n1-c1ccccc1 1510618322 JOACZZNTOJGXRK-FQEVSTJZSA-N 434.588 4.066 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)[C@H]1c1ccc(Cl)c(F)c1 1528620034 QFBQFSVVNWBXQD-KSFYIVLOSA-N 449.929 4.299 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(=O)n(-c4ccc(F)cc4)n3)c2C)c1 1534758513 ISSMVKKZUFSPLU-UHFFFAOYSA-N 430.483 4.018 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C2=Cc3ccccc3O[C@@H]2C(F)F)cc1 1544529212 AXYIVGQTCCHFKX-REWPJTCUSA-N 442.506 4.370 10 10 IICE CCOc1ccc2c(c1)CN(c1nnc(CC)n1CCCSc1nccs1)CC2 1547979902 BJWXEKXWELZQBB-UHFFFAOYSA-N 429.615 4.441 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)OCc1ccccc1C 1556426622 UUWBQBYMXOCSNG-LJQANCHMSA-N 426.557 4.289 10 10 IICE Cc1cc(C(=O)Nc2ccc(C3(O)COC3)cc2)c(C)n1-c1ccccc1Br 1556900586 MSLAYXCFJJIDCF-UHFFFAOYSA-N 441.325 4.327 10 10 IICE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc2cccnc2c1O 1557121809 OHLXSKOEJHEFQH-IBGZPJMESA-N 425.916 4.055 10 10 IICE COc1ccc(CCNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1O 1564649707 KPDPJLZMBIHXIJ-MRXNPFEDSA-N 431.964 4.332 10 10 IICE CSC[C@H]1CCCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1569556317 SNTKHNINDXFRAA-ZCQLHAAUSA-N 438.615 4.019 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CC[C@H](CNC(=O)OC(C)(C)C)C3)ccc21 1570390796 YEVPTMWCIXWKJH-ICSRJNTNSA-N 443.588 4.328 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(CCN(C)Cc2ccccc2)CC1 1585356115 VALUGKHVHNJHCD-UHFFFAOYSA-N 436.625 4.045 10 10 IICE Cc1nccn1CCCn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1612446528 AKTBDTSVMISVKP-UHFFFAOYSA-N 435.620 4.407 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](COC)OC 1614160769 QFZMROXCEWXYKI-UNMCSNQZSA-N 437.588 4.393 10 10 IICE Cc1cc(CC(=O)NCc2cccc(CN3C(=O)CSC3=O)c2)c(C)n1-c1ccccc1 1623339413 IUEDPZQOWIFKHC-UHFFFAOYSA-N 447.560 4.148 10 10 IICE Cc1ccc(CN2C[C@@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1624069137 DCDQCCHIEXTWNW-DEOSSOPVSA-N 429.564 4.376 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cncc2nc(C(F)(F)F)n(C)c12 1624553697 BNNUYPWSRWAVAK-UHFFFAOYSA-N 431.462 4.250 10 10 IICE CN(c1ccc(CNC(=O)C2(n3cc(Br)cn3)CC2)cc1)C1CCCCC1 1625905128 IMMXZXSLPWFXPJ-UHFFFAOYSA-N 431.378 4.220 10 10 IICE CCCN(CC)c1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 1629055848 SZMVJLBPJVLMCI-GOSISDBHSA-N 432.515 4.318 10 10 IICE CC(C)(C)CC(C)(C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1629405172 YLJGSYMMBCKYOB-UHFFFAOYSA-N 449.529 4.046 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1631840282 MAVRBCGRHGDGMB-DEOSSOPVSA-N 443.547 4.136 10 10 IICE CCC(C)(C)c1ccc(CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1633445576 ISPKPHHCESAPHT-UHFFFAOYSA-N 431.527 4.488 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCCN(C(=O)OC(C)(C)C)[C@@H]3C)ccc21 1639435753 UISLZEMVAZPVIR-WIYYLYMNSA-N 443.588 4.422 10 10 IICE CCOc1ccc(N2CCN([C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)CC2)cc1 1642355275 YUYONBGRTMOAMT-NRFANRHFSA-N 434.367 4.320 10 10 IICE Cc1cc(C(=O)N[C@H](c2cnn(C)c2)C(C)C)c(C)n1-c1ccc(Br)cn1 1646122338 KNOXKYVJBZVQTH-IBGZPJMESA-N 430.350 4.112 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)CNC(=O)N4CCCC4)n3)c2C)cc1 1648404961 WCMJZYQRGKTQQP-UHFFFAOYSA-N 437.569 4.270 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)c1O 1654233374 NGTAVNULIWYUHY-HXUWFJFHSA-N 438.749 4.020 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccco1 1690967956 UBIFXACVCAXECF-UHFFFAOYSA-N 446.555 4.108 10 10 IICE C[C@@H]1C[C@@H](Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CCO1 1707990887 LZUBQNSEVXDDOX-BAYUQKDNSA-N 442.604 4.354 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)OC)C1 1712051568 LZLKGNJHURBPOW-OAQYLSRUSA-N 437.588 4.393 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC[C@H](SC)C2)n1Cc1ccc(N2CCOCC2)cc1 1726983077 WXXXBWSCWXJKFM-KNQAVFIVSA-N 443.661 4.398 10 10 IICE COc1cc(OC)cc(-c2nnc(N(C)C3CC3)n2CCCSc2nccs2)c1 1730008385 PDNLSLSOQMUUBT-UHFFFAOYSA-N 431.587 4.200 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C(C)C)C3)n2CCCSc2nccs2)n1 1742697813 SWYVBNZYKVXLJT-GOSISDBHSA-N 445.662 4.261 10 10 IICE CCc1nnc(N(C)[C@@H](C)c2cccs2)n1Cc1ccc(N2CCOCC2)c(F)c1 1744525973 JATNNHGRDJGAAD-INIZCTEOSA-N 429.565 4.123 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1748462715 IZMMGEMAFQUQIH-QHCPKHFHSA-N 429.634 4.008 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)[C@H]1C 1752460405 GDGBNNJPWHBCTC-JYJNAYRXSA-N 439.676 4.141 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CCC1CC1 1764679031 QNVFLYXFRAWXHT-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(CC)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1766469649 LPIAVVWPQUEVLS-JOCHJYFZSA-N 425.621 4.378 10 10 IICE COc1ccc(N2CCN(Cc3cc(=O)c(OCC(C)C)cn3CCC(C)C)CC2)cc1 1870438219 PADNTPWSENYBIE-UHFFFAOYSA-N 441.616 4.260 10 10 IICE CCCN[C@@H](CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1)c1ccccc1O 1947471574 WCPRQHPSHCWXQN-QFIPXVFZSA-N 427.589 4.460 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2060639977 OBWAYDSYHKRMCR-UXHICEINSA-N 445.564 4.426 10 10 IICE CC(C)(C)OC(=O)N1CCOC2(CCC(Nc3c(N)cccc3Br)CC2)C1 2162504838 XRLWKAJOIDEOOG-UHFFFAOYSA-N 440.382 4.392 10 10 IICE Nc1ccc(NC(=O)Nc2ccc(Br)cc2I)cc1 2231448148 NMFCCZAQXODTGN-UHFFFAOYSA-N 432.059 4.280 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3cccc(F)c3)C2=O)c(C)n1-c1ccc(F)cc1 2294199261 JOLUIUQAYBWXLW-UHFFFAOYSA-N 437.471 4.204 10 10 IICE COc1cccc(OCCCOc2ccc(C=C3SC(=S)N(C)C3=O)cc2OC)c1 2297499247 JYMIVKIBDKEKQX-UHFFFAOYSA-N 445.562 4.383 10 10 IICE Cc1ccc(CNC(=O)CC2CC(CNC(=O)OC(C)(C)C)C2)c(O)c1Br 2380723094 SUFDWYKKJVEWGO-UHFFFAOYSA-N 441.366 4.020 10 10 IICE O=S(=O)(c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@@H]32)cc1)N1CCOCC1 9968861 PZYXUOKZHZFZJV-IPJJNNNSSA-N 430.957 4.187 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCCC(=O)O 16919556 RZNIYAMNWVOPSC-WOJGMQOQSA-N 447.509 4.484 10 10 IICE CCCCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CC)c2N2CCCC2)SC1=S 39989639 PXWHWTBBCVZGLN-AQTBWJFISA-N 444.626 4.040 10 10 IICE Cc1nn(-c2ccccc2)c(Cl)c1/C=C1\C(=N)N2N=C(C(F)(F)F)SC2=NC1=O 102469979 DCQPZRRSQJDOHK-MYEDEKDNSA-N 438.822 4.016 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S)c1ccncc1 206293743 LVVXSUDJCQGHQR-XSFVSMFZSA-N 447.541 4.207 10 10 IICE CCOc1cc(/C=C2\SC(Nc3cccc(C)c3)=NC2=O)ccc1OCCC(=O)O 210468766 OENGXIMOLLFDGD-UYRXBGFRSA-N 426.494 4.330 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc(Br)ccc1O)N2 226725078 AICSEQBLSFOIPN-XFQAVAEZSA-N 443.341 4.357 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)c1 751061576 XEMJNDWHTLZKPR-CYBMUJFWSA-N 430.302 4.148 10 10 IICE COCCN(Cc1ccc(Br)s1)C(=O)NCc1ccc(N(C)C)c(F)c1 755642786 ILRPZKJXGKKRMM-UHFFFAOYSA-N 444.370 4.074 10 10 IICE C[C@@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)ccc1O 757638921 SVMBZVQLSPXKEH-WBMJQRKESA-N 431.309 4.218 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(NC(=O)c4cccs4)c(C)c3)CC2)cc1 758055522 QMZQTJZPPUIFFN-UHFFFAOYSA-N 435.549 4.280 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@H](c2ccsc2)C1 758815541 REJSYBYXTPVRJU-APWZRJJASA-N 437.512 4.101 10 10 IICE Cc1ccc(C)c(CN(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 760547673 LTVJAYNSTHDPLJ-UHFFFAOYSA-N 430.551 4.144 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1Oc1cccnc1 768911410 OMXGFTZBNFNYTP-UHFFFAOYSA-N 442.563 4.336 10 10 IICE O=C(/C=C/c1cccc(OC2CCCC2)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129659901 ACAREQVCAPGOCD-CMDGGOBGSA-N 442.506 4.452 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC(C)(C)c2ccc3c(c2)OCO3)cc1 1142479853 VVOFTFNUIHFRFF-UHFFFAOYSA-N 432.520 4.272 10 10 IICE CC(=O)NCCN(Cc1ccc(C)s1)C(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1155222690 NTFXFKUIRCXTFX-UHFFFAOYSA-N 437.565 4.055 10 10 IICE C[C@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1162713135 RVWYCRQQPRGYGD-HNNXBMFYSA-N 429.521 4.101 10 10 IICE Cc1cc(C(=O)Cn2cc([N+](=O)[O-])cc(Cl)c2=O)c(C)n1-c1ccc2c(c1)CCC2 1165702322 LOZRIOWIKIBYKU-UHFFFAOYSA-N 425.872 4.189 10 10 IICE COc1ccc(-n2nnnc2SCC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)cc1 1188500786 LMJIUHNXNZNIRD-UHFFFAOYSA-N 437.500 4.193 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CSc3nc(C)nc4sc(C)c(C)c34)C2)cc1 1278861998 UIUSJGAXXCQZNH-INIZCTEOSA-N 442.610 4.112 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC3(C(=O)OC(C)(C)C)CCOCC3)c2C)c1 1301396266 WRGLWUYEIWKLJU-UHFFFAOYSA-N 426.557 4.332 10 10 IICE C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)N(Cc1ccco1)Cc1ccccc1O 1313137152 KOAAKBOUQNYOAA-OFNKIYASSA-N 433.552 4.465 10 10 IICE COC(=O)c1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(N(C)C)c1 1435874370 YPTPBEUDGUUFRZ-UHFFFAOYSA-N 435.524 4.020 10 10 IICE CCOC(=O)COc1cccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1441301688 XYYJKIWNDFNEME-UHFFFAOYSA-N 434.492 4.030 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C/Sc1cc(F)ccc1F 1446818598 WWXFOMRTOXYMAS-VOTSOKGWSA-N 427.856 4.131 10 10 IICE COc1ccc(N(Cc2ccccc2)Cc2nc(N)nc(Nc3ccccc3OC)n2)cc1 1459747932 QFLJVLUCCYGTTK-UHFFFAOYSA-N 442.523 4.421 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)Nc2nc(-c3ccc(C)c(C)c3)cs2)cc1 1459936765 QXCYEUYGYJHWCG-UHFFFAOYSA-N 439.537 4.054 10 10 IICE COc1ccc(N2CCN(C(=O)CCCCOc3cc(C)ccc3C)CC2)c(OC)c1 1461985841 ZOIUFLKUYWHQTM-UHFFFAOYSA-N 426.557 4.219 10 10 IICE COc1cc(CC2CN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)cc(OC)c1 1465524933 IMLAFHDVVKTKOV-UHFFFAOYSA-N 432.520 4.239 10 10 IICE Cc1cc(C(=O)Nc2ccccc2C[S@@](C)=O)c(C)n1-c1ccc(Br)cn1 1466746769 IOWCGXXXDFBHDT-HHHXNRCGSA-N 446.370 4.382 10 10 IICE CCCNC(=O)OC[C@@H]1CCCCN1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1470969174 QSPHGHRHQXYQOG-QHCPKHFHSA-N 440.588 4.337 10 10 IICE C[C@@H]1CCN(c2nnc([C@@H]3CCO[C@H]3C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1494034538 WOZFEPXOFQUUPT-HGHGUNKESA-N 429.584 4.296 10 10 IICE COCCCN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1504813400 NQFKRTKDVUFRFB-UHFFFAOYSA-N 443.661 4.085 10 10 IICE Cc1occc1CN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1510476295 DUMOOUAKSQBTIN-UHFFFAOYSA-N 437.588 4.289 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)COC)CC1 1518812625 IMIFYTOUTACQKA-LJQANCHMSA-N 449.599 4.418 10 10 IICE COCCN(CC1CC1)c1nnc(CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1519160365 XFIVDJIGNCECHG-UHFFFAOYSA-N 425.621 4.160 10 10 IICE Cc1cc(CNC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)c(C)n1-c1ccccc1 1531612979 ZOPWKAWSCWDDJE-UHFFFAOYSA-N 434.540 4.444 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1535144296 XCKWQZUXFRIUFK-QGZVFWFLSA-N 439.581 4.101 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(OCC(F)(F)F)c4ccccc4n3)ccc21 1542389706 LSLPGMBETPGWNM-UHFFFAOYSA-N 429.442 4.488 10 10 IICE CCCCCCNC(=O)[C@@H]1CCCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)C1 1544474255 IXEUFKXZBWNVKA-JOCHJYFZSA-N 437.584 4.455 10 10 IICE CC[C@@]1(C)CCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1546062052 JWKGKPLTLKNRSN-DFBJGRDBSA-N 441.620 4.059 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(CC)C[C@@H]2CCCO2)cc1 1547443956 IBURMMLMFYFIGJ-QHCPKHFHSA-N 434.588 4.240 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)CCOC(C)(C)C)cc1 1547444219 MKPQWIFQLYUMEZ-UHFFFAOYSA-N 436.604 4.486 10 10 IICE CN(Cc1cscn1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1554195985 GABIYQPYNQCCNF-HNNXBMFYSA-N 436.632 4.252 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)c1cc(C)oc1C 1555760222 ITFAMNDVOCCUCR-VWLOTQADSA-N 449.555 4.468 10 10 IICE COC(=O)[C@@H](C)Cc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1556129940 VKVLPZOMGBWLLS-KRWDZBQOSA-N 432.520 4.439 10 10 IICE C[C@H]1C[C@@H](c2ccc(Br)cc2)CN1CC(=O)NCc1ccc(N(C)C)cc1 1560061676 PRGVVLGVGCQCAF-QFBILLFUSA-N 430.390 4.009 10 10 IICE O=C(N(Cc1ccccc1O)C[C@@H]1CCCO1)C(F)(F)c1cccc(Br)c1 1597090022 MWOLUIVVVBPWNA-KRWDZBQOSA-N 440.284 4.454 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc(C(F)(F)F)c2N)c1 1616648364 IDGRNSPDKQQRKD-UHFFFAOYSA-N 442.441 4.032 10 10 IICE CCOC[C@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1617044891 ZLFOKSBSRJXABC-FQEVSTJZSA-N 429.584 4.127 10 10 IICE COC(=O)CCN(C[C@H]1CCCO1)C(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1629327490 NOBLLRDGEKQDSE-JOCHJYFZSA-N 426.557 4.402 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2Cc3ccc(O)cc3N2C(=O)OC(C)(C)C)cc1 1630469822 MFONVMUPLRVFGL-JOCHJYFZSA-N 439.556 4.221 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2c(Br)c(C)ccc2[nH]1 1630486328 JENLUNSCOZKQEI-UHFFFAOYSA-N 445.313 4.150 10 10 IICE Cc1ccc(C(=O)N(C)CCN(C)C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1631862342 QDUQPFYQJBRKEC-UHFFFAOYSA-N 427.545 4.154 10 10 IICE Cc1ccc(SCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c(C)c1 1640689272 HTBNXSZJZYKQLF-UHFFFAOYSA-N 428.579 4.333 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1642997859 QATJFTXCXSNPIN-IRLDBZIGSA-N 436.600 4.361 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H](C)c3cccc(SC(F)(F)F)c3)nc12 1644566407 HWAGMQODZKTQOB-LLVKDONJSA-N 440.447 4.074 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1c(O)cccc1F)c1ccc(C(F)(F)F)cc1 1645050112 CSTSCEUTSQDXCY-QGZVFWFLSA-N 442.409 4.432 10 10 IICE COc1ccc(N(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)Cc2ccccc2)cc1OC 1648668225 NMAOUSXXYCZFTO-UHFFFAOYSA-N 447.491 4.208 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C2(COC)CCC2)sc(C)c1-c1ccccc1 1655528647 DIRWRIZUWMYRTH-UHFFFAOYSA-N 430.570 4.340 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1CNC(=O)NCc1cc(Cl)ccc1O 1672608272 IRKLTBGWOBTMNS-LJQANCHMSA-N 445.947 4.379 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(Cl)cc2c1OCC2 1685382926 DAPJQHKNZDJQCL-INIZCTEOSA-N 443.975 4.044 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccn3)n2CCCSc2nccs2)n1 1693180148 YQRRFHWKVIIZCI-UHFFFAOYSA-N 437.598 4.319 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H]2CSC)n1Cc1ccc(N2CCOCC2)cc1 1708505226 URVXMRFAANDJJE-NQIIRXRSSA-N 429.634 4.008 10 10 IICE CCC(=O)N[C@@H]1CCCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)C1 1726786012 YKRCXJJEFQMUGU-QGZVFWFLSA-N 448.662 4.070 10 10 IICE CC1(C)CN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)CCS1 1742005963 RCHPDPPBJMFLLI-HNNXBMFYSA-N 439.676 4.143 10 10 IICE CC(=O)N[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C1 1749928403 XBFOERAPJUIQCP-NRFANRHFSA-N 434.588 4.114 10 10 IICE CC1CCN(c2ccc(Cn3c(N4CCC(CO)CC4)nnc3C(C)(C)C)cc2)CC1 1752209592 ZSSTZGUAVJDDQT-UHFFFAOYSA-N 425.621 4.069 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](n3cc(C)cn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752755200 GVHDDBVWRZLNHL-UYAOXDASSA-N 439.583 4.391 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCC[C@@H]1C 1761198006 FMYAEDMKXRHGON-PZJWPPBQSA-N 438.620 4.089 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1771437149 UUKZCCHXKBQZIN-HZPDHXFCSA-N 439.676 4.490 10 10 IICE COc1ccc(C)cc1N1C(=O)/C(=C\c2cc(OC)c(OC)c(OC)c2)SC1=S 1860086803 INDLNJRGTZYKHS-WOJGMQOQSA-N 431.535 4.435 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ccc(F)cn2)sc(C)c1-c1ccc(C)c(C)c1 1860748724 JCAGMWAWOKDPJP-UHFFFAOYSA-N 441.484 4.238 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccccc1OC(F)(F)F 1891709413 BUNUZERWSDKBGX-RDJZCZTQSA-N 426.460 4.052 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@H](CNCc2cc(Cl)ccc2O)C1 2025248549 SWKSQZROUXTIJL-OAQYLSRUSA-N 445.991 4.257 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@H](NCc3cccc(Br)c3O)[C@H]2C1 2092943094 HDCSSKJHYMIZMC-ZOBUZTSGSA-N 425.367 4.280 10 10 IICE COc1ccc(C=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)cc1OC 2296405689 DHPLJAWCRSRBAU-UHFFFAOYSA-N 429.432 4.447 10 10 IICE COc1ccc(C2=NC(=Cc3ccc(OC)c(OC)c3)C(=O)N2c2ccc(O)cc2)cc1 2297332354 GDZYMDXQCBPUJV-UHFFFAOYSA-N 430.460 4.253 10 10 IICE CCCN1C(=O)/C(=C/c2ccc(OS(=O)(=O)c3ccccc3)c(OC)c2)SC1=S 2989153 RWZMUNBZKQWWOD-AQTBWJFISA-N 449.575 4.074 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 15039751 TWAGMEAPOFLDDQ-AQTBWJFISA-N 430.526 4.454 10 10 IICE O=[N+]([O-])c1cccc(S(=O)(=O)Nc2nc(-c3ccc(Br)cc3)cs2)c1 40858608 XLWBLOMSOVVHPL-UHFFFAOYSA-N 440.300 4.282 10 10 IICE CCCN(CCc1ccccn1)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 729612315 VPRVOOPPKWRQDO-UHFFFAOYSA-N 432.515 4.316 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 730138275 GKRKWCFIYAFLAL-FQEVSTJZSA-N 432.609 4.321 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)C2CC2)cc1 764511443 ICQZUTDXCZSOLE-GOTSBHOMSA-N 428.527 4.150 10 10 IICE Cc1nc(-c2ccc(S(=O)(=O)NCc3cc(Br)ccc3O)s2)cs1 796190266 FCXCBKHEBAOESX-UHFFFAOYSA-N 445.385 4.127 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NC1CC(F)(c2cccc(Cl)c2)C1 796636118 WMOSJUDYKUXXHI-UHFFFAOYSA-N 445.966 4.375 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(CCN(C(=O)NCc3ccc(N4CCCC4)cc3)C2)C1 801745678 QJXYCDGHZNBUOW-RUZDIDTESA-N 442.604 4.219 10 10 IICE CCOc1ccc(C(C)(C)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cc1OCC 1131030104 KUFDKSUJOLLIAH-IBGZPJMESA-N 426.557 4.165 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1141901245 DBCDBOMDWCVLGT-UHFFFAOYSA-N 449.526 4.121 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1csc(-c2ccco2)n1 1156287991 ULOULAFIDXPQAZ-UHFFFAOYSA-N 427.526 4.405 10 10 IICE COc1cnc([C@@H]2CCCN2C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)nc1O 1158517381 VRPWULCNAWDCCA-SFHVURJKSA-N 426.904 4.229 10 10 IICE O=C(Nc1ncc(Cc2ccc(OC(F)(F)F)cc2)s1)c1c(F)ccc(O)c1O 1182228869 FNKWTFXDNQMPBC-UHFFFAOYSA-N 428.363 4.435 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(C)[C@H](C)c3ccc(-c4ccccc4)cc3)nc12 1191287509 AJHPPWKMXVZIOL-QGZVFWFLSA-N 430.508 4.472 10 10 IICE C[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1223424251 WUQUZMLWZOXNDO-FOIQADDNSA-N 433.394 4.178 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCc3ccc(S(C)(=O)=O)cc3)cc2Cl)C1 1270440668 SYNGCOMBGQWQMO-KRWDZBQOSA-N 449.016 4.229 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 1292433712 WVCJOFQUIDZFME-HSZRJFAPSA-N 435.955 4.207 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)OC(C)(C)C)[C@@H](C)C3)c2C)cc1 1294029368 BPULAPVUUPNRIR-KRWDZBQOSA-N 427.545 4.184 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ncsc1Nc1cccnc1 1294860527 VSVXAMMQTUQZHZ-KRWDZBQOSA-N 443.960 4.035 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCSc1ccccc1Cl 1295590525 LGBNNJPUSIEBGT-UHFFFAOYSA-N 428.337 4.383 10 10 IICE CC[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@@H](C)O1 1306454537 XGSNEFZQFFARKT-AUSIDOKSSA-N 425.621 4.437 10 10 IICE CN(C)[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1c(F)cccc1Cl 1354113256 BOHVSKFOKVGXDE-NRFANRHFSA-N 436.870 4.496 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(F)c(F)c(F)c1 1435282126 VIPPLLZJLOAFHU-CHHVJCJISA-N 440.443 4.473 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@H](O)COc1cc(F)cc(Br)c1 1459325775 BCHDHJXTBMYMBH-FQEVSTJZSA-N 439.369 4.305 10 10 IICE O=C(NCCCSc1ccccc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1464002033 PVCLHAHCJPBDHD-UHFFFAOYSA-N 448.591 4.167 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCCN(C(=O)Cc4ccccc4)C3)c2C)c1 1467402742 UIZBELDRMPAISP-QHCPKHFHSA-N 429.564 4.366 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H](c4ncc(Br)cn4)C3)cc2)CC1 1473792727 FIZIUQHCYRYEHI-SFHVURJKSA-N 445.405 4.234 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1C[C@H](C)S[C@@H](C)C1 1510675574 SPSOKKGNEYCQQX-OALUTQOASA-N 436.629 4.017 10 10 IICE Cc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Cl 1518324448 DXPGYPOVVCLXIC-UHFFFAOYSA-N 442.947 4.019 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 1520960868 HTBSNIWTTBBQED-KRWDZBQOSA-N 441.494 4.257 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1-c1cnn(C)c1 1527480793 AMOMIVCKJQTEBM-QZTJIDSGSA-N 436.531 4.078 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1c1ccc(OC)cc1 1540518307 JNPLLFNFUWERHM-ZCYQVOJMSA-N 437.584 4.110 10 10 IICE Cc1cc(CC(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c(C)n1-c1ccccc1 1542637910 ORYSUVUENCARPR-UHFFFAOYSA-N 431.536 4.370 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)C3(CNC(=O)OC(C)(C)C)CCC3)ccc21 1543948336 DJTIGTLJYYUWTP-UHFFFAOYSA-N 443.588 4.424 10 10 IICE COCCC1(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCC1 1555442349 ZCVAUVIIRJWGGR-UHFFFAOYSA-N 426.586 4.479 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nc(C)cs1 1555510229 FOWRFXDAOYTYNF-UHFFFAOYSA-N 436.585 4.248 10 10 IICE O=C(CCCc1ccccc1)N[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1556556497 MBVZIJXEOARIKC-GOSISDBHSA-N 438.549 4.056 10 10 IICE CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1564594227 WPYYRRNESWRXMM-USCONSEESA-N 432.996 4.084 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)c2ccc(O)cc2)c(C)n1-c1ccccc1Br 1570781875 AQEVPLQHLIQIHN-JOCHJYFZSA-N 443.341 4.200 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3csc(-c4ccccc4Cl)n3)cc2)CC1 1583475641 KALJWCKKJCUAIU-UHFFFAOYSA-N 426.973 4.145 10 10 IICE C[C@@H](c1ccc(Br)cc1)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1586006088 PXWXNXWFMSOFLD-AWEZNQCLSA-N 444.333 4.131 10 10 IICE CCS(=O)(=O)c1ccccc1CC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1586081183 BKYMMYIVIZXNMP-KRWDZBQOSA-N 449.016 4.229 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)ccc1[N+](=O)[O-] 1586082859 UUQAYQKPXMOVFU-OAHLLOKOSA-N 431.920 4.488 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(-c4ccccc4)cc3OC)CC2)c(OC)c1 1587486662 FAMAIGQUUROIRO-UHFFFAOYSA-N 438.549 4.403 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)N(C)C)cc1 1603554717 JWMOUGSMLJPOPO-HNNXBMFYSA-N 443.306 4.139 10 10 IICE CN1CC[C@H](C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[C@@H]1c1ccccc1 1610971191 GKJXONVLHPOZBL-COPCDDAFSA-N 429.511 4.066 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CSC[C@H]3C(=O)N[C@H](C)C(C)C)c2C)c1 1616945443 HQAFIGWBUKGKOP-GCJKJVERSA-N 427.614 4.387 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(NC(=O)OC(C)(C)C)cc3)CC2)c(OC)c1 1623759275 AJHAEKXZHVLPQP-UHFFFAOYSA-N 441.528 4.013 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3CCc3ccccc3)CC2)c(OC)c1 1623760206 SRFFDZFPLNBHPB-UHFFFAOYSA-N 430.548 4.451 10 10 IICE Cc1ccc(C(=O)NCC2(N3CCSCC3)CCCC2)cc1-n1c(C)cc(C=O)c1C 1629934201 LLKUATMDCUDOQB-UHFFFAOYSA-N 439.625 4.306 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1O 1630368685 UDKLFFUOBQHHTI-UHFFFAOYSA-N 448.363 4.196 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)[C@@]12CCCO2 1638250235 JCQDPNSWITVUAA-SJBKTWHCSA-N 447.373 4.313 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1C[C@H](OCC)C1(C)C 1641815485 BQMGZIYANCWYIT-YADHBBJMSA-N 448.563 4.316 10 10 IICE CCn1c(O)nnc1SCC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1643430227 OIAFIZUPPFROND-UHFFFAOYSA-N 435.347 4.149 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CC3)c3cccc(F)c3)cc2F)C[C@@H](C)O1 1644162481 YKZRVGSBRXPAFY-HDICACEKSA-N 443.538 4.111 10 10 IICE COC1CCN(c2ccc(CN3CCO[C@H](c4ccc(OC(F)F)cc4)C3)cc2)CC1 1645163091 KMZJVNBEGKMNSK-QHCPKHFHSA-N 432.511 4.477 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCN(CCCc2ccccc2)C1=O 1655228066 OMDSPMNHJVNSNL-XMMPIXPASA-N 443.503 4.471 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3nc(-c4ccccc4F)cs3)C2)cc1 1672316573 HLSYDNSIKWTOPN-HNNXBMFYSA-N 426.517 4.036 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(F)c2ccccc12 1686658385 FNHJTUIBQIDZFQ-QGZVFWFLSA-N 448.542 4.241 10 10 IICE CCc1nnc(N2CCC[C@H](c3nc(C)cs3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694714103 PWHIOFSZDDPZHK-KRWDZBQOSA-N 428.581 4.243 10 10 IICE CCc1nnc(N2CCC[C@@H](c3nc(C)cs3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694714105 PWHIOFSZDDPZHK-QGZVFWFLSA-N 428.581 4.243 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1712776586 BIZCOHLVKOMFEE-GHTZIAJQSA-N 447.624 4.495 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](O)C1 1712823285 GXZOVVRFRSYNBK-VGSWGCGISA-N 439.629 4.313 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1C[C@H](c1cccs1)N1CCCC1 1728983533 OXKIKXFVHJIJAE-LJQANCHMSA-N 441.601 4.055 10 10 IICE CCOCc1nnc(N(C)[C@H](C)c2ccco2)n1Cc1ccc(N2CCSCC2)cc1 1767758422 QKOFSGYPUQMLCE-GOSISDBHSA-N 441.601 4.207 10 10 IICE C[C@H](C(=O)NC(C)(C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C1CCCC1 1867018131 WSACUZWRDCGCQG-HNNXBMFYSA-N 432.520 4.122 10 10 IICE COc1ccc(CNCCCONC(=O)OCC2c3ccccc3-c3ccccc32)c(O)c1 1937207510 BRHFSPCQQKQUGQ-UHFFFAOYSA-N 448.519 4.351 10 10 IICE Cc1ccc(O)c([C@H](C)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c1 2084723465 YPVVYFNTRFYGTN-RBBKRZOGSA-N 439.600 4.473 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 2193233501 KTROGDVRQUTJNG-WBVHZDCISA-N 447.270 4.446 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccccc3C)C2=O)cc1OC 15045501 KRZDGMJBFBBGLN-VCRXTVNUSA-N 442.562 4.241 10 10 IICE NC(=O)c1ccccc1NC1=NC(=O)/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)S1 39869846 HFNDJFHIGAHMHW-WOJGMQOQSA-N 434.433 4.036 10 10 IICE Cc1ccc2c(c1)N[C@H](SCC(=O)Nc1ccc3c(c1)C(=O)c1ccccc1C3=O)N2 59485257 YFJXEAIBNSSEGW-XMMPIXPASA-N 429.501 4.263 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1F 726708542 CEMXGNKTERHSCZ-QGZVFWFLSA-N 441.482 4.170 10 10 IICE CCOC(=O)c1c(CSc2ncc(-c3ccc4c(c3)OCCO4)n2CC)noc1C 809951810 JDUSTVTUJVDAQE-UHFFFAOYSA-N 429.498 4.107 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)/C=C\c2ccc(Br)o2)cc1 916566488 ZQTSLFXTSGCHHP-XASXRRJKSA-N 433.346 4.329 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3nc(C(C)C)n(-c4ccccc4Cl)n3)C2)cc1 1131030737 UTJGZYWSNUESEU-MRXNPFEDSA-N 439.947 4.061 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1Cc2cc(Br)ccc2O1 1135964769 NHEZYNLKEYUDCS-OAQYLSRUSA-N 429.358 4.402 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(=O)c4ccc(Cl)cc4o3)cc2F)C[C@@H](C)O1 1136310965 BTCWIYMKTVIYSJ-OKILXGFUSA-N 444.890 4.129 10 10 IICE CCOC(=O)c1sc([C@H]2CCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)C2)nc1C 1153397547 ODMDBDIQXSHAOY-KRWDZBQOSA-N 438.553 4.060 10 10 IICE Cc1sc(-n2cccc2)c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1C 1161175553 XAEMWUBFIHPALI-UHFFFAOYSA-N 431.508 4.200 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3c(=O)oc4cccc([N+](=O)[O-])c43)c2C)cc1 1189255955 JONYCOILWJBBPU-UHFFFAOYSA-N 435.436 4.192 10 10 IICE COC(=O)CCN(C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1cccc(F)c1 1265439589 LZLFMYPIRLGYPI-UHFFFAOYSA-N 438.499 4.264 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1291361143 HPFMFZNTWNLQOB-RDPSFJRHSA-N 439.629 4.455 10 10 IICE CCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1292258959 WVHUZEHGTRCWIP-UHFFFAOYSA-N 429.586 4.147 10 10 IICE Cc1ccccc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCC[C@@H](C)C1 1293237407 XJYMBZXNQPJHCV-ZDPZECHZSA-N 430.570 4.370 10 10 IICE CO[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCCC1 1293793540 QYGAMBSHHLYJRX-LEWJYISDSA-N 433.593 4.030 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccc([C@H]3CCCCN3C(=O)OC(C)(C)C)n2C)c1 1301046521 DTWAHLLPMFLSTI-LJQANCHMSA-N 427.545 4.431 10 10 IICE Cc1cc(C(=O)N[C@@H]2C[C@@H](N(C)C)C23CCC3)c(C)n1-c1ccccc1Br 1301549172 RHBMWLLPDYKXKG-WOJBJXKFSA-N 430.390 4.459 10 10 IICE C[C@H](Cn1c(C2CCCC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1302870961 CRSHDNYNYDSVEB-MRXNPFEDSA-N 429.565 4.191 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC(C)(C)CC3)n2CCCSc2nccs2)n1 1304750951 OYGMRJTVFMJADF-UHFFFAOYSA-N 445.662 4.405 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)CCn4cccn4)nnc3C(C)(C)C)cc2)CC1 1305066718 NYXPFLCLSAALHT-UHFFFAOYSA-N 435.620 4.193 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccc(Cl)c(Cl)c3)cc2F)C[C@@H](C)O1 1356036802 PWDBMWYKGNEQLV-OKILXGFUSA-N 441.330 4.441 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CSC[C@H]2C(=O)N[C@@H](C)C(C)C)c1 1360236120 HXZZAHKBEZFXSV-JXFKEZNVSA-N 434.005 4.423 10 10 IICE CCOC(=O)Cc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1360752938 VDJMMHRWLVHYPK-UHFFFAOYSA-N 433.552 4.152 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCCCCC[C@H]1NC(=O)OC(C)(C)C 1360847930 CMVFTSVHKCCMCB-RBUKOAKNSA-N 431.577 4.342 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2[C@@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1361045276 SCWMNKVQTNCVJG-HRAATJIYSA-N 434.588 4.284 10 10 IICE COC(=O)[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(C)c(C)c1 1436001426 VHBAEPIQAUDVIS-SANMLTNESA-N 447.579 4.055 10 10 IICE Cc1ccc(NC(=O)C2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)nc1 1441710141 AZPHKMKEWXIJIS-UHFFFAOYSA-N 444.535 4.101 10 10 IICE Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c(C)n1-c1ccc(Br)cc1 1445941458 YBQRATKAZMPQPQ-UHFFFAOYSA-N 429.314 4.240 10 10 IICE COc1ccc(S[C@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952115 VPKHZSWIDYMZTN-QAPCUYQASA-N 434.989 4.316 10 10 IICE CCc1ccc(C2=CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)cc1 1470448890 COSOJCJIRLKWQL-UHFFFAOYSA-N 441.522 4.363 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N=[S@](C)(=O)c2ccc(N(C)C)cc2)cc1 1471018107 NZTCHUHFLGFRBH-WJOKGBTCSA-N 437.565 4.199 10 10 IICE COCCN(Cc1cn(-c2ccc(Cl)c(Cl)c2)nn1)c1ccc(OC)c(OC)c1 1473227719 KSLGBTZGCJVRPX-UHFFFAOYSA-N 437.327 4.244 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](CCO)c1cccc(C(F)(F)F)c1 1478840350 AMAPQWMRUYPIMS-IERDGZPVSA-N 437.506 4.434 10 10 IICE C[C@@H]1CCCC[C@H]1OCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1493597489 FNUOGKZQVMMYND-KAGYGMCKSA-N 428.577 4.109 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ncc(C(F)(F)F)cc3Cl)cc2F)C[C@@H](C)O1 1516809649 CJUMRGFQWLQZGU-TXEJJXNPSA-N 445.844 4.437 10 10 IICE Cc1cc(F)ccc1CCNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1517250721 MQMCAHYNWPLIGY-CPNJWEJPSA-N 446.544 4.223 10 10 IICE CCC[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccn1 1537512726 RKSNBSZLGUXZML-OWBBTNHHSA-N 443.569 4.470 10 10 IICE CC(C)[C@H]1CCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541380820 YOKPNVKYHMBUCQ-HSZRJFAPSA-N 439.648 4.457 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1ccc(NCCc2ccccn2)cc1 1544408275 BYJVVIZHWJQNNC-UHFFFAOYSA-N 432.593 4.219 10 10 IICE C[C@H]1CCCN(c2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccn2)C1 1545632484 NEZGLHQDCOFJBY-UWJYYQICSA-N 442.991 4.071 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)C(C)(C)C1 1556879524 QPRZZLADXUMRSE-INIZCTEOSA-N 435.528 4.228 10 10 IICE CC(C)c1ccc([C@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(C)C)cc1 1559708541 VTOKLXSQWDHCPJ-AREMUKBSSA-N 441.591 4.389 10 10 IICE CCOc1ccc(N(CC(=O)N2CCCN(Cc3ccccc3C)CC2)CC2CC2)cc1 1560070410 YAPGPTZKANPSDK-UHFFFAOYSA-N 435.612 4.345 10 10 IICE CC(C)[C@H](NC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)[C@H](O)C(F)(F)F 1564649522 FSTSSXFVNHWNON-KKXDTOCCSA-N 435.918 4.323 10 10 IICE Cc1cc(C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cc1 1585441605 UXWMGVZWPUOOEP-FQEVSTJZSA-N 448.405 4.039 10 10 IICE COc1ccc(N2CCN(c3c([N+](=O)[O-])cnc4c(Cl)cccc34)CC2)c(OC)c1 1612786291 YXXJHSSGNTWHNK-UHFFFAOYSA-N 428.876 4.140 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3nccnc3SCc3ccccc3)CC2)cc1 1623429545 GNSCCGMAIRNGFZ-UHFFFAOYSA-N 434.565 4.130 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c1 1626339828 XNLFZHNRSXVBKG-QFIPXVFZSA-N 444.579 4.034 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)c1 1629048791 MBWXSGJRWVCGHG-JOCHJYFZSA-N 445.519 4.068 10 10 IICE Cc1nc(Br)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1631612341 MMFCIZHMRCLXLJ-INIZCTEOSA-N 438.391 4.101 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(OCc4ccccn4)cc3)c2)CC1 1632290808 QPNIEUYMALJWKN-UHFFFAOYSA-N 430.552 4.443 10 10 IICE COC(=O)c1cc(Cl)cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1O 1636168677 ZZQANTRORNKSCH-UHFFFAOYSA-N 442.899 4.313 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccccn3)C2)c(C)n1-c1ccc(Br)cc1 1636530582 HFNGTSSCPLEKCF-GOSISDBHSA-N 439.357 4.260 10 10 IICE Cc1cc(C)nc(Nc2ccc(Cl)c(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)c2)n1 1638348211 OQHUKYBLRNXDJO-AWEZNQCLSA-N 426.904 4.263 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)c1C 1645632002 LXFJVRCKHIAIAD-XUZZJYLKSA-N 437.490 4.383 10 10 IICE CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N1Cc2cccc(O)c2C1 1650672856 OZELDAWBTSGMEP-KRWDZBQOSA-N 439.364 4.093 10 10 IICE Cc1cc(C(=O)NCc2noc3cc(F)ccc23)c(C)n1-c1ccc(Br)cn1 1650822660 RAXNEDKNPHGZMV-UHFFFAOYSA-N 443.276 4.462 10 10 IICE Cc1ccc(N(C)CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1652848059 YTQHDCBXJCWXHV-IAGOWNOFSA-N 433.955 4.154 10 10 IICE COC(=O)CN(Cc1cccc(C(=O)Nc2ccccc2)c1)Cc1cc(Cl)ccc1O 1653612121 YLJUHSMJCBIEQY-UHFFFAOYSA-N 438.911 4.473 10 10 IICE CC(=O)N1CCC(N(Cc2ccc(N3CCCCC3)c(C)c2)Cc2cncs2)CC1 1653697545 VZDIKXQIMVBCNX-UHFFFAOYSA-N 426.630 4.455 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)C(=O)N([C@@H](C)c3ccccc3)C2=O)c1C 1656211819 LLIBRTFFNARBMH-SFHVURJKSA-N 443.503 4.137 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CC=C(c2ccccc2Cl)CC1 1673472167 BRTADPZNLXGXQS-UHFFFAOYSA-N 447.913 4.454 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(CCc2ccccc2)Cc2cccnc2)N(C)C)cc1 1676653193 HNLWUZLYIRSKEV-SANMLTNESA-N 445.611 4.205 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1COc2cccc(Br)c2C1 1683253604 IYHXYIIPBZZESM-NVXWUHKLSA-N 446.389 4.057 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCC(C)(C)C(=O)N3CCCC3)cc2Cl)C1 1686269472 QCUSCXIXCCLMEV-KRWDZBQOSA-N 435.012 4.024 10 10 IICE COCC1(C)CCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC1 1697793747 YEELMWQMRFVOCR-UHFFFAOYSA-N 432.619 4.165 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1750326296 FXQXMQDRLDFTMS-HXUWFJFHSA-N 425.602 4.331 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1764208569 QACFIHBMRHVJER-HXUWFJFHSA-N 437.588 4.394 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCSC1 1765963087 VYPMQSYJZRFUCH-XMMPIXPASA-N 439.629 4.457 10 10 IICE [N-]=[N+]=NCC1(CNC(=O)c2cc(Cl)cc(Cl)c2I)CC1 2174355244 MQPNQAFFIGEQMG-UHFFFAOYSA-N 425.057 4.418 10 10 IICE N=C1C(=Cc2ccc([N+](=O)[O-])cc2)C(=O)N=C2SC(C34CC5CC(CC(C5)C3)C4)=NN12 2297630498 VGHZHEQHCWDTCO-UHFFFAOYSA-N 435.509 4.430 10 10 IICE O=C(O)CCN1C(=O)C(=Cc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)SC1=S 2314650357 BTRATZLNTUNBNE-UHFFFAOYSA-N 438.870 4.184 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3C[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352949834 JTTYOPLJYXHIKT-VNQPRFMTSA-N 425.367 4.198 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2cccc(O)c2)SC1=S)NCc1ccccc1 15045293 KXVBVKISIBYQGC-HKWRFOASSA-N 440.590 4.470 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1cc(C)ccc1C 20236205 YSUFZPDENMSAMP-SEOKDCOXSA-N 447.491 4.220 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(CCCC)C1=O 33467321 MQDJSJVRPLNCSJ-JQIJEIRASA-N 430.599 4.298 10 10 IICE CCCCOC(=O)c1cc(-c2ccc(/C=C3/C(=O)N(C)C(=O)N=C3O)o2)ccc1Cl 59862130 LIEVKFRVLLAXHD-RVDMUPIBSA-N 430.844 4.489 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3cccc(C)c3)C2=O)ccc1OCCC(=O)O 210444398 UGQFRKTVEUSYRG-PDGQHHTCSA-N 429.519 4.263 10 10 IICE Cc1ccc(S(=O)(=O)N(CCF)c2cccc3c2C(=O)c2ccccc2C3=O)cc1C 586211709 OPTKOEKKRYHJLN-UHFFFAOYSA-N 437.492 4.244 10 10 IICE Nc1cc([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)cc1F 687755309 ZLFFUJXYVSRZMH-NRFANRHFSA-N 436.439 4.168 10 10 IICE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1cc(Br)c(CN)cc1F)C2 705881854 OKOWHSWJOTYIFJ-VXKWHMMOSA-N 432.381 4.395 10 10 IICE Cc1ncc(Cl)c(C(=O)OCC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 745378804 QHVJTBBNMFLDOT-UHFFFAOYSA-N 449.841 4.487 10 10 IICE COc1ccc(Br)cc1CC(=O)Nc1c(-c2ccccn2)nc2ccccn12 751308173 RSNNODZDWOXXEN-UHFFFAOYSA-N 437.297 4.349 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(N2CCOC2=O)c1 773145657 KTWFCPSPKLMIKT-FQEVSTJZSA-N 434.584 4.026 10 10 IICE C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(-c2ccccc2)cc1 774788815 LXYKUOFDVAQMFK-FQEVSTJZSA-N 447.554 4.296 10 10 IICE Cc1cc(C(=O)COC(=O)c2cc3c(O)ncnc3cn2)c(C)n1-c1ccc(C(C)C)cc1 778467658 GTZVOFJJDIIBEF-UHFFFAOYSA-N 444.491 4.301 10 10 IICE CC(C)(C)OC(=O)N(CC(=O)NCc1cc(Br)ccc1O)c1ccccc1 804736314 RMOGNQGWOWGBIP-UHFFFAOYSA-N 435.318 4.213 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](OC(C)(C)C)c3ccccc3)cc2F)CC1 1125975749 ACOPGUZGRGVMSV-QHCPKHFHSA-N 427.564 4.140 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(C)n(-c4cccc(C(F)(F)F)c4)n3)C2)cc1 1131031038 XISPDPUUPYWVDZ-KRWDZBQOSA-N 444.457 4.217 10 10 IICE Cc1cc(CNC(=O)CCCN2CCN(c3ccccc3)CC2)c(C)n1-c1ccccc1 1132263297 CNECHGIQZYWOOQ-UHFFFAOYSA-N 430.596 4.313 10 10 IICE Cc1ccc(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1142335775 LQHKOEAXHCYKGF-DEOSSOPVSA-N 443.547 4.309 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1cccnc1 1160197638 NYHHQGKGWWYBBY-HSZRJFAPSA-N 425.916 4.351 10 10 IICE Cc1cc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)c(C)o1 1188716594 CEDWWTDKHAJYCP-XMMPIXPASA-N 437.471 4.093 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1 1234971673 NXLDVBOSWGCEDX-MXVIHJGJSA-N 430.593 4.122 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@@H](C)c3noc(COC(C)C)n3)c2C)c1 1251572882 JIHWIUPEJSBUEY-KRWDZBQOSA-N 425.533 4.271 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@@H]1CCCC1(F)F 1288283231 FYVUFAOVABMAAL-AOHITCTBSA-N 442.528 4.359 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)O[C@H](C)C3)n2CCOC(C)C)c(C)n1-c1ccccc1 1289358903 HDKUHMOIVAVUHL-WOJBJXKFSA-N 437.588 4.391 10 10 IICE CC(=O)Nc1ccc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)nc1 1296284005 UYWVYLSLLUQVKQ-UHFFFAOYSA-N 427.302 4.462 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)S[C@H](C)C1 1301818658 RELPJXPBOFHOCB-QZTJIDSGSA-N 425.602 4.329 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)cc1 1307644705 WTGLBGRGJBPIMW-YYDVJCTNSA-N 427.564 4.105 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@H]3c3ccc(O)nc3)cc2Cl)C1 1312590760 PWCBPXILMFAUBD-YOMUGFJLSA-N 444.963 4.006 10 10 IICE COC1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCSC)C1 1315261150 SDMJCSUZCJNKDG-UHFFFAOYSA-N 425.602 4.331 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3ccc(OC(F)F)cc3)cc2F)C[C@@H](C)O1 1355129986 KHDXWJPUFBQYIZ-IDENBPMYSA-N 448.485 4.461 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(N(C)C)c3ccccc3n2)cc1 1442619715 SUISXGBNWJFFMW-NRFANRHFSA-N 432.568 4.188 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1450410405 MGCIEVVMQGCNAB-AEFFLSMTSA-N 429.521 4.101 10 10 IICE COC(=O)C[C@@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccccn1 1459368276 VNADMNRADOLTDQ-XMMPIXPASA-N 439.943 4.280 10 10 IICE COCCCCN(C(=O)/C=C\c1cnc2ccccc2n1)c1ccc(Br)cn1 1459426308 KLSVTGFAITUFOK-LUAWRHEFSA-N 441.329 4.260 10 10 IICE Cc1nc(-c2ccsc2)ccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460741152 MBHVJIMAYCBUJL-UHFFFAOYSA-N 429.492 4.163 10 10 IICE Cc1cc(C(=O)NCc2noc3c2CCCC3)c(C)n1-c1ccc(Br)cn1 1468692204 PPDICOVWFYUAJA-UHFFFAOYSA-N 429.318 4.048 10 10 IICE C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1470447389 GWLBCHLZHLAPJI-HNNXBMFYSA-N 449.364 4.044 10 10 IICE Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)NCc3cccc(O)c3O)cc12 1471643125 FESRIWIHVYWJJO-UHFFFAOYSA-N 427.913 4.449 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)[C@H](O)Cc1ccccc1 1478529237 XPHAYMKMEHQDFU-IEGUWTFLSA-N 429.992 4.368 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H](C)Cc1cccs1 1499154541 SSOUBUOAKSENQO-KRWDZBQOSA-N 443.592 4.255 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CCC(=O)N1CCCCCC1 1517145627 AYZGXVFFSIMXER-UHFFFAOYSA-N 439.604 4.146 10 10 IICE COc1cc(OC2CC2)ccc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1524058762 PIHAGUUMIFKTME-OAHLLOKOSA-N 432.467 4.237 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1coc2ccccc12 1526850923 YIHSATVGAVNPKX-YBFXNURJSA-N 440.521 4.480 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4ccc(Br)cc4)CC3)C2)cc1 1529705882 BGKQSTAVZZBYIG-INIZCTEOSA-N 429.358 4.132 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CCCN3C(=O)Cc3ccccc3)c2C)c1 1534760401 STOHBTXECHBZSW-RUZDIDTESA-N 429.564 4.252 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 1542473482 WRKCHJPHWQWRMA-OAQYLSRUSA-N 427.545 4.098 10 10 IICE C[C@@H]1CCCCN1CCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1544027909 ZABIITVSGKHQQP-DENIHFKCSA-N 427.593 4.126 10 10 IICE CCc1nnc(N2CCC(Cn3nc(C)cc3C)CC2)n1Cc1ccc(N(CC)CC)cc1 1546474102 UCHHFWKMWLVEOQ-UHFFFAOYSA-N 449.647 4.465 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1547449437 WUJGDUGEOKFMAS-DEOSSOPVSA-N 448.615 4.020 10 10 IICE COCCN(Cc1ccco1)c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1 1555551336 KWONZVDLKQFDHK-UHFFFAOYSA-N 427.524 4.045 10 10 IICE Cc1ccc(C(=O)N2CCC[C@H](Oc3ncccc3F)C2)cc1-n1c(C)cc(C=O)c1C 1556487159 MXGJNMIIWLPFCH-NRFANRHFSA-N 435.499 4.433 10 10 IICE O=C(CCCc1ccccc1)N[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1 1556556498 MBVZIJXEOARIKC-SFHVURJKSA-N 438.549 4.056 10 10 IICE CCOC(=O)CS[C@H](CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C)C(F)(F)F 1558053426 BPFSQVOPXQWXEF-GOSISDBHSA-N 442.503 4.360 10 10 IICE C[C@@H](NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(N(C)C)cc1 1564598100 ZJOROIZZSGENDX-NLFFAJNJSA-N 444.579 4.041 10 10 IICE CC(C)[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)[C@H](O)C(F)(F)F 1564649521 FSTSSXFVNHWNON-BVGQSLNGSA-N 435.918 4.323 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3nccc4c(Br)cccc34)CC2)cc1 1566562112 CTXXOQNGVGUGSC-UHFFFAOYSA-N 440.341 4.358 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@@H](C(=O)OC(C)(C)C)CC[C@@H]2C)cc1 1570475135 GUUPHJVIJRTQHH-UWJYYQICSA-N 438.568 4.418 10 10 IICE CCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(Cl)cc1 1586061670 UAPLJMJAVXXUGQ-QHCPKHFHSA-N 439.991 4.187 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(I)cc2NC)cc1 1596578035 GKDFPGCKOAMQED-UHFFFAOYSA-N 437.325 4.109 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC(C)(C)C1CC1 1616885351 YHBSLVRJPNOSQR-UHFFFAOYSA-N 441.620 4.366 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)cc1 1617139096 FEAZFKNIVLZVLA-HSZRJFAPSA-N 438.568 4.336 10 10 IICE Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1626252871 CEISUUIADSDFOR-XMMPIXPASA-N 445.519 4.077 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@H](C)[S@@]1=O 1627248491 AXUAHTFDMJAJLF-PVUPQYDMSA-N 437.403 4.228 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1628325300 HQLXKUZJUHLEQP-LLVKDONJSA-N 430.382 4.101 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(Br)cc1O 1629969222 RIQNXRDFTAIBJC-UHFFFAOYSA-N 429.108 4.285 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(c3nc(F)c(F)cc3F)CC2)c1C 1633971040 IEMKXZFOUMRYJV-UHFFFAOYSA-N 428.458 4.177 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(F)(F)c3ccc(Br)cc3)CC2)cc1 1636707088 SFHGFSUGPUAATJ-UHFFFAOYSA-N 439.300 4.288 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(C)nn(-c3ccc(F)cc3)c2Cl)cc1 1639814418 XYVLOLRMDOUQTK-UHFFFAOYSA-N 430.911 4.190 10 10 IICE CCOc1ccc(N2CCN(Cc3csc(-c4ccc(C(=O)OC)cc4)n3)CC2)cc1 1649398215 SOSJVWBXTHUYED-UHFFFAOYSA-N 437.565 4.318 10 10 IICE Cn1cc(Br)c(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)n1 1652477011 VXGHUEKALHBZCX-UHFFFAOYSA-N 435.366 4.160 10 10 IICE O=S(=O)(c1cc(F)ccc1NCc1cccc(Br)c1O)C(F)(F)F 1655446843 AYZQPEAPOQWXPN-UHFFFAOYSA-N 428.201 4.199 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](Cc3ccccc3)c3ccccn3)C2)cc1 1673825401 AUYDETUOHUODFR-OFVILXPXSA-N 430.552 4.200 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1676549972 QRTSWKGBLZUSIZ-DQEYMECFSA-N 431.584 4.034 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccoc3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1707268839 BOCJRJRCYDLAAE-UHFFFAOYSA-N 446.555 4.060 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1727690328 WMSWQIJHPLSPQH-GHTZIAJQSA-N 448.615 4.456 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1727904704 ZCXJVJIPGDNPKI-KBMIEXCESA-N 437.588 4.129 10 10 IICE CN(Cc1ccsc1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1729439633 VKXIZTIYUHHFGW-UHFFFAOYSA-N 431.616 4.015 10 10 IICE CNC(=O)CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC1(C)C 1729698251 QYOMWLPFAUPCLE-FQEVSTJZSA-N 448.615 4.361 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2ccc(OC(C)C)nc2)o1 1742181871 RRHZOEVRPWTHKU-UHFFFAOYSA-N 433.512 4.419 10 10 IICE CCCN(CCC)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1745640786 JPQMMKYVHGAHHQ-UHFFFAOYSA-N 449.578 4.396 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1760946722 RRQXMCCYEDUWCN-MRXNPFEDSA-N 429.619 4.246 10 10 IICE CCC(CC)(Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1762133081 KMJMEKVQVWEDAC-UHFFFAOYSA-N 441.620 4.476 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1CC12CCC(CC1)C2 1764083332 DACRIQLLEGHOJI-UHFFFAOYSA-N 425.577 4.119 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)c(CCC(=O)O)s2)cc1 1858070024 AIWLYBYMNOPXJZ-UHFFFAOYSA-N 438.552 4.088 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)sc(C)c1-c1ccccc1 1866047740 MAPKQZGHLBOQSX-LJQANCHMSA-N 448.544 4.497 10 10 IICE CN(Cc1csc(=NCc2ccc(Br)cc2O)[nH]1)C(=O)OC(C)(C)C 2217853049 SUDFOQJIKFITNF-UHFFFAOYSA-N 428.352 4.012 10 10 IICE CC(C)(C)OC(=O)N1CCC(NCc2cccc(Br)c2O)(C(F)F)CC1 2227503184 RIHHMFJNTXBMCV-UHFFFAOYSA-N 435.309 4.279 10 10 IICE C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S 2314650637 SSUFFEBQHXCUOG-QMMMGPOBSA-N 438.870 4.183 10 10 IICE CCCC(=O)Nc1ccc2nc(N3CCN(c4ccc(OC)cc4)CC3)cc(C(=O)O)c2c1 33260610 DWDUCXYZGFDOQZ-UHFFFAOYSA-N 448.523 4.007 10 10 IICE COc1ccc(N2CCCN(C(=O)c3nn(-c4ccc(F)cc4)c4c3CCCC4)CC2)cc1 108429936 MQPSYKQIOLDVCE-UHFFFAOYSA-N 448.542 4.251 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](C)[C@H]2c2cccc(F)c2)c1 747460876 CMHLLRVKSCUDRX-XDHUDOTRSA-N 426.532 4.149 10 10 IICE COc1ccccc1[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1ccccn1 807036267 YCXOGTMZJOCXOH-HXUWFJFHSA-N 442.313 4.147 10 10 IICE COc1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1OC(C)C 1125189077 ZTTXDYZICCVOIH-CALCHBBNSA-N 430.520 4.165 10 10 IICE COc1cccc([C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 1128247107 MPXOISSRVSNVJP-IIBYNOLFSA-N 427.545 4.204 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(CN3CCC[C@H](C(N)=O)C3)cc2)c1 1143167838 PMWBISNNPZLMLF-QFIPXVFZSA-N 444.579 4.352 10 10 IICE CCOCn1nc(C)c(C[C@H](C)C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1C 1160563792 UGSNNTVUUYKAOK-INIZCTEOSA-N 432.528 4.021 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3nc(-c4ccc(F)cc4)cs3)C2)cc1 1276832497 WHASRIJIMXZYOM-MRXNPFEDSA-N 425.529 4.143 10 10 IICE CCOCc1nnc(N2CCC[C@H](OC(C)(C)C)C2)n1CCCSc1nccs1 1297227979 XGMQRGPISUZVKK-INIZCTEOSA-N 439.651 4.237 10 10 IICE O=C(N[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1cc2cc(O)c(O)cc2s1 1297551804 XIXMNVCTDUOZLT-FQEVSTJZSA-N 437.439 4.463 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(NC(=O)C2CCCCC2)c1 1301350514 OGJOVFRQGZNMDB-UHFFFAOYSA-N 435.568 4.097 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)SC)C1 1302390792 RWVRDAOKODLSEY-PXNSSMCTSA-N 425.602 4.329 10 10 IICE C[C@H](NC(=O)[C@@H](C)NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccccc1O 1302537988 CDNGMUDDNXUAAZ-DLBZAZTESA-N 430.504 4.497 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@H](C(F)(F)F)C1 1304071864 FYSARWMZWMYGHC-GJSJWPQCSA-N 434.530 4.140 10 10 IICE CCOc1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1355668719 IFOUXULUIIYHFM-CPNJWEJPSA-N 444.553 4.132 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Br)cn1 1465508221 IZDMPTLHKQBGHQ-HNNXBMFYSA-N 448.361 4.055 10 10 IICE CC(C)(C)Oc1cccc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 1479216558 WUZKOEVOEJKYCQ-UHFFFAOYSA-N 425.573 4.072 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ncc(CC)s1 1503014244 LPRGMHCWLZJIJI-UHFFFAOYSA-N 440.617 4.118 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](CC(C)C)C1 1503807923 GUFMVGYKRQGYJL-NRFANRHFSA-N 448.615 4.361 10 10 IICE CCC(CC)(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)c1ccc(OC)c(OC)c1 1528317170 AIFJXOHVRQZQMV-LJQANCHMSA-N 426.557 4.165 10 10 IICE Cc1cc(CC(=O)N2CSC[C@@H]2C(=O)Nc2cccc(F)c2)c(C)n1-c1ccccc1 1530215088 QBAKXHVSEBBWOY-JOCHJYFZSA-N 437.540 4.316 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCS[C@@H](C)[C@H]1C 1542227180 VKNMHOAZFNRJQF-MOPGFXCFSA-N 436.629 4.017 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1542490027 AVLQDIKLGKQFNU-PMACEKPBSA-N 430.980 4.199 10 10 IICE CCOCCCNC(=O)c1cccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1543118630 LDEWJPGCTHKAOG-UHFFFAOYSA-N 447.535 4.315 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc3ccc(Br)cc3c(=O)o2)cc1F 1543251558 SMGFAFVURQJQOC-UHFFFAOYSA-N 447.304 4.471 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)Cc4ccccc43)ccc21 1544165115 UVTADZRLYIGNLC-QFIPXVFZSA-N 435.568 4.220 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1cccc(C(F)(F)F)n1 1556426334 IJUSUMYONSRRFY-UHFFFAOYSA-N 437.462 4.032 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3ccc(O)cc3O)[C@H]2c2cccs2)cc1 1557084922 UHIKWMNRVPQFNN-CVDCTZTESA-N 436.533 4.268 10 10 IICE Cc1[nH]c(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)c(C)c1C(=O)OC(C)C 1557274390 DOIVVEATMUAQEJ-UHFFFAOYSA-N 439.478 4.467 10 10 IICE Cc1cc(CC(=O)NCCNC(=O)NC2CCCCC2)c(C)n1-c1ccc(Cl)cc1 1566398897 YBTOBNLGPSHURC-UHFFFAOYSA-N 430.980 4.038 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(NC(=O)C4CCCCC4)c3)C2)cc1 1584439449 LXXKCADEHGBLRI-IBGZPJMESA-N 435.568 4.470 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc(C)c1OCC(=O)N1CCCCC1 1585424883 TWVLPQXALZIMCY-FQEVSTJZSA-N 437.584 4.252 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1c(Cl)cccc1OCC1CC1 1586799937 JOWSTLHGZVEDRX-UHFFFAOYSA-N 428.960 4.268 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(OCC(F)(F)C(F)F)nc1 1597801081 WXRIBIPSPVHNJW-AWEZNQCLSA-N 427.442 4.096 10 10 IICE Cc1ncc(CN(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)s1 1612431349 YGCQXUWRYMGKFX-UHFFFAOYSA-N 433.585 4.164 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CCC=CO3)CC2)cc1F 1619302726 ZDNCYIJGJPHSSB-IBGZPJMESA-N 443.567 4.034 10 10 IICE COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2ccccc2C)c1C 1625407901 RVSJKTLOECNBQO-QHCPKHFHSA-N 429.520 4.398 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@H](c2ccccc2)c2ncc[nH]2)cc1 1631612523 PTQTVQMKAREKBA-BJKOFHAPSA-N 432.568 4.206 10 10 IICE Cc1cccc(CN2CCO[C@@H](CNC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)c1 1632291773 CYJIGJUHLJNTII-VWLOTQADSA-N 431.580 4.342 10 10 IICE Cc1cc(C(=O)N[C@@H]2CS(=O)(=O)Cc3ccccc32)c(C)n1-c1ccc(Cl)cc1 1633651376 WSEGYPKXLPBKIG-OAQYLSRUSA-N 428.941 4.147 10 10 IICE CCN(C(=O)/C=C/[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1634247962 SWYOVOBMCNXCNF-BNCSFYMNSA-N 443.588 4.079 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(C(F)(F)F)ccc1Cl 1634424339 WQWGXZFKCBWAIN-UHFFFAOYSA-N 430.829 4.389 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(O)(c2c(F)cccc2F)CC1 1634748146 JSVFQCPHDILREE-UHFFFAOYSA-N 438.474 4.309 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1636354173 SPWPKMWOVXALDR-JOCHJYFZSA-N 446.595 4.471 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1scc(Br)c1Br 1638348298 QRDDENDVEKOSGK-ZETCQYMHSA-N 435.137 4.045 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2csc(Nc3cc(F)cc(F)c3)n2)cc1 1640771419 LDWFWQPJTLHBAO-UHFFFAOYSA-N 432.496 4.382 10 10 IICE Cc1nn(C)c(N2CCC2)c1NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1642632161 LMDIYGYKJMRNAY-UHFFFAOYSA-N 442.361 4.361 10 10 IICE Nc1ncc(Br)cc1CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1651053403 BQRVRCQPTZTHAD-UHFFFAOYSA-N 427.258 4.178 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](CC3CCCC3)c3ccccc3)CC2)cc1 1653967383 GOZAVBRAQHOTKD-BDYUSTAISA-N 437.628 4.089 10 10 IICE COc1ccc(N2CCCN(Cc3nnc(-c4ccc(Cl)cc4[N+](=O)[O-])o3)CC2)cc1 1657023724 NVFZWXXALLAPDZ-UHFFFAOYSA-N 443.891 4.019 10 10 IICE CCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1672133024 MZVZDMPDCCRUOF-PKOBYXMFSA-N 435.012 4.024 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)CC1 1674850601 UQOOCBAZIHURNK-HDJSIYSDSA-N 432.348 4.334 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1684322969 YWZYXHJEZJZIJG-HHHXNRCGSA-N 449.570 4.412 10 10 IICE C=CCN(Cc1cccs1)c1nnc(C)n1Cc1ccc(N2CCSCC2)cc1 1705863735 DIHNCJAHPKDWGI-UHFFFAOYSA-N 425.627 4.442 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC(C)(C)CN(C)C 1723271083 QKRNRHXQLKJQTN-UHFFFAOYSA-N 426.653 4.301 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCOC3)n2CCCOC(F)F)c(C)n1-c1ccccc1 1724206464 WADPGCFZHPOHEL-LJQANCHMSA-N 445.514 4.207 10 10 IICE CCN(Cc1cccs1)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1728443110 GJUBNLIMCIYEPZ-IBGZPJMESA-N 425.602 4.293 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@@H]3C)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1742120084 QJHQFXBGYPJTEM-SFHVURJKSA-N 439.629 4.455 10 10 IICE CCCO[C@H]1CCCN(c2nnc(COCC)n2Cc2ccc3c(c2)CCCN3C)CC1 1766328567 JRCYQHIJQOARHO-QFIPXVFZSA-N 441.620 4.031 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1CCc1ccc(Cl)s1 1767111782 FXHAGXMTLHCBOC-INIZCTEOSA-N 432.977 4.472 10 10 IICE CCCCCCOc1ccc(S(=O)(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1872716793 IWRAOTABHMKBIY-UHFFFAOYSA-N 432.586 4.165 10 10 IICE Cc1ccccc1NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCN(C)C)C1=O 1873421040 CVPJONSAYZSULO-UHFFFAOYSA-N 442.563 4.156 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](NCc1cccc(Br)c1O)C2 1878851827 UBSWLOMBQYRMCI-TUUVXOQKSA-N 429.330 4.123 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C(C)C)c(C(N)=O)c1I 2079954635 OTNABFQSCARLBN-CYBMUJFWSA-N 441.313 4.032 10 10 IICE CCCC1=NN(CC)C(=O)C1=Cc1ccc(OCC(=O)N(CCC)CCC)c(OC)c1 2332139252 LTXLDCTVPQRJGR-UHFFFAOYSA-N 429.561 4.124 10 10 IICE CC(=O)N[C@@H](CC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1cccs1 11942814 CRCOBWNOEJAXLR-FQEVSTJZSA-N 442.512 4.288 10 10 IICE CCOC(=O)CCCCCN1C(=O)/C(=C\c2ccc(Br)o2)SC1=S 40928408 GMPVDLNYEFQGNZ-ZRDIBKRKSA-N 432.361 4.367 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(C(=O)NCc4ccccc4)CC3)ccc21 481947807 SVQZEOFVKFJAQR-UHFFFAOYSA-N 447.579 4.073 10 10 IICE CCCNC(=O)[C@@H](C(C)C)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 606672186 XUGHMYKZIYLHOF-BAAYTWLHSA-N 441.416 4.201 10 10 IICE COc1ccccc1NC(=O)CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731037268 ZRRDUEJFATXFDB-UHFFFAOYSA-N 425.529 4.111 10 10 IICE Cc1ccc([C@H](C)CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 737647097 IWJFTGVVQYMOMS-OAHLLOKOSA-N 428.444 4.212 10 10 IICE CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 746425562 WBVZMXAIXJTJAC-SANMLTNESA-N 429.564 4.289 10 10 IICE Cc1cc(C(=O)COC(=O)c2cnc(-c3ncccn3)s2)c(C)n1-c1ccc(F)cc1 750192868 KADSSLRPKCSWBY-UHFFFAOYSA-N 436.468 4.186 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 768237134 KUGHVQPUAOGSCU-GGAORHGYSA-N 429.605 4.135 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nccn2Cc2ccccc2)C1 769665440 SAXGKKYIRWRDTI-UHFFFAOYSA-N 442.563 4.396 10 10 IICE CC(C)[C@@H]1C[C@@H](CC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc21 782724530 DNWQHSRTILJTBB-WATLYSKOSA-N 433.596 4.322 10 10 IICE CCn1c(CNCc2cc(Cl)cc([N+](=O)[O-])c2O)nc2cc(Br)ccc21 792199293 CZSJUGAQZSZCDO-UHFFFAOYSA-N 439.697 4.376 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc([C@H]3COCCO3)n2CCc2ccccc2)cc1 802303327 DQVWAPXCFHFKHM-XMMPIXPASA-N 449.599 4.091 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccn(C2CCCCC2)n1 1116799851 SWOJOBIAKMWYJU-UHFFFAOYSA-N 436.604 4.242 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cnc2ccccn12 1130651449 OREXYASLINHLGE-KAMYIIQDSA-N 428.564 4.016 10 10 IICE CC(=O)N[C@H](CC(=O)NCc1cc(C)n(-c2ccccc2)c1C)c1ccc(F)cc1F 1132267531 IYTOYVWPQQJBHG-HSZRJFAPSA-N 425.479 4.256 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)c(C)n1-c1cccc(C(C)C)c1 1135829003 ACMRTKRCOJBAIQ-KRWDZBQOSA-N 439.581 4.356 10 10 IICE COc1c(C)cnc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1C 1136489920 IQHNOCIDAZBHCA-UHFFFAOYSA-N 443.345 4.202 10 10 IICE Cn1cnc(-c2ccc(Br)cc2)c1NC(=O)c1ccc(N=NC(N)=O)cc1 1141522296 FCTCPNYDHSMBTF-UHFFFAOYSA-N 427.262 4.264 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCC(C)(C)C[C@@H]1c1ccccc1 1153663511 MVEHGLSIQYATRT-HBMCJLEFSA-N 439.552 4.298 10 10 IICE CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1169565235 BBHLSMNBUPGZDB-IRBZQWRBSA-N 448.563 4.362 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@H]1C[C@]2(CCN(C(=O)OC(C)(C)C)C2)CO1 1190436685 HEFSEUQKNACFTL-RDGATRHJSA-N 431.621 4.379 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1227207226 DXXRMFPVIHQQRS-NXHRZFHOSA-N 435.996 4.496 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@H](CCCc4ccccc4)C3)cc2)CC1 1246301415 GHENCICROYTWPK-VWLOTQADSA-N 434.628 4.383 10 10 IICE O=C(NCCc1ccc(Cl)c(Cl)c1)NCc1ccc(N2CCC(CO)CC2)cc1 1255270022 ITHBQBBXJMCJNM-UHFFFAOYSA-N 436.383 4.244 10 10 IICE COc1cccc([C@H]2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)C2(C)C)c1 1256237021 PBTCYPFYPMHFME-RPWUZVMVSA-N 438.616 4.342 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)/C(=C/c1ccccc1)C(F)(F)F 1266258974 MLXZDDHAIQRWIJ-KQWNVCNZSA-N 443.513 4.481 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 1294859087 HYDOUWJJXLLAEM-IXDOHACOSA-N 438.877 4.347 10 10 IICE Cc1cc(C(=O)N2CCC(OC3CCC3)CC2)c(C)n1-c1ccc(Br)cn1 1299535614 KCYJXGOHKIIJFF-UHFFFAOYSA-N 432.362 4.425 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1302010795 AZOODHYTGUESCL-WOJBJXKFSA-N 443.636 4.297 10 10 IICE CO[C@H]1CCC[C@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1315690049 FWOFSJCBIXKPNP-YUVXSKOASA-N 442.604 4.354 10 10 IICE Cc1cc(C(=O)CCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)s1 1445889374 YAGQBVHGTGZPBD-SFHVURJKSA-N 434.989 4.468 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3OCCOc3ccccc3)C2)cc1 1461077398 OUGOSUFBLMZCIA-NRFANRHFSA-N 446.547 4.409 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1463886194 KHYQMQQSCRXQFW-IAGOWNOFSA-N 448.405 4.086 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COC3(CCCC3)O2)c(C)n1-c1ccccc1Br 1466426088 IFSSXBNUOHGLBU-MRXNPFEDSA-N 433.346 4.272 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(Cc2ccccc2Cl)CC1 1470556566 XOXWOUOGOLHUSN-IBGZPJMESA-N 429.008 4.173 10 10 IICE Brc1cc(CN2CCC[C@H](N3CCOCC3)CC2)ccc1N1CCCCC1 1474601082 GPKHIFGZNUKWIQ-FQEVSTJZSA-N 436.438 4.126 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)CC2CCCC2)n1Cc1ccc(N(C)C)cc1C 1496735038 UMDUXHHHTBNVIK-UHFFFAOYSA-N 440.636 4.246 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1499338262 UEVBQEIDTTVEOR-PXNSSMCTSA-N 429.584 4.224 10 10 IICE CCCCN(CCOC)c1nnc([C@H]2CCCCO2)n1Cc1ccc2c(c1)CCCN2C 1500453651 ODTMZMCKXBUNMG-HSZRJFAPSA-N 441.620 4.203 10 10 IICE C[C@H]1Cc2ccccc2CN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1514830807 WQKCPMFDMQNNGR-NPRIEWAGSA-N 440.565 4.390 10 10 IICE CCN(c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1515400257 RWOCOQOPMNFXPO-UHFFFAOYSA-N 437.588 4.338 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)CC(C)(C)C1 1517583801 IKLVGSOCMFUKPX-SFHVURJKSA-N 448.615 4.361 10 10 IICE Cc1cc(CC(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)c(C)n1-c1ccccc1 1531065102 UMYCYRFWFXXMAD-UHFFFAOYSA-N 445.972 4.179 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)sc(C)c1-c1ccc(C)cc1 1531343381 XOBWGIAOUWINQB-INIZCTEOSA-N 426.538 4.158 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)C2(N3CCOCC3)CCCC2)c(C)n1-c1ccc(Cl)cc1 1543468539 DKLPYNPHUFEZDQ-FQEVSTJZSA-N 444.019 4.440 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)[C@H](O)c2c(F)cccc2Cl)cc1 1566342413 RYYDHNWRKVZGDM-OWJWWREXSA-N 442.918 4.480 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3ccc(Br)cc3)CC2)cc1F 1566346720 JMTPLFJQFRNIJM-UHFFFAOYSA-N 439.350 4.038 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2OCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1586619223 FPVKCRXYOREHPU-VXKWHMMOSA-N 439.556 4.096 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC[C@H](CO)O1)C(C)C 1615201536 JFYWOVKUJCGXBC-FCHUYYIVSA-N 437.588 4.127 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)[C@H]3CN(Cc4ccccc4)CCO3)c2C)cc1 1618337396 ZBVJZATZJCZZQB-RXFWQSSRSA-N 447.579 4.122 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)c(Cl)cc3N)cc2F)C[C@@H](C)O1 1626158013 HUSWLOHDOMTOBP-TXEJJXNPSA-N 426.319 4.258 10 10 IICE COc1ccc(-c2cncc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)c(C)c1 1628854588 QJOXMQBQRNHDLA-UHFFFAOYSA-N 431.536 4.174 10 10 IICE CC[C@@]1(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)OCCc2ccccc21 1629212338 UJRHLGPYWSMVEG-MHZLTWQESA-N 430.548 4.444 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(CCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1635017365 OTISUSRAQJUKSU-JOCHJYFZSA-N 432.542 4.176 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cccc3c2OCCN(C(=O)OC(C)(C)C)C3)c1 1636061341 NEVUETVCCUYTCB-OAHLLOKOSA-N 442.512 4.021 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 1636262923 JWDSKYVLPADUIJ-KNQAVFIVSA-N 446.599 4.366 10 10 IICE Cc1cc(CNC(=O)N2CCC(CC(=O)NC3CCCC3)CC2)c(C)n1-c1ccccc1 1637581882 OJWVXUIQZHZGSR-UHFFFAOYSA-N 436.600 4.465 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@H](CNC(=O)N(Cc3ccccc3O)C3CCCCC3)[C@H]2C1 1638218433 QDPCEVQPTZNQIN-MZADTFQBSA-N 443.588 4.349 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(F)c(N2CCCNC2=O)c1 1641997851 ZALZFSKLUAVUCN-UHFFFAOYSA-N 434.471 4.218 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(N4CCCOC4=O)CC3)cc2Cl)C1 1680561248 AHYYUETZVOJSRS-KRWDZBQOSA-N 448.995 4.093 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@H]3CC(=O)N(Cc4ccccc4)C3)c2C)c1 1681102272 RKVTZISREWJVCI-HSZRJFAPSA-N 444.579 4.250 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(Cc4nc(C)c(C)o4)CC3)c2C)c1 1683304224 UNAMLWPRYRKYDL-UHFFFAOYSA-N 435.572 4.035 10 10 IICE CC(C)Cc1nnc(N(C)CCn2cccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1692093516 KSVGYTNOKWIUAT-UHFFFAOYSA-N 435.620 4.094 10 10 IICE COCCC1(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCCC1 1697943251 MBYRGWZMEPIDFH-HXUWFJFHSA-N 428.577 4.111 10 10 IICE CC(C)[C@@H]1CCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C1 1706342823 UGNNOFQLUCKYRI-GOSISDBHSA-N 428.631 4.385 10 10 IICE CCc1nnc(N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)n1CCCSc1nccs1 1709098872 AGYVIJJNYNJGEL-WBMJQRKESA-N 432.446 4.500 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCC[C@H](COC)C2)cc1 1710027813 LQERNDVDQZUXPL-QFIPXVFZSA-N 448.615 4.021 10 10 IICE CSC[C@@H]1CCCN1c1nnc(-c2cccn2C)n1CCCSc1nccs1 1712787361 NBMASUIMHOFOAX-HNNXBMFYSA-N 434.660 4.254 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@@H]4CCCCO4)n3CCC(C)(F)F)CC2)cc1 1730181084 ZSFXFBFKOLLKHL-FQEVSTJZSA-N 449.546 4.290 10 10 IICE CO[C@H](Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)C 1748440426 ZCHOCQNGYOREOL-JOCHJYFZSA-N 443.636 4.011 10 10 IICE CCCN(CC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1764326878 REINQQNBZKCTQR-UHFFFAOYSA-N 429.584 4.226 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1765070599 BHSOZZHYRMXAMS-JTSKRJEESA-N 435.620 4.187 10 10 IICE Cc1cc(C)c2c(c1)c(=O)c(C(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)cn2C 1866220100 WLHCOIRXABWGIR-UHFFFAOYSA-N 436.467 4.183 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)[C@@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1999535870 BUNXCSNFVSAASL-DHIUTWEWSA-N 426.605 4.038 10 10 IICE COc1ccc(Br)c(CN[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)c1O 2220461994 FIPRAUUJSNELQR-OAQYLSRUSA-N 449.345 4.054 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](C2CC(NCc3cc(Br)ccc3O)C2)C1 2265436245 JUYVBBGGHQSIRC-TUBUQKNSSA-N 425.367 4.280 10 10 IICE CCc1ccccc1N1C(=O)C(=Cc2ccc(OC)c(OC)c2C(=O)O)SC1=S 2314929990 VVZQXGCGMGOPTE-UHFFFAOYSA-N 429.519 4.370 10 10 IICE O=C(O)c1cccc(Nc2cc(N3CCOCC3)c3noc4c3c2C(=O)c2ccccc2-4)c1 2457273 NPAIAMGUJRJSED-UHFFFAOYSA-N 441.443 4.318 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550807 WKGVFLPSQQEGBS-LQWHRVPQSA-N 427.526 4.498 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CCC(=O)NCCc3ccccc3)C2=O)cc1 33417674 GMWMMJPQFABMAD-CAPFRKAQSA-N 440.590 4.036 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccccc3F)=NC2=O)ccc1OCCC(=O)O 210469780 UFNUUFZYIGNXPH-PDGQHHTCSA-N 430.457 4.160 10 10 IICE Cc1nc([C@@H]2CCCCCN2C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)no1 436035321 CRDARXGFKWKRPJ-QHCPKHFHSA-N 435.572 4.243 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)n2)s1 727246051 IAQXZPRYICFEQD-UHFFFAOYSA-N 428.944 4.405 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N[C@H](c3ccccc3)c3ccncc3)cc2F)C[C@@H](C)O1 728596162 AULHVIDEYDGJHF-HHJKRLRDSA-N 448.542 4.423 10 10 IICE C/C(=C/C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccccc1C(F)(F)F 741915284 SKUNIORCWDXZSV-ZUTYSQTGSA-N 445.485 4.127 10 10 IICE O=C1[C@H]2C[C@H](C3CCCCC3)CN2C(=O)N1C1CCN(c2ccc(OC(F)F)cc2)CC1 761158682 KZGJSALXHKMQKP-LAUBAEHRSA-N 447.526 4.490 10 10 IICE COc1cc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc(Cl)c1OC 768669935 JQVCXTPWIHXRBL-UHFFFAOYSA-N 429.992 4.179 10 10 IICE C[C@H](N[C@H]1CCN([C@@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cc(F)cc(F)c1O 788982829 INQSBZZAEJLWIN-PNHOKKKMSA-N 446.494 4.005 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CN(C)C(=O)N3)cs1 799187257 OYVZLKDHMMGSBS-UHFFFAOYSA-N 432.502 4.036 10 10 IICE COc1ccc(OC)c([C@@H]2CCCN2C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 920869799 ALULNHDSLGXQEU-MBSDFSHPSA-N 439.556 4.148 10 10 IICE Cc1ccccc1N1C(=O)/C(=C\c2cc(C)n(-c3cccc(F)c3)c2C)C(=O)NC1=S 1084285252 RHZWWKJHSNKJNN-NDENLUEZSA-N 433.508 4.373 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1ccccc1I 1124549669 OHPBYGDLURWNDQ-UHFFFAOYSA-N 434.321 4.093 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 1136140152 JTLWJBVYQGTMKU-OAQYLSRUSA-N 441.409 4.441 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cc4ccccc4)ccc3O)cc2F)CC1 1136687620 YAAJMMWMKRLUOP-UHFFFAOYSA-N 447.554 4.194 10 10 IICE CCOC(=O)[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1cccc(C)c1C 1138577617 JCQVWZCSUXDYKG-AREMUKBSSA-N 446.547 4.487 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 1162206115 PIMLLCXWBSMZRE-HOTGVXAUSA-N 430.524 4.142 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(C)c3C)C2)sc2c1CCCCC2 1264552678 GWUFRRWYVQFBBY-MRXNPFEDSA-N 440.565 4.412 10 10 IICE COc1cc(Br)c(OC)c(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c1 1276285057 ZFYCTNGDWZDRGS-AWEZNQCLSA-N 435.362 4.202 10 10 IICE Cc1cccc(CS(=O)(=O)CCC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1 1287660645 JVIVUHLRZOQJIL-UHFFFAOYSA-N 438.593 4.332 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3ccccc3Cl)CC2)cc1 1290578341 RJRFMQNGGJALTA-UHFFFAOYSA-N 435.955 4.451 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1 1291658961 PVMPLSCHXZQSLA-UHFFFAOYSA-N 444.579 4.412 10 10 IICE Cc1cc(C(=O)CSC[C@@H]2CC[C@H]3C[C@@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1307377242 OBELHTCHJDQKDF-SQNIBIBYSA-N 432.611 4.094 10 10 IICE CSc1ccc([C@H](CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)N(C)C)cc1 1312757499 ZLVZPEMKPHBXNC-UNMCSNQZSA-N 443.613 4.108 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC(N4CCCCC4)CC3)nnc2C(C)(C)C)cc1F 1314659282 UWDKJJGTNMYCSC-UHFFFAOYSA-N 442.627 4.284 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccc(C)cc3)C2)sc2c1CCCC2 1353914969 XBUOXPQUYMWSFN-KRWDZBQOSA-N 440.565 4.099 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)cc1 1435635808 DJMNCJYTQUTPFB-HXUWFJFHSA-N 428.941 4.348 10 10 IICE CC(C)(C)OC(=O)N[C@](C)(C(=O)NCc1cccc(Cl)c1O)c1cccc([N+](=O)[O-])c1 1457037958 TYFISGXJHARZOQ-NRFANRHFSA-N 449.891 4.010 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)c(C)n1-c1ccc(F)cc1 1458930038 BPUZKNSXEJXYKR-XMMPIXPASA-N 437.446 4.022 10 10 IICE CC(C)CN(Cc1ccccn1)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1462933326 GMACOJOATMEXQE-UHFFFAOYSA-N 443.459 4.064 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCO[C@@](C)(C3CC3)C2)sc(C)c1-c1ccccc1 1473637629 JJBFGBMBJQWUHG-XMMPIXPASA-N 442.581 4.340 10 10 IICE CC[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1514103345 IJBZSASUBBCQDY-HXUWFJFHSA-N 439.648 4.360 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](OCC1CCCC1)c1ccccc1 1524855332 INEDQNGETGSBTJ-XMMPIXPASA-N 444.522 4.366 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@H](C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 1526247582 ZABMZAAEFTUTBL-PCCBWWKXSA-N 449.595 4.204 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(CCN(C)C)Cc3cccc(OC)c3)ccc21 1528916329 KMOCRNBRESSXAM-UHFFFAOYSA-N 437.584 4.117 10 10 IICE CCOc1ccc(N2C[C@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1530888850 DVDXVAPOZQONHX-JOCHJYFZSA-N 445.563 4.205 10 10 IICE C[C@H](CC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)n1cc(Br)cn1 1533209490 GATZFOSNJQFLGF-MRXNPFEDSA-N 445.361 4.485 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Oc2cc(OC)c(OC)c(OC)c2)CCCC1 1536989281 HSQMDBMKFSBOFS-UHFFFAOYSA-N 425.481 4.160 10 10 IICE CC[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)[C@@H](O)c1c(F)cccc1F 1545596699 XUUXOUSRKMMVGQ-RCZVLFRGSA-N 440.490 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCS[C@H](C)C2)cc1 1547448570 OCRJMDKCMVGYDI-LJQANCHMSA-N 436.629 4.100 10 10 IICE CCN1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C[C@H]1C 1547709663 ZPKFTUHAUZNLBK-OAQYLSRUSA-N 438.664 4.391 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCc3cccs3)CC2)cc1F 1554959217 LVQWCXZGIIXLHB-UHFFFAOYSA-N 443.592 4.354 10 10 IICE COC(=O)[C@H](C)Cc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1556129941 VKVLPZOMGBWLLS-QGZVFWFLSA-N 432.520 4.439 10 10 IICE C[C@H](NC(=O)N1CCCC[C@@H]1c1ncc(Br)cn1)c1ccc(N(C)C)cc1 1564596671 FDAMKCIUXLZSRZ-KBXCAEBGSA-N 432.366 4.303 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](OCC3CCCC3)c3ccccc3)CC2)cc1F 1566347839 XHOMIOWRZNEJFK-DEOSSOPVSA-N 426.532 4.431 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCOC(C)(C)C 1613167870 HYAQCAGXFFUJRK-LJQANCHMSA-N 429.609 4.080 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cccc([N+](=O)[O-])c1 1618368409 GDTCFNKMZBTPOV-UHFFFAOYSA-N 438.241 4.319 10 10 IICE Cc1oc(Br)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634998 NSMQOJUIBQIBDJ-CQSZACIVSA-N 427.726 4.104 10 10 IICE Cc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)nc2ccccc12 1631425543 INIVTZHAKISAQP-QGZVFWFLSA-N 425.916 4.002 10 10 IICE Cc1cc(C(=O)N[C@@H](CCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1631657747 UHUHWRLYDUXIQO-IBGZPJMESA-N 428.330 4.105 10 10 IICE Cc1cc(CC(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1632965123 UEOVWADZNYRJDV-RTBURBONSA-N 425.573 4.493 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H](C)N1CCc2ccccc21 1634385087 RMORAMYTVKXSFQ-IBGZPJMESA-N 437.584 4.216 10 10 IICE Cc1cc(C(=O)Nc2cnc(CC(C)C)nc2)c(C)n1-c1ccc(Br)cn1 1634545903 AQZZSKMJTRNORR-UHFFFAOYSA-N 428.334 4.492 10 10 IICE Cc1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c(O[C@@H]2CCOC2)c1 1636156428 UNIGJPYXMUWXHW-JOCHJYFZSA-N 432.520 4.313 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1639684271 WNHAIALPMPZYHW-NRFANRHFSA-N 445.563 4.480 10 10 IICE CC(C)COc1cn(-c2ccccc2)nc1C(=O)NCc1cccc(Br)c1O 1640083768 GCEAMGZCDUZMOC-UHFFFAOYSA-N 444.329 4.305 10 10 IICE CC[C@@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1640088556 SQZCOCNCCDHTRR-DOMZBBRYSA-N 429.355 4.100 10 10 IICE Cc1cnn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1C(=O)NCc1cccc(Cl)c1O 1648609228 UUYCZOCPSDEIAW-MRXNPFEDSA-N 448.951 4.053 10 10 IICE Cc1ccc(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1652848058 YTQHDCBXJCWXHV-CALCHBBNSA-N 433.955 4.154 10 10 IICE Cc1cc(CCNC(=O)NCc2cccnc2OCC(F)F)c(C)n1-c1ccccc1 1671305634 RGQCQOLNNFASQO-UHFFFAOYSA-N 428.483 4.175 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 1673744241 KPNYRRMKNQQQQP-LJQANCHMSA-N 429.008 4.173 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCN3CC(F)F)cc2Cl)C1 1682024376 RIWKYWTYJGVJDH-NVXWUHKLSA-N 428.955 4.105 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccccc3Br)C2)cc1 1682188089 GLGHCNUWZQDULW-INIZCTEOSA-N 432.362 4.126 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC[C@H](O)c3ccc(Cl)c(Cl)c3)C2)cc1 1683944844 LJDVXOWCFWZJMN-QRWLVFNGSA-N 438.355 4.004 10 10 IICE Cc1cc(CN(C)c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)no1 1692992660 FBEHQTFQNNGCDN-UHFFFAOYSA-N 426.540 4.197 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@@H](C)[C@@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1708566219 QVLJUMZXOYZNJA-BZSNNMDCSA-N 447.624 4.146 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cc(COC(C)(C)C)on1 1752616310 XVUQZZAOYXOGIA-INIZCTEOSA-N 427.549 4.485 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1763242616 QJMGWISCEWCZSX-DENIHFKCSA-N 425.621 4.376 10 10 IICE CN1CCCc2cc(Cn3c(Cc4ccsc4)nnc3N(C)CCC(F)F)ccc21 1769068606 FLOWUIHCEUNFBP-UHFFFAOYSA-N 431.556 4.453 10 10 IICE Cc1nc(-c2ccc(S(=O)(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cc2)co1 1892066323 DCDRUFUAWCFYCG-UHFFFAOYSA-N 442.478 4.483 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NCc3cc(Cl)cc(Br)c3O)C[C@H]21 2037301453 ZSMVQOXCPBSBDN-VHDGCEQUSA-N 431.758 4.296 10 10 IICE CCCOc1cc(N(Cc2ccccc2)CC2(O)CN(C(=O)OC(C)(C)C)C2)ccc1N 2044713186 GJQMOKOTWYDCFH-UHFFFAOYSA-N 441.572 4.046 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cccc(OC(F)(F)F)c1 2313683110 RWRRXNDMTCDPTC-UHFFFAOYSA-N 433.386 4.237 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cc(Cl)ccc2O)SC1=S)NCc1ccccc1 2314831426 KVCMXHJCTXTBSN-UHFFFAOYSA-N 446.981 4.343 10 10 IICE Cc1ccc(CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C23CC3)c(O)c1Br 2352949924 KYMUFAWZYVIZLI-HNNXBMFYSA-N 425.367 4.342 10 10 IICE Cc1ccc(CNC(=O)C2(NC(=O)OC(C)(C)C)CC(C)(C)C2)c(O)c1Br 2381144241 XVIUXZKGEVXHTN-UHFFFAOYSA-N 441.366 4.163 10 10 IICE COc1ccc([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)c1O 44546885 YXPIMPOYNRDLDB-FQEVSTJZSA-N 449.459 4.161 10 10 IICE COc1ccc(N2CCCN(Cc3cc(=O)oc4cc(Br)ccc34)CC2)cc1 97494621 SRQOJTSVWVUWPR-UHFFFAOYSA-N 443.341 4.276 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(F)c(N3CCCS3(=O)=O)c2)cc1 97554898 YFFJRVHVJJORQV-UHFFFAOYSA-N 427.501 4.025 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3ccc(OCc4ccccn4)cc3)CC2)cc1 108431399 GANUYDJFYSPNGN-OVCLIPMQSA-N 443.547 4.421 10 10 IICE COCCNCc1ccc(N2CCC(OCc3ccccc3)CC2)cc1Br 384177410 WPRMPJIPLPHJLI-UHFFFAOYSA-N 433.390 4.371 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCO[C@@H](c3ccccc3)C2)C1 683443276 JGYOQJJZMMJFJR-AREMUKBSSA-N 431.580 4.398 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(-n3cccc3)c(F)c2)c1 729374189 XKJFHHFIQGLCLS-UHFFFAOYSA-N 442.494 4.361 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2cccc(COC3CCOCC3)c2)C2CC2)cc1 732476191 YNSSLOYILDQEAL-UHFFFAOYSA-N 437.584 4.322 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCC3CCN(CC(F)(F)F)CC3)ccc21 735889388 RULXAXUJYRFAHJ-UHFFFAOYSA-N 426.479 4.336 10 10 IICE Cc1cn(C2CCCCC2)nc1NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 752902269 JBYFHKPELZRNTO-UHFFFAOYSA-N 425.577 4.227 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc([C@H]2CCCOC2)c1 766358391 RMFKVSOMNNKWFP-FQEVSTJZSA-N 448.485 4.366 10 10 IICE Oc1cc2c(cc1CN(Cc1ccccc1)C[C@@H](O)c1cccc(OC(F)F)c1)OCO2 770689787 TXWUAWNKRNUZBF-OAQYLSRUSA-N 443.446 4.458 10 10 IICE Cc1cc(Cl)cc(CNCc2ccccc2CN2C(=O)NC3(CCCCC3)C2=O)c1O 776175804 SIPNYRJSOTZQQI-UHFFFAOYSA-N 441.959 4.399 10 10 IICE CN1[C@H]2CC[C@H]1CC([C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc(Cl)cc1)C2 802409034 PEFVXCHSGKLPMO-QYDWTZEFSA-N 426.944 4.495 10 10 IICE Cc1ccccc1[C@H](O)C1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 804989072 LKFKYRGRALSQET-NBGIEHNGSA-N 437.584 4.048 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3cccc(-n4ccnc4)n3)no2)C1 809418956 PMCXVRQUGRMPKZ-UHFFFAOYSA-N 439.523 4.087 10 10 IICE COc1cc(CNCc2cc(Br)ccc2O)cc(OC)c1OCC(F)F 809713568 TZTMINDWSNQTGK-UHFFFAOYSA-N 432.261 4.106 10 10 IICE CCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc1OC 1084503978 QTRWARGZZAOBSY-RGEXLXHISA-N 430.460 4.304 10 10 IICE COc1ccc(COCCCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1125155782 PAFLSTMRDBHCGO-UHFFFAOYSA-N 429.472 4.406 10 10 IICE COc1cccc([C@@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCCC2)c1 1135279713 MDUCICAWUVDJII-AREMUKBSSA-N 445.563 4.482 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1)N(C(=O)c1cc2cc(O)c(O)cc2s1)C1CC1 1144002976 DZTAGDMQVGFIFT-QGZVFWFLSA-N 425.506 4.092 10 10 IICE C[C@@H](NC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1)c1ccc(N(C)C)cc1 1154668486 HUFKOCHIJJRREF-MRXNPFEDSA-N 441.528 4.184 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3c([N+](=O)[O-])cnc3C)c2C)ccc1Br 1165569667 AUGMMWJHLCNJJA-UHFFFAOYSA-N 431.290 4.461 10 10 IICE Cc1cc(C(=O)Cn2c(-c3cccnc3)noc2=O)c(C)n1-c1cc(Cl)cc(Cl)c1 1165626313 GCIGNLZEHQRZIM-UHFFFAOYSA-N 443.290 4.496 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2c2ccc(Br)cc2)c(C)n1-c1ccccn1 1165658320 SGMCUXZNSKSUDG-FQEVSTJZSA-N 440.341 4.465 10 10 IICE Brc1cc(CNC2CCN(C[C@@H]3CCOC3)CC2)ccc1N1CCCCC1 1200621277 HHAXJXYIDKOBLE-IBGZPJMESA-N 436.438 4.030 10 10 IICE C[C@H](NC(=O)N1CCN(c2ccc(Br)cc2)CC1)c1ccc(N(C)C)cc1 1226648033 YLTNYWVHNBGBSB-INIZCTEOSA-N 431.378 4.108 10 10 IICE CC(C)N(Cc1ccco1)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1287946190 BNYDCISYUNPISM-LJQANCHMSA-N 441.551 4.434 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCOC1CCCCCC1 1293105568 ZOKQBJCQHZILRO-UHFFFAOYSA-N 445.583 4.054 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC=C(Br)C2)cc1F 1314662123 YRRJREHQDLENBV-UHFFFAOYSA-N 445.340 4.016 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCC3(OC)CCC3)CC2)cc1F 1315512060 ICIFQCMGXLYPKQ-UHFFFAOYSA-N 445.583 4.009 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](O)C1 1316378487 VLWJQQNPYRUXSB-NRJQMVOHSA-N 439.629 4.311 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1 1353910424 JDMJZABGZQTRAP-NRFANRHFSA-N 444.000 4.114 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nc(C)cs1 1360840084 HCQCTTFBEPKMQX-XNTDXEJSSA-N 435.571 4.235 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@H](C)C3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1361052044 KOJYHKVTWSPLTQ-RTBURBONSA-N 438.645 4.244 10 10 IICE COc1cc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)ccc1C 1441678473 HMEXIXNASKSHRA-UHFFFAOYSA-N 445.563 4.318 10 10 IICE CC(C)(COc1ccc(C(F)(F)F)cn1)NC(=O)c1cc2cc(O)c(O)cc2s1 1446510368 SKARNYISAMFCEM-UHFFFAOYSA-N 426.416 4.314 10 10 IICE COc1cc(N2CCC([C@H]3N(C(=O)OC(C)(C)C)CC3(C)C)CC2)c([N+](=O)[O-])cc1OC 1458378596 XUJHRFZNXGVJIW-HXUWFJFHSA-N 449.548 4.474 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2nccn2-c2ccc(C)c(C)c2)cc1 1469804681 HICGOFFRNFXFPT-UHFFFAOYSA-N 438.597 4.185 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 1499765950 NFRYFZGSSZXRNJ-VQIMIIECSA-N 443.592 4.188 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1509039480 SHKQRMAYBMCTML-NRFANRHFSA-N 425.621 4.333 10 10 IICE C[C@H]1CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C[C@H](C)S1 1512486749 NLSDRDPYZRUWPU-HOTGVXAUSA-N 446.671 4.233 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1513129192 ZQONUFSHISCGRT-SFHVURJKSA-N 446.603 4.402 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C/c1cccnc1C)CCC2 1520514360 QXMXVODNAOFDAJ-ZHACJKMWSA-N 432.476 4.341 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1scc(Br)c1Br 1523542068 MBBGCWNBQGSXSI-UHFFFAOYSA-N 446.164 4.378 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCS(=O)(=O)c3ccc(F)cc3)c2C)c1 1534759906 OIIDFHCLYVGHTJ-UHFFFAOYSA-N 428.529 4.022 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(Br)c2F)cc1 1544524276 VMQHETLBLOLTSU-QGZVFWFLSA-N 435.337 4.476 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(CC)CCCC2)CCOC1 1547866038 JYNWFWRUBJGZQL-DEOSSOPVSA-N 428.577 4.243 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CC[C@@H](SCC)C2)n1Cc1ccc(N(C)C)c(F)c1 1548076070 QGNALXKSJGAWHT-QZTJIDSGSA-N 435.613 4.178 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C(C)C 1554478956 FEFUPQTTXRVZKW-QFIPXVFZSA-N 434.588 4.114 10 10 IICE CC[C@@](C)(NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2)C(N)=O 1585333958 OCLHQIBCUYHWHI-WVDYZEMSSA-N 442.563 4.171 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3sccc3S(=O)(=O)C(F)F)c2C)c1 1596482235 MLWBQYLNCOLINZ-UHFFFAOYSA-N 438.521 4.390 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COCCNC(=O)OC(C)(C)C 1597561107 OQRHELJIXJQKQH-GOSISDBHSA-N 428.529 4.023 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCOc1ccccc1Cl 1597567215 HIWARXRLWPEBHI-UHFFFAOYSA-N 426.296 4.060 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1597567328 JYJHLSOIVASIPD-UHFFFAOYSA-N 444.890 4.408 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)cc1)C1CCCCC1 1597949812 HIXQPTNKVPUBJW-GOSISDBHSA-N 441.522 4.403 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cc2n(n1)CCN(C(=O)OC(C)(C)C)C2 1598091217 TWRQVUJJAXQDHE-UHFFFAOYSA-N 441.557 4.355 10 10 IICE COc1ccc(N2CCN(c3ccc(Br)c(C(F)(F)F)n3)CC2)cc1F 1612118982 CDWWBWUCBNHKHW-UHFFFAOYSA-N 434.231 4.337 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(F)(F)F)cc2N2CCCC2)N(C)C)cc1 1616858907 UWUBMMPVGFNPCS-QFIPXVFZSA-N 448.533 4.404 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(CCN3CCOCC3)Cc3ccco3)c2C)c1 1638053286 JYBIFDXOSNHXNI-UHFFFAOYSA-N 435.568 4.279 10 10 IICE CC(C)(C)NS(=O)(=O)c1cc(C(=O)NCc2c(O)ccc3ccccc23)ccc1Cl 1639383980 DONJHRKRRKZNLL-UHFFFAOYSA-N 446.956 4.206 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(CC)(CO)CC2)sc(C)c1-c1ccccc1 1652932306 OYOJALLAULHJLR-UHFFFAOYSA-N 444.597 4.323 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc([N+](=O)[O-])cc1 1660099532 ZBLNXCLJEOHITC-LSDHHAIUSA-N 443.459 4.048 10 10 IICE COC(=O)c1cc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)n(C)c1C 1681827195 BMWOMJIQYJFJAA-HNNXBMFYSA-N 446.979 4.009 10 10 IICE Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683017964 APBDMJKGDOLXSD-NRFANRHFSA-N 433.474 4.296 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H]3c3ccc(Br)cc3)C2)cc1 1687022754 GUHMMCJBPPEDBK-XLIONFOSSA-N 430.346 4.193 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C)OC 1695112820 MBIMWRBKWWZBHV-UGKGYDQZSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(C)[C@H]2CCC[C@@H](C)C2)cc1 1695623448 DLLWSUSATDVJOQ-COPCDDAFSA-N 438.620 4.139 10 10 IICE COCC[C@H]1CCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1697957034 QRTQIESNHCIFGF-QGZVFWFLSA-N 444.630 4.150 10 10 IICE Cc1nnc(N2CCC(C(=O)Nc3ccccc3)CC2)n1CCCSc1nccs1 1726376437 CYHHFEIXGCTLSC-UHFFFAOYSA-N 442.614 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCCCCCC2)cc1 1728380082 XDIBKUATJWFVOR-UHFFFAOYSA-N 426.609 4.081 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1C[C@H]1CCCC1(C)C 1729418623 FVQKLNKEECPORO-GOSISDBHSA-N 434.544 4.094 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@H]1CCC[C@H](O)C1 1729419945 ABNKMNMGUZFSOU-UGGKCQTMSA-N 442.604 4.090 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)CCOC(C)(C)C)cc1F 1747572642 NWGBLIKXUWYWJE-FQEVSTJZSA-N 433.572 4.024 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cccnc1OCC(F)F 1752616443 YGUJGNIAIAZPGP-OAHLLOKOSA-N 431.487 4.221 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nnc(C)s1 1763499856 OHTGWTRQKJQHAF-INIZCTEOSA-N 425.606 4.236 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(Cl)s1 1764083788 KJFREMTYRVEXMV-UHFFFAOYSA-N 447.992 4.302 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)C[C@@H]2CCCCO2)cc1F 1766912270 SGDHQODQUJYEBM-IBGZPJMESA-N 443.592 4.189 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)[C@@H](F)C1 2029903615 KFAMUBKMHVINAJ-KBPBESRZSA-N 437.737 4.245 10 10 IICE Cc1c(C2CC2)nn(Cc2cc(Br)ccc2O)c1I 2079785884 FMTVNEUHASNVLJ-UHFFFAOYSA-N 433.087 4.190 10 10 IICE CN1CCc2cc([C@H](O)c3ccc(Br)cc3I)ccc21 2207267390 LJWLWVRFLIIGKY-INIZCTEOSA-N 444.110 4.128 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3cccc4nccnc34)SC2=S)cc1OC 2296599762 RFHXNPQOHBOOHB-UHFFFAOYSA-N 437.546 4.091 10 10 IICE O=C(O)COc1ccc(C=C2SC(=S)N(CCc3ccccc3)C2=O)cc1Cl 2297349736 KCYBHGZVYYZHJY-UHFFFAOYSA-N 433.938 4.247 10 10 IICE COc1cccc(C=C2SC(=S)N(CC(=O)O)C2=O)c1OCc1ccc(Cl)cc1 2297577590 BWRPUHWCCBPODB-UHFFFAOYSA-N 449.937 4.213 10 10 IICE Cc1ccc(CN[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)c(O)c1Br 2307569072 HCVHIVFMVLDKPT-NRFANRHFSA-N 433.346 4.354 10 10 IICE C[C@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S 2314836241 BUEMKPCHLLCCSF-LLVKDONJSA-N 446.937 4.267 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(CCc3ccccc3)C2=O)cc1)C(=O)O 2314928974 FNKUWUKCWJCDHD-SFHVURJKSA-N 427.547 4.373 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3)C2=O)ccc1O[C@@H](C)C(=O)O 2314933897 DZABSQPCLQLPSU-ZDUSSCGKSA-N 429.519 4.343 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CC[C@@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2380760981 BYGBITGEVJTZOK-UKRRQHHQSA-N 441.366 4.210 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2C[C@@H](N(C)C(=O)OC(C)(C)C)C2)c(O)c1Br 2380780759 CPTLEECXUORGOJ-GASCZTMLSA-N 441.366 4.067 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2381134183 YZTYDOBDGPASHV-FQEVSTJZSA-N 441.366 4.259 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)NC4(CCC(C)CC4)C3=O)c2C)cc1 8658402 UURAYAVIDSVXLI-UHFFFAOYSA-N 437.540 4.176 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)sc2c1CCCC2 21450186 IYEJTBUNMAGPOZ-ZDUSSCGKSA-N 446.956 4.449 10 10 IICE CSC1=NSC2=NC(=O)/C(=C/c3ccc(OC(=O)c4cccc(C)c4)cc3)C(=N)N12 104372283 JNCFNFKPXOHTLB-YHIMZFEVSA-N 436.518 4.154 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3cc(Br)ccc3O)C[C@H]2C1 401125645 NPKMFGUVOKOFEQ-QRTARXTBSA-N 425.367 4.280 10 10 IICE CO[C@@H](C)c1noc(CN(C)C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 747932703 GZXFVVUDYSASMC-AWEZNQCLSA-N 447.333 4.219 10 10 IICE Cc1cc(N2CCCC2)ccc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768850244 WGPWWRJTBGWOAF-UHFFFAOYSA-N 447.627 4.449 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 801549250 HLPFVTNYAJJENU-OAQYLSRUSA-N 426.532 4.141 10 10 IICE COc1ccc(N2CCCN(C[C@](C)(O)c3ccc(Br)cc3F)CC2)cc1 815021982 LAUZSRXZIPNYGC-NRFANRHFSA-N 437.353 4.017 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1ccccc1OCc1ccccc1 916650657 FWFIBPBLYJAUGC-UHFFFAOYSA-N 445.563 4.444 10 10 IICE CC(C)(C)OC(=O)CCCCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125196113 AISWMYIKCIPIBR-UHFFFAOYSA-N 444.494 4.060 10 10 IICE O=C(CCSc1ccc(Cl)cc1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661623 QIDWQNGYSILFES-UHFFFAOYSA-N 426.916 4.253 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)O2)C1 1133272680 KDKLOQWNQYLWSY-KKSFZXQISA-N 437.506 4.024 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)c1 1136187086 KFMQLIPNRMRHPO-UHFFFAOYSA-N 435.568 4.161 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccccc3CCC(C)C)CC2)cc1 1136447842 KUFTYHNAVWUUSA-PFONDFGASA-N 435.568 4.127 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@H](c2ccco2)C1 1136805021 QWGWJEYODVEBJT-BRFSQIRFSA-N 430.526 4.026 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@H](NC(=O)OC(C)(C)C)c1cccc(Br)c1 1137345320 CJCBPTZLPAOSPD-GOSISDBHSA-N 449.345 4.379 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1 1139975123 VGELIQPXTNMBHU-HNNXBMFYSA-N 444.112 4.271 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)c1 1143368122 JKJFFTQWBUQKKZ-UHFFFAOYSA-N 439.556 4.284 10 10 IICE COC(=O)/C=C/c1ccc(N(C)Cc2nc3ccc(C(F)(F)F)cc3[nH]2)c([N+](=O)[O-])c1 1163957374 AKWMUXOCWMSFJS-XBXARRHUSA-N 434.374 4.313 10 10 IICE COC(=O)c1ccc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)cc1 1165462472 AKVWPXVCBRMNFK-FQEVSTJZSA-N 436.533 4.491 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3ccco3)oc2=O)c(C)n1-c1ccc(OC(F)(F)F)cc1 1188480384 QARPONDKPAETGJ-UHFFFAOYSA-N 447.369 4.285 10 10 IICE CNC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cc1 1188621458 YILXTWGEGIRESY-UHFFFAOYSA-N 441.325 4.478 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](C)C[C@H]1CNC(=O)OC(C)(C)C 1230196288 XQEJMTIPXBYRLO-LZNRXBQRSA-N 446.636 4.327 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(OCc4ccccc4)c(OC)c3)C2)cc1 1278860701 ACSBVQJTGSEYKV-OAQYLSRUSA-N 432.520 4.292 10 10 IICE C[C@@H]1CCC[C@H](N(C)c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1291074262 MKJUGOSADVTGRF-HOJAQTOUSA-N 429.584 4.440 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O 1295594410 JUPRNRXSLDVRNR-ZWKOTPCHSA-N 428.488 4.167 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 1300396469 VHDKMUIEXURTMH-RTBURBONSA-N 427.957 4.034 10 10 IICE C[C@H](CN(C)C(=O)OC(C)(C)C)Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C 1303674731 PASXFMSYODQHNH-QGZVFWFLSA-N 445.608 4.421 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](O)CCO3)c(C)n1-c1ccccc1Br 1456152477 YMCIRVQSBYPFPO-KRWDZBQOSA-N 447.373 4.003 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)ccc1N(C)C 1459237607 MGUKWZRWTTXVHD-QHCPKHFHSA-N 428.504 4.105 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc(Nc4nccs4)cc3F)c2)CC1 1467305197 HZTCFDISSSNQKS-UHFFFAOYSA-N 425.533 4.420 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H]1CSc2ccccc2O1 1467632178 RXBBJXZCUQQSRC-IBGZPJMESA-N 442.581 4.318 10 10 IICE O=C(CCSc1nc2ccccc2s1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1468816254 BUZLMTHBZGRLOO-UHFFFAOYSA-N 449.548 4.210 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(c4ccc(F)cc4F)CCCCC3)cc2)CC1 1471192234 WMDOWFNLXGDQBG-UHFFFAOYSA-N 442.554 4.375 10 10 IICE COc1ccc2c(c1)nc(CNC(=O)NCCc1cc(C)n(-c3ccccc3)c1C)n2C 1478487680 OHCFXMXBTDLLHK-UHFFFAOYSA-N 431.540 4.031 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NCc1noc(-c2cccc(Br)c2)n1 1478898681 TWGIXWAYGXOATG-UHFFFAOYSA-N 445.317 4.327 10 10 IICE CC(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1526967597 IOWDGJQQXZNPGR-RXVVDRJESA-N 433.593 4.030 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(C)CCN(C)c1ccc(OC)cc1)O[C@H](C)C2 1531374385 AQAVGUHAHSTMPN-FRGLQRNOSA-N 438.568 4.116 10 10 IICE Cc1cc(CCNC(=O)CCN(C)C(=O)OCc2ccccc2)c(C)n1-c1ccccc1 1534542751 JRDIRKWTOGEYRN-UHFFFAOYSA-N 433.552 4.412 10 10 IICE CN1CCN(c2ccc(CNC(=O)C(Cc3ccccc3)Cc3ccccc3)cc2)CC1 1536934371 VHCYZEFAAHPUSC-UHFFFAOYSA-N 427.592 4.156 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)C1 1537815370 RQITYNVEYHXRBN-HRFSGMKKSA-N 432.612 4.215 10 10 IICE Cc1cccc(-c2cccc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)c2)c1 1538138281 NVUJJIIJLWWJBO-UHFFFAOYSA-N 427.548 4.294 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N(C)Cc1csc(Br)c1 1542224544 LDFDLYRSMWRUML-UHFFFAOYSA-N 434.407 4.470 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)Nc2ccccn2)nnc1N(C)C1CCCCC1 1542224901 VWJKDLUISVKRIV-UHFFFAOYSA-N 447.587 4.117 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3)CC2)c(C)n1-c1ccc(F)cc1 1542624490 FQTFSXJDBRMCSH-UHFFFAOYSA-N 439.918 4.485 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cccnc1OCc1ccccc1F 1544408300 CEKFOAPOMMZTHH-UHFFFAOYSA-N 437.540 4.283 10 10 IICE Cc1ccc(C(=O)N[C@H](COC(=N)O)Cc2ccccc2)cc1-n1c(C)cc(C=O)c1C 1557030829 PROVRWLLHXITJJ-QFIPXVFZSA-N 433.508 4.066 10 10 IICE COc1ncc(Br)cc1CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1557528565 FFXZZOQOVJPAAB-UHFFFAOYSA-N 442.313 4.003 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCCc2sccc2C1 1565644873 HNGCZDXXMLNIJI-PDGQHHTCSA-N 446.594 4.454 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C12CCCC2 1583728118 MPCCYZUZEZRNNM-GOSISDBHSA-N 432.542 4.365 10 10 IICE CC[C@H](C(=O)N(C)Cc1ccc(N(CC)CC)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1587460307 USXIWNVAYVYZQH-OAQYLSRUSA-N 440.979 4.449 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)n1[C@@H]1CCCOC1 1598290936 IFUGGXZUXRZJOD-RPWUZVMVSA-N 439.600 4.344 10 10 IICE CC(C)CN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1607306015 UNBJRMWDPNQYPL-UHFFFAOYSA-N 429.584 4.127 10 10 IICE COCCCN(Cc1c(O)ccc2c(C)c(C)c(=O)oc12)C[C@H]1CCCN2CCCC[C@H]12 1614472432 IIQYOXGMHYEWRT-NFBKMPQASA-N 442.600 4.218 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(COC)CC2)sc(C)c1-c1ccccc1 1615477997 WOAROQXEVLSBLP-UHFFFAOYSA-N 430.570 4.197 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(C)c(S(=O)(=O)NC3CC3)c2)c1 1618008294 BOHPSYBWAFTYEI-UHFFFAOYSA-N 437.565 4.404 10 10 IICE COc1ccccc1[C@H](C)N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)OC 1620597981 MGFQICJEJFRJTL-INIZCTEOSA-N 444.487 4.034 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCCCN1Cc1ccc(F)cc1 1624893162 UEWWHAZSUUGYSQ-HSZRJFAPSA-N 427.589 4.050 10 10 IICE CCO[C@@H]1C[C@](O)(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1626720589 VEGXLSVZEIUDGQ-KNQAVFIVSA-N 449.389 4.153 10 10 IICE CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NCc1ccc2cccnc2c1O 1627069805 SOSQJOSLGNYGLH-DEOSSOPVSA-N 441.531 4.093 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H](NC(=O)OC(C)(C)C)C3CCCCC3)C2)cc1 1627153950 CZPHVGCZGUPPOZ-XMSQKQJNSA-N 445.604 4.111 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)CC[C@H]1C1CC1 1629137153 XJOHWARXFLGDKX-HOTGVXAUSA-N 429.344 4.493 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1630273915 XQEDRVRTXLAAKR-CQSZACIVSA-N 433.335 4.247 10 10 IICE COC(=O)c1ccc(CCNC(=O)N(Cc2ccccc2O)C2CCCCC2)c(OC)c1 1635604897 YUHYPYCZVXGOLS-UHFFFAOYSA-N 440.540 4.274 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3ccncc3)C2)c(C)n1-c1ccc(Br)cn1 1637002991 XKHXDZXGTBYNQA-KRWDZBQOSA-N 425.330 4.276 10 10 IICE COC(=O)CC1(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCCCC1 1639145799 PNZGHKBDYHQRDD-UHFFFAOYSA-N 426.557 4.159 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N[C@@H](C)c2cc(OC)ccc2O)sc2c1CCCC2 1653961807 XRPZYLOZTOFTGI-UONOGXRCSA-N 446.569 4.196 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CC(O)(CC)CC)sc(C)c1-c1ccccc1 1654434726 XPRFPANVUFWDEK-UHFFFAOYSA-N 432.586 4.322 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(=Cc4ccc(F)c(F)c4)CC3)C2)cc1 1674326421 JCUFLMFAJZWWQE-IBGZPJMESA-N 427.495 4.441 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1676288488 MEBWIKTYQLZZJQ-VQTJNVASSA-N 432.609 4.368 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCCOc3cccc(Cl)c3)C2)cc1 1682188620 WJHSWSNBXYPRPX-GOSISDBHSA-N 431.964 4.285 10 10 IICE COc1ccc(Cl)cc1C(C)(C)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684606067 AQGKFGTXPBGBDJ-FQEVSTJZSA-N 432.996 4.252 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C(N)=O)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1707274275 TUDMSHJCRZOKJR-FQEVSTJZSA-N 434.588 4.100 10 10 IICE CC(C)Cc1nnc(N2C[C@H](O)CC3(CCCC3)C2)n1CCCSc1nccs1 1723288986 MZZCBQCUIZIEIO-QGZVFWFLSA-N 435.663 4.247 10 10 IICE CC[C@]1(C)CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1727323515 ZBMZQZOFXNVTEA-HSZRJFAPSA-N 429.634 4.008 10 10 IICE CCC[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1727989407 AUVPHDGJWXNXRC-GOTSBHOMSA-N 441.620 4.420 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)C2CCCCC2)n1Cc1ccc2c(c1)CCCN2C 1730815907 NIVRQCMXXVFYEY-IBGZPJMESA-N 441.620 4.202 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1750280998 FHINYYXWAPDCII-RBBKRZOGSA-N 443.661 4.317 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CC[C@H](C(C)(C)C)C2)cc1 1766608653 RFJRYDCBTCKDHS-FQEVSTJZSA-N 440.636 4.183 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)cc1 1766809128 QFHSYHWJSWFSNS-IBGZPJMESA-N 431.650 4.254 10 10 IICE COCC1CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC1 1769451361 MRWVGVOQLXLZBV-UHFFFAOYSA-N 433.603 4.348 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC[C@@H]1C 1770652607 NGHFUVWKRMFHAM-JTSKRJEESA-N 439.629 4.214 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)CCc1ccccc1 1857998033 RGHMVOLTMSWLJG-UHFFFAOYSA-N 443.500 4.294 10 10 IICE COc1cccc(-n2nc(C(=O)Nc3ccc(Oc4ccc(N)cc4)cc3)c(=O)cc2C)c1 1866287227 QMORZWRCLSFSCP-UHFFFAOYSA-N 442.475 4.176 10 10 IICE CN(C[C@H](O)COCc1ccccc1)c1ccc(CNC2CCC2)cc1Br 2240053669 NKAFFADKWIIMIU-FQEVSTJZSA-N 433.390 4.105 10 10 IICE CCOC(=O)COc1c(C=C2SC(=S)N(c3cccc(C)c3)C2=O)cccc1OC 2297356873 OAMMMIUNTPWBCJ-UHFFFAOYSA-N 443.546 4.351 10 10 IICE COc1cc(C=C2SC(=S)N(CCCC(=O)Nc3ccc(C)cc3)C2=O)ccc1O 2314831283 HMPLPWOVCWTNGS-UHFFFAOYSA-N 442.562 4.329 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)C(=Cc3c(C)nc4ccccn34)SC2=S)c1 2318756645 QIXCGAQUWWKZER-UHFFFAOYSA-N 443.937 4.489 10 10 IICE CCC(CC)(NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352943547 VKGWTYLESFRDAZ-UHFFFAOYSA-N 429.355 4.163 10 10 IICE CCN1CCN(Cn2cc(/C=C3\C(=O)N(c4ccccc4)N=C3C)c3ccccc32)CC1 33584981 VRZILHFLMAUKTG-ULJHMMPZSA-N 427.552 4.042 10 10 IICE O=C1/C(=C/c2ccc3c(c2)OCO3)C(=O)N(c2ccccc2)C(=S)N1Cc1ccccc1 59391088 XAZUEISFNBBVOZ-MOSHPQCFSA-N 442.496 4.159 10 10 IICE O=C(O)CCCCCNC(=O)CCCCCN1C(=O)/C(=C\c2ccccc2)SC1=S 210752383 URILOQPCDSDMBL-FBMGVBCBSA-N 448.610 4.209 10 10 IICE CN(C)c1cccc(NC(=O)c2cc(I)ccc2Br)c1 234266200 FQWLZIZKDPFDMH-UHFFFAOYSA-N 445.098 4.372 10 10 IICE O=C(O)/C=C\c1ccc(N2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1Br 687211322 CDAQYUKLNGAJNF-QCJSNAMPSA-N 427.342 4.400 10 10 IICE COc1ccc([C@H]2CCCCCN2C(=O)CN(C)c2cc(OC)c(OC)c(OC)c2)cc1 741794881 DEVOITSBMAWEHC-OAQYLSRUSA-N 442.556 4.301 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(CN2CCCC2)c1 742800047 FIDAWAMGHZNRJG-HXUWFJFHSA-N 429.511 4.283 10 10 IICE COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 746946511 DNPMTRKOGAKPRG-HSZRJFAPSA-N 441.547 4.014 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n1 771272410 HJSMVSIWCVZHPA-UHFFFAOYSA-N 429.571 4.076 10 10 IICE Cc1c(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cnn1C1CCCC1 772859709 GGEWICDSAOUDLA-UHFFFAOYSA-N 433.556 4.012 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3CCCCN3C(=O)c3cc(C)cc(C)c3)CC2)cc1 773314606 PBMNDIJRRBFVSQ-RUZDIDTESA-N 449.595 4.092 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(F)c(Br)cc1Cl 793161614 GDTUIHOYZWIWGF-UHFFFAOYSA-N 427.701 4.008 10 10 IICE CCC1(CC)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CC[S@]1=O 800727774 OILNEGFPZLMJNU-SSEXGKCCSA-N 425.602 4.017 10 10 IICE Cc1cccc(COc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c1 1084105272 AALOYXQHSSAESY-STZFKDTASA-N 430.435 4.380 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@]3(C(=O)OC(C)(C)C)CC=CCC3)cc2F)C[C@@H](C)O1 1125188852 VVLBKDYTOOGWQJ-ATLLOTDBSA-N 446.563 4.124 10 10 IICE COc1ccc(CN2CC[C@@H]2C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1 1141518797 RRXWNQMRWWKWMJ-RUZDIDTESA-N 433.552 4.158 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccc(CN4CCN(C)CC4)cc3)c2C)c1 1141656697 KOSHRDAGTXBELP-UHFFFAOYSA-N 430.596 4.080 10 10 IICE C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1nc(-c2ccc(Br)cc2)no1 1150695540 NKGUWEMXKWWPHX-JTQLQIEISA-N 443.261 4.153 10 10 IICE CCOc1ccc(N2C(=O)c3ccc(C(=O)N[C@@H](C)c4ccccc4O)cc3C2=O)cc1 1171730566 OQDLCOUJHRLZMU-HNNXBMFYSA-N 430.460 4.083 10 10 IICE CCOc1ccc(N(CC(=O)NC2CCN(Cc3ccccc3C)CC2)CC2CC2)cc1 1196952256 DUYZHYSAHCNOSE-UHFFFAOYSA-N 435.612 4.391 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(F)c3ccncc23)c1 1265026342 CEUDKLSDZWKGIL-UHFFFAOYSA-N 428.467 4.118 10 10 IICE Cc1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)nn1-c1ccccc1Br 1265457850 YBMVCFPQQRVUFY-UHFFFAOYSA-N 441.329 4.048 10 10 IICE CC[C@@H]1CCCCN1CCn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccccc1O 1293374124 TXWZTSYCZDBXDX-OAQYLSRUSA-N 434.588 4.255 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1296438678 KSIAZMOEQGSCCV-IBGZPJMESA-N 437.588 4.393 10 10 IICE C[C@H](CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1313356971 VZDWUUQFRQUDTC-IIBYNOLFSA-N 447.421 4.221 10 10 IICE C[C@@H](NC(=O)C(F)(F)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 1357126338 AAXFVMSTOPCWFY-CQSZACIVSA-N 439.300 4.255 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nn(-c2cc(F)cc(F)c2)c2c1CCC2 1436847945 LRVPDHXUZWDNPV-MRXNPFEDSA-N 438.522 4.375 10 10 IICE COc1ccc(C(=O)c2ccccc2C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 1441632655 RVIMLRJOTGZXOW-UHFFFAOYSA-N 446.572 4.409 10 10 IICE CC[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(F)cc1F 1459842328 HNHMBRYZNYZXDN-QFIPXVFZSA-N 434.442 4.420 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1463784994 KZISPOFPRXMPHE-SFHVURJKSA-N 443.950 4.481 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(-c3cnc4nc(O)n(C)c4c3)c2)cc1F 1465008394 YEDSXBHYWUSDNQ-UHFFFAOYSA-N 447.514 4.256 10 10 IICE Cc1cc(C(=O)Nc2ccccc2C[S@](C)=O)c(C)n1-c1ccc(Br)cn1 1466746770 IOWCGXXXDFBHDT-MHZLTWQESA-N 446.370 4.382 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccc(CNC(=O)NCc3cc(Cl)ccc3O)cc2C1 1469799706 XBHWBRQLJINLPG-UHFFFAOYSA-N 431.920 4.296 10 10 IICE COCCO[C@H](C)c1nnc(N(C)C2CCC(C)CC2)n1Cc1ccc(N(C)C)cc1C 1504943960 MGULSKXBCSJDCH-AATLZSDMSA-N 443.636 4.440 10 10 IICE Cc1ccccc1Cc1nnc(N(C)C[C@H]2CCOC2)n1CCCSc1nccs1 1511291002 DRSHTXRHXZSXAC-GOSISDBHSA-N 443.642 4.289 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C\c1cccnc1C)CCC2 1520514358 QXMXVODNAOFDAJ-KHPPLWFESA-N 432.476 4.341 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Cl)cc(C(F)(F)F)c1 1528261448 LOBNAOZGECMHLO-UHFFFAOYSA-N 434.792 4.404 10 10 IICE CCO[C@@H]1C[C@@](CO)(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1556221453 GLBCVLKFBBTPCA-KNQAVFIVSA-N 449.389 4.153 10 10 IICE COCCN(C)CCCC1CCN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 1566514302 IIBGVZNWEUHOIR-UHFFFAOYSA-N 429.580 4.444 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(NC(=O)[C@H]2CCCO2)cc1 1594939000 RUOCCMKBPMZDEZ-HSZRJFAPSA-N 431.492 4.276 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC[C@@H]2c2cnn(C)c2)cc1 1615380444 AHQIWVGLIZYJFY-HSZRJFAPSA-N 435.620 4.446 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@H]2CC2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1616673991 CDDNPNOJCUOIMH-HSZRJFAPSA-N 430.976 4.334 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nn(-c2ccc(Cl)cc2F)c2c1CCC2 1623574622 USMSHHRILBJITE-UHFFFAOYSA-N 434.895 4.275 10 10 IICE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1 1625905204 MDPNAJFXANTLBD-RUZDIDTESA-N 449.595 4.385 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Br)cc(C(=O)OC)c2)cc1 1628858035 XPGAFWWEBGYQBC-UHFFFAOYSA-N 433.346 4.354 10 10 IICE Cc1cc(CC(=O)N[C@@H]([C@@H]2CCCO2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1631196088 TWXYVAXCIWJQQN-GMAHTHKFSA-N 430.976 4.116 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)[C@H]1CCC[C@@H](OC)C1 1631887780 GQITUHPCFNNHBN-XKCSPQBFSA-N 426.557 4.188 10 10 IICE C[C@H]1CO[C@@H](C(F)(F)F)CN1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1634719744 FKBVBJRTRDPBOM-QWQRMKEZSA-N 433.902 4.438 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)c2ccccc2)c(C)n1-c1cccc(Br)c1 1636138095 KSQAJMIAJGNDCV-SFHVURJKSA-N 427.342 4.363 10 10 IICE Cc1cc(O)nc(C(C)(C)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 1640564134 MHPSDEZBDFTMQB-UHFFFAOYSA-N 443.345 4.326 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccc(I)cc2)cc1Cl 1644865768 HJNLWSMAYNHNJW-UHFFFAOYSA-N 430.673 4.028 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCc2c1cccc2C(F)(F)F 1683195963 VGHAVIOODIQUPY-UHFFFAOYSA-N 441.400 4.093 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H]2c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1 1694108835 SEXQCBNNPMHUPY-OXQOHEQNSA-N 425.556 4.120 10 10 IICE CCC[C@@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709489446 MKOHSBTUJRGPMY-LJQANCHMSA-N 425.621 4.427 10 10 IICE CCO[C@@]1(c2nnc(N(CC)CC)n2Cc2ccc(N3CCC(C)CC3)cc2)CCOC1 1710438025 AXUAHTRYMUESKU-VWLOTQADSA-N 441.620 4.061 10 10 IICE COC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)CCO1 1712282237 ZRHTVPKXHAPHBQ-QFIPXVFZSA-N 437.588 4.250 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2CC2)n1CC(C)(C)C(F)(F)F 1747720367 LEVAATKGILNLCL-UHFFFAOYSA-N 437.510 4.217 10 10 IICE C[C@@H]1SCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)[C@@H]1C 1752455991 KIPYNIXFNMIIQL-PMPSAXMXSA-N 439.676 4.489 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(N)=O)C1 1763323486 XVHYIUUNSOHEOR-AREMUKBSSA-N 448.615 4.491 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4cc5ccccc5oc4=O)cc3)CC2)cc1 1860300285 XDEJOXXKSRIATH-UHFFFAOYSA-N 440.499 4.431 10 10 IICE CC(C)(C)c1ccc(CNCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1860716284 COSDZWRNSMWCAW-UHFFFAOYSA-N 426.516 4.488 10 10 IICE COCCN1C(=O)C(Nc2ccccc2C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420197 JEGKMFGWUFBXTR-UHFFFAOYSA-N 429.520 4.241 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)c(C)n1-c1ccccc1F 2293370093 RVSQZGFCEIJKOK-UHFFFAOYSA-N 437.471 4.204 10 10 IICE Cc1ccc(CNC(=O)C(C)(C)[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352619892 KUHABIVISGRXJG-LBPRGKRZSA-N 429.355 4.019 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c(O)c1Br 2352670256 HVJYGLWSTYQGHD-HRCADAONSA-N 425.367 4.341 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c(C)n1-c1ccc(F)cc1 23156342 BTGLRVPWBBLACZ-XMMPIXPASA-N 439.506 4.176 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(C)cc3)C(=S)N=C2O)cc(Br)c1O 34138520 BAVSZYYABVGSQU-QPEQYQDCSA-N 447.310 4.143 10 10 IICE Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 57642414 WUGKFJZXDYABSP-UHFFFAOYSA-N 439.493 4.381 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccccc2CN2CCC[C@@H]2C(N)=O)c1C 110830659 FIJKAHGTROGJEQ-XMMPIXPASA-N 430.552 4.105 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2CNCc1ccc(Br)cc1O 704004802 MFKHPEKYNDBRHD-OAHLLOKOSA-N 425.367 4.282 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1nc(-c2c(F)cc(F)cc2F)c(C)s1 729115990 ZGLPTBDBBKVMBR-UHFFFAOYSA-N 436.868 4.032 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC2(CCCCC2)C1 743554474 FZTWOQOCLIWDEU-UHFFFAOYSA-N 425.495 4.408 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 743758477 FMHTZEAQTDTIGN-IBGZPJMESA-N 439.556 4.004 10 10 IICE C[C@@H](NC(=O)N[C@@H]1COc2c1ccc(Cl)c2Cl)c1ccc(N2CCOCC2)cc1 745779037 MGEWAAJNPXPTKI-FZKQIMNGSA-N 436.339 4.324 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](C)C[C@H]3c3ccco3)cc2F)CC1 745808028 JNEKJFPLUHHCRG-GCJKJVERSA-N 428.552 4.243 10 10 IICE CN(c1ccc(CNC(=O)N2CCOC[C@H]2C[C@H](O)c2ccco2)cc1)C1CCCCC1 756684838 NFRVYTVHIYLQMQ-PKTZIBPZSA-N 441.572 4.083 10 10 IICE CC(C)N(Cc1cccs1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769042034 MLAKPSOSRUMLPR-UHFFFAOYSA-N 426.630 4.400 10 10 IICE Cc1cc(Br)c(O)c(CN2CCCN(C(=O)CCc3ccccc3)CC2)c1 781903314 YIKQNMOWFWQEHC-UHFFFAOYSA-N 431.374 4.130 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C(=O)NCc1ccc(-c2csc(C)n2)s1 785567889 SFBVNLNXOCLDRV-UHFFFAOYSA-N 443.594 4.331 10 10 IICE CO[C@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)n1 799995569 OODLGMUAUVGJST-HUUCEWRRSA-N 435.956 4.008 10 10 IICE Cc1cc(C(=O)COC(=O)[C@@H]2CCNC(=O)CC2)c(C)n1-c1ccc(Cl)c(Cl)c1 815419625 ANBLPKZMLOOCID-AWEZNQCLSA-N 437.323 4.043 10 10 IICE CC[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccncc1 1126373563 FJTVEQBRGPPXRB-GFWHJHDHSA-N 429.542 4.080 10 10 IICE CCOC(=O)[C@H](C[C@H]1CCCO1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1133413103 RVTWIUCOSVZBJW-KNQAVFIVSA-N 438.528 4.399 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccccc3CCc3ccccc3)CC2)cc1 1136454189 OGMDBEKKPJHJDB-UHFFFAOYSA-N 443.591 4.032 10 10 IICE Cc1cc(C(=O)Nc2cc(Br)cn(C)c2=O)c(C)n1-c1ccc(Cl)cc1 1137189346 OFXAQHCTKSTLHF-UHFFFAOYSA-N 434.721 4.461 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3cc(F)ccc3F)CC2)cc1 1137243669 IHIOFMLFLQFDQT-UHFFFAOYSA-N 437.490 4.076 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)[C@H]1OCCc2sccc21 1139584616 HMPOBPCYIYTEJI-WAIKUNEKSA-N 444.597 4.387 10 10 IICE C[C@@H](CN1CCN(c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1162592004 RVVFYTLGJCWIGL-FQEVSTJZSA-N 444.535 4.448 10 10 IICE CCOc1ccc(NC(=O)c2ccc(NC(=O)CN(C)c3ccc(OC)cc3)cc2)cc1 1171746170 QBOOFBQKMVIWBF-UHFFFAOYSA-N 433.508 4.421 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)CC[C@@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1289360010 YPHWAIRGVOCXAE-MOPGFXCFSA-N 448.615 4.456 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H](Cc1ccncc1)NC(=O)OC(C)(C)C 1297006680 ZEBQPOFCNDZZRH-FQEVSTJZSA-N 427.545 4.052 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CC[C@H](C(C)(C)C)C2)cc1F 1298055423 DAPMGBMXNYGHOO-MOPGFXCFSA-N 429.584 4.298 10 10 IICE O=C(N[C@H]1CCCCC12CCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1298649271 NZSBFVRBZCHDKG-SFHVURJKSA-N 434.583 4.487 10 10 IICE CC(=O)Nc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1347854159 PCOZZJICRDCCLA-PDGQHHTCSA-N 443.525 4.014 10 10 IICE C[C@@H](Cc1ccsc1)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1357156278 BZEGHRZQIBDZKT-HNEYUBDGSA-N 434.583 4.226 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C(=O)c3cnn(-c4ccccc4)c3)cc2Cl)C1 1436046704 GAYIDIBECHYLSM-QGZVFWFLSA-N 436.943 4.261 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1 1440684449 NTPUVTSTWPXYLG-UHFFFAOYSA-N 433.512 4.102 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(-c2ccc(F)cc2)n(C)n1 1445647825 AYNXSMXYSCMFTR-UHFFFAOYSA-N 432.293 4.357 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H](C3CCCCC3)C3CCC3)CC2)cc(OC)c1OC 1470613863 YLVUKUSUYWPCMM-QHCPKHFHSA-N 445.604 4.293 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@H](O)c2cc(F)ccc2F)CC1 1478840794 HRMZTFNKQHDNJA-OSPHWJPCSA-N 445.554 4.425 10 10 IICE CCCCOCCn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1500619151 KELHZKQCXWNRLS-UHFFFAOYSA-N 448.365 4.194 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1CC(C)(C)N1CCCCC1 1503487177 ICYZMNHRIQETER-NRFANRHFSA-N 427.593 4.126 10 10 IICE Cc1ccc(-c2nnc(N3CCN(C(C)C)CC3)n2CCCSc2nccs2)o1 1510812874 DLGDHRJKRBEKEA-UHFFFAOYSA-N 432.619 4.016 10 10 IICE Cc1ccc(OCc2nnc(N(C)[C@H]3CCOC3)n2CCCSc2nccs2)cc1 1510962385 GTAHOWQNGNQDIR-KRWDZBQOSA-N 445.614 4.030 10 10 IICE Cc1nnc(N(C)Cc2csc(Br)c2)n1Cc1ccc2c(c1)CCCN2C 1511778079 BLTMBSCBDYMOLT-UHFFFAOYSA-N 446.418 4.478 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)cc1C 1519309448 XWZOAKCCIDRWQT-HXUWFJFHSA-N 429.609 4.195 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCN3C(=O)COc4ccccc43)cc2Cl)C1 1539911656 ACLVXZDOULCHIE-KRWDZBQOSA-N 441.959 4.008 10 10 IICE CCCCN(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1546997704 OCPWWPACPXEPJD-UHFFFAOYSA-N 436.629 4.102 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3ccccc3Cl)cc2Cl)C1 1568140339 NXJSLZVEJBCFFU-OAHLLOKOSA-N 434.367 4.276 10 10 IICE CNC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Cc1ccc(F)cc1C 1570692180 TXXOVLITGOLCKL-QFIPXVFZSA-N 449.570 4.493 10 10 IICE Cc1ccccc1[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C1CC1 1585943686 YXSXXDMOFSIGOP-NRFANRHFSA-N 442.562 4.444 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2nn(-c3ccc(Cl)cc3F)c3c2CCC3)c1 1595806519 NMUUUPVGOZJRPK-LBPRGKRZSA-N 429.879 4.359 10 10 IICE COCCN(Cc1nc(N)c2c3c(sc2n1)C[C@@H](C)CC3)c1ccc(OC)c(OC)c1 1615904116 AINNVBUGLNQMOO-AWEZNQCLSA-N 442.585 4.069 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)c(C)n1-c1ccc(Cl)cc1 1623391166 MSPILXHUHVJSIB-KRWDZBQOSA-N 427.854 4.031 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CC2)cc1 1623429630 JZVQGBXDPSEBSY-UHFFFAOYSA-N 433.552 4.464 10 10 IICE CCCO[C@@H](C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(F)cc1C 1629967935 KEAUCSMQKCFBII-HSZRJFAPSA-N 432.511 4.018 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)c3ccsc3)CC2)c(C)n1-c1ccc(Cl)cc1 1630682859 WQKBIWSEKGASKR-UHFFFAOYSA-N 441.984 4.336 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCC[C@H]1c1cccc(Cl)c1 1632355698 BTGQCJNPNCNHGO-ZCNNSNEGSA-N 445.943 4.316 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(COC2CCOCC2)cc1 1633484821 QYKUKIIDSMUHJG-UHFFFAOYSA-N 437.584 4.324 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3cccc(Br)c3)C2)c(C)n1-c1ccccn1 1634081090 CHUSHXZCQWCLIX-GOSISDBHSA-N 439.357 4.260 10 10 IICE CCS[C@@H](C)c1noc(CN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n1 1636209556 UMZXOLQDGSPVIP-KRWDZBQOSA-N 440.569 4.305 10 10 IICE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1638306366 YDXMZBGQGJYLFK-SNVBAGLBSA-N 438.336 4.286 10 10 IICE CCOc1ccc2nc(NC(=O)CN(Cc3ccccc3O)C[C@H]3CCCO3)sc2c1 1642199703 LKCOGWGQZAACES-GOSISDBHSA-N 441.553 4.020 10 10 IICE COC(=O)[C@H](C[C@@H]1CCCOC1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1648733924 CHCVEOPQKDLIMY-CVDCTZTESA-N 426.557 4.306 10 10 IICE Cc1cc(CN2CCC[C@H]([C@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)C2)ccc1N(C)C 1659304096 YBFSIGKGUSRACC-QNWVGRARSA-N 431.621 4.345 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)[C@@H]1CCN(c2ccccc2Cl)C1=O 1673743527 FRQXPVYTDQWXRY-HTAPYJJXSA-N 442.991 4.092 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1679613629 HZDANTNYKZJURH-KRWDZBQOSA-N 428.577 4.239 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCn1cccn1 1711483739 KEVDNTXIEBTOAQ-UHFFFAOYSA-N 447.587 4.111 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1conc1COC 1728385971 YWKLSRSIVYFIBR-UHFFFAOYSA-N 434.544 4.382 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@@H]3C)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1742118881 ARXLVXBIZCYGSL-MOPGFXCFSA-N 438.645 4.244 10 10 IICE CO[C@@H](CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)OC)C(F)(F)F 1748400800 FTFRESICEOPHIU-SFHVURJKSA-N 437.466 4.318 10 10 IICE Cn1c2c(c3cc(Cl)ccc31)C[C@@H](C(=O)N1CCN(c3ccc(F)cc3)CC1)CC2 1858153830 WTUQFVBQFSTXPA-INIZCTEOSA-N 425.935 4.425 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1CNCc1cc(Br)cc(F)c1O 2087520720 PYBXVZOEWQIBMI-BLLLJJGKSA-N 431.346 4.467 10 10 IICE Cc1ccc(Oc2nc3c(C)cccn3c(=O)c2C=C2SC(=S)N(C)C2=O)c(C)c1 2314508838 RAQNBVPVQGWKOU-UHFFFAOYSA-N 437.546 4.243 10 10 IICE CCOC(=O)[C@H](C)N1C(=O)C(=Cc2cc(Br)ccc2OCC)SC1=S 2314741211 WCVACWYQIZUASK-JTQLQIEISA-N 444.372 4.001 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2381134184 YZTYDOBDGPASHV-HXUWFJFHSA-N 441.366 4.259 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475855 ZWDZWAUVKNZVHK-GSHUGGBRSA-N 443.525 4.157 10 10 IICE CCOC(=O)c1ccc(NCN2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 59371477 LFZLCCNDTCXRGN-GZTJUZNOSA-N 443.506 4.042 10 10 IICE Cc1cc(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)n1-c1ccccc1F 110417603 HGFNLUCSIVBECS-OALUTQOASA-N 427.564 4.195 10 10 IICE COc1cc(CCc2cc(NC(=O)c3c(C)oc(-n4cccc4)c3C#N)[nH]n2)cc(OC)c1 261453492 PQSKQCCLAAVYHU-UHFFFAOYSA-N 445.479 4.028 10 10 IICE COc1ccc2[nH]cc(C3=CCN(c4cc(Br)cc(F)c4C(N)=O)CC3)c2c1 538743603 RMFOLCHTMQBRIW-UHFFFAOYSA-N 444.304 4.471 10 10 IICE CC(C)(C)OC(=O)NC[C@H](NCc1cc(Br)cc(F)c1O)C1CCCC1 715814922 UXCHNDBCWBXKNJ-INIZCTEOSA-N 431.346 4.467 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1CCc1cccs1 727861443 UZYUPOONOLONHR-DHZHZOJOSA-N 447.344 4.390 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](c1ccccc1)N1CCc2ccccc21 731866120 QZRJRZUEZNPTMG-HHHXNRCGSA-N 441.575 4.286 10 10 IICE C[C@H](Oc1ccccc1)c1noc(-c2cc(NS(=O)(=O)c3cccs3)ccc2O)n1 762106700 SXGSFIFIJYQXBX-ZDUSSCGKSA-N 443.506 4.445 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(Br)cc1Br 768334803 OVVXOJQCRSEAMM-UHFFFAOYSA-N 440.135 4.301 10 10 IICE C[C@@H]1CN(Cc2ccccc2NC(=O)NCc2cc(Br)ccc2O)C[C@@H](C)O1 806212899 FQTOSXJXGWQJEA-HUUCEWRRSA-N 448.361 4.086 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCC(c3ccccc3)CC1)c2[N+](=O)[O-] 881443234 YGVGACDTIWQEMG-UHFFFAOYSA-N 440.455 4.390 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(C)cc3C)cs2)cc1 917853431 RRAWGAHLCGKFMF-UHFFFAOYSA-N 436.580 4.021 10 10 IICE COc1ccc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1124864586 ZIXUFVWXPQTQFX-RMENWYJGSA-N 444.553 4.303 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)ccc3N(C)C(C)C)cc2F)CC1 1125975924 FGRRJHUCSJUPFC-UHFFFAOYSA-N 426.580 4.051 10 10 IICE CC1CCN(c2cccc(NC(=O)c3ccc(S(=O)(=O)C(F)(F)F)cc3)c2)CC1 1126399138 HNFBONCILXVMJW-UHFFFAOYSA-N 426.460 4.469 10 10 IICE COc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(OCCC(C)C)c1 1129549677 RHYZBHMBHIPUBA-UHFFFAOYSA-N 448.510 4.165 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)Nc2ccccc2)NC(=O)OC(C)(C)C)cc1 1136904801 ZMZUQFCTQOTLPE-OAQYLSRUSA-N 440.588 4.325 10 10 IICE Cc1ccc(C(=O)NCCCc2nc3ccccc3n2C)cc1-n1c(C)cc(C=O)c1C 1146335714 LQPGIYDPMAOOEG-UHFFFAOYSA-N 428.536 4.464 10 10 IICE CCOC(=O)C1([C@@H](C)NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)CCOCC1 1157687127 SHKQWTCVIXPNQE-HXUWFJFHSA-N 426.557 4.189 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cc(Br)ncc1Br 1179033496 XSBQXXHAPNCHTF-UHFFFAOYSA-N 436.103 4.395 10 10 IICE Cc1cc(CNC(=O)N2CCC(CCCN3CCOCC3)CC2)c(C)n1-c1ccccc1 1254080087 QHVNRVDYVTUSTR-UHFFFAOYSA-N 438.616 4.128 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(C(F)(F)F)CCC2)NC(=O)OC(C)(C)C)cc1 1293792776 IXIOJWJRXIEUIT-MRXNPFEDSA-N 429.483 4.167 10 10 IICE CO[C@@H](C)c1nc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cs1 1294344060 JOYSTZGAKZWVBR-ZDUSSCGKSA-N 449.374 4.346 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCN(CCCc4ccccc4)C3=O)c2C)cc1 1294448205 QYMZEMHWDHMURQ-VWLOTQADSA-N 445.563 4.066 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1 1297005628 KRGJEFYFSMCATL-KRWDZBQOSA-N 430.932 4.236 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC[C@]2(C1)CC2(F)F 1300222083 LRXLOIWTNMLYKQ-DQXUBXGMSA-N 440.512 4.065 10 10 IICE COCCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)O 1301763430 ZAJZNMHKPLMVCH-UHFFFAOYSA-N 439.604 4.232 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C(C)C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1304197054 XFGUQOZZPZBEKJ-OAQYLSRUSA-N 448.615 4.360 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1CC[C@H](C)C1 1304241376 UQOLGAUCZNFHMO-MTNREXPMSA-N 425.621 4.466 10 10 IICE CCc1nc(CN(C)c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)cs1 1306029001 HJBSRAFQBQSNPI-UHFFFAOYSA-N 449.628 4.362 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@@H](CC)C2 1348205037 JKYXPEYYWUMFHI-CABCVRRESA-N 444.553 4.020 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1nc2c(s1)CCCC2 1352173403 STIIKVPWQDIUPE-WJDWOHSUSA-N 447.582 4.391 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(N4CCC[C@@H](C)C4)c3)cc2F)C[C@H](C)O1 1355130909 PWKNMYJJBGHXGC-QYZOEREBSA-N 440.563 4.001 10 10 IICE CCOC(=O)Cc1cccc(N(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1440073081 HUIHEMGNJJTNCX-UHFFFAOYSA-N 447.579 4.176 10 10 IICE O=C(NCc1noc(-c2cccc(Br)c2)n1)c1cc2cc(O)c(O)cc2s1 1448679960 BQTJFCAINRJCDN-UHFFFAOYSA-N 446.282 4.055 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)c1 1464486313 NMDDKEBWENPQSQ-UHFFFAOYSA-N 443.547 4.463 10 10 IICE CCOc1cccc2c1OCC(C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)=C2 1465951307 KTEDOHACOJJHFC-FQEVSTJZSA-N 442.943 4.001 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 1469760840 JEDUZDFUEKZZPO-UHFFFAOYSA-N 437.519 4.250 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCCC12CCN(Cc1ccc(N3CCOCC3)cc1)CC2 1473898620 ANHXJXQBZDGDSR-JOCHJYFZSA-N 443.632 4.430 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1493597488 FNUOGKZQVMMYND-CBQOVEMMSA-N 428.577 4.109 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCC1CCCC1 1503105895 SEVFVEGLCQSWCV-UHFFFAOYSA-N 445.583 4.259 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@@H]1C 1503798562 RTWRLDDCNUEULV-RXVVDRJESA-N 448.615 4.361 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnc2c(c1)c(C)nn2-c1ccccc1 1536549633 IGJGHKFIAIHUNO-SFHVURJKSA-N 427.552 4.464 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3cc(C(F)(F)F)ccc3n2C)N(C)C)cc1 1539236381 STXMAUJATJKMAG-OAQYLSRUSA-N 432.490 4.296 10 10 IICE C[C@@H](NC(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1556261069 ZCPQUHCOGDAJCF-NQIIRXRSSA-N 425.573 4.456 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)[C@@H](O)c2c(F)cccc2Cl)cc1 1566342414 RYYDHNWRKVZGDM-OYLFLEFRSA-N 442.918 4.480 10 10 IICE C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccc(-c2ccc(F)cc2)cc1 1566452869 USSKRSMNDBMFQJ-AWEZNQCLSA-N 428.485 4.061 10 10 IICE Cc1cc(C(=O)Nc2ccnn2[C@@H]2CCOC2)c(C)n1-c1ccc(Br)cc1 1598116188 KJJUEDXCDRVANS-QGZVFWFLSA-N 429.318 4.267 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1610959357 YTZQWGJLNCGVSZ-IBGZPJMESA-N 439.556 4.284 10 10 IICE CCOC(=O)C1=C(CN(CC)c2ccc(OC)cc2)NC(=O)N[C@H]1c1ccc(Cl)cc1 1616007406 SFDIIIDGIFFSRN-NRFANRHFSA-N 443.931 4.046 10 10 IICE CCc1ccccc1OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1618253062 JDVVDBXNBVGCPR-NRFANRHFSA-N 441.572 4.076 10 10 IICE Cc1cccc(C2(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CCCCC2)c1 1626090491 KAKSONRPIWRKDA-UHFFFAOYSA-N 433.596 4.215 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1 1627026830 ZEANXOROHRPZQS-SFHVURJKSA-N 447.597 4.007 10 10 IICE CNC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)C1 1628354514 NIBQAODAVTWVBU-JOCHJYFZSA-N 435.490 4.358 10 10 IICE O=C(Nc1cccc(NS(=O)(=O)c2ccccc2)c1)c1cc2cc(O)c(O)cc2s1 1629979786 JEJOOCDDWANPQY-UHFFFAOYSA-N 440.502 4.366 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1630698323 SNQDWVCLBSTJME-FXAWDEMLSA-N 431.577 4.054 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccc(OCC(F)F)c2)cc1 1632162260 VGPOIRSKXFQFHM-UHFFFAOYSA-N 426.463 4.409 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCCS(=O)(=O)C[C@H]3c3ccccc3)c2C)c1 1636235662 WZLMKXRDOMNOTE-DEOSSOPVSA-N 436.577 4.405 10 10 IICE Cc1cc(CC(=O)Nc2ccc(F)cc2NS(C)(=O)=O)c(C)n1-c1ccc(Cl)cc1 1637251035 ICRZXDWUMLPVOA-UHFFFAOYSA-N 449.935 4.439 10 10 IICE CCOC(=O)c1sc2nc(C)nc(N(Cc3ccccc3O)C[C@@H]3CCCO3)c2c1C 1639661684 NKAOLWSDIAAZEI-KRWDZBQOSA-N 441.553 4.376 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 1642997903 QZPOTHSWDZLBPG-VLIAUNLRSA-N 431.989 4.265 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CC3)c3cccc(F)c3)cc2F)C[C@H](C)O1 1644162483 YKZRVGSBRXPAFY-ROUUACIJSA-N 443.538 4.111 10 10 IICE CC(=O)N[C@@H](CC(=O)NCc1c(O)ccc2ccccc12)c1ccc(Br)cc1 1647788593 KLSGIUKCERVXBN-FQEVSTJZSA-N 441.325 4.192 10 10 IICE O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)NCc1cccc(Cl)c1O 1653563832 OPWQVCBWTPQHMP-UHFFFAOYSA-N 436.895 4.201 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(Cc2ccccc2F)CC1 1673472313 GWASTYQUOXBFCR-UHFFFAOYSA-N 447.501 4.105 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@@H](c4ccc(Cl)s4)C3)C2)cc1 1683504105 KXLWZYZTRGTMNY-CRAIPNDOSA-N 435.977 4.020 10 10 IICE COC[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cccc(OC)c1 1683838156 LWRLCEVUAOHMBE-DEOSSOPVSA-N 437.540 4.454 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2sc(C)cc2Br)cc1 1684131184 QMBKHBUQQMSCKX-UHFFFAOYSA-N 426.380 4.105 10 10 IICE CCN(c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1)[C@@H](C)C1CCC1 1695547211 XGFOMXSKZBNJEP-HNNXBMFYSA-N 431.635 4.332 10 10 IICE C=CCCCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1705807146 USNIVGMOBUMBSU-HSZRJFAPSA-N 439.604 4.349 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@@H]2[C@@H]2CCCO2)cc1F 1711006459 JMFZUDNMKRKCJD-RTWAWAEBSA-N 429.584 4.268 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@@H]2CCCCO2)n1CCOCC(F)F 1711080321 MOESXVXADCFQTM-FQEVSTJZSA-N 449.546 4.038 10 10 IICE CCN(c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N(C)C)cc1C)C1CCCC1 1728285510 YHWROIYCTDDQFV-UHFFFAOYSA-N 447.587 4.117 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1728378617 ATZYTPSKAKUXQE-IBGZPJMESA-N 434.588 4.238 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)cc1C 1752611800 IKCXEEQTJKINCC-HTAPYJJXSA-N 435.620 4.462 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@@]3(C)CCCO3)CC2)cc1 1768705136 WWVAYBBKVUFSHX-RUZDIDTESA-N 441.620 4.161 10 10 IICE COCCN(CC(C)C)c1nnc(C2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1769821673 ZRBJTEQULIFHCD-UHFFFAOYSA-N 443.661 4.256 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(Br)c2)N2CCCCC2)cc1 1858074661 PZAVBWOWAPAAND-NRFANRHFSA-N 430.390 4.472 10 10 IICE CCC(CC)C(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 1860548205 BEGIFCSPARILSE-UHFFFAOYSA-N 441.487 4.484 10 10 IICE CCc1sc(NC(=O)[C@@H](N)CC)c(C(=O)OC)c1-c1ccc(Br)cc1 1865951386 PRLMOGYHFRPCQR-LBPRGKRZSA-N 425.348 4.202 10 10 IICE CN1CCCc2cc([C@@H](O)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044734274 URMLQSWWRMZOGW-DEOSSOPVSA-N 439.600 4.129 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@@H](CNC(=O)OC(C)(C)C)C2(C)C)c1O 2236054035 DITALSJWQHHVQT-BLLLJJGKSA-N 443.382 4.192 10 10 IICE CC(C)N1C(=O)C(=Cc2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)SC1=S 2296851531 QOCOEENCPDIXAM-UHFFFAOYSA-N 441.509 4.236 10 10 IICE CCCCN1C(=O)C(=Cc2cc3cc(C)ccc3nc2N2CCOCC2)SC1=S 2314647596 DYSJCPVHZXROTD-UHFFFAOYSA-N 427.595 4.381 10 10 IICE COc1cccc(C=C2SC(=S)N(CCNC(=O)C=Cc3ccc(C)cc3)C2=O)c1 2320656451 QOZSLGWRSFHUHN-UHFFFAOYSA-N 438.574 4.034 10 10 IICE CCN(CC)c1ccc(C=C2SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1 2321681379 ZZSVIXVIGPJLTP-UHFFFAOYSA-N 428.535 4.342 10 10 IICE COc1cc(N2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)cc(OC)c1OC 2321738503 IVNKCRBAHHOQDE-UHFFFAOYSA-N 432.479 4.026 10 10 IICE Cc1cc(C(=O)CSc2ccc(Cl)cc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 10532316 VLSNEXUDDZYCAS-UHFFFAOYSA-N 434.970 4.370 10 10 IICE O=[N+]([O-])c1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)cc1 14550783 ZZUZOJCBIFQLHI-NNMXDRDESA-N 425.510 4.206 10 10 IICE COc1ccc(CN/C=C2\C(=O)N(c3nc4ccccc4s3)N=C2C(F)(F)F)cc1 102643662 DYJLTQMRBJTWEH-KAMYIIQDSA-N 432.427 4.244 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2CNCc1cccc(Br)c1O 703956079 SURXBHDVVGMZFD-HNNXBMFYSA-N 425.367 4.282 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc3c(c2)CCO3)nc1-c1c(F)cc(F)cc1F 729110477 MEQNAIUXRBOBIM-UHFFFAOYSA-N 426.441 4.272 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(N(C)C(=O)OC(C)(C)C)CC2)c1O 730564401 BGUMFVOUBZBOEX-UHFFFAOYSA-N 428.529 4.163 10 10 IICE NC(=O)c1ccc(Oc2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cc2)cc1 735520396 ZWQIRPSXXLFLKN-HSZRJFAPSA-N 446.503 4.105 10 10 IICE COc1ccc([C@H]2CCCN2C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 769041399 JCTYQNAHGVOYEO-AREMUKBSSA-N 448.611 4.274 10 10 IICE COc1ccccc1-c1ncc(/C=C2\SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cn1 794185792 ROFURUWVDXUHPA-UWVJOHFNSA-N 449.513 4.287 10 10 IICE O=C(CC1CCCC1)NC1CCC(C(=O)NCc2cc(Br)ccc2O)CC1 804733790 ZDHPTUDAPDSZPW-UHFFFAOYSA-N 437.378 4.026 10 10 IICE O=C(CCc1cc(Br)ccc1F)NCc1cc(Br)ccc1O 804738305 LCSRSHLBCKTFAK-UHFFFAOYSA-N 431.099 4.305 10 10 IICE CC(=O)C(=O)COC(=O)c1cc(/C=C/c2ccc(C)o2)nc2ccc(Br)cc12 808508623 GMHDVFRYHILGDW-FNORWQNLSA-N 442.265 4.384 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 813807800 DIZGPVKIXCJKMR-HXUWFJFHSA-N 431.577 4.494 10 10 IICE Cc1cc(/C=C2\C(=O)N(C)C(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1 1084251964 XUFWSCVRCNPAJI-KGENOOAVSA-N 444.447 4.011 10 10 IICE CS[C@@H]1CC[C@H](N(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1126591625 VDBIWCYXGLPNOD-GUNNMUBUSA-N 438.615 4.160 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)cc2)cc1 1136436233 OAGUNGXQXFTKHC-UHFFFAOYSA-N 449.576 4.108 10 10 IICE CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1142363641 NEXZIPCBAPQIMY-SFHVURJKSA-N 433.508 4.441 10 10 IICE CCC1(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CCN(C(=O)c2ccccc2)CC1 1142418186 AVAZOVRRLOQLNV-NRFANRHFSA-N 435.612 4.441 10 10 IICE O=C(CCc1nc(-c2cc(Br)cs2)no1)NCc1cc(Cl)ccc1O 1146231647 GNTZFHWMKVXALL-UHFFFAOYSA-N 442.722 4.169 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)c1 1146559070 ZWXLSICQHQEQKA-UHFFFAOYSA-N 437.565 4.343 10 10 IICE CCCCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NCc2ccccc2O)c1 1150535877 ISQFSFANNFADDG-UHFFFAOYSA-N 438.549 4.318 10 10 IICE Cc1cc(CNC(=O)CNC(=O)c2ccc(Cl)c(Cl)c2)c(C)n1-c1ccccc1 1151154440 VLBQGZIZANRYJJ-UHFFFAOYSA-N 430.335 4.447 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)C(=O)NCc1ccccc1 1235835257 VNJGDUYHEHIZAK-MSOLQXFVSA-N 442.991 4.080 10 10 IICE Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1264610289 AJIKCFLKPAJONW-UHFFFAOYSA-N 447.800 4.278 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccnc(C(=O)OC(C)(C)C)c2)C1 1278795749 UEXIDQSIIRQZMW-UHFFFAOYSA-N 448.567 4.397 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)NCc2cc(Cl)ccc2O)cc1 1300402535 ZQEVPDOUOGHBKG-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CCOC(=O)[C@H](C)C1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1303358268 PAMLZAXNEQFMMC-CQSZACIVSA-N 433.346 4.128 10 10 IICE C[C@H]1C[C@@H]1Cn1c(-c2cc(Br)cn2C)nnc1N(C)Cc1ccccc1O 1304951199 OYMSOXTYLDKEEO-DZGCQCFKSA-N 430.350 4.044 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@H]1CCN(c2cccc(Br)c2)C1 1312601266 DDWYCKJZEVVKRG-KRWDZBQOSA-N 444.373 4.112 10 10 IICE NC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c1 1318241799 UGWSZZASMTVWRJ-UHFFFAOYSA-N 428.322 4.017 10 10 IICE CCOC(=O)C[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1435776319 JHWLLBQNBBSAPU-HSZRJFAPSA-N 447.579 4.219 10 10 IICE CC(=O)c1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1F 1436198934 OVPIANPKEMHBAP-VCHYOVAHSA-N 446.500 4.397 10 10 IICE Cc1cc(C)c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(C)c1Br 1439960583 NFYZRSBFYIGSIC-IBGZPJMESA-N 432.406 4.473 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(C(=O)Nc3ccccc3)c2)N(C)C)cc1 1439962170 VWXFZDTYFMUWKN-XMMPIXPASA-N 430.552 4.038 10 10 IICE Cc1cc(C(=O)NCCCNC(=O)c2ccc(F)cc2)c(C)n1-c1cccc(Cl)c1 1444189191 VMUSFGRIOFHVAR-UHFFFAOYSA-N 427.907 4.437 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CN1C(=O)CCOc2ccccc21 1446808205 WDFVYCYXXUIZEM-IBGZPJMESA-N 430.504 4.298 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2[nH]c3c(c2c1)C[C@@H](C)CC3 1466397897 BUZDDLYNNSPTPN-AWEZNQCLSA-N 440.927 4.467 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1470398388 OPCUYKPEMFUULF-HXUWFJFHSA-N 427.545 4.362 10 10 IICE COC1CCN(c2ccc(CN[C@@H](C)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1473367138 ODVZJXKKMNTHQF-PZJWPPBQSA-N 431.621 4.427 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1499762550 IWDSUZQVQBWQLJ-GBXCKJPGSA-N 448.615 4.162 10 10 IICE Cc1cc(C(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)c(C)n1-c1ccc(F)cc1 1542247061 CZUZDGPLZCGXDX-LJQANCHMSA-N 435.543 4.384 10 10 IICE Cc1cc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCCCC2)c(C)n1-c1ccccn1 1545066528 YGPANFLIVHQJKN-UHFFFAOYSA-N 426.561 4.447 10 10 IICE CCN1C[C@@H](C)N(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1547644213 DWNBOZRFNNEXRC-ZWKOTPCHSA-N 428.600 4.108 10 10 IICE Cc1cc(C(=O)N(CCn2ccnc2)Cc2cnn(C)c2)c(C)n1-c1cccc(C(C)C)c1 1556543365 XGNVPXCFRXDZDV-UHFFFAOYSA-N 444.583 4.490 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](NC(=O)c1ccccc1)c1ccccc1 1557063225 ISRPPOJIZQKVRF-NLFFAJNJSA-N 429.564 4.280 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1557063806 ZXNOYRBMILHLGT-KXBFYZLASA-N 448.394 4.468 10 10 IICE C[C@@H](NC(=O)CCCOc1ccc(I)cc1)c1ccccc1O 1557967202 WZNSRXBGYRCPQX-CYBMUJFWSA-N 425.266 4.033 10 10 IICE Cc1ccc(-n2nnnc2SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)cc1C 1559344150 XDARPUKSFHVUOK-UHFFFAOYSA-N 436.516 4.196 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccccc2CCN(C)C(=O)OC(C)(C)C)c1 1566374888 XLYOLAFWTJNKPA-INIZCTEOSA-N 428.529 4.301 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4c(Br)cccc4cn3)CC2)cc1 1566562344 HFMVGVDKCZZWPJ-UHFFFAOYSA-N 440.341 4.358 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)CCCC1 1570425965 NPLYHOHSULHGCU-QZTJIDSGSA-N 440.584 4.355 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cnc(CC3CC3)s2)NC(=O)OC(C)(C)C)cc1 1586619165 DOMKBFUQJSUFFZ-SFHVURJKSA-N 444.601 4.157 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2ccc(F)cc2F)NC(=O)OC(C)(C)C)cc1 1586619306 HAMYABFSCDAITQ-OAQYLSRUSA-N 447.526 4.346 10 10 IICE Cc1ccc(CC(C)(C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 1597976339 WCWKUXKFEQMUPT-UHFFFAOYSA-N 442.471 4.430 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CCc2ccn(C)n2)c(C)n1-c1ccccc1 1611934105 VTVYBSQTXSJENO-UHFFFAOYSA-N 431.588 4.421 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN(CC)C1CC1 1613296038 UVQPJEGGSQTNFM-FQEVSTJZSA-N 440.636 4.001 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)Cc2ccc(C)o2)cc1 1615379999 SVASWPBCDHJCNE-UHFFFAOYSA-N 431.544 4.167 10 10 IICE Cc1cc(CC(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)c(C)n1-c1ccccc1 1626547526 FVAPUIIQOJESQM-OAQYLSRUSA-N 431.580 4.174 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2cccc(F)c2)c(C)n1-c1ccccc1Br 1628609990 JWGODKQVOGFYPP-SFHVURJKSA-N 445.332 4.329 10 10 IICE CC(C)(C)C(=O)Nc1ccccc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257020 KZWNFKQJEWOMPC-SFHVURJKSA-N 443.975 4.425 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1 1633243533 JMNHAPKRUSWKMW-NRFANRHFSA-N 430.426 4.389 10 10 IICE CCN1CCO[C@@H](C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)C1 1648493755 LDHGOUYDPBQLFS-PZJWPPBQSA-N 435.490 4.019 10 10 IICE C[C@@H](NC(=O)N[C@H]1Cc2ccccc2N(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671851992 OBHZNELRDCWWKX-XLIONFOSSA-N 438.572 4.479 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccnc(-c4ccccn4)n3)c2C)c1 1675115947 UVQUOYIGUIQAAI-UHFFFAOYSA-N 426.524 4.254 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3cccc(F)c3F)CC2)N(C)C)cc1 1676652767 AIKZQLZFCXPKTB-QHCPKHFHSA-N 444.570 4.298 10 10 IICE CC[C@@H](CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)NC(=O)OC(C)(C)C 1681307397 BUPSLKVFLYXHLB-FQEVSTJZSA-N 428.577 4.239 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCO[C@@H](c3ccncc3)C2)cc1 1682628280 PGFPZYMEZFBUEI-ZJSXRUAMSA-N 434.540 4.373 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1684478995 PHJJXYNBOLMACJ-UHFFFAOYSA-N 430.552 4.070 10 10 IICE Cc1cc(CNC(=O)NCC2(n3cc(Br)cn3)CC2)c(C)n1-c1ccccc1 1684604322 MRAQZQRPSBCQDK-UHFFFAOYSA-N 442.361 4.042 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)cc1C 1710097461 VWMFKOPSCOOBOI-UHFFFAOYSA-N 449.628 4.113 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)n1CCC1CC1 1711096507 KQBFGNTXUBWQGK-KDURUIRLSA-N 441.576 4.191 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763405221 UNVNDYCLMOPZMW-OYHNWAKOSA-N 429.952 4.133 10 10 IICE CC(C)(C)OC(=O)N1Cc2[nH]c(=NCc3cc(Br)cc(F)c3O)sc2C1 1898928537 RZCFRVPOAFULML-UHFFFAOYSA-N 444.326 4.035 10 10 IICE [N-]=[N+]=NC[C@@H]1CCCN(C(=O)c2cc(Br)ccc2I)C1 1912147625 YPMOUCABFLEKHP-VIFPVBQESA-N 449.090 4.216 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@H](NCc1cccc(Br)c1O)C2 2232282622 QFAWNNVFZYQQAK-SDNTUTLCSA-N 425.367 4.326 10 10 IICE CC(C)(C)OC(=O)NC(C)(C)c1csc(=NCc2ccc(Br)cc2O)[nH]1 2267696877 IMEJJMWNFTWAKE-UHFFFAOYSA-N 442.379 4.405 10 10 IICE Cc1nnc(NC(=O)CCCN2C(=O)C(=Cc3ccc(Cl)cc3)SC2=S)s1 2297296830 XMWHCCDUURLXPW-UHFFFAOYSA-N 438.987 4.120 10 10 IICE COc1ccc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccc(C)cc3)C2=O)cc1OC 2314836298 CMVOUXQDMCHHNX-AWEZNQCLSA-N 442.562 4.241 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCC(=O)O 2314934401 ZLAZUYIZUPNRDN-UHFFFAOYSA-N 433.482 4.094 10 10 IICE CCCCN(CC(=O)NCc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2352620399 PURZNNSXZXYPJV-UHFFFAOYSA-N 429.355 4.117 10 10 IICE Cc1ccc(CN[C@@H]2CCCC23CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352931947 GDKUHWZFMITAID-OAHLLOKOSA-N 425.367 4.342 10 10 IICE CC(/C=C1\SC(=S)N([C@@H]2CC(=O)N(c3ccccc3)C2=O)C1=O)=C\c1ccccc1 14903945 ZVXPEIXTKZGELO-NEVULKFESA-N 434.542 4.166 10 10 IICE COc1ccccc1-n1nnnc1SCC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C 15226817 FGGLTWRRRPEKRX-UHFFFAOYSA-N 433.537 4.362 10 10 IICE CCN(CC)c1ccc(N2C(=O)/C(=C\c3ccc(OCC(=O)O)cc3)SC2=S)cc1 16906440 KRGNVGAPIUIGJG-CPNJWEJPSA-N 442.562 4.402 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2ccc(OCc3ccccc3C)cc2)SC1=S 40937942 TYASPIUKMDPMBK-UYRXBGFRSA-N 427.547 4.338 10 10 IICE Cc1ccc(-n2cnnn2)cc1NC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 725857143 YJRWAUWKMUREFQ-GOSISDBHSA-N 428.496 4.472 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1F 726708539 CEMXGNKTERHSCZ-KRWDZBQOSA-N 441.482 4.170 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(n3cc(Br)cn3)CC2)c1O 731662013 IAKHDUDVOOQMBI-UHFFFAOYSA-N 444.329 4.128 10 10 IICE COc1ccc(Nc2nc(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)cs2)cc1 740743027 CWOLSZQLRSQTRI-UHFFFAOYSA-N 438.553 4.303 10 10 IICE O=C(NCc1cc(O)nc2ccccc12)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754372199 CTHCKNFRJLHMCU-INIZCTEOSA-N 442.466 4.010 10 10 IICE CCN1CCN(c2ccc(CN[C@@H]3CCCc4nn(-c5ccccc5)cc43)cc2F)CC1 794812070 ZKWWDECDUXNSDT-XMMPIXPASA-N 433.575 4.321 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCOCC3)n2C[C@@H]2CCOC2)c(C)n1-c1ccccc1 802762506 ALSZLZLRPQOIIJ-QFIPXVFZSA-N 449.599 4.252 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCc2sc(Cl)cc21 813590200 JSUJYZVPDFMVQF-KRWDZBQOSA-N 437.968 4.379 10 10 IICE Cc1nc(C(C)C)sc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916458522 NKMGSUWWRLZVRW-UHFFFAOYSA-N 427.492 4.360 10 10 IICE Cc1cc(C(=O)NCCNC(=O)c2ccccc2)c(C)n1-c1cccc(Br)c1 918008897 ZXXHSIZKFSXZPF-UHFFFAOYSA-N 440.341 4.016 10 10 IICE C/C=C/COc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1125256954 QWQJJVLGGJERGF-OJBOGMDESA-N 426.532 4.253 10 10 IICE CC(C)(NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)[C@H]1CCCCO1 1132742626 ZTWZVIGIXSQHPD-QJPKHSJYSA-N 438.640 4.193 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)c1 1135470376 QLTUGEITHQVTBI-UHFFFAOYSA-N 425.554 4.214 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(F)c(Cl)c(N)c3Cl)cc2F)C[C@H](C)O1 1141901568 IKANPGXOABEVGT-QWRGUYRKSA-N 444.309 4.397 10 10 IICE O=C(N[C@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1142285610 YEYUUKDSFFMCCP-OAHLLOKOSA-N 430.335 4.393 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(Cc3ccccc3)c3ccc(C)cc3)CC2)cc1 1192070866 PADXGJOBIBTVOC-MHZLTWQESA-N 445.607 4.193 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@H]3c3ccc(Cl)cc3)CC2)cc1 1194348965 TUABJLGMUGNHJH-ZCYQVOJMSA-N 444.019 4.059 10 10 IICE CC(C)(C)Oc1ccc(CCNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1224609358 JJWPLHCYRNMNQN-UHFFFAOYSA-N 447.526 4.021 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CCN(C(=O)/C=C/c2ccccc2)CC1 1264286633 SVCUZGGDNJCZLG-SDNWHVSQSA-N 431.580 4.197 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4cccc(C)c4)cn3)cc2F)CC1 1265012318 XESFUWIBDUNMEW-UHFFFAOYSA-N 448.542 4.393 10 10 IICE Cc1cc(C)c(C)c(OCCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1266259217 URWFYBSTSVLGDQ-UHFFFAOYSA-N 435.612 4.229 10 10 IICE Cc1cc(C(=O)NC[C@]2(N(C)C)CCSC2)c(C)n1-c1cccc(Br)c1 1294306159 VWSLKPGHUBQSCW-HXUWFJFHSA-N 436.419 4.024 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C[C@H]1C(=O)Nc2ccc(Br)cc21 1297005609 JVUHWOZWBRWVNK-QGZVFWFLSA-N 431.330 4.409 10 10 IICE Cc1nnc(N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)n1CCCSc1nccs1 1304786172 BNVMVLFOBWLNEJ-HJFSHJIFSA-N 435.644 4.160 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(C)=O 1305576852 JNLLFNXKJWXWPD-GOSISDBHSA-N 436.604 4.361 10 10 IICE COCCCN(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1316028570 SYIQAVMOQRPVNN-UHFFFAOYSA-N 448.615 4.021 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)cc1 1352408816 FEEXDEPINRRJSN-CLJLJLNGSA-N 435.612 4.298 10 10 IICE COc1ccc(N2CCN(C(=O)c3cn(-c4ccc(C)cc4)nc3C(C)(C)C)CC2)cc1 1356444691 CLHZGNIZLWXDIE-UHFFFAOYSA-N 432.568 4.449 10 10 IICE C[C@@H]1CC(F)(F)CCN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1438486002 PIHSLWGZALFUMJ-JXCQQFQQSA-N 428.501 4.063 10 10 IICE Cc1cccc(COc2cccc(CC(=O)NCc3ccc(N4CCC(O)CC4)cc3)c2)c1 1453985149 RVKBCYGPJKSXBF-UHFFFAOYSA-N 444.575 4.394 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@H]1CCN(C2CCCCC2)C1=O 1459464804 LBJOYMMLMMGKKA-QFIPXVFZSA-N 427.589 4.398 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@@H](C)c3cccc4ccccc34)CC2)c(OC)c1 1460653435 XQSBNCBPOVBTSZ-PMACEKPBSA-N 447.579 4.245 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1 1463814743 RXEAXJZBPUZHFQ-RUZDIDTESA-N 427.548 4.417 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@@H]1Oc1ccccc1 1467367749 QHYITCAJVDWATM-WEWMWRJBSA-N 446.547 4.190 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CC[C@@H]3CCOC3)CC2)cc1 1504292901 VEFXYSWYDMZTEP-HXUWFJFHSA-N 441.620 4.019 10 10 IICE CC(C)Cc1nnc(N(C)[C@@H]2CCCc3c2cnn3C)n1CCCSc1nccs1 1509127392 KSWIBNLGNNDJPX-QGZVFWFLSA-N 445.662 4.363 10 10 IICE CN(Cc1ccc(F)cc1)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1517120881 PQUXUHBVADNMOK-MRXNPFEDSA-N 433.578 4.196 10 10 IICE COc1ccc([C@@H]2C[C@H]2CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1527481804 RJSLIPKKLAZLOH-AXRVMRSRSA-N 426.532 4.258 10 10 IICE CC[C@@](C)(NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C(F)(F)F 1530428146 KQJUNLCZNMLJLY-JIIJFUIFSA-N 434.480 4.264 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@@H]1CCC2(CCCC2)O1 1530756384 QFKDSHVPVWESIJ-NAVNFMRLSA-N 448.585 4.025 10 10 IICE CCc1ccccc1NC(=O)CN(C)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1543169778 UOOGIVNPFBONFT-UHFFFAOYSA-N 431.536 4.488 10 10 IICE CCS[C@@H]1CC[C@H](N(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1552511260 AEZVNOHCTRXOSB-GBESFXJTSA-N 447.624 4.146 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@H](C)c1ccccc1 1566185376 GGWDJBGTHILKMJ-GJZGRUSLSA-N 430.551 4.177 10 10 IICE CCOC[C@@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1597059075 QZDQTRYEEWMKGZ-XOAFGZPJSA-N 438.640 4.147 10 10 IICE CC[C@H](C)c1nnc(N2CCC(C(=O)OC)CC2)n1Cc1ccc(N(CC)CC)cc1 1613217258 SBPJFOMTDQEJGH-SFHVURJKSA-N 427.593 4.076 10 10 IICE CCC[C@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1614402629 HHGAWSLRRITPCN-JOCHJYFZSA-N 436.604 4.335 10 10 IICE CCCN(CC)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1614697719 DJVYVQFRGJIVKJ-HXUWFJFHSA-N 429.634 4.010 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@H](C)O[C@H](COC)C2)cc1 1615381557 YMOWOYJVBLJNLO-UGKGYDQZSA-N 443.636 4.001 10 10 IICE COC1CCN(c2ccc(CN(C)[C@H]3CCN(c4ccccc4Cl)C3=O)cc2)CC1 1615500587 OWZGFGBZPKRUBE-QHCPKHFHSA-N 427.976 4.193 10 10 IICE CC(=O)c1cc(Cl)cc(CNC(C)(C)COc2ncccc2Br)c1O 1616411147 QATDYKGCJXMYAX-UHFFFAOYSA-N 427.726 4.353 10 10 IICE Cc1c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cccc1N1C(=O)CCNC1=O 1617669854 QALRYQGLJQMRJS-UHFFFAOYSA-N 430.508 4.030 10 10 IICE Cc1cc(Br)cc(C)c1N1CCC[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 1627048423 UKRKZHXZGDSTHY-IWHGQQBYSA-N 445.357 4.276 10 10 IICE Cc1ccc(OCC(=O)N2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)cc1 1627786113 XACRKWQHZNMLPB-UHFFFAOYSA-N 445.563 4.074 10 10 IICE C[C@@H]1[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)[C@H]1c1ccccc1 1628495578 MVTGATFTDYSXDT-QMZRJTEUSA-N 437.584 4.484 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(F)(F)c3cccc(Br)c3)CC2)cc1 1630992273 JYXUQDWNCILDNV-UHFFFAOYSA-N 439.300 4.288 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)c3ccc(O)cc3)CC2)c1 1631155303 SOKUHJRLAGGYHO-UHFFFAOYSA-N 430.504 4.347 10 10 IICE COc1cnc(C2(NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)CCCC2)nc1O 1636106414 MBPSRWXQEPEBCN-UHFFFAOYSA-N 440.931 4.451 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 1642997771 MQYOHARQSBQZHY-RXVVDRJESA-N 429.605 4.288 10 10 IICE CON(C[C@@H]1CCC[C@@H](C)C1)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1643308420 KGZILGHARFIPHL-FGTMMUONSA-N 434.536 4.479 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])c1 1655534259 JBTFVBWVUDVXTR-LSYMRDCYSA-N 445.516 4.008 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(NC(C)=O)cc2)Cc2ccccc2)cc1OC 1655929090 LQNUAQXOEXFVNC-UHFFFAOYSA-N 433.508 4.308 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCc1cnc(SC2CCCC2)nc1 1682916723 VTSQFCSTQWOKSW-UHFFFAOYSA-N 439.629 4.496 10 10 IICE C[C@@H](c1ccccc1Br)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1684280705 OJRGDOPKGNLMSJ-INIZCTEOSA-N 446.389 4.313 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN(CC)C(C)C 1694108290 HJGUCBLBULHGNM-OAQYLSRUSA-N 442.652 4.247 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2ccc(Cl)s2)cc1F 1696611838 XPYQBZAFWPUFQF-HNNXBMFYSA-N 449.983 4.387 10 10 IICE CC(C)CCN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1706455203 BZKIVMVACGAUNI-UHFFFAOYSA-N 436.629 4.424 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](CNC(C)=O)C2)n1Cc1ccc(N(CC)CC)cc1 1708491075 FPXWMYKUPDLOON-SIKLNZKXSA-N 440.636 4.039 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CO)CC1 1750326294 FXJTUYGNCJJVDF-UHFFFAOYSA-N 439.629 4.314 10 10 IICE CSCCCCn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1771470537 KEVSHDLYIIXVDI-UHFFFAOYSA-N 431.650 4.192 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3cccc(Cl)c3)N=C2C(F)(F)F)cc(OC)c1O 1865679777 GDFDHDOSJZPDRS-AUWJEWJLSA-N 440.805 4.407 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CCCNC2)sc(C)c1-c1ccc(Br)cc1 1865973726 CSKABGDBLAUYIZ-ZDUSSCGKSA-N 437.359 4.211 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](NC(=O)[C@@H](C)C3CCCC3)c3ccccc3)CC2)cc1 1868891447 UJSFSJADNYVSHJ-CPJSRVTESA-N 449.595 4.028 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(COc4ccccc4OC)c3)CC2)cc1 1872849697 CWVVSHLKKDHCNH-UHFFFAOYSA-N 432.520 4.245 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179458 FRYPLDXMBKDRSN-UHFFFAOYSA-N 435.483 4.446 10 10 IICE O=C(O)CCC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)nc(O)c1 1952222497 RUIGQKOMMPUGLN-OAQYLSRUSA-N 448.475 4.328 10 10 IICE CC(C)(C)OC(=O)N[C@@]1(C)CCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2044741801 BIZAOYWFHCEUKJ-DEOSSOPVSA-N 446.592 4.056 10 10 IICE COc1cccc(Cn2nc(C3(C)CC3)c(C(F)F)c2I)c1O 2079754267 ZNQVIBQDNGDLCN-UHFFFAOYSA-N 434.224 4.239 10 10 IICE CCOC(=O)c1c(CC)nn([C@H](c2ccc(OC)cc2O)C2(C)CC2)c1Br 2079982707 XHIJCQFBBCMXRW-QGZVFWFLSA-N 437.334 4.488 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(Cc3ccccc3)C3(CC3)C2)c1O 2236054523 JJHVLNXFDBCUCK-KRWDZBQOSA-N 431.374 4.450 10 10 IICE CC[C@@H](C)N1C(=O)C(=Cc2ccc3c(c2)CCCN3Cc2ccccc2)C(=O)NC1=S 2296342641 LYRIIAPEFWBJHG-QGZVFWFLSA-N 433.577 4.065 10 10 IICE CCC1=NC(=C2C(=O)N(c3ccccc3)N=C2C)c2nnn(Cc3ccccc3Cl)c2N1 2297707501 LQHPUAOTBCORLP-UHFFFAOYSA-N 445.914 4.348 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccccc3)C2=O)ccc1O[C@H](C)C(=O)O 2314934646 JFRZRUWPIKLCCS-CQSZACIVSA-N 443.546 4.339 10 10 IICE CCC[C@@H](CC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2352620987 XCBQRDPUULHSJZ-AWEZNQCLSA-N 429.355 4.163 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2380738257 WIZTXMCTLBOWKU-AWEZNQCLSA-N 441.366 4.115 10 10 IICE CCOC(=O)c1ccc(N2C(=O)/C(=C\c3ccc(O)c(O)c3)c3ccccc3C2=O)cc1 2662762 FBTLHEBDSRNSID-MOSHPQCFSA-N 429.428 4.002 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@H](c2cccc(Cl)c2)N3)CC1 14460353 OESDAGULAZQRDM-VIZSFHNOSA-N 444.000 4.103 10 10 IICE CCCOc1ccccc1/C=C1\SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O 16926753 WECFOEFMSZJCKC-BOPFTXTBSA-N 443.502 4.278 10 10 IICE O=C1N=C(O)/C(=C/c2cccn2-c2ccc(Cl)cc2)C(=O)N1c1ccc2c(c1)OCO2 33420937 QMDWAELFPZXJJX-YVLHZVERSA-N 435.823 4.366 10 10 IICE CN1C(=O)/C(=C/c2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCCO3)SC1=S 39850176 MLIXIUPNOMWBKN-UNOMPAQXSA-N 435.530 4.142 10 10 IICE CCCCOC(=O)CN1C(=O)/C(=C/c2ccc(OC)c(Br)c2)SC1=S 40885094 HRADCQKRQCIHKF-ZROIWOOFSA-N 444.372 4.002 10 10 IICE C[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H](c2ccc(F)cc2)O1 743554344 BJFZJEFKHPBMCJ-VGSWGCGISA-N 429.561 4.051 10 10 IICE Cc1cccc(OC(F)F)c1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768888152 KNQMVAKDSHIUSL-UHFFFAOYSA-N 444.526 4.450 10 10 IICE COc1ccccc1[C@H]1CCCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769057447 UNYPYCBWEIHBFZ-RUZDIDTESA-N 448.611 4.274 10 10 IICE CCOC(=O)[C@H]1CC[C@@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c2ccccc21 802305771 TZVKODPRRBWZSJ-RRPNLBNLSA-N 447.623 4.490 10 10 IICE Cc1cc(CCNC(=O)Nc2ccc(F)c(N3C(=O)CCC3=O)c2)c(C)n1-c1ccccc1 806743968 KWULCJVRUUOKOE-UHFFFAOYSA-N 448.498 4.251 10 10 IICE C[C@@H](Sc1ccccc1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661143 HLOMADJQZJGNEQ-CYBMUJFWSA-N 426.916 4.252 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3c(F)ccc(SCC4CC4)c3F)cc2)CC1 1133123587 SAXYWQSDJDPTET-UHFFFAOYSA-N 431.552 4.149 10 10 IICE COC(=O)c1ccc(Cl)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 1142712707 FEOPUPPZPZYMRF-IBGZPJMESA-N 430.932 4.014 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1180410529 RIIHEYVKYTZWIJ-DLENHJPASA-N 433.335 4.410 10 10 IICE C[C@@H](C(=O)NCc1ccccc1F)N1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1190932982 AKZNFPWPEYEBCL-KRWDZBQOSA-N 441.547 4.308 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3C(=O)NC(C)(C)C)cc2Cl)C1 1227208686 PPMIDTPVKILPFD-OXQOHEQNSA-N 435.012 4.165 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@]12CCC[C@H]1CN(C(=O)OC(C)(C)C)C2 1230199434 BOCYJMOAUPJJQZ-KHOMTPLRSA-N 444.620 4.081 10 10 IICE CC(C)Cc1ncc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)s1 1264640887 NVUXFOAQBAOYCN-UHFFFAOYSA-N 427.492 4.127 10 10 IICE CN1CCN(c2ccc(CNC(=O)COc3c(Cl)cc(Cl)cc3Cl)cc2)CC1 1288335104 YRGVDUMNGSCDSO-UHFFFAOYSA-N 442.774 4.094 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)C3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1289359309 MNIFSRZSJUVPCU-SFHVURJKSA-N 434.588 4.067 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1 1290756737 IAPKLHUYCIWXFC-WGSAOQKQSA-N 427.545 4.178 10 10 IICE COc1ccc(C(=O)C[C@H](C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 1292381530 FFHHAGTUXDXDDA-CYFREDJKSA-N 438.568 4.178 10 10 IICE CCOC(=O)c1c[nH]nc1[C@H]1CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1 1301587184 VJYDPPARGZYBPO-INIZCTEOSA-N 440.931 4.277 10 10 IICE Cc1cc(C(=O)CSC[C@@H]2CC[C@@H]3C[C@@H]3C2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1307377240 OBELHTCHJDQKDF-KURKYZTESA-N 432.611 4.094 10 10 IICE CN(CCc1ccccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(=O)OC(C)(C)C 1351697071 VONODKITVGQCOR-UHFFFAOYSA-N 425.485 4.207 10 10 IICE CCCc1sc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1Br 1355131583 XLLNIDHBLAGNNO-UHFFFAOYSA-N 441.366 4.369 10 10 IICE CCOc1cccc2c1OCC(C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)=C2 1435330794 ARNJTDLQWBHYAD-GOSISDBHSA-N 444.478 4.248 10 10 IICE CC[C@@H](Oc1ccccc1Cl)C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1446812738 AEAZAJCEPWHLQB-QGZVFWFLSA-N 426.296 4.058 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)CC2)cc1 1455927377 DATAOSLDRBSAHD-OAQYLSRUSA-N 445.604 4.206 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CSCc3cccc(F)c3F)cc2F)C[C@H](C)O1 1459255086 XIJHGAIQCXARSL-GJZGRUSLSA-N 438.515 4.267 10 10 IICE Cc1ccc(CC(=O)N2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)cc1 1464669786 IWASORUQOLSZCV-UHFFFAOYSA-N 429.564 4.238 10 10 IICE COc1ccc(C(=O)C[C@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952035 TXXRYTFHRYKXNR-JXFKEZNVSA-N 444.959 4.044 10 10 IICE Cc1nn(C)c(N2CCC2)c1NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1470666233 DIQXYIAHCUQEJJ-UHFFFAOYSA-N 442.361 4.361 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@H]1CNC(=O)OC(C)(C)C 1478840887 JZGXWIVDUSRYAQ-NQIIRXRSSA-N 432.609 4.081 10 10 IICE COCC1(C)CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1504619005 OHCKZGGZZKRGBC-UHFFFAOYSA-N 425.621 4.160 10 10 IICE CC(C)[C@@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1509072227 QPDCKDIHDICBEO-NRFANRHFSA-N 440.592 4.171 10 10 IICE CN(C)CC(C)(C)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1517017355 UCIRCYIGVSTCHF-TZIWHRDSSA-N 443.636 4.127 10 10 IICE COc1cc(F)c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(Cl)c1 1524066982 JNAPOGHRJYGWQL-LBPRGKRZSA-N 428.838 4.488 10 10 IICE Cc1cc(CC(=O)Nc2ccc3c(c2)S(=O)(=O)CC3)c(C)n1-c1ccc(Cl)cc1 1532902192 XFRIOJFFRMTUNI-UHFFFAOYSA-N 428.941 4.259 10 10 IICE Cc1cc(C(=O)N[C@H](CC(N)=O)C2CCCCC2)c(C)n1-c1cccc(Br)c1 1545212278 NAORDSBSPAUOQY-HXUWFJFHSA-N 446.389 4.411 10 10 IICE CCc1ccc(-c2nnc(N3CC(C)(OC)C3)n2CCCSc2nccs2)cc1 1546177495 BDWQBRSIYWIPAL-UHFFFAOYSA-N 429.615 4.372 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1564554504 ZEGOAKSRMXJLOX-RSXGOPAZSA-N 439.575 4.341 10 10 IICE CC(C)Oc1cc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)ccc1[N+](=O)[O-] 1567269769 ZXTHTPDNYIGQAL-UHFFFAOYSA-N 426.517 4.165 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)Oc1cc(Cl)cc(Cl)c1 1570514624 JJRJJYOKIBYTDK-CYBMUJFWSA-N 426.296 4.058 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C(=O)OC(C)(C)C)c(C)n1-c1cccc(C(C)C)c1 1584489672 FISQMBBBFWCEDM-QFIPXVFZSA-N 426.557 4.400 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)CCc1cccs1 1611964037 KACILLVFPTWSBB-UHFFFAOYSA-N 446.624 4.427 10 10 IICE C[C@H]1CCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)[C@@H]1C 1612838630 SARQRKFFLMMCRS-LSDHHAIUSA-N 428.943 4.482 10 10 IICE CCC[C@H](Cn1c([C@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1614395726 XBXRCHILPNKUQQ-IEBWSBKVSA-N 433.572 4.081 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCN(C)[C@@H](C(C)C)C2)sc(C)c1-c1ccccc1 1620509964 KWNJFKZMKHLTJY-LJQANCHMSA-N 443.613 4.111 10 10 IICE O=C(N[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1623543482 OBPMYCASIOIHOL-OWCLPIDISA-N 434.583 4.343 10 10 IICE CCOC(=O)[C@@H](CC)N(C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C1CC1 1625355903 CBPYWFBHDGXDNZ-GOSISDBHSA-N 448.361 4.198 10 10 IICE CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)c2cc3cc(O)c(O)cc3s2)ccn1 1630645159 UDVXNNBVCCSWDB-UHFFFAOYSA-N 449.488 4.420 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCN(c2cc(C)cc(C)c2)C1=O 1631167259 OAWYOJYKCSQRDM-IBGZPJMESA-N 445.357 4.173 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1CCCCN1Cc1ccccc1 1635940746 ILNJASHYBJIORR-DHIUTWEWSA-N 442.003 4.181 10 10 IICE COc1cc(/C=C\C(=O)NCc2c(O)ccc3ccccc23)cc(Br)c1O 1635965210 QSUVYNAWFRGSQW-TWGQIWQCSA-N 428.282 4.352 10 10 IICE CCc1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1OC 1636811203 DBRJVYCWSJSIQF-UHFFFAOYSA-N 432.523 4.078 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCCO[C@@H](CNC(=O)OC(C)(C)C)C3)c2C)c1 1638644657 UEDNORPVWONSKP-NRFANRHFSA-N 441.572 4.158 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@@H](c2cccnc2)C1 1639866346 QAFBTWLKCGXUIW-YAJBTMAUSA-N 443.619 4.141 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639898001 UDAHHYPGBBPOBN-QFBILLFUSA-N 432.362 4.283 10 10 IICE Cc1ncc(CNC(=O)CCSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)s1 1651743099 NGIVTTSFNWZBLT-SFHVURJKSA-N 442.610 4.293 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccccc3-c3ccccc3)CC2)c(OC)c1 1655379094 ZNLAWPJDVBMIOW-UHFFFAOYSA-N 431.536 4.132 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1C[C@H](C)OC(C)(C)C1 1707305532 CIBSOBRMWLLQQN-IBGZPJMESA-N 425.621 4.437 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cnn(C)c3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1751409442 CWMGZVZLUHWSNR-UHFFFAOYSA-N 443.477 4.285 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1cccnc1 1769684571 PDFNIJKZSVMLAH-UHFFFAOYSA-N 444.583 4.463 10 10 IICE CC[C@](C)(O)CN(Cc1ccccc1)c1ccc(CNCCOC)cc1Br 1915199332 WKESSNCVAWDNMP-QFIPXVFZSA-N 435.406 4.353 10 10 IICE C[C@@H](NCc1ccc(Br)cc1O)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116257367 SSLNKSHOPDGWJS-SJKOYZFVSA-N 425.323 4.492 10 10 IICE Oc1cc(Br)ccc1CNCCc1cccc(I)c1 2273845408 XWTDWHICOZVFEX-UHFFFAOYSA-N 432.099 4.092 10 10 IICE O=C1N=C(N2CCN(c3cccc(C(F)(F)F)c3)CC2)SC1=Cc1ccccc1O 2296124585 JQZOSHRFWALBRH-UHFFFAOYSA-N 433.455 4.204 10 10 IICE Cc1cccc(N2C(=O)C[C@H](N3C(=O)C(=Cc4ccc(Cl)cc4)SC3=S)C2=O)c1 2314832213 CDKWFMDEUHXLAP-INIZCTEOSA-N 442.949 4.182 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccc3c(c2)OCCO3)cc1 2332127400 UVLWBOMVTQHYMQ-UHFFFAOYSA-N 442.471 4.310 10 10 IICE Cc1ccc(CNC[C@@]2(F)CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352944583 JSLXGIQRZRJUTF-IBGZPJMESA-N 431.346 4.292 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)ccc1O 14459047 XYSAVTXIARQLBC-IXFSTUDKSA-N 426.538 4.012 10 10 IICE COc1ccc(N2CCN(c3ncccc3-c3nc(-c4ccc(C)cc4)no3)CC2)cc1 15669979 AISLFSBCNCPYAT-UHFFFAOYSA-N 427.508 4.442 10 10 IICE CCc1ccccc1N1C(=O)/C(=C\c2ccc(OCC(=O)O)c(OC)c2)SC1=S 16915038 PVXHDEPIBIDJER-WOJGMQOQSA-N 429.519 4.127 10 10 IICE Cc1cc(/C=C2/SC(=N)NC2=O)c(C)n1-c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1 34688798 KCBOLMMDUKXYFN-VCHYOVAHSA-N 435.465 4.328 10 10 IICE CCCn1c(N2CCCCCC2)c(/C=C2\SC(=S)N(CC)C2=O)c(C)c(C#N)c1=O 39990195 WXPXUDMUGUGXJJ-AQTBWJFISA-N 444.626 4.040 10 10 IICE Oc1c(Br)cc(Cl)cc1CNC[C@H]1CN(Cc2ccccc2)CCCO1 708170061 HCJRUTXATKKDBB-SFHVURJKSA-N 439.781 4.189 10 10 IICE COc1ccc(OC)c(N2C(=O)/C(=C/c3ccc4c(c3)CCCN4C)SC2=S)c1 726625918 QLIFPHSZWGIIDP-NDENLUEZSA-N 426.563 4.492 10 10 IICE CCN(CC)c1ccc(CNC(=O)N[C@@H](C)c2ccc(N3CCCC3=O)cc2)cc1F 731402960 AGAHBAPTVDJBGQ-KRWDZBQOSA-N 426.536 4.359 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@@H](c3ccc(Br)cc3)C3CC3)cc2)C1 774392549 PDUNCIXCGGENJR-DENIHFKCSA-N 442.401 4.392 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 775970781 DOMROLDUXQJERH-SFHVURJKSA-N 427.854 4.279 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(F)(F)Cc1ccccc1 793100203 AQVDIABSCKXCOC-UHFFFAOYSA-N 428.401 4.036 10 10 IICE C[C@@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1ccc(Br)cc1O 797103757 NVQNHJVTOBWCFN-LLVKDONJSA-N 426.742 4.092 10 10 IICE Oc1ccc(Br)cc1CNc1ncc(Cn2cc(Br)cn2)s1 804827895 FRRJOSULXWCIKL-UHFFFAOYSA-N 444.152 4.231 10 10 IICE COc1ccc2c(CC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)coc2c1 917712284 WLBYIHJKLNYKNE-HZPDHXFCSA-N 426.488 4.053 10 10 IICE COc1cc(/C=C2/C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)ccc1OC(C)C 1083927844 PFSGQBQKRTWLJR-UYRXBGFRSA-N 430.460 4.302 10 10 IICE CC1CC(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)(c2cccc(Cl)c2)C1 1125257652 OBHBEMXIFXEYRW-HTHJYTGDSA-N 439.987 4.026 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CCN(CC(F)(F)F)c3ccccc32)C1 1126705868 RFFAMGMXXVWCAG-OAHLLOKOSA-N 425.451 4.015 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Cl)c(F)cc3Br)C2)cc1 1130826898 MMYDROWYHAZVEL-LLVKDONJSA-N 427.701 4.259 10 10 IICE CCc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)o2)cc1 1133846954 ACQCMAGDNGDNIU-UHFFFAOYSA-N 431.536 4.141 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccccc1C(F)(F)F 1133847683 REOWKSRQZRFCQO-MRXNPFEDSA-N 447.501 4.217 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc(Cl)c(Cl)c1 1137816999 XQNAPINMILFAPV-UHFFFAOYSA-N 430.715 4.487 10 10 IICE CC(=O)NCCN(Cc1ccc(C)s1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1138774690 DMAUBKRGTFOUFC-UHFFFAOYSA-N 437.565 4.055 10 10 IICE CON(C[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1141446973 TYSVGHXNPVZWSN-HMJNCXCJSA-N 448.585 4.243 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@H]1c1ccccn1 1142285730 JENIAZUMOAMMRR-OWBBTNHHSA-N 441.553 4.176 10 10 IICE CCOC(=O)[C@@H](CC1(OC)CCC1)NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1164626735 MNOAYHBRWKUYPH-JOCHJYFZSA-N 426.557 4.332 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCC[C@H](NC(=O)OC(C)(C)C)C3)ccc21 1296625777 SYSZWAGROOKRDX-PMACEKPBSA-N 443.588 4.470 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccccc2SCC(=O)N2CCc3ccccc32)c1 1301046644 HEXKOXWWBAQPFG-UHFFFAOYSA-N 432.545 4.312 10 10 IICE C[C@H]1C[C@H](C)CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C1 1304916777 IETXDVJJVJBLPV-IRXDYDNUSA-N 428.631 4.385 10 10 IICE C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307695742 PAXSMBQMPAFLSB-IRXDYDNUSA-N 441.531 4.206 10 10 IICE COC(=O)[C@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@@H]1CCC[C@@H](OC)C1 1307891995 DUKKNMSIBPACRN-ODOSVJCGSA-N 438.528 4.377 10 10 IICE C[C@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)cc1Cl 1312761619 RRQOTPGTKFZOLL-LBPRGKRZSA-N 427.854 4.154 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(OC2CCOCC2)c(Cl)c1 1355636114 OHNNWGMDHUYGMI-UHFFFAOYSA-N 431.964 4.410 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3(c4ccc(F)cc4F)CCC3)cc2F)C[C@@H](C)O1 1357834710 AIPSURXRAVQYGK-HZPDHXFCSA-N 432.486 4.456 10 10 IICE CCOC(=O)[C@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 1361046808 MNDWJESNFAHBAJ-PJCCXHTNSA-N 443.547 4.469 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)CCC1CCOCC1 1361098446 UYLCEVHZXWBUNM-QHCPKHFHSA-N 441.620 4.195 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CC[C@@H](Nc2ccccn2)CC1 1444993314 ZPMQJLDYHZSVQM-OTWHNJEPSA-N 444.526 4.439 10 10 IICE Cc1ccc(C(=O)N2CCN([C@H](C)c3nccs3)CC2)cc1-n1c(C)cc(C=O)c1C 1447405378 GOCHBAKGYMYRDT-LJQANCHMSA-N 436.581 4.191 10 10 IICE CC[C@H](Cc1ccccc1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1459638667 FLNORJBOCHKHAO-LJQANCHMSA-N 426.516 4.354 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2NC(=O)OC(C)(C)C)cc1F 1465004505 OVVHEVVBBKXTEB-PZBISTMVSA-N 433.568 4.228 10 10 IICE CN(CC(=O)NCc1cc(Cl)cc(Cl)c1O)c1ccc(C(F)(F)F)cc1C=O 1468668954 ZLKVWJFHRBZGMO-UHFFFAOYSA-N 435.229 4.283 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)CC1CCN(C(=O)OC(C)(C)C)CC1 1470556476 WBUUFPTURGFUJX-LJQANCHMSA-N 446.636 4.281 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)CC(C)(C)C2)c1 1471013854 ZGUUKQBDBQRCCG-HOTGVXAUSA-N 435.565 4.187 10 10 IICE CCN(CC(=O)Nc1ccc(OC(F)F)cc1)Cc1cc(Br)ccc1O 1473190976 ITBMOHYRNHBUPQ-UHFFFAOYSA-N 429.261 4.217 10 10 IICE Cc1cc(CCNC(=O)NCc2ccnc(N3CCSCC3)c2)c(C)n1-c1ccccc1 1479056739 IDPAJBOESRDGPN-UHFFFAOYSA-N 449.624 4.084 10 10 IICE CC[C@@H](C)CN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1513099358 YNYLEPCSXUTWNR-LJQANCHMSA-N 427.637 4.315 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@H]3CCCC[C@H]32)sc2c1CCCC2 1522411122 PVIWKUGSIPOFPW-IMJJTQAJSA-N 432.586 4.216 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CC[C@@H](C3CC3)N2C(=O)OC(C)(C)C)C2CC2)cc1 1524793233 CPDUEDSSVDCWGI-VXKWHMMOSA-N 427.589 4.422 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nnn(-c4ccc(F)c(F)c4)c3C)c2C)c1 1534760649 VLWIHCCPXDRSGW-UHFFFAOYSA-N 435.478 4.500 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)CCCC1 1537509658 LVVQWKCIKPVBAZ-UHFFFAOYSA-N 446.956 4.224 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nn1-c1ccc(F)cc1 1545632055 ABYQTRNJCXOQNI-IBGZPJMESA-N 442.922 4.073 10 10 IICE Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(O)c2)cc1-n1c(C)cc(C=O)c1C 1545677975 MXDAALJYOKYUBI-UHFFFAOYSA-N 433.552 4.125 10 10 IICE Cc1cc(C(=O)NC(C)(C)COc2ncccc2C(F)(F)F)c(C)n1-c1ccccn1 1545935359 GSIQBSPDSSAQCI-UHFFFAOYSA-N 432.446 4.490 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCN(C(C)C)C(C)C 1546516950 XICPLUNIYLHWKT-UHFFFAOYSA-N 442.652 4.075 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3ccccc3cc2NC(=O)C2CC2)N(C)C)cc1 1558723125 IFTAEDOJKWYTNA-RUZDIDTESA-N 444.579 4.287 10 10 IICE CCOc1ccc(N(CC)CC(=O)Nc2cc(C(F)(F)F)ccc2-n2cncn2)cc1 1559635136 LRHALYMCUOAVMT-UHFFFAOYSA-N 433.434 4.150 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3C[C@@H]2O)c(C)n1-c1cccc(Br)c1 1566324644 JRNPKXHNUWDBMK-SFTDATJTSA-N 425.326 4.245 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ncccc32)c(C)n1-c1cccc(Br)c1 1587088099 JYHYADFVNVKNMT-UHFFFAOYSA-N 425.330 4.348 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)/C=C/c1ccc(S(C)(=O)=O)o1 1597567780 WCPMYSYWGWHYKA-VSOYFRJCSA-N 425.506 4.192 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@@H]3C)n2CCCOC(F)F)c(C)n1-c1ccccc1 1611935920 KBNLKIIICPEQNP-KRWDZBQOSA-N 445.514 4.207 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1615380557 CLIPFYYCPYYEAL-PKTZIBPZSA-N 441.620 4.275 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCC(C)(C)C 1616883845 DBROCUGEPGDDCX-UHFFFAOYSA-N 429.609 4.366 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccn1C1CCN(C(=O)OC(C)(C)C)CC1 1623574472 PHKFMJLMIJHLCQ-UHFFFAOYSA-N 448.560 4.181 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)c1 1625361771 SXHVTLHFIJRQKZ-UHFFFAOYSA-N 447.510 4.080 10 10 IICE CNS(=O)(=O)c1ccc(C)c(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c1 1625812394 OUXGYODYLARVSF-UHFFFAOYSA-N 425.554 4.180 10 10 IICE COc1ccc(N2CCN(CCNc3c([N+](=O)[O-])ccc(Cl)c3Cl)CC2)cc1 1639364448 ZBXZEJQGQAUCHI-UHFFFAOYSA-N 425.316 4.144 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)CCc3ccccc3)cc2F)C[C@@H](C)O1 1641707270 HTCWCKGIXHYHCT-BGYRXZFFSA-N 441.591 4.057 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@H]1CC[C@@H](C(N)=O)C1 1654253675 VLQFPZIIJQCMGG-ZRGWGRIASA-N 433.474 4.200 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](CN(C)Cc3ccccc3)C(C)C)CC2)cc1 1680395158 CFLKWSGMNJTDAF-RUZDIDTESA-N 438.616 4.074 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3c(ccc(Cl)c3Cl)C2)N(C)C)cc1 1687806762 KAPGQSMRQVYVLA-FQEVSTJZSA-N 435.399 4.430 10 10 IICE COc1ccc(-c2nnc(N3CCSCC3)n2CCCSc2nccs2)cc1 1697387164 ZWJWDAIONXFAES-UHFFFAOYSA-N 433.628 4.146 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1727216473 FRKGOBUENHIRPT-QGZVFWFLSA-N 444.599 4.076 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1ccncc1 1768104146 GWZZPFVQIMIYFA-UHFFFAOYSA-N 444.583 4.463 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CC(C)(C)SC)CC2)cc1F 1770259249 UMMKOOKMFYWCPT-UHFFFAOYSA-N 433.597 4.162 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H]3OCC[C@H]3C)CC2)cc1 1770259255 XHWQFOXBUIOHGP-DENIHFKCSA-N 441.620 4.017 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccccc4F)n4ccccc34)CC2)cc1 1858336403 VMFODSWMAOVAME-UHFFFAOYSA-N 430.483 4.111 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CCCCN2)sc(C)c1-c1ccc(Br)cc1 1866039125 SCICRIWCQYXXSH-CQSZACIVSA-N 437.359 4.353 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(Br)cc2O)C[C@H]1C1CC1 1895872826 BLQJFVBUWSVDHE-SJORKVTESA-N 425.367 4.422 10 10 IICE CCN1CCc2cc([C@@H](O)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999501443 AZNVCPJMWFXVGJ-JTHBVZDNSA-N 426.557 4.213 10 10 IICE CCOC(=O)c1c(CC)nn([C@@H](CC)c2ccc(C)cc2O)c1I 2079124350 GQSLZAPBMUSEOX-AWEZNQCLSA-N 442.297 4.240 10 10 IICE COc1ccc([C@H](n2nc(C(F)(F)F)c(C(=O)O)c2Br)C2(C)CC2)c(O)c1 2079844038 KBKVOBWLFWYNJU-ZDUSSCGKSA-N 449.223 4.466 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@H](CN[C@@H]2CCc3cccc(O)c32)C1 2084722315 OUAOOGCWCULYKX-FGZHOGPDSA-N 437.584 4.091 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c1O 2227748775 QKVHZXXLAKLRRB-HUUCEWRRSA-N 429.355 4.089 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2cccc(O)c2)SC1=S)Nc1ccc(O)cc1 2314831083 CCNHAZBMFGWBGJ-UHFFFAOYSA-N 442.562 4.498 10 10 IICE Cc1ccc(CNC(=O)[C@H](CNC(=O)OC(C)(C)C)C2CCC2)c(O)c1Br 2380723287 UUNMZUHRZUKYMG-OAHLLOKOSA-N 441.366 4.020 10 10 IICE CCOc1ccc(/C=C/C(=O)Nc2ccc3nc(N4CCOCC4)cc(C)c3c2)cc1OC 3649880 RBSRLSNLDOCVBG-UXBLZVDNSA-N 447.535 4.439 10 10 IICE O=C(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476240 HJGRQAURCQFWEW-DWKCODDLSA-N 435.480 4.036 10 10 IICE O=C1NN(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C/c1cccn1-c1ccc([N+](=O)[O-])cc1 33939495 FSQPFOVICRATBY-WOJGMQOQSA-N 443.246 4.154 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(Cc3ccccc3)C3CCCCC3)cc2)C1 745690778 DMNYEDGLTMCTDV-HSZRJFAPSA-N 448.611 4.433 10 10 IICE COc1cc(Cl)cc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1O 761215774 USLDFJJRWVAJRW-MRXNPFEDSA-N 440.931 4.409 10 10 IICE Cc1nn(C)c(C)c1[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)C(F)(F)F 782797154 ZGKDEPOPICAQGZ-LJQANCHMSA-N 425.499 4.327 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 802286408 SGOLUZPBKGXZGU-FQEVSTJZSA-N 437.519 4.117 10 10 IICE COc1ccc(Nc2ccccc2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 918138837 XOMYKEFJPUYOKP-UHFFFAOYSA-N 435.499 4.345 10 10 IICE CCCc1nc(C)c(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1129575184 SJXBYWKCNMZFPD-GZTJUZNOSA-N 448.541 4.409 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2cc(-c3cccnc3)nn2CCO)c1 1149087612 YADAUVAHTMIDKD-UHFFFAOYSA-N 435.915 4.251 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1 1290400994 NZCPNEQRMUYRAA-NRFANRHFSA-N 427.545 4.098 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C 1294684050 COBJNYRJBKWRHO-MRXNPFEDSA-N 443.382 4.443 10 10 IICE COCC[C@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1301519876 YPUNYESABSDELH-QGZVFWFLSA-N 443.592 4.047 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccc(F)cc2)c(C)n1-c1ccccc1Br 1303697279 ROQJWDQXKSZAPB-GOSISDBHSA-N 445.332 4.329 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305487554 HSHCFCKKFIAPQY-YJBOKZPZSA-N 441.555 4.120 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCN(C)[C@H]1c1cccs1 1306080545 MJBPYVOCZWOGFD-XMSQKQJNSA-N 425.602 4.327 10 10 IICE Cc1cc(C(=O)Cn2cc(Cl)cc([N+](=O)[O-])c2=O)c(C)n1-c1ccc2c(c1)CCC2 1307316428 HTBHCMVJBHEIML-UHFFFAOYSA-N 425.872 4.189 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CC[C@@H](C)C2 1348721129 WVTNNZHFJCQRBP-NVXWUHKLSA-N 440.565 4.037 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccsc1 1361097563 CVYHTPAAQYXGQM-UHFFFAOYSA-N 432.597 4.385 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3csc(COc4ccccc4)n3)CC2)cc1 1435026088 MRJMZOAISIUVBQ-UHFFFAOYSA-N 437.565 4.058 10 10 IICE CCCCN(CC)c1ccc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cc1 1438185768 NJAKWYWTJVLKDS-UHFFFAOYSA-N 425.573 4.293 10 10 IICE COC(=O)Cc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 1443633779 KRGCXGXLEPEPAM-UHFFFAOYSA-N 432.520 4.324 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCOc1cc(Cl)cc(Cl)c1 1451918783 QTKYTJYUMFMMTC-UHFFFAOYSA-N 426.296 4.060 10 10 IICE CC(C)(C)OC(=O)CN1CCC(Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)CC1 1472856090 YDASQUVZFOBBTB-UHFFFAOYSA-N 439.512 4.044 10 10 IICE CCOc1ccc(N2CCN([C@@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC2)cc1 1473296474 OVSHAAQNNWCIGQ-OAQYLSRUSA-N 433.474 4.032 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H](Cc3cnn(C)c3)C2)cc1 1501840782 PILMDIGKTSQPBJ-QFIPXVFZSA-N 449.647 4.174 10 10 IICE CC(=O)N(CCc1ccccc1)CC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1519550059 FKWSFCKHDMEQBZ-IBGZPJMESA-N 442.003 4.284 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(NC(=O)c4cccs4)c(C)c3)C2)cc1 1532106019 PPXVSAOAIPDSMD-SFHVURJKSA-N 435.549 4.326 10 10 IICE CCN(CC)C(=O)[C@@H](Cc1ccccc1)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1532695829 DFSGDOGUNBGVPN-RUZDIDTESA-N 431.580 4.233 10 10 IICE FC(F)[C@@H]1CCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1555975213 ZYKAIACFINDKSN-ZIAGYGMSSA-N 429.562 4.250 10 10 IICE Cc1ccc(C(=O)N2[C@@H](C)CN(C(=O)C(C)(C)C)C[C@@H]2C)cc1-n1c(C)cc(C=O)c1C 1556755918 YHTUHNXJDPLVCP-OALUTQOASA-N 437.584 4.323 10 10 IICE CSc1cc(C)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)o1 1565881318 AMJQGMGXLLUQFY-QGZVFWFLSA-N 433.574 4.372 10 10 IICE Cc1sc(-c2ccco2)nc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1566357250 ZUKSXWWTYGYWPH-MRXNPFEDSA-N 431.945 4.465 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC/C=C\c1ccccc1 1583747210 NITWXFCHRANZKH-XDMYZPJXSA-N 426.538 4.247 10 10 IICE Cc1cccn2c(NC(=O)CCCN3C(=O)/C(=C\c4cccs4)SC3=S)cnc12 1586286608 UXWAASXAXIFZFU-RVDMUPIBSA-N 442.591 4.324 10 10 IICE CC(C)(C)OC(=O)Nc1ncc(CCC(=O)NCc2ccc(N3CCCC3)cc2)s1 1595435778 KFQHZKAKHJJNEB-UHFFFAOYSA-N 430.574 4.339 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)CCS1 1614250888 SWNDTIOBYVEGGE-QGZVFWFLSA-N 446.671 4.235 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C/C=C\c3ccccc3)CC2)c1 1616912745 PSDYOACOGCLVJC-YFHOEESVSA-N 427.548 4.378 10 10 IICE CC(C)[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1617538606 GMENFQGBXICUEY-FUMQJTLXSA-N 445.554 4.182 10 10 IICE CN(C)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)C[C@@H]2CC=CCC2)cc1F 1617667616 QEQMAJVASGIDJP-LJQANCHMSA-N 434.563 4.310 10 10 IICE CC(=O)c1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1C 1618253098 KLCSXPKLROFBMF-QFIPXVFZSA-N 439.556 4.259 10 10 IICE C[C@H](OCc1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1618253670 PTYLCTYAKCCSTL-AVRDEDQJSA-N 441.572 4.040 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c(C)n1-c1ccc(F)cc1 1618294943 IEWCUHUTLZHRAS-INIZCTEOSA-N 434.433 4.232 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CC[C@@H]1C1CC1 1624892067 AIENTYJEKYJISO-RTWAWAEBSA-N 445.629 4.034 10 10 IICE Cc1cc(C(=O)N(C)CCN(C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1628578650 DAQCMBWHZDAIIE-UHFFFAOYSA-N 441.373 4.460 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2C[C@H](C)S(=O)(=O)c3sccc32)c1 1629189202 JUVFXCRSGORGPD-XOBRGWDASA-N 442.562 4.005 10 10 IICE CC(C)Oc1cc(Br)ccc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1630282736 IBPXIUZRWFTRAY-UHFFFAOYSA-N 447.373 4.127 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)nn2-c2ccccc2)cc1 1632681255 OEZYQQWSEUGITB-QGZVFWFLSA-N 443.503 4.320 10 10 IICE Cc1ccc(C(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1633708099 AUBFBOSRVYQINO-HXUWFJFHSA-N 437.584 4.230 10 10 IICE CC(C)(Cc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1633793817 KKURECUJWYVXDP-UHFFFAOYSA-N 445.401 4.295 10 10 IICE Cc1cc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CCCC2)c(C)n1-c1ccccn1 1634251347 NFGJILVUCBQPOV-FQEVSTJZSA-N 426.561 4.302 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](C)NC(=O)OC(C)(C)C)cc2Cl)C1 1634720232 RHHJJWPGNMMPLM-JKSUJKDBSA-N 439.000 4.289 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1nc(O)c2ccccc2c1C 1639827412 STQVSFOQNYAPSM-UHFFFAOYSA-N 435.524 4.251 10 10 IICE Cc1cc(C(=O)Cn2c(C)nn(C(C)(C)C)c2=O)c(C)n1-c1ccc(OC(F)F)cc1 1641043474 GALTXRLORFBLOE-UHFFFAOYSA-N 432.471 4.000 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc3nc(CC4CCCCC4)[nH]c3c2)c1 1641341558 OJCHBVMVQQEYDC-UHFFFAOYSA-N 442.541 4.015 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(F)nc2Br)c1 1645237028 JWYUZOIPZWMOAO-UHFFFAOYSA-N 430.277 4.133 10 10 IICE Cc1cc(CN2CCC[C@H](S(=O)(=O)Nc3ccccc3)C2)ccc1N1CCCCC1 1647757207 JHZWZDFIFQPHMU-QHCPKHFHSA-N 427.614 4.392 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1N[C@H]1CCN(CCCc2ccccc2)C1=O 1655228065 OMDSPMNHJVNSNL-DEOSSOPVSA-N 443.503 4.471 10 10 IICE COc1cc2c(c(OC)c1)N(Cc1nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o1)CCC2 1659015625 AFSLHYOFCIKNLN-UHFFFAOYSA-N 430.848 4.268 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3cccc(F)c3)C[C@@H]3CCCO3)C2)cc1 1686854781 CWADVAHRGXJBOJ-RDPSFJRHSA-N 441.547 4.051 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)COC)CCO1 1694919770 JVPHSGFOASNACZ-GCJKJVERSA-N 437.588 4.250 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCOC1CCCCCC1 1744547076 RHUKXWBYQUEWGE-UHFFFAOYSA-N 441.620 4.053 10 10 IICE COCCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)C1 1771267078 AFBJXHJLZBNHGM-LJQANCHMSA-N 437.588 4.252 10 10 IICE CC(=O)c1cccc(S(=O)(=O)N(CCc2c[nH]c3ccccc23)c2ccc(N)cc2)c1 1857991422 DNHDVFOHBUBGJG-UHFFFAOYSA-N 433.533 4.391 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@@H](NCc2c(O)cccc2Br)C1 1966034786 VGUSJHUZMFRHCU-KRWDZBQOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(F)C[C@@H](NCc2cc(Cl)cc(Br)c2O)C1 2042923050 YGTWSYPPDIFVAJ-LAUQKZGBSA-N 437.737 4.293 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@@H](N)c1ccc2c(c1)CCCN2C 2044759500 YYQLBADGRBIYMC-UPVQGACJSA-N 438.616 4.094 10 10 IICE CC[C@H](C)N(Cc1ccccc1)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080880875 PLABNHQNHAHUIG-PXNSSMCTSA-N 442.556 4.361 10 10 IICE CN(Cc1ccc(I)cc1)c1ccc(CO)cc1Br 2265600561 VCSWZQIQDRHTHF-UHFFFAOYSA-N 432.099 4.182 10 10 IICE CN1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)SC1=S 2293175982 BOGNQOVOBYHYNF-UHFFFAOYSA-N 425.285 4.448 10 10 IICE Cc1ccc(OCCOCCOc2cccc(C=C3SC(=S)N(C)C3=O)c2)cc1 2293452767 AJDBFUVRFSRPAU-UHFFFAOYSA-N 429.563 4.300 10 10 IICE C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(Br)cc3)o2)SC1=S 2295923771 VNJRMAWKUKKZSC-SECBINFHSA-N 438.324 4.383 10 10 IICE Cc1cccc(-n2c(C)cc(C=C3C(=O)NC(=S)N(c4ccccc4F)C3=O)c2C)c1 2313559268 VGTJXULBSOWIPO-UHFFFAOYSA-N 433.508 4.373 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1C=C1SC(=S)N(CC(C)C)C1=O 2314414904 QGOBKTIBKYIWMI-UHFFFAOYSA-N 444.626 4.462 10 10 IICE Cc1ccc(CN(C)C(=O)CC[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352669007 ZTOFXESAYVEVHX-ZDUSSCGKSA-N 429.355 4.115 10 10 IICE CC[C@H](N[C@]12CO[C@H](C1)[C@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2359243388 IWCCMSNPVTUPKI-VZHLBOQGSA-N 441.366 4.020 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C\c1cc(C)c(OCC(=O)O)c(Br)c1 96484269 SLCCVDGMGAFLNE-SXGWCWSVSA-N 429.270 4.027 10 10 IICE CC1=NN(c2ccc(I)cc2)C(=O)/C1=C/Nc1ccc(O)cc1C 101123617 WTVOQGXWIHTBKS-MHWRWJLKSA-N 433.249 4.024 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)/C=C/c2cnc3ccccc3n2)c2ccccc2C1 728004409 MEESKWJSEMJGNG-OUKQBFOZSA-N 430.508 4.427 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3cccc4ccccc34)cs2)cc1 733731489 NKPNENDDOSLPDR-UHFFFAOYSA-N 438.530 4.480 10 10 IICE C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742754897 RNCSEKCGQQEYKW-PGRDOPGGSA-N 425.573 4.313 10 10 IICE COc1ccc([C@H](C)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1F 743506085 KIFGKXYCLAOCHR-GOEBONIOSA-N 437.462 4.465 10 10 IICE CO[C@@H](C)c1nc(C)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 749402915 RRFWSXQVPPWNHF-UONOGXRCSA-N 425.501 4.159 10 10 IICE CNC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc1 769115577 HJBFXGOASHOUOJ-UHFFFAOYSA-N 448.378 4.339 10 10 IICE C[C@H]1CCCN(c2ccc(CNS(=O)(=O)Cc3cccc([N+](=O)[O-])c3)cc2Cl)C1 800148488 MKMKAMKTRSMGFG-HNNXBMFYSA-N 437.949 4.104 10 10 IICE COc1cc(F)c(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)c(Cl)c1 1125997216 HHRKBFIKSQSPMC-UHFFFAOYSA-N 441.890 4.232 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3csc(-c4ccccc4Cl)n3)C2)cc1 1130826934 NRWSKKJZKLPEBK-OAHLLOKOSA-N 427.957 4.410 10 10 IICE COc1ccccc1[C@H](C)N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)OC 1176310403 DELVLXFVLQAPHF-INIZCTEOSA-N 444.487 4.034 10 10 IICE CCCCN(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1Cl 1190751852 GQZWMKFFFOOKKS-UHFFFAOYSA-N 447.982 4.234 10 10 IICE C[C@H]1CCCC[C@@H]1OCCNC(=O)CN(Cc1cccs1)c1ccc2c(c1)OCCO2 1191581692 IHTYYGAIUJMVIL-RXVVDRJESA-N 444.597 4.237 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4cccc(OC)c4)CC3)C2)cc1 1230300965 NDUSANBKNVDVPQ-JOCHJYFZSA-N 437.584 4.194 10 10 IICE COc1cc2c(cc1OC)[C@H](NC(=O)NCc1cccc(Br)c1O)CCCC2 1246270425 SQYZJIAVNOGZLT-QGZVFWFLSA-N 449.345 4.439 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H]3O[C@@H](c4ccccc4)C[C@H]32)N(C)C)cc1 1256237380 YPXYRROHZFJDDW-ZFFYZDHPSA-N 436.600 4.060 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cnc(Nc2ccccc2)nc1C(F)(F)F 1265456888 ALORGDKJXRPIII-UHFFFAOYSA-N 443.429 4.344 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCOc2ncc(Cl)cc2Cl)CCCC1 1266044994 GMKOZGDUNFXHNC-UHFFFAOYSA-N 448.350 4.426 10 10 IICE CN(C)[C@H]1CCc2cc(Br)ccc2N(C(=O)/C=C/c2ccc(Cl)nc2)C1 1280507424 KEGFEVQSUVOAKE-COKXLDBZSA-N 434.765 4.420 10 10 IICE CC(C)c1nnc(N2CCC(c3cnn(C)c3)CC2)n1CCCSc1nccs1 1287196574 MARDASLZXKIWTO-UHFFFAOYSA-N 431.635 4.158 10 10 IICE C[C@H](CN(C)c1nnc(CC2CC2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1288591807 BTVNESQIRNHFIJ-OAHLLOKOSA-N 428.581 4.180 10 10 IICE CCCCN(C)C(=O)C1CCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CC1 1291780422 YHBDUDOINYYWRA-UHFFFAOYSA-N 439.600 4.026 10 10 IICE CCc1nnc(N(Cc2ccco2)C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1306099781 HGQOYGVREAKPGK-UHFFFAOYSA-N 425.602 4.450 10 10 IICE C[C@@H](CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(Br)cc1 1313356969 VZDWUUQFRQUDTC-HRAATJIYSA-N 447.421 4.221 10 10 IICE COc1cc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc(Br)c1OC 1349118969 PLZNLBOWWQGPHL-UHFFFAOYSA-N 433.346 4.339 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4ccc(OC)cc4s3)cc2F)CC1 1360093682 KLUJACFANNUFKP-UHFFFAOYSA-N 427.545 4.121 10 10 IICE COCc1nc(C(=O)N(C)CCN(C)c2ccc(OC)cc2)c(-c2ccccc2)s1 1437385340 YBMHDNIJRPBAHE-UHFFFAOYSA-N 425.554 4.174 10 10 IICE COc1cc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cnc1Br 1438177088 KITOLWIDPJARMQ-UHFFFAOYSA-N 428.330 4.233 10 10 IICE Cc1cc(CCNC(=O)[C@H](C(C)C)N2Cc3ccccc3C2=O)c(C)n1-c1ccccc1 1438178789 OUITVCCPRPKLDE-VWLOTQADSA-N 429.564 4.433 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)[C@@H]1CC1(Cl)Cl 1439869986 IBDFLKZTPJAWMA-JTQLQIEISA-N 426.101 4.291 10 10 IICE Cc1ccc(-n2nc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c3c2CCCC3)cc1 1439960694 NNOYLGDBWPVHIR-VWLOTQADSA-N 445.611 4.158 10 10 IICE COc1ccc(O)c([C@H](C)N[C@H]2CCCN(c3ccc(Br)c(C)c3)C2=O)c1 1459850556 NEYFFBBZFWLYMZ-LIRRHRJNSA-N 433.346 4.318 10 10 IICE COc1ccc(N2CCN([C@H](C)c3nc(-c4ccc(Cl)cc4)no3)CC2)c(OC)c1 1460650438 IVBHJLYEBNVNKB-OAHLLOKOSA-N 428.920 4.290 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1463814695 RQJZUBUPFLIAMK-HSZRJFAPSA-N 437.584 4.381 10 10 IICE Cc1c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)nc(O)c2ccccc12 1464696658 OLAWDIIUJDSJGM-UHFFFAOYSA-N 427.451 4.249 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1467497477 IEGKOKRKWRACIO-QGZVFWFLSA-N 426.504 4.413 10 10 IICE Cc1cc(CNC(=O)NCCNc2ncccc2C(F)(F)F)c(C)n1-c1ccccc1 1479100014 RMWLVMKKBSDGLM-UHFFFAOYSA-N 431.462 4.419 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CCNc1ncc(Cl)cc1Cl 1503487833 OJRVSXXHGJGHFS-UHFFFAOYSA-N 433.343 4.311 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCCNc1ccccn1 1503488277 SICJZGZUBVLPMF-UHFFFAOYSA-N 449.946 4.233 10 10 IICE CC(C)Cc1nnc(N2CCS[C@@H](C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1509234177 PDPSXIJVULNWRQ-OALUTQOASA-N 445.702 4.408 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccc(OC)cc3)n2CCCSc2nccs2)CCO1 1514143977 YATMDUUWVMLNAB-KRWDZBQOSA-N 445.614 4.208 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1526246042 AMPWVIBVDINMDE-RDJZCZTQSA-N 449.364 4.418 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(O[C@@H]2CC2(F)F)cc1 1530287879 JOAMYBMVSKTKLW-LJQANCHMSA-N 438.421 4.473 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(Cn4cc([N+](=O)[O-])cn4)cc3)c2C)c1 1535136259 JCWFYBZGNNICQJ-UHFFFAOYSA-N 443.507 4.486 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(-c4cccc(Br)c4)no3)ccc21 1542390021 WJXWZDAKIDEWAD-UHFFFAOYSA-N 426.314 4.417 10 10 IICE Cc1ccc(N2CCC[C@H](NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1544851003 JRSZLEYKPSAIOP-DEOSSOPVSA-N 429.520 4.140 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](CN3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1545424637 FAXSMHXWLPIRJA-FPOVZHCZSA-N 442.627 4.357 10 10 IICE CCOC(=O)c1csc([C@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)n1 1564945949 IQOZGTIYQJIYMB-OXJNMPFZSA-N 444.601 4.172 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCNC(=O)[C@@H]3c3ccccc3C)c2C)c1 1565193253 SZHQZCTWKVSSHA-DEOSSOPVSA-N 430.552 4.094 10 10 IICE CCC(CC)n1nccc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1586619809 NOWDBNUKHQBWRB-HXUWFJFHSA-N 443.592 4.306 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)cc1F 1627604534 LHBUCFZBQYYDTK-UHFFFAOYSA-N 441.934 4.465 10 10 IICE CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1637228864 PPXPKQCFPQOVRI-HSZRJFAPSA-N 425.548 4.265 10 10 IICE CN(CCCOc1cccc(Cl)c1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1638918465 VPGITPPMWHIRFH-QFIPXVFZSA-N 432.996 4.119 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(I)cc2)CC2CC2)cc1 1643139865 KQLBBHRTHCQSIJ-UHFFFAOYSA-N 436.293 4.155 10 10 IICE COc1ccc(C)cc1CSCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1643791453 WTJIJYQSENDERS-QZTJIDSGSA-N 446.588 4.306 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCOc3c(Cl)cc(Br)cc3C2)cc1 1648446046 QYINLBZSWWWAHL-UHFFFAOYSA-N 437.681 4.300 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1649579212 JGXXOGXOIUOTQW-OAQYLSRUSA-N 437.588 4.129 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C(C)C)cc1 1657673116 SVVYHEZHKANSRZ-WOJBJXKFSA-N 427.564 4.279 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(CCN4CCCC[C@H]4C)CC3)C2)cc1 1686854726 AOHGBOVRAXUWTD-GGAORHGYSA-N 442.648 4.208 10 10 IICE CC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)CC)C1 1709259537 AARGGCPRKYPCCD-NRFANRHFSA-N 448.615 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCCO[C@@H](C)C2)cc1 1710025522 CTSHFRHZNMMPGJ-FQEVSTJZSA-N 434.588 4.158 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccccn3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1724198157 LRVFRRYZPDGPIM-FQEVSTJZSA-N 443.599 4.334 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](Cc3cnn(C)c3)C2)n1CCCSc1nccs1 1726933161 SUBJWLRMCGDJFL-IAGOWNOFSA-N 445.662 4.233 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@H](C)N(CC)C[C@H]2C)cc1 1728379083 GFOFJFRSXBMRAX-LEWJYISDSA-N 449.647 4.097 10 10 IICE CCOCCN(CC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1729144791 ZXXOHRPUMVFLAY-UHFFFAOYSA-N 431.650 4.040 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O)OC 1743537821 ISGCHQGJBFDCQF-FOIQADDNSA-N 429.590 4.037 10 10 IICE CCOCc1nnc(N2CCC(C)=C(Br)C2)n1Cc1ccc(N(C)C)cc1C 1767822660 VRAFWYGLDUTCQZ-UHFFFAOYSA-N 448.409 4.116 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N([C@H](CC(C)C)C(=O)O)C3=O)n12 1858592139 HTSTXLPCQHOXMB-QZULDAKNSA-N 429.976 4.058 10 10 IICE CC(C)CN1C(=O)c2ccc(C(=O)Nc3c(Cl)cc(Cl)cc3C(=O)O)cc2C1=O 1865877630 LSHIHSRPLJQTBJ-UHFFFAOYSA-N 435.263 4.196 10 10 IICE CN(C[C@H](O)COCc1ccccc1)c1ccc(CNC(C)(C)C)cc1Br 1916393300 GTBVMPLDEFQLKV-IBGZPJMESA-N 435.406 4.351 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCc1ccccc1)c1cc(Cl)cc(Br)c1O 1951971841 WNIGZMQSMGJDGP-SFHVURJKSA-N 442.693 4.424 10 10 IICE CC[C@H](NC1CC(COC)(NC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2152880154 WUDVDWYEBVQCAW-FXUPRZHBSA-N 443.382 4.268 10 10 IICE CC[C@@H](C)N1C(=O)C(=Cc2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 2296546082 LRCPGRFVERWDAJ-CQSZACIVSA-N 430.599 4.071 10 10 IICE CN(C)c1ccc([C@H](N)Cc2ccc(I)c(Br)c2)cc1 2377346315 YNHBMEKSOKGGKM-MRXNPFEDSA-N 445.142 4.362 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(C(C)=O)c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526432811 HCDSGGBPSPRHEJ-HSZRJFAPSA-N 431.444 4.366 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)NCc1ccc(N2CCOCC2)cc1 727756153 RUUGYDOJKRHDGS-FMIVXFBMSA-N 431.536 4.190 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCCC[C@@H]3CNC(=O)OC(C)(C)C)ccc21 728519215 ZCCDFHKRAJJQHW-HXUWFJFHSA-N 443.588 4.424 10 10 IICE Cc1cc(C(=O)CSc2nccn2Cc2ccccn2)c(C)n1-c1ccc2c(c1)OCO2 733082006 IAEZLYVPYLYAGG-UHFFFAOYSA-N 446.532 4.438 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)c1 743672256 HFNKKZPXYJVYML-HNAYVOBHSA-N 429.517 4.027 10 10 IICE C[C@@H](NC(=O)c1ncc(Br)cc1Br)c1ccc(N(C)C)cc1 773987742 HALQEWKQCNHLLU-SNVBAGLBSA-N 427.140 4.164 10 10 IICE CCOC(=O)c1csc([C@@H]2CCCN2Cc2c(O)c(C(=O)OC)cc3ccccc23)n1 790484001 RYCSSTXFQYHXEM-IBGZPJMESA-N 440.521 4.302 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)/C=C/c1cnc2ccccc2n1 791248373 OCGWVGGDWFTQNC-JXMROGBWSA-N 432.524 4.032 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC(C)(C)C(F)(F)F)NC(=O)OC(C)(C)C)cc1 795136199 HHPZYUTZANSQSF-MRXNPFEDSA-N 431.499 4.413 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)c(C)n1-c1ccccc1 797414009 KWCZZXOYZTYDNN-ZYLNGJIFSA-N 425.573 4.005 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)NC(=O)OC(C)(C)C)cc1 798279110 FLGGGOWRZZVUMY-BHDDXSALSA-N 441.547 4.377 10 10 IICE CCOc1ccc([C@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 918200104 XIURMZFHQMXBTC-BZSNNMDCSA-N 429.536 4.398 10 10 IICE Cc1ccc(-n2nc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)cc2C)cc1 1125259277 ZFWAJRGTIHTYIV-RTBURBONSA-N 436.531 4.172 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(N3CCC(C)CC3)nc2)c1 1141798310 GYWGMPJWZFHDJP-UHFFFAOYSA-N 430.552 4.468 10 10 IICE Nc1cc(Cl)c(Cl)cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1141815670 UEBQOWBUMLLMSP-UHFFFAOYSA-N 448.272 4.361 10 10 IICE Cc1cc(=O)oc2cc(N(C)C(=O)/C=C\[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc12 1157108365 XZEUSJMIDHOQGP-NLZINVLXSA-N 426.513 4.268 10 10 IICE COc1ccc2c(c1)c(C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c(C)n2C1CC1 1158718419 XPNMRAHDSZASEV-XMMPIXPASA-N 434.584 4.392 10 10 IICE COc1ccc(N(CC(=O)NCCOc2cccc(Cl)c2)Cc2ccco2)cc1F 1167680421 DGZSJCXYVLNESQ-UHFFFAOYSA-N 432.879 4.283 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C(F)(F)c1cc(Cl)ccc1OC 1295590002 BLSHJSFLKZVJTK-UHFFFAOYSA-N 448.249 4.001 10 10 IICE CC(C)(C)OC(=O)N1CCC(C(=O)NCc2c(O)cccc2F)(c2ccccc2)CC1 1303877984 KGYVYWFGOGUBGO-UHFFFAOYSA-N 428.504 4.116 10 10 IICE Cc1cc(CNC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1313134466 ZXTGVHRAPQJVOG-UHFFFAOYSA-N 426.561 4.293 10 10 IICE CCOCc1nnc(N2CCC[C@H](OCC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1314372344 QLUWFLRWODSIHF-QHCPKHFHSA-N 441.620 4.105 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1355131777 ZHSQNNIMNZFTFZ-IYBDPMFKSA-N 440.494 4.003 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)ccc1N1CCOCC1 1358433799 SHOROAZVWWXVNP-UHFFFAOYSA-N 433.552 4.333 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1noc2c1CCCC2 1436982743 YWCCLKKRHKHHPT-WQRHYEAKSA-N 446.525 4.027 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)OC(C)(C)C 1445654255 JOGMFYOGEUZUCX-KRWDZBQOSA-N 428.533 4.001 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCCC[C@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)c1O 1460387932 LARCOSXPKSRHEA-KSSFIOAISA-N 446.897 4.404 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCC1(C)C 1516454071 GHAIABXTPKBGRG-OAQYLSRUSA-N 441.620 4.114 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC[C@H]1CCc2ccccc21 1521696654 XPQDNBHNDUGDOR-UOBPLZBXSA-N 440.565 4.263 10 10 IICE C[C@@H](NC(=O)c1ccc(Cn2cc(Br)cn2)cc1)c1ccc(N(C)C)cc1 1537680596 YZTMIGINOHMCAS-OAHLLOKOSA-N 427.346 4.251 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCNC(=O)c3ccc(F)cc3)cc2Cl)C1 1539912712 LMMWBFWZSIVJRB-INIZCTEOSA-N 431.939 4.152 10 10 IICE CC(C)[C@@H](Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1541309118 HJTBBJXFTCCEOX-HSZRJFAPSA-N 442.567 4.441 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(-c4ccccc4Cl)n3)CC2)c(OC)c1 1543631430 BVLUPPFEWWCLDQ-UHFFFAOYSA-N 443.956 4.443 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(c4ccc(C(C)C)cc4)CCC3)CC2)cc1 1544314964 JYQCFHPDLYTRCS-UHFFFAOYSA-N 435.612 4.179 10 10 IICE COc1cc(CN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)C2CC2)ccc1O 1545679990 JUIDQUMTGMSKDS-UHFFFAOYSA-N 432.520 4.355 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCc3nn(C)cc32)c(C)n1-c1ccccc1Br 1556371691 HRUJVGHPWBRAOJ-SFHVURJKSA-N 427.346 4.398 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cc1-n1c(C)cc(C=O)c1C 1568471141 AWDRGKUVNKLDKS-KDURUIRLSA-N 446.551 4.476 10 10 IICE COc1ccc(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)n[nH]2)cc1 1570906134 ISAHPJROCGVPTR-UHFFFAOYSA-N 432.446 4.356 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 1586261728 YMNUIITZWRWIJY-MXVIHJGJSA-N 439.556 4.472 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1 1623451508 GBYCUVBOWJZJES-UHFFFAOYSA-N 431.920 4.017 10 10 IICE C[C@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCC(Cc2ccccc2)CC1 1623641596 WEOUNNBJFZKCJT-PXDATVDWSA-N 436.596 4.243 10 10 IICE CCc1cnccc1[C@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1624023005 MZUSZPTWQHNCFS-YQNUULROSA-N 443.569 4.252 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)Cc3ccccc3C)CC2)c1 1627718657 SWJQNBGORZVRSD-UHFFFAOYSA-N 429.564 4.238 10 10 IICE Cc1cc(Br)c2oc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc2c1 1630287559 FTRRRXUPFGQCFZ-UHFFFAOYSA-N 443.341 4.395 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CCOCC2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1631241107 YODUUYPIHPFXNO-QFIPXVFZSA-N 430.976 4.435 10 10 IICE Cc1ccc(C(=O)NCc2ccncc2Br)cc1-n1c(C)cc(C=O)c1C 1631859800 LIRLXZMBPYJEMG-UHFFFAOYSA-N 426.314 4.303 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)Cc2ccccc21 1636058599 JFXIYXFGYUVVHU-SFHVURJKSA-N 431.529 4.029 10 10 IICE CC(C)(C)OC(=O)NCc1ccccc1C(=O)NCc1cccc(Br)c1O 1640087910 MUTRWKDJNCUTHX-UHFFFAOYSA-N 435.318 4.109 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N(C)[C@H]1CCCC[C@@H]1C 1640759337 PXCPHBYNXWFMPC-WMZOPIPTSA-N 429.586 4.470 10 10 IICE CC(C)(C)OC(=O)N(CCC(=O)Nc1c(-c2ccccn2)nc2ccccn12)CC1CC1 1641972148 MLNFZTKFRARAHL-UHFFFAOYSA-N 435.528 4.372 10 10 IICE COc1ccc(N2CCN(CCNc3nc4c(Br)cccc4s3)CC2)cc1 1642160950 LAVRRXJQQTWLKJ-UHFFFAOYSA-N 447.402 4.302 10 10 IICE CC(C)c1ccc([C@@H]2CCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1645165996 FUQYOVKZGTUTEO-DEOSSOPVSA-N 439.575 4.239 10 10 IICE CC[C@@]1(C(C)C)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(SC)c3)c2C)C1=O 1652650832 HTYIMZVMQLVFRL-QHCPKHFHSA-N 427.570 4.355 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3cc(F)ccc3F)cc2Cl)C1 1672138000 ZYYKKOCTJSFSRP-VLIAUNLRSA-N 437.918 4.387 10 10 IICE O=C(NCc1cccc(Cl)c1O)N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1672931131 DLKGUNWVGDLNID-CQSZACIVSA-N 432.858 4.002 10 10 IICE CC(C)[C@H]1c2ccccc2CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683018058 CTBLUNBUGMBFMZ-QFIPXVFZSA-N 429.511 4.266 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@]3(C)Cc3ccc(F)cc3)C2)cc1 1683504570 XJHSIBVRQMTZPG-NLFFAJNJSA-N 425.548 4.467 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]([C@@H]1C)N2C(=O)OC(C)(C)C 1687270506 FRYKVFWEEMELAY-CIQXWFTPSA-N 444.620 4.461 10 10 IICE CCN(c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1)[C@H](C)C1CCC1 1695547212 XGFOMXSKZBNJEP-OAHLLOKOSA-N 431.635 4.332 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1)C(C)C 1697148387 KMDJIRJFYGDICK-HSZRJFAPSA-N 437.588 4.250 10 10 IICE CCN(CC)C1CCN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)CC1 1710042031 CPQJUJZRRAWXNK-UHFFFAOYSA-N 435.620 4.007 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1726902896 AWIYDXAYEJPJCA-GBESFXJTSA-N 429.584 4.440 10 10 IICE C[C@H]1CC[C@@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1742981101 NOPISLQTJDUBCQ-UXHICEINSA-N 439.648 4.457 10 10 IICE CC(C)[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1760966565 QOSOFALWZRBMBV-JOCHJYFZSA-N 429.584 4.125 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1761960126 DKIGXFXWXPVZTL-DLBZAZTESA-N 440.592 4.232 10 10 IICE C[C@H]1CCCN([C@H](C)Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1762883764 HIYLLKSRSTVHTJ-RBUKOAKNSA-N 439.629 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)C[C@H]2CCCCO2)cc1 1764935682 UVCOBRZOIPJZAZ-HSZRJFAPSA-N 434.588 4.240 10 10 IICE CO[C@@H](Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1768095794 XRRYTNNBDYKUBZ-QHCPKHFHSA-N 434.588 4.248 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1c(O)cccc1O 1952825543 LRNVROMKKHHBOG-YADARESESA-N 445.471 4.495 10 10 IICE CN(C)C(=O)CN(Cc1ccccc1)c1ccc(CNC(C)(C)C)c(Br)c1 2152241730 XANVHEFJSLNVKW-UHFFFAOYSA-N 432.406 4.432 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OCc1ccc(F)cc1 2293185145 LVHCNVDGVLSKAK-UHFFFAOYSA-N 446.434 4.080 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(c3ccc(OC)cc3)C2=O)c1)C(=O)O 2314930640 GZEFGHSOCZIIFZ-QGZVFWFLSA-N 429.519 4.343 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C)cc3C)C2=O)ccc1OCC(=O)O 2314932762 PLSUCPCEUBWEPB-UHFFFAOYSA-N 429.519 4.181 10 10 IICE CC(C)Oc1cccc(C=C2SC(=S)N(c3ccc4c(c3)OCC(=O)N4C)C2=O)c1 2318753405 UYTANLLHOPALTE-UHFFFAOYSA-N 440.546 4.235 10 10 IICE CCC[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352943227 QBJKEGUBIIMYLX-AWEZNQCLSA-N 429.355 4.020 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550809 WKGVFLPSQQEGBS-OPYAIIAOSA-N 427.526 4.498 10 10 IICE Cc1cc(Br)ccc1N1C(=O)/C(=C\c2ccc(N(C)C)cc2)C(O)=NC1=S 33321813 ZMVWGWXNEQETNF-WJDWOHSUSA-N 444.354 4.495 10 10 IICE Cc1cc(C)c(/N=N/c2ccc3c(S(=O)(=O)O)cccc3c2O)c(S(=O)(=O)O)c1 38191580 BDUVDVIOZOTUGM-FMQUCBEESA-N 436.467 4.071 10 10 IICE Cc1cccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)c1 47152304 PULZERKSZUACNX-GPLLRDDGSA-N 427.507 4.132 10 10 IICE CC(C)CC[C@H](N)c1cc(I)cc(I)c1O 95769147 JTRFZWJIYWEFSH-NSHDSACASA-N 445.082 4.037 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(O)cc3)SC2=S)cc1 210699740 VNARDLRKLNHCQB-QGOAFFKASA-N 428.535 4.021 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(C(C)=O)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526263322 AIWMBHRYNNZUJB-HSZRJFAPSA-N 431.444 4.366 10 10 IICE C[C@](Cc1ccc(O)c(O)c1)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 723259880 WRIYRSHCZBPMDQ-RUZDIDTESA-N 433.460 4.022 10 10 IICE C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)NCc1ccc(N2CCSCC2)cc1 746750804 CGYBKPIWHOXCSU-NRFANRHFSA-N 438.641 4.046 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 768239995 YGDDBXFXZWIXIF-RBBKRZOGSA-N 447.595 4.274 10 10 IICE CC(C)N1CC[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1c1ccc(F)c(F)c1 778826322 ISWMTRWBWMZVLR-PKTZIBPZSA-N 430.543 4.396 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1sc([C@@H](C)OC)nc1C 791246235 KERUVEAOBLVHHM-OAHLLOKOSA-N 433.574 4.161 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)c(O)c1 794379888 UJGSULVGOPHTLO-RVHYNSKXSA-N 442.943 4.144 10 10 IICE COc1cc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)c(OC)c1 800575669 MCCNNKZNSMNBJT-UHFFFAOYSA-N 435.471 4.404 10 10 IICE C[C@@H]1C[C@H](NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CCS1 1134491332 CFMCQMAODFCIJV-ZBDODSLASA-N 426.654 4.130 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Nc4ccccc4OC)cc3)CC2)c(OC)c1 1169989106 BAFJMZBYBMYOEI-UHFFFAOYSA-N 447.535 4.418 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCCc3c(C(F)(F)F)[nH]c4ccccc34)C2)cc1 1230857501 CCTAICPLUGARTI-HNNXBMFYSA-N 446.473 4.316 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1291692396 JMEJNSITAUZYHA-GBESFXJTSA-N 429.634 4.007 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H](C)N2Cc3ccccc3C2=O)cc1 1293122535 HSWCRIWDRYCUKI-LJQANCHMSA-N 443.547 4.339 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCOc1cccc(Cl)c1Cl 1299697956 CKCGELJXKRSTDI-UHFFFAOYSA-N 440.323 4.450 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCc1cnn(C)c1 1305384735 UZRFKYZGQBKLIG-FQEVSTJZSA-N 435.620 4.395 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 1312529775 WEWYHIPZQJGMDR-PMACEKPBSA-N 430.593 4.264 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F 1351673991 OLQHCOJGYCQWTF-UHFFFAOYSA-N 447.436 4.298 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4ccc(OC)c(OC)c4)CCCC3)C2)cc1 1436968471 CFOOHUGDNJMQDZ-IBGZPJMESA-N 438.568 4.167 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(Br)c4ccccc4c3)cc2)CC1 1438887592 REFJRILPKDSYDB-UHFFFAOYSA-N 438.369 4.284 10 10 IICE CC(C)n1cc(Cl)c(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 1439378537 OIXZPUQIGNVHGW-UHFFFAOYSA-N 438.827 4.053 10 10 IICE Cc1cccc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)c1C 1456089162 PETOEQUABZAIPS-IBGZPJMESA-N 447.501 4.313 10 10 IICE Cc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1NC(=O)OC(C)(C)C 1463281132 LIJPINJTHMLQKC-JOCHJYFZSA-N 440.588 4.441 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](c3ccc(F)cc3)N3CCOCC3)c2C)c1 1463831693 WFHSBRCMBPRFEU-RUZDIDTESA-N 435.543 4.345 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1466290171 SAUBAJLIGKACOI-IHPCNDPISA-N 434.577 4.229 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CO)c3ccccc3OC(F)(F)F)c2C)cc1 1467754783 JWHQBERHUQDHMI-FQEVSTJZSA-N 448.441 4.465 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@](C)(Cc2ccccc2)[C@@H](C)O)cc1 1467801824 AXYNWIXEVTYTLI-JIPXPUAJSA-N 432.564 4.195 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](c1ccc(F)c(F)c1)c1nccn1C 1470556391 TYTCGLMVFBYHGM-ZHRRBRCNSA-N 441.526 4.093 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCCCCCNC(=O)CC3)cc2Cl)C1 1478528404 OJMOJYYEOPIULA-SFHVURJKSA-N 435.012 4.168 10 10 IICE Cc1csc(CN(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)c1 1492648124 KLEXPKXNTMHODL-HXUWFJFHSA-N 429.565 4.389 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCO[C@H](COC(C)C)C3)nnc2C(C)(C)C)cc1 1501847363 LRSCGBDZSGAXAC-QFIPXVFZSA-N 443.636 4.100 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CC4)n3CCCCCSC)CC2)cc1F 1504297285 WDRPVGWKCYZNHM-UHFFFAOYSA-N 433.597 4.163 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)cc2C)C1 1504480288 DGNHCBZLDMYRCO-HXUWFJFHSA-N 440.979 4.031 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C(C)(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1511697454 OEWLFYUZCONHOS-QFIPXVFZSA-N 449.647 4.435 10 10 IICE CCCN(C)c1nnc(-c2cc(Br)cn2C)n1Cc1ccc(N(C)C)cc1C 1514566789 KULZPXVQXSWMSU-UHFFFAOYSA-N 445.409 4.315 10 10 IICE COc1cccc(-c2nnc(N3C[C@@H](C)O[C@H](C)C3)n2CCCSc2nccs2)c1 1518379865 XSGHSFWMTCLYJS-HZPDHXFCSA-N 445.614 4.206 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)O1 1524586166 IKLSGODATJWWQG-NOOVBMIQSA-N 430.932 4.071 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCCC(F)(F)C1 1525799008 HNURRTHYCFHGHL-MFYHJKBNSA-N 428.501 4.111 10 10 IICE COc1ccc([C@H](OC)[C@@H](C)NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1527126912 GKTBREGPWZKTRU-WGDIFIGCSA-N 436.552 4.430 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)cc1 1527595605 NGODYBUWVNVHAM-UHFFFAOYSA-N 432.446 4.108 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)c(C)n1-c1ccccc1 1534247848 WADRMGKTTPDNDJ-IBGZPJMESA-N 437.490 4.084 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccccc1F 1535415182 WIPQJGKVARSLDM-CHISUXBFSA-N 444.528 4.228 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)N(C)C)cc1 1537482979 KGOLXVCAKKYIHN-SFHVURJKSA-N 429.433 4.439 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1542490046 BIGVLGVOXQLVSE-FQEVSTJZSA-N 432.511 4.451 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@H]1CCCO[C@H]1C(C)(C)C 1554175107 HUZCOPPBGJVWDD-ZJSXRUAMSA-N 449.599 4.447 10 10 IICE CCOc1cc(N2CCOC(C)(C)C2)ccc1NC(=O)c1ccc(N=NC(N)=O)cc1 1556229294 OMDMRNIPNQVFQQ-UHFFFAOYSA-N 425.489 4.115 10 10 IICE CC(C)[C@H](Cc1ccccc1)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1560141404 RUBXHPQGFATVHN-DEOSSOPVSA-N 426.516 4.257 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](c3ccccc3)[C@@H](O)c3ccccc3)C2)cc1 1564962432 KYSGJFSUJHQGMW-LZYPDUGYSA-N 445.563 4.296 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(Cl)cc1 1570150622 OQJRFENAGWODDI-LBPRGKRZSA-N 436.942 4.399 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccccc1SCC(=O)N1CCCC1 1570416733 LBIGDKSSWITPAY-IBGZPJMESA-N 439.625 4.137 10 10 IICE CCOc1ccc(C2(CNC(=O)c3cc4cc(O)c(O)cc4s3)CCOCC2)cc1 1597327650 HIMOXQOIHDRJEB-UHFFFAOYSA-N 427.522 4.189 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@@H]2CC2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1616673992 CDDNPNOJCUOIMH-QHCPKHFHSA-N 430.976 4.334 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@](C)(O)CCC(C)C)CC2)cc1F 1619302238 LNYNQHIRAUFIPR-XMMPIXPASA-N 447.599 4.063 10 10 IICE Cc1ccc(C(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1628880188 GFIIEBOGTJJWKB-JPYJTQIMSA-N 429.520 4.139 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1ccc(C(F)(F)F)cc1 1630280334 KACJNPRPAUOTLZ-YJBOKZPZSA-N 444.400 4.125 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(-c2ccc(OC)cc2)[nH]n1 1631167603 VBIOJFMINLISTB-UHFFFAOYSA-N 430.302 4.216 10 10 IICE COC(=O)N1CCC([C@@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1634430632 IWIMCEBFONMCSU-GOSISDBHSA-N 426.561 4.069 10 10 IICE Cc1cc(C(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1-c1ccc(Cl)cn1 1640897884 ISWXKNBCXVTVEH-UHFFFAOYSA-N 436.859 4.192 10 10 IICE CN1C(=O)CC[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(C(F)(F)F)cc1 1644590979 XTNDIORAIUYPLB-LPHOPBHVSA-N 440.849 4.290 10 10 IICE COC(=O)[C@@H]1c2ccccc2OCCN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1646111606 NCNWCJPZXLEMQQ-DEOSSOPVSA-N 432.520 4.460 10 10 IICE COC1CCN(c2ccc(CN3CCC(CCNC(=O)OC(C)(C)C)CC3)cc2)CC1 1646567525 MGQDMMLFHZUILT-UHFFFAOYSA-N 431.621 4.429 10 10 IICE CO[C@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1650996392 VNIFMPDZNGEYHL-QGZVFWFLSA-N 446.267 4.045 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@](C)(C(F)(F)F)C1 1655517785 DXJGXBKKVHZHFA-WHEQGISXSA-N 430.426 4.063 10 10 IICE CC(=O)N1CC[C@@H](C)c2ccc(S(=O)(=O)NCc3cc(Cl)cc(Cl)c3O)cc21 1655535915 PUQWRWIGRNZMDB-LLVKDONJSA-N 443.352 4.038 10 10 IICE COc1ccc(N(C)CC(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)cc1Cl 1657676048 QLLDDARSWAMULN-HXUWFJFHSA-N 436.383 4.392 10 10 IICE CC[C@@H](c1ccccc1)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)C(C)C 1659544089 HVWKYYYTFQGOKS-QHCPKHFHSA-N 427.564 4.140 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H]2CSCCN2Cc2ccccc2)cc1 1686093242 OSHSJIFKARSDID-XMMPIXPASA-N 440.657 4.292 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1692278320 VDKKKMNLIQTTCL-INIZCTEOSA-N 431.635 4.190 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)cc1C 1696555909 FQWMKFXQHPZTTO-GOSISDBHSA-N 441.649 4.069 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1ccnc(N2CCCCC2)c1 1706379344 MKXKIOMUPOWKGH-UHFFFAOYSA-N 434.588 4.252 10 10 IICE CN1CCCc2cc(Cn3c(Cc4cccnc4)nnc3N(C)CCC(F)(F)F)ccc21 1711278473 JLXHCDGFNBFMMU-UHFFFAOYSA-N 444.505 4.083 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1712726115 KPJOAJZOTLWTOR-FXAWDEMLSA-N 425.602 4.329 10 10 IICE Cc1noc(C)c1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1726432347 VRRJLDLPHAJECM-WIYYLYMNSA-N 439.560 4.192 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H]2CC)n1Cc1ccc(N2CCC(CO)CC2)cc1 1743713905 NDPQFTDRCPIIBF-UGKGYDQZSA-N 425.621 4.427 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1744778359 GKZFTICMBJPTIK-MBSDFSHPSA-N 448.615 4.456 10 10 IICE CCOCc1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1747086907 WOOIAOSABHKHJN-HXUWFJFHSA-N 443.661 4.289 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[S@](=O)C(C)(C)C 1750609796 FZHIFZXBBSTFLK-PMERELPUSA-N 431.650 4.185 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1761679211 YIXSWDOSFCLDCY-SFHVURJKSA-N 434.588 4.114 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CCC(F)(F)C1 1767080675 KGZZINBXVAUVSU-IBGZPJMESA-N 447.574 4.484 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC[C@H]2NCc2cc(Br)cc(F)c2O)C1 1918936777 SUYKZPPWXAJKTF-OAHLLOKOSA-N 429.330 4.173 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@]1(CN)CC[C@H]1OCc1ccccc1 2018785598 FAKPVRXSDHLTBM-RDGATRHJSA-N 425.573 4.224 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(F)C[C@H](NCc2cc(Cl)cc(Br)c2O)C1 2042930001 YGTWSYPPDIFVAJ-QASKLWRZSA-N 437.737 4.293 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C(F)F)c(CN)c2I)c(O)c1 2079062536 RCVLXZMSNIABDT-AWEZNQCLSA-N 435.256 4.143 10 10 IICE COc1ccc(-c2nn(Cc3ccccc3)cc2C=C2SC(=S)NC2=O)cc1OC 2295356332 FWLREJWSKPGFSX-UHFFFAOYSA-N 437.546 4.104 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CCC(=O)NCCc3ccccc3)C2=O)cc1 2296881420 GMWMMJPQFABMAD-UHFFFAOYSA-N 440.590 4.036 10 10 IICE CCOc1cc(N(CC)CC)ccc1C=C1C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O 2313548011 IUFLNRZZEXJIBF-UHFFFAOYSA-N 435.524 4.215 10 10 IICE O=C(O)Cc1ccc(N2C(=O)C(=Cc3ccccc3Br)SC2=S)cc1 2318756461 MBSPWJFXKZMXJC-UHFFFAOYSA-N 434.336 4.482 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475875 AWNWHHYDURMGII-GCKMJXCFSA-N 443.525 4.204 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccco3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 16401589 UEYVESQZTUCOTJ-RUZDIDTESA-N 433.508 4.460 10 10 IICE CC(C)COC(=O)Nc1c(C(=O)O)cc(Br)c2c1C(=O)c1ccccc1C2=O 39899561 IRQFGPOXPWDFFL-UHFFFAOYSA-N 446.253 4.127 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)CCc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 62694602 HYFKXELZBKSTTO-UHFFFAOYSA-N 447.554 4.193 10 10 IICE Cn1cc(/C=C2/SC(=S)N(NC(=O)c3ccccc3Cl)C2=O)c2ccccc21 97492190 KLRBDTKKXWMEAU-LICLKQGHSA-N 427.938 4.378 10 10 IICE CCc1nc([C@@H]2CCCCN2C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)no1 683444401 JCAUAMPEIGJGCK-QFIPXVFZSA-N 435.572 4.107 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 725884324 XPWYOIPVWVJRMN-FQEVSTJZSA-N 431.305 4.459 10 10 IICE CC1CCN(c2ccc(CNC(=O)NC3CCN(C(=O)c4ccccc4)CC3)cc2)CC1 731115224 CUVAUSFLYRSGSN-UHFFFAOYSA-N 434.584 4.027 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3coc(-c4ccc(F)cc4)n3)cc2F)C[C@@H](C)O1 733216842 AOMYCULHFBPARZ-IYBDPMFKSA-N 441.478 4.092 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc3cnn(C(C)C)c3c2)c(C)n1-c1ccccc1 737080787 GZXMVBZTMZUSGE-UHFFFAOYSA-N 443.551 4.322 10 10 IICE Cc1ccc(C[C@@H](C)N(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 737653298 MMWIIHMQQNZHNR-MRXNPFEDSA-N 442.471 4.382 10 10 IICE C[C@H](NC(=O)N[C@@H]1COc2c1ccc(Cl)c2Cl)c1ccc(N2CCOCC2)cc1 745779038 MGEWAAJNPXPTKI-SCLBCKFNSA-N 436.339 4.324 10 10 IICE O=C(CCc1cc2ccccc2nc1O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 767391050 VQBZEKOPZLHKTH-UHFFFAOYSA-N 441.478 4.260 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)C1 791191266 FJJXODUYRBPEOX-IRLDBZIGSA-N 434.411 4.450 10 10 IICE COc1c([N+](=O)[O-])ccc(CNc2ccc3c(c2F)CCN(C(=O)OC(C)(C)C)C3)c1O 793609579 PGWQRIXNKVVKFO-UHFFFAOYSA-N 447.463 4.353 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3cscc3Br)cc2F)C[C@H](C)O1 814405688 DMYKPPRTZLJDKS-STQMWFEESA-N 441.366 4.122 10 10 IICE COc1ccc(N2CCC(NC(=O)C3(c4cc(OC)cc(OC)c4)CCCC3)CC2)cc1 1125750059 CQPFSYNYTYBIRD-UHFFFAOYSA-N 438.568 4.309 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@]3(C)C[C@H](NC(=O)OC(C)(C)C)CCO3)cc2)CC1 1136705124 BPBVETZUBBVMKW-CJFMBICVSA-N 445.604 4.002 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2c2ncon2)c(C)n1-c1ccc(Br)cn1 1147276575 KJLRZTYEIQVFNO-INIZCTEOSA-N 430.306 4.002 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)N(C)Cc3c(F)cccc3Cl)CC2)cc1 1192412906 LYJPBDAZGZYWED-QGZVFWFLSA-N 433.955 4.047 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCc3ncc(-c4ccccc4Cl)o3)C2)cc1 1278862112 XILWKQDPINTQHQ-MRXNPFEDSA-N 425.916 4.331 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CC[C@H](F)C3)CC2)cc1 1300247252 KHTIVYBTSMOZHT-PMACEKPBSA-N 429.584 4.340 10 10 IICE C[C@@H](NC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1)c1ccc(OC(F)(F)F)cc1 1307424505 SOIRQZKKLZOZTB-MRXNPFEDSA-N 435.490 4.493 10 10 IICE COc1ccc(C)cc1[C@H](C)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307827071 MTTSKGAZWGPGJH-INIZCTEOSA-N 428.488 4.068 10 10 IICE CN1CCC(CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)(c2ccccc2)CC1 1313187553 YQKVCWBGCPRWIB-UHFFFAOYSA-N 434.628 4.482 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@H](C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1361052851 YIJFSKCOHKTFRK-GOSISDBHSA-N 439.629 4.455 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)Nc2cccc(N3CCOCC3)c2)cc1 1435032094 MAIARVCRPGAITE-QGZVFWFLSA-N 425.529 4.361 10 10 IICE Cc1ccc(-n2nc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c3c2CCCC3)cc1 1439960693 NNOYLGDBWPVHIR-RUZDIDTESA-N 445.611 4.158 10 10 IICE CCCN(C)C[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1444896519 KIVCLTOTIFTATI-KRWDZBQOSA-N 433.394 4.056 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)cc1-n1cnnn1 1465541623 NKUGDGLVONGFOX-UHFFFAOYSA-N 430.512 4.454 10 10 IICE C[C@@H]1c2ccc(C(=O)NCc3c(O)ccc4c3CCCC4)n2CCN1C(=O)OC(C)(C)C 1465958039 DDPDRRUJSCZLPP-MRXNPFEDSA-N 439.556 4.314 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1[N+](=O)[O-] 1473771012 RBKVYKQKIUUXKR-LSDHHAIUSA-N 443.459 4.048 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2cccn2C)n1Cc1ccc(N(C)C)cc1C 1505236493 WQHPTMKJLHETQH-SFHVURJKSA-N 426.634 4.284 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)CCC(C)C)n2Cc2ccc3c(c2)CCCN3C)n1 1511684915 GUDKKRKUBPBLLJ-UHFFFAOYSA-N 435.620 4.053 10 10 IICE CC(C)[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C(F)(F)F 1517322329 LVRDDXVECJIINU-GLNPCMGASA-N 434.480 4.120 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1519289201 ALNIDFVQTVTVQZ-ICSRJNTNSA-N 429.609 4.051 10 10 IICE COc1cc(C(F)(F)F)ncc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1525107600 OYGMLXZALQFGBS-UHFFFAOYSA-N 446.473 4.469 10 10 IICE CC(C)CNC(=O)[C@@H]1CSCN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1539562530 NMXIGHDOFVDBOP-NRFANRHFSA-N 439.585 4.455 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3csc(C4CCCCC4)c3)CC2)cc1 1544315762 ULODBCIYXXMTRJ-UHFFFAOYSA-N 427.614 4.356 10 10 IICE Cc1cc(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)ccc1I 1564596721 FZVACDOYCMSEFS-CQSZACIVSA-N 437.325 4.226 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H](N(C)c4ccc(C)cc4)C3)C2)cc1 1564962043 CVTMTMGVSMJXSY-URXFXBBRSA-N 436.600 4.140 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@H]1CCCOC1 1567449549 BFNATLQBXXIRRU-NZQKXSOJSA-N 426.557 4.306 10 10 IICE C[C@H](NC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O)c1ccc(N(C)C)cc1 1585424828 SARBOLKNIPKYRF-SFHVURJKSA-N 441.531 4.082 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCCc3nc(-c4ccc(Cl)cc4)no3)C2)cc1 1587112327 DRGPADOZWYRWCC-SFHVURJKSA-N 440.931 4.116 10 10 IICE C[C@@H](NC(=O)c1cc(Br)cc(I)c1)c1ccccc1O 1587447209 MIDATWZTCXBSKL-SECBINFHSA-N 446.082 4.250 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCCc1nnn(C(C)(C)C)n1 1613370628 UCEHMZICSGTOCX-UHFFFAOYSA-N 435.395 4.409 10 10 IICE CN(CC(C)(C)C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1617823217 IMSKWTZPPVTKMN-UHFFFAOYSA-N 429.584 4.442 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)Cc1c(F)cccc1F 1618101678 OLTXAAVRSIMEAC-CQSZACIVSA-N 434.442 4.199 10 10 IICE CCN1C[C@@H](CN(C)C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)Oc2ccccc21 1623538811 PVTVFBJNBFOBDT-OAQYLSRUSA-N 431.536 4.266 10 10 IICE Cc1cc(CCNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)c(C)n1-c1ccccc1 1623739377 OJTWBRQOXHXJJN-UHFFFAOYSA-N 446.526 4.071 10 10 IICE O=C(NCc1cccc(Br)c1O)c1csc(-c2c(F)cccc2F)n1 1626822893 XTHZXRNMHKRNOE-UHFFFAOYSA-N 425.254 4.486 10 10 IICE Cc1ccc([C@H](CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)N2CCOCC2)o1 1628920724 UJFPWDZWQIKVNA-QFIPXVFZSA-N 441.959 4.452 10 10 IICE COc1cccc(N(CC(=O)N[C@H](C)c2cc(OC)ccc2O)C(=O)OC(C)(C)C)c1 1630365639 BHCUZLNXCVRZCH-OAHLLOKOSA-N 430.501 4.028 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccccc2C(=O)N[C@H]2CC[C@H](O)CC2)cc1 1631085669 ZDSRQJGRGFRWKX-AQYVVDRMSA-N 431.536 4.380 10 10 IICE CCN1C(=O)CCc2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)ccc21 1633782043 JMWFJALZIYMRAN-UHFFFAOYSA-N 429.520 4.387 10 10 IICE CCCOc1ccccc1[C@@H](CC(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1635257684 ZOEJRCLCHIVTLY-LJQANCHMSA-N 434.558 4.070 10 10 IICE CCO[C@H]1C[C@@](O)(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1635726155 LZXJZTLDYZCHQW-SIKLNZKXSA-N 449.389 4.153 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccn(-c2cccc(Br)c2)n1 1635959897 QGYQGQXBGSPJDZ-UHFFFAOYSA-N 426.314 4.149 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC3(c4ccc(Br)cc4)CCC3)C2)cc1 1636853837 LGVIHLOGFFCYDK-GOSISDBHSA-N 444.373 4.415 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCCc2nc(-c3ccc(F)cc3)no2)c1 1638396428 OVOJWUWKPIZFLQ-UHFFFAOYSA-N 446.482 4.458 10 10 IICE Cc1cccc(CNC(=O)c2ccc(C(=O)NCc3ccc4cccnc4c3O)cc2)c1 1639624825 LTWIKBSHPYMPSV-UHFFFAOYSA-N 425.488 4.109 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639929324 ZBWPMQZHNCZDMZ-JXFKEZNVSA-N 432.362 4.187 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cc([N+](=O)[O-])cc(Br)c3=O)c2C)cc1 1641005902 OWJKFIKSPQRKDE-UHFFFAOYSA-N 444.285 4.118 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CCO)CC(C)(C)C)sc(C)c1-c1ccccc1 1641738241 JJFSXIRAFBCOOE-UHFFFAOYSA-N 432.586 4.179 10 10 IICE C[C@@H](SCCC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1643871843 BSSPIFGWZLEIRB-CQSZACIVSA-N 439.533 4.254 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H]2CCOC2)c(C)n1-c1ccc(Br)cc1 1645743117 GZFWFGNUTQHPJR-XLIONFOSSA-N 447.373 4.124 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C4CCCCC4)C3)cc2F)C[C@@H](C)O1 1647853273 BUPQKNNGJJULLB-VIZSFHNOSA-N 445.623 4.348 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)CNC(=O)C(C)(C)C 1648493597 JJUJKDPKEDLDHA-GOSISDBHSA-N 435.490 4.460 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1 1686827089 VYPABLOCWJVWKG-OAHLLOKOSA-N 448.489 4.218 10 10 IICE C=CCCCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1705806831 NNQAFGVKSLZEJS-QFIPXVFZSA-N 439.604 4.001 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1708591540 ULYOTMIPBJYCKQ-HXUWFJFHSA-N 434.588 4.097 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCOC1 1730682038 HUGAMXCLYJOFOH-NRFANRHFSA-N 437.588 4.252 10 10 IICE COC[C@H]1CCCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1749476364 RCVUZWITRAILNS-SIKLNZKXSA-N 445.583 4.026 10 10 IICE CCOCc1nnc(N2CCC[C@](C)(OC)CC2)n1Cc1ccc(N(CC)CC)cc1 1766348966 PVHIZKCVTZAQKO-DEOSSOPVSA-N 429.609 4.105 10 10 IICE C[C@H](NC(CCNC(=O)OC(C)(C)C)CCNC(=O)OC(C)(C)C)c1ccccc1O 2025360280 PADFEUCQSOWHSG-INIZCTEOSA-N 437.581 4.241 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C3CC3)c(C(=O)O)c2I)c(O)c1 2078993573 GVAPCHVXRICSCN-MRXNPFEDSA-N 438.265 4.077 10 10 IICE CC(C)(C)c1nn(-c2ccc(O)c(O)c2)c(I)c1C(F)(F)F 2079721792 RTMLSVCXZCANPI-UHFFFAOYSA-N 426.176 4.204 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NCc2cccc(Br)c2O)C1 2092943090 HDCSSKJHYMIZMC-ZMSDIMECSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCc1cc(Br)ccc1O)C2 2103451279 UVPSPDUBKIBKIQ-AYGBPOKTSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NCc3cccc(Br)c3O)C(C)(C)[C@@H]21 2119292227 AIFOSYHNWLZRCR-KBRIMQKVSA-N 425.367 4.278 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C3(CC3)C2)c1O 2236056329 UZVSPTFZNIIBHO-CYBMUJFWSA-N 441.366 4.185 10 10 IICE O=C1C(=Cc2ccccc2F)SC(=S)N1CC(=O)N1CCCC[C@@H]1c1cccnc1 2296266104 XPOSSRIPTPYRCF-GOSISDBHSA-N 441.553 4.176 10 10 IICE CCCCCCN1C(=O)C(=C2SC(=S)N(CCC(=O)OCC)C2=O)c2ccccc21 2314760008 IBFRIHCKLPBEIT-UHFFFAOYSA-N 446.594 4.138 10 10 IICE C[C@H]1Oc2ccc(-c3csc(NS(=O)(=O)c4ccc(Cl)s4)n3)cc2NC1=O 11857778 SBWGVVBCKCIYQQ-MRVPVSSYSA-N 441.943 4.045 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457138 HMRJNLLOXFBFOO-STSQHVNTSA-N 428.554 4.258 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccc(F)cc3)C2=O)cc1OC 15046233 VKGVLGSPKWUAHA-SJWFJVLYSA-N 446.525 4.071 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccc(F)cc3)C2=O)ccc1O 15046248 YYNJLZVFUYDSCO-OTWJJXBCSA-N 446.525 4.158 10 10 IICE COc1cccc(C(=O)Oc2c(Cl)cc(/C=C3/SC(=S)N(C)C3=O)cc2OC)c1 33307330 SDYMLWVXTRVPBW-CXUHLZMHSA-N 449.937 4.407 10 10 IICE COc1cccc([C@@H]2OC(c3cc(Br)ccc3OC(C)C)=NN2C(C)=O)c1O 64567424 FOSHXEXPELFQTL-FQEVSTJZSA-N 449.301 4.190 10 10 IICE CCOc1cccc([C@@H]2CC(c3ccc(Cl)cc3)=NC3(CCN(C(C)=O)CC3)N2)c1O 65298359 XFCLSGWMBYUMLP-NRFANRHFSA-N 441.959 4.307 10 10 IICE biogenic CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 251317354 FZHFETZVPJXVCI-KXXRBXEXSA-N 427.526 4.498 10 10 IICE CC1CCN(c2ccc(CNC(=O)N3CCC(c4nnc5ccccn45)CC3)cc2)CC1 303412467 VECSTEYGNJIPMO-UHFFFAOYSA-N 432.572 4.055 10 10 IICE CC[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)ccc1O 390698143 SEPVNHNTRYGWOQ-CTNGQTDRSA-N 433.390 4.487 10 10 IICE CC(=O)Nc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526335763 MTGFQHPIZBVKOY-QHCPKHFHSA-N 430.460 4.422 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2cccc(CC(F)(F)F)c2)c(C)n1-c1ccccc1 743881876 FSLUNLAXCAAKKD-UHFFFAOYSA-N 443.469 4.496 10 10 IICE Cc1cc(CCNC(=O)CCCc2nc(O)c3ccccc3n2)c(C)n1-c1ccccc1 746426060 MJJJAMJMCMBGMB-UHFFFAOYSA-N 428.536 4.425 10 10 IICE C[C@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@@H](C[C@@H]2CCCc3ccccc32)C1=O 761160111 OTGSPODCEMIDCY-ZHRMCQFGSA-N 433.552 4.015 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H]3CCCc4cn(C5CCCC5)nc43)CC2)cc1 764711431 ZHHUJQKSBSDJAT-QHCPKHFHSA-N 437.588 4.352 10 10 IICE O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 769306847 DFOHXMRBOBXXCF-HSZRJFAPSA-N 443.950 4.264 10 10 IICE CCN1CC[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1c1cc(F)c(F)c(F)c1 782537294 UDKUVMMUWVSZEN-IFMALSPDSA-N 434.506 4.147 10 10 IICE CC(C)c1nn(C)cc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 797762912 ALKZRDVLRVFGSB-XNTDXEJSSA-N 434.612 4.225 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](c3ccccc3)c3nc[nH]n3)cc2Cl)C1 800718759 DFCQPQBNQQUXRS-IIBYNOLFSA-N 438.963 4.283 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2CC(F)F)c(C)n1-c1ccc(Br)cc1 804723322 WGKOXTRMXHXCLJ-INIZCTEOSA-N 427.289 4.353 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc(-c2ccncc2)s1 807930623 LDKXKQLCUHEZCG-UHFFFAOYSA-N 438.553 4.207 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2C[C@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1 813633875 VWYXRXRRPZBMGT-LEWJYISDSA-N 443.547 4.052 10 10 IICE CCN1CCN(c2ccc(C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)cc2F)CC1 921166428 ILDIPTXLHQQHRN-UHFFFAOYSA-N 438.591 4.230 10 10 IICE CCc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)c(C)c3C)C2=O)cc1 1084384427 OBWBVVXHSAVZJJ-WJDWOHSUSA-N 427.298 4.295 10 10 IICE C[C@@H]1C[C@@H]1c1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1125177845 QMKUOTXABLEKQY-HFRPTOJQSA-N 444.553 4.450 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)C2 1125468403 BQLHFPFLJZEFTB-NRFANRHFSA-N 445.510 4.322 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 1126580671 BIMKQVVCPTZZFV-UIAACRFSSA-N 431.439 4.085 10 10 IICE COC(=O)[C@H]1CCCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1138138416 WWDZCLFTVGBBHH-LJQANCHMSA-N 433.346 4.414 10 10 IICE CCCS(=O)(=O)Nc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1142153387 XYJVEBRTBBRHDT-UHFFFAOYSA-N 425.554 4.427 10 10 IICE CCOc1cccc2c1OCC(C(=O)N(CC)Cc1cc(Br)ccc1O)=C2 1149893006 KINJHEIONMGLSJ-UHFFFAOYSA-N 432.314 4.378 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCC(C)(C)C[C@@H]1c1ccccc1 1153663513 MVEHGLSIQYATRT-NJYVYQBISA-N 439.552 4.298 10 10 IICE CC(C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1cc(O)ccc1O 1153888947 IYTQHURRLMVDOH-UHFFFAOYSA-N 446.503 4.031 10 10 IICE C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F)c1ccc(N(C)C)cc1 1154668780 LYAKDELDEYXIKR-VBKZILBWSA-N 433.499 4.474 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2CCS(=O)(=O)C3(CCC3)C2)cc1 1156395337 DASKMTHPQLWXJB-SFHVURJKSA-N 440.569 4.398 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CO)c2ccc(Br)cc2)c1 1160059192 IFPSMKGFWHGTRW-OAQYLSRUSA-N 441.325 4.133 10 10 IICE COc1ccc(N(CC(=O)NC(=O)Nc2cccc(C)c2C)Cc2ccco2)cc1F 1167681385 ZBEMKSUQIDAWQI-UHFFFAOYSA-N 425.460 4.399 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCCCc4ccccc43)cc2F)C[C@H](C)O1 1191781242 ORKYANSGISWPCH-PMACEKPBSA-N 439.575 4.289 10 10 IICE CC(C)(C)OC(=O)[C@@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H]2CC[C@H]1C2 1291626383 HKRQVZLUJHNBAW-JXQFQVJHSA-N 430.614 4.004 10 10 IICE Cc1cc(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1292056431 HLVGPAFTDGOYFN-HUUCEWRRSA-N 433.394 4.102 10 10 IICE CCOc1ccc(SCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1294858211 AUPYJGLNZIXZPB-SFHVURJKSA-N 434.989 4.317 10 10 IICE CCN1CCC(CCn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)CC1 1296025201 NXXWRMIQEWKTMC-UHFFFAOYSA-N 434.588 4.113 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1296922878 MDLPIAZTWISZGT-UXHICEINSA-N 431.600 4.469 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](C)C1 1300955868 GTWJDBFZRRTROY-HOJAQTOUSA-N 437.588 4.249 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1ccsc1 1305525560 IHSSFYCIGITSRK-INIZCTEOSA-N 429.565 4.376 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2ccsc2)cc1 1313681691 WBKBVFVDRZXSGJ-FQEVSTJZSA-N 425.602 4.374 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2ccc(OC(F)F)cc2)C1 1352215585 NYCRQLXXAGPXKB-UHFFFAOYSA-N 441.522 4.368 10 10 IICE CCOc1ccc(C[C@H](C)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 1357834731 AQOZSLAVXZBTHV-FHWLQOOXSA-N 428.548 4.333 10 10 IICE COc1cc(NC(=O)CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cc(OC)c1 1445282760 BXKPYHRRUZQSJH-UHFFFAOYSA-N 441.915 4.133 10 10 IICE Cc1cc(C(=O)N2CCOc3ncccc3C2)c(C)n1-c1ccc(Br)cc1 1447379666 NLSOQHNUYLCRGV-UHFFFAOYSA-N 426.314 4.286 10 10 IICE Cc1cc(CNC(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)c(C)n1-c1ccccc1 1462086154 QDWKRTLAHSTPPE-QHCPKHFHSA-N 428.540 4.261 10 10 IICE Cc1nccn1-c1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1F 1464427069 ZANRWAJWIMLSOO-UHFFFAOYSA-N 444.510 4.399 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)c2ccc(O)cc2)c(C)n1-c1cccc(Br)c1 1469485075 VYZGTRDWZIHYAO-JOCHJYFZSA-N 443.341 4.200 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(C)n1-c1ccccc1 1470968717 FLXMHQGQMAHXMC-AREMUKBSSA-N 447.627 4.305 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4c3ccc(F)c4Br)C2)cc1 1478634043 CYZFNSQBYDXXQH-DJJJIMSYSA-N 448.336 4.162 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)N(C)C)cc1 1479534200 MCHGUINQJVJYOB-WRALFONMSA-N 436.600 4.139 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCSC1(C)C 1496723505 ZGMJMIJMWSDQCA-KRWDZBQOSA-N 445.633 4.070 10 10 IICE CCC[C@@H](C)N(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1500066264 YHBUPJIZTRYWOT-GOSISDBHSA-N 449.578 4.395 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)CC2CCOCC2)cc1 1501843926 BQGBDSFIKWDEOH-UHFFFAOYSA-N 448.615 4.021 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N(C)CCCc1ccccn1 1510680688 JDESBDJKAKMZJO-HSZRJFAPSA-N 434.588 4.016 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1514252423 HHZONVFXMNOVOV-OFVILXPXSA-N 437.588 4.129 10 10 IICE COc1cc(N2CCN(C(=O)CCCc3ccc(SC)cc3)CC2)cc(OC)c1OC 1514838948 POWNFWVXYXDRBO-UHFFFAOYSA-N 444.597 4.106 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3CCc4cc(Br)ccc43)CC2)cc1 1528110252 LLPBIVWREXEKJA-NRFANRHFSA-N 429.358 4.273 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)cc(C)c(Br)c3C)CC2)c(OC)c1 1534283034 MAPYJFICNFBUEE-UHFFFAOYSA-N 447.373 4.354 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C)[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541443743 BVNURTZTXOYEPC-NHCUHLMSSA-N 439.648 4.216 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(OC(F)(F)F)c(Cl)c3)CC2)c(OC)c1 1543632877 RJFKKORLHORWLF-UHFFFAOYSA-N 444.837 4.218 10 10 IICE COC(=O)c1cc2c(cc1NC(=O)Cc1cc(C)n(-c3ccccc3)c1C)OCCCO2 1544411435 RNQVQPJMEKTRDC-UHFFFAOYSA-N 434.492 4.223 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc([C@@H]4CCCN(C)C4)c3)cc2F)C[C@@H](C)O1 1558915503 PXKFZHZELYDABE-SELNLUPBSA-N 439.575 4.179 10 10 IICE COC(=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1564649800 NQVSNZWDMWJOSM-KRWDZBQOSA-N 443.975 4.291 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1ccccc1C(F)(F)F 1566155133 NZRDPWFEHIYUAJ-FZKQIMNGSA-N 444.400 4.125 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2scc(Br)c2Br)c1 1566374267 BCDUXPHSNSZJGV-SSDOTTSWSA-N 435.137 4.478 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc([C@@H]4CCC(=O)N4)cc3)cc2Cl)C1 1586083181 XALSSKDIJHIARK-KKSFZXQISA-N 425.960 4.457 10 10 IICE Cc1ccc(C(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1-n1c(C)cc(C=O)c1C 1598240057 LYUQEKONNAOXDT-UHFFFAOYSA-N 435.499 4.443 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1=CCCCC1 1616883801 BTAGISIVEOCHJQ-UHFFFAOYSA-N 425.577 4.040 10 10 IICE COc1ccc2nc(C3CC3)cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2c1 1618642823 JBFUEMRCWLKFOX-RUZDIDTESA-N 432.568 4.220 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccccc1O)c1cccc(Br)c1 1622772751 FSMPXGKSYHRZIY-KRWDZBQOSA-N 435.318 4.037 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C(C)(C)C)[C@H](O)C2)c(C)n1-c1ccc(Br)cn1 1624128271 VJKXRYIQRPTFJA-ZWKOTPCHSA-N 434.378 4.121 10 10 IICE COc1cccc(N(CC(=O)N[C@@H](C)c2cc(OC)ccc2O)C(=O)OC(C)(C)C)c1 1630365638 BHCUZLNXCVRZCH-HNNXBMFYSA-N 430.501 4.028 10 10 IICE CC1(C)[C@H](NC(=O)NCc2cccc(Br)c2O)C[C@H]1OCc1ccccc1 1634535475 ABBBZNUZXJUZIH-QZTJIDSGSA-N 433.346 4.338 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1C[C@@H](OC(C)(C)C)[C@H]1n1cccn1 1635334221 CSQDULSPRQJWFO-ZLNRFVROSA-N 439.604 4.212 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCN(CC(F)F)C2)c(C)n1-c1ccc(Br)cc1 1636563744 KFISXZKPUWIJJW-HNNXBMFYSA-N 440.332 4.173 10 10 IICE C[C@H](Nc1c([N+](=O)[O-])cnc2c1ccn2S(=O)(=O)c1ccccc1)c1ccccc1O 1640282183 HIWQAOHFJGLSKZ-AWEZNQCLSA-N 438.465 4.060 10 10 IICE Cc1ccccc1CN1CCC(NC(=O)CN2CCCc3cc(OC(F)F)ccc32)CC1 1644806195 KRHJBALZKFGMDS-UHFFFAOYSA-N 443.538 4.130 10 10 IICE CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCc1c(O)ccc2ccccc12 1647788582 JTHOHQYHXRCPES-HSZRJFAPSA-N 429.520 4.026 10 10 IICE CC(=O)c1cc(F)cc(CN2C[C@@H](CNC(=O)OC(C)(C)C)Cc3ccccc32)c1O 1648093054 WMTDYYVIQQIPPB-MRXNPFEDSA-N 428.504 4.438 10 10 IICE CS(C)(=O)=NCC1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 1654847742 FPLDGLMVURCZID-UHFFFAOYSA-N 427.574 4.480 10 10 IICE COc1cccc(OC)c1OC1CCN(Cc2ccc(N3CCC(OC)CC3)cc2)CC1 1657130149 QBPOUDQNXQNHHG-UHFFFAOYSA-N 440.584 4.362 10 10 IICE COCCCC[C@@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccccc1 1672443496 TUCBBVQRQQKBRI-JOCHJYFZSA-N 441.572 4.093 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC3(c4ccc(C(F)(F)F)cc4)CC3)C2)cc1 1686132747 ZURCVQDIFJZHEX-SFHVURJKSA-N 433.474 4.324 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H](c3ccccc3)c3cccc(F)c3)cc2)CC1 1687441089 ADVQRQLRESSJEH-VWLOTQADSA-N 432.543 4.166 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C(C)(C)C1 1687728548 YBUSGRJYUXGPRU-CQSZACIVSA-N 432.348 4.144 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1696223811 JBQPNPBSSPRMHF-QFIPXVFZSA-N 434.588 4.077 10 10 IICE CCC(CC)NC(=O)c1nnc(N(CC)C2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1727180086 NGBNZGNCQRPGMN-UHFFFAOYSA-N 444.599 4.219 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1731034603 NDDZITLFQALNMN-MSOLQXFVSA-N 425.602 4.329 10 10 IICE CC(C)Cc1nnc(N2CCO[C@](C)(C(C)(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1750758263 RWZGIVJKXJKVIC-DEOSSOPVSA-N 431.600 4.371 10 10 IICE Cc1cc(-c2nnc(Nc3cnn(C)c3)n2C[C@@](C)(O)C(C)C)c(C)n1-c1ccccc1 1761677442 PKLWQVXNSWENBO-XMMPIXPASA-N 433.560 4.237 10 10 IICE Cc1ccc(NC(=O)COc2cccnc2NC(=O)Oc2ccc(N)cc2)cc1Cl 1858683224 FURTVLOGOYJHIO-UHFFFAOYSA-N 426.860 4.254 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCC(=O)c2ccc(F)cc2)N2CCCCC2)cc1 1865954454 XCROOALXBANINM-QHCPKHFHSA-N 425.548 4.198 10 10 IICE CCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccccc2OC)C1=O 1873164929 ZBFKEGCTWDYMKR-UHFFFAOYSA-N 443.547 4.382 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(CNCc2ccc(Br)cc2O)CC12CCC2 1967859063 ZROJYMVXFKLAEL-FQEVSTJZSA-N 425.367 4.329 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C3CC3)c(CO)c2I)c(O)c1 2078999562 RIEQMQVYQRPAFL-KRWDZBQOSA-N 426.298 4.117 10 10 IICE Cc1cc(O)c([C@H](C2CC2)n2nc(C(F)F)c(CO)c2I)cc1C 2079845138 QLXWYERGHXNKCP-HNNXBMFYSA-N 448.251 4.239 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cc(Br)cc(F)c2O)[nH]1 2138337484 PXUBPAHSKPASQP-VIFPVBQESA-N 446.342 4.370 10 10 IICE CCN(C(=O)c1ccc(Br)cc1I)c1ccc(N)cc1 2207260320 FZZVUHUYBWVPCB-UHFFFAOYSA-N 445.098 4.303 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc(OC)c1OC 2313608970 BVPVUTXGBWJHIK-UHFFFAOYSA-N 446.506 4.335 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(Cc3ccccc3)C2=O)cc1OC)C(=O)O 2314932748 PHKIMBCYXAXQLD-MRXNPFEDSA-N 443.546 4.339 10 10 IICE CN(C)c1ccc(/C=C2\C(=O)N(Cc3ccccc3)C(=O)N=C2O)cc1Br 33396872 FPESOSANXAZKOF-GDNBJRDFSA-N 428.286 4.017 10 10 IICE CN(C)c1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)OCC(=O)NC2CC2)cc1 35681578 AUKPNMNIUFRRCT-SDXDJHTJSA-N 441.531 4.223 10 10 IICE COc1ccc2nc(NC(=O)CN3C(=O)/C(=C/c4ccccc4)SC3=S)sc2c1 39875019 VUTUJDHKYGJBRG-SXGWCWSVSA-N 441.559 4.145 10 10 IICE CC1=NN(c2ccc(Br)c(C)c2C)C(=O)/C1=C/Nc1ccc(C(=O)O)c(O)c1 101123208 JEKWLXZPWDUEGU-OQLLNIDSSA-N 444.285 4.188 10 10 IICE CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C/c1ccc(OC(=O)c2cccs2)cc1 103732379 XLEMZFNFVOYJAC-CPNJWEJPSA-N 432.457 4.472 10 10 IICE CCO[C@H](C)c1nc(CN(C)C(=O)NCc2ccc(N3CCSCC3)cc2)cs1 743555412 XYYCNAXAAVWQEX-MRXNPFEDSA-N 434.631 4.135 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)COC(=O)Cn3ccc(=O)c4ccccc43)c2C)c1 744519428 HEJVSNLCLYIHIH-UHFFFAOYSA-N 428.488 4.144 10 10 IICE C[C@@H](NCc1ccc(CO)c(F)c1)c1cc(Br)cc(Br)c1O 756461310 XTKJSHWCHALVFK-SECBINFHSA-N 433.115 4.399 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1cccc(OCC(F)(F)F)c1 783314266 KUWOMOYJRRZNMU-UHFFFAOYSA-N 437.462 4.069 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](c3ccccc3)c3nc[nH]n3)cc2Cl)C1 800718757 DFCQPQBNQQUXRS-IERDGZPVSA-N 438.963 4.283 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(CCc2ccco2)n1C[C@H]1CCOC1 802754600 DEMYOQMYVIHMPT-JOCHJYFZSA-N 449.599 4.320 10 10 IICE CC(=O)Nc1cccc(N2C(=O)/C(=C\c3ccccc3-c3ccnn3C)SC2=S)c1 814185504 IQYKUKQRTUDULS-UDWIEESQSA-N 434.546 4.451 10 10 IICE CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)c(C)cc3Br)C2=O)cc1 1084301770 STNMRNKUTQQRDZ-LFIBNONCSA-N 443.297 4.131 10 10 IICE CCOc1cc(Cl)ccc1C(=O)Nc1cccc(N(CC(N)=O)Cc2ccccc2)c1 1125925232 NYCYLEJOPDZORR-UHFFFAOYSA-N 437.927 4.483 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1 1135689564 HVAOHEJCGINQNR-JOCHJYFZSA-N 439.625 4.224 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCC(=O)NCCc1ccc(O)c(O)c1)CC1CCCCC1 1137464535 DTABWXOOPRGWSI-IBGZPJMESA-N 434.577 4.400 10 10 IICE C[C@@H](NC(=O)c1cc(Br)cc(Br)c1O)c1ccc(N(C)C)cc1 1154669068 PMBAHYLZLFKGFR-SNVBAGLBSA-N 442.151 4.474 10 10 IICE CCC(CC)NC(=O)[C@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2O)c2ccccc2O1 1192129159 KTWAUCQVTVIRCZ-OAQYLSRUSA-N 430.932 4.321 10 10 IICE Cc1ccc2[nH]c3c(c2c1)C[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)CC3 1230852144 FMXMIXJZFJLTPE-CLOONOSVSA-N 433.600 4.002 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 1230982976 LRGUCIXBOZIEIC-OAQYLSRUSA-N 444.938 4.026 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(CC(F)(F)F)[C@@H](C)C3)cc2Cl)C1 1235836278 ZIMHQERJWKORJM-HOTGVXAUSA-N 446.945 4.354 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc(C(C)(C)C)nc1O 1254139928 CTZAMKCFWCLEAI-UHFFFAOYSA-N 436.350 4.285 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnnn1-c1cccc(Cl)c1Cl 1264286968 FIOGDLTXCHYYBI-UHFFFAOYSA-N 430.339 4.447 10 10 IICE C[C@H](CN(C)c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1288591979 VRSVFMZUOLLYIL-OAHLLOKOSA-N 428.581 4.495 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)Cc2cscn2)cc1F 1298061322 MHLNWVPCRRGBFD-UHFFFAOYSA-N 428.581 4.357 10 10 IICE CC(C)(c1ccc(F)cc1)C1(NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1312834284 VTLXYDRFXQWDNI-UHFFFAOYSA-N 447.501 4.250 10 10 IICE CCOCc1nnc(N(C)CC2CCCCC2)n1Cc1ccc(N2CCSCC2)cc1 1314312926 VARDHTKNDSZXAD-UHFFFAOYSA-N 443.661 4.433 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCOc1ncccc1Cl 1314752991 JIVOLFMEADSFTK-UHFFFAOYSA-N 429.952 4.336 10 10 IICE O=C(/C=C/c1cc(Cl)cc(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436625327 YXTSEMCWDBCRER-OWOJBTEDSA-N 427.278 4.438 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CCCN3C(=O)OCc3ccccc3)cc2)CC1 1443662152 IUBOBPBORCJBSS-DEOSSOPVSA-N 435.568 4.340 10 10 IICE Cc1cc(C(=O)NC[C@H]2CSCCS2)c(C)n1-c1cccc(Br)c1 1445294523 RHMPIXVVCIMYFK-INIZCTEOSA-N 425.417 4.435 10 10 IICE COC(=O)CCCc1csc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)n1 1445556017 XRTPXACROLXVCA-UHFFFAOYSA-N 439.537 4.420 10 10 IICE Cc1cc(CC(=O)Nc2cccc(CN3CCOCC3)n2)c(C)n1-c1ccc(Cl)cc1 1447121610 HKEJUSKGRBKOFD-UHFFFAOYSA-N 438.959 4.156 10 10 IICE CC[C@H](C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)n1nnc(-c2ccc(Cl)cc2)n1 1469106309 KAMUJFTWHMJFSI-IIBYNOLFSA-N 440.979 4.066 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)C(C)(C)c3ccccc3)cc2F)C[C@@H](C)O1 1473340333 FXSOJIVCHQWWAN-VAMGGRTRSA-N 441.591 4.011 10 10 IICE CCC[C@H](C)CN(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCOCC2)cc1 1500026044 YKNCRRAFQUKACM-NRFANRHFSA-N 448.615 4.021 10 10 IICE CCOCc1nnc(N2C[C@H](C)O[C@@H](CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1516498626 WKHREXKMGHIVDH-REWPJTCUSA-N 441.620 4.103 10 10 IICE COc1ccc(N(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1F 1516759494 ANWDMXTZSOYYKZ-WQRHYEAKSA-N 448.516 4.228 10 10 IICE CCOC(=O)c1ccc2c(c1)NC(=O)[C@H](C)N2C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1524267948 DJWARTIAOMYPGT-SFHVURJKSA-N 445.519 4.187 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@H]3CC[C@@H](C(N)=O)C3)n2)c(C)n1-c1ccc(F)cc1 1525995233 XULGGYZGZXBCAQ-CABCVRRESA-N 426.517 4.197 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)ccc3OC(F)F)CC2)cc1 1535591419 ZUFJTJQRNFJRLM-UHFFFAOYSA-N 441.272 4.022 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CC1CC(F)(F)C1 1554159994 OXTKAKJCWZJWQK-UHFFFAOYSA-N 433.547 4.094 10 10 IICE CN(CCCn1c(C2CCCC2)nnc1N(C)Cc1ccccc1O)CC(F)(F)F 1554286804 RAGOIRRPOLEOBX-UHFFFAOYSA-N 425.499 4.162 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cc(O)c(F)cc1F 1556919962 XQDRNCSZPLMSJE-VIZOYTHASA-N 440.518 4.352 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(C(=O)NCCN(C)C)cc3)c2C)c1 1557533226 DZUPLBVTDFNFDR-UHFFFAOYSA-N 432.568 4.255 10 10 IICE CCOC(=O)c1sc2nc(CN(c3ccc(OC)c(F)c3)C(C)C)nc(N)c2c1C 1559644804 MKPMWKFBWMEYLH-UHFFFAOYSA-N 432.521 4.321 10 10 IICE Cc1cc(C(=O)NC[C@H](Cc2ccccc2Cl)C(N)=O)c(C)n1-c1ccc(Cl)cc1 1565782395 TXFFGTMUEUNXDN-KRWDZBQOSA-N 444.362 4.475 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cccn(Cc2ccccc2)c1=O 1566290780 QGAICAJGDQGQSL-UHFFFAOYSA-N 425.488 4.369 10 10 IICE Cc1cc(C(F)(F)F)n2nc(C(=O)N(Cc3ccco3)Cc3ccccc3O)cc2n1 1566302712 HHUVRLREQOHGLO-UHFFFAOYSA-N 430.386 4.198 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](NC(=O)OC(C)(C)C)C1CCC1 1566306200 CVPNFCPCZCRIEV-QGZVFWFLSA-N 441.366 4.197 10 10 IICE COc1cc(C)c(Br)cc1C(=O)NCc1cccc(Br)c1O 1568604807 JYHTXUJUSSHCGP-UHFFFAOYSA-N 429.108 4.164 10 10 IICE O=C(CSc1ccc2c(c1)CCC2)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595574416 XJVXLCKNGUWDDY-FQEVSTJZSA-N 431.001 4.407 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1615377875 CEBOLWPSBDWASL-IBGZPJMESA-N 434.588 4.238 10 10 IICE COC(=O)CN(CCC(=O)Nc1cccc(C(F)(F)F)c1)Cc1cc(Cl)ccc1O 1615934649 AQOQDBOYVKTLBN-UHFFFAOYSA-N 444.837 4.068 10 10 IICE CCOC(=O)C[C@H]1CCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1617306195 ATCHYQIIZDCIRB-GOSISDBHSA-N 433.346 4.414 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 1623641874 ZFGOXJBGJZOQEZ-KRWDZBQOSA-N 432.904 4.435 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c(Cl)c1 1630202109 MBGIMVNVESUJLY-UHFFFAOYSA-N 435.883 4.019 10 10 IICE Cc1cc(C(=O)NC2(C(N)=O)CCC(C)(C)CC2)c(C)n1-c1ccccc1Br 1631970471 OSHGKFCLPUVLOT-UHFFFAOYSA-N 446.389 4.411 10 10 IICE CCOC(=O)CC[C@H]1CCCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1632464538 QFHWABOROKNXCR-GOSISDBHSA-N 426.557 4.111 10 10 IICE CCOC(=O)c1n[nH]c([C@@H](CC(C)C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)n1 1639735499 CMCINGRLZGUCGP-HXUWFJFHSA-N 437.544 4.215 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(F)cc2NC(=O)OC(C)(C)C)N(C)C)cc1 1640235733 LYWOKEDDXSUVRQ-NRFANRHFSA-N 444.551 4.271 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(C)c(NC(=O)NC(C)(C)C)c2)cc1 1640771502 MJURGYJSFAQTEA-UHFFFAOYSA-N 426.561 4.132 10 10 IICE CCCN(CCc1cccc(F)c1)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1641746697 AHORIQUDCFMANQ-UHFFFAOYSA-N 444.506 4.494 10 10 IICE Cc1ccc(O)c(CNC(=O)c2nn(-c3c(Cl)cc(Cl)cc3Cl)cc2O)c1 1654735205 SCJHKUVYYFRYHE-UHFFFAOYSA-N 426.687 4.482 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC([C@H](O)c4ccc(Cl)cc4)CC3)C2)cc1 1682646597 UPZHSPFAYAHCRL-NFBKMPQASA-N 443.975 4.083 10 10 IICE Cc1ccc(C[C@H]2CCCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1683195677 KFLCORAKMQYGOP-HXUWFJFHSA-N 443.538 4.274 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](CCO)c1ccccc1Br 1683421609 UBXCTCMMLBYPPL-HRAATJIYSA-N 448.405 4.177 10 10 IICE CCCCOc1ncccc1Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccccc1O 1709667080 KPDXLZQPTSWQBC-UHFFFAOYSA-N 432.528 4.237 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3Cc3cscc3C)CC2)cc1F 1711866176 ROZBAOUTUJFNAX-UHFFFAOYSA-N 429.565 4.294 10 10 IICE CCN(CC)[C@@H](C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1746063267 UWZQALSYKGXPNX-NRFANRHFSA-N 447.631 4.307 10 10 IICE CCSCCCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1747513373 BTUUTORBKOHTCM-UHFFFAOYSA-N 429.634 4.414 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1763850870 KAAUNEGRHGGLPK-IBGZPJMESA-N 436.629 4.424 10 10 IICE COCCCN1C(=O)C(NC2CCCCC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165340 IVRBTPAYKYBPEJ-UHFFFAOYSA-N 435.568 4.133 10 10 IICE Oc1c(Br)cccc1CN[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1878710427 OFHSUPFPGZKEII-NVXWUHKLSA-N 429.280 4.307 10 10 IICE CCOC(=O)COc1c(C=C2SC(=S)N(c3cccc(F)c3)C2=O)cccc1OC 2297366867 BGDPWUWDWGZHQW-UHFFFAOYSA-N 447.509 4.182 10 10 IICE COc1cc(C=C2SC(=S)N(NC(C)=O)C2=O)ccc1OCc1ccccc1Cl 2314717631 HSMHVOCIRRRBMD-UHFFFAOYSA-N 448.953 4.180 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cc(Br)ccc2O)C[C@H]2CCC[C@H]21 2335107032 HCVSQYFITFEMMP-XOKHGSTOSA-N 425.367 4.422 10 10 IICE C[C@@H]1SC(=S)N(CCCCCC(=O)Nc2ncc(Cc3ccccc3)s2)C1=O 11636558 APLVWCKWLIQQJV-AWEZNQCLSA-N 433.624 4.482 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(C(C)C)cc2)nc1-c1ccc2c(c1)NC(=O)CO2 11857562 BJPCJVUZPBUGCJ-UHFFFAOYSA-N 443.550 4.374 10 10 IICE CCCOc1ccc(/C=C2\SC(N3CCC(C(=O)OCC)CC3)=NC2=O)cc1OCC 33447944 RWJXVLTVPVXPLG-HKWRFOASSA-N 446.569 4.120 10 10 IICE COc1ccc(N2CCN(c3ncnc(Sc4ccc(C)cc4)c3[N+](=O)[O-])CC2)cc1 40611211 MJZQVTKMQKLJOM-UHFFFAOYSA-N 437.525 4.180 10 10 IICE COc1cc(OC)c(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)cc1Br 59106217 BHPWBNSUKIIEFT-QPEQYQDCSA-N 449.232 4.112 10 10 IICE CCCCC1=NN2C(=N)/C(=C\c3cccn3-c3cc(OC)ccc3OC)C(=O)N=C2S1 102465970 BKFMYVFXZGENPS-PSZZWWBBSA-N 437.525 4.304 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2ccccc2OCc2ccccc2C)SC1=S 206837141 XQESAEACHUUTLT-UYRXBGFRSA-N 427.547 4.338 10 10 IICE C[C@]1(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCCc2ccccc21 303154305 UAYORQHQPPSVQY-QHCPKHFHSA-N 432.486 4.452 10 10 IICE COC(=O)CCc1nnc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)s1 736273317 YHJYBRVRYRFUBD-UHFFFAOYSA-N 426.542 4.427 10 10 IICE COc1ccc(Br)cc1S(=O)(=O)Nc1cccc(N2CCC(C)CC2)c1 740610046 SDXMPYGNPGAEQG-UHFFFAOYSA-N 439.375 4.495 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cc1Cl 749738041 PHJXALJUMUCTKI-UHFFFAOYSA-N 444.868 4.329 10 10 IICE COc1ccc(N2CCN(C(=O)CSCc3cc(-c4cccs4)on3)CC2)cc1F 753738736 TVGIAHVNABTOPP-UHFFFAOYSA-N 447.557 4.133 10 10 IICE CC(C)(C)OC(=O)N1CCc2cccc(/C=C3/SC(=S)N(Cc4ccon4)C3=O)c21 764411472 KPNFURXHVPCXGT-LFIBNONCSA-N 443.550 4.374 10 10 IICE COc1cccc([C@@H]2[C@@H](N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)CCN2C2CC2)c1 779176990 BLJGBVBQVBZQGP-VLGQDORFSA-N 439.575 4.300 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C4CC4)C3)n2C[C@@H]2CCOC2)c(C)n1-c1ccccc1 802756563 RRPXMKRTZMSNPZ-GBXCKJPGSA-N 447.583 4.004 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc(Cc3ccsc3)n2C[C@H]2CCOC2)cc1 802760695 YNFYTADNBCVVEC-OAQYLSRUSA-N 439.629 4.450 10 10 IICE CC(C)(C)OC(=O)Cc1cccc(NC(=O)NCc2cc(Br)ccc2O)c1 806316908 STTQTQHJFXJORL-UHFFFAOYSA-N 435.318 4.361 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2cc(Br)ccc2O)C(F)(F)F)cc1 806434330 IMAUOKBSVJZEPR-OAHLLOKOSA-N 433.224 4.266 10 10 IICE CC(=O)c1cccc(-c2ccc(/C=C3/C(=O)NC(=S)N(c4ccccc4F)C3=O)o2)c1 1084467464 WQDDLPLHWIQQKQ-ATVHPVEESA-N 434.448 4.120 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@H]3CCC[C@H](C(F)(F)F)C3)CC2)cc1 1124586326 YTGSKCDTMDKMOX-OALUTQOASA-N 441.538 4.082 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Cl)c(Br)cc3OC)C2)cc1 1130827334 ZBOGBRPAYKCDCH-LBPRGKRZSA-N 439.737 4.128 10 10 IICE CCOC(=O)Cc1cccc(N(C)C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1135058814 WVASFJWKDGPLFV-UHFFFAOYSA-N 434.536 4.297 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 1136637494 QYKBVDADVHWIJD-UHFFFAOYSA-N 447.510 4.034 10 10 IICE C[C@H](NC(=O)c1cc(Br)cc(Br)c1N)c1ccc(N(C)C)cc1 1138363615 PBGRNNBQNXOOJN-JTQLQIEISA-N 441.167 4.351 10 10 IICE CCS(=O)(=O)c1ccc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)s1 1156838370 BPYMMMMUPNXYBW-UHFFFAOYSA-N 444.578 4.000 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCCO[C@@H](CNC(=O)OC(C)(C)C)C2)c1 1161110174 QRLFRGWFBGPGHH-FQEVSTJZSA-N 441.572 4.158 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccncc3)noc2=O)c(C)n1-c1cc(Cl)cc(Cl)c1 1188726567 RYUDUCXQMJDCGU-UHFFFAOYSA-N 443.290 4.496 10 10 IICE CCS[C@@H]1CCCCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 1190936115 VHLKEDXXDZUAKA-IAGOWNOFSA-N 436.577 4.397 10 10 IICE C[C@@]1(Cc2cccc(F)c2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751092 VUTRGLNHVASTLL-DEOSSOPVSA-N 447.501 4.247 10 10 IICE COc1cccc([C@H](C)CCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1275224481 KZZCMFHCOOPVPL-QGZVFWFLSA-N 432.511 4.400 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCS[C@@H](C(C)C)C1 1289422980 FQZYDILAVFIPBC-JOCHJYFZSA-N 436.629 4.341 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@H](N(C)C)C23CCC3)c(C)n1-c1ccccc1Br 1301549169 RHBMWLLPDYKXKG-PMACEKPBSA-N 430.390 4.459 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1O 1307734405 MTIXLZWDECVNLN-GOSISDBHSA-N 430.932 4.387 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1356166353 SAJSXLHOGSMJCR-YMVVMYQSSA-N 435.612 4.249 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F 1436845513 FUHBRQYZKNZDBQ-AWEZNQCLSA-N 449.452 4.161 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccc(Sc2cccc(Br)c2)n1 1451765882 IXMJIOVOLFLPGR-UHFFFAOYSA-N 431.311 4.337 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(F)cc(Br)cc3[nH]2)N(C)C)cc1 1456930551 HYCPQMZGJKTCFE-FQEVSTJZSA-N 447.352 4.168 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1461967520 JVVVQKWVVNLRMF-FCHUYYIVSA-N 425.573 4.446 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)NCCCSc1nccs1)Cc1ccccc1 1464902589 TYMRDVNHCOKDJK-QGZVFWFLSA-N 435.615 4.268 10 10 IICE CN(Cc1ccccc1O)C(=O)NCC[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1471069180 ODWKGDJWUQADHO-KRWDZBQOSA-N 425.529 4.463 10 10 IICE CCCN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1500691687 REOUNAWHPFHTIH-UHFFFAOYSA-N 439.629 4.034 10 10 IICE C[C@H]1CN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)CC(C)(C)C1 1512437080 HWTQAFHRXBOXIA-OAHLLOKOSA-N 431.635 4.190 10 10 IICE Cc1cc(Cl)ncc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1517990022 QSSSXRPNLBHXPL-OQLLNIDSSA-N 435.933 4.413 10 10 IICE CC(C)(C)OC(=O)[C@]1(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1(C)C 1524065975 BEYQQQDSLCVPLV-NPMXOYFQSA-N 438.515 4.131 10 10 IICE C[C@H](CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)CC(F)(F)F 1525651370 VYKWBRSYZZZHAI-ZWSXMNCCSA-N 436.546 4.434 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3coc(-c4c(F)cccc4F)n3)cc2F)C[C@H](C)O1 1527481946 SKOAZSTZSXLDMI-KBPBESRZSA-N 445.441 4.303 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1535142444 AZSYEQWJIPSQAO-SQJMNOBHSA-N 441.572 4.125 10 10 IICE Cc1sc2ncn(CCC(=O)NCc3cc(C)n(-c4ccccc4)c3C)c(=O)c2c1C 1535142486 CCEFMFJNFPCTKD-UHFFFAOYSA-N 434.565 4.189 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(NC(=O)C3CC3)s2)cc1 1537497547 LEEHPYFADXGLBG-UHFFFAOYSA-N 425.476 4.367 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1540440319 CTYVJZZFVADVDV-LAUBAEHRSA-N 434.367 4.237 10 10 IICE Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)n1 1542117336 MWUJTBQEUZHOHJ-FQEVSTJZSA-N 444.535 4.101 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1nccs1 1555510588 NWBMCAMPBKVVFC-UHFFFAOYSA-N 436.585 4.134 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CO[C@@H]1C[C@H](C)CC[C@H]1C(C)C 1566848916 CTKDKGOCDIWAED-MOXGXCLJSA-N 425.953 4.025 10 10 IICE COc1cc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc(OC)c1Br 1584089843 UOHLVRLUJDYXPX-AWEZNQCLSA-N 435.362 4.202 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(CC)[C@H]2c2cccc(C)c2)cc1F 1616924873 OPWZZGKJDKDORK-YKSBVNFPSA-N 425.548 4.206 10 10 IICE CCS[C@H]1CCCC[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1621898754 WVSPAAWQLKYHBA-RDJZCZTQSA-N 440.612 4.049 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1 1623877437 ZQWBLZWSZCQMJI-QFIPXVFZSA-N 435.572 4.495 10 10 IICE CC(C)(C)OC(=O)N[C@]1(C)CCCC[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1625970012 OORTVBVWBPPRTR-GBXCKJPGSA-N 447.645 4.330 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 1626722726 HANTVLLNGDRIEY-AWEZNQCLSA-N 442.357 4.026 10 10 IICE CC(=O)N1CCN(c2ccccc2CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)CC1 1627458415 VJUQCFRBKJPXQV-UHFFFAOYSA-N 444.579 4.001 10 10 IICE COC(=O)Nc1ccc(CCNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1628528422 VTACBDXZTNQCMN-UHFFFAOYSA-N 433.508 4.366 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1 1630301444 AEDHQRPWQSGNTL-UHFFFAOYSA-N 442.397 4.023 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C[C@](O)(c2nc3ccccc3s2)C(F)(F)F)c1 1630366878 YOSFNQLFPSABEG-WLRWDXFRSA-N 440.443 4.028 10 10 IICE CCC(CC)(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 1631442736 HYLARIFWBFTFIU-UHFFFAOYSA-N 444.019 4.345 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cncc3ccccc23)NC(=O)OC(C)(C)C)cc1 1634161661 BEEKAGFURVEZBG-HSZRJFAPSA-N 448.567 4.226 10 10 IICE CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)NCc1cccc(Br)c1O 1634535461 ABBBZNUZXJUZIH-MSOLQXFVSA-N 433.346 4.338 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 1635964380 NYIADIYVPOVJNB-FQEVSTJZSA-N 428.573 4.315 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(Cc2nc([C@H]3C[C@@H]3C)no2)CC1 1673743166 AYSLYNQJCJOKJU-SPEDKVCISA-N 439.604 4.163 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@H]3Cc3ccccc3Cl)cc2)CC1 1683702173 YFSCARBCACJZHX-QFIPXVFZSA-N 426.992 4.009 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(Cc3ccccc3)C[C@@H](O)c3ccccc3)C2)cc1 1683782684 SJBMOSLKMUYUKQ-ZEQKJWHPSA-N 445.563 4.219 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1Cc1ccc(N(C)C)c(F)c1 1693998437 MQGYFKSRAHVMBW-CQSZACIVSA-N 433.963 4.068 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1CCc1nc(C(C)(C)C)cs1 1696250891 IDTVXELOKKCRRV-UHFFFAOYSA-N 429.590 4.153 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@](C)(OC)C1CC1 1727000473 DIHMKNRIGIOOPT-XDHUDOTRSA-N 445.583 4.081 10 10 IICE CC(C)c1nnc(N2CC[C@](O)(c3cccc(F)c3)C2)n1CCCSc1nccs1 1760914365 JCCOTIVRMARRBE-OAQYLSRUSA-N 447.605 4.277 10 10 IICE C[C@@H](Cc1cccs1)Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1761372195 JZESPXQAMRJGIO-HKUYNNGSSA-N 426.586 4.454 10 10 IICE Cc1nnc(N2CCC[C@H](CN3CCCCCC3)C2)n1CCCSc1nccs1 1762583314 UJFAFPCLAJFNRE-LJQANCHMSA-N 434.679 4.318 10 10 IICE CCOCC(C)(C)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1766189072 KFJJPJAXRYPWPR-UHFFFAOYSA-N 429.952 4.398 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC[C@@H](C(F)(F)F)C2)cc1F 1768494470 IKJFSHKDGMYYOR-OAHLLOKOSA-N 436.457 4.305 10 10 IICE CC(C)(C)NC[C@H](O[C@@H](CNC(C)(C)C)c1ccc(O)c(O)c1)c1ccc(O)c(O)c1 1848439011 MTOMWRDVPFYJDM-VXKWHMMOSA-N 432.561 4.084 10 10 IICE O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1C[C@@H](c1ccccc1)N1CCCC1 1858593864 AWIBEOIREGPEER-LANLRWRYSA-N 438.574 4.454 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ccc(F)cn2)sc(C)c1-c1ccccc1 1860747889 ZTSVBEOROAJZFL-UHFFFAOYSA-N 427.457 4.012 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)[C@H](O)c1ccc(N2CCCC2)cc1 1999522245 XHPZGOQCIPCANG-XZOQPEGZSA-N 426.557 4.430 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(F)F)c(C=O)c2I)c(O)c1 2079061635 ZMCYVXUSRKVBHR-AWEZNQCLSA-N 432.208 4.251 10 10 IICE Cc1cc(Br)ccc1N1C(=O)C(=Cc2ccc(Cl)s2)C(=O)NC1=S 2294235489 XZGMOLQVLYQGPK-UHFFFAOYSA-N 441.759 4.304 10 10 IICE Cc1nnc(NC(=O)CCCN2C(=O)C(=Cc3ccccc3Cl)SC2=S)s1 2296881875 CTSGUZGUIVZGOF-UHFFFAOYSA-N 438.987 4.120 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3SC(N4C[C@@H](C)O[C@H](C)C4)=NC3=O)o2)cc1 2314433844 VFYXBXWQEYPVBT-HUUCEWRRSA-N 440.521 4.203 10 10 IICE Cc1ccc(CN[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2327802400 YOQIGBQERYKLCD-NSHDSACASA-N 427.261 4.008 10 10 IICE CCOC(=O)COc1c(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cccc1OC 33315557 FKOJTWKGTGOUSV-LDADJPATSA-N 443.546 4.039 10 10 IICE O=C(/C=C\c1ccc(F)cc1)NC(=S)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 35304244 DARHCYSVIVSTDH-GHXNOFRVSA-N 430.460 4.128 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccc(-c3ccccc3)o2)SC1=S)Nc1nccs1 39793764 FZIKUIGCBTUAKT-GDNBJRDFSA-N 427.532 4.243 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H]1CCc2c1ccc(Cl)c2Cl 733352224 ABXIMQBJZPNHSD-GOSISDBHSA-N 438.330 4.456 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(Br)s2)cc1 733952920 XZMVRKOOCFKSHL-KRWDZBQOSA-N 437.403 4.327 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cnc(-c2ccc(F)c(F)c2)s1 765750508 HMRGIYJNSYOLQU-UHFFFAOYSA-N 425.254 4.486 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](CO)c2ccsc2)sc(C)c1-c1ccccc1 770690178 WRUXCHIBCQAUBT-KRWDZBQOSA-N 444.578 4.223 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(N2CCCOC2=O)cc1 815600332 QPMCGDUQNPNTFV-NRFANRHFSA-N 448.611 4.416 10 10 IICE Cc1ccc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)cc1F 1124951068 DXGUSBKWOIBNFC-FQEVSTJZSA-N 449.526 4.375 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCCc2cccnc21 1134460493 BGEBXMFXBTYBPB-CLEQQJOVSA-N 441.553 4.006 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)cc3SC)CC2)cc1F 1137422853 LDARVTKSUZGKHK-UHFFFAOYSA-N 439.350 4.281 10 10 IICE Cc1cc(C(=O)NC2(C(=O)N(C)C)CCCCC2)c(C)n1-c1ccc(Br)cc1 1141073659 WKTPCWYFOUIAFW-UHFFFAOYSA-N 446.389 4.378 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@@H](C)C[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1141736552 RXHBZKMJRRGWOS-IYBDPMFKSA-N 447.421 4.349 10 10 IICE COC(=O)CC[C@@H](Cc1ccccc1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1153375734 ZENPJZACLOZGPO-NRFANRHFSA-N 434.536 4.397 10 10 IICE Cc1cc(C(=O)N2CCC[C@@]3(CCS(=O)(=O)C3)C2)c(C)n1-c1cccc(C(C)C)c1 1158229827 HUGNMWPDKXLGSV-XMMPIXPASA-N 428.598 4.258 10 10 IICE Cc1ccc(CNC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c(-n2cc(Cl)cn2)n1 1234385809 BIHICAKCWFQANT-QGZVFWFLSA-N 440.979 4.034 10 10 IICE COc1ccc(OCCCNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1264776294 XHLUVGFMFWVCIV-UHFFFAOYSA-N 435.568 4.002 10 10 IICE CCOC(=O)C1CCC(CC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 1264992693 IRPVMKFXEXJNGX-UHFFFAOYSA-N 438.515 4.133 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Cc3ccc(F)c(Br)c3)CC2)cc1 1266269042 VLSPGOJRVHNUIW-HNNXBMFYSA-N 435.337 4.124 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cnn(-c4ccc(F)cc4)n3)cc2Cl)C1 1270431271 IWDXYWYPYBQUCT-OAHLLOKOSA-N 427.911 4.226 10 10 IICE Cc1ccc(C(=O)N(C)Cc2ccc(C(=O)NC3CC3)cc2)cc1-n1c(C)cc(C=O)c1C 1290654993 KLQQLDOQFBIATP-UHFFFAOYSA-N 443.547 4.379 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(COC)CCC1 1291609554 HYYNHILDSRDQHF-SFHVURJKSA-N 445.583 4.083 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccccc3Cl)cc2F)C[C@@H](C)O1 1291755397 GYVZYCSTHSTRAF-HUUCEWRRSA-N 442.922 4.413 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)CCCC1 1294703185 DEJALSDTPJNCIT-VWLOTQADSA-N 436.552 4.166 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC3(CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1302039038 YYBANVWDEVGPBQ-SFHVURJKSA-N 445.583 4.026 10 10 IICE Cc1csc([C@@H](C)Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)n1 1304619814 KQCQRFZXYVFJFG-INIZCTEOSA-N 434.569 4.175 10 10 IICE Cc1nnc(N2CCC(OCc3ccccc3)CC2)n1CCCSc1nccs1 1304829602 KQPZNYYRPVYPOJ-UHFFFAOYSA-N 429.615 4.411 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC2(CC1)CN(C(=O)OC(C)(C)C)C2 1312884643 LDYOETQRJXQVAK-IBGZPJMESA-N 444.620 4.035 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnc2ncc(Br)cc2c1 1351164576 WVIUCKSWRXUDKX-UHFFFAOYSA-N 425.330 4.265 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Cc1cccs1 1435332614 MCNPOKQVWOHRHB-HIXWQLQUSA-N 448.610 4.474 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CN(Cc4ccccc4)C[C@H]3C)ccc21 1438328168 NAMYMENANWWMAE-DVECYGJZSA-N 433.596 4.402 10 10 IICE CCCc1ccc([C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2cccs2)cc1 1440863531 CPFGUTYAWRTZHI-NRFANRHFSA-N 444.578 4.297 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCOc3ccc(Cl)c(F)c3)cc2F)C[C@@H](C)O1 1441792816 ZYGWFFMUVILVMW-GASCZTMLSA-N 438.902 4.317 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC=C(c2ccccc2)C1 1446737864 FNEQIUDGFVGBEC-XSFVSMFZSA-N 438.549 4.343 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C[C@H](O)CC(C)(C)C)C2CCN(C)CC2)cc1 1449380877 AQFCKDCKTGDGDI-XMMPIXPASA-N 425.617 4.428 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCSCC3)cc2)cnn1-c1ccc(F)cc1 1464256856 BHUBNNCQFREUNP-UHFFFAOYSA-N 438.572 4.447 10 10 IICE COC(=O)c1cc(Br)cc(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1 1464962295 OBRYUVPLJJNQKN-UHFFFAOYSA-N 445.357 4.402 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)C1 1467702701 PUWKEJWRSYGYPJ-UZLBHIALSA-N 439.556 4.424 10 10 IICE COc1nsc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1Br 1470350803 JFTPVEXPVAXYIQ-UHFFFAOYSA-N 448.342 4.064 10 10 IICE CCOCc1nc(C)cc(NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1472776439 UOKLYVATUGXCQY-IBGZPJMESA-N 429.565 4.065 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)C1 1499569584 SUUHTOJMXGWQNC-HXUWFJFHSA-N 434.588 4.067 10 10 IICE CCc1nnc(N2CCO[C@H](c3ccc(F)cc3)C2)n1CCCSc1nccs1 1513936852 FEXUUTHICKFVBF-KRWDZBQOSA-N 433.578 4.196 10 10 IICE CN(CC1CC(F)(F)C1)c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1517198812 RKQRBDRLKMGOAF-CQSZACIVSA-N 429.562 4.250 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1519013063 ZEDIYJIRWNPMLA-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CCOC(=O)c1c(NC(=O)c2cccc(-n3cnnn3)c2)sc(C)c1-c1ccc(C)cc1 1524869710 NAXMXHXYAYLOQS-UHFFFAOYSA-N 447.520 4.437 10 10 IICE COC(=O)C(C)(C)n1ccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 1529369383 VEXJENIYTJAXBZ-UHFFFAOYSA-N 428.920 4.033 10 10 IICE Cc1cc(CCNC(=O)C2=NN(c3ccc(F)cc3)C(=O)CC2)c(C)n1-c1ccccc1 1534247487 KZXLNGBNBDNLPI-UHFFFAOYSA-N 432.499 4.075 10 10 IICE Cc1cc([C@H]2CCCN2C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)no1 1540260471 VOWVZVIKVQFKNA-ZCWPUFOUSA-N 445.541 4.077 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCc2sc(C)nc2C)n1 1542563661 GMYOLHQRXJMTKS-UHFFFAOYSA-N 434.569 4.307 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2c(F)cccc2C1 1544801647 XZASLZGNGIJIJK-XDHOZWIPSA-N 444.528 4.141 10 10 IICE CSC(C)(C)Cn1c(Cc2cn3ccccc3n2)nnc1N(C)Cc1ccccc1O 1555828084 BFEPRZBNBWAUJD-UHFFFAOYSA-N 436.585 4.000 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 1557426961 FOSXJCIYPIFJTE-NEEZITCHSA-N 438.524 4.020 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](CCCc3ccccc3)c3ccccc3)nc12 1559606938 SUNRHWDABJMRPB-QHCPKHFHSA-N 444.535 4.465 10 10 IICE Cc1cccc2c1OC[C@@H](NC(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)C2 1570036015 IQRMJCDJFKRJJM-SFHVURJKSA-N 440.341 4.294 10 10 IICE Cc1cc(CC(=O)N[C@@H](C(N)=O)c2ccc(Cl)cc2)c(C)n1-c1ccc(Cl)cc1 1586449696 HWCDGQWXVHXEQW-OAQYLSRUSA-N 430.335 4.286 10 10 IICE COc1cccc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1C 1586766421 IWZNNGZAIKOSTE-PDGQHHTCSA-N 446.619 4.363 10 10 IICE COc1ccc(-c2noc(CCC(=O)NCc3cc(C)n(-c4ccccc4)c3C)n2)cc1 1587886605 RFDCBCRCVPRYGR-UHFFFAOYSA-N 430.508 4.402 10 10 IICE CCN(CC)c1ccc2cc(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)c(=O)oc2c1 1597801167 YOBNPKVVQKQSNL-GOSISDBHSA-N 435.568 4.375 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H](C)C1 1615091415 QXRZSULPFQYVPL-OALUTQOASA-N 448.615 4.313 10 10 IICE CCN(CC)c1nnc(-c2cc(Br)cn2C)n1Cc1ccc(N(C)C)c(F)c1 1615386450 NECAYOACNFKDJB-UHFFFAOYSA-N 449.372 4.146 10 10 IICE CC(C)(C)OC(=O)N1CCC(C2(C(=O)NCc3ccc(N4CCCC4)cc3)CC2)CC1 1624321430 DTVKKXGLBANSAD-UHFFFAOYSA-N 427.589 4.330 10 10 IICE COc1ccc(/C=C(\C(=O)NCc2ccc(N3CCOCC3)cc2)c2cccs2)cc1 1626693240 KUXAWKSLAAFZPS-QJOMJCCJSA-N 434.561 4.450 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(-c4ccc(C=O)s4)cc3)c2)CC1 1628412287 TYFZPCZRRLIMHX-UHFFFAOYSA-N 433.533 4.182 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2scnc2C(F)F)NC(=O)OC(C)(C)C)cc1 1629685204 MRPHYUWISSZNFV-AWEZNQCLSA-N 440.516 4.143 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)/C(=C/c3ccccc3)n3nnnc3C)c2C)c1 1635327380 SNUOSJPXTUHQFP-IWIPYMOSSA-N 426.524 4.012 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc3cccnc3c2O)cc1I 1638573106 JEXBFWWXRQIHRV-UHFFFAOYSA-N 432.261 4.092 10 10 IICE C[C@H]1CN(C(=O)CN(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)CC(C)(C)O1 1642029371 JYEUTCJGDZAIHI-SONCPKABSA-N 436.552 4.004 10 10 IICE C[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)c1cc(NS(C)(=O)=O)ccc1O 1646131001 LLQSIBFIUNIQLP-GOSISDBHSA-N 438.549 4.037 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](n3ccnn3)CC2)c(C)n1-c1cccc(Br)c1 1647874657 KXDIAUZAXCCSDT-GOSISDBHSA-N 442.361 4.316 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC)c(Cl)c2)sc(C(C)=O)c1C 1657676061 RDDMURAGIJQBRD-UHFFFAOYSA-N 438.933 4.173 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)cc1 1673892678 ULGTWERHYIIUHU-RTBURBONSA-N 435.572 4.376 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCSC[C@@H]2c2ccccc2)N(C)C)cc1 1685686380 MCLBECJNIHVFQW-XZOQPEGZSA-N 426.630 4.245 10 10 IICE COc1ccc(N2CCN(C(=O)NCCOc3ccc(Cl)c(Cl)c3)CC2)cc1F 1686620407 HNTONDJSVSVVBZ-UHFFFAOYSA-N 442.318 4.052 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccc(F)cc3F)C3CCCC3)cc2)CC1 1687441507 OYCASOYKVZBBJR-UHFFFAOYSA-N 442.554 4.371 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@]3(CCCc4ccccc43)C2)N(C)C)cc1 1687807268 QEYHHMRMHYOXAS-XNMGPUDCSA-N 434.628 4.435 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC([C@@H]4CCCO4)CC3)nnc2C(C)(C)C)cc1F 1729330034 QFOBJQOLDVNNLY-NRFANRHFSA-N 429.584 4.224 10 10 IICE CCc1nc(C)c(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)o1 1744447146 XLUVOBXEFXYPEU-UHFFFAOYSA-N 438.919 4.243 10 10 IICE Cc1ccc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)cn1 1751522303 YGKDTAOAQIZREQ-UHFFFAOYSA-N 448.615 4.091 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc(-c2cccn2C)n1CCCSc1nccs1 1763284606 WPNXFMKGMRNCTG-LSDHHAIUSA-N 434.660 4.253 10 10 IICE CCS[C@@H]1CC[C@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768371528 GGBKULSAFHRICP-WAOWUJCRSA-N 447.624 4.493 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)Cc1ccc(F)cc1 1857996890 LWTLZGNBYUSBAA-UHFFFAOYSA-N 447.463 4.390 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\c3ccc([N+](=O)[O-])s3)SC2=S)cc1OC 1858589890 OFLTVLHZPKWLDD-XNTDXEJSSA-N 436.536 4.117 10 10 IICE O=C(O)c1ccc(CN2C(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)cc1 1858591039 VEJDCPGFIWKYRZ-OVCLIPMQSA-N 434.882 4.348 10 10 IICE C[C@@H]1CCCN(C(=O)CCn2c3c(c4ccccc42)CCn2c-3nc3ccccc3c2=O)C1 1860344921 HPWMKCJWJICMNG-GOSISDBHSA-N 440.547 4.223 10 10 IICE CCc1nn([C@H](c2ccc(C)cc2O)C(C)(C)C)c(I)c1CO 2079141076 XGZKHZXAINMTOL-MRXNPFEDSA-N 428.314 4.192 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCC[C@@H]2CNC(=O)OC(C)(C)C)c1O 2236056746 XHNOWNAACCZUEP-CJNGLKHVSA-N 443.382 4.336 10 10 IICE O=C1C(=CN2CCN(CC=Cc3ccccc3)CC2)SC(=S)N1CCc1ccccc1 2296535434 DDCSDFUIZUSMAW-UHFFFAOYSA-N 449.645 4.262 10 10 IICE COC(=O)CCCCCN1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2297306885 WYYGNXOXBSZQGA-UHFFFAOYSA-N 428.373 4.384 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3cccc(O[C@H](C)C(=O)O)c3)SC2=S)cc1 2314931407 NWHLTPPKICAYRW-CYBMUJFWSA-N 429.519 4.343 10 10 IICE COc1cccc(C=C2SC(=S)N(CCNC(=O)CCC3CCCCC3)C2=O)c1 2320656467 RPOPTOSZFRAJCF-UHFFFAOYSA-N 432.611 4.373 10 10 IICE Cc1ccc(CNC(=O)c2cccnc2NC(=O)OC(C)(C)C)c(O)c1Br 2380736698 FOFVZQDDIJPGBR-UHFFFAOYSA-N 436.306 4.135 10 10 IICE COc1ccccc1-n1nnnc1SCC(=O)c1cc(C)n(-c2cccc(F)c2)c1C 15227236 HLAMCFACLWATLH-UHFFFAOYSA-N 437.500 4.193 10 10 IICE Cc1cc(/C=C2\C(=O)N(Cc3ccccc3)C(=O)N=C2O)c(C)n1-c1ccc(C(=O)O)cc1 23330386 RCKISWKGKWTZRE-BKUYFWCQSA-N 443.459 4.295 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(NC(=O)C3CCC3)cc2N2CCCCC2)cc1 65165929 QAQPKAWFRUDMDP-UHFFFAOYSA-N 434.584 4.412 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](C(=O)Nc4cccc(C)n4)C3)ccc21 484696808 SHIKTXMMJWWZNH-OAQYLSRUSA-N 448.567 4.099 10 10 IICE COc1ccc(-c2cc3nc(CN(C)c4ccc(OC)c(F)c4)[nH]c(=O)c3s2)cc1 757856581 CMSKJQBQXVGAAI-UHFFFAOYSA-N 425.485 4.444 10 10 IICE COc1ccc2c(c1)C=C(S(=O)(=O)N(C)Cc1ccc(N3CCCCC3)cc1)CC2 758431477 OTZZQXUMPYTRET-UHFFFAOYSA-N 426.582 4.434 10 10 IICE COc1ccc(S[C@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768542753 HDJGTVABKCRMKI-LJQANCHMSA-N 439.625 4.024 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccc(COCC2CC2)c1 768876820 AXUHDBGMKKMRQY-UHFFFAOYSA-N 448.611 4.467 10 10 IICE Oc1nc(/C=C/c2ccc3c(c2)CCN3Cc2ccccc2)nc2c1cnn2-c1ncccn1 794704246 YOFTZYQETHHOMV-CSKARUKUSA-N 447.502 4.044 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2N(C(=O)OCc3ccccc3)CC2(C)C)C2CC2)cc1 1136181017 YESCBWBILZEFKX-HSZRJFAPSA-N 435.568 4.291 10 10 IICE COc1ccccc1-c1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)s1 1136984744 RAQANEJSCGCNGE-UHFFFAOYSA-N 440.540 4.454 10 10 IICE Cc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1N1CCNC1=O 1139209086 MRBMEDMXRCQVSU-UHFFFAOYSA-N 430.508 4.305 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)c1 1140930538 SWQNGSMGWWOPOR-DNVJHFABSA-N 434.540 4.030 10 10 IICE COc1cccc(CCNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 1148333715 JOGPOWMCNKASKL-UHFFFAOYSA-N 428.330 4.233 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc2c(N(C)C)ncnc2n1C 1152402511 ZCCFUTLZDSGGPQ-QGZVFWFLSA-N 429.524 4.144 10 10 IICE Cc1ccc(NS(=O)(=O)c2cccc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)c2)cc1 1154668423 GREHFCVJRPXNSG-SFHVURJKSA-N 437.565 4.353 10 10 IICE Cc1cc(C(=O)NCC(C)(C)c2cccnc2)c(C)n1-c1ccc(Br)cn1 1161953227 MXYXXMOIKHVUQW-UHFFFAOYSA-N 427.346 4.354 10 10 IICE CCN(C)c1ccc(CN2CCN(C(=O)COc3ccc(Cl)cc3Cl)CC2)cc1 1169353803 QQLDXPBYOJJWCO-UHFFFAOYSA-N 436.383 4.173 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2=O)c(C)n1-c1ccccc1 1233974489 OQKYQPSUZJMCCA-RUZDIDTESA-N 444.579 4.079 10 10 IICE COc1ccc(N2CCCN(C(=O)CN(Cc3ccccc3)c3ccccc3)CC2)cc1 1264732866 IOPGRFHTGISABN-UHFFFAOYSA-N 429.564 4.441 10 10 IICE Cc1nc(COc2cccc(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2)no1 1287468785 MQFKKPADTOOEGC-UHFFFAOYSA-N 430.508 4.337 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)[C@H](CC(C)C)c3ccc(Cl)cc3)cc2)CC1 1296400883 UOQIQAXYVKIUOY-XMMPIXPASA-N 442.003 4.455 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2ccc(F)cc2)c(C)n1-c1ccccc1Br 1303697288 ROQJWDQXKSZAPB-SFHVURJKSA-N 445.332 4.329 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccoc2)n1Cc1ccc(N2CCOCC2)c(F)c1 1305386792 APLVPYVANBBAQA-KRWDZBQOSA-N 427.524 4.045 10 10 IICE COc1ccc(N(C)Cc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)cc1OC 1307441759 AQVUKXZCVMJFMV-UHFFFAOYSA-N 425.485 4.444 10 10 IICE C[C@]1(c2ccccc2)CCCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1312834259 UVFVJOXQWBRNPW-DEOSSOPVSA-N 429.511 4.065 10 10 IICE CN1C[C@H](C(=O)Nc2ccc(N=Nc3ccccc3)cc2)N(C(=O)OC(C)(C)C)CC1=O 1350165063 YARPKMYXBZRMLN-LJQANCHMSA-N 437.500 4.118 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(Cl)cn1 1352802015 WDRNVARAJAAUMD-XNTDXEJSSA-N 435.933 4.128 10 10 IICE Cc1nc(O[C@H](C)C(F)(F)F)ccc1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1356167230 ZOYYAIKGTBYMPK-GOEBONIOSA-N 437.462 4.047 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](c4nccc(C(F)(F)F)n4)C3)ccc21 1439745001 UISAJELPLKMJST-QGZVFWFLSA-N 446.473 4.343 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCN(C(=O)OC(C)(C)C)C2CC2)cc1 1442601480 MCLAIIZSOAKHCQ-QFIPXVFZSA-N 445.604 4.050 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCCC[C@H]3c3ccccc3)CC2)cc1 1442747367 UASGRDRHXDKOLM-SSVKHQHASA-N 447.579 4.044 10 10 IICE Cc1cc(C(=O)Nc2ccc(-c3nc[nH]n3)cc2)c(C)n1-c1ccc(Br)cn1 1443332546 IDGNQLUYIRLROZ-UHFFFAOYSA-N 437.301 4.289 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CC[C@]3(CO[C@@H](C)[C@@H]3C)O2)c(C)n1-c1ccc(Cl)cc1 1462838656 HMINLPVUKQKIAT-GODDJFOZSA-N 430.976 4.379 10 10 IICE CC1CCN(c2cccc(NC(=O)c3ccc(I)c(O)c3)c2)CC1 1465309774 MBWJCLYUXRDVIZ-UHFFFAOYSA-N 436.293 4.485 10 10 IICE C[C@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)N(C)C 1510101235 AQHNDUYHVJMAPM-LJQANCHMSA-N 438.645 4.117 10 10 IICE Cc1ccsc1CCNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1520673814 NIFCWEVHXZGIGO-SFQUDFHCSA-N 434.583 4.146 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(OCC(=O)OC(C)(C)C)c1 1525762956 VHPYXJWLXLZKBC-GOSISDBHSA-N 426.557 4.143 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1COCC[C@@H]1c1ccccc1 1537458809 NFENEELVNPBYLF-FGZHOGPDSA-N 430.495 4.193 10 10 IICE Cc1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c(C)n1-c1ccc(Br)cc1 1540585812 YDBRFJYNZDYFOE-UHFFFAOYSA-N 437.301 4.289 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCOC[C@H]1OC 1545332784 OEHPDLROAIAVFQ-IEIRFRATSA-N 441.620 4.080 10 10 IICE CC[C@H](C)CN(CC)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1545654012 ZOHYNKPIURVBAV-NRFANRHFSA-N 448.615 4.021 10 10 IICE CCC(CC)NC(=O)c1nnc(N(CC)CC(C)C)n1Cc1ccc2c(c1)CCCN2C 1545844205 WSNXQEZJTIANGU-UHFFFAOYSA-N 440.636 4.110 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1csc(-c2ccc(Cl)cc2)c1 1567305999 BGLARICJMXQYRJ-KRWDZBQOSA-N 445.924 4.384 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc(C4(C)OCCO4)s3)cc2Cl)C1 1568141843 GVSIJHCGUQJUHX-CQSZACIVSA-N 435.977 4.182 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc2c(c(OC)c1)O[C@@H](C)C2 1568378679 JOMPHWOKVXUKRQ-INIZCTEOSA-N 440.540 4.021 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CN(C)c2nc3ccccc3s2)cc1 1583919360 PSBUCWSKXYRBQB-HXUWFJFHSA-N 438.597 4.006 10 10 IICE CC1(C)CO[C@H](CCNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1597742060 CFKDAGHWQGLRAJ-DSQDWWTGSA-N 438.640 4.051 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H](C)Cc3ccc(Br)cc3)C2)cc1 1598363874 JZUYNIRLTLDRAM-SJLPKXTDSA-N 431.374 4.279 10 10 IICE CCn1cc(CN(C)c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)cn1 1615695093 VNBIQFDMMIWCIO-KRWDZBQOSA-N 447.634 4.011 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C3=NN(Cc4ccc(F)cc4)C(=O)CC3)c2C)c1 1624070432 RGODETUXKLFSSD-UHFFFAOYSA-N 446.526 4.336 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc4nccc(C(F)(F)F)n4n3)c2C)c1 1624075041 GSNSKVKAQVAUBW-UHFFFAOYSA-N 427.430 4.394 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1cccc(S(N)(=O)=O)c1 1625471054 NNFSVWAPCQYYLA-OAQYLSRUSA-N 445.972 4.276 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc4c(c3)CN(C(=O)OC(C)(C)C)CC4)ccc21 1626941424 YXFCUVYCFSQFET-UHFFFAOYSA-N 435.568 4.292 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCC3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1 1627154513 SDXUOVCJQOZRTB-FQEVSTJZSA-N 445.604 4.065 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)Cc2ccccc2)c(C)n1-c1ccc(Br)cc1 1632438066 ONEADJOKLPMWOP-LJQANCHMSA-N 427.342 4.190 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCCN(C(=O)Cc4ccccc4)C3)c2C)cc1 1634855537 UQQMBTHALFMVOL-QFIPXVFZSA-N 445.563 4.066 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](C(=O)OC(C)(C)C)C(C)C)cc1 1639240455 HZPISWDGOUVBDH-QFIPXVFZSA-N 426.557 4.179 10 10 IICE CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1641201092 QAPNIJOGFRMTMC-UHFFFAOYSA-N 432.568 4.061 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3ccc(Cl)cc3)cc2F)C[C@H](C)O1 1646075681 GHARQSNOUBPSNR-YESZJQIVSA-N 433.955 4.060 10 10 IICE CC(=O)c1cc(F)cc(CN[C@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)c1O 1658788514 CBMCXBMYIJMXHU-ZJSXRUAMSA-N 439.458 4.414 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4cccc(Br)c4C3)C2)cc1 1673823400 RUCPEBDNSGPZSX-MRXNPFEDSA-N 444.373 4.052 10 10 IICE Cc1cc(CNC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)c(C)n1-c1ccccc1 1681583927 UYLGQRYPVTUXLW-UHFFFAOYSA-N 445.972 4.150 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)CCc3ccccc3)cc2Cl)C1 1682023248 CLAHTRABAVQMOS-NQIIRXRSSA-N 429.992 4.369 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc(OC)c(OC)c1C 1684303466 AQPCFIBBZGGYDM-UHFFFAOYSA-N 437.334 4.212 10 10 IICE C=CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H](C)C(=O)NC 1705812306 WHGISIWMEKFXMZ-SFHVURJKSA-N 434.588 4.137 10 10 IICE CCC[C@@](C)(O)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709446579 MUEIPGIVSLDLQM-WIOPSUGQSA-N 441.620 4.307 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CC4)n3CCCSCC(C)C)CC2)cc1F 1711866422 YHGMDUBRHKYHQQ-UHFFFAOYSA-N 447.624 4.409 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CCN(C)C(C)C)CC2)cc1 1730180070 KDYOGSIBAAIAMY-UHFFFAOYSA-N 440.636 4.001 10 10 IICE C[C@H](c1cccc(O)c1)N(C)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1741785152 WVKGORJAXGRNJR-NVXWUHKLSA-N 445.614 4.324 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[S@@](=O)C(C)(C)C 1750609798 FZHIFZXBBSTFLK-SSEXGKCCSA-N 431.650 4.185 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](C)N2CCC[C@H](C)C2)n1 1761916913 SFJCXXBQDBHAAF-ICSRJNTNSA-N 434.588 4.111 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C(C)C)C(C)C 1764747847 VOLFVVLMJYJMGY-UHFFFAOYSA-N 436.604 4.360 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(Cc3ccc(C(=O)O)cc3)C2=O)cc1OC 1858590803 JWBOAYUPZBMPDQ-WOJGMQOQSA-N 429.519 4.194 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cc(Br)ccc1F 1891661130 ZSASMKHRVVHAQX-YOEHRIQHSA-N 439.350 4.055 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(NCc2c(O)cccc2Br)C[C@H]2CC[C@H]1C2 2131761084 QOCXKSPWQIWQJE-YRVVQQKDSA-N 425.367 4.328 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236056349 VEQIDBNQFZYINT-CQSZACIVSA-N 443.382 4.290 10 10 IICE Cc1cc(C=C2C(=O)NC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)n1C[C@@H]1CCCO1 2313630179 UADVIOGNABQCIR-QFIPXVFZSA-N 443.503 4.104 10 10 IICE Cc1cccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)c1 2314837229 PULZERKSZUACNX-CYBMUJFWSA-N 427.507 4.132 10 10 IICE COc1ccc(-n2c(C)cc(CNC(=O)Nc3cc(OC)c(OC)c(OC)c3)c2C)cc1 9228657 VZTDDVQCHNFWJF-UHFFFAOYSA-N 439.512 4.450 10 10 IICE CC(C)C1=NN2C(=N)/C(=C\c3cccn3-c3ccc([N+](=O)[O-])cc3Cl)C(=O)N=C2S1 32964382 JPPBUXWBIOBTRB-KBFOAYOGSA-N 442.888 4.314 10 10 IICE COC(=O)COc1ccccc1/C=C1/SC(=S)N(CCCc2ccccc2)C1=O 33448023 AUAPPFQORUTSBW-XMHGGMMESA-N 427.547 4.072 10 10 IICE O=C1/C(=C\c2cc(Br)ccc2O)C(O)=NC(=S)N1c1ccc(Cl)cc1 34222244 SDBVDVSOAGADHQ-JYRVWZFOSA-N 437.702 4.480 10 10 IICE Cc1cc(OC[C@@H](O)CN(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)ccc1Cl 256038944 UNVRPWKBZLSYAO-JTHBVZDNSA-N 432.992 4.135 10 10 IICE Cc1ccc2c(c1C)OC[C@@H]2NC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 728310829 PFCADWCSPHRLQY-FQEVSTJZSA-N 449.473 4.092 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)nc1-c1c(F)cc(F)cc1F 729110422 GVKLKVJJWBQIGA-UHFFFAOYSA-N 429.401 4.245 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@H]3C[C@@H]3c3cccc4ccccc34)CC2)cc1 730769394 FDPAVVJIXDFGML-SXOMAYOGSA-N 443.591 4.280 10 10 IICE CC[C@@H]1CN(C(=O)/C=C/c2cc3cnn(C(C)C)c3[nH]c2=O)c2cccc(Cl)c2O1 753054810 WBCASZBUEWCOLQ-ROJDOSBLSA-N 426.904 4.176 10 10 IICE Cc1nccn1-c1ccc([C@H](C)NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 754911134 KVISWRGPXLKUCN-SFHVURJKSA-N 435.597 4.294 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@H]3CCc3ccccc3)cc2)C1 760821450 QPSOUNBAXPKKFX-ZCYQVOJMSA-N 448.611 4.085 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C(F)(F)c1ccccc1F 765633680 CJUNKBMJRKWEHF-UHFFFAOYSA-N 432.364 4.089 10 10 IICE Cc1cc(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)c(C)n1-c1cccc(Cl)c1 765742513 AFIDWKHKPVECEE-UHFFFAOYSA-N 442.922 4.048 10 10 IICE CCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)nnc1-c1cnccn1 768415297 ZDPYCUBKXAMIJI-UHFFFAOYSA-N 436.516 4.277 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc(OC(F)F)c(F)c1 768871049 FSPOYYMUEYBBJP-UHFFFAOYSA-N 448.489 4.281 10 10 IICE Cc1cc(C(=O)COC(=O)C2CCC(NC(=O)C3CC3)CC2)c(C)n1-c1ccc(F)cc1 795959061 PZAIMEBJUDWSMT-UHFFFAOYSA-N 440.515 4.044 10 10 IICE COc1c(C)cc(C)cc1S(=O)(=O)Nc1nc(-c2ccc(-n3cccn3)cc2)cs1 800925037 ANPGPAWECBYAKZ-UHFFFAOYSA-N 440.550 4.422 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2C[C@@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1C 807705486 JKWFUPOHBSYIDL-NHCUHLMSSA-N 443.547 4.052 10 10 IICE Cc1ccc(C(=O)CCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1C 918141296 ULDHMVMARGPKST-KDURUIRLSA-N 426.532 4.335 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)C2)cc1 1130826923 NIQGHQXMBYFHLM-QGZVFWFLSA-N 433.464 4.404 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@H](C(=O)NCc1ccc(N(C)C)cc1)C2 1135643667 XYBHHEVISCGEKM-NRFANRHFSA-N 427.520 4.183 10 10 IICE CC(C)C[C@@H](CC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1)NC(=O)OC(C)(C)C 1136443099 QFYFQGNOFNEDPD-ICSRJNTNSA-N 433.593 4.030 10 10 IICE Cc1cc(CC(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c(C)n1-c1ccccc1 1150641148 HDTLOLSRFKACGC-UHFFFAOYSA-N 431.580 4.480 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1C 1150860131 GQVLHZFFEZQTOR-HSZRJFAPSA-N 429.564 4.366 10 10 IICE CCOc1ccc(N2CCN([C@@H]3CCN(c4ccc(Cl)cc4Cl)C3=O)CC2)cc1 1168331680 ODLFFIXOSNNUTM-OAQYLSRUSA-N 434.367 4.320 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3ncon3)C2)c(C)n1-c1ccccc1Br 1178363796 PUCWRDVKKMTGOL-HNNXBMFYSA-N 429.318 4.259 10 10 IICE Cc1cc(CC(=O)Nc2ccc(I)cn2)c(C)n1-c1ccccc1 1265163744 PILFNYZLOVBWEG-UHFFFAOYSA-N 431.277 4.275 10 10 IICE COc1cc(C2(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2)ccc1C 1265564802 WBLYCFQGXRTBJT-GOSISDBHSA-N 430.495 4.422 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccc(C)cc3)c2C(F)(F)F)cc1 1278287979 AYNOJZQWLBPNLP-UHFFFAOYSA-N 446.473 4.417 10 10 IICE CCCc1c(C(=O)N(C)CCN(C)c2ccc(OC)cc2)nnn1-c1cccc(Cl)c1 1278287982 BCRVMOPRGJERKU-UHFFFAOYSA-N 441.963 4.090 10 10 IICE COc1cc(Br)c(N)c(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 1290331032 ATDATWIKBLOQHH-UHFFFAOYSA-N 432.362 4.302 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291506058 SXHDGZIRCLGQHE-MRXNPFEDSA-N 437.510 4.051 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(Br)ccc3OC(F)F)ccc21 1292207614 XHWGUNWHEPTKCH-UHFFFAOYSA-N 425.273 4.363 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1293571602 OGTQKFVYZJVWQH-WMZHIEFXSA-N 434.588 4.238 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1ccc(Cl)c(I)c1 1299721175 DOODPGINWHTSBU-UHFFFAOYSA-N 438.652 4.128 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3ccc(F)cc3)n2)c(C)n1-c1ccc(OC(F)F)cc1 1307280664 HJMCGZYRUUFWSA-UHFFFAOYSA-N 441.413 4.371 10 10 IICE C[C@H](C(=O)Nc1nc(-c2ccc(F)cc2)cs1)N1CCOc2cc(N(C)C)ccc21 1307648477 OUSLPMCDYWDDQS-CQSZACIVSA-N 426.517 4.241 10 10 IICE CON(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccccc1Cl 1307812639 HHKVBVFLDMBGHN-UHFFFAOYSA-N 434.879 4.118 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1 1312887105 ZFUQZQCXZFOMAM-SFHVURJKSA-N 448.571 4.026 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(F)c(Br)c1 1438885668 GBQNBOVKZVDPSL-INIZCTEOSA-N 448.380 4.150 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cc(F)c(F)cc2NC(C)=O)CCCC1 1442827324 VTYZFGBJMCGRRU-UHFFFAOYSA-N 427.451 4.404 10 10 IICE Cc1cc(CC(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1443012438 OHZWNJVDBUCPMK-UHFFFAOYSA-N 425.573 4.400 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3[nH]c4c(Cl)cccc4c3C)cc2F)CC1 1443590275 FWAYOKKRWLDIEP-UHFFFAOYSA-N 428.939 4.341 10 10 IICE C[C@H]1COCCN1C1CCN(C(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CC1 1450523854 LLULXJCWLVAJQL-IBGZPJMESA-N 435.572 4.493 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)N(C)C)cc1 1463279707 JPHHNIIAPUHPAP-JOCHJYFZSA-N 440.588 4.061 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2C)c1 1468017792 PAGSUVMFKBFSKG-OALUTQOASA-N 447.501 4.194 10 10 IICE Cc1cc(CC(=O)NC[C@H](CC(=O)O[C@@H]2CCOC2)CC(C)C)c(C)n1-c1ccccc1 1469530496 GDYHAWAJMDGIQV-XUZZJYLKSA-N 440.584 4.137 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(C(=O)c4ccc(C)cc4C)CC3)C2)cc1 1478956338 FGZPYRLINYOUSI-NRFANRHFSA-N 435.568 4.195 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1501847769 XHSSOPXPNXBQMA-GHTZIAJQSA-N 427.593 4.028 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(CC)CC)cc2)C1 1503153407 WZHDIMSFXNFIRK-JOCHJYFZSA-N 448.615 4.406 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CC(C)C)C(=O)[C@H]1C 1514788914 KJLUIPKNMSCUAD-OAQYLSRUSA-N 448.615 4.456 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@H](C)C1 1519144614 OCRNMVNJGKQVHS-PXNSSMCTSA-N 429.584 4.125 10 10 IICE C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524851399 PXMYRZZFZRHALB-AWEZNQCLSA-N 442.428 4.315 10 10 IICE C[C@H](NC(=O)c1cc2c(Br)cccc2cn1)c1ccc(N2CCOCC2)cc1 1535558700 PQFJPLWIDAFROU-HNNXBMFYSA-N 440.341 4.325 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(-c2cccc(Cl)c2F)no1 1570514994 XHIVMDBTSRLOHO-UHFFFAOYSA-N 432.835 4.045 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2Cl)C1 1586083082 VWPGXLQBTYUUMH-SJLPKXTDSA-N 443.950 4.385 10 10 IICE CN(C)Cc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1587782594 YXFNZNODONUBMV-UYRXBGFRSA-N 443.569 4.117 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@H](C(F)(F)F)C2)c(C)n1-c1ccc(Br)cn1 1629963356 KUCHMLGJXWSPIS-XHDPSFHLSA-N 446.267 4.043 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1 1631543282 SMMAYBKPGMLKMA-OAHLLOKOSA-N 426.513 4.185 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cnn(-c2ncccc2Cl)c1C(F)F 1638573172 LWEHJSAMYMFLPQ-UHFFFAOYSA-N 429.814 4.042 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(c4c(F)cccc4F)CC3)c2C)cc1 1638947233 SNIYCOZBYAUOJN-UHFFFAOYSA-N 425.479 4.343 10 10 IICE Cc1cc(CC(=O)NC[C@](C)(O)c2ccccc2Br)c(C)n1-c1ccccc1 1639552406 DGUZYSBMWOIEHF-QHCPKHFHSA-N 441.369 4.423 10 10 IICE CSc1cccc(N2C[C@H](C(=O)NCc3cc(Cl)cc(Cl)c3O)CC2=O)c1 1641997587 RVRYFEXWASFGKC-GFCCVEGCSA-N 425.337 4.090 10 10 IICE COc1ccc(N2CCN(Cc3cccc(Br)c3Cl)CC2)c(OC)c1 1648086564 CSMWNSLOZXDPNY-UHFFFAOYSA-N 425.754 4.442 10 10 IICE COc1ccc([C@@H](NC(C)C)C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1 1648435832 WHVPCLLNSYJRHS-JWQCQUIFSA-N 439.600 4.008 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)c2cccnc2)c(C)n1-c1ccc(Br)cc1 1653443331 FBAYJRIVFWBQHH-HXUWFJFHSA-N 428.330 4.057 10 10 IICE COc1ccc(N(Cc2cccs2)C[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1 1657566875 KRBRHEYJIMSEKC-IBGZPJMESA-N 438.549 4.088 10 10 IICE COC(=O)c1nc([C@@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)sc1C 1683253112 CTBFDLXNKKXYDT-KXBFYZLASA-N 444.601 4.090 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@]3(C)Cc3ccc(F)cc3)C2)cc1 1683504568 XJHSIBVRQMTZPG-CPJSRVTESA-N 425.548 4.467 10 10 IICE Cc1cc(CNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(C)n1-c1ccccc1 1687286549 LBXISRFXULABKI-SFHVURJKSA-N 426.561 4.245 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1695299946 WVLZTMNKABSQRU-HXUWFJFHSA-N 444.643 4.288 10 10 IICE CCOCC(C)(C)Cn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1696278341 UGHNIQZFWRVJQW-UHFFFAOYSA-N 441.620 4.019 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc2c(c1)CCCN2C 1698409726 YMCRFNJIVLTNRM-DYESRHJHSA-N 429.634 4.138 10 10 IICE C#CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN1CCC[C@@H](C)C1 1705547018 PTVSNJNXRAQNLS-HXUWFJFHSA-N 430.600 4.154 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cccnc1OC 1708397858 YSMJDGSQJXHOAH-IBGZPJMESA-N 434.588 4.480 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H]3OCCC[C@@H]3C2)cc1 1710026987 VCEVOZNNCGRBFQ-GGAORHGYSA-N 425.621 4.376 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cc(C)cn1 1712374587 XEDIJSQTUQHAQB-UHFFFAOYSA-N 447.587 4.030 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)N1CCC[C@@H](C)C1 1712655369 KQICPYAGRJXATC-QUCCMNQESA-N 436.604 4.471 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CC1CN(C(=O)OC(C)(C)C)C1 1729420092 GWHUWJRNYWRLBT-UHFFFAOYSA-N 441.576 4.145 10 10 IICE COCCN(C)c1nnc(-c2c[nH]c3ccccc23)n1CCCSc1nccs1 1730720388 SUKMXFIIJJHMRZ-UHFFFAOYSA-N 428.587 4.148 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@H]1CCO[C@H](C)C1 1747030683 ZLQQKBMCMQNJOX-RTWAWAEBSA-N 441.620 4.256 10 10 IICE CS[C@H](C)Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1750233684 ZKRQLXSOCAGMNZ-GFCCVEGCSA-N 436.379 4.129 10 10 IICE C[C@@H]1C[C@@H]1n1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1752054203 XPNIQPYALJPLMY-NJAFHUGGSA-N 427.549 4.273 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC[C@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1762447620 HWJGPCDPWGFBNK-KRWDZBQOSA-N 439.583 4.020 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@]3(C)CCCO3)CC2)cc1 1768705137 WWVAYBBKVUFSHX-VWLOTQADSA-N 441.620 4.161 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1771436484 NAMPXEFRYWYIAR-NHCUHLMSSA-N 429.634 4.274 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCCC(C)C)sc(C)c1-c1ccc(OCC)cc1 1860762793 ROXWFGMHTZVYOC-UHFFFAOYSA-N 446.569 4.400 10 10 IICE Cc1ccc(Cn2cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)ccc2=O)cc1 1861854473 NFMJKUURLIVPIA-UHFFFAOYSA-N 448.478 4.233 10 10 IICE COCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CCCCCC2)C1=O 1873165452 OWNVGJBBXPUIQX-UHFFFAOYSA-N 435.568 4.133 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CNCc2cc(Br)cc(F)c2O)CC1(C)C 1878889097 DOKXEPYXOABBJT-GFCCVEGCSA-N 431.346 4.419 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@@H]2[C@H](NCc3cc(Br)cc(F)c3O)[C@H]21 1966019278 MNXMHMLOUJHWMH-KBMXLJTQSA-N 429.330 4.171 10 10 IICE CN[C@@H](c1ccc2c(c1)CCCN2C)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044757136 VCWBABHUCHFXJW-UPVQGACJSA-N 439.600 4.440 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@H](N)c1ccc(N2CCCC2)cc1 2044760067 HMLKLUWDGGMTNC-DNQXCXABSA-N 438.616 4.312 10 10 IICE CC[C@H](NC[C@@]12C[C@H]1CN(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2092532396 SLQYMFKAPQZWLO-ZSOFBXJNSA-N 425.367 4.452 10 10 IICE C[C@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)CCN(C(=O)OC(C)(C)C)C1 2103298768 FSCZLGGIFHGKGT-WFASDCNBSA-N 431.346 4.419 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](NCc2cc(Br)ccc2O)(C(F)(F)F)C1 2103577888 PQSYZUMNZBOJRQ-MRXNPFEDSA-N 439.272 4.186 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3ccc(Br)cc3O)C(C)(C)[C@H]21 2119290657 JGONPDOAOGFAMX-PVAVHDDUSA-N 425.367 4.278 10 10 IICE O=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)C1=Cc1cc(Cl)cc(Cl)c1O 2294208460 DVPOZLGNMSDJRM-UHFFFAOYSA-N 427.696 4.184 10 10 IICE COc1cccc(-n2c(C)cc(C=C3C(=N)N4N=C(SC)SC4=NC3=O)c2C)c1 2297470127 GNZSBPKENQRYMA-UHFFFAOYSA-N 425.539 4.042 10 10 IICE O=C1NC(=S)N(c2ccccc2F)C(=O)C1=Cc1ccccc1OCc1ccccc1 2313558945 NJWOTKQJBIDUTG-UHFFFAOYSA-N 432.476 4.236 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3cc(OC)ccc3OC)SC2=S)cc1 2314732368 QJMZGJJGPBLJML-UHFFFAOYSA-N 429.519 4.286 10 10 IICE CCCC1=NN2C(=N)/C(=C\c3cccn3-c3ccc([N+](=O)[O-])cc3Cl)C(=O)N=C2S1 32964127 YMJZIURXXYXMRX-CHLNCNNDSA-N 442.888 4.458 10 10 IICE COc1cc(CNC(=O)/C=C/c2ccc(N3CCOCC3)cc2)ccc1OCCC(C)C 97553947 SRCZKIUYVFVQKZ-YRNVUSSQSA-N 438.568 4.286 10 10 IICE COc1ccc(N2CCN(C(=O)CN(C)[C@H](C)c3ccc(Cl)cc3Cl)CC2)cc1 105815104 LZMRXCHXFSPYAB-MRXNPFEDSA-N 436.383 4.344 10 10 IICE COc1ccc(OC)c([C@H](C)NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 108446028 RIBIPTGWUZJFGU-ZACQAIPSSA-N 445.535 4.017 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@H](c3ccccc3Br)C2)c([N+](=O)[O-])c1 209608775 BEIPTSQJQITLCS-FUKPKEADSA-N 447.285 4.121 10 10 IICE COc1cc(F)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 557932100 NRRUTEIGJXACFL-UHFFFAOYSA-N 425.504 4.203 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cccc1O 687755217 QZYLXWRNKPSGNS-RUZDIDTESA-N 433.460 4.326 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccco2)c(-c2ccco2)s1 727244082 SAENVUGBNAQIQC-UHFFFAOYSA-N 448.478 4.460 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(C(=O)OC(C)(C)C)cc3F)CC2)cc1 763995758 CQLDLGLPBBYERG-UHFFFAOYSA-N 429.492 4.144 10 10 IICE Cc1cccnc1[C@@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(C)C 768727880 PPIFHGWBBWXUDW-DEOSSOPVSA-N 435.616 4.119 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1C(F)F 769140892 WODHAYBTJUCJHD-UHFFFAOYSA-N 446.420 4.221 10 10 IICE COc1ccc(CNC(=O)N[C@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c(O)c1 793042819 UNHFWWXZRPHROD-FPOVZHCZSA-N 435.927 4.217 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2cc(Br)ccc2O)cc1 804737650 VFUVBIDEFAVOEK-UHFFFAOYSA-N 435.318 4.109 10 10 IICE Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657909 LYTIKJRSIAYKMR-QGZVFWFLSA-N 426.467 4.087 10 10 IICE O=C(/C=C\c1cccc(OC2CCCC2)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129659902 ACAREQVCAPGOCD-HJWRWDBZSA-N 442.506 4.452 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)[C@@H](CO)c2ccc(Cl)cc2)C1 1141299515 INSDMQCUHHBINA-DEOSSOPVSA-N 439.987 4.253 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1148054856 DCZQULNTINKMBP-LJQANCHMSA-N 427.545 4.184 10 10 IICE COC(=O)c1c(NC(=O)CSc2nc3cc(F)c(F)cc3[nH]2)sc2c1CCCC2 1188591144 SIHFNNDVGCMDBL-UHFFFAOYSA-N 437.493 4.299 10 10 IICE CC1(C)Cc2cccc(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)c2O1 1264640750 HJPKCJKKWCQYIQ-UHFFFAOYSA-N 434.458 4.186 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Br)cc(N4CCCC4)c3)C2)cc1 1278860867 CLFMCVAXYUVAIG-SFHVURJKSA-N 444.373 4.067 10 10 IICE CC(C)[C@@H]1OCC[C@@H]1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1287304816 DMBYUZUHMKOHNH-KNQAVFIVSA-N 426.586 4.334 10 10 IICE Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1296676249 BZYRJVKCNQOZBU-MRXNPFEDSA-N 428.529 4.134 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC[C@@]2(C1)CC2(F)F 1300222168 LRXLOIWTNMLYKQ-XZGNNNQISA-N 440.512 4.065 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCCOCC(C)C)CC2)cc1F 1300246028 CNJZCQVKDSOOFR-UHFFFAOYSA-N 447.599 4.113 10 10 IICE COCCN(Cc1ccco1)c1nnc(CC(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1301791642 UPLUKGSMFZHXSI-UHFFFAOYSA-N 443.567 4.366 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccoc2)n1Cc1ccc(N2CCOCC2)c(F)c1 1305386793 APLVPYVANBBAQA-QGZVFWFLSA-N 427.524 4.045 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1306270275 AAFLMDZMEWKICH-HRAATJIYSA-N 439.583 4.018 10 10 IICE CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1351674750 YNEFLXUXHXDMDH-VWLOTQADSA-N 446.595 4.110 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1Cc2ccc(O)cc2N1C(=O)OC(C)(C)C 1442339925 CMJPBRBKODVKCO-QFIPXVFZSA-N 439.556 4.173 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(CN4CCNC4=O)cc3)c2C)c1 1454776748 SIXUBIRSZGKLID-UHFFFAOYSA-N 430.552 4.166 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3sc(SCC(C)C)nc3C)C2)cc1 1461077749 PCRHOSGTTNKLNQ-KRWDZBQOSA-N 433.643 4.393 10 10 IICE Cc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1-n1c(C)cc(C=O)c1C 1465029460 KQWPVDCUZSRLKT-OAQYLSRUSA-N 441.572 4.494 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)C[C@H]3CCCO[C@H]3c3ccccc3)C2)cc1 1478860717 RAUYOQXATQSEBR-LFAGZIFBSA-N 437.584 4.331 10 10 IICE CCC[C@@H](Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1500136976 VSEIGOWTIQNZDB-QFIPXVFZSA-N 429.609 4.017 10 10 IICE CCC[C@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1514389476 MTTBQELRNIOELL-DEOSSOPVSA-N 448.615 4.164 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H](C)C3)nnc2[C@]2(OC(C)C)CCOC2)cc1 1515527998 FHCXUZORQBBIRH-CPJSRVTESA-N 441.620 4.059 10 10 IICE Cc1cc(CC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)c(C)n1-c1ccc(Cl)cc1 1527334264 HFDDZBZJQPHANU-QHCPKHFHSA-N 435.955 4.380 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(C)C)C2)cc1 1529706825 IQHFEAYCPQDIIB-GHTZIAJQSA-N 447.620 4.213 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)Oc2ccc(C(F)(F)F)cc2)N(C)C)cc1 1539707848 UKHSEXZRQBUEPX-FQEVSTJZSA-N 437.506 4.348 10 10 IICE C[C@@H]1SCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)[C@@H]1C 1545157155 RJCSMMAAIZWUSD-CABCVRRESA-N 432.644 4.309 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)c(C)n1-c1ccccc1 1595950636 SWVSRVMTPXMCIF-IBGZPJMESA-N 437.490 4.084 10 10 IICE CCc1ccccc1O[C@@H](C(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccccc1 1596523034 FHWWHSVEXDTTBK-HHHXNRCGSA-N 443.591 4.437 10 10 IICE Cc1ccc(CC(=O)N2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)cc1 1610400405 FKDFYBYZAXJBRF-UHFFFAOYSA-N 429.564 4.238 10 10 IICE Cn1cccc1-c1nnc(N2CCC[C@@H](C(F)F)C2)n1CCCSc1nccs1 1618442684 DPHMVRNUNVOVLB-CQSZACIVSA-N 438.573 4.404 10 10 IICE CCNC(=O)c1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)s1 1623557977 ADERDSVJTLCAOA-UHFFFAOYSA-N 438.597 4.166 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCCC(=O)c2ccc(Br)cc2)cc1 1628469377 YRXAWFLZNITLFX-UHFFFAOYSA-N 447.373 4.406 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1628667636 YVRNSJVLYVWYOV-SSGOSMAHSA-N 433.335 4.410 10 10 IICE CN(C)[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1630257156 PWFQJBBTYLXZPB-CTNGQTDRSA-N 436.383 4.083 10 10 IICE CC1(C)[C@@H](NC(=O)NCc2cccc(Br)c2O)C[C@H]1OCc1ccccc1 1634535480 ABBBZNUZXJUZIH-ZWKOTPCHSA-N 433.346 4.338 10 10 IICE C[C@@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)c1ccccc1O 1635793726 FHUIIVVPBBHHIT-FZKQIMNGSA-N 449.320 4.166 10 10 IICE COCc1nn(C)cc1C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1638241601 RNQQSNFEDYFDNF-IBGZPJMESA-N 446.473 4.492 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1oc(C2CC2)nc1C(F)F 1639827226 LCVPTECDZHPLEJ-UHFFFAOYSA-N 435.471 4.492 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cc(Br)cc([N+](=O)[O-])c3=O)c2C)cc1 1651873421 JIUFBOZCIDZFRS-UHFFFAOYSA-N 444.285 4.118 10 10 IICE O=C(CN[C@@H]1CS(=O)(=O)Cc2ccccc21)Nc1ccc(N=Nc2ccccc2)cc1 1654307556 PRWYBXKPVOYKIY-JOCHJYFZSA-N 434.521 4.300 10 10 IICE COc1ccccc1NC(=O)[C@@H]1CCCN(Cc2ccc(N3CCC(OC)CC3)cc2)C1 1654990103 QLSTXYAJJMIVLR-OAQYLSRUSA-N 437.584 4.161 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc3cc(Br)ccc3[nH]2)cc1 1681168335 RLMPMYMECRFQEZ-UHFFFAOYSA-N 445.361 4.217 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CCNC(=O)NCc1cc(Cl)ccc1O)Cc1ccccc1 1687328277 GVBZHNCZTBWIDG-IBGZPJMESA-N 447.963 4.371 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@H]2C[C@H](Oc3ccccc3)C2(C)C)N(C)C)cc1 1687807570 UNFWAPNDNCMPCA-HJOGWXRNSA-N 438.616 4.243 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](N3CCCCC3)C2)n1CCCSc1nccs1 1694061246 GOTSYFXTBLKQBE-QZTJIDSGSA-N 434.679 4.495 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](CCOC)C1 1710822643 HXPCQDBVAWGOCJ-NRFANRHFSA-N 437.588 4.252 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1CCC(C)(F)F 1711080324 MPUOYJPBQROGQM-UHFFFAOYSA-N 435.563 4.385 10 10 IICE CC(C)[C@@H]1OCCC[C@H]1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1723250834 XLZNLCXSZPRHRJ-BVSLBCMMSA-N 428.577 4.313 10 10 IICE CCC(O)(CC)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1727296612 PKHAPDOGCIDBNK-UYAOXDASSA-N 430.593 4.090 10 10 IICE CCc1nnc(N2CCC[C@@H](n3nc(C)cc3C)C2)n1Cc1ccc(N(CC)CC)cc1 1727582982 IVEYNZFSRNJEOR-HSZRJFAPSA-N 435.620 4.390 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@H]1CCC[C@@H](O)C1 1729419942 ABNKMNMGUZFSOU-JWUVWSEFSA-N 442.604 4.090 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@H](OC)C2)cc1 1746091659 DOCJKQPLRQWOTH-FCHUYYIVSA-N 427.593 4.029 10 10 IICE CC(C)CCCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1750783898 VPPOSIPTQXXZLZ-JOCHJYFZSA-N 427.593 4.039 10 10 IICE C[C@H]1CCC[C@](Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752093906 XGWYNLZPPDZRNG-FNZWTVRRSA-N 448.615 4.116 10 10 IICE CCN(CC)Cc1ccc(/C=C2/SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)cc1 1860073522 NJRVYKTVHRWVKT-CPNJWEJPSA-N 425.579 4.033 10 10 IICE CCCc1nc(N2CCN(c3ccc(OC)cc3)CC2)cc(N2CC[C@@H](c3ccco3)C2)n1 1869224513 NXSSEVWJFKMJQV-HXUWFJFHSA-N 447.583 4.351 10 10 IICE CC(=O)Nc1ccc(Br)cc1C(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1891633350 BUTUSODYBXEEAM-LPHOPBHVSA-N 442.357 4.326 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)[C@@H](O)c1ccc2c(c1)CCN2C 1999507092 GCYLQOISKQUTJJ-RTFZILSDSA-N 426.557 4.211 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(Cc4cccc(C(=O)O)c4)C3=O)n12 2326973184 WJMZFUYXJGKKQF-UHFFFAOYSA-N 449.966 4.457 10 10 IICE Cc1oc(C(=O)O)cc1COc1cc(Br)cc(I)c1 2338704333 CEIPZXDIMMZFOZ-UHFFFAOYSA-N 437.027 4.232 10 10 IICE COc1ccc(CC(=O)n2nc(-c3ccco3)nc2NCc2ccc(N(C)C)cc2)cc1 14610813 HKHOCVRYALCTDP-UHFFFAOYSA-N 431.496 4.108 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3cn(CCOc4ccc(C)cc4)c4ccccc34)C(=N)N2O1 20236015 MFWCPHPZOWCEER-UDYULTBOSA-N 426.476 4.479 10 10 IICE Cc1cc(C(=O)CSc2nnc(-c3ccncc3)o2)c(C)n1-c1ccc2c(c1)OCO2 23585321 MJEWSPMGAGKPJJ-UHFFFAOYSA-N 434.477 4.243 10 10 IICE CC(C)N1C(=O)/C(=C\c2c(Oc3ccccc3F)nc3ccccn3c2=O)SC1=S 33714720 OYKCYGZWDNXNSJ-LFIBNONCSA-N 441.509 4.236 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@H](C(=O)Nc4cccc(OC)c4)[C@@H]3C2)cc1 96456627 GGUIXYXQANMOBO-AHWVRZQESA-N 443.547 4.210 10 10 IICE CN1CCCc2cc(CNC(=O)N3CCC[C@H](c4nc(-c5cccc(F)c5)no4)C3)ccc21 726710092 WHPZWCOVCHTVTB-FQEVSTJZSA-N 449.530 4.347 10 10 IICE Cc1nc(CNC(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)no1 743640070 AUPSJVZUFCTLOQ-QGZVFWFLSA-N 433.434 4.373 10 10 IICE C[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(N2CCCCCC2)cc1 767157757 WZHJKRKGVAAUIN-CAVYSCNFSA-N 446.639 4.317 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)cc1 772465266 VGGKSCIAGMKGHM-HXUWFJFHSA-N 432.524 4.183 10 10 IICE CN(c1ccc(CNS(=O)(=O)c2ccccc2Cn2ccnc2)cc1)C1CCCCC1 799764983 NFFZNYWXIUTHMQ-UHFFFAOYSA-N 438.597 4.179 10 10 IICE COc1ccc([C@@H](CC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)NC(C)=O)cc1 914456267 UVXDNBDWXKABQC-RUZDIDTESA-N 449.551 4.151 10 10 IICE Cc1cc(CC(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)c(C)n1-c1ccccc1 1124424589 HNXHTFQXLAPOGX-UHFFFAOYSA-N 437.565 4.060 10 10 IICE COc1ccc(Oc2ccc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)nc2)cc1 1125451946 SDWMPOOSMFEMNV-SFHVURJKSA-N 433.508 4.210 10 10 IICE CC(C)(C)OC(=O)N1CCc2nc(NC(=O)c3cc4cc(O)c(O)cc4s3)sc2C1 1136666426 FNKUKHYOVPUQHA-UHFFFAOYSA-N 447.538 4.315 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1144325110 QRVIIMIMQHKFBH-DEOSSOPVSA-N 448.563 4.411 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(-c3ccn(C)c3)[nH]n2)cc1 1144705298 ZFRFOAXDGSQIDO-UHFFFAOYSA-N 429.524 4.337 10 10 IICE C[C@H]1Cc2cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)ccc2O1 1147508189 UVYYVIPKLKBMLQ-HRAATJIYSA-N 439.556 4.072 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1F 1160766405 IRGWBVIAFYCNQO-OAQYLSRUSA-N 443.563 4.424 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H](C(=O)Nc4ccc(Cl)cn4)C3)cc2)CC1 1168052797 LBUPLZZQCIZXTI-LJQANCHMSA-N 442.991 4.201 10 10 IICE CC(=O)N1CCN(c2ccccc2CNCc2ccc(N(C)Cc3cccs3)cc2)CC1 1199934513 YTFILZFGSRBYSW-UHFFFAOYSA-N 448.636 4.343 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cn(-c4ccc(Cl)c(Cl)c4)cn3)C2)cc1 1276831807 FHJJRSUNMLRTNK-HNNXBMFYSA-N 445.350 4.444 10 10 IICE O=C(Cc1ccccc1OCc1ccncc1)NCc1ccc(N2CCSCC2)cc1 1291626275 GHWFYJZUMSPTMR-UHFFFAOYSA-N 433.577 4.073 10 10 IICE CN(Cc1cccs1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1298386566 GPESYTXNTYZFAM-UHFFFAOYSA-N 431.616 4.015 10 10 IICE CC(C)OC1CCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC1 1303526850 KXDYDLRSOHBSQL-UHFFFAOYSA-N 432.619 4.306 10 10 IICE CCC[C@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1306621719 ZPPZFHZTCYKEMW-SFHVURJKSA-N 427.524 4.105 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC[C@@H]1CC[C@H](C(F)(F)F)O1 1313268644 KPLVUKBKXXUCET-DZGCQCFKSA-N 439.272 4.186 10 10 IICE CC(C)Cc1nnc(N2CCCN(C3CCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1359841212 GYAPRMSHEXWRNY-UHFFFAOYSA-N 442.627 4.185 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3(N4CCSCC4)CCCC3)c2C)cc1 1441306827 IJEOOHWNDZIFJS-UHFFFAOYSA-N 427.614 4.194 10 10 IICE CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1442312852 GVNDIRPZAJMRDZ-XLIONFOSSA-N 425.573 4.260 10 10 IICE CCC(CC)[C@H](C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1)N1CCOCC1 1448445652 CASUKZCEEGDXFU-FDDCHVKYSA-N 436.040 4.330 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCCC[C@@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c1O 1460387933 LARCOSXPKSRHEA-RDTXWAMCSA-N 446.897 4.404 10 10 IICE CCN(CC)C(=O)C1(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CCCCC1 1464406990 UPWKMNUIFCIUIE-UHFFFAOYSA-N 437.584 4.137 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H]3CCCC34CCCCC4)CC2)cc(OC)c1OC 1470793757 PRYKUPBQPALYTR-OAQYLSRUSA-N 431.577 4.047 10 10 IICE CC[C@@H]1[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)CCN1C(=O)OC(C)(C)C 1470841524 VKVJWNKTVJSZER-VQTJNVASSA-N 443.544 4.485 10 10 IICE COC(=O)COc1ccc(N(C)Cc2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)cc1 1473374063 ZRZJZVSEBXGGLQ-UHFFFAOYSA-N 439.533 4.016 10 10 IICE CCO[C@H](CCn1c(C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)C1CCCC1 1502582381 SVTMWBANGVUVCZ-JOCHJYFZSA-N 445.583 4.046 10 10 IICE COc1cc(Br)c(Cl)cc1C(=O)Nc1cccc(N2CCOCC2)c1 1537157011 OMFUAJXWEMPUQX-UHFFFAOYSA-N 425.710 4.200 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cc2cn3cc(F)ccc3n2)cc1 1543115493 PIFKBIGANVDEBI-UHFFFAOYSA-N 432.499 4.324 10 10 IICE C[C@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(I)cc1 1543591946 UGOUBADGJZDLSF-HNNXBMFYSA-N 434.321 4.311 10 10 IICE COc1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1OC(C)C 1545632805 WKFSTYUYIGAYKK-GOSISDBHSA-N 432.948 4.236 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@H](c2ccc(Br)cc2)C2CCC2)cc1 1559693068 YORAIZGJBMAYFB-QFIPXVFZSA-N 430.390 4.262 10 10 IICE CCOCCCN1CC[C@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@@H](C)C1 1565726637 XFLFFRFWNYKUHW-CYFREDJKSA-N 439.600 4.082 10 10 IICE C/C=C\c1ccc(OCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1566356489 GSRDFMPFFMVKCD-MNKBLEIRSA-N 444.959 4.247 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c2c(F)cccc2F)cc1F 1583752761 PGPFGPGYBSFBQO-LJQANCHMSA-N 437.462 4.052 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCc2ccccc2)NC(=O)OC(C)(C)C)cc1 1586619074 BBAQIGXVHGGZOX-JOCHJYFZSA-N 425.573 4.458 10 10 IICE Cc1cc(CC(=O)N2CCC(NC3CCOCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1588185405 YDQKKZCHJQGXMN-UHFFFAOYSA-N 429.992 4.050 10 10 IICE Cc1csc(CCCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)n1 1612363772 AGQYWRGPAMFEGI-UHFFFAOYSA-N 434.569 4.470 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](C)N(CC)C(=O)OC(C)(C)C 1622327834 BVGSRHCPHKEKAE-CYBMUJFWSA-N 429.355 4.149 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCc2cccc(Cl)c2C1 1626157715 WBZVOJCLTDSGTK-UHFFFAOYSA-N 448.953 4.106 10 10 IICE C[C@@H](NC(=O)c1csc(Nc2cc(F)cc(F)c2)n1)c1ccc(N2CCOCC2)cc1 1626978471 QWWBPEKGIQHADR-CQSZACIVSA-N 444.507 4.493 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2ccccc2F)c2nccn2C)c1 1629295001 LNWVUVOSFWHEAH-HSZRJFAPSA-N 430.483 4.299 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)cc1F 1630201954 GPAMOTQLOBGDFX-UHFFFAOYSA-N 425.479 4.343 10 10 IICE O=C(c1cc(F)cc(Br)c1F)N(Cc1ccccc1O)C[C@H]1CCCO1 1631218783 DGIIFMGINGIBLE-CQSZACIVSA-N 426.257 4.254 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(-c2cccs2)nc2c1cnn2CC 1636058714 OJKQTUSUQSPFEX-UHFFFAOYSA-N 427.526 4.301 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cccc(S(=O)(=O)N(C)C)c1 1637243696 GQWMPNSYWADNSW-SFHVURJKSA-N 438.549 4.046 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CC(C)(C)Oc3ccc(F)cc32)N(C)C)cc1 1674160886 JWYGDMUDMREWSL-RTWAWAEBSA-N 428.552 4.096 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)nnc1C(C)(C)C 1707305895 PSVCSCVURLCQRQ-CRAIPNDOSA-N 439.526 4.154 10 10 IICE CCN(c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1709965555 GTOLWNRMBPYDIC-UHFFFAOYSA-N 443.592 4.189 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CCCCNC(=O)OC(C)(C)C 1760994776 OABAAMYTJAVUQF-UHFFFAOYSA-N 431.581 4.124 10 10 IICE C[C@H](CN1CCCCC1)Cn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O 1761432899 AVUFPIVSPJWHME-HXUWFJFHSA-N 425.621 4.475 10 10 IICE CC[C@H](C)CN(CC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1761993766 YXYSZUHGXXDCFU-IBGZPJMESA-N 449.647 4.443 10 10 IICE CCC[C@H](C)CN(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1763794796 VVHHNZHWAVTBQN-IBGZPJMESA-N 431.600 4.373 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@H](CN)c1sncc1Br 1881501378 PGZVUKHQSYQXKH-HNNXBMFYSA-N 441.395 4.067 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccnc3-c3nc4ccccc4s3)CC2)cc1 1890996781 ZNERQRVSMQATKJ-UHFFFAOYSA-N 430.533 4.329 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1C(C)(C)[C@@H]2NCc1c(O)cccc1Br 2119291555 SSGOBJDBHJYKLG-JLZZUVOBSA-N 425.367 4.278 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(C)c3)C2=O)ccc1OS(C)(=O)=O 2297356958 XVRTUEAHGRUNQY-UHFFFAOYSA-N 449.575 4.138 10 10 IICE COc1ccc2c(C=C3SC(=S)N(c4cccc(F)c4)C3=O)c(C(=O)O)[nH]c2c1 2297580094 NQJNPAWXDMDZER-UHFFFAOYSA-N 428.466 4.420 10 10 IICE CCOc1cccc(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)c1O 2321635440 IQVAJVWLZHJUBW-UHFFFAOYSA-N 432.479 4.114 10 10 IICE CCc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3cccc(OC)c3)C2=O)cc1 33413944 MZFMYJILKFJMTJ-CPNJWEJPSA-N 426.563 4.488 10 10 IICE Cc1ccc(NC(=O)COc2ccc(Cl)cc2/C=C2\SC(=S)NC2=O)c(C)c1 39794036 VSDXEUQUSSSYEG-MFOYZWKCSA-N 432.954 4.463 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 97043452 RRRQNKDXOZOBJO-HXUWFJFHSA-N 441.597 4.292 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@@H](C(=O)Nc4cccc(OC)c4)[C@@H]3C2)cc1 104915137 GGUIXYXQANMOBO-RSXGOPAZSA-N 443.547 4.210 10 10 IICE Cc1cc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nc(-c2cccnc2)n1 301127512 WZJKEVNGJCLYGA-UHFFFAOYSA-N 429.446 4.315 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cc(-c3ccccc3)on2)C1 574933375 OTJXLWHYPJFICG-UHFFFAOYSA-N 428.536 4.379 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cc3ccc4c(c3)OCO4)no2)C1 576980471 QKQNDYGBSDRZJH-UHFFFAOYSA-N 430.508 4.159 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)NC(=O)NCc2cccc(Br)c2O)c(C)c1 765532090 CTBNNUHTGNZSFV-LJQANCHMSA-N 443.345 4.209 10 10 IICE CCC1(CC)CN(C(=O)c2ccccc2SCc2occc2C(=O)OC)CC[S@]1=O 769462468 OZBDPFPFKBJNCO-SSEXGKCCSA-N 449.594 4.122 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3nc(-c4sccc4C)ns3)CC2)cc1 771267217 BVJFNBMLWWNLSZ-UHFFFAOYSA-N 429.571 4.328 10 10 IICE C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 771544389 IDFVPGXTYOUNQU-OPAMFIHVSA-N 445.510 4.290 10 10 IICE COC(=O)[C@H](NCc1cc(C)cc(Br)c1O)c1ccc(OC)c(Cl)c1 779179251 CLGAUDWSTRWGIH-MRXNPFEDSA-N 428.710 4.129 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1n[nH]c2cc(F)ccc12 789886974 ZQPJCSMRFREWOC-GDNBJRDFSA-N 446.554 4.384 10 10 IICE CCOc1cc(/C=C2\SC(=S)NC2=O)ccc1OC(=O)c1ccc([N+](=O)[O-])c(C)c1 1084178123 WABFJNSEFIDWTL-YVLHZVERSA-N 444.490 4.010 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)NC3CCN(c4ccc(OC)cc4)CC3)CC2=O)cc1 1125816153 HOPOEGOQVMHSDV-NRFANRHFSA-N 449.595 4.176 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c2c(C)nn(C)c2n1 1128488056 MKAYCLABOJNEEQ-CQSZACIVSA-N 425.964 4.405 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccccc1OCCN(C)C(=O)OC(C)(C)C 1136743479 SGVNCALVHQRCOM-UHFFFAOYSA-N 441.572 4.237 10 10 IICE CCN(CC(=O)Nc1ccccc1C(=O)NCc1ccc(C)cc1)c1ccc(OC)cc1 1167834320 FHTUNUOUTRFCCN-UHFFFAOYSA-N 431.536 4.399 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](Oc4ccc(Cl)cc4)C3)C2)cc1 1252117899 YTEIULQXKSKIRN-VGOFRKELSA-N 429.948 4.038 10 10 IICE Cc1cc(CNC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)n1-c1ccccc1 1254079792 NUGSJYAGMLPCMN-UHFFFAOYSA-N 433.512 4.034 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](N3CCCC3)C2)n1CCCSc1nccs1 1287446292 JQFRXCGBQFELEV-SFHVURJKSA-N 434.679 4.180 10 10 IICE CC[C@@H]1CCCN1c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1293411715 ONECSDYPYQWQDR-OAQYLSRUSA-N 438.620 4.080 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@H](C)CNC(=O)OCC2c3ccccc3-c3ccccc32)c1 1301047418 XEVVQAVITIFCDM-GOSISDBHSA-N 444.531 4.492 10 10 IICE CSCCCN(C)c1nnc(CC2CC2)n1Cc1ccc(N2CCSCC2)cc1 1302793019 GBOUVZZJHOVTQZ-UHFFFAOYSA-N 431.675 4.021 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1ccc2[nH]cc(I)c2c1 1305085184 RUIHJARLQHYEDQ-UHFFFAOYSA-N 426.641 4.062 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3c(Cl)cccc3Br)CC2)cc1 1352538793 XVNUWFYCJGNWKV-UHFFFAOYSA-N 437.765 4.439 10 10 IICE O=C1CC(C(=O)NCc2ccc(N3CCCCC3)cc2)(c2cccc(Br)c2)C1 1452051700 MFQDRHLWLPBMAQ-UHFFFAOYSA-N 441.369 4.357 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3sc(Cc4ccc(F)cc4)nc3C)C2)cc1 1461077746 OZUGYQXAXMGYHW-SFHVURJKSA-N 439.556 4.446 10 10 IICE O=C(C[C@H]1C(=O)Nc2c(Br)cccc21)NCc1ccc(N2CCCCC2)cc1 1469302689 MAAWQNNXHQYYKJ-GOSISDBHSA-N 442.357 4.182 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3cc(C(F)(F)F)nn3C)cc2Cl)C1 1478528681 SMYUFMIZUWHDBL-ZDUSSCGKSA-N 443.901 4.328 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1479533559 HDRTYETWZZREFJ-RUZDIDTESA-N 437.632 4.187 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCC(C)CC3)C2)n1CCCSc1nccs1 1513903129 UXLAKJCEHCULHK-LJQANCHMSA-N 448.706 4.428 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H](OC)C1 1516727024 ITFFRVHNRXJHGG-WZONZLPQSA-N 437.588 4.250 10 10 IICE CS[C@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1520125821 SSDHNSDNEKKKAN-NRFANRHFSA-N 429.634 4.008 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccnc(F)c1F 1538920371 RWRPDBDVUXXFLG-UHFFFAOYSA-N 430.212 4.084 10 10 IICE CC[C@H](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)N1CCc2ccccc2C1 1540832447 NZYKINADDLAJNB-XMMPIXPASA-N 429.564 4.473 10 10 IICE CC[C@](O)(C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Cl)c1 1545043460 ZWRKPJKCFQUPPB-HTAPYJJXSA-N 438.902 4.324 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H](C)[C@@H](OC)C2)sc(C)c1-c1ccccc1 1559757311 YJKOATAEXZARAP-QAPCUYQASA-N 430.570 4.196 10 10 IICE COc1ccc(CNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)c3ccccc32)c(O)c1 1568097764 PBPHSJHIWAVYMH-INIZCTEOSA-N 426.513 4.336 10 10 IICE CC1(C)CC[C@@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)OC1 1596542121 DKFICMSPSSRPSF-HNDQUVLASA-N 438.640 4.051 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1 1597417494 GGANWPZMRJQZRQ-IBGZPJMESA-N 439.556 4.284 10 10 IICE CC[C@H](C)N(C)CCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1613407363 PZZJWJHPYOOKPE-NRFANRHFSA-N 447.631 4.307 10 10 IICE CN(CC(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc(OCc2ccccc2)cc1 1617258748 DUYPXBRYXKFAPP-UHFFFAOYSA-N 433.527 4.190 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCc1c[nH]nc1C 1619863422 JHINIVLELGAUJP-UHFFFAOYSA-N 447.587 4.100 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)C(=O)N3c4ccccc4C[C@@H]3C)c2C)cc1 1627730701 SHOXDTOWEOMZCQ-WMZOPIPTSA-N 431.536 4.199 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1628667633 YVRNSJVLYVWYOV-LFIXQJEJSA-N 433.335 4.410 10 10 IICE CC(C)c1ccc([C@H](NC(=O)c2cc(NS(C)(=O)=O)ccc2O)c2cccs2)cc1 1629122517 HOEZLYKNAIBGMG-NRFANRHFSA-N 444.578 4.468 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1631211079 CKROANCZMVERKL-RBUKOAKNSA-N 439.600 4.072 10 10 IICE COc1ccccc1N1CC[C@H](NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1=O 1631662257 ORDGYTVTMPNCJY-FQEVSTJZSA-N 437.927 4.291 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(Cc3ccc(C(N)=O)cc3F)C3CC3)c2C)cc1 1636757354 KVHQPNMOMGRINK-UHFFFAOYSA-N 435.499 4.146 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC2(CC(=O)OC(C)(C)C)CCOCC2)c1C 1637416348 KZROILHQQUPPCD-UHFFFAOYSA-N 426.557 4.413 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)s1 1637581041 HSFBARAGFYRXRL-UHFFFAOYSA-N 436.581 4.132 10 10 IICE CCOC(=O)[C@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)[C@@H](O)c1ccc(Cl)cc1 1641948697 QMAXGJACVQHQNN-YADHBBJMSA-N 440.927 4.143 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](Cc2ccccc2)c2nccn2C)c1 1644347126 ITUJWYINKTUPRU-XMMPIXPASA-N 426.520 4.354 10 10 IICE O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)NCc1c(O)cccc1O 1645360796 JKEGJWMUBNMTOB-UHFFFAOYSA-N 433.895 4.463 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cccc(-c2nnnn2C(C)C)c1 1647787034 UNLYZURMMMUOCZ-UHFFFAOYSA-N 428.496 4.393 10 10 IICE CCOC(=O)CN(CC(=O)Nc1cccc(Oc2ccccc2)c1)Cc1ccccc1O 1654806095 POOOXGWUMUVMBY-UHFFFAOYSA-N 434.492 4.188 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCO)Cc3ccccc3)cc2Cl)C1 1682024327 QANGJVTZFPTJCP-RXVVDRJESA-N 429.992 4.369 10 10 IICE COC(=O)[C@H]1CN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)Cc2ccccc21 1684600937 ZGQWJUQQXYADGS-DEOSSOPVSA-N 431.536 4.385 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1[C@H]2Cc3c(Br)cccc3[C@@H]21 1686827267 ZJZVINBFHGSLBW-JASAOFIISA-N 442.401 4.392 10 10 IICE Cc1cccc(-c2nnc(N3CCC(NC(C)C)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1693191829 SWBHXZZCZOIJJI-UHFFFAOYSA-N 447.631 4.038 10 10 IICE Cc1ncc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)s1 1693377175 ILLSHLNHJJESLW-UHFFFAOYSA-N 426.933 4.149 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1708574993 OQBTZDGXXMXXTD-UQBPGWFLSA-N 443.636 4.224 10 10 IICE COCC1(CCn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCCC1 1730506539 PZNRIRXEEZVMKC-HXUWFJFHSA-N 428.577 4.111 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)CC(N)=O 1763323032 SPQUBGPDXLKOED-KRWDZBQOSA-N 436.604 4.489 10 10 IICE Cc1ccc(CN2N=C(C(F)(F)F)/C(=C/c3cc4c(cc3[N+](=O)[O-])OCCO4)C2=O)cc1 1865679382 KUHJDAWRPYNLDI-NVNXTCNLSA-N 447.369 4.019 10 10 IICE O=C(NC[C@H](NCc1cccc(Br)c1O)C(F)(F)F)OCc1ccccc1 1942700266 BGIRGPYKSPOSRK-HNNXBMFYSA-N 447.251 4.102 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1ccc(O)c(O)c1 1952824461 BNFPPMNSVJBPMO-HYBUGGRVSA-N 445.471 4.495 10 10 IICE CC(C)(C)OC(=O)Nc1ncc(CNCc2cc(Br)cc(F)c2O)s1 1962850745 XDIGAAMDKWOAEG-UHFFFAOYSA-N 432.315 4.387 10 10 IICE CC(C)(C)OC(=O)NCCN(CCCC(=O)Nc1ccc(N)cc1)Cc1ccccc1 1999439052 DYBZCQYHKXFMIM-UHFFFAOYSA-N 426.561 4.014 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H]2[C@H]1CNCc1cc(Cl)cc(Br)c1O 2078327243 AZCQZGXAJJILER-CORIIIEPSA-N 431.758 4.153 10 10 IICE Cc1c(C2(C)CC2)nn(Cc2cccc(Br)c2O)c1I 2079802483 HEOGGJNFTCCIMD-UHFFFAOYSA-N 447.114 4.364 10 10 IICE O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=Cc1cccc(C(F)(F)F)c1 2294095344 QOZPUQBCKRSMMQ-UHFFFAOYSA-N 439.187 4.134 10 10 IICE COc1cc(N2CCCCC2)ccc1C=C1NC(=O)N(Cc2ccc(Cl)cc2)C1=O 2294276892 DSSBEXURSSQUNY-UHFFFAOYSA-N 425.916 4.432 10 10 IICE COC(=O)c1[nH]c2ccc(F)cc2c1C=C1SC(=S)N(c2ccc(O)cc2)C1=O 2296599773 USVDPVHBQGESLF-UHFFFAOYSA-N 428.466 4.205 10 10 IICE CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1=O 8644671 LCQFOGQVTSBXDQ-RUZDIDTESA-N 433.483 4.273 10 10 IICE C[C@H]1SC(=S)N(CCCCCC(=O)Nc2ncc(Cc3ccccc3)s2)C1=O 11636559 APLVWCKWLIQQJV-CQSZACIVSA-N 433.624 4.482 10 10 IICE COc1cccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@@H]32)c1O 14459686 AFGIGDYJTCHWBK-BSRJHKFKSA-N 440.565 4.402 10 10 IICE CCCNc1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N(C2CCCCC2)C1=O 33526207 CANDMXSPABOMLM-ATVHPVEESA-N 442.610 4.359 10 10 IICE Cc1ccc2oc(SCC(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)nc2c1 303645916 SSJYEBQLBRUCRW-HOTGVXAUSA-N 443.544 4.297 10 10 IICE CC(C)(C)OC(=O)NC1CCC(OCCNCc2c(O)cccc2Br)CC1 706852104 PGASYLQNWGSWRD-UHFFFAOYSA-N 443.382 4.097 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(N4CCCCC4=O)cc3)ccc21 728470456 LCVLBVCRWFTTIA-UHFFFAOYSA-N 433.552 4.351 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)Cc2c(C)nn(-c3ccc(C(F)(F)F)cn3)c2C)c1 728981970 GMTCAHPKOLSLHE-LBPRGKRZSA-N 448.445 4.037 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNC(=O)NCc1ccc(N2CCCC2)cc1)c1ccccc1 743551990 KYJHVFWZASOSAX-JOCHJYFZSA-N 438.572 4.352 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc(Cl)cc2)cs1 748680521 FAGLOJWNBABITF-UHFFFAOYSA-N 425.875 4.181 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccc(F)cc2F)cc1 749473927 XUTOPMUAOTTWGB-VSDWSMLSSA-N 441.522 4.121 10 10 IICE Cc1cc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)nn1[C@@H](C)C1CC1 752863936 MNOVPRYGWTZCBY-IBGZPJMESA-N 436.604 4.016 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]4CCCC[C@@H]4N3c3ncccn3)cc2)CC1 764099719 SSMFMSVYRXYZGS-NHTMILBNSA-N 433.600 4.167 10 10 IICE COc1ccc(N2CCN(Cn3nc(-c4cccc(Cl)c4)n(C)c3=S)CC2)cc1 764856281 GKBSEDORVJEDGC-UHFFFAOYSA-N 429.977 4.060 10 10 IICE O=C(Cc1coc(-c2ccc(F)cc2)n1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 771062525 APJUEMKFLXRAEB-IBGZPJMESA-N 443.906 4.163 10 10 IICE FC(F)(F)Oc1cccc(C2(NCc3ccc(N4CCOCC4)cc3)CCOCC2)c1 775027519 HSDDLBZCCRDNBA-UHFFFAOYSA-N 436.474 4.217 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(-c2cccs2)nc2c1c(C)nn2C 808094150 CUFNTXUAYBEUQA-UHFFFAOYSA-N 427.526 4.127 10 10 IICE Cn1cc(CNCc2cc(Br)ccc2O)c(-c2ccc3c(c2)OCCCO3)n1 809713388 OAKNMTAGHVPTGJ-UHFFFAOYSA-N 444.329 4.006 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(Br)ccc1F 1127182276 VHDHRGZIKXLVAW-UHFFFAOYSA-N 446.364 4.050 10 10 IICE O=C(Cc1csc(CCC(F)(F)F)n1)NCc1ccc(N2CCSCC2)cc1 1136282557 OVJKWGSMYSDTMF-UHFFFAOYSA-N 429.533 4.050 10 10 IICE CC(C)(C)OC(=O)N(CC1CC1)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1148787571 OPFWRFOTXQVSFQ-UHFFFAOYSA-N 429.521 4.101 10 10 IICE Cn1cc(-c2ncccc2C(=O)N2C[C@@H](CCNC(=O)OC(C)(C)C)c3ccccc32)cn1 1156931588 FTRGMXGWDINBJU-QGZVFWFLSA-N 447.539 4.141 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1225677141 YTPAOIRIZANBOI-NRFANRHFSA-N 446.954 4.271 10 10 IICE O=C(COc1cccc(C(F)(F)F)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860436 SLQSIFIHWYUCKU-QGZVFWFLSA-N 442.865 4.224 10 10 IICE Cc1cc(C(=O)NCc2cc(S(C)(=O)=O)ccc2F)c(C)n1-c1ccc(Cl)cc1 1296943744 RRPKIULJEDNAIV-UHFFFAOYSA-N 434.920 4.220 10 10 IICE CC(C)OCC(C)(C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1299293873 CWGNVZUUWPVVNN-PTNGSMBKSA-N 426.629 4.049 10 10 IICE C/C=C\COc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1350761652 RVULEHOOGNTJJT-IHWYPQMZSA-N 448.485 4.356 10 10 IICE CC(C)c1cccc(O[C@@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1356422670 UTAQQZZFJNKHFN-NRFANRHFSA-N 435.612 4.426 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCSC1(C)C 1359681080 OJHOYEYDDODCGF-FQEVSTJZSA-N 443.661 4.406 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c(O)c(C(C)C)c1 1441944046 GGRKSWOTULFILC-IBGZPJMESA-N 437.584 4.271 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cccc(CN4CCN(C)CC4)c3)c2C)c1 1443150498 FJLWQKDRMJMBGY-UHFFFAOYSA-N 444.623 4.388 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2nccc3c(Br)cccc23)N(C)C)cc1 1463287058 XKAYTMSPEXDPRC-HXUWFJFHSA-N 441.373 4.096 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C(F)=C\c3ccc(C(F)(F)F)cc3)cc2)C1 1464363662 RPLHWGICMCSSSW-XNHPLOEXSA-N 449.448 4.034 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2cc(Br)ccc2o1 1469231443 ZODHTVUJPKPMPK-UHFFFAOYSA-N 432.270 4.106 10 10 IICE COC(=O)/C=C\c1ccc(N2CC[C@@H]3[C@@H](CCCN3Cc3ccccc3)C2)c([N+](=O)[O-])c1 1472722446 SCMGBCGZJMBAAS-XTPVVANBSA-N 435.524 4.272 10 10 IICE Cc1nnc(N(C)[C@@H](C)C2CCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1492788258 YDRZSSNFJHQEPP-IBGZPJMESA-N 425.621 4.249 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)CCO1 1499753042 ZHHGLMBCFMLCAJ-QGZVFWFLSA-N 447.605 4.262 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cnccn4)n3CC(C)(C)C(C)C)CC2)cc1 1504291931 DIUVKUOTZSZVSL-UHFFFAOYSA-N 449.603 4.143 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCOc2ncccc2C(F)(F)F)CCCC1 1518985268 MWSQNCZNGWICNC-UHFFFAOYSA-N 447.457 4.138 10 10 IICE Cc1ccc(C(=O)NCCNC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)cc1F 1525893431 BGFHPYBRFRVVGT-UHFFFAOYSA-N 427.907 4.355 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccccc3OC(F)(F)F)cc2F)C[C@@H](C)O1 1527481768 QPWWTKSSDDEOOH-ZIAGYGMSSA-N 426.410 4.268 10 10 IICE COc1ccc(N2CCN(C(=O)c3cncc(-c4ccc(Cl)cc4)c3)CC2)c(OC)c1 1534277887 DXYOYRVIVGELHE-UHFFFAOYSA-N 437.927 4.382 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)Cc3ccccc32)c1 1545684260 QBSZJZHCDXHKNV-MGPUTAFESA-N 426.513 4.113 10 10 IICE Cc1cc(C(=O)N[C@H]2CN(c3ccccc3)C2=O)c(C)n1-c1cccc(Br)c1 1567495882 TXMJHRONSFNLLP-FQEVSTJZSA-N 438.325 4.002 10 10 IICE O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc2cc(O)c(O)cc2s1 1584084043 AYVLEBCIAKSYJW-UHFFFAOYSA-N 431.271 4.112 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1 1585264260 POMYTHCOUDQYAC-FQEVSTJZSA-N 442.625 4.285 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccn(CC(C)C)c2=O)cc1 1585493141 RNMSFZKYUUIWRD-UHFFFAOYSA-N 433.552 4.426 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC1CCC(F)CC1 1586534066 QIPGYPLUOYLKMP-WJDWOHSUSA-N 426.604 4.374 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccccc3SCc3ccco3)cc2)CC1 1598009480 NPZWCNZDFHCBIJ-UHFFFAOYSA-N 449.576 4.204 10 10 IICE CN1CCN(c2ccc(CNC(=O)C(F)(F)c3cccc(Cl)c3Cl)cc2)CC1 1598277034 JPPHOLHDLLRQTI-UHFFFAOYSA-N 428.310 4.153 10 10 IICE Cc1nnc(N2CCC=C(Br)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1612578247 JSFSVEKIVKWUNQ-UHFFFAOYSA-N 430.394 4.360 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](C(=O)OC)C2)n1Cc1ccc(N(CC)CC)cc1 1613266707 BRVKITWUIREUNZ-QUCCMNQESA-N 427.593 4.076 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCc2ccc(Br)s2)N(C)C)cc1 1618636366 YEPQMIXOKWHQDC-GOSISDBHSA-N 438.435 4.318 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)C[C@@H]3CN(c4ccccc4)C(=O)O3)ccc21 1625614435 YTWJLTQMIBMWOH-OAQYLSRUSA-N 435.524 4.002 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(Cl)c3)ccc21 1626941315 WZNHMKXAUFLRPZ-VGSWGCGISA-N 446.378 4.212 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 1630272552 AOTRHBBCJBXSAK-JOCHJYFZSA-N 436.552 4.249 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)[C@@H]1c1ccc(Cl)c(Cl)c1 1630273301 MPLXPKDTMMYNDI-ZHRRBRCNSA-N 447.362 4.414 10 10 IICE CCOc1ccc([C@@H](O)C2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)cc1 1636715060 JSIRSOFXCMGETR-JOCHJYFZSA-N 427.522 4.297 10 10 IICE O=C(CCSCc1nc(O)c2c3c(sc2n1)CCC3)NCc1cccc(Cl)c1O 1637227349 YEJMCKNNYKVAGP-UHFFFAOYSA-N 449.985 4.184 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCC12CC(CN1C(=O)OC(C)(C)C)C2 1638243705 MCZBUIIBKFLFHG-ONSGGECDSA-N 429.605 4.288 10 10 IICE COC(=O)[C@@H]1C[C@H](C)CCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1639165633 DOZCXASKZOSXGR-YJYMSZOUSA-N 433.346 4.270 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCc2cc(O)ccc2C1 1648941167 NMJGLIDBCACBQR-LDADJPATSA-N 444.603 4.020 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)/C=C1/SCC(=O)N1C 1654253757 YUTFKHHNDNMSMB-RYFGYPJOSA-N 449.498 4.345 10 10 IICE Cc1nc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)sc1C 1692913127 UNBOKMTXPKOYSE-UHFFFAOYSA-N 440.960 4.457 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)OC)CC1 1694976446 BZWVPHPZOPZEEO-POHAHGRESA-N 448.571 4.207 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1CCCCC1 1723559818 GMEQJISLYLYRTJ-UHFFFAOYSA-N 438.620 4.233 10 10 IICE CC[C@H](C)[C@H](Cn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1726860231 OZPZAMIVQLPHDI-CVDCTZTESA-N 441.620 4.017 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1727690331 WMSWQIJHPLSPQH-WIYYLYMNSA-N 448.615 4.456 10 10 IICE CCN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1)[C@@H](C)C1CCC1 1728285246 IGUFOVGZSRVSCL-IBGZPJMESA-N 425.621 4.475 10 10 IICE CCN1C(=O)CCc2cc(-c3csc(NS(=O)(=O)c4ccc(F)cc4)n3)ccc21 1859571652 NYDCYIWJMWLLEG-UHFFFAOYSA-N 431.514 4.049 10 10 IICE CCOC(=O)c1c(NC(=O)CC(=O)OC)sc(C)c1-c1ccc(Br)cc1 1865786680 WVPOQZFCPSGDNJ-UHFFFAOYSA-N 440.315 4.164 10 10 IICE COc1ccc(N2CCN(c3cc(N(C)CC(C)(C)C)nc(-c4cccnc4)n3)CC2)cc1 1869367589 CVVYAIJBKLPNMA-UHFFFAOYSA-N 446.599 4.356 10 10 IICE CC(C)(C)OC(=O)N1CC2(CC2)C[C@@H]1CNCc1cc(Br)cc(F)c1O 1965970105 IMCWWGMDLBBAKE-CQSZACIVSA-N 429.330 4.173 10 10 IICE O=C(COC(=O)C=Cc1ccccc1Cl)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 2040421112 OHIDBKBIBYYZFI-UHFFFAOYSA-N 445.858 4.311 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C(C)(C)C)c(C=O)c1I 2079848776 NBKLNLFYNBZCCQ-CQSZACIVSA-N 442.297 4.311 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(NCc3cc(Br)ccc3O)CCC[C@@]2(F)C1 2126055412 LWMCVAYTUJFCHQ-MOPGFXCFSA-N 429.330 4.126 10 10 IICE C[C@@]1(CCOCc2ccccc2)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2197750971 BBKPWGXWFFOUMB-CTNGQTDRSA-N 431.330 4.010 10 10 IICE CN(Cc1cccc(I)c1)c1ccc(CN)c(Br)c1 2265614801 OQQJDKLEHKHTEJ-UHFFFAOYSA-N 431.115 4.149 10 10 IICE Cc1ccc(-c2ccc(C=C3SC(N4CCOCC4)=NC3=O)o2)c(Br)c1 2293806430 USASLUYVBVRUGC-UHFFFAOYSA-N 433.327 4.320 10 10 IICE CCN(CC)c1ccc(C=C2C(=O)NC(=O)N(c3ccc(N(CC)CC)cc3)C2=O)cc1 2297056730 SIVQMBCEQXKWDA-UHFFFAOYSA-N 434.540 4.045 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@@H](NCc1cccc(Br)c1O)C2 2333632608 WLDXECUAWLHECW-UNEWFSDZSA-N 425.367 4.280 10 10 IICE O=C(Cn1cc(/C=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc21)NC[C@H]1CCCO1 3648606 PYGUOUXPSNUWBQ-GTNUZRKBSA-N 435.911 4.083 10 10 IICE Cc1nn(CC(=O)N[C@H](c2ccccc2)c2c(O)ccc3ccccc23)c(C)c1[N+](=O)[O-] 10909508 FMBWHGZATUYUGP-HSZRJFAPSA-N 430.464 4.173 10 10 IICE CC(=O)c1cccc(NC(=O)/C(=C\c2ccc(N(C)C)cc2)NC(=O)c2ccccc2)c1 33325891 JCGIHPZJFBCESR-LFVJCYFKSA-N 427.504 4.365 10 10 IICE CCn1c(/C=C\c2ccccc2[N+](=O)[O-])nc2ccc(I)cc2c1=O 33472835 OOAGIFZMNTXUQI-YFHOEESVSA-N 447.232 4.100 10 10 IICE COc1ccc(N2CCN(c3ncc4c(n3)C[C@@H](/C=C\c3ccccc3)CC4=O)CC2)cc1 97214974 KVJGRERCXFIDDO-GIWCCYDRSA-N 440.547 4.270 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccccc2C(=O)N2CCCC2)C1 435665947 YCOCPDIRJNMGSE-UHFFFAOYSA-N 444.579 4.283 10 10 IICE CC(=O)Nc1ccc(C)c(N2C(=O)C(O)=C(c3cccs3)[C@H]2c2ccc(O)c(O)c2)c1 526510208 JOXPXBWUSOCRIV-OAQYLSRUSA-N 436.489 4.483 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@](C)(CNCc2cc(Br)cc(F)c2O)C1 715813282 NNHTWLSZDYIITF-LJQANCHMSA-N 431.346 4.421 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2ccccc2)c(C)s1 761342357 JLXZSPPRFDLDJM-UHFFFAOYSA-N 443.550 4.276 10 10 IICE CC(=O)c1ccc(O)c(CCOC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 769663733 QNGFBPFCSWRRPH-UHFFFAOYSA-N 434.536 4.102 10 10 IICE CC(C)N1CC[C@@H](NC(=O)NCCCSc2nccs2)[C@H]1c1ccc(F)c(F)c1 779364765 RGYKUSCVFGUBFO-QZTJIDSGSA-N 440.585 4.427 10 10 IICE O=C(N[C@@H]1C[C@H]1c1cnn(-c2ccccc2)c1)N(Cc1ccco1)Cc1ccccc1O 793447111 XTGPEYHRMAVKCD-XZOQPEGZSA-N 428.492 4.439 10 10 IICE CCN1CCN(c2ccc(CN[C@H]3CCCc4nn(-c5ccccc5)cc43)cc2F)CC1 794812069 ZKWWDECDUXNSDT-DEOSSOPVSA-N 433.575 4.321 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc(C(=O)N(C)C)cc3)n2)c1C 799636388 OILFVCLSHHBBMC-UHFFFAOYSA-N 446.598 4.141 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C(C)(C)Oc2ccc(Br)cc2)cc1 1130745472 XZTFASQFAAHCRA-UHFFFAOYSA-N 435.362 4.210 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(Cc2cccc(Cl)c2)C(=O)C1 1137541596 FKGOPHTXJISUSJ-UHFFFAOYSA-N 449.938 4.045 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)Oc1cccc(Cl)c1Cl 1162539858 NSXJMUQDCINQBG-CYBMUJFWSA-N 426.296 4.058 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(C)nc(-c4ccc(Cl)cc4)n3)CC2)cc1 1295272263 HUAQQGWBIWWJTJ-UHFFFAOYSA-N 436.943 4.467 10 10 IICE Cn1cccc1-c1nnc(N2CCO[C@H](C(C)(C)C)C2)n1CCCSc1nccs1 1298861186 ITZNKFMQSGVQLH-KRWDZBQOSA-N 446.646 4.174 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1ccc2[nH]cc(I)c2c1 1300395848 FCOYJDDWKBWJOJ-UHFFFAOYSA-N 426.641 4.062 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1305594812 RNTAHGSREAMKLG-SFHVURJKSA-N 436.604 4.313 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3CO)c2C)c1 1446281722 JHBUXRGPMJQOTM-ZEQKJWHPSA-N 431.580 4.015 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1cc(Cl)cc(Cl)c1 1446814237 FZRDJCNLPHCSHR-LLVKDONJSA-N 446.714 4.322 10 10 IICE Cc1ccccc1C[C@H](CO)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1447763023 LKVFMSKJCAJMQV-LJQANCHMSA-N 441.369 4.498 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC3(CC(=O)OC(C)(C)C)CCOCC3)c2C)c1 1450946274 PNTUWHHXMSIHRV-UHFFFAOYSA-N 426.557 4.413 10 10 IICE CCn1cnc2c1CCN(C(=O)c1cc(C)n(-c3ccc(Br)cc3)c1C)C2 1456176012 SGFYITMHUBRESM-UHFFFAOYSA-N 427.346 4.272 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(N(C)C)ncnc32)c(C)n1-c1ccc(Cl)c(Cl)c1 1458951609 YWVQXVFTFLEECD-UHFFFAOYSA-N 443.338 4.490 10 10 IICE COCCOCc1ccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1460481139 SYVNQLRMVRKQGC-UHFFFAOYSA-N 436.552 4.008 10 10 IICE CC(C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@H](O)c1ccccc1 1467625623 KXLUPWGERIYJJS-RRPNLBNLSA-N 433.596 4.282 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(Cc1cccc(O)c1)[C@H]1CC[C@H](O)CC1 1470556231 PBLGWRBIVADZLM-APTRMMRNSA-N 439.600 4.213 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1494691642 XQTGYATYFURPOP-JKSUJKDBSA-N 446.671 4.233 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1 1508379743 LFQHHXCHAPLPAX-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCS[C@H]1CC[C@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1516888683 KPYUYKXJPWHKGY-VXKWHMMOSA-N 443.661 4.397 10 10 IICE CC(C)Oc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1517374444 XDCKVTPXHMQAJO-GZTJUZNOSA-N 445.541 4.238 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1519289171 ALNIDFVQTVTVQZ-AZUAARDMSA-N 429.609 4.051 10 10 IICE CC(C)N(Cc1cccs1)C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1524894890 NQQBEWZSVHFVTH-UHFFFAOYSA-N 434.473 4.483 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1(CCCOCc2ccccc2)CC1 1534309101 NFMXUNXFHXBSKY-UHFFFAOYSA-N 426.532 4.056 10 10 IICE COc1ccc(/C=C(/C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c2cccs2)cc1 1536524790 WSTKQKLTJSZBBY-HKOYGPOVSA-N 447.604 4.366 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)c1 1539728116 FXNFZPKTFGQKAU-UHFFFAOYSA-N 444.535 4.333 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](CC(C)C)C(=O)OC(C)(C)C)CCCC1 1544319819 LANMKLNRPIWRBA-HXUWFJFHSA-N 428.573 4.401 10 10 IICE COCCCN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1555479965 HNRRWLYYRHRZRE-QHCPKHFHSA-N 441.620 4.277 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@](C)(O)c3ccc(F)cc3)cc2Cl)C1 1564650429 WTEYRHLFVAPVFU-MWTRTKDXSA-N 433.955 4.422 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCC1 1564667899 KNUHRPIVAOUYEO-XMSQKQJNSA-N 446.636 4.375 10 10 IICE O=C(C/C=C/c1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1566023202 OHAAPMQYNHTXHD-OWOJBTEDSA-N 447.348 4.269 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)NCc2ccccc2O)C1 1566373732 BRKXLDFEUJOFBK-MOPGFXCFSA-N 430.932 4.313 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)[C@H](C)Oc4ccccc43)cc2Cl)C1 1586081384 DIXMAVCGVKABBS-IRXDYDNUSA-N 441.959 4.007 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccc(Cl)cc1 1587443875 LZHUZGGEVSYHFO-HSZRJFAPSA-N 437.971 4.378 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(-c4cccc(Cl)c4)noc3C)CC2)c(OC)c1 1587490052 CVVZCROMUNHYCX-UHFFFAOYSA-N 441.915 4.283 10 10 IICE COc1cccc(C(=O)CCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1595582512 DIFMWYGBEFTJCG-FQEVSTJZSA-N 444.959 4.188 10 10 IICE Cc1ccnc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1C1CC1 1596188634 RRRCXDJYLJKUKB-UHFFFAOYSA-N 429.523 4.088 10 10 IICE Cc1ccc(I)c(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c1 1597801166 YMVMIJUOIXYSQX-OAHLLOKOSA-N 436.337 4.335 10 10 IICE Cc1ccc(C(=O)N2CCC(C(=O)N[C@H](C)C(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1611196583 BGNPBECZHMNMCD-LJQANCHMSA-N 437.584 4.228 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)cc1 1626107505 YAGCJHMDWYQOIF-SFTDATJTSA-N 437.367 4.301 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1626722728 HBVDRPKGNPKILS-GHTZIAJQSA-N 429.605 4.145 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(C=O)c(OC)cc2OC)cc1 1627425302 FIPXKDHLXSMBOL-UHFFFAOYSA-N 448.519 4.438 10 10 IICE Cc1nc2cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)ccc2n1-c1ccccc1 1627464293 LJVXEVVHPSOTFR-SANMLTNESA-N 441.579 4.433 10 10 IICE CCO[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCC1 1628496396 XMXJVYFSILNYCK-LEWJYISDSA-N 433.593 4.030 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](Cn2ccnc2)c2ccccc2)cc1 1633155217 KOJSVUDYSQAXAO-RUZDIDTESA-N 426.520 4.203 10 10 IICE O=C(NCc1cccc(O)c1O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1 1633515756 OLYLMSBKBIJIPS-FCHUYYIVSA-N 436.939 4.283 10 10 IICE COC[C@@H]1CC[C@H]([C@@H]2COCCN2C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)O1 1646250563 JEYOHJCFTQHILQ-ZKMPZPQNSA-N 440.584 4.253 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(F)cc1 1653098850 KRPFLYVZVKATRA-CRAIPNDOSA-N 429.536 4.466 10 10 IICE COc1cc(N2CCN(Cc3cc(Cl)cc(Cl)c3F)CC2)cc(OC)c1OC 1658172546 SGMBLQDUNFMZFF-UHFFFAOYSA-N 429.319 4.481 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(c3nc4ccccc4o3)CC2)N(C)C)cc1 1676653527 QEHFHODAXWBHCG-JOCHJYFZSA-N 435.572 4.086 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1680563095 PAJDIAAUVXHTBP-UZLBHIALSA-N 433.955 4.118 10 10 IICE Cc1cc(-c2nnc(N(C)C3CC3)n2CCN(C)CC(F)(F)F)c(C)n1-c1ccccc1 1692989425 UUUINZZMYOQKIB-UHFFFAOYSA-N 446.521 4.445 10 10 IICE CC1CCN(CCCCn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CC1 1708138941 GLZCOLDRNYXABI-QFIPXVFZSA-N 441.620 4.026 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)C[C@H]2CC=CCC2)cc1F 1729329564 HJIOLGZFWBTELQ-FQEVSTJZSA-N 434.563 4.310 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCC(C(F)(F)F)CC1 1742138984 HRQYESFGNIJDTG-UHFFFAOYSA-N 446.521 4.485 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](N3CCCC3)C2)n1CCCSc1nccs1 1743703986 ZLIBKTQLJIFLHF-ZWKOTPCHSA-N 434.679 4.495 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCC[C@H]1CC 1767936406 MBKPCODPJGYFDW-RTBURBONSA-N 445.583 4.115 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@H]1OC 1771066137 MLRNFSVFLRCHPJ-NZQKXSOJSA-N 437.588 4.250 10 10 IICE CCCCOc1cn(CCC(C)C)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870660391 XBECKESRGRTGKN-UHFFFAOYSA-N 441.616 4.404 10 10 IICE CC[C@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccncc2)C1=O 1873168217 NAURTYCILCEVGI-KRWDZBQOSA-N 428.536 4.157 10 10 IICE O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1 2294143786 IQIBYKVPOKOEQH-UHFFFAOYSA-N 437.795 4.175 10 10 IICE Cc1cc(N2C(=O)NC(=O)C(=Cc3ccccc3OC(C)C)C2=O)ccc1Br 2313548402 VHAFKVFEZFYWGP-UHFFFAOYSA-N 443.297 4.211 10 10 IICE Cc1ccc(CNC[C@@H]2CC3(CC3)CN2C(=O)OC(C)(C)C)c(O)c1Br 2352940964 KNXLQWIJSYTCCG-HNNXBMFYSA-N 425.367 4.342 10 10 IICE CCN(CC)c1ccc(CN(CC(C)C)C(=O)NC(C)(C)C)c(OS(=O)(=O)CC)c1 37420552 MEWCHGNOJYENMT-UHFFFAOYSA-N 441.638 4.227 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)c(C)n1-c1cccc(Cl)c1 110487389 PWUNSGPQWDWGGD-UHFFFAOYSA-N 439.903 4.013 10 10 IICE C[C@H]1[C@@H](NCc2c(O)cccc2Br)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709436159 KVHYSLMUHGPSFP-UWWPHRKUSA-N 425.367 4.421 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(Cc3c(O)ccc4c(=O)c(-c5ccccc5)c(C)oc34)[C@@H]2C1 754800042 UJTTZSWBAOHIFP-JMUQELJHSA-N 435.520 4.242 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@H]2[C@@H]2CNC(=O)C2)c(C)n1-c1ccc(F)c(Cl)c1 764465946 NELXJHDNGDUPMS-KKSFZXQISA-N 431.939 4.060 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cc(Br)cc(C)c2O)C1 775725191 QONDXJHLFLZNEK-CYBMUJFWSA-N 437.300 4.086 10 10 IICE O=C(c1ccccc1)c1ccc(O)c(CN2CCC[C@H](c3ncc4n3CCCC4)C2)c1O 799942060 JJUTZXBILCBQNP-IBGZPJMESA-N 431.536 4.241 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc(C(=O)OC)s3)n2)c1C 917869328 MMBUXGHRLQENDM-UHFFFAOYSA-N 439.584 4.287 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCCCC(=O)c3ccccc3)cc2F)C[C@H](C)O1 918140327 LBGZROZIKXRCMR-OALUTQOASA-N 426.532 4.499 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N1CCC[C@H]1C(F)(F)F 1135027765 BLYYBQYQLDMHQY-XSNHNAGMSA-N 434.530 4.283 10 10 IICE COC(=O)C[C@@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccnc1 1135204946 IEQNGVKWXDOTIG-XMMPIXPASA-N 439.943 4.280 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)cc1 1142479660 MYIUJRGXSNPRFE-UHFFFAOYSA-N 446.547 4.314 10 10 IICE NC(=O)[C@@]1(c2ccccc2)CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1171180412 WEQUYDYCMQDWMJ-VWLOTQADSA-N 427.508 4.170 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1230702710 KNTMSPIPZFEXTN-QGZVFWFLSA-N 428.577 4.097 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1293571601 OGTQKFVYZJVWQH-CVDCTZTESA-N 434.588 4.238 10 10 IICE COc1cccc(-c2nnc(N3CCOC(C)(C)C3)n2CCCSc2nccs2)c1 1300395431 NMEIZSFUVCRWAP-UHFFFAOYSA-N 445.614 4.208 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)/C(=C\c3ccc(O)c(OC)c3)c3ccccc3)C2)cc1 1300633915 NMYKVGYRPBRETR-MVUTXWCHSA-N 444.531 4.345 10 10 IICE CC(C)(C)c1csc(CC2(O)CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)n1 1302517585 PQQZIQDNFOLIJB-UHFFFAOYSA-N 446.594 4.276 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1CC[C@@H](C)C1 1304241377 UQOLGAUCZNFHMO-ZPMCFJSWSA-N 425.621 4.466 10 10 IICE CC1CCN(CCn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CC1 1305106388 IKVUWCUORCFKRU-UHFFFAOYSA-N 440.979 4.067 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3ccccc3OC(F)(F)F)C2)cc1 1312900935 AUFLMHPVSKDJGU-MRXNPFEDSA-N 437.462 4.262 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1 1350933691 PZOHNODMUYFLRC-IAGOWNOFSA-N 440.494 4.003 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C\c3ccc(F)c4ccccc34)CC2)cc1 1353705567 CYQHVVSFORCRBS-ZSOIEALJSA-N 447.554 4.329 10 10 IICE Cn1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1-c1ccccc1 1355708002 LMXJLPHFWRRJIL-UHFFFAOYSA-N 443.469 4.478 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@@H]2CCC[C@@H]2C)c(C)n1-c1ccccc1 1361044804 FRPPBWMZWMBRKF-UEXGIBASSA-N 448.615 4.489 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc(Oc2ccccc2)cn1 1361063319 MQBXSHKESOTWLU-MRXNPFEDSA-N 440.450 4.269 10 10 IICE COC(=O)c1cnc(CC2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)s1 1438935677 MTJOTGDKTJQOGN-UHFFFAOYSA-N 437.565 4.432 10 10 IICE CCOC(=O)[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1444846593 POINLJBCAROODF-HSZRJFAPSA-N 432.520 4.292 10 10 IICE CCN(CC(C)C)c1nc(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cs1 1446567534 MMWFFHIXVZMWAE-FQEVSTJZSA-N 431.602 4.081 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)Cc1ccc(Br)c(Br)c1 1456231958 VAOLGVLXYZRLGI-UHFFFAOYSA-N 440.179 4.445 10 10 IICE C[C@@H](NC(=O)c1ccc(Cn2cc(Br)cn2)s1)c1ccc(N(C)C)cc1 1459179254 UDLCIYKLUVRAMK-CYBMUJFWSA-N 433.375 4.312 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)N(C)Cc3ccc(N4CCCC4)cc3)c2C)C1=O 1466797050 FHHPECKHZIESIP-UHFFFAOYSA-N 449.555 4.048 10 10 IICE Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)o1 1470449058 GTJLMQSNDAVDPE-QRWLVFNGSA-N 433.499 4.386 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccc(F)cn4)CC3)cc2Cl)C1 1478528677 SDBKFWDYQRRPIB-QGZVFWFLSA-N 445.970 4.142 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC[C@@H]1CCC[C@H]1c1ccccc1 1478714098 ZARGAURIXATQGH-PMACEKPBSA-N 429.511 4.185 10 10 IICE CN(C)c1ccc(Cn2c(N3CC[C@@H](C4CCOCC4)C3)nnc2C(C)(C)C)cc1F 1503392007 BEQHTBJCMARTMM-LJQANCHMSA-N 429.584 4.082 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]3CCC[C@@H]32)n1Cc1ccc(N(C)C)c(F)c1 1519302275 GDJLPZULUPCJEP-QFUCXCTJSA-N 445.583 4.024 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CCc3nncn3CC2)sc(C)c1-c1ccc(C)cc1 1524869762 NSXRGWGTPIDFOW-QGZVFWFLSA-N 438.553 4.391 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(NC(=O)c4cccc(C)c4)CC3)ccc21 1534055331 XHXZYFYWSNWZJC-UHFFFAOYSA-N 447.579 4.248 10 10 IICE Cc1ccc(-c2nnc(N3CCCN(C(C)C)CC3)n2Cc2ccc(N(C)C)c(F)c2)o1 1542335517 HYQXBKIRGZZRJJ-UHFFFAOYSA-N 440.567 4.020 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](C)N3C(=O)c4ccc(C)cc4C3=O)c2C)c1 1544080070 JWPSAWWODWREID-IBGZPJMESA-N 429.520 4.012 10 10 IICE CC[C@H](C)c1nnc(N2CCC([C@H]3CCCO3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545416096 WDBVRFBFMUZRJL-HTAPYJJXSA-N 429.584 4.440 10 10 IICE COc1cc(-n2cccc2)c(Cl)cc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1557638579 AXXYUKOZVRWMQU-UHFFFAOYSA-N 439.943 4.030 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C4CCN(C)CC4)C3)cc2Cl)C1 1564649500 FHGKOOJAGICNIB-NQIIRXRSSA-N 433.040 4.450 10 10 IICE CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1566730548 BCDBPHOWDIGBJO-LJQANCHMSA-N 428.529 4.216 10 10 IICE CC[C@](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)(C(=O)OC)c1ccccc1 1568899048 ZETLXMSTVWCDLL-AREMUKBSSA-N 432.520 4.044 10 10 IICE C/C(=C\C(=O)N1C[C@@H]2CCCCN2c2cc(Br)c(F)cc21)c1cnccn1 1583070299 HUBLYVFJZMHUCH-CZAWJFPGSA-N 431.309 4.187 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)O[C@@]3(CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613204372 RSFHXUFQGQLYOR-DFIYOIEZSA-N 441.620 4.070 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC1(COC)CCCC1 1614012058 MCHUUCLQWRMJDM-UHFFFAOYSA-N 441.620 4.163 10 10 IICE CCOCc1nnc(N2CCC[C@H](C(F)(F)F)C2)n1Cc1ccc2c(c1)CCCN2C 1616840998 WGLKRBYWJHIHJB-SFHVURJKSA-N 437.510 4.024 10 10 IICE CNC(=O)[C@@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)C1 1618578363 WVADJPTUCFJADR-SANMLTNESA-N 448.615 4.361 10 10 IICE COc1cc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ccccc2n1 1620501081 VZMFXRLIKRIYSF-UHFFFAOYSA-N 427.504 4.322 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cccc(CN2CCO[C@@H](C)C2)c1 1626547987 IITSFOYXBIKIDQ-FQEVSTJZSA-N 445.563 4.057 10 10 IICE CSc1cccc(N2C[C@@H](C(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2=O)c1 1633111137 NQBQIDOHALCVTC-FQEVSTJZSA-N 437.609 4.314 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](C)NC(=O)OC(C)(C)C)cc2Cl)C1 1634720230 RHHJJWPGNMMPLM-HOTGVXAUSA-N 439.000 4.289 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1c(F)c(F)c(Br)c(F)c1F 1639624975 SARYFQAXWZFFHD-UHFFFAOYSA-N 429.167 4.189 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3CCC[C@@H]3c3ccccc3C(F)(F)F)nc12 1645315130 SQDHUWUAQLCBNK-QAPCUYQASA-N 448.445 4.056 10 10 IICE CN1CCN(c2ccc(CNc3ccc(Br)c(C(F)(F)F)n3)cc2)CC1 1652171453 OKSIANBIFCBNOR-UHFFFAOYSA-N 429.284 4.227 10 10 IICE Cc1cc(C(=O)CSCCCc2ccccc2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1652651068 MMNPMNMNWYVDNS-UHFFFAOYSA-N 442.606 4.290 10 10 IICE Cc1cc(CCNC(=O)NC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c(C)n1-c1ccccc1 1683148856 DWGIWTMCKIZDJQ-UGKGYDQZSA-N 437.506 4.419 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1696546760 VQZLVIZDGPQDNJ-CEMLEFRQSA-N 443.661 4.315 10 10 IICE CC(C)c1nc(CCn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)cs1 1706270622 NEHCUMRTDLKSJR-LJQANCHMSA-N 427.574 4.294 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1710387109 XZKBAIOTVOSMSW-LJQANCHMSA-N 437.588 4.393 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC(c2cnn(C)c2)CC1 1724233674 BQWFKMXWLFHHNF-UHFFFAOYSA-N 449.647 4.407 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC(O)(C(F)(F)F)CC2)cc1 1746087580 ZRZQRGJJZXBGJM-UHFFFAOYSA-N 439.526 4.190 10 10 IICE O=C(O)[C@@H](c1ccccc1)N1C(=O)/C(=C\c2ccccc2Br)SC1=S 1858591259 HDTCWNSAWCDJOD-YVGNARHYSA-N 434.336 4.476 10 10 IICE COc1cccc2sc(N3CC(C(=O)NCc4ccc(N5C[C@H]6CC[C@H]5C6)cc4)C3)nc12 1891608314 GWUSCNHKEFWFRF-PXNSSMCTSA-N 448.592 4.046 10 10 IICE Cc1cc(C=C2NC(=S)N(c3ccccc3F)C2=O)c(C)n1-c1cccc([N+](=O)[O-])c1 2054672209 GYEQTAPSPOEAIC-UHFFFAOYSA-N 436.468 4.404 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C2CC2)c(I)c1C(=O)O 2079945779 LVLQWRDVPMKSQV-MRXNPFEDSA-N 440.281 4.070 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@@H](CN[C@H]2CCc3cccc(O)c32)C1 2084722316 OUAOOGCWCULYKX-VXKWHMMOSA-N 437.584 4.091 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(CCNCc2ccc(Br)cc2O)C1 2140332933 WWMNQUWPXGCNNN-QRWLVFNGSA-N 425.367 4.282 10 10 IICE CCCOc1ccc([C@H](CC(=O)O)N2C(=O)C(=Cc3ccc[nH]3)SC2=S)cc1OC 2323679957 RLYAIZOUYKMTJV-HNNXBMFYSA-N 446.550 4.229 10 10 IICE CCOc1cccc(C=C2SC(=S)N(CCOc3ccc(OC)cc3)C2=O)c1O 2323719253 BEVGKNDVMRQJFS-UHFFFAOYSA-N 431.535 4.080 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2381130617 BFVXDVQLKYHJAM-ZFWWWQNUSA-N 441.366 4.257 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3cc(C)nc(-c4ccc(C)cc4)n3)CC2)cc1 33301553 UAXBKVIOLFSMOX-UHFFFAOYSA-N 448.592 4.210 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N(C(C)C)C1=O 33489106 VCSGMURXJWRESV-VBKFSLOCSA-N 430.599 4.215 10 10 IICE CCN(CC)c1ccc(N2C(=O)/C(=C/c3ccc(OCC(=O)O)cc3)SC2=S)cc1 210408256 KRGNVGAPIUIGJG-UYRXBGFRSA-N 442.562 4.402 10 10 IICE Cc1cccc(NC(=O)CCCN2C(=O)/C(=C\c3ccc(O)cc3O)SC2=S)c1 210712855 YENCVQKQAZVRJH-WOJGMQOQSA-N 428.535 4.026 10 10 IICE C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 732040095 RBCBGJVKIJSVGQ-LRTDBIEQSA-N 426.428 4.034 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCSc2nccs2)C[C@H]2CCCC[C@@H]21 733975017 VIWPXQCYGWEGMD-PMPSAXMXSA-N 425.620 4.310 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N[C@@H](c1ccccc1)c1ccco1 768920012 DZXPLRPBRQRQKO-SANMLTNESA-N 444.579 4.400 10 10 IICE O=C1/C(=C\c2ccnn2-c2ccccc2)SC(=S)N1CCc1ccc2c(c1)OCCO2 790628405 WZEDBAFMXYFIPT-RCCKNPSSSA-N 449.557 4.087 10 10 IICE COc1cc2c(cc1F)CC[C@H]2NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 800997794 CCRYWVIEFMGLMI-LRAJWGHMSA-N 445.510 4.074 10 10 IICE CCOc1cc(CN[C@H](C)c2ccc(N3CCOCC3)cc2)cc(Br)c1O 920867919 BMWFPLINJMPHQI-OAHLLOKOSA-N 435.362 4.241 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(C)n(-c4cccc(C(F)(F)F)c4)n3)C2)cc1 1131031039 XISPDPUUPYWVDZ-QGZVFWFLSA-N 444.457 4.217 10 10 IICE CC(=O)Nc1ccccc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1131161203 ZUGFZAWDQSWMPY-ATVHPVEESA-N 445.591 4.327 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)COc2ccc(Cl)c3ccccc23)N(C)C)cc1 1134682015 QAUUQAFQIYBTCJ-QFIPXVFZSA-N 425.960 4.357 10 10 IICE COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)C1 1136418343 FIYXOSDNNADCFR-XMSQKQJNSA-N 439.600 4.221 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@H](CO)C2CC2)c(C)n1-c1ccc(Br)cc1 1141274298 MWHUIDAMSZVQQV-RTWAWAEBSA-N 431.374 4.384 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c(C)n1-c1ccccc1Br 1150029415 FCFOLUCHLQIWSV-XLIONFOSSA-N 430.390 4.413 10 10 IICE Cc1cccnc1[C@H](C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1305303906 FWJORZIBQJWPRD-QXPQOBGOSA-N 431.608 4.310 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@](O)(c3ccc(Br)cc3)C2)c1O 1308128804 LYJAIGMBKZWXOV-HXUWFJFHSA-N 438.749 4.494 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1 1315775685 NLKKPPDHQQSGHI-ICSRJNTNSA-N 437.588 4.250 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)cc1C 1316447938 BGQLSTWQBSQOOL-LJQANCHMSA-N 438.645 4.264 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2cc(Br)cnc2OCC(F)(F)F)cc1 1444300322 FWTCZDLYUXLEKG-UHFFFAOYSA-N 446.183 4.200 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(C)(N(C)C)CC2)sc(C)c1-c1ccccc1 1473721111 JODDTGFFYFSUGX-UHFFFAOYSA-N 443.613 4.255 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](c3ccccc3)C3(CO)CCCC3)C2)cc1 1478859231 DBLDNNHNCWFOPW-GBXCKJPGSA-N 437.584 4.115 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1517498536 IZZDAPLLZDQXSL-QGZVFWFLSA-N 439.581 4.352 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F 1525762871 UXEZBRBUWDMJTF-AWEZNQCLSA-N 449.452 4.161 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1 1527057334 HFPNAMSZDFQFJQ-UHFFFAOYSA-N 428.444 4.065 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1528582771 DWEQRXOKWYCMHL-UHFFFAOYSA-N 444.457 4.320 10 10 IICE Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1536933193 GOQZYMCCNXKTEL-UHFFFAOYSA-N 438.572 4.024 10 10 IICE CCOC(=O)Nc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(Cl)c1 1539708290 YTLUZWYZDIMXAS-HXUWFJFHSA-N 432.952 4.007 10 10 IICE CC(C)=CCCn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1541253826 DLBJGFGCEYIMEX-UHFFFAOYSA-N 446.599 4.478 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1542181082 JVSZOECVYKSVRW-UHFFFAOYSA-N 436.604 4.360 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(c4ccccc4)CCCCCC3)CC2)cc1 1542431980 NLXSXIFENKJUQS-UHFFFAOYSA-N 435.612 4.226 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3c(C)noc3C)n2Cc2ccc(N(C)C)cc2C)n1 1542555921 HDIWPVAUZOQZMR-UHFFFAOYSA-N 445.571 4.312 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@@H](C(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543052086 MHMVWTOBYWGSGX-JOCHJYFZSA-N 449.647 4.435 10 10 IICE COc1cc(CC2CN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2)cc(OC)c1 1545021053 GUMKUVOWOXVPLA-UHFFFAOYSA-N 446.547 4.167 10 10 IICE CCOc1ccc(N2CCN(C(=O)CC[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1545931620 PGWJYGZOHFAEKA-FQEVSTJZSA-N 445.604 4.161 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(NCc4ccsc4)cc3)CC2)c(OC)c1 1557822234 CGNRVMIYHHRPMZ-UHFFFAOYSA-N 437.565 4.340 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)[C@@H](C)c3cccc(S(N)(=O)=O)c3)c2C)c1 1565574694 OMYKBOOTJLUBIA-SFHVURJKSA-N 439.581 4.192 10 10 IICE CC1(C)C[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)CCN(C(=O)OC(C)(C)C)C1 1586864292 YEJNVLHJLOBHSA-CQSZACIVSA-N 434.558 4.468 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@]2(CO)CC[C@H](C)C2)sc(C)c1-c1ccccc1 1617443848 POVYYLAWORCRAY-UPCLLVRISA-N 444.597 4.322 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC34CN(C(=O)OC(C)(C)C)C4)cc2Cl)C1 1617901015 OYWNPRAFFRYEDF-WMZOPIPTSA-N 448.007 4.450 10 10 IICE Cc1cc(C)c(C)c(OCCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1630549855 BBXKHQPYHLWPDL-RTBURBONSA-N 428.548 4.450 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccccn3)C2)c(C)n1-c1ccccc1Br 1630822298 BYURQIVPYDBNGN-QGZVFWFLSA-N 439.357 4.260 10 10 IICE CCOC(=O)CC[C@@H]1CCCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1632464540 QFHWABOROKNXCR-SFHVURJKSA-N 426.557 4.111 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C2CCC1(CNC(=O)OC(C)(C)C)CC2 1636266857 JWDBSEZQIBLOPB-OBYNWZINSA-N 444.620 4.223 10 10 IICE Cc1cc(C(=O)N(C2CC2)C2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(F)cc1 1640293937 JHLLNPKKFGFHMN-UHFFFAOYSA-N 427.520 4.457 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C(=O)OC(C)(C)C)c(C)n1-c1ccc(C(C)C)cc1 1641400602 MTKUXKXGXLWAOU-QFIPXVFZSA-N 426.557 4.400 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CC[C@H](C)N(C(=O)OC(C)(C)C)C3)ccc21 1642247095 GAUHINQBFFQDFC-OXJNMPFZSA-N 443.588 4.422 10 10 IICE CCCCOc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(O)c1 1650720460 VHLNZTBVVGUTLY-CALCHBBNSA-N 430.520 4.254 10 10 IICE COc1cc(Br)ccc1CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1671938895 GUXIWGAXXKLZRP-UHFFFAOYSA-N 432.362 4.400 10 10 IICE C[C@H](NC(=O)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1)c1ccc(N(C)C)cc1 1686173484 JABPKHAJGSKTBS-KRWDZBQOSA-N 434.506 4.360 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(c4cccc(F)c4)C(=O)C3)c2C)c1 1687285157 RTWSDUYKZYITOA-UHFFFAOYSA-N 434.515 4.100 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)Cc2cscn2)cc1 1710025584 GFJFCECMMQYRAG-UHFFFAOYSA-N 433.585 4.328 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc2c(c1)CCCN2C 1712550437 LWWYMMMVQQIVAZ-UXHICEINSA-N 441.620 4.059 10 10 IICE CCN(CCc1cccs1)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1746301769 NRFBFCGXLOVQMM-GOSISDBHSA-N 443.592 4.166 10 10 IICE CN(CCc1cccs1)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1747899341 HYONBKREDCDCKD-OAHLLOKOSA-N 435.644 4.161 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)c1ccco1 1765911397 YWBLJIHTHDXQBR-UHFFFAOYSA-N 446.555 4.222 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncccc1N(C)C 1766389292 LOSGBJQSOPPEEI-UHFFFAOYSA-N 429.572 4.318 10 10 IICE COC[C@H](C)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1770739214 PWTBDZVPWOBZOT-KNQAVFIVSA-N 427.593 4.039 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(SC)CC1 1771066534 SZLVDPJTBAZMLL-UHFFFAOYSA-N 425.602 4.331 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(F)(F)F 1771493799 UHJVBDZVQQHKKL-GDBMZVCRSA-N 448.468 4.228 10 10 IICE Oc1c(Br)cccc1CN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878710426 OFHSUPFPGZKEII-DOTOQJQBSA-N 429.280 4.307 10 10 IICE COc1cccc(O)c1[C@@](C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1951722016 ANWVYFIUDWIHLK-RUZDIDTESA-N 433.460 4.239 10 10 IICE CN(CCN(Cc1ccccc1)[C@H](CN)c1ccc2c(c1)CCN2C)Cc1ccccc1 2034744396 XEOFIWAOTVMEQK-MUUNZHRXSA-N 428.624 4.313 10 10 IICE CN1CCc2cc([C@H](O)c3ccc(I)c(Br)c3)ccc21 2163061071 DWSWPLKUQKYKHG-INIZCTEOSA-N 444.110 4.128 10 10 IICE CCN[C@@H](c1ccccc1O)C1(COCc2ccccc2)CN(C(=O)OC(C)(C)C)C1 2248463214 NKFIFDLCWLOJLC-QFIPXVFZSA-N 426.557 4.497 10 10 IICE CN(Cc1cccc(I)c1)c1ccc(CN)c(Br)c1F 2280258605 UDQMSIYJPDQESU-UHFFFAOYSA-N 449.105 4.288 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3cc(C)cc(C)c3)nc3ccccn3c2=O)SC1=S 2314506519 FDIFBIFZWPEYRF-UHFFFAOYSA-N 437.546 4.325 10 10 IICE N=C1S/C(=C/c2ccc(N3CCOCC3)cc2)C(=O)N1c1ccc(Br)cc1 1005129 UBXPYGNONZIEIP-RAYXNOPOSA-N 444.354 4.341 10 10 IICE COC(=O)c1ccc([C@H]2Oc3ccccc3[C@@H]3CC(c4cc(OC)ccc4O)=NN32)cc1 20071296 JVZMRXCGKOAJSZ-XUZZJYLKSA-N 430.460 4.430 10 10 IICE O=C(NCCN1CCOCC1)c1ccc(-n2c(-c3ccccc3)cc3c2CCCCC3)cc1 20902531 NCSITOWUBGSRGN-UHFFFAOYSA-N 443.591 4.475 10 10 IICE CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 60347891 UTMQNDOJWWSCRF-UHFFFAOYSA-N 441.434 4.354 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccc(O)cc2)SC1=S)Nc1cccc(C(F)(F)F)c1 210672796 XMDCAGROYQJBPX-OVCLIPMQSA-N 438.452 4.251 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@@H](C(=O)NCc4ccc(F)cc4)[C@H]3C2)cc1 245280849 UQCHVMVWXYGEDZ-AOYPEHQESA-N 445.538 4.018 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccccc2N2CCCC2)C1 683472888 VQKZQRMGDDYTFO-UHFFFAOYSA-N 430.596 4.324 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H](c1ccccc1)N1CCc2ccccc21 729653361 OUWCRRDYQXUJHW-SANMLTNESA-N 445.538 4.083 10 10 IICE O=C(Cc1coc(-c2ccc(F)cc2)n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 733218939 IBFJYYATTXYTTI-UHFFFAOYSA-N 445.441 4.410 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(C)c1 750391973 OWKLOCHOYJMAFH-ISKFKSNPSA-N 448.567 4.338 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccc([S@@](=O)C(F)(F)F)cc3)CC2)cc1 750625468 NVGAOVDYQYGPFV-SSEXGKCCSA-N 441.475 4.067 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@H](c3ccccc3C(F)(F)F)C2)c([N+](=O)[O-])c1 781680484 RHJUWNMIABTUIF-FUKPKEADSA-N 436.386 4.378 10 10 IICE Cn1cc(C(=O)NCc2cc(Br)ccc2O)c(-c2ccc(Cl)s2)n1 804737340 PBFWYKOORBXOMQ-UHFFFAOYSA-N 426.723 4.200 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4Cc5ccccc5O4)n3CC(C)C)CC2)cc1 812219929 UAJIIGWLVLDWIA-XMMPIXPASA-N 447.583 4.336 10 10 IICE COc1cc(N2CCN(C(=O)c3ccccc3-c3ccccc3)CC2)cc(OC)c1OC 1127934303 YFMCBBMFMDXGLF-UHFFFAOYSA-N 432.520 4.342 10 10 IICE CCCCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)c(Cl)c1 1132031903 BKTVWXSMMIJDHD-UHFFFAOYSA-N 432.948 4.499 10 10 IICE O=C(CCc1cccc(OCc2ccccc2)c1)NCc1ccc(N2CCOCC2)cc1 1136397029 RBSPNAALHRUWAK-UHFFFAOYSA-N 430.548 4.351 10 10 IICE Cc1cc(C(=O)NCc2cn3c(C)cccc3n2)c(C)n1-c1ccc(Br)cn1 1146543728 JZXJFCGGVQOQQL-UHFFFAOYSA-N 438.329 4.138 10 10 IICE CCOC(=O)c1c[nH]nc1[C@H]1CCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1 1168482941 KKXDHAQZSVPAGW-IBGZPJMESA-N 434.540 4.240 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1230301355 XRRIKCHNPYYORK-ZWKOTPCHSA-N 443.975 4.388 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)[C@H](O)c3c(Cl)cccc3Cl)C2)cc1 1230857418 AMKABXLYAHJALN-YRVVQQKDSA-N 438.355 4.002 10 10 IICE CN(Cc1ccccc1O)C(=O)NCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1234533393 KBNPMEAZTNLNHS-FQEVSTJZSA-N 427.545 4.060 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1251951663 SKPZSSVJTWWFMY-BXUZGUMPSA-N 432.348 4.192 10 10 IICE Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1288330145 JDFXEIMCGRWPTK-UHFFFAOYSA-N 448.636 4.459 10 10 IICE Cc1cc(-c2nnc(N3CCN(CC(C)C)C(=O)C3)n2CC(C)C)c(C)n1-c1ccccc1 1289360566 JGQHCELSTHMODV-UHFFFAOYSA-N 448.615 4.313 10 10 IICE Cc1cc(C)c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(C)c1Br 1439960584 NFYZRSBFYIGSIC-LJQANCHMSA-N 432.406 4.473 10 10 IICE O=C(CN[C@H](CC1CCCC1)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 1459860469 XJIGMAYSTFGRME-XMMPIXPASA-N 439.575 4.190 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](c1ccncc1)C1CCCCC1 1460742433 WPCANIWTQWOSDT-QFIPXVFZSA-N 429.511 4.177 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1466290170 SAUBAJLIGKACOI-DFQSSKMNSA-N 434.577 4.229 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCCC12CCN(C(=O)/C=C\c1ccc(O)c(O)c1)CC2 1472410086 YZFVCVJWTYVKTH-YPLUBFQTSA-N 430.545 4.045 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 1532656336 RBTSGHNKCDHNRU-DSKINZAPSA-N 443.588 4.436 10 10 IICE COc1cc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cnc1Br 1544081680 ZJAOSLHWMSENDS-UHFFFAOYSA-N 428.330 4.499 10 10 IICE COc1c(Br)cccc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1544529986 RTRCYSLFVJGUDW-GOSISDBHSA-N 447.373 4.345 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC[C@@](C)(OC)C2)cc1 1547445163 ZPLLFFDMDQAIKZ-RUZDIDTESA-N 436.604 4.183 10 10 IICE COC(=O)/C=C\c1ccc(N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c([N+](=O)[O-])c1 1559156694 HHDVRNVGWBVAPK-NMIMRFFTSA-N 439.512 4.033 10 10 IICE CCCO[C@@H]1CCCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1559533495 MZSXRAFLMUJZHK-IEBWSBKVSA-N 434.536 4.070 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@H]1C1CCN(C(=O)OC(C)(C)C)CC1 1570418007 CDHSATZZAGIVMB-OFAXGOBFSA-N 443.632 4.391 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cccc(I)c1C 1585264592 UUCAFDCYCHTETE-AWEZNQCLSA-N 436.337 4.335 10 10 IICE CN1CCCN(C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)c2ccc(F)cc21 1587413041 GOXDYULWRFTKOR-UHFFFAOYSA-N 426.492 4.005 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CSC(c3ccccc3O)=N2)cc1 1595385663 SGBRXUVEQOEBCN-NRFANRHFSA-N 435.549 4.142 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(F)c(Br)c(Cl)c3)CC2)cc1F 1595481358 ASRWJMBYCPFMQY-UHFFFAOYSA-N 445.691 4.352 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CCO1 1614439270 VVMOJFGIKYWPIJ-DENIHFKCSA-N 437.588 4.393 10 10 IICE COc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(OC2CCCC2)c1 1616858683 QNSNKGQFGUWRFV-HSZRJFAPSA-N 425.573 4.115 10 10 IICE CCNC(=O)N1CCc2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc21 1618383458 SMJAJUODUHWBEZ-UHFFFAOYSA-N 430.508 4.251 10 10 IICE CC(=O)N1CC[C@H](C)c2ccc(S(=O)(=O)Oc3ccc4c(c3)c(C)c(C)n4C)cc21 1622251929 KKVYABCNEISEDB-AWEZNQCLSA-N 426.538 4.423 10 10 IICE O=C(CN(Cc1ccccc1)c1ccccc1)NCc1cccc(Br)c1O 1623364074 MSFKTWNKQHVDPH-UHFFFAOYSA-N 425.326 4.478 10 10 IICE COCN1C(=O)CCc2cc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)ccc21 1625449132 OQQFWUPMNZYOMY-UHFFFAOYSA-N 431.492 4.042 10 10 IICE CCCc1c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nnn1-c1ccc(C(C)(C)C)cc1 1632681869 WLJBKGUPJSISID-INIZCTEOSA-N 436.556 4.290 10 10 IICE CC(C)[C@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)C(=O)NCc2c(O)cccc2F)CC1 1638866894 RRPVWAKYDBXMAK-TXTKFYIRSA-N 440.559 4.337 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCO[C@@H](c3ccc(F)cc3F)C2)cc1 1639047339 MKIGSGDQGFWJBX-XMMPIXPASA-N 438.474 4.327 10 10 IICE Cc1cc(C(=O)N2Cc3cncnc3[C@@H](C)C2)c(C)n1-c1ccc(Br)cc1 1644316471 IYVGFBCZAZFSKU-ZDUSSCGKSA-N 425.330 4.406 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](C(C)(C)C)C[C@H]3C)cc2F)C[C@@H](C)O1 1654615476 PGDJBVVVRTVVRG-BNDYYXHWSA-N 433.612 4.202 10 10 IICE Cc1cccc(OC[C@@H](O)CN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C(C)C)c1 1686826441 IHLJBWBYEUEGPU-QPPBQGQZSA-N 441.616 4.160 10 10 IICE C#CCN(CC#CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)CCC 1705590605 QPUSHWPNHMVKLB-MHZLTWQESA-N 443.595 4.367 10 10 IICE CCC[C@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1709558852 BACVALZBGZSVHD-QFIPXVFZSA-N 443.661 4.083 10 10 IICE CCN(CCc1cccs1)c1nnc(C)n1Cc1ccc(N2CCSCC2)cc1 1710133390 USDGNYKAHCHNHS-UHFFFAOYSA-N 427.643 4.319 10 10 IICE CC(C)[C@@H]1OCCC[C@@H]1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1723250838 XLZNLCXSZPRHRJ-HJNYFJLDSA-N 428.577 4.313 10 10 IICE CCC(C)(C)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1726794211 BVXQGHUHVDRHEM-UHFFFAOYSA-N 448.615 4.173 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1726842998 JIYSARJTAXNEHM-CLOONOSVSA-N 443.636 4.098 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](COC)C1 1727847401 IAKITSZILRBWSB-LPLSSMDUSA-N 435.572 4.170 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CC[C@@H](C)C1 1741434566 ZBCJJPYOTIHLSN-IRLDBZIGSA-N 425.621 4.386 10 10 IICE CC(C)[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCO1 1760967775 MLPYFIRNINZLQC-JOCHJYFZSA-N 425.621 4.159 10 10 IICE CSc1ccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCC(=O)N4C)C2=O)cc1 1860087861 WZIKEOIIVDCCHP-RQZCQDPDSA-N 428.560 4.170 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCCc2ccccc2)sc(C)c1-c1ccccc1 1860759680 DOBKDMPRPXOGRT-UHFFFAOYSA-N 436.533 4.198 10 10 IICE Cc1[nH]nc(-c2ccc(F)cc2)c1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874179731 MTYZHPJGBOPXIP-UHFFFAOYSA-N 439.446 4.481 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](NCc1cc(Br)ccc1O)C2 1878848353 GPUMEUHDJGZBDH-IVSAIRAKSA-N 429.330 4.123 10 10 IICE CCN[C@H](c1ccccc1O)[C@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 1942402002 YSGMQWZNIFCWJE-RDGATRHJSA-N 425.573 4.212 10 10 IICE C[C@@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(-c2ccccc2)c1I 2070262313 QKNIKJDGZVZHGT-NSHDSACASA-N 435.221 4.378 10 10 IICE COc1ccc(Br)c(CNCc2cncc(NC(=O)OC(C)(C)C)c2)c1O 2236054983 NACPYGMZHOKNJO-UHFFFAOYSA-N 438.322 4.195 10 10 IICE CC(C)c1ccc(C=C2SC(=S)N(CCC(=O)N3CCCC[C@H]3CCO)C2=O)cc1 2296551078 QEUNXIXALCYEBK-IBGZPJMESA-N 446.638 4.165 10 10 IICE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=Cc1ccc(Sc2nc3ccccc3[nH]2)o1 2297333221 BVCGEJZBGDARKR-UHFFFAOYSA-N 448.435 4.113 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)cc1 2318683532 GKKGXNQPUNIGTP-UHFFFAOYSA-N 429.592 4.465 10 10 IICE COc1ccc(Br)c(CNC[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1O 2336897000 IXURDUQNTIKVQR-HNNXBMFYSA-N 431.371 4.192 10 10 IICE Cc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)CC23CC3)c(O)c1Br 2352679196 IOSMIKIOCDURCM-HNNXBMFYSA-N 425.367 4.342 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)ccc1OS(C)(=O)=O 3001240 XVRTUEAHGRUNQY-LDADJPATSA-N 449.575 4.138 10 10 IICE CCC1=NN2C(=N)/C(=C\c3ccc(OCc4ccccc4F)c(OC)c3)C(=O)N=C2S1 33323860 UKOZUKQSNXCJEL-WAPYETIASA-N 438.484 4.442 10 10 IICE C=CCN1C(=O)/C(=C/c2c(NC3CCCCC3)nc3c(C)cccn3c2=O)SC1=S 33507076 AHIDJNDMNMUAJD-LGMDPLHJSA-N 440.594 4.135 10 10 IICE CCc1cc(C)cc(OCCOc2ccccc2/C=C2\C(=O)NN(c3ccccc3)C2=O)c1 33711211 YYOQIRFWQBSHDB-HKOYGPOVSA-N 442.515 4.477 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C/c3cc(C)n(-c4ccc(OC)cc4)c3C)C(=N)N12 104372774 QSFUEAGTOPHCNP-WBIXSPHCSA-N 439.566 4.433 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 731479857 YVZLTHMGQALPSP-RBIGCLEJSA-N 430.888 4.384 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)Nc1nc2c3c(ccc2s1)CCCC3 733850477 NZLILMAEJLMJOE-UHFFFAOYSA-N 436.581 4.228 10 10 IICE COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)N(C)Cc1ccccc1O)C(=O)OC2 767186076 ISMNLPVOYADMOT-OQLLNIDSSA-N 439.508 4.013 10 10 IICE Cc1cc(C)c(N2CC[C@@H](NC(=O)N(Cc3ccco3)Cc3ccccc3O)C2=O)c(C)c1 788937708 RJMRUZGNYSYUHN-JOCHJYFZSA-N 447.535 4.428 10 10 IICE O=C(NCCc1ccc(Br)s1)NCc1cc(Br)ccc1O 804889025 BMZOZWWULIQAJW-UHFFFAOYSA-N 434.153 4.021 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N[C@H]3CCCc4ccccc43)ccc21 1125198167 RDFNWTUDOSJLLL-QHCPKHFHSA-N 434.536 4.255 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1C(F)(F)F 1127182266 VCPCHENZDNXHOZ-UHFFFAOYSA-N 447.501 4.176 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)Cc1ccc2c(c1)N(C(=O)OC(C)(C)C)CC2 1136972709 XELLBBZJJYLWBD-UHFFFAOYSA-N 437.540 4.018 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(I)cc3)c2)CC1 1138031566 XULXNDGCBPKNNO-UHFFFAOYSA-N 449.336 4.074 10 10 IICE COc1ccc2c(c1)c(C(=O)NCc1ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c1)c(C)n2C 1141901995 VQJXEHJAHXZMTB-IYBDPMFKSA-N 439.531 4.178 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(OC)cc1 1165498558 NYBVEPZJYGZMHN-NZQKXSOJSA-N 444.959 4.450 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C=C\c3cc(C(F)(F)F)ccc3Cl)cc2)CC1 1288335136 ZPQFBPMPMBZQMC-WTKPLQERSA-N 437.893 4.440 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(CC2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291748029 KHXYPYOFIXPIQL-GOSISDBHSA-N 429.584 4.127 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](OC2CCCC2)C(F)(F)F)cc1 1300504457 XYAAIVWSFCOLAW-NRFANRHFSA-N 436.474 4.455 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCCCC1)OC 1300998566 KOCGLTAVIABYCR-JOCHJYFZSA-N 437.588 4.394 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3ccco3)oc2=O)c(C)n1-c1cccc(C(F)(F)F)c1 1307278157 UTFJZMZNSFVHJW-UHFFFAOYSA-N 431.370 4.406 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2C[C@H](C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1313100085 HSZWNKPVXUAMGW-RQNOJGIXSA-N 445.563 4.458 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 1313162429 FZBQBBVNBYVUKC-QQFNCUIESA-N 444.620 4.462 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccnn1CCc1ccccc1 1435332276 JZUUQXPUFSLIDZ-IBGZPJMESA-N 440.494 4.126 10 10 IICE C[C@H](NC(=O)CCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccccc1 1435334695 WEISPFDOHPEKLY-HKUYNNGSSA-N 445.510 4.031 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@H]3CCCC[C@H]32)c(C)n1-c1ccc(C(C)C)cc1 1445952386 BKDUSOJJLVSHLY-PKTZIBPZSA-N 428.598 4.399 10 10 IICE CC(C)(C)OC(=O)/C=C/c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)co1 1446571569 YMPGUBGYYXWXNX-CFGKVWFZSA-N 427.497 4.162 10 10 IICE CC(C)NC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1 1452618999 YKDSEKLKIKMBTP-UHFFFAOYSA-N 436.478 4.487 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@](C)(CO)Cc3ccc(Cl)cc3)c2C)cc1 1454969285 UMHGTOPZDJZALP-DEOSSOPVSA-N 426.944 4.480 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc(O)c1C 1455262790 OYGXEDDQJLEOKR-VCHYOVAHSA-N 430.526 4.378 10 10 IICE COc1cc(OC)cc(C2(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)CCCC2)c1 1463776046 HKQSJCVFGWNJOX-UHFFFAOYSA-N 438.568 4.011 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)cc4nc(O)[nH]c34)cc2)CC1 1464960545 IDUFSCWSXFJTDP-UHFFFAOYSA-N 443.345 4.197 10 10 IICE Cc1cc(O)nc(C(C)(C)NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1 1469699437 NUBNXXGFBSBJEV-UHFFFAOYSA-N 443.345 4.326 10 10 IICE CCC[C@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1=O 1472979165 NBUKNUQRKHHLKC-NRFANRHFSA-N 446.345 4.150 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCCCCNC(=O)CC3)cc2Cl)C1 1478528403 OJMOJYYEOPIULA-GOSISDBHSA-N 435.012 4.168 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)CCO1 1514162034 JIRXNIAMAVOHBW-SFHVURJKSA-N 447.605 4.262 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@@H](CN(C)C)Oc2ccccc21 1517788644 MNLQKGWCMBUBTE-DZFTYQQFSA-N 431.536 4.393 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N(C)C)cc1C 1519289207 ALNIDFVQTVTVQZ-UYAOXDASSA-N 429.609 4.051 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)c(C(F)(F)F)c1 1533992468 VBMPMWULXHAHBQ-UHFFFAOYSA-N 435.465 4.307 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccccc1 1538843205 FTMCVICHHJYYEA-LVXARBLLSA-N 431.580 4.042 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O 1542371025 OARFBMWKRVXBHM-UHFFFAOYSA-N 428.330 4.019 10 10 IICE COC(=O)CCSc1ncccc1NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1546139495 JRYKHBQECGQABX-UHFFFAOYSA-N 439.537 4.405 10 10 IICE CCN(c1nnc(C(=O)NC(C)C)n1Cc1ccc2c(c1)CCCN2C)C1CCCCC1 1547339218 AVWXVYFUPHDROK-UHFFFAOYSA-N 438.620 4.006 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@@H](Oc1ccccc1Br)c1ccccc1 1558174371 KXNGFJLHGITECU-FQEVSTJZSA-N 428.282 4.297 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccccc3Nc3ccccc3)cc2)CC1 1558398178 ZKXQECIYUYMLDJ-UHFFFAOYSA-N 428.536 4.062 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2C[C@@H](C(=O)OC(C)(C)C)c3ccccc32)c1 1565007492 PLPCKTIHERAGQE-KPOBHBOGSA-N 426.513 4.331 10 10 IICE C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)c1ccccc1O 1587447012 GXXWQIIKVYHRMM-KDOFPFPSSA-N 447.329 4.133 10 10 IICE COc1ccc(C(=O)NCCNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)cc1 1596654717 UTCYBZNAMUHPTB-UHFFFAOYSA-N 433.552 4.386 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@@]3(CCOC3)C2)n1Cc1ccc(N(CC)CC)cc1 1613204373 RSFHXUFQGQLYOR-RLSLOFABSA-N 441.620 4.070 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3ccccc3n2Cc2ccncc2)cc1 1616534981 RZAFUHREXUXMEU-UHFFFAOYSA-N 428.536 4.302 10 10 IICE COC(=O)c1cn([C@@H]2CCCN(C(=O)c3cc(C)n(-c4cccc(C(C)C)c4)c3C)C2)nn1 1624643633 GNJLFCHZYFGUNS-OAQYLSRUSA-N 449.555 4.073 10 10 IICE CC(C)[C@@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NCc1ccc2c(c1)CCCN2C 1626940168 ASRFCWPDDADSBN-HHHXNRCGSA-N 443.591 4.222 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)Sc1nc2ccccc2s1 1627013403 CFNMQPIMEWTKNC-AWEZNQCLSA-N 430.551 4.074 10 10 IICE Cc1cc(CC(=O)N2CCCC[C@@H]2COC(=O)N(C)C)c(C)n1-c1ccc(Cl)cc1 1627097403 XMSSNAFHTVDBNM-OAQYLSRUSA-N 431.964 4.369 10 10 IICE CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1628102643 VNXOELIXMNKRBH-IBGZPJMESA-N 428.573 4.389 10 10 IICE COC(=O)[C@H](C)CN(Cc1ccccc1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1628915778 HZTGVUZJNSLOTK-GOSISDBHSA-N 432.520 4.358 10 10 IICE COc1cc(C(=O)NCc2cc(Cl)ccc2O)c([N+](=O)[O-])cc1OCc1ccccc1 1632227906 JCNOGHRYGPEPJX-UHFFFAOYSA-N 442.855 4.471 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)c1ccc([N+](=O)[O-])cc1F 1634381076 FBMANVGEMJGJBI-HNNXBMFYSA-N 445.491 4.226 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1640259895 INHZYQPHLUGSMH-INIZCTEOSA-N 431.529 4.423 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CSc3nc(O)c4cnn(C)c4n3)c2C)c1 1641279121 ULSYKOYLAUXXSR-UHFFFAOYSA-N 439.566 4.173 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@](C)(O)C(F)(F)C(F)(F)F 1641743910 SLTQEFKUMLBMQS-GOSISDBHSA-N 438.437 4.413 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)COCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1648696541 ABDBBSWSWMUVDQ-JOCHJYFZSA-N 426.944 4.397 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)COCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1648696542 ABDBBSWSWMUVDQ-QFIPXVFZSA-N 426.944 4.397 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3c(Br)ccc(F)c3C2)c([N+](=O)[O-])c1 1650950519 MOFOAJSDSVWYRO-CLTKARDFSA-N 435.249 4.245 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@H]2c2ccc(Br)c(F)c2)cc1 1658454265 KWMBCWXRFWJTBO-FQEVSTJZSA-N 434.353 4.108 10 10 IICE Cc1cc(CNC(=O)N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1683307809 POCZHMDKRIPHKA-QFIPXVFZSA-N 449.530 4.339 10 10 IICE CC[C@@H](C)c1nnc(N2CCSC3(CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694153476 QFPKKAWUHBHDBF-QGZVFWFLSA-N 447.624 4.147 10 10 IICE CCN(C)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(CC)CC)cc1 1695513974 WIUQRBXJZIRBJQ-UHFFFAOYSA-N 431.382 4.386 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC3(SC)CCC3)CC2)cc1F 1697472136 ZJVIZUAFMZOJHK-UHFFFAOYSA-N 447.624 4.336 10 10 IICE CCN(CC)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCSCC2)cc1 1710038044 JUJDYCYMOPAAEO-UHFFFAOYSA-N 427.643 4.378 10 10 IICE CC(C)c1nnc(N(C)C[C@H]2CC=CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1723142445 QHMFLMXVNUMWJK-NRFANRHFSA-N 437.632 4.451 10 10 IICE CCC[C@H](C)NC(=O)[C@H]1CCCN(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1727941838 JZCGTAGMKGHXNC-UGKGYDQZSA-N 440.636 4.002 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1CCSCC(F)(F)F 1729420305 MGQRQSLSACGQLG-INIZCTEOSA-N 430.496 4.157 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC1CC1 1741112712 MIMZJMSTBCRVQE-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCn1cnnc1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(C)C 1746371411 ZWLWCBXLTKIEJV-UHFFFAOYSA-N 446.603 4.495 10 10 IICE Cc1cnn([C@@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)c1 1751721758 BVVCMXJPMCHDGR-QGZVFWFLSA-N 431.635 4.387 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3c4c(nc5ccccc35)CCOC4)cccc21 1859616681 YFXOZMAEOACXPL-UHFFFAOYSA-N 434.451 4.335 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2ccc([N+](=O)[O-])cc2)cc1 1865679825 IPHHYOFQEHQVIZ-PXLXIMEGSA-N 429.432 4.447 10 10 IICE CCN1C(=O)C(NCCCc2ccccc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873170559 FQKBXIAPBGPHEL-UHFFFAOYSA-N 427.548 4.416 10 10 IICE CC1(C)C[C@@H](CNCc2cc(Br)cc(F)c2O)N(C(=O)OC(C)(C)C)C1 1965977220 WZXNMDZHUXPORM-AWEZNQCLSA-N 431.346 4.419 10 10 IICE CN1CCCc2cc([C@@H](N)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536842 POLFJUGGVPLYBW-JTHBVZDNSA-N 425.573 4.179 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@H]1CNCc1cc(Br)cc(F)c1O 2102799401 VPNLDNPVYCPXJW-GFCCVEGCSA-N 439.272 4.028 10 10 IICE CC[C@H](NC[C@H](F)C1CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2112915573 HQWLCYXKJTYFBW-HOTGVXAUSA-N 431.346 4.400 10 10 IICE COc1ccc(Br)c(CNC2CCC(NC(=O)OC(C)(C)C)CC2)c1O 2227748322 MWKPIAIIQMSNPL-UHFFFAOYSA-N 429.355 4.089 10 10 IICE COc1ccc(Br)c(CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1O 2236035627 GIYDTJVJBMZSPV-AYHJJNSGSA-N 431.374 4.449 10 10 IICE O=C1C(=Cc2cc(Br)ccc2O)SC(=S)N1c1ccccc1[N+](=O)[O-] 2297616274 AYIURXKZWSHCEQ-UHFFFAOYSA-N 437.296 4.469 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478078 OSCRUMCLLZLPJU-GCKMJXCFSA-N 427.526 4.498 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4nc5c(C)cccc5s4)c3N)CC2)cc1 40727799 MXGYRMNHLDJQBY-UHFFFAOYSA-N 447.568 4.056 10 10 IICE CCCCSc1cc(N)c2c(c1N)C(=O)c1c(N)c(Oc3ccccc3)cc(N)c1C2=O 206682610 GXCIEWFXOHODKA-UHFFFAOYSA-N 448.548 4.475 10 10 IICE Cc1nc(-c2cccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)c2)no1 435533406 VKORCHVEUHPOKU-UHFFFAOYSA-N 429.524 4.405 10 10 IICE CCc1nc([C@H]2CCCCN2C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)no1 683444400 JCAUAMPEIGJGCK-JOCHJYFZSA-N 435.572 4.107 10 10 IICE COc1ccc(OC)c(/C=C2/SC(=S)N(CCCN(C)c3ccccc3)C2=O)c1 726627321 PZTHXRQNULJHIE-HMMYKYKNSA-N 428.579 4.432 10 10 IICE CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3cccs3)cs2)c1 747750525 BLSBKZPBFMJNRN-UHFFFAOYSA-N 427.960 4.028 10 10 IICE CCOC(=O)c1csc(C2CCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)CC2)n1 760657825 ZGGKROBPFDFBIQ-UHFFFAOYSA-N 438.553 4.142 10 10 IICE O=C(NCc1ccccc1CN1CCCCC1)NCc1cccc(Br)c1O 764756922 JMIIAHADSRDOEL-UHFFFAOYSA-N 432.362 4.140 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(CCC(F)(F)F)CC1CC1 769045034 HRNHZKCTUHAOEI-UHFFFAOYSA-N 438.538 4.093 10 10 IICE Cc1cc(Br)cc([C@@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)c1O 779019634 XZUXTMANCBGHBB-CHWSQXEVSA-N 427.364 4.246 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)c([N+](=O)[O-])c1 782381276 ZQZZYBOGLWLBFX-JFKHNGDKSA-N 436.386 4.378 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3cnc(C4CC4)nc3)cc2Cl)C1 799961762 ASYMEQKLKZTGRW-MRXNPFEDSA-N 427.980 4.286 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc4c(c3)C(=O)OC4)n2)c1C 917872188 GTXBXIWVVGWJLF-UHFFFAOYSA-N 431.539 4.110 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccc(Cl)c1 1125325887 RTUXSHNCIQPFEU-DENIHFKCSA-N 427.976 4.242 10 10 IICE CCCCN(C)c1ccc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1127181333 GPVZTURSIZYJPI-UHFFFAOYSA-N 434.628 4.385 10 10 IICE COc1cccc(C(F)F)c1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127184329 QYBCIQMZVXKNSS-UHFFFAOYSA-N 429.511 4.095 10 10 IICE CC[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@@H](O)c1ccccc1F 1150196653 JOGSWPBUCJFACH-NVQXNPDNSA-N 437.559 4.175 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC(Cc4ccccc4OC(F)(F)F)C3)C2)cc1 1252923108 KPKDSNTXRICUNC-GOSISDBHSA-N 449.473 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(CCN(C)C)Cc2cccs2)C1 1265755840 LBSPPHJCHLIKSM-UHFFFAOYSA-N 438.641 4.060 10 10 IICE C[C@H]1C[C@@H](CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCO1 1291018489 GUEAUSNQPVIRML-ROUUACIJSA-N 426.586 4.478 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)c(F)c1 1292025893 WMYQXHBVBNSKLN-SJORKVTESA-N 444.599 4.075 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCC23CCOCC3)c(C)n1-c1ccc(Br)cn1 1296880635 CJOXOMMWVYSKRQ-SFHVURJKSA-N 432.362 4.331 10 10 IICE Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1313304107 CPOAJKFCBLECFW-CJFMBICVSA-N 448.611 4.380 10 10 IICE CO[C@]1(C)CCCN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)cc2C)CC1 1315247489 PVZMQTKEYFPWOD-AREMUKBSSA-N 448.615 4.082 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(CCC(F)(F)F)cc3)cc2F)CC1 1352960858 OGOLDGCFAOATFQ-UHFFFAOYSA-N 437.481 4.393 10 10 IICE CC(C)(C)c1nnc(N2CC[C@@H](C3CCOCC3)C2)n1CCCSc1nccs1 1359504149 MFPALPZCMMKTQZ-QGZVFWFLSA-N 435.663 4.467 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCc2cc(F)ccc2[N+](=O)[O-])cc1 1360069400 XUMDTGKTKQOOCY-UHFFFAOYSA-N 427.398 4.324 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 1442341497 HWZKXZKOKTWQFD-VWLOTQADSA-N 429.564 4.142 10 10 IICE Cc1cc(CC(=O)NCc2ccccc2N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1442660792 XKXPARBZTJSRNT-UHFFFAOYSA-N 437.971 4.443 10 10 IICE Cc1ccc(C(=O)NC[C@@H](O)c2cc(F)cc(Cl)c2)cc1-n1c(C)cc(C=O)c1C 1448828119 VRXJGPKSRBVBFO-JOCHJYFZSA-N 428.891 4.471 10 10 IICE CCN(CC)c1ccc(CNc2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])cc1 1458113657 OASINAKAVKGBPJ-UHFFFAOYSA-N 446.573 4.228 10 10 IICE C[C@@H]1Nc2ccnn2[C@H](C)[C@H]1CCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1465532851 RJCPJUWDFZXNST-XLSPSMHOSA-N 447.530 4.041 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCC[C@H]3Cc3ccccc3F)C2)cc1 1470593217 LAUXTLJUFGEEIY-UGKGYDQZSA-N 425.548 4.467 10 10 IICE CCOC(=O)[C@H](Cc1cc(Cl)cc(Cl)c1)NCc1cc(F)cc(C(C)=O)c1O 1473699074 ASITZDTZTZOECK-SFHVURJKSA-N 428.287 4.305 10 10 IICE COc1ccc(N2CCCN(C(=O)NCC3(c4c(F)cccc4F)CCC3)CC2)cc1 1478824877 PLPWFXGVXUYPOQ-UHFFFAOYSA-N 429.511 4.317 10 10 IICE CCCCN(C)CCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1500416402 ZFJKCHAFDHMEJA-UHFFFAOYSA-N 440.636 4.003 10 10 IICE CCc1cnc(CN(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)s1 1513705072 IXKQUYXBDDENER-UHFFFAOYSA-N 447.612 4.418 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CO[C@@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1534550469 XHFOVCWFTJCWTC-GMAHTHKFSA-N 440.584 4.280 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(OCCCN(C)C)cc1 1542912935 BDHBMQWBYILMJD-UHFFFAOYSA-N 433.552 4.167 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(CC(C)C)CC1 1548161034 DCDYMAZVOJGXNV-UHFFFAOYSA-N 441.620 4.366 10 10 IICE CC(C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1F 1556798706 IJILDAHYMCDPDQ-UHFFFAOYSA-N 434.514 4.059 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H](N(CC)CC)C2)sc(C)c1-c1ccccc1 1559577031 URVLNAWQAALWJO-LJQANCHMSA-N 443.613 4.255 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H](c3ccc(F)c(Cl)c3)C3CC3)cc2)CC1 1564777968 URVRBJLSEWKCND-QFIPXVFZSA-N 430.955 4.181 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)nc1 1565193097 OGXVGHNXPIGWRV-OAQYLSRUSA-N 445.567 4.358 10 10 IICE Cc1cc(CC(=O)N[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c(C)n1-c1ccccc1 1570531980 VMDWDRSKKGZDMN-NHCUHLMSSA-N 425.573 4.445 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2cc(Br)ccc2s1 1583335348 XTYRCKRVTXJOKJ-UHFFFAOYSA-N 431.355 4.430 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cnn2ccccc12 1587300183 YHHFVVHVCJCGLL-LFIBNONCSA-N 428.564 4.016 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccc2c(c1)CCOC2 1587504308 BTGWPPGFIQAMFC-LDADJPATSA-N 444.603 4.441 10 10 IICE Cc1cc(CNC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)c(C)n1-c1ccccc1 1596482500 OCUVQYYJKVQWNG-UHFFFAOYSA-N 436.577 4.063 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](C[C@@H](C)CC)NC(=O)OC(C)(C)C)CC2)cc1 1596732699 GDYGBPMNHAQHJS-GHTZIAJQSA-N 433.593 4.063 10 10 IICE Cc1cc(C(=O)N(C)[C@H]2CCCc3c2cnn3C)c(C)n1-c1ccc(Br)cn1 1596748760 VQQIYFKPXBXGHT-SFHVURJKSA-N 442.361 4.135 10 10 IICE COc1ccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1S(C)(=O)=O 1597578001 UQXXWQKDZPQSPH-UHFFFAOYSA-N 446.956 4.341 10 10 IICE CCNc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cn1 1602723344 AMSCCUISMZWXFG-PTNGSMBKSA-N 432.596 4.195 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@H]3C(=O)Nc4ccc(F)cc43)cc2Cl)C1 1617901179 PZNUBVGIXIDCTE-KBXCAEBGSA-N 429.923 4.458 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1624197711 IWGOXERAQVSBQW-INIZCTEOSA-N 427.545 4.248 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1 1625117721 ZFLWXBJDENFIIG-UHFFFAOYSA-N 449.938 4.158 10 10 IICE C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)cc1 1625848204 ZFHNMCZWIIPFRI-BGYRXZFFSA-N 449.595 4.167 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)Cc1cccc2ccccc12 1627721523 SGGPEPFIINHCGH-QGZVFWFLSA-N 435.501 4.227 10 10 IICE Cc1cc(C(=O)NC[C@H](Cc2ccccc2Cl)C(N)=O)c(C)n1-c1cccc(Cl)c1 1629352223 PXXQBFKEGWGHLD-KRWDZBQOSA-N 444.362 4.475 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 1631533741 DOUMPWUPSCPUDY-KRWDZBQOSA-N 433.785 4.277 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)C(=O)OCc2ccccc2)c(C)n1-c1cccc(C(C)C)c1 1637802552 QPKKGEOZGDLAAD-DEOSSOPVSA-N 434.536 4.052 10 10 IICE CCOC(=O)c1cnc(C)c(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1639535179 XJXMMVKHQLGNRK-OAHLLOKOSA-N 429.948 4.386 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1ccc(Br)c(F)c1F 1644815814 UYUCNMSHUIRHAX-UHFFFAOYSA-N 434.664 4.262 10 10 IICE Cc1ccc2c(c1)NC(=O)N(CC(=O)c1cc(C)n(-c3ccccc3C)c1C)S2(=O)=O 1653004028 HRHBRUSEFIYMRR-UHFFFAOYSA-N 437.521 4.130 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1CCCc2ccc(Cl)cc21 1674892215 DWNADJQPHFFHKY-HSZRJFAPSA-N 427.976 4.426 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2ccnc(-c3ccccn3)n2)cc1 1675585465 QVNSNDPQRURFOO-UHFFFAOYSA-N 442.523 4.110 10 10 IICE Cc1ccccc1CN(Cc1cccnc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1683697558 CEQYDRVDJKLREW-UHFFFAOYSA-N 443.595 4.054 10 10 IICE Cc1ccccc1CN(Cc1cccnc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684607953 XVPDECFAYJUPIW-AREMUKBSSA-N 445.611 4.471 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@H]2Cc2cc(F)ccc2F)N(C)C)cc1 1685609213 MEWMHWAKANSMHJ-FYYLOGMGSA-N 430.543 4.050 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(-n2nc(C)cc2C)nc1 1693998465 PMDILKGDDZEBID-KRWDZBQOSA-N 445.571 4.379 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C[C@H](C)O1 1694950777 QEMXIBISYOEBGW-BBWFWOEESA-N 437.635 4.162 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1763596547 YCUFWUHTIUAJJM-IPJJNNNSSA-N 443.661 4.254 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCCO1 1766577057 TZYLGIKHQLWIJK-JOCHJYFZSA-N 437.588 4.394 10 10 IICE COC[C@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1769397026 WTEUULQSJDKZQS-FQEVSTJZSA-N 425.621 4.259 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(c3nc(C)no3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1772850764 LBAJZHFOUFPERG-OAHLLOKOSA-N 441.555 4.120 10 10 IICE C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1nccn1C 1866014598 GDDAZZQJOLLFIY-VLIAUNLRSA-N 447.366 4.466 10 10 IICE CCCCC(=O)Nc1nc(N2CCN(c3ccc(OC)cc3)CC2)nn1-c1ccc(C)cc1 1869969918 JVNVAAFLGDLAAF-UHFFFAOYSA-N 448.571 4.040 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@H](NCc1cc(Br)ccc1O)C2 1878848356 GPUMEUHDJGZBDH-QSJFSLAZSA-N 429.330 4.123 10 10 IICE COC(=O)c1c(C2CC2)nn([C@@H](c2ccc(OC)cc2O)C2(C)CC2)c1Br 2080004594 CRMJLFDTOPTIJM-KRWDZBQOSA-N 435.318 4.413 10 10 IICE CC[C@H](NC1CN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C1)c1ccccc1O 2259425763 HGWDBKSHOWFPEE-IBGZPJMESA-N 449.592 4.289 10 10 IICE COc1cc(C=C2SC(=S)N([C@@H](C)C(=O)O)C2=O)ccc1OCc1ccc(C)cc1 2293202138 HZWOAPJQURMERP-AWEZNQCLSA-N 443.546 4.257 10 10 IICE CC(C)(C)c1ccc(C=C2SC(=S)N(CCC(=O)NCc3ccco3)C2=O)cc1 2296730244 MCYBODDICQUAPJ-UHFFFAOYSA-N 428.579 4.485 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(c3cccc(C(=O)O)c3)C2=O)c1)C(=O)O 2314927670 IZTOIGFGJAPGID-INIZCTEOSA-N 443.502 4.033 10 10 IICE Cc1ccc(CNC[C@]2(F)C[C@H](CNC(=O)OC(C)(C)C)C2)c(O)c1Br 2352677137 XCJWGMLMPLXKER-HJGJAMNPSA-N 431.346 4.196 10 10 IICE Cc1ccc(CN[C@@H]2CCC23CC(NC(=O)OC(C)(C)C)C3)c(O)c1Br 2352693094 OHNLTQOKYYSRHE-RDYUPDBUSA-N 425.367 4.389 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459061 RXQBFGRONAKLEI-IXFSTUDKSA-N 428.554 4.258 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(C)C2=O)ccc1OCc1ccccc1[N+](=O)[O-] 33446550 UMCSOOFIDSKMPK-WOJGMQOQSA-N 430.507 4.404 10 10 IICE COC(=O)c1c(O)c(/N=N/c2ccc(Cl)cc2[N+](=O)[O-])c(O)n(-c2ccccc2)c1=O 35998228 DCRLOKANFFMHBN-QURGRASLSA-N 444.787 4.012 10 10 IICE CCOc1cccc(CN2CCC[C@@H](COc3ccccc3C(=O)NC(C)C)C2)c1O 169765052 QSHQUINBTGOGRZ-LJQANCHMSA-N 426.557 4.220 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4C)cs2)cc1 170549575 AQHMWHJGUAVWDP-UHFFFAOYSA-N 427.551 4.173 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](C)C[C@H]3c3ccco3)cc2F)C[C@H](C)O1 743876199 VXSJTAZSHQILHT-XQQXVUDOSA-N 443.563 4.122 10 10 IICE CC(=O)N(C)c1cccc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 746034675 CCCRYLSMOQGNPC-QGZVFWFLSA-N 432.471 4.061 10 10 IICE Cc1cnccc1N1CCC(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1 751891351 KSGSIJUKRINYOZ-UHFFFAOYSA-N 432.568 4.494 10 10 IICE COc1cc(N2CCN(C(=O)[C@H](Sc3ccccc3)C(C)C)CC2)cc(OC)c1OC 759221218 QANUOFRAWZBHDO-HSZRJFAPSA-N 444.597 4.178 10 10 IICE COc1ccc(N2CCC(NC(=O)Nc3nnc(/C=C\c4ccco4)s3)CC2)cc1 763999021 CQMQCBVZNSBJKF-HJWRWDBZSA-N 425.514 4.101 10 10 IICE Cc1nnc(-c2ccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)cc2)o1 766708668 DPRQPYIQPWTVJQ-UHFFFAOYSA-N 429.524 4.405 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H](c3ccccc3)c3cccc([N+](=O)[O-])c3)cc2)C1 779021493 ZMZBVVLBAFRINX-RCZVLFRGSA-N 444.535 4.176 10 10 IICE Cc1cc(C(=O)COC(=O)CCCCC(N)=O)c(C)n1-c1cc(Cl)cc(Cl)c1 787545037 OBGVYDATKWLPSD-UHFFFAOYSA-N 425.312 4.173 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(F)(c2ccc(Cl)cc2)CC1 798385234 GMQNZSPGKJTJAF-UHFFFAOYSA-N 431.939 4.347 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc4c(c3)nc(C(F)F)n4C)cc2F)C[C@@H](C)O1 798400280 ZAPWZXYHWXACSM-ZIAGYGMSSA-N 446.473 4.194 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](c4nncn4C4CC4)C3)n2C)c(C)n1-c1ccccc1 809806668 DZXYQWVYUSPXTQ-LJQANCHMSA-N 442.571 4.200 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2C[C@@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1 813633877 VWYXRXRRPZBMGT-RTWAWAEBSA-N 443.547 4.052 10 10 IICE CN(C)c1ccc(CN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C2CC2)cc1 918080793 VJUOANLRHGGKBF-UHFFFAOYSA-N 448.611 4.050 10 10 IICE COc1ccc(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1OC 1126510083 AYMRETAOYFENMM-WQRHYEAKSA-N 447.509 4.040 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3[C@@H](CCCN3C)C2)c(C)n1-c1ccc(Br)cc1 1137305146 AVYBZTXJGHROCG-UWJYYQICSA-N 430.390 4.413 10 10 IICE CCc1ccc([C@H]2CN(C(=O)OC(C)(C)C)CCN2C(=O)c2ccc(C)c(O)c2O)cc1 1138979930 KVFHPYZZNKJSKI-HXUWFJFHSA-N 440.540 4.403 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC1CC(Cl)(Cl)C1 1156837796 VPTMMSGJTCYAEX-KPKJPENVSA-N 435.423 4.182 10 10 IICE Cn1nc(C(C)(C)C)cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1264259193 HUEVJNCNARURKR-RVDMUPIBSA-N 446.573 4.087 10 10 IICE Cc1cc(CC(=O)N2CSC[C@@H]2C(=O)N[C@@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1293236754 RLYJVFBCRNCUFQ-HRAATJIYSA-N 448.032 4.352 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H]([C@@H]4CCOC4)C3)nnc2C(C)(C)C)cc1 1295420427 ZYPAVJHZFFSDEN-LEWJYISDSA-N 425.621 4.333 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1296481036 FVRYXRRQARCCGA-OAQYLSRUSA-N 439.556 4.344 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CC[C@@H](CC(C)C)C1 1304238876 YAGUPPZFYMMDTG-RBBKRZOGSA-N 425.621 4.467 10 10 IICE CC[C@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1306388337 VNOJKUYODIJGPJ-RXVVDRJESA-N 429.634 4.007 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)COCCO1 1306796147 OSBNRPFCZYWCRS-VWLOTQADSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3C[C@H]3c3cccc(C(F)(F)F)c3)CC2)cc1 1313223841 WXEPVWJCNKGDHW-LEWJYISDSA-N 433.474 4.492 10 10 IICE CCN(Cc1cccs1)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)c(F)c1 1313749713 LKZGIHDSLGVWFD-UHFFFAOYSA-N 437.548 4.077 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N(C)C)cc1)Cc1ccccc1Br 1459651368 KONYRAYZYVFSBJ-UHFFFAOYSA-N 432.406 4.290 10 10 IICE CC[C@@H]1COC(C)(C)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1461378136 POQZJKKPVUROAC-VQCBNXJZSA-N 438.640 4.146 10 10 IICE Cc1cc(C(=O)N(C)CC[C@@H]2CCCCN2C)c(C)n1-c1ccc(Br)cn1 1465463904 JWZJSARYDDEEQT-SFHVURJKSA-N 433.394 4.198 10 10 IICE C[C@@H]1Nc2ccnn2[C@H](C)[C@@H]1CCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1465532850 RJCPJUWDFZXNST-TVKQPGBESA-N 447.530 4.041 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(Cc2ccco2)Cc2cccs2)N(C)C)cc1 1479534746 NXCLPPCPWAOBDI-QFIPXVFZSA-N 426.586 4.422 10 10 IICE Cc1cccc(-c2nnc(N(C)[C@H]3CCSC3)n2CCCSc2nccs2)n1 1492497413 WENFHRGCCCHJTL-HNNXBMFYSA-N 432.644 4.229 10 10 IICE CCO[C@@]1(c2nnc(N(CC(C)C)C(C)C)n2Cc2ccc(N(C)C)c(F)c2)CCOC1 1502657472 YHCMGBXGOIVBBR-DEOSSOPVSA-N 447.599 4.054 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CC(C)C 1515087530 BBSTXDYFQFQKIL-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@@H](COC)C2)cc1 1515530854 GFUYLIKYABJOKV-GGAORHGYSA-N 441.620 4.277 10 10 IICE CCN(C(=O)Cc1cc(C)n(-c2ccccc2)c1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1534783892 CEZFVTLRWHRJLJ-JOCHJYFZSA-N 425.573 4.495 10 10 IICE Cc1cc(CNC(=O)C[C@@H]2CSCCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1535144385 YWDQMSIDUJOYKX-OAQYLSRUSA-N 443.613 4.453 10 10 IICE CCCOc1c(Cl)cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1OC 1537477512 BAQOVFMGCBUWOA-HXUWFJFHSA-N 433.980 4.236 10 10 IICE Cc1cc(CC(=O)NC2(C(=O)NCC3CC3)CCCC2)c(C)n1-c1ccc(Cl)cc1 1539527532 HOXXUGPZQSCRPV-UHFFFAOYSA-N 427.976 4.245 10 10 IICE CC(C)CNC(=O)[C@H]1CSCN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1539562531 NMXIGHDOFVDBOP-OAQYLSRUSA-N 439.585 4.455 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(Br)c2F)cc1 1544524275 VMQHETLBLOLTSU-KRWDZBQOSA-N 435.337 4.476 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCC(=O)C(=O)OC(C)(C)C 1559342914 XVUBKQQMWWXWEH-UHFFFAOYSA-N 425.348 4.335 10 10 IICE Cc1ncsc1/C=C/C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1584901513 OGISXFDIYTWIGN-KIUWMYQTSA-N 431.533 4.334 10 10 IICE Cc1cc(C(=O)NCC[C@H](N(C)C)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1595136381 HGEGZXDXOSOOAQ-KRWDZBQOSA-N 446.311 4.469 10 10 IICE CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)cc1 1595595581 GLENHTQMOWCQAF-UHFFFAOYSA-N 444.597 4.012 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1C[C@H](C)S[C@H](C)C1 1611963143 IPRXRJGEFQVABF-UEXGIBASSA-N 429.634 4.273 10 10 IICE C[C@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1612814574 YHFNCANJFIIUAO-IBGZPJMESA-N 425.621 4.112 10 10 IICE Brc1cc(CN2CCC(OC[C@@H]3CCOC3)CC2)ccc1N1CCCCC1 1621196748 MBJCJKXPEUXFQC-LJQANCHMSA-N 437.422 4.457 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)c(C)n1-c1ccc(F)cc1 1624056297 AWRUHZVSNAMRDC-UHFFFAOYSA-N 439.918 4.485 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(Br)cnc3O)cc2Cl)C1 1626169088 NLRPNYAQEBPVQG-LBPRGKRZSA-N 438.753 4.369 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCO[C@H]1c1ccnn1-c1ccccc1OC 1626885838 NTTOZPRLVNTRGD-PXDATVDWSA-N 448.567 4.073 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C/c2cc(Br)c(O)c(OC)c2)cc1 1630469789 KZCSCBPRLMCIED-DHZHZOJOSA-N 433.346 4.339 10 10 IICE C[C@H](NC(=O)N1CCC[C@H](CC(=O)NCc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 1634434973 JTDZTRLPQDUIOB-AZUAARDMSA-N 440.563 4.081 10 10 IICE CN(C)c1cc(C(F)(F)F)nc(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1639551447 PBJHJPHBHWJWCY-LBPRGKRZSA-N 431.409 4.244 10 10 IICE COC(=O)/C=C/c1ccc(N(C)CC(=O)Nc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 1641958366 SBOJCZFRMRNPGK-XBXARRHUSA-N 438.267 4.163 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cn(-c2ccc(Cl)c(Cl)c2)cn1 1646431539 NSIVKLFXYPVMLG-UHFFFAOYSA-N 445.350 4.070 10 10 IICE COc1ccc(N(C[C@@H](O)COc2cc(F)cc(Br)c2)C(C)C)cc1F 1653759446 YZFCXWZGDRYSTG-MRXNPFEDSA-N 430.289 4.391 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(c2cccc3cnccc23)C[C@H]1C 1673743375 CYFOOAPAAJBPBR-LEWJYISDSA-N 445.611 4.461 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)Cc3cccc(F)c3)cc2Cl)C1 1680561729 FLWZLFSZPOXNKX-OXQOHEQNSA-N 433.955 4.118 10 10 IICE CC1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1693717635 JTMTXHQUIILSOZ-UHFFFAOYSA-N 429.584 4.127 10 10 IICE Cc1ccc(NC(=O)c2nnc(N(C)C3CC3)n2CCCSc2nccs2)cc1C 1707513682 BHLHAAAPQARUGG-UHFFFAOYSA-N 442.614 4.385 10 10 IICE CON(C)c1nnc(-c2cc(-c3ccccc3)on2)n1CCCSc1nccs1 1712659208 GLYQYAOHASMJMJ-UHFFFAOYSA-N 428.543 4.237 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCO[C@](C)(C(C)(C)C)C1 1742141663 KXXVJASWUDSOAE-VWLOTQADSA-N 425.621 4.295 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCCN1CCCCC1 1747750014 HSFIKLVQLGNLSK-UHFFFAOYSA-N 440.979 4.212 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C1 1748464826 JEZKWGGFEAUZAO-RUZDIDTESA-N 437.588 4.129 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCCC1 1764679448 WIFOUVGZZOECLQ-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(=O)NC)C1 1765769242 ADZQNBXWIAOWLV-VWLOTQADSA-N 434.588 4.115 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1ccnc(N2CCCCC2)c1 1767112212 UNSQKOOKRMWYTA-UHFFFAOYSA-N 434.588 4.351 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1C 1768309986 NJHPHKMRCGMIGZ-NVDIGUCNSA-N 439.629 4.356 10 10 IICE O=C(OCc1ccccc1)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)C1 1938937538 YGPORGYESWTNCS-INIZCTEOSA-N 439.737 4.309 10 10 IICE O=C(N[C@]1(c2ccc(OCc3ccccc3)cc2O)C[C@H]1C(=O)O)OCc1ccccc1 1952841121 PRXJYIWOTKZQNI-OFVILXPXSA-N 433.460 4.197 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C(C)(C)C)c(C(=O)OC)c1Br 2080048498 TXEIJBFPXBJXPO-CYBMUJFWSA-N 425.323 4.443 10 10 IICE CC(NCCc1ccc(O)cc1)=C1C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 2313682883 MWRFAVYIZCQJDT-UHFFFAOYSA-N 442.475 4.158 10 10 IICE COc1ccc([C@@H]2Nc3ccc(C(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@H]32)cc1OC 14479713 WZSJEHQOMYRBNY-KSYXXAMZSA-N 434.536 4.439 10 10 IICE CCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OC)c(Br)c2)SC1=S 40885084 FEAREHMIMKUXBZ-UVTDQMKNSA-N 444.372 4.002 10 10 IICE O=C(N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@H]1CCCN(C(=O)C2CC2)C1 109915412 OKNFPPDLNZZEFR-OFVILXPXSA-N 428.532 4.400 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H](C)c3ccccc3Br)CC2)cc1 110468027 VNRSFNAFABTBKV-OAHLLOKOSA-N 432.362 4.487 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCc3nc(C)nc(C(F)(F)F)c3C2)cc1F 758480222 GYNKVXJJEINRLE-HNNXBMFYSA-N 438.469 4.210 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc([C@@H]3CCCOC3)cc2)c1 779916391 RIMKNOZXGNFQFV-HSZRJFAPSA-N 443.547 4.325 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)no1 802692033 GOZMYDVJJNBILA-QFIPXVFZSA-N 446.555 4.464 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(NC(=O)Cc2cccnc2)cc1 1124551490 WQDAIIOKGFCXKE-UHFFFAOYSA-N 428.536 4.135 10 10 IICE CCCN1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@H](CC)C3)CC1=O 1128128186 HAAYGJQRFNZLAU-GJZGRUSLSA-N 434.602 4.415 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCc1nc(C(C)(C)C)no1 1139584828 KJHQSCKJOBJFHR-UHFFFAOYSA-N 444.576 4.078 10 10 IICE COc1ccc(N(CC(=O)Nc2cc(C(C)(C)C)nn2C)Cc2ccccc2)cc1OC 1177022887 VFMGJWPMJRYDLR-UHFFFAOYSA-N 436.556 4.380 10 10 IICE COC(=O)c1cc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)no1 1264377361 AOJAKOFRXXCZJW-UHFFFAOYSA-N 440.456 4.384 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)cn1 1265741401 QTCNXXOZEMUACO-UHFFFAOYSA-N 430.468 4.391 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)c2ncc(Br)s2)CCCC1 1277849032 GSGATGPTZXCHKA-UHFFFAOYSA-N 434.359 4.411 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1COCCO1 1293898806 IIGFIXFHALQRNF-GCJKJVERSA-N 437.588 4.393 10 10 IICE Cc1ccc(-c2ccc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2)nn1 1294859162 JWWYHECVBNSPJE-OAQYLSRUSA-N 436.943 4.205 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1ccc(F)c(F)c1 1355590777 XBFNLOVRLNGQEX-YVLHZVERSA-N 436.480 4.012 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cn(Cc3ccc(Cl)cc3Cl)nn2)cc1 1357724531 XVLJUUMVFKGARU-UHFFFAOYSA-N 432.355 4.409 10 10 IICE Cc1cc(CC(=O)N[C@H](Cc2ccncc2)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1437141051 XVBZDYVRSSUTQX-HSZRJFAPSA-N 433.552 4.101 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]21 1440681586 HIOMSHSSNGUZRO-BDTNDASRSA-N 427.589 4.138 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccccc1[N+](=O)[O-] 1460727470 QNZBGQBUVISLAH-LSDHHAIUSA-N 443.459 4.048 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(N)c1Cl 1464275682 TVRUOVVFUSYFNM-UHFFFAOYSA-N 427.854 4.016 10 10 IICE CO/C(=C/c1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465324411 DSDOAJCNWSARSH-IFRHDIGASA-N 439.556 4.122 10 10 IICE COc1ccc2nc(C)c(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2c1 1465951104 JCLBGEGWHPASEQ-IBGZPJMESA-N 439.943 4.305 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3CC(OCc4ccccc4)C3)cc2F)C[C@@H](C)O1 1516815580 MSMSTGCYFKXJSR-OTXOEQGISA-N 426.532 4.051 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(Cl)nc1 1519912614 HVKSMXNECIPDOJ-XNTDXEJSSA-N 435.933 4.128 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cn1c(-c2ccc(F)cc2)c(C)sc1=O 1528924799 SABYVTNILUUEKO-MRXNPFEDSA-N 441.572 4.146 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3sc(N4CCCC4)nc3s2)cc1 1530903786 CIOHTDZPQPXRIR-UHFFFAOYSA-N 430.599 4.175 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4ccccc4OC)s3)CC2)c(OC)c1 1530968460 NSLZIMJCNWGIKU-UHFFFAOYSA-N 438.549 4.403 10 10 IICE COc1ccccc1N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1531689928 DMUUMWRNADYIJF-AQTBWJFISA-N 430.526 4.089 10 10 IICE COc1cc(N2CCN(C(=O)CCc3ccc(CC(C)C)cc3)CC2)cc(OC)c1OC 1536634619 USPKEPQOMYSQHK-UHFFFAOYSA-N 440.584 4.192 10 10 IICE COC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)ccc1F 1538382337 RSHHMZJXCDCIPP-UHFFFAOYSA-N 446.276 4.430 10 10 IICE Cc1sc(CNC(=O)OC(C)(C)C)nc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1539467346 AKESRUJUROLXDC-UHFFFAOYSA-N 444.601 4.349 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2c1 1539581251 ASANMHMJSIIVLR-CQSZACIVSA-N 445.441 4.388 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1541080028 BXLXPVHWTUISCY-ILBGXUMGSA-N 437.653 4.404 10 10 IICE CC(C)CCN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1541509249 GDQJRJKWBDZMTR-UHFFFAOYSA-N 439.629 4.298 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] 1543098620 DDSDEQAGLHRVSL-UHFFFAOYSA-N 425.432 4.097 10 10 IICE COc1ccccc1Nc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1543234023 VVOZILQPVVLSTM-UHFFFAOYSA-N 435.499 4.345 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1nc(C)cs1 1545538044 UKXBFKRYPDNCGO-HNNXBMFYSA-N 444.580 4.079 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1C[C@@H]1CCCO[C@@H]1C(C)(C)C 1554175994 DJLUOXCFTNCKPR-TYPHKJRUSA-N 428.577 4.313 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC(OC(=O)Nc4cccc(F)c4)C3)c2C)cc1 1556223392 KEGZHYHSAGVWHF-UHFFFAOYSA-N 437.471 4.315 10 10 IICE Cc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(OCCN(C)C)c1 1565970932 UCPUYMYAEKSJCC-UHFFFAOYSA-N 433.552 4.337 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3CO)c2C)c1 1566448078 PPAIETSSMCIYFG-RPLLCQBOSA-N 445.607 4.324 10 10 IICE CC(=O)N/C(=C/c1ccccc1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1568142092 MYGMBNATPMGCOV-FEMWLQECSA-N 425.960 4.370 10 10 IICE Cc1ccc(-c2nnc(N3CCC(OC(C)C)CC3)n2Cc2ccc(N(C)C)c(F)c2)o1 1612033269 RNFUFCQWKPQEFD-UHFFFAOYSA-N 441.551 4.494 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(C)n(C)c1=O 1613164381 BSUPNRYOBGKTHO-LJQANCHMSA-N 448.615 4.084 10 10 IICE CCc1cnc(CN(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)s1 1613840769 QSYVJFVLIPBDTA-UHFFFAOYSA-N 435.601 4.351 10 10 IICE CCSc1cc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)ccn1 1617457076 GBRHBPMOHHUHKG-UHFFFAOYSA-N 446.580 4.161 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc2c(c1)CCO2 1625811087 LQYFIMSBQMKDOD-QFIPXVFZSA-N 438.911 4.327 10 10 IICE COc1ccc(Cn2nccc2NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1626892139 CFBBRMSBHRBABL-UHFFFAOYSA-N 428.492 4.412 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](c2n[nH]cc2C(=O)N2CC(C)(C)c3ccc(F)cc32)C1 1628327766 FJZKJUMCSWOMRW-CQSZACIVSA-N 428.508 4.211 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)C2CCC(O)CC2)NC(=O)OC(C)(C)C)cc1 1629679378 OSJWFGBZQRHKDJ-MNLRITNHSA-N 447.620 4.012 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(F)c(Br)cc1F 1630351693 YWEUPUYWKHDSFQ-UHFFFAOYSA-N 427.314 4.211 10 10 IICE CCOc1ccccc1-c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)n[nH]1 1631608442 XPLLUVLFGNWGKR-OAQYLSRUSA-N 448.567 4.363 10 10 IICE Cc1ccc(OCc2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)o2)c(C)c1 1633790160 ZYWUSYQFKGNPAQ-UHFFFAOYSA-N 434.536 4.367 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@@H](C1)[C@@H]2C(=O)N(Cc1ccco1)Cc1ccccc1O 1635647589 NLNKQVICDUTDPN-QKNQBKEWSA-N 426.513 4.017 10 10 IICE COC(=O)[C@@](C)(Cn1cnc2ccccc21)NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1636116553 LVFAHYQFJNOWPN-AREMUKBSSA-N 444.535 4.114 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1637410473 MZZPUWNSTFMEQU-UHFFFAOYSA-N 444.579 4.113 10 10 IICE COc1ccc(-c2nc(C)c(C(=O)NCc3ccc4cccnc4c3O)s2)cc1OC 1638569865 NVNSUJKOJGIURR-UHFFFAOYSA-N 435.505 4.320 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)c1 1638952486 MKKCFKIGGFSSKT-JKSUJKDBSA-N 427.545 4.328 10 10 IICE Cc1ccc(C(=O)N2CCNC(=O)[C@@H]2CC2CCCCC2)cc1-n1c(C)cc(C=O)c1C 1639371289 CVJDCYIIHALQFV-DEOSSOPVSA-N 435.568 4.126 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(C(=O)NCC(C)C)cc2)cc1 1643918920 RLQBPEFEPANAHS-UHFFFAOYSA-N 431.536 4.474 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCC[C@@H]3c3ccccc3C(F)(F)F)nc12 1645315128 SQDHUWUAQLCBNK-CRAIPNDOSA-N 448.445 4.056 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)(F)F)CC2)c(C)n1-c1cccc(Br)c1 1645607778 YYEPZPMUYWAWMO-UHFFFAOYSA-N 440.332 4.270 10 10 IICE COCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H](C)c1ccccc1 1653248743 XFSQQWWVSCFSMM-SFHVURJKSA-N 442.515 4.110 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(C(C)=O)CC2)sc(C)c1-c1ccccc1 1654727767 NBFOPBRNOKPODZ-UHFFFAOYSA-N 428.554 4.140 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCC[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1 1685758431 LEDOWKPUAWANJF-DLBZAZTESA-N 435.565 4.188 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(C)Cc3ccccc3-c3ccccc3)cc2)CC1 1687441574 RLYQGQDYBMJQCA-UHFFFAOYSA-N 428.580 4.447 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694024499 HSIZZLIPFCMVHY-IEBWSBKVSA-N 429.584 4.176 10 10 IICE Cc1cc(-c2nnc(N3CCC(C)(C)CC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1707274373 UZFYPNJRELBETK-UHFFFAOYSA-N 434.588 4.067 10 10 IICE Cc1nnc(N2CCC(CO)(Cc3ccccc3)CC2)n1CCCSc1nccs1 1707884263 CGWDSZGHKRMSLR-UHFFFAOYSA-N 443.642 4.047 10 10 IICE CC[C@@H]1CCCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709280967 VAGFPVOKYNPFSV-JOCHJYFZSA-N 425.621 4.112 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C[C@@H]2CCOC2)C2CC2)cc1F 1711006541 LMRSZKMUQZWUON-SFHVURJKSA-N 429.584 4.125 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccccn4)n3CCC=C(C)C)CC2)cc1 1748846808 AZRUVCZFGVVFFW-UHFFFAOYSA-N 432.572 4.422 10 10 IICE CCN(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1764711234 WPCKPUXQTIFBIS-VWLOTQADSA-N 441.620 4.059 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1765272845 OGQNIKZJZBQFAQ-XLIONFOSSA-N 433.597 4.105 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CCCC(F)(F)F 1768651829 YHZMJHVLYZHKIQ-UHFFFAOYSA-N 439.526 4.391 10 10 IICE COCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@H](C)C1 1771095495 RBFIRMKGOWITKB-LQBOVUBWSA-N 445.583 4.024 10 10 IICE CC(C)c1ccc(/C=C2/SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 1858590416 ORQZSCSYOWHNHK-LPGQDOADSA-N 427.547 4.413 10 10 IICE COc1cc(N2C(=O)/C(=C\c3cccc([N+](=O)[O-])c3)SC2=S)cc(OC)c1OC 1860087589 IVNKCRBAHHOQDE-LZYBPNLTSA-N 432.479 4.026 10 10 IICE CC[C@@H](NC(=O)/C=C/c1ccc(C(C)C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862143221 LTBUKWPUUIVTDN-AJQOZTQRSA-N 449.595 4.075 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3cccc(OC(=O)c4ccccc4)c3)CC2)cc1 1874734292 PORQQZKDSGYTIC-UHFFFAOYSA-N 444.531 4.309 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(NCc2cc(Cl)cc(Br)c2O)C1 2033965974 DJPZQJXKATZNSV-SGTLLEGYSA-N 431.758 4.297 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@H](NCc3cc(Br)cc(F)c3O)[C@H]2C1 2149375967 QXPFXORXDDSZMH-NUTKFTJISA-N 443.357 4.419 10 10 IICE OCc1ccc(N2C[C@@]34CCC[C@]3(CN(Cc3ccccc3)C4)C2)cc1Br 2153339277 SHMIRMFGLGPDDM-GOTSBHOMSA-N 427.386 4.434 10 10 IICE Cc1ccccc1N1C(=O)C(=Cc2cc(C)n(-c3ccc(F)cc3)c2C)C(=O)NC1=S 2294244396 DMECKYNXOWGIBZ-UHFFFAOYSA-N 433.508 4.373 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCC(=O)Nc3ccccc3C)C2=O)ccc1O 2314827298 BAHJMWBMJKRDQR-UHFFFAOYSA-N 442.562 4.329 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cc(Br)ccc2O)C[C@@H]2CCC[C@@H]21 2335107030 HCVSQYFITFEMMP-JQFCIGGWSA-N 425.367 4.422 10 10 IICE Cc1ccc(CN(C)C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380784690 UUFXPVVKFYYIEB-HNNXBMFYSA-N 439.350 4.035 10 10 IICE CC(C)N1CCC2(CC1)N=C(c1ccc3c(c1)OCO3)C[C@@H](c1cc(Cl)ccc1O)N2 2936532 OWSVNVZVWGZFTP-FQEVSTJZSA-N 441.959 4.499 10 10 IICE biogenic Cc1ccc([C@H]2CC(c3cccn3C)=NN2C(=O)CN(C)C(=O)c2ccccc2Cl)cc1 35960336 GGRGKDZLDZSFOV-HSZRJFAPSA-N 448.954 4.437 10 10 IICE COc1cc(Br)cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)c1OC 59135373 YLOOPABXRAQMKC-ZSOIEALJSA-N 449.232 4.112 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C/NCc2cccs2)cc1 104647869 FWUMVKHGLJBFGE-XSFVSMFZSA-N 434.477 4.090 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC[C@H]2CC(=O)c2ccco2)C1 444289548 GKVJKFGLRPQHOW-IBGZPJMESA-N 433.552 4.265 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(N)ccc1O 687754341 CDZLSEMSIDWLGP-RUZDIDTESA-N 432.476 4.203 10 10 IICE CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3cccc4ncccc34)n2)c(F)c1 727244913 MBXJZKALVAVNTK-UHFFFAOYSA-N 442.497 4.257 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 741091814 CIWWTOUJVGQMCG-FQEVSTJZSA-N 447.514 4.341 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(C)cc([N+](=O)[O-])c3C)n2)cc1OC 758382240 FEEIRJIETLYRAY-UHFFFAOYSA-N 449.510 4.153 10 10 IICE CC(C)(C)OC(=O)N1CCC(CCC(=O)NCc2cc(Br)ccc2O)CC1 804738073 BDASNLFWALEIOK-UHFFFAOYSA-N 441.366 4.198 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 1125948583 PGLNEMQYFRLBEE-UHFFFAOYSA-N 445.466 4.403 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@H]2O)c(C)n1-c1ccc(Br)cc1 1141668763 MASGYPJRFFGMGB-PZJWPPBQSA-N 441.325 4.081 10 10 IICE CCC(C)(C)N1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1144205197 KMJNATCLFMRHBU-UHFFFAOYSA-N 433.394 4.198 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(-n3ccccc3=O)cc2F)cc1 1147096535 FMYKSMPZCHTIMN-UHFFFAOYSA-N 443.478 4.378 10 10 IICE Cc1cc(C(=O)N[C@H](c2ccccc2F)[C@H](C)O)c(C)n1-c1ccc(Br)cn1 1164548325 FQBJIMWZHYHXTM-XOBRGWDASA-N 446.320 4.243 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1165498078 LBLYIZYFWXOUKX-YWZLYKJASA-N 439.314 4.453 10 10 IICE Cc1cc(C(=O)CSCc2cccc(C(N)=O)n2)c(C)n1-c1ccc(F)c(Cl)c1 1189112554 MMJSTTXCBANFFT-UHFFFAOYSA-N 431.920 4.497 10 10 IICE Cc1cc(CNC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1254080663 ZSQTVNQXABMCSW-SFHVURJKSA-N 426.561 4.245 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(N2CCN(c3ccc(OC)c(F)c3)CC2)nnc1C(C)(C)C)OC 1291424895 DIUQQJBPPZLMCR-DYESRHJHSA-N 447.599 4.111 10 10 IICE Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2)n1 1294859134 JJUAVWRYGOFBRN-NRFANRHFSA-N 438.959 4.243 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC[C@@H]3CCCCO3)CC2)cc1F 1300248382 WSYDJRHUAGNMKS-IBGZPJMESA-N 445.583 4.009 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1302710935 DTCGZQZCMBSXFI-QGZVFWFLSA-N 435.613 4.003 10 10 IICE C[C@](CO)(NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)c1cccc([N+](=O)[O-])c1 1307999608 LBQQAMPVDSBAKL-HSZRJFAPSA-N 433.468 4.446 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)c1O 1308117137 HPSSGXRCSVQNOU-LJQANCHMSA-N 426.738 4.094 10 10 IICE COCCCC[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1 1312651647 WNMRMNVVQZUHMG-DEOSSOPVSA-N 425.573 4.005 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCC1(C)C 1314389519 GXNNRAPAQODOMX-GOSISDBHSA-N 445.583 4.115 10 10 IICE CC[C@]1(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)CCNC1=O 1349819218 FPKUZOKEYOZEKV-QFIPXVFZSA-N 426.517 4.212 10 10 IICE CC(=O)c1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1350546403 RXRFZAPIJBODEJ-WOJGMQOQSA-N 428.510 4.258 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cc(Br)cc3c2OCCO3)C2CC2)cc1 1353227766 AMLPTBXALKERBL-UHFFFAOYSA-N 431.330 4.091 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CC(C)(C)OC(C)(C)C1 1361098482 VAGJSMQWIVEUBF-UHFFFAOYSA-N 448.615 4.080 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)c2ccc(N3CCCNC3=O)cc2)c1 1450404299 POAIBZTXTNQKEG-GOSISDBHSA-N 444.535 4.317 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccccc3Cc3ccccc3)CC2)c(OC)c1 1461981496 LJVWEEDRSAHUHL-UHFFFAOYSA-N 446.547 4.022 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@@H]3C(=O)OCc3ccccc3)c2C)cc1 1464835813 DZHYTIYXEPNGRF-XMMPIXPASA-N 432.520 4.451 10 10 IICE COc1ccc(N(CCOc2cccc(S(C)(=O)=O)c2)CCc2ccccc2)cc1 1473251241 SVAYGNPRAFCMGE-UHFFFAOYSA-N 425.550 4.227 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C[C@@H](C)O1 1494394283 HNBGGEXKXNOJER-IYBDPMFKSA-N 447.605 4.261 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1 1512653668 SYQUKGNGBJDPMW-UQBPGWFLSA-N 437.588 4.129 10 10 IICE CCCc1ccc(CCCC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 1528359541 QSXAVGXZBPTHCB-UHFFFAOYSA-N 440.584 4.336 10 10 IICE CC[C@](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)(C(=O)OC)c1ccccc1 1532316412 RIEJKGYOUFVTJK-HHHXNRCGSA-N 447.579 4.003 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc4ccc(Br)cc4c3)cc2)CC1 1536934654 ZSBBHQZKOYGCSA-UHFFFAOYSA-N 438.369 4.284 10 10 IICE CC(C)[C@H](Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1541309119 HJTBBJXFTCCEOX-QHCPKHFHSA-N 442.567 4.441 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCO[C@H]2C(C)C)c(C)n1-c1ccc(Br)cn1 1544926915 BVFIAXUZXIONEX-UZLBHIALSA-N 434.378 4.433 10 10 IICE O=C(NCC(=O)N1CCCCc2ccccc21)N(Cc1ccco1)Cc1ccccc1O 1565423176 PAIQNLIAEPPNMU-UHFFFAOYSA-N 433.508 4.067 10 10 IICE C[C@@H]1O[C@H](C)[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)[C@@H]1C 1585834659 LYZANRHNSYIKSK-ZHRONYKTSA-N 429.318 4.157 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc(C(C)C)n(-c3ccccc3Cl)n2)cc1 1586649608 PEZTYBBXKPROEY-UHFFFAOYSA-N 441.963 4.261 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](CC(C)C)NC(=O)C(C)(C)C 1588192923 FXXKQTLWJFCGSF-INIZCTEOSA-N 427.383 4.080 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCc1cnc(C2CC2)o1 1596761485 PQDNEMPYOVOOFB-DHDCSXOGSA-N 434.564 4.338 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3csc(Cc4ccc(F)cc4)n3)C2)cc1 1598364189 OMHWKXKNZMGZTJ-GOSISDBHSA-N 439.556 4.067 10 10 IICE COC(=O)C[C@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccc(C(F)(F)F)cc1 1603555364 PMYQXSBYEKPQOM-ZDUSSCGKSA-N 439.411 4.366 10 10 IICE COc1cc(N2CCN([C@H](C)c3nc4ccccc4s3)CC2)c([N+](=O)[O-])cc1OC 1611745643 ZJTVAENCDWBGHX-CQSZACIVSA-N 428.514 4.105 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N3CCC(CO)CC3)cc2)CC1 1612826123 NNVCJACOJARCRN-UHFFFAOYSA-N 439.648 4.360 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@@H]3CC[C@]32CNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1612988711 UACIUWCLKFWKLZ-XJPKAEQDSA-N 445.516 4.055 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3c(=O)sc4ccccc4c3=O)c2C)c1 1613703217 OBNYYHDTSDAILK-UHFFFAOYSA-N 436.558 4.436 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)cc1F 1633752929 ISYWBOFNBXCNED-LJQANCHMSA-N 435.499 4.473 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cncc3ccccc23)NC(=O)OC(C)(C)C)cc1 1634161662 BEEKAGFURVEZBG-QHCPKHFHSA-N 448.567 4.226 10 10 IICE Cc1ccc(CCC(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1635126218 JWNSEAQAMASTFN-LJQANCHMSA-N 442.003 4.250 10 10 IICE Cc1ccn(CC(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)c(=O)c1 1638240964 KNXIWOBXGDCGAE-HXUWFJFHSA-N 443.469 4.468 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2sc(NC(=O)OC(C)(C)C)nc2C)cc1 1640772439 ZRCAGSAOZRNRCW-UHFFFAOYSA-N 434.562 4.016 10 10 IICE CC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1O 1641848962 ZFJKRCYAIQFRBG-UHFFFAOYSA-N 428.286 4.412 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccccn3)noc2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 1643687065 OAQBSQGGHQGXEY-UHFFFAOYSA-N 430.508 4.486 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(COc2cccc(F)c2)c1 1646434939 KPAZSCCFOBKCIT-UHFFFAOYSA-N 434.511 4.296 10 10 IICE CC(C)(C)OC(=O)N1CCOc2ccccc2[C@@H]1C(=O)NCc1cccc(Cl)c1O 1648608864 OQHZWWJTROMYBE-GOSISDBHSA-N 432.904 4.033 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](CO)C2CCCCC2)sc(C)c1-c1ccccc1 1654125778 XQWIGDLKOJZWNT-LJQANCHMSA-N 444.597 4.370 10 10 IICE Cc1ccc(CN2CCCN(C(=O)CN(C)c3ccc(-c4nccs4)cc3)CC2)cc1 1658932939 ULEKXOZSFKZQGB-UHFFFAOYSA-N 434.609 4.289 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 1683424807 JATPSODJXDOUTC-RCZSKKKRSA-N 444.620 4.033 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)C[C@@H](C)C3)n2CCCSc2nccs2)n1 1693422862 IOJIRVUUOKSFIK-HZPDHXFCSA-N 445.662 4.261 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC(=O)N1 1695328253 DUOVSAYMXBLHQB-HXUWFJFHSA-N 434.588 4.258 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H]3C[C@H](C)O[C@H](C)C3)CC2)cc1 1697471273 YFOPFFBSJKHTTI-WKCHPHFGSA-N 441.620 4.330 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCO[C@@H](C)C1 1708508436 GWGFASMKXLGIKS-PCCBWWKXSA-N 441.620 4.332 10 10 IICE CCO[C@]1(c2nnc(N(CC)CC)n2Cc2ccc(N3CCC(C)CC3)cc2)CCOC1 1710438024 AXUAHTRYMUESKU-RUZDIDTESA-N 441.620 4.061 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)C[C@H]2CCCCO2)cc1 1746089986 XMGIXRIXVCIXAC-JOCHJYFZSA-N 434.588 4.240 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746942369 NCOAFJYWTOLQHB-SFTDATJTSA-N 429.584 4.124 10 10 IICE C[C@H]1CN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)CC(C)(C)C1 1752281895 UJAIJLKJYKLHSO-MRXNPFEDSA-N 448.662 4.025 10 10 IICE CCc1cnc(CN(C)c2nnc(CC(C)C)n2Cc2ccc(N(C)C)c(F)c2)s1 1764577694 URNCHGNBCRIWRW-UHFFFAOYSA-N 430.597 4.385 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)C1 1770921689 ZDCMABDQAONRJQ-OAHLLOKOSA-N 433.578 4.196 10 10 IICE CCCOC(=O)c1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1 1860076482 CEWDAMGRPJJYMH-WOJGMQOQSA-N 427.503 4.388 10 10 IICE COc1ccc(N2CCN(c3nc(Nc4ccc(Cl)cc4)ncc3[N+](=O)[O-])CC2)cc1 1871303385 XMNJQEBIBRFDKG-UHFFFAOYSA-N 440.891 4.117 10 10 IICE O=[N+]([O-])c1cccc(-c2csc(NS(=O)(=O)c3cc(Cl)c(F)cc3F)n2)c1 1892116453 QDILSISSUNWBIY-UHFFFAOYSA-N 431.829 4.451 10 10 IICE CCN[C@@H](c1ccccc1O)[C@@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 1942402003 YSGMQWZNIFCWJE-WIOPSUGQSA-N 425.573 4.212 10 10 IICE O=C(NC[C@H](NCc1ccc(Br)cc1O)C(F)(F)F)OCc1ccccc1 1942706851 NCMSRHGBHAMDFK-INIZCTEOSA-N 447.251 4.102 10 10 IICE CCc1nn([C@@H](c2ccc(C)cc2O)C2(C)CC2)c(I)c1C(=O)O 2079124395 IVHAYUATNFSXHM-HNNXBMFYSA-N 440.281 4.152 10 10 IICE CN(C)c1ccc([C@@H](O)C2(COCc3ccccc3)CN(C(=O)OC(C)(C)C)C2)cc1 2248461222 RLHPFFJWMFNKRB-JOCHJYFZSA-N 426.557 4.240 10 10 IICE Cc1ccccc1NC(=O)CCN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314827361 CHDPSOBNONBHAR-UHFFFAOYSA-N 427.507 4.133 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CC[C@@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381136226 CDBNHENNGOXPKI-DOMZBBRYSA-N 441.366 4.115 10 10 IICE CC[C@@H](C)N1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(CC)c2N2CCCCC2)SC1=S 33468569 JIYPRXFTGAEKJO-CRRKTRLDSA-N 444.626 4.038 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(CC(C)C)C2=O)c(C)n1-c1ccc(OC(F)F)cc1 57496667 JFPFZQGARSUUQX-QHCPKHFHSA-N 447.482 4.235 10 10 IICE CC(C)(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4[nH]c(=O)oc4c3)cs2)cc1 71557517 BHWHUBHVEFUYLX-UHFFFAOYSA-N 429.523 4.343 10 10 IICE Cc1cccc(C)c1OCCOc1ccc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1 96544512 AMGINXQIINXRIG-QJOMJCCJSA-N 428.488 4.223 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CCC[C@H]3Cc3cccc(F)c3)cc2F)CC1 303255433 BXWWGGGFLJOUHK-QFIPXVFZSA-N 442.554 4.023 10 10 IICE Cc1cc(C(=O)COC(=O)C[C@H](C)NC(=O)C2CCCC2)c(C)n1-c1ccc(F)cc1 727200558 LJEHDSIYQPFWDB-HNNXBMFYSA-N 428.504 4.044 10 10 IICE CC1CCC(OC2CCN(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)CC1 731047394 NWSMCAORLORZKV-KQVJYAISSA-N 429.605 4.354 10 10 IICE COc1cc(CN(C)C(=O)CN(C)Cc2ccccc2O)ccc1OCc1ccccc1 731842783 CJCSJQPNDVVGLV-UHFFFAOYSA-N 434.536 4.070 10 10 IICE Cc1cc(C(=O)N2CC[C@H](N3CCC3)[C@H](F)C2)c(C)n1-c1cccc(Br)c1 791256570 DTXTUIKISWQBQJ-UXHICEINSA-N 434.353 4.115 10 10 IICE O=C(Cc1c(F)ccc(Br)c1F)N(Cc1ccccc1O)C[C@H]1CCCO1 800522700 MFEZEPMFHIOKJS-CQSZACIVSA-N 440.284 4.183 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CC)C2=O)ccc1OCc1ccc(C(=O)OC)o1 915838246 BLHTUAZKYHTMGK-WOJGMQOQSA-N 447.534 4.265 10 10 IICE Cc1ccc(-n2nc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c3c2CCC3)c(C)c1 1134882875 WFMHCBWQAJIVKL-VWLOTQADSA-N 445.611 4.077 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2CCCN(CCc3ccccc3)C2)cc1 1136480601 RQAQPVNHTVRRMA-AHKZPQOWSA-N 449.639 4.215 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(Cc3nc[nH]n3)cc2)cc1 1136698266 ANUUGXNDKSUXEJ-UHFFFAOYSA-N 441.535 4.317 10 10 IICE COC(=O)c1occc1CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1147799560 JCBUUZAKTFJZDA-UHFFFAOYSA-N 431.286 4.166 10 10 IICE C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NCc1cccc(Br)c1O 1156792747 OZKGEDXQZHTCOE-MRXNPFEDSA-N 447.373 4.338 10 10 IICE COc1ccc(N(CC(C)C)C[C@@H](O)COc2cc(F)cc(Br)c2)cc1 1195256578 AJYPLPMXHSWWSR-GOSISDBHSA-N 426.326 4.499 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3c(Cl)oc4ccccc34)CC2)cc1 1264273726 PGKVIZSIXSQCKS-UHFFFAOYSA-N 427.932 4.037 10 10 IICE Cc1cc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c(C)n1-c1ccccc1 1287662315 XGDOFEHVSMHAJJ-OAQYLSRUSA-N 435.955 4.412 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1 1300955871 GTWJDBFZRRTROY-YSIASYRMSA-N 437.588 4.249 10 10 IICE CC(C)c1csc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)n1 1302542453 UWUOMQLXDKWJAU-LJQANCHMSA-N 427.574 4.490 10 10 IICE CSc1ccc([C@@H](C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1307711886 AXQIRXNUAIFUFS-OAHLLOKOSA-N 430.529 4.473 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@@H]1CCCCO1 1316054853 SKTFCEJVFQLZRJ-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCOc1ccc(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1347710631 RIVNAWVRRBHCGF-QGOAFFKASA-N 431.510 4.421 10 10 IICE CC[C@@](C)(NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nccs1 1353971787 NJJXWJVUMAZBIA-NLBZTSMMSA-N 449.598 4.315 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCCC[C@H]2N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1355606068 UAHQDIDJVCOKBK-XZOQPEGZSA-N 429.992 4.050 10 10 IICE COC(=O)c1ccc2c(c1)CN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)CC2 1446764910 MMKVPWPWBFFNQT-UHFFFAOYSA-N 430.504 4.200 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](Cc3cccnc3)C3CCCC3)cc2F)CC1 1456124487 CMSQJBFYWBAGFH-HSZRJFAPSA-N 438.591 4.028 10 10 IICE CC[C@@H](C)CCNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 1461441634 XDLKZMKDBJZKCN-JXCQQFQQSA-N 441.416 4.203 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@H](c2ccc(Br)cc2)C1 1464419478 NLZJYNMWGRDUKT-MRXNPFEDSA-N 434.311 4.289 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(F)cc2Cl)NC(=O)OC(C)(C)C)cc1 1465325355 PQHFAQGBYFWAAA-FQEVSTJZSA-N 449.954 4.470 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cn(-c2cccc(F)c2)nc1C 1465848949 IFBJWIMRDUXLHY-UHFFFAOYSA-N 432.293 4.450 10 10 IICE CN(CC(=O)NC(c1ccccc1)c1ccccc1)C(=O)c1cc2cc(O)c(O)cc2s1 1468408422 GRGZLUPVQGDQML-UHFFFAOYSA-N 446.528 4.290 10 10 IICE CCOc1ccc(N2CCN(C[C@](C)(O)c3ccc(Br)cc3F)CC2)cc1 1473296865 SJTPWVZFUJCNQB-NRFANRHFSA-N 437.353 4.017 10 10 IICE C[C@H](NC(=O)N1CCC[C@H]([C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 1478471025 MDCIQUUMCAQRFV-SESVDKBCSA-N 444.620 4.492 10 10 IICE CC(C)c1nnc(N2CCC[C@H](C(F)F)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1508976750 FGKBVIAXMGHIQK-FQEVSTJZSA-N 447.574 4.140 10 10 IICE CC(C)OC1CCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)CC1 1509835819 SAINCGNRWCIUTO-UHFFFAOYSA-N 446.646 4.316 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1512865457 QNJJMAINBIZOLL-RTBURBONSA-N 443.661 4.397 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCN(C)C1CCCC1 1517145535 AIOZZXMMDLHOCV-UHFFFAOYSA-N 425.602 4.147 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccc(Cl)c(F)c1 1518808379 NXRGIYOPPOLZMP-QFIPXVFZSA-N 428.891 4.460 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(COc2ccccc2)cc1 1528262079 USBIHOOEPZIWKE-UHFFFAOYSA-N 438.474 4.310 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3csc(-c4ccc(Cl)s4)n3)C2)cc1 1528317553 LSTALVRLHIQUEH-ZDUSSCGKSA-N 433.986 4.471 10 10 IICE Cc1cc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(C)s1 1540739752 QMYYPYJMBMNZSV-LBPRGKRZSA-N 436.580 4.424 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1C[C@@H](O)CC2(CCCC2)C1 1542227235 WOEBCERXUITGJQ-QFIPXVFZSA-N 425.621 4.031 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCCC(=O)N2CCc3ccccc32)c1 1543008333 QHONUIKVKCGAGM-UHFFFAOYSA-N 429.520 4.006 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F 1544629887 DIZLLPXSBMGJHR-MJGOQNOKSA-N 434.914 4.389 10 10 IICE CCOc1ccc(N2CCN(C(=O)CC[C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1545931621 PGWJYGZOHFAEKA-HXUWFJFHSA-N 445.604 4.161 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1CC 1547393292 AKQATIVVVLSAKE-UHFFFAOYSA-N 446.603 4.495 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)OC(C)(C)C)N(C)C)cc1 1558722780 BZSMQXGGJXBNSH-OAQYLSRUSA-N 426.561 4.132 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@]23CCC[C@H]2OCC3)sc(C)c1-c1ccccc1 1560095233 FVKKEAFYNOYADS-HXOBKFHXSA-N 428.554 4.140 10 10 IICE COc1ccc([C@@H]2CCCCCN2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1565126064 DQDRHEQALUUUQB-VWLOTQADSA-N 437.584 4.483 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CC(=O)N(Cc1ccco1)Cc1ccccc1O 1566302658 FEYUJOIZLSAZTB-IEBWSBKVSA-N 428.529 4.407 10 10 IICE CCOc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1OCC 1566356430 DTKDXDQUVRDPAW-IBGZPJMESA-N 432.948 4.237 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(O)c(F)c1F 1569010623 HMOHAIYDKMMKGZ-ZROIWOOFSA-N 438.452 4.040 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)COc1cccc(NC(=O)c2ccco2)c1 1584088756 FVEVXELGKVJNMI-SFHVURJKSA-N 435.524 4.033 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)cc1 1586649902 RVWZCBSJRUEAJS-UHFFFAOYSA-N 446.960 4.086 10 10 IICE Cc1cc(C(=O)NC[C@@]2(OC(C)C)CCOC2)c(C)n1-c1cccc(Br)c1 1597066758 VYMSJMCHUKXDRI-NRFANRHFSA-N 435.362 4.171 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CCC1CC(OC(C)(C)C)C1 1617941921 ZVUKJMWLGPKAKZ-CNBHCMJISA-N 428.577 4.455 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(C)C[C@H](C)C3CCCCC3)cc2F)C[C@@H](C)O1 1620486159 WNXUTIFCLDKBLJ-XUVXKRRUSA-N 433.612 4.204 10 10 IICE Cc1cc(C(=O)N2CC[S@@](=O)C(C)(C)CC2)c(C)n1-c1ccc(Br)cc1 1624189415 CHEMJELTTYAAAS-AREMUKBSSA-N 437.403 4.230 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cccc(I)c2O)cc1 1624541561 QYQUCVUKRSKMHN-UHFFFAOYSA-N 438.309 4.115 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2c(c1)CCCCC2=O 1631425508 HUQPHRWYXRXOKE-HXUWFJFHSA-N 426.944 4.349 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CCC(=O)NCc2c(O)ccc3c2CCCC3)COC1(C)C 1631439076 ULMLHSNFFRLVLB-QGZVFWFLSA-N 432.561 4.039 10 10 IICE CCCN(Cc1ccccc1O)C(=O)CN1C(=O)NC2(CCC(C(C)(C)CC)CC2)C1=O 1635663255 NHKKEKDGMBBDJK-UHFFFAOYSA-N 443.588 4.048 10 10 IICE Cc1cc(S(N)(=O)=O)cc(C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)c1C 1637243534 APJQGBGYFHGAOO-SFHVURJKSA-N 438.549 4.060 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3cc(Br)cnc3OC)c2C)cc1 1641596700 RYDAZUUHXWMISY-UHFFFAOYSA-N 444.329 4.199 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2c2ncccn2)c(C)n1-c1ccc(Br)cn1 1641835616 IYVAZXHXURNACH-KRWDZBQOSA-N 426.318 4.019 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC2CCC2)[C@@H](C)CO)sc(C)c1-c1ccccc1 1642865357 DGXFYLMINSQZDR-INIZCTEOSA-N 444.597 4.322 10 10 IICE COCCN(Cc1ccc(N(C)C)cc1)C1CCN(C(=O)OCc2ccccc2)CC1 1646579541 ZGUULLJWKDIEEJ-UHFFFAOYSA-N 425.573 4.002 10 10 IICE Cc1ncc([N+](=O)[O-])c(OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)c1C 1656621772 CJETUPSELQPJIX-UHFFFAOYSA-N 437.452 4.047 10 10 IICE CC(C)N(CC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1)Cc1ccc(N(C)C)cc1 1657024427 YDFAJMUIMZWCSX-SFTDATJTSA-N 438.616 4.215 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CC[C@@H](Oc3cncc(Br)c3)C2)c1O 1659186906 XCZRWMPXWOVZGO-OAHLLOKOSA-N 425.710 4.059 10 10 IICE CC(=O)N(c1ccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1)[C@@H]1C[C@H]1C 1670258215 HQDRXIKZLAIPAM-MQNAVGNWSA-N 437.540 4.367 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(Cc1ccccc1F)CC1CC1 1686725878 YYPCMHMKSSOASK-UHFFFAOYSA-N 433.474 4.062 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)Cc1cc(F)cc(OC)c1 1686754883 CTRPEIKBMXOFTP-CYBMUJFWSA-N 439.325 4.465 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C[C@H](C)S1 1693824022 PGQFUEZWVMGFKR-HOTGVXAUSA-N 446.671 4.233 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)CCC(F)(F)F)cc1 1695626318 RTQJRLQSSVIQHV-KRWDZBQOSA-N 425.499 4.065 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1709480728 JUFRIMMDRCSVAY-WXTAPIANSA-N 448.615 4.456 10 10 IICE COC[C@@H]1CCCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1712242656 KWFMDELAPLUEIX-IAGOWNOFSA-N 437.635 4.021 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nccn1C(F)F 1741334907 QGSPFQCGCXBMRS-UHFFFAOYSA-N 429.519 4.278 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N(Cc1cccs1)C[C@H]1CCCO1 1761698119 RMEBSKSPSHEEAF-OAQYLSRUSA-N 425.602 4.256 10 10 IICE CCOc1ccccc1NC(=O)CCNCc1cc(Cl)cc(Br)c1O 1860657313 HKDRFEKAHGNBQV-UHFFFAOYSA-N 427.726 4.325 10 10 IICE CCCCCn1cc(OCC(N)=O)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1871116966 XJQXNYITLBSCPI-UHFFFAOYSA-N 434.540 4.258 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C(C)C)c1O 2236054348 HMDWVFBXBNEYRS-RDJZCZTQSA-N 443.382 4.287 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1cccc(C(=O)O)c1 2293031033 KMJQRLFWICNYKU-UHFFFAOYSA-N 432.548 4.066 10 10 IICE COc1ccc2cc(C=C3SC(=S)N(c4ccc(C(=O)O)cc4)C3=O)c(O)nc2c1 2296595324 RSBBENFQQSMOQH-UHFFFAOYSA-N 438.486 4.053 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccc(N4CCOCC4)cc3)N=C2SCC)cc1 2297337952 ZMMBZRJGPMUKPH-UHFFFAOYSA-N 437.565 4.419 10 10 IICE O=C1NC(=S)N(c2ccccc2)C(=O)C1=Cc1ccccc1OCc1ccccc1F 2297341916 JMOUBPCUFNMZOW-UHFFFAOYSA-N 432.476 4.236 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(c4ccc5c(c4)OCO5)C3=O)n12 2321611113 YVEBLXFKIKXABB-UHFFFAOYSA-N 435.939 4.492 10 10 IICE CC(C)Oc1cccc(C=C2SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 2323812527 ALQCDHMXHXMVNB-SFHVURJKSA-N 443.546 4.077 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCC(=O)Nc3ccccc3C)C2=O)ccc1O 15037289 BAHJMWBMJKRDQR-UYRXBGFRSA-N 442.562 4.329 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3cc(Cl)ccc3O)C2=O)cc1 33373225 FGQJPFZWWLIGRA-LICLKQGHSA-N 448.953 4.284 10 10 IICE COc1cccc(/C=C2\SC(=S)N(NC(=O)c3ccc(Br)cc3)C2=O)c1 40844955 IAXWWQKOBLZXBX-GDNBJRDFSA-N 449.351 4.004 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/c3ccc(Oc4cccnc4)c(F)c3)CC2)cc1 109918441 DBAHBLXRJVAZOR-VZUCSPMQSA-N 433.483 4.384 10 10 IICE CC(=O)c1cccc(N2C(=O)/C(=C/c3ccc(OCCC(=O)O)cc3)SC2=S)c1 210413892 UBUSNYVXKKZLDO-WQRHYEAKSA-N 427.503 4.149 10 10 IICE COc1ccc(N2CCN(C(=O)CNc3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1 248154714 YFVINBHLNISJLH-UHFFFAOYSA-N 427.854 4.128 10 10 IICE CC1CCN(c2cccc(NS(=O)(=O)c3cc(C(=O)N(C)C)ccc3Cl)c2)CC1 747765706 IPOXWHMYEAPDCC-UHFFFAOYSA-N 435.977 4.079 10 10 IICE FC(F)(F)c1cc(N2CCOCC2)ccc1CNCc1cnc(-c2ccncc2)s1 753366505 MPIKQXOZVRDCRT-UHFFFAOYSA-N 434.487 4.350 10 10 IICE C[C@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)cc(F)c1O 757639038 UGWHHISQSHRFKI-XHDPSFHLSA-N 449.299 4.357 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1cccnc1Oc1ccc(F)cc1Br 762264485 ZXDRNLCAHWFPTP-UHFFFAOYSA-N 447.260 4.159 10 10 IICE C[C@H]1CN(c2ccc(CN[C@H](c3ccc(F)cc3)c3ccn(C)n3)cc2F)C[C@@H](C)O1 775621511 KTPQDGFOACZJIE-XVTZWQNCSA-N 426.511 4.191 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F 776015787 XJRZWZYLGQKNMP-IBGZPJMESA-N 443.416 4.246 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cn(C(C)(C)C)nc2Br)cc1F 779907899 VNLAGBULMPFTFX-UHFFFAOYSA-N 425.346 4.316 10 10 IICE COc1ccccc1[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1ccco1 806993647 DUQLBFRFGFQDPX-LJQANCHMSA-N 431.286 4.345 10 10 IICE Cc1c(Cl)cccc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 915290919 BWRSTTQVGPMQHX-UHFFFAOYSA-N 433.942 4.457 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2cnn(-c3ccccc3)c2)cc1 919655917 XWEUOGRCYBKDOS-UHFFFAOYSA-N 429.524 4.443 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)Cn3ccc(=O)c4ccccc43)c2C)cc1C 920263529 HTELJAJQHBNPQH-UHFFFAOYSA-N 442.515 4.452 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1Cl 1127182239 ULWCLWHLBLGRPR-UHFFFAOYSA-N 426.004 4.466 10 10 IICE Cc1ccc(CCC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134883217 ZIMIYYRIHGALAP-NRFANRHFSA-N 432.406 4.175 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F 1136985903 ANHDYUMHOUZLQF-JOCHJYFZSA-N 430.426 4.087 10 10 IICE CCS[C@H](C)c1noc(CN(C)C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1137519107 KZVSFFQZWCFLPC-MRXNPFEDSA-N 426.542 4.376 10 10 IICE Cc1cc(C(=O)NCC[C@@H]2CCC3(CCC3)O2)c(C)n1-c1ccc(Br)cn1 1156476098 JPHRXQZGICBXPG-KRWDZBQOSA-N 432.362 4.473 10 10 IICE CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1255508840 GKTQWEGPGZUVOH-JWQCQUIFSA-N 448.611 4.256 10 10 IICE CCN(Cc1ccccc1)C(=O)CNC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1264812182 IPJJSJZVZMOCPN-UHFFFAOYSA-N 437.971 4.455 10 10 IICE Cc1nc(-c2ccc(F)cc2)sc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1275224566 OBXWZGXAIRSPCO-UHFFFAOYSA-N 447.482 4.302 10 10 IICE Cc1cc(CNC(=O)c2cc(Br)cn(C3CC3)c2=O)c(C)n1-c1ccccc1 1287660339 HTAMEJWXYWQAAA-UHFFFAOYSA-N 440.341 4.283 10 10 IICE CCS(=O)(=O)c1ccc(F)c(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1 1287660388 NLUGCARQMHNOEZ-UHFFFAOYSA-N 428.529 4.265 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@@]2(C)c2cccc(Br)c2)N(C)C)cc1 1289602912 YBJYAPYNACKKHO-FUDKSRODSA-N 444.417 4.212 10 10 IICE Cc1cc(C(=O)Nc2ccc3oc(O)nc3c2)c(C)n1-c1ccc(Br)cn1 1289958839 ZNLSKBHOMLIEOD-UHFFFAOYSA-N 427.258 4.351 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC3(CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1302039037 YYBANVWDEVGPBQ-GOSISDBHSA-N 445.583 4.026 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCOC(C)C)CC2)cc1 1315512878 PQAULEYRAVIYQJ-UHFFFAOYSA-N 429.609 4.017 10 10 IICE CCc1cc(OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1Cl 1350934146 ZFLZODWIMUSRIU-HZPDHXFCSA-N 434.939 4.350 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)nc(-c2ccc(Cl)cc2)n1 1355124103 SWPFYKGVJHPVDL-UHFFFAOYSA-N 440.906 4.011 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)c4ccccc4n3)cc2F)CC1 1359920154 JJQWPSHTFSHRFR-UHFFFAOYSA-N 426.923 4.099 10 10 IICE COc1ccc(-c2nc(C)sc2CC(=O)NCc2cccc(Br)c2O)cc1 1448961158 NKOWLUXOTWNDEA-UHFFFAOYSA-N 447.354 4.454 10 10 IICE COc1cc(OC)cc(C2(C(=O)NCc3ccc(N4CCSCC4)cc3)CCCC2)c1 1464260655 NLRCHHBTKFTQLU-UHFFFAOYSA-N 440.609 4.385 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1cc(Cl)cc2c1OCC2 1467632197 SPQDMFYHZJTABL-UHFFFAOYSA-N 444.959 4.206 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(S(=O)(=O)N(C)C)c(C)c2)c1 1472093945 CDMZHAQEPJBCNT-UHFFFAOYSA-N 425.554 4.214 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3C[C@H](c4ccc(Br)cc4)C3)C2)cc1 1478740083 FSLBVHQTMUMSND-BHIYHBOVSA-N 444.373 4.282 10 10 IICE CO[C@H](C)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1503944374 JHLNNRBQVIWNLT-GOSISDBHSA-N 425.602 4.202 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC(F)(F)Br 1513789215 HSKMMWHGICLUCP-UHFFFAOYSA-N 428.325 4.065 10 10 IICE COC(=O)CCN(Cc1ccncc1)C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1517215880 DFAAMZWVSOSKKK-UHFFFAOYSA-N 425.916 4.348 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCCCCSC)CC2)cc1F 1518307672 FSFMZAYRMOMGST-UHFFFAOYSA-N 435.613 4.409 10 10 IICE COc1c(C)cccc1CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1530621294 NBBXVZAJHYSXEQ-LDADJPATSA-N 444.553 4.050 10 10 IICE CO[C@H]1CN(C(=O)OC(C)(C)C)[C@](C)(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1535142441 AZSYEQWJIPSQAO-BWKNWUBXSA-N 441.572 4.125 10 10 IICE CSc1ncc(C(=O)NCc2cccc(Br)c2O)n1-c1ccc(F)cc1 1556480270 KGWCODBHNUJHFF-UHFFFAOYSA-N 436.306 4.131 10 10 IICE Cc1ccccc1[C@@H](CO)N(C)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1558381634 OWJDBXVHRQPEQB-HXUWFJFHSA-N 442.357 4.366 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C(=O)c4ccc(F)cc4)CC3)c2C)c1 1565193439 YLWKNVDHTORAPD-UHFFFAOYSA-N 448.542 4.209 10 10 IICE CC[C@@H](OC1CCCC1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1565882035 NTLRKAGVIMLYKQ-NHCUHLMSSA-N 433.593 4.172 10 10 IICE CNC(=O)OC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1570017402 MSVBGLZBFQXQRU-SFHVURJKSA-N 448.361 4.207 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(NC(=O)OC(C)(C)C)c3)CC2)c(OC)c1 1587486700 HDMDPJHBXARSKQ-UHFFFAOYSA-N 441.528 4.013 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4ccc(C(F)(F)F)cc4[nH]3)cc2F)CC1 1616495826 HHIQJOHAOIOGOS-UHFFFAOYSA-N 448.464 4.398 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1626106943 TTXCVRZUNGAGRS-HSZRJFAPSA-N 436.531 4.207 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(F)c(NC(=O)OC)c1 1629971639 DFEALHPBBLAMAG-UHFFFAOYSA-N 425.254 4.134 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C2CC2)cc1 1633701023 CSRYVWMOWPAOMR-OAQYLSRUSA-N 444.938 4.025 10 10 IICE O=C(CSc1ccccc1Br)NCc1cccc(Br)c1O 1634725601 ZJAPZWXJKSOPFX-UHFFFAOYSA-N 431.149 4.326 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1635801032 AWJPWOIENHUAQL-NQIIRXRSSA-N 444.620 4.081 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@@H]3CCNC3=O)n2)c(C)n1-c1cccc(C(F)(F)F)c1 1638077629 YLERSFRDZHROQD-OAHLLOKOSA-N 448.470 4.311 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@H](CC(C)C)C(N)=O 1648494038 RHXMBSYXTPTVAD-RTBURBONSA-N 435.490 4.446 10 10 IICE COC(=O)c1ccc2cc(CCNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)oc2c1 1648609197 TYAVIMJRSDLGSU-UHFFFAOYSA-N 444.487 4.412 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3COC4(CCCCC4)O3)cc2Cl)C1 1680794040 JRKAQTAYFGYBFG-MJGOQNOKSA-N 435.996 4.451 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C)[C@@H](C)C1CCC1 1695538056 SSDCMHXZMZMREI-IBGZPJMESA-N 448.615 4.456 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(Cc2ccsc2)n1CCC(C)(C)O 1696684841 LFUYDMYJXDAGBK-UHFFFAOYSA-N 439.629 4.328 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)N1CCC[C@H](C)C1 1712655358 KQICPYAGRJXATC-AZUAARDMSA-N 436.604 4.471 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1C[C@H](C1CCCCC1)N(C)C 1729420218 JXNMBQKXRNNJNM-FGZHOGPDSA-N 441.620 4.025 10 10 IICE CCCCn1cc(Cn2c(CC)nnc2N(C)Cc2ccc(N3CCCC3)cc2)c(C)n1 1765811043 RIZIJIHZTNTMTA-UHFFFAOYSA-N 435.620 4.430 10 10 IICE CCO[C@]1(c2nnc(N(C)CC(C)(C)C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1767384804 LLDGAKJUTJODHE-RUZDIDTESA-N 443.636 4.307 10 10 IICE CCS[C@H]1CC[C@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768371521 GGBKULSAFHRICP-BBTUJRGHSA-N 447.624 4.493 10 10 IICE COc1ccc(-c2ncccc2C(=O)N[C@H](c2ccc(N(C)C)cc2)c2nccn2C)cc1 1866165803 SQWKDMLORKGJEF-XMMPIXPASA-N 441.535 4.076 10 10 IICE CC(C)c1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCO[C@H](C)C2)n1 1868227994 IRWCGBFUYJKEAW-MRXNPFEDSA-N 442.519 4.344 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@@H]1NCc1ccc(Br)cc1O 2144131262 XKFICJIMDXIZEC-PKOBYXMFSA-N 433.346 4.435 10 10 IICE CC(C)Oc1cccc(C=C2SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)c1 2323866056 MNFHHQDMIUFQFN-GOSISDBHSA-N 427.547 4.371 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2ccccc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 15040166 PBCXQVCLTJEEAA-LGMDPLHJSA-N 427.507 4.215 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccccc3OC)=NC2=O)ccc1OCCC(=O)O 16920055 UVIGUUVEIITYMD-CPNJWEJPSA-N 442.493 4.030 10 10 IICE CCCOc1cc(N(CC)CC)ccc1/C=C1/C(=O)NN(c2cccc(Cl)c2)C1=O 96577933 AWQSTPNSCBBQMY-MOSHPQCFSA-N 427.932 4.436 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C/c3cc(Br)ccc3F)CC2)cc1 108427818 ORGBSJSPIINHTE-XCVCLJGOSA-N 433.321 4.349 10 10 IICE CC(C)CCOC1CCN(C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CC1 435548827 QWDRHFYHGXRJSV-UHFFFAOYSA-N 425.617 4.462 10 10 IICE CCn1cc(-c2nn(C)cc2C(=O)N2CCCc3cc(OCc4ccccc4)ccc32)cn1 488989571 VBCVAUDDWQXOKY-UHFFFAOYSA-N 441.535 4.476 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(N4CCSCC4)c(Cl)c3)CC2)cc1 748999123 FCOONKFUYHOXGH-UHFFFAOYSA-N 447.004 4.256 10 10 IICE Cc1noc(C)c1CO[C@@H]1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 762577835 XMAOAACBJRNTPN-JOCHJYFZSA-N 426.561 4.028 10 10 IICE COc1cccc(CNC(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)c1O 764223174 KNKYBASEWMJSOZ-UHFFFAOYSA-N 429.480 4.029 10 10 IICE Cc1ccc(-n2nnc([C@@H](C)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)c2C)cc1 773143659 BYLFPDYPIYXFEP-OAQYLSRUSA-N 444.627 4.267 10 10 IICE CCOc1ccc(-c2csc(NS(=O)(=O)c3cnccc3C(F)(F)F)n2)cc1 785542429 AZDFNNTXNXXBGS-UHFFFAOYSA-N 429.445 4.423 10 10 IICE O=S(=O)(NCCCSc1nccs1)c1cccc(Br)c1Cl 790197401 VWKVONADEYYNDO-UHFFFAOYSA-N 427.798 4.020 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N(CCC(F)(F)F)Cc1ccccc1 790220137 UEOVXRYHXPEVBM-UHFFFAOYSA-N 439.453 4.327 10 10 IICE COc1cc(Cl)c(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1OC 790477575 GISHLNDEXGSAOB-UHFFFAOYSA-N 428.894 4.421 10 10 IICE Cc1ccc(-n2nnc(CC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)c2C)cc1 919966852 UVJJIRSSKOZQEU-UHFFFAOYSA-N 443.551 4.315 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CCCc3cc(OC(F)(F)F)ccc32)C1 1124988785 UEMVJTFDTVCIIG-HNNXBMFYSA-N 426.435 4.478 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3csc(Cc4cccc(F)c4)n3)C2)cc1 1129991715 WDGUJXWAOCGGFM-QGZVFWFLSA-N 425.529 4.138 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2cccc(C)c2nc1Cl 1152401992 SMORDSQQXFGBLI-UHFFFAOYSA-N 433.291 4.371 10 10 IICE C[C@H](N[C@@H](CF)c1ccc(F)cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1197135206 IMJMKPNTDOSCSB-FPTDNZKUSA-N 434.442 4.229 10 10 IICE COC[C@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(Cl)cc1 1228558135 USJCQGFBCPMHLO-PZJWPPBQSA-N 432.948 4.166 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1 1230200823 MIGNFKLAVWFKNJ-KRWDZBQOSA-N 425.577 4.232 10 10 IICE Cc1cc(C(=O)NC[C@@H](Cc2ccc(F)cc2)C(N)=O)c(C)n1-c1ccc(C(C)C)cc1 1292140798 FDDUAVVSTPAPOB-OAQYLSRUSA-N 435.543 4.431 10 10 IICE Cc1cc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)ccc1N1CCOCC1=O 1304240783 ZOPLLFLRWSXAII-UHFFFAOYSA-N 445.519 4.139 10 10 IICE Cc1nnc(N(C)Cc2ccc(Br)o2)n1Cc1ccc2c(c1)CCCN2C 1304793385 WENWIUPJAXCRSP-UHFFFAOYSA-N 430.350 4.009 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CCO1 1305882342 AMAZTVLJNHUNEV-KBMIEXCESA-N 437.588 4.393 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCC1(C)C 1314389521 GXNNRAPAQODOMX-SFHVURJKSA-N 445.583 4.115 10 10 IICE COCCCOc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1C 1359865824 QXUPBEIIWHMCDN-UHFFFAOYSA-N 448.510 4.411 10 10 IICE Cc1cc(CC(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)c(C)n1-c1ccc(Cl)cc1 1435364917 WAFGZWZOYBURMG-QFIPXVFZSA-N 444.984 4.192 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@H](O)C(F)(F)F 1447085141 WMYCVCDQYKUMHL-CVEARBPZSA-N 433.268 4.288 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc2cccnc2c1O)c1ccc(F)cc1F 1451951048 BNBXISUXPIGOAV-IBGZPJMESA-N 443.450 4.101 10 10 IICE CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1458023925 YYNVLMNEXQXFQK-LPPUWEFUSA-N 441.660 4.312 10 10 IICE CC(C)N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccccc1F 1459377691 JXGWFDCFELPZRK-UHFFFAOYSA-N 430.479 4.450 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)ccc3C3CC3)CC2)c(OC)c1 1461977963 LJVXAWVAFUXKQR-UHFFFAOYSA-N 445.357 4.306 10 10 IICE Cc1cccc(C)c1OC[C@@H](O)CNC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1465907079 JJAMTLRVHPRWGR-QHCPKHFHSA-N 440.971 4.463 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCC[C@@H]3Cc3ccccc3F)C2)cc1 1470593210 LAUXTLJUFGEEIY-DENIHFKCSA-N 425.548 4.467 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3C[C@H]3c3ccc(Br)c(F)c3)C2)cc1 1478559778 VXIPBTNGAXYCRX-GZRFBZBPSA-N 448.336 4.031 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](F)C1 1494773813 SRWGUOQISMPOOO-YOJAFSQSSA-N 425.552 4.308 10 10 IICE COC1CCC(CCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CC1 1504462912 FMGPVANHXWSQFS-ZOGYUUGASA-N 428.577 4.457 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCOC(F)F 1512984502 OGQODPXHFTZIND-KRWDZBQOSA-N 437.535 4.146 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CCCCC2 1515519670 LDKODCYAYKRMLU-CQSZACIVSA-N 444.528 4.324 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)ncc2Br)cc1 1525918305 HISHNADLRYEZFX-UHFFFAOYSA-N 441.167 4.383 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc2c(s1)CN(C(=O)OC(C)(C)C)CC2 1539187602 DVXTULOEPWVFGC-UHFFFAOYSA-N 429.586 4.380 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cc1ccc(NC(=O)C(F)(F)F)cc1 1540543307 IDOUWXFSZHDQLB-UHFFFAOYSA-N 433.474 4.379 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1 1544884568 KSOVUQARAVXQQA-UHFFFAOYSA-N 444.004 4.390 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]3CCC[C@H]32)n1Cc1ccc(N(C)C)cc1C 1555658024 ZEYGEGBOOOLGAB-TXTKFYIRSA-N 441.620 4.194 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)CC(=O)N(C)[C@@H](C)c3ccccc3)c2C)cc1 1556316614 FIPCGYGBOYFUEP-IBGZPJMESA-N 433.552 4.394 10 10 IICE CCOCCOC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 1564649448 DCMWGSGQIXVPSZ-GOSISDBHSA-N 438.012 4.303 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)c2ccc(N=NC(N)=O)cc2)cc1 1566270882 JEYLDISRHWDFJI-AWEZNQCLSA-N 425.489 4.365 10 10 IICE Cc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)[nH]c2c1C(=O)CC(C)(C)C2 1566356347 CGJDDRYGBQFSDO-QGZVFWFLSA-N 443.975 4.232 10 10 IICE Cc1cc(C(=O)NCCNC(=O)c2cccs2)c(C)n1-c1ccc(Br)cc1 1596257260 WFTJCSKPQGZANX-UHFFFAOYSA-N 446.370 4.078 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)C(C)(C)C)CC2(C)C)cc1-n1c(C)cc(C=O)c1C 1623933492 RPDBPHWFKXMDGK-UHFFFAOYSA-N 437.584 4.324 10 10 IICE Cc1cccc(-c2nnc(S)n2CCC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1628951396 WMRTWYWAXYSYSO-UHFFFAOYSA-N 435.597 4.191 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@]2(c3ccccc3)CCN(C(=O)OC(C)(C)C)C2)c1 1630365690 DCTYQYQKOXCCBE-GKVSMKOHSA-N 440.540 4.157 10 10 IICE Cc1ccc(C2=NO[C@@H](CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2)cc1 1635004039 UWSNWMCPPJIWJE-XMMPIXPASA-N 429.520 4.067 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCNc2ncnc3ccc([N+](=O)[O-])cc23)c1 1635509968 MVCSQCPKPNFQEX-UHFFFAOYSA-N 444.495 4.096 10 10 IICE Cc1cc(C(=O)N[C@H](Cc2ccc(Cl)cc2)C(N)=O)c(C)n1-c1ccc(Cl)cc1 1636006040 RYHBWTLXPIAHDJ-HXUWFJFHSA-N 430.335 4.227 10 10 IICE Cc1cc(C(=O)N2CC[C@@](CO)(C(F)(F)F)C2)c(C)n1-c1ccccc1Br 1645047144 CXOAZRRLRUFUOM-GOSISDBHSA-N 445.279 4.244 10 10 IICE COC(=O)c1cc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)n(C)c1C 1681827196 BMWOMJIQYJFJAA-OAHLLOKOSA-N 446.979 4.009 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@](CO)(C(F)(F)F)C3)cc2Cl)C1 1682024386 RPGBDNORCCJSFZ-AUUYWEPGSA-N 433.902 4.033 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(CCN4CCCC[C@@H]4C)CC3)C2)cc1 1686854728 AOHGBOVRAXUWTD-JTHBVZDNSA-N 442.648 4.208 10 10 IICE CC(C)c1nnc(N(C)C[C@@H]2CC=CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1691677849 OUTRCEDTMGKCCX-LJQANCHMSA-N 427.568 4.218 10 10 IICE CC(C)Cc1nnc(N2CCOC3(CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1706431378 INXOMFCLQQSTJI-UHFFFAOYSA-N 429.584 4.270 10 10 IICE CCCN1CCCC[C@H]1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1728141918 FVSXXPSSBYZAFT-RBBKRZOGSA-N 427.593 4.126 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1CC1CCN(CC(F)(F)F)CC1 1747750169 NFLUBKRNPDLWMP-UHFFFAOYSA-N 439.526 4.192 10 10 IICE CO[C@@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1748426738 FSYPKCIFOALQEL-QHCPKHFHSA-N 436.604 4.191 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCOC1 1768104523 LNDPBDYTWXYPBT-NRFANRHFSA-N 437.588 4.252 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c(Br)c1 1912064240 GUFTVCVQXIEFBT-KDURUIRLSA-N 427.342 4.115 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(NCc2cc(Cl)cc(Br)c2O)C1 2033965972 DJPZQJXKATZNSV-KPZWWZAWSA-N 431.758 4.297 10 10 IICE Cc1ccc([C@@H](C)n2nc(C(C)(C)C)c(C(=O)O)c2I)c(O)c1 2079034479 NDSTUUFVVKQXPV-SNVBAGLBSA-N 428.270 4.107 10 10 IICE CN1CCc2cc([C@H](N)c3ccc(I)c(Br)c3)ccc21 2163125484 CPPCXSLPGAHZGW-INIZCTEOSA-N 443.126 4.094 10 10 IICE O=C1C(=Cc2ccc(I)o2)SC(=S)N1c1cccc(F)c1 2293772160 JBPMGHWANSIARB-UHFFFAOYSA-N 431.251 4.429 10 10 IICE O=C(O)CN1C(=O)C(=Cc2ccc(-c3cccc(OC(F)(F)F)c3)o2)SC1=S 2294821362 LGLKWETYECHCMM-UHFFFAOYSA-N 429.397 4.131 10 10 IICE COc1cccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C(=O)NC2=S)c1 2296169276 ARQDWFRSEHPSHJ-UHFFFAOYSA-N 449.507 4.073 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)cc1 2313559916 BJAAHMSVNAUBSI-UHFFFAOYSA-N 444.443 4.132 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(c3ccccc3C(=O)OC)C2=O)cc1OC 39861618 ICVVAECQEFNIDK-PDGQHHTCSA-N 429.519 4.286 10 10 IICE CN(C)c1ccc(CNC(=O)C2CCN(Cc3cn(C)c4ccc(Cl)cc34)CC2)cc1 65060096 QXIILDYQMDMTMC-UHFFFAOYSA-N 439.003 4.426 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)Cc2csc(-c3cccc(F)c3)n2)cc1 98080416 RLVLOHPYFBGQBV-UHFFFAOYSA-N 435.528 4.441 10 10 IICE COc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1NC(C)=O 435569915 LSYUQGWGNTWZES-UHFFFAOYSA-N 434.540 4.014 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H](Cc3noc(-c4ccncc4)n3)C2)cc1 581781637 FKZBFCUIJUIBLD-LJQANCHMSA-N 427.508 4.244 10 10 IICE Cc1cn2cc(NC(=O)CCCN3C(=O)/C(=C\c4cccs4)SC3=S)ccc2n1 726948488 VHXUFPYXSBKJKJ-MHWRWJLKSA-N 442.591 4.324 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC(Oc2ccc(F)cc2)CC1 734524910 DWXRWGDYFJXAKW-UHFFFAOYSA-N 429.561 4.132 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 735519003 NCEMLCLEDXQOQI-NRFANRHFSA-N 440.540 4.238 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@H]2CCN(C)[C@H](C)C2)sc(C)c1-c1ccccc1 741790127 CTDRERGNQPOQTH-APWZRJJASA-N 443.613 4.253 10 10 IICE COc1cccc(N2CC[C@H](CN[C@H](C)c3ccc(N4CCOCC4)cc3Cl)C2)c1 765638788 QJPIKTRMXYMBPQ-RTBURBONSA-N 429.992 4.362 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc(OC(F)F)cc1 768842429 LNCWHYBRVPKDEO-UHFFFAOYSA-N 430.499 4.142 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1OCC(F)F 768903488 OENPVLLCFGFQKZ-UHFFFAOYSA-N 444.526 4.184 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)N[C@@H](C)c1cc(OC)ccc1O 778290674 ZZBYCEPVSXCBMI-LBPRGKRZSA-N 439.306 4.071 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC[C@@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1O 779619613 HYZYXTGKTSUJTO-QGZVFWFLSA-N 436.487 4.089 10 10 IICE Cc1ccccc1-c1noc(C)c1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 793760596 PSKAJLGHJOAAAG-UHFFFAOYSA-N 444.579 4.420 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N[C@H]1CCOc2c(Br)cccc21 799933452 ONGFWEVRFVIBQJ-IBGZPJMESA-N 428.330 4.148 10 10 IICE CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NCc2cc(Br)ccc2O)c1 804971616 IMOZWBNXIIALFY-CYBMUJFWSA-N 434.334 4.139 10 10 IICE CN1CCN(c2ccc(CNc3ccc([C@@H]4C[C@H]4NC(=O)OC(C)(C)C)cc3)cc2)CC1 864042386 JQLBNCKXLVVRJJ-BJKOFHAPSA-N 436.600 4.431 10 10 IICE CN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccc(Cl)nc1 1128583619 FXMJVPNJYXVQMT-UVTDQMKNSA-N 437.999 4.441 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2csc3nc(-c4ccccc4)cn23)N(C)C)cc1 1134682060 RQYSOYFNIRXONH-HSZRJFAPSA-N 447.608 4.090 10 10 IICE C[C@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cnn(C)c1 1134751338 XYSWRACODBHYQZ-CYBMUJFWSA-N 439.317 4.025 10 10 IICE Cc1cc(C(=O)NCc2ccccc2[N+](=O)[O-])c(C)n1-c1ccc(Br)cn1 1136274190 SBZQVFRGQCNOPK-UHFFFAOYSA-N 429.274 4.090 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(F)c(F)cc1I 1137346586 DDEHCHOVVNCPFH-UHFFFAOYSA-N 431.220 4.327 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1n[nH]c2ccc(F)cc12 1143904119 FPFHNPCOMPGTRO-CXUHLZMHSA-N 444.488 4.071 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cc2ccccc2[nH]1 1157766573 KAGOITDVGVXNDT-ODLFYWEKSA-N 439.537 4.215 10 10 IICE CCN(CC)Cc1csc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)n1 1163769996 JWYLAZHOJPTNAH-UHFFFAOYSA-N 426.586 4.466 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CC(O)(c2ccc(Br)cc2)C1 1167030498 QSUBDVODJWETDP-UHFFFAOYSA-N 431.355 4.262 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCCN(C(=O)OC(C)(C)C)c3ccccc32)cc1 1167684422 GHVQLBGHEUKSRN-UHFFFAOYSA-N 438.572 4.021 10 10 IICE COC(=O)c1coc(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1169002343 LOLNSWDFFZILPE-UHFFFAOYSA-N 431.286 4.166 10 10 IICE COc1ccc(N(CCc2ccccc2)Cc2ccc(S(=O)(=O)N3CCCC3)o2)cc1 1191892558 YIFYEEGZOANZKQ-UHFFFAOYSA-N 440.565 4.322 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)cc1 1195791185 YOWKVAARBMIDOW-QHCPKHFHSA-N 429.580 4.496 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H]3C[C@@H](OCc4ccccc4)C3(C)C)C2)cc1 1235188391 WYSJGZKRPIGLEI-FGCOXFRFSA-N 437.584 4.205 10 10 IICE CCN(C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)[C@@H](C)Cc1ccc(OC)cc1 1251501084 NHUASMCHSBEYSR-YADARESESA-N 426.605 4.027 10 10 IICE Cc1ccc(-c2nnc(N3CCC(NC(C)C)CC3)n2Cc2ccc(N(C)C)c(F)c2)o1 1289577800 VCCZPBGKQCWBGV-UHFFFAOYSA-N 440.567 4.067 10 10 IICE Cc1csc(CN(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)c1 1290337127 QVBNUJQDALLYQM-IBGZPJMESA-N 425.602 4.211 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1291102869 UVBZEUAXLYGNRU-LJQANCHMSA-N 434.588 4.193 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)OCc1cccc(C)c1 1297228148 BLTDXUNMRFABCZ-IBGZPJMESA-N 426.557 4.289 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-c2nc(C)no2)cc1 1297228486 KFBGKKMCNQAIQJ-UHFFFAOYSA-N 436.512 4.047 10 10 IICE CN(Cc1ccc(S(=O)(=O)N2CCCC2)o1)c1ccc(OCc2ccccc2)cc1 1307688477 JULBXXJFXGZDKF-UHFFFAOYSA-N 426.538 4.280 10 10 IICE COC(=O)[C@@H]1CN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C[C@@H]1c1ccccc1 1313100425 KZAOAOPXNHXXFD-JWQCQUIFSA-N 445.563 4.235 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H](c1ccc(F)cc1F)c1nccn1C 1313393375 XSYIQHZIJQEPDV-QFIPXVFZSA-N 439.510 4.230 10 10 IICE CON(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1316314362 UBFVEYBTHYUTAJ-FGZHOGPDSA-N 441.620 4.479 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(C(=O)OC(C)(C)C)c3)cc2F)C[C@H](C)O1 1350934102 YFCFHZHHWZQHDP-IRXDYDNUSA-N 442.531 4.325 10 10 IICE Cc1cc(CC(=O)N[C@H](Cc2ccc(Cl)cc2)C(N)=O)c(C)n1-c1ccc(Cl)cc1 1436169433 ZJCNLUWGICQWEI-OAQYLSRUSA-N 444.362 4.156 10 10 IICE O=C(CCc1ccc(Cl)cc1Cl)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436623631 FONQYVXQOCVIJW-UHFFFAOYSA-N 429.294 4.357 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccccc3-c3ccccc3C)CC2)cc1 1442475769 SDUCIXJBYARYPL-UHFFFAOYSA-N 429.564 4.223 10 10 IICE Cc1ccc2c(c1)CCN(C(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)C2 1461030094 LHAWEINALIQWMD-DEDYPNTBSA-N 440.565 4.310 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(C)n(-c3cc(C)cc(C)c3)c1C)C[C@@H]2O 1464040175 GHTJQEVWDFABGY-QFIPXVFZSA-N 434.536 4.418 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 1466289717 DPQUEJDGLVGTPU-VWLOTQADSA-N 446.547 4.363 10 10 IICE CC[C@@H](C)Oc1ccccc1/C=C/C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1466398937 VAEAPKMKGPBYIP-ONOODXEBSA-N 431.916 4.438 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(CCc3ccccn3)Cc3ccc(F)cc3)C2)cc1 1470771316 CRHUMDMWWIXOAP-QHCPKHFHSA-N 448.542 4.263 10 10 IICE CC(C)c1ncc(CN(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)cn1 1508902683 XQLCJMUWBAUXHE-UHFFFAOYSA-N 439.583 4.379 10 10 IICE C[C@@H](NC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1)c1ccc(N(C)C)cc1 1517377713 XWIZMDIHNYRLAH-FIOICXDGSA-N 444.564 4.343 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1Cc2cc(F)ccc2N(C(=O)/C=C\c2cncc(F)c2)C1 1538219171 WNSZEMJCTWZABO-HQQUCIOCSA-N 429.467 4.103 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1 1542403083 JJNLCDVLIRREKG-IBGZPJMESA-N 431.536 4.234 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1544010917 AMQQMGZRWSOPDT-PGRDOPGGSA-N 437.584 4.372 10 10 IICE C[C@H](NC(=O)c1cc2cccc(C(F)(F)F)c2nc1O)c1ccc(N2CCOCC2)cc1 1544214615 BROLCWIELMSRDX-AWEZNQCLSA-N 445.441 4.287 10 10 IICE Nc1c(Cl)cc(Cl)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632277 HFAFHYXFKRORDF-CQSZACIVSA-N 428.747 4.329 10 10 IICE C[C@@H](O)c1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1F 1556525224 KLSABNFOJONMCE-SGEFVQMOSA-N 448.516 4.248 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3ccccc3Cc3ccccc3)CC2)cc1 1559666965 FZNKJXYYRXAENM-UHFFFAOYSA-N 429.564 4.437 10 10 IICE COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559698130 QKALLVIGFUUMLS-CVEARBPZSA-N 428.488 4.148 10 10 IICE Cc1ccc(-c2cnc(CCC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)o2)cc1 1596683454 BWKHXVRCKGGJEN-UHFFFAOYSA-N 441.478 4.014 10 10 IICE CC(C)c1ncc(CN(C)c2nnc(C(C)C)n2Cc2ccc3c(c2)CCCN3C)cn1 1598357467 KJVWUCPUSDHHPT-UHFFFAOYSA-N 433.604 4.382 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCCN1C(=O)C(F)(F)F 1612528772 KMJMWJXYYFKTHK-INIZCTEOSA-N 435.402 4.181 10 10 IICE COC(=O)C1=C(CSc2ncc(C(C)(C)C)s2)N(C)C(=O)N[C@H]1c1ccccc1 1613617233 HNCNNJYNANWXKA-KRWDZBQOSA-N 431.583 4.356 10 10 IICE CCc1nc(Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)cs1 1613886086 DCMBVTMUEFZGML-UHFFFAOYSA-N 440.617 4.194 10 10 IICE COc1cc(OC)cc(C2(F)CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)c1 1626097504 YARIYBGAMOMIBP-UHFFFAOYSA-N 431.485 4.431 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CN(Cc2ccccc2)C[C@]1(C)c1ccccc1 1633820040 ZTQLYUCDLABLRM-ZQSLEGLSSA-N 444.575 4.235 10 10 IICE Cn1c(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc2cc(Br)cnc21 1637133315 DOQPEEBCMQJIRW-UHFFFAOYSA-N 429.101 4.278 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CNC(C)(C)CCc3ccccc3)cc2F)C[C@@H](C)O1 1641707272 HTCWCKGIXHYHCT-WOJBJXKFSA-N 441.591 4.057 10 10 IICE C[C@H](NC(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1O)c1ccccc1O 1643745364 MLVGAGRAVZFWBL-ZDUSSCGKSA-N 446.912 4.043 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3CCC3CCCC3)cc2F)C[C@@H](C)O1 1644947624 XSSUUGQFKZBHPZ-TXTKFYIRSA-N 445.623 4.490 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cccnc1C1CC1 1647141755 VAUVVILUXXSWOZ-ATVHPVEESA-N 427.526 4.328 10 10 IICE COC(=O)c1cc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)on1 1654252802 BYBFACYEHNVTFT-INIZCTEOSA-N 447.413 4.387 10 10 IICE CC(C)Cc1nnc(N2CCCO[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1692195971 CCRFAPSBNMBYKP-OAQYLSRUSA-N 425.621 4.376 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc([C@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1694800031 KUNIAVVVGKTSJV-LQBOVUBWSA-N 429.609 4.050 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCSC(C)C)CC2)cc1 1697470407 GAOMGQGBQZHCSX-UHFFFAOYSA-N 431.650 4.443 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccccc3O)n2CCc2sccc2C)n1 1707817406 ZMSKJNGVQKAXPQ-UHFFFAOYSA-N 436.585 4.094 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H]([C@H]3CCCO3)C2)n1Cc1ccc(N(CC)CC)cc1 1708559984 RCMLGSUGLCIBRR-PMOQBDJRSA-N 441.620 4.070 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(N)=O)C1 1723045355 UCNAYPSCEWJNFU-HXUWFJFHSA-N 432.572 4.021 10 10 IICE CCO[C@]1(c2nnc(N3CCC[C@@H](C)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1746714890 LZADUKCCYVIYED-CJFMBICVSA-N 441.620 4.061 10 10 IICE C[C@@H]1CCC[C@@](Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752088514 ZSCVIEYXPCLXAY-KBMIEXCESA-N 434.588 4.193 10 10 IICE CCC[C@H](C)N(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1765531957 RLLXPIOHFKLBIN-IBGZPJMESA-N 439.629 4.440 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccc(F)c([N+](=O)[O-])c3)sc2C)cc1C 1859481342 NPIORJJTZXMDFM-UHFFFAOYSA-N 437.474 4.284 10 10 IICE COCCN1C(=O)C(NC2CCCCCC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873168138 KDNYKYUBHQHIPD-UHFFFAOYSA-N 435.568 4.133 10 10 IICE Oc1ccc(Br)cc1CN[C@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156285019 PIBWBRJYFZSFPQ-HXUWFJFHSA-N 431.374 4.068 10 10 IICE Cc1c(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3Cl)C2=O)c2ccccc2n1C 2294095504 UGEHHLSPONDJSU-UHFFFAOYSA-N 428.275 4.460 10 10 IICE CC(=O)N1CCN(C2=NC(=O)C(=Cc3ccc(-c4cccc(C(F)(F)F)c4)o3)S2)CC1 2296767801 AZHUARHLUJEDRI-UHFFFAOYSA-N 449.454 4.100 10 10 IICE COc1ccc(N2C(=O)C(=Cc3c(C(=O)O)[nH]c4cc(OC)ccc34)SC2=S)cc1 2297500961 WWMGNOSCABLJDA-UHFFFAOYSA-N 440.502 4.289 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(c2cccc(C(=O)O)c2)C1=O)C(=O)O 2314927332 DFDOXHFMGMFJFV-OAHLLOKOSA-N 443.502 4.033 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(C3CCCCC3)C2=O)cc1OC)C(=O)O 2314931317 FAGQIWNALZJKMA-HNNXBMFYSA-N 435.567 4.471 10 10 IICE Oc1c(F)cc(Br)cc1CNCCC12CC(I)(C1)C2 2353104505 JQDLKIXJLJZDET-UHFFFAOYSA-N 440.094 4.131 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](NC(=O)OC(C)(C)C)C2CCC2)c(O)c1Br 2380724212 YPLQRJXVWUAAQA-OAHLLOKOSA-N 441.366 4.163 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCCC1 13639852 JKOMCCPTKZDSGT-AXHZCLLHSA-N 440.565 4.489 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)cc1OC 14479315 RDMVAJCVARHDFH-GLDPYIMESA-N 440.565 4.315 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CCCN(c3nccnc3Sc3ccccc3)C2)cc1 33168872 UVKDVJJWDGYVHF-HXUWFJFHSA-N 447.608 4.227 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S)Nc1cccc2nonc12 33584081 UFJQBGIBSIEBLS-XNTDXEJSSA-N 444.925 4.106 10 10 IICE CCOC(=O)CCCCCN1C(=O)/C(=C/c2ccc(OC)c(OCC)c2)SC1=S 40928441 NCUDEBQWZZKRSQ-JXAWBTAJSA-N 437.583 4.419 10 10 IICE COC[C@@H](C)Nc1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 437616845 WVNLUHKYDGMQHU-LJQANCHMSA-N 434.584 4.493 10 10 IICE COc1ccc2c(c1)CCN2C(=O)Cc1ccccc1C(=O)N1CCc2cc(OC)ccc21 680845187 XGXPMDXIPLUBDX-UHFFFAOYSA-N 442.515 4.039 10 10 IICE COc1ccc([C@H](C)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1F 726609971 FMUXPXVGSAHTTR-AWEZNQCLSA-N 437.462 4.465 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N[C@@H](c3ccccc3)c3ccncc3)cc2F)C[C@@H](C)O1 728596158 AULHVIDEYDGJHF-CEYNDMKZSA-N 448.542 4.423 10 10 IICE CCc1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)nn1-c1ccccc1 735547177 GFOMLGDLAZRNEB-UHFFFAOYSA-N 446.482 4.416 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN(Cc2ccoc2)C2CCCCC2)c1 742156051 VUSIIIOIPOBTSP-UHFFFAOYSA-N 426.557 4.355 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccccc3Cn3ccnc3)sc2C)cc1 759478124 RNLDLXFUCSCSCF-UHFFFAOYSA-N 440.550 4.173 10 10 IICE O=C(CCC(=O)Nc1nnc(C2CCCCC2)s1)NCc1c(O)ccc2c1CCCC2 787450079 PTYHZPZJNNIUKW-UHFFFAOYSA-N 442.585 4.205 10 10 IICE Cc1nn(C)c(Cl)c1Cc1noc(Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n1 809488804 PAWWKADFWPEQBW-UHFFFAOYSA-N 438.963 4.125 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)c1C 918134793 RYLZHOUQHYLVIA-KRWDZBQOSA-N 425.554 4.265 10 10 IICE C[C@@H](NC(=O)c1cccc2nc(O)n(CC(C)(C)C)c12)c1ccc(N2CCOCC2)cc1 1125518898 NOKBORHKEIBKSH-QGZVFWFLSA-N 436.556 4.116 10 10 IICE O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)O1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126583841 UUBDZKWYWUXVAI-COXVUDFISA-N 436.421 4.263 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3c[nH]c4cc(Br)ccc34)C2)cc1 1129990640 FAQYLIYNAAZSCH-OAHLLOKOSA-N 442.357 4.124 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2C[C@H](S(=O)(=O)c3ccccc3)C2)c1 1132707119 JNHCGZMDFPKUSX-IRJFHVNHSA-N 442.968 4.482 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc2c(s1)CC[C@@H](C(C)(C)C)C2 1138053244 CHQSGUDHJHTVMY-SJORKVTESA-N 445.581 4.215 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2COC(=O)N2CCCC2)c(C)n1-c1ccc(F)cc1 1140284273 BVLHHBKSGLKQGJ-NRFANRHFSA-N 427.520 4.460 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)c(C)n1-c1ccc(F)cc1 1146855517 WDMRXCVRAWOTQQ-HXUWFJFHSA-N 425.891 4.422 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 1154026595 NPQUJMXLVJLKHN-YSHGAJCASA-N 432.561 4.103 10 10 IICE Cc1noc(C[C@@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c2ccccc2)n1 1154185042 ALHYODXPQAGCNV-HSZRJFAPSA-N 428.492 4.312 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)c1C 1154248650 CBSPXSPZTZQMPO-UHFFFAOYSA-N 430.957 4.389 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnc4ccc(Cl)cc4c3=O)c2C)cc1 1166376353 BYVXUHXUZAVXNB-UHFFFAOYSA-N 436.899 4.134 10 10 IICE COc1ccc(N2CCN(Cc3ccc(Cl)c(Br)c3)CC2)c(OC)c1 1175524038 SQWIQDDUCAFVKL-UHFFFAOYSA-N 425.754 4.442 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCc4cc(C)c(Br)cc4C3)C2)cc1 1252924853 VPKKEPFZFXUHBQ-GOSISDBHSA-N 444.373 4.113 10 10 IICE CCn1c([C@H]2CCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)nc2ccccc21 1256231659 AJCIXVMDDAGZTP-RPWUZVMVSA-N 448.615 4.272 10 10 IICE COC(=O)[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)Cc1cccc(C)c1 1293146633 WLZFOJWGIJLIAY-QHCPKHFHSA-N 446.547 4.285 10 10 IICE CCCc1c(C(=O)N(CC)Cc2cc(Br)ccc2O)[nH]c(C)c1C(=O)OC 1294686207 VPLHTNUJKHVKFC-UHFFFAOYSA-N 437.334 4.193 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3sc(SC(F)(F)F)nc3C)CC2)cc1F 1294822860 AFSQRWUIEJPIRO-UHFFFAOYSA-N 449.495 4.102 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(NCc4nc(C)cs4)c3)CC2)cc1 1295275439 SLQGDLUUHRJJNS-UHFFFAOYSA-N 436.581 4.425 10 10 IICE CCN1C[C@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)cc2C)C[C@H]1C 1295977421 OOZHUHOXOUCRPE-MOPGFXCFSA-N 436.604 4.188 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C(C)(C)CC(=O)OC)sc(C)c1-c1ccccc1 1307604592 VWKLKPKYWKEMIB-UHFFFAOYSA-N 446.569 4.112 10 10 IICE COc1cccc(CNC(=O)NCCCCCC2CCN(C(=O)OC(C)(C)C)CC2)c1O 1313273958 AFOPFDPMEPAPLV-UHFFFAOYSA-N 449.592 4.408 10 10 IICE COC(=O)[C@@H]1O[C@@H](C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)C[C@H]1C 1352514668 FDNDVMQKZYXHBS-VVFCZOMOSA-N 445.537 4.194 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 1352893327 ZCMZKAFFIWCLNY-PMACEKPBSA-N 431.439 4.085 10 10 IICE CCc1nc(C(=O)NCc2ccc(N(C)C)cc2C)nn1-c1c(Cl)cccc1Cl 1353247320 YCPICBUGDWJKBD-UHFFFAOYSA-N 432.355 4.441 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(CN2C(=O)CCCC2=O)cc1 1447428750 SFJQSPLIGJLAEA-UHFFFAOYSA-N 443.503 4.198 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(F)c(NC(=O)OC)c1 1448685337 LGEPVFYKNIBEFC-UHFFFAOYSA-N 445.491 4.006 10 10 IICE CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)NCc1cc(Cl)ccc1O 1452946332 NMQRLLVFZHFHKT-ZDUSSCGKSA-N 427.975 4.026 10 10 IICE Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@@H](O)COc1cc(Cl)cc(Cl)c1 1459739244 IHJNTWHIRROLIW-MOPGFXCFSA-N 426.340 4.120 10 10 IICE CC(C)[C@@H](Cc1ccccc1)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1460774188 GZDVZHCEKPGZIC-HSZRJFAPSA-N 426.516 4.257 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 1461339357 VGAMSYDXTQXFEN-QHCPKHFHSA-N 449.517 4.044 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CCN(C)C)c3cccnc3)cc2Cl)C1 1469960606 QMZPVOLRUYKXFT-AVRDEDQJSA-N 444.023 4.464 10 10 IICE CCC[C@@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1=O 1472979166 NBUKNUQRKHHLKC-OAQYLSRUSA-N 446.345 4.150 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H]3c3ccc(Br)cc3)C2)cc1 1478861306 XWCBUDQFHGAYAS-IIBYNOLFSA-N 444.373 4.441 10 10 IICE CCOCc1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1503028165 AONUXPDKUIYBKE-MOPGFXCFSA-N 429.634 4.041 10 10 IICE COC1(C)CN(c2nnc(COc3ccc(C)cc3)n2CCCSc2nccs2)C1 1504041412 GRZQFVMVMQZUJH-UHFFFAOYSA-N 445.614 4.030 10 10 IICE Cc1cccc(CN(C)c2nnc(C(=O)NC(C)C)n2CCCSc2nccs2)c1 1510617708 GMXYBCAEQFMFNT-UHFFFAOYSA-N 444.630 4.000 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1[C@H]1CCC[C@H](C(F)(F)F)C1 1517143216 YHKUUVOTEVRQQN-IRXDYDNUSA-N 434.466 4.314 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nn1-c1ccc(F)cc1 1531503836 NBELZIZIQUWFPM-QGZVFWFLSA-N 444.457 4.320 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cccc(CN(C)Cc4ccccc4)c3)C2)cc1 1538747067 OUTGXKJOXVDYPG-DEOSSOPVSA-N 429.564 4.336 10 10 IICE C[C@H](Oc1ccccc1F)c1nnc(N2CCOCC2)n1CCCSc1nccs1 1541987137 UACXVAPRWHRAEY-HNNXBMFYSA-N 449.577 4.033 10 10 IICE O=C(Cc1c[nH]c2ccc(Br)cc12)N(Cc1ccccc1O)C[C@@H]1CCCO1 1546033913 JHZVNUHYHDXIPM-SFHVURJKSA-N 443.341 4.386 10 10 IICE Cc1c(Br)cccc1CCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1565329759 AWZDVIGMTQQMMK-IBGZPJMESA-N 447.373 4.396 10 10 IICE Cc1cc(C(=O)N(C)Cc2noc(C3CC3)n2)c(C)n1-c1cccc(Br)c1 1570315325 WGFAAHUSBDSGQV-UHFFFAOYSA-N 429.318 4.389 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(Br)cc4cccnc34)C2)cc1 1585664417 BEHBAVUZNWEZKL-HNNXBMFYSA-N 440.341 4.262 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1 1587460322 VFNWHMWMHPLMMC-YLJYHZDGSA-N 433.593 4.252 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CCC3(CCOCC3)CO2)c(C)n1-c1ccc(Cl)cc1 1610914997 VLMWHSIRKJSSLU-QFIPXVFZSA-N 430.976 4.382 10 10 IICE C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F)c1ccc(N(C)C)cc1 1616834633 KUIPNUNRTGEAJF-XOBRGWDASA-N 433.499 4.474 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@]1(c2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1623573847 GMYJHRDYBPZSIS-RUZDIDTESA-N 445.556 4.073 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCCN(Cc2ccc(F)cc2)CC1 1623845636 MWROCLCCDNGNMZ-UHFFFAOYSA-N 433.527 4.394 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 1624554468 YDKSZPLBGBWDNM-IBGZPJMESA-N 425.960 4.342 10 10 IICE CCOC(=O)c1n[nH]c(-c2cccc(CNC(=O)c3sccc3-n3c(C)ccc3C)c2)n1 1626572605 YJHMFJNMICRCER-UHFFFAOYSA-N 449.536 4.047 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Br)c(C)c1F 1632701545 HBFOJEOLOAWDBC-UHFFFAOYSA-N 444.684 4.071 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCCCOc2ncc(C(F)(F)F)cc2Cl)cc1 1633421679 CZCMREMWELEFLE-UHFFFAOYSA-N 429.786 4.115 10 10 IICE CN(C(=O)c1c[nH]nc1[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(Br)cc1 1635497233 WVLJIEAYHXQAKZ-CYBMUJFWSA-N 449.349 4.173 10 10 IICE COC(=O)[C@H](COC1CCC1)N(C)C(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1636221305 XWSQVYDMQSTJCJ-QHCPKHFHSA-N 426.557 4.400 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cncc(-c4ccc(OC)cc4C)c3)CC2)cc1 1636707018 QLJJHYUQIBIGEU-UHFFFAOYSA-N 431.536 4.427 10 10 IICE CN(Cc1ccccc1OC(F)(F)F)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1638917850 LXEYSSKDNRIXLP-IBGZPJMESA-N 438.494 4.096 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(Cc3nc(C(C)C)n[nH]3)CC2)cc1 1640614200 NBNHMMINGCXQLC-UHFFFAOYSA-N 447.583 4.172 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)cc1 1643685040 QHEMWYBHYKEQTP-UHFFFAOYSA-N 449.599 4.185 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](c3ccccc3)C3CCC3)cc2F)C[C@@H](C)O1 1644930819 VCQABFUCIFDHDA-LJKQEARRSA-N 439.575 4.187 10 10 IICE Cc1ccc(C(=O)NCc2ccc(F)nc2Br)cc1-n1c(C)cc(C=O)c1C 1646373148 RGVJAAJNYFPXQW-UHFFFAOYSA-N 444.304 4.442 10 10 IICE C[C@H](NC(=O)N1CCCC[C@H]1COC(=O)N1CCC[C@@H](C)C1)c1ccc(N(C)C)cc1 1681552638 QWOGXMPNBNSPSN-DXIQSLLYSA-N 430.593 4.246 10 10 IICE COc1ccc([C@H](NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c2ccco2)cc1 1683392918 IRHNEYAHHZYUSG-UPVQGACJSA-N 436.556 4.046 10 10 IICE CC(C)c1nnc(N2CCN(CCC(C)(C)C)CC2)n1Cc1ccc2c(c1)CCCN2C 1706319165 RRPLIAUKLUHYEP-UHFFFAOYSA-N 438.664 4.390 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H](C(F)F)C1 1724235439 KYLZUCKZGZUPLC-QUCCMNQESA-N 433.547 4.424 10 10 IICE CC(C)(C)c1nnc(N2CCOC[C@H](C3CCC3)C2)n1CCCSc1nccs1 1741175034 UAJCSDJTBFBCOH-QGZVFWFLSA-N 435.663 4.467 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1OCC[C@H]1C 1768105139 OSVPUUKZIKYZAR-WZONZLPQSA-N 437.588 4.250 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC[C@H]3CCCO3)C(=O)N(C3CCCCC3)C2=O)cc1 1873166368 NHPDDBKSDGORQK-HSZRJFAPSA-N 447.579 4.275 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)C2(CO)CCC2)c(Br)c1 1915769824 KBLPYDDHLRQPHZ-UHFFFAOYSA-N 433.390 4.107 10 10 IICE COc1ccc([C@H](n2nc(C(F)F)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2079857177 YGLMLEJOTZOGJG-ZDUSSCGKSA-N 432.265 4.032 10 10 IICE COc1ccc(Br)c(CNC2([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1O 2236049803 WKAQLIYIKIGLFW-ZDUSSCGKSA-N 441.366 4.043 10 10 IICE COc1ccc(C=CC(=O)NCc2ccc(C(=O)Nc3cccc(N(C)C)c3)cc2)cc1 2318715230 DFQQXWOOGJZXHV-UHFFFAOYSA-N 429.520 4.343 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@@H]32)ccc1O 14459037 VYITUVMZDWJWNS-JXQFQVJHSA-N 440.565 4.402 10 10 IICE CCCC1=NN2C(=N)/C(=C\c3ccc(-c4ccc(OC)cc4[N+](=O)[O-])o3)C(=O)N=C2S1 20238693 YOLLFRWZEYCNPG-AZYSWTJUSA-N 439.453 4.283 10 10 IICE O=C(O)C[C@@H]1c2cc(O)c(O)cc2CCN1C(=O)OCC1c2ccccc2-c2ccccc21 44197850 GAROZOSQBNFMNR-JOCHJYFZSA-N 445.471 4.421 10 10 IICE O=C(Oc1ccc(/C=C2/SC(=S)N(C[C@H]3CCCO3)C2=O)cc1)c1cccs1 102630338 PPJKERXDELZNHS-QAEAHILHSA-N 431.560 4.348 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 250531382 LIVRQJJFONDDEK-ROMRWMGNSA-N 435.549 4.015 10 10 IICE Cc1cc(C(=O)COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c(C)n1-c1ccccc1 745246023 LTSPTXJZBAPEEE-UHFFFAOYSA-N 444.531 4.372 10 10 IICE C[C@@H](Nc1cnn(CC(=O)NC2CCCC2)c1)c1cc(Br)cc(Cl)c1O 756867453 KHTJMADLUSEKOB-LLVKDONJSA-N 441.757 4.237 10 10 IICE Cc1nc(-c2ccccc2NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)no1 766407725 MUGPSUONYCXITD-UHFFFAOYSA-N 429.524 4.405 10 10 IICE C[C@@H](NCc1ncn(Cc2cccc(F)c2)n1)c1cc(Br)cc(Cl)c1O 783312209 DBNGDTPFJAQFQX-LLVKDONJSA-N 439.716 4.438 10 10 IICE O=C(COC(=O)c1cnc(OCC2CC2)cn1)Nc1ccc(N=Nc2ccccc2)cc1 792842300 KWCXUOOMAPOHIR-UHFFFAOYSA-N 431.452 4.476 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cccs3)cs2)c(F)cc1Cl 795544075 DDJUKLAMPCRASO-UHFFFAOYSA-N 432.907 4.252 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 802005580 NXJKNMCXZBCABE-IBGZPJMESA-N 443.485 4.051 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC1CCC(F)(F)CC1 1128338442 ONYLRWHCPLAFGP-LFIBNONCSA-N 442.528 4.359 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(OC(F)F)cc1F 1139590599 XFNZJYMHLQSHJP-UHFFFAOYSA-N 438.446 4.429 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2Cl)C1 1155726270 FGCWZIMHRXMSDK-KNQAVFIVSA-N 441.019 4.500 10 10 IICE Cc1ccc(C(=O)Nc2ccc(F)c(S(C)(=O)=O)c2)cc1-n1c(C)cc(C=O)c1C 1158049353 UPEIWDMPAAUKHR-UHFFFAOYSA-N 428.485 4.010 10 10 IICE Cn1nc2cc(Br)ccc2c1C(=O)NCc1cc(Cl)cc(Cl)c1O 1160599915 OXDMNPKELKEUFK-UHFFFAOYSA-N 429.101 4.278 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(CCc4ccccc4)ccc3O)C2)cc1 1162717872 BXQMEAGQOORFDP-QFIPXVFZSA-N 430.548 4.442 10 10 IICE COC(=O)[C@](C)(Cc1ccc(Cl)cc1)NCc1ccc(N2CCC(OC)CC2)cc1 1175015969 MEHWOHPWATVEIN-DEOSSOPVSA-N 430.976 4.219 10 10 IICE CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1c(F)cccc1F 1190729409 ASQIQPOTTUKYAA-UHFFFAOYSA-N 434.442 4.201 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)COCCO1)C(C)C 1295151909 KXFADNLVSHPUAP-VWLOTQADSA-N 437.588 4.393 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1ccc(I)c(Cl)c1 1299725220 KPVPDWNJFXBAIJ-UHFFFAOYSA-N 438.652 4.128 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@](C)(O)c1ccsc1 1306078340 QQPIJDNRJASNIN-QHCPKHFHSA-N 425.602 4.046 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 1312527440 FRZHYBPCJRSEFJ-DFQSSKMNSA-N 432.609 4.127 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2ccncc2OCCC(C)(C)C)cc1 1312814655 WCBLMWQQENZPIW-UHFFFAOYSA-N 428.577 4.183 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CC3(C)C)CC2)cc1F 1315513636 XYTXUCPTBNOULI-KRWDZBQOSA-N 429.584 4.387 10 10 IICE Cn1ccnc1[C@H](NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1Cl 1326553698 TWYWHSRVZGLQMO-JOCHJYFZSA-N 428.939 4.053 10 10 IICE C[C@H](NC(=O)C(C)(C)Oc1ccc(Br)cc1)c1ccc(N2CCOCC2)cc1 1357928766 QHCXLBQDLDYFQB-INIZCTEOSA-N 447.373 4.321 10 10 IICE CCOc1ccc(C(C)(C)C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1OCC 1436973540 WVCAMKYHLPMOAD-IBGZPJMESA-N 440.584 4.413 10 10 IICE CC(C)(C)OC(=O)N1CCOC[C@@H]1C[C@@H]1CN(C(=O)/C=C\c2cccnc2)c2ccccc21 1439584660 KOLUYKQKHKAXOT-KGQOZSFESA-N 449.551 4.251 10 10 IICE C[C@@H](C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C(=O)OC(C)(C)C 1439869920 BHZQBDARRHCLLR-LBPRGKRZSA-N 445.317 4.075 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4c(F)cc(Br)cc4[nH]3)CC2)cc1 1446418529 XUBYJOJVSDOJGW-UHFFFAOYSA-N 446.320 4.431 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)NCc3cc(Cl)cc(Cl)c3O)c2)n1 1450722533 RLIXTBJSQBSPAC-UHFFFAOYSA-N 433.295 4.485 10 10 IICE Cc1ccc(O[C@@H](C)C(=O)N2CCN(Cc3ccc(N(C)C)c(C)c3)CC2)c(Cl)c1 1459639843 SKIXKPRHAOXBKE-IBGZPJMESA-N 429.992 4.135 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccccc3CN3CCOCC3)c2C)c1 1463718053 LNJITLBMTBRNOC-UHFFFAOYSA-N 431.580 4.473 10 10 IICE COc1ncc(Br)cc1CNC(=O)NCc1cc(C)n(-c2ccccc2)c1C 1470829703 FVPZGWXMDICNRY-UHFFFAOYSA-N 443.345 4.260 10 10 IICE CCOC(=O)c1ccc(N2CCCN(Cc3ccc(N4CCCCC4)c(C)c3)CC2)nc1 1473266805 CPJNMSNPKQFMSN-UHFFFAOYSA-N 436.600 4.269 10 10 IICE CCS(=O)(=O)c1ccc(CNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1478531643 DBYWFFRMJKBZDA-UHFFFAOYSA-N 439.581 4.196 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(OC(F)F)cc(OC(F)F)c2)cc1 1527596284 UFEIYXFDJXDMAX-UHFFFAOYSA-N 430.398 4.106 10 10 IICE CSc1cc(Br)ccc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1539707743 SGOCIXASMJUKBU-GOSISDBHSA-N 436.419 4.270 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCCS(=O)(=O)Cc3ccccc3)c2C)c1 1540776076 NJBMKTOBTAJXIC-UHFFFAOYSA-N 438.593 4.446 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1ccc(I)c(Cl)c1 1543806016 RKCSUBNHPOHIGV-UHFFFAOYSA-N 434.020 4.387 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(N3CCNC(=O)C3)c(Cl)c2)c1C 1543847607 XSTDTPLYPUJYNJ-UHFFFAOYSA-N 436.943 4.244 10 10 IICE C[C@@H]1CCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C[C@@H]1C 1544425882 HPTLNJDQHPGDAI-SJORKVTESA-N 428.631 4.385 10 10 IICE Cc1cccc(-c2nc(C)c(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)[nH]2)c1 1544676438 KDLJYSFDRXFHKP-CALCHBBNSA-N 436.531 4.376 10 10 IICE CC[C@@H](C)c1nnc(N2CCC([C@@H]3CCCO3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545416099 WDBVRFBFMUZRJL-VGSWGCGISA-N 429.584 4.440 10 10 IICE CCCCN(C)CCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1547008730 OLQFXDCSZPYFFT-UHFFFAOYSA-N 442.652 4.033 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)C[C@H]2CC=CCC2)cc1F 1552833331 PHCXHEFQUOMMLH-AZUAARDMSA-N 427.568 4.218 10 10 IICE CS[C@@H]1CCCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1555885812 PGKYAULXCYGXQP-JOCHJYFZSA-N 443.661 4.083 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3cc(F)c(Br)cc32)c(C)n1-c1ccccn1 1556351327 WALOEPMDCSPGEJ-KRWDZBQOSA-N 430.277 4.254 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H]2CCCO2)c(C)n1-c1ccc(Br)cc1 1558607677 YBEWJZYWNUTEMY-VQTJNVASSA-N 447.373 4.267 10 10 IICE COc1cc(N2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)c([N+](=O)[O-])cc1OC 1559113616 QXDSSFPRTMZQFK-UHFFFAOYSA-N 437.855 4.260 10 10 IICE CNc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)c1 1565884145 JHOUMRXVHUCQLP-FQEVSTJZSA-N 446.979 4.444 10 10 IICE CC(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1568604499 JAGUEJODJSKHNW-OAHLLOKOSA-N 429.355 4.100 10 10 IICE Cc1cc(C(=O)N2CCC(c3ncco3)CC2)c(C)n1-c1ccc(Br)cn1 1570619910 WHQFOZHROXGGJO-UHFFFAOYSA-N 429.318 4.259 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(Sc4ccccc4Cl)nn3)C2)cc1 1585987365 AYXDSGHFBKWKBO-OAHLLOKOSA-N 440.956 4.299 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)NCC2CC2)c(C)n1-c1cccc(C(C)C)c1 1587593329 OTOQPEWJIIRLDL-QFIPXVFZSA-N 425.598 4.259 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(NC(=O)Nc4ccccc4)cc3)cc2)CC1 1598267491 KLLJXXMSUVSSKH-UHFFFAOYSA-N 443.551 4.012 10 10 IICE CC(C)Cc1nnc(N(C)CCC2CCOCC2)n1Cc1ccc2c(c1)CCCN2C 1603348551 CDBWOEXPEAUBHS-UHFFFAOYSA-N 425.621 4.160 10 10 IICE Cc1ccccc1Cc1nnc(Nc2cnn(C)c2)n1CCCSc1nccs1 1612299525 NCBSXCYPEMRICL-UHFFFAOYSA-N 425.587 4.293 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)NCc1ccc(OC)cc1O)NC(=O)OC(C)(C)C 1617762779 MMIOXOPIPAMYRF-LJQANCHMSA-N 444.528 4.072 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCc3cc(F)ccc32)NC(=O)OC(C)(C)C)cc1 1618253954 UXXPBNXKQFYPKG-FCHUYYIVSA-N 441.547 4.304 10 10 IICE C[C@H]1CC[C@@H](CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)O1 1618369505 WAKGXLWTWBUWRY-ZFWWWQNUSA-N 429.318 4.445 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H]3CCC=CO3)CC2)cc1F 1619302727 ZDNCYIJGJPHSSB-LJQANCHMSA-N 443.567 4.034 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1C 1623202234 AAGGHCLKRRHWGA-UKILVPOCSA-N 431.580 4.015 10 10 IICE Cc1cc(C(=O)N[C@@H]2CN(C)Cc3ccccc32)c(C)n1-c1ccc(Br)cn1 1624624146 RHTOPLIEBPQHDD-HXUWFJFHSA-N 439.357 4.168 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCCC2)[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1624893125 SROXYZLENWCNEZ-FQEVSTJZSA-N 445.629 4.036 10 10 IICE Cc1cc(C(=O)NCc2nc3ccc(Br)cc3o2)c(C)n1-c1ccccn1 1631436812 MKQUAHQZGGCFJV-UHFFFAOYSA-N 425.286 4.323 10 10 IICE CCCc1sc(C(=O)N(CC(=O)OCC)Cc2ccccc2O)cc1Br 1638528950 BVLOWBRSLMZWMH-UHFFFAOYSA-N 440.359 4.374 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639929326 ZBWPMQZHNCZDMZ-OXQOHEQNSA-N 432.362 4.187 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSc2ncnc3sc(C)c(C)c23)cc1 1640772441 ZTLPINYMCLVMIM-UHFFFAOYSA-N 430.599 4.004 10 10 IICE CCOC(=O)[C@]1(Cc2ccccc2)CCCN1Cc1ccc(N2CCC(OC)CC2)cc1 1642712707 NGWWAKOXSLJNGE-HHHXNRCGSA-N 436.596 4.442 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2ccccc2F)c(C)n1-c1ccccc1Br 1645516140 MZDTXDGCEBBJJG-KRWDZBQOSA-N 445.332 4.329 10 10 IICE COc1ccc(N2CCCN(CC(=O)Nc3ccc(N4CCCCCC4)cc3)CC2)cc1 1652319570 PZSMTIXLXQNEKZ-UHFFFAOYSA-N 436.600 4.226 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(Cc4cccc(F)c4F)CC3)C2)cc1 1682645779 JRTBFJZWYYLISW-LJQANCHMSA-N 429.511 4.216 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN(CC)C(C)C 1694108288 HJGUCBLBULHGNM-NRFANRHFSA-N 442.652 4.247 10 10 IICE CCN(c1nnc(C(=O)NC(C)C)n1CCCSc1nccs1)C1CCCCC1 1695533863 UFNKJLYLPMUBNU-UHFFFAOYSA-N 436.651 4.214 10 10 IICE CSCCCN(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCSCC2)cc1 1698427764 XAHKGVRGNGBYLE-UHFFFAOYSA-N 433.691 4.267 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCN1CCC[C@@H](C)C1 1723270482 MKYKGUKCAYDGKA-JOCHJYFZSA-N 438.664 4.445 10 10 IICE CC(C)CC1(Cn2c(C(=O)Nc3ccccn3)nnc2N(C)Cc2ccccc2O)CC1 1750701339 GSTCFRFFQOVVFA-UHFFFAOYSA-N 434.544 4.094 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)cc1C 1752611802 IKCXEEQTJKINCC-VGOFRKELSA-N 435.620 4.462 10 10 IICE COc1ccc(N2CCN(c3nc(O)cc(-c4ccc(Cl)c(Cl)c4)n3)CC2)cc1 1858503648 SNTGPGMCXUBJBY-UHFFFAOYSA-N 431.323 4.491 10 10 IICE COC(=O)c1c(NC(=O)CCCC(=O)O)sc(C)c1-c1ccc(Br)cc1 1866114582 PBVFXEKFNYMGMY-UHFFFAOYSA-N 440.315 4.466 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@H](CN)c1sncc1Br 1881501379 PGZVUKHQSYQXKH-OAHLLOKOSA-N 441.395 4.067 10 10 IICE O=C(N[C@@]1(c2ccc(F)cc2O)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952760655 HBBBMIQHAYLFOM-PXDATVDWSA-N 433.435 4.370 10 10 IICE CN1CCCc2cc([C@H](N)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536840 POLFJUGGVPLYBW-GGAORHGYSA-N 425.573 4.179 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010406502 VJMOMDRUCRPOLA-RBUKOAKNSA-N 431.537 4.036 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NCc2cc(Br)ccc2O)C12CCC2 2118417018 BHBGDEYKTUBNDF-YOEHRIQHSA-N 425.367 4.328 10 10 IICE COc1cc(Cl)cc(CN[C@@H]2CN(C(=O)OCc3ccccc3)CC23CCC3)c1O 2145350605 FFKYATDYAYTXTR-HXUWFJFHSA-N 430.932 4.335 10 10 IICE O=C1NC(=O)N(Cc2ccco2)C(=O)C1=Cc1cn(Cc2ccccc2F)c2ccccc12 2296285329 RBVPEZNRRTYZOL-UHFFFAOYSA-N 443.434 4.084 10 10 IICE O=C1NC(=S)N(c2ccc(Cl)cc2Cl)C(=O)C1=Cc1cc(Cl)ccc1O 2297322417 CALBVRUHQLUENT-UHFFFAOYSA-N 427.696 4.184 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)c(O)c1Br 2381143634 SNQCKMWPPRAISG-OTVXOJSOSA-N 441.366 4.163 10 10 IICE CCC(CC)NC(=O)c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc2ccccc12 23332160 HLIGWDOYPQCGCE-UHFFFAOYSA-N 432.568 4.488 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccccc1Br 35640519 SBMUCOFLTBUKBU-UVTDQMKNSA-N 437.340 4.272 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)C12CCC2 715765323 GGORYCNNTQJLPK-HUUCEWRRSA-N 429.330 4.219 10 10 IICE O=c1ccccn1Cc1ccc(CNCc2ccc(OCc3ccccc3)cc2O)cc1 753550403 FDCVMSMDTFIEEA-UHFFFAOYSA-N 426.516 4.471 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCCCC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 758179075 OJQQVZLYGWEKSV-YADHBBJMSA-N 445.604 4.003 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2\SC(=S)N(CCc3cccnc3)C2=O)cc1 764886780 SUYNPRLRLMQSHW-AQTBWJFISA-N 426.563 4.481 10 10 IICE CCc1noc(-c2ccc(C)c(NC(=O)NCc3cc(Br)ccc3O)c2)n1 806334708 STYNZWYBVDYNHD-UHFFFAOYSA-N 431.290 4.397 10 10 IICE C[C@@H](Oc1ccc(F)cc1)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCO1 812264445 JCDFQRJPEODEEJ-OXQOHEQNSA-N 426.492 4.078 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(Cc4ccc(Cl)cc4)CC3)cc2F)CC1 1125906844 CMSMQKIGHRXJNV-UHFFFAOYSA-N 429.967 4.260 10 10 IICE O=C(C[C@@H]1CCC[C@H](C(F)(F)F)O1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126583852 UUBDZKWYWUXVAI-XOKHGSTOSA-N 436.421 4.263 10 10 IICE COc1cc(OC)cc(N(C)C(=O)c2ccccc2CCN(C)C(=O)OC(C)(C)C)c1 1128009582 JJCJZBMNDSJQGQ-UHFFFAOYSA-N 428.529 4.390 10 10 IICE COc1cc(-n2cccc2)c(Cl)cc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1134682091 UOVOFFLWLMZSBQ-QFIPXVFZSA-N 440.975 4.238 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(C(F)(F)F)c1O 1136546735 URGNEJPZOFGAHU-UHFFFAOYSA-N 430.373 4.411 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc2c(s1)CN(C(=O)OC(C)(C)C)CC2 1136972290 HHXHZFHWFKYZAU-UHFFFAOYSA-N 443.569 4.147 10 10 IICE CCCN(Cc1ccccc1O)C(=O)CCOc1cccc(I)c1 1137346981 SDPOSYBTJCYJAY-UHFFFAOYSA-N 439.293 4.205 10 10 IICE CCOc1ccc(N(CC)C[C@@H](O)c2ccc3c(c2)CN(C(=O)C(F)(F)F)CC3)cc1 1167982675 FVHDDONAXGRGGW-OAQYLSRUSA-N 436.474 4.092 10 10 IICE O=C1C[C@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CN1c1ccccc1F 1229108362 FKXOUNXUEOXODI-SFHVURJKSA-N 425.504 4.181 10 10 IICE Cc1ccccc1C1CCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1251750752 MRZMVZKLIIUGPH-UHFFFAOYSA-N 429.511 4.199 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N(CCC1CC1)CC1CC1 1280370443 JKRQGRWVLUDTIW-UYRXBGFRSA-N 432.586 4.456 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCC[C@H](C)CC2)cc1 1295411134 PWDCWTRXSBEQEY-FQEVSTJZSA-N 438.620 4.035 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2ccc(C)o2)n1CCCSc1nccs1 1295722553 LQHQFKINWMVTJR-INIZCTEOSA-N 433.603 4.491 10 10 IICE CC1=C(C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1304029040 NGVXBHZNTQZDJY-UHFFFAOYSA-N 437.632 4.379 10 10 IICE COCCN(Cc1ccc(C)o1)c1nnc(C(C)C)n1Cc1ccc(N(C)C)c(F)c1 1316089227 BRLQMKIKPZUMLQ-UHFFFAOYSA-N 429.540 4.209 10 10 IICE C[C@@H](C1CCCCC1)N(C)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)c(F)c1 1316480280 NPUQIUHSWPYPHX-KRWDZBQOSA-N 437.567 4.394 10 10 IICE C[C@@H](NC(=O)c1cnn(-c2ccccc2)c1C(F)F)c1ccc(N2CCOCC2)cc1 1351696672 ODNIKBPEFHLVNR-MRXNPFEDSA-N 426.467 4.138 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CC[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1436972469 QVMZPWOJEWJPBI-PMACEKPBSA-N 445.604 4.065 10 10 IICE C[C@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1440670802 ABENIYSYWBFHCX-QGZVFWFLSA-N 436.474 4.259 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1 1444240102 LYIJDWNVIWLYAO-MRXNPFEDSA-N 427.545 4.139 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CSCc3cccc(F)c3F)cc2F)C[C@@H](C)O1 1459255089 XIJHGAIQCXARSL-HUUCEWRRSA-N 438.515 4.267 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)cc1 1460123178 WGDMVIZTZWWZRG-QHCPKHFHSA-N 440.569 4.209 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3csc(NC4(C)CCCC4)n3)CC2)cc1 1464705374 QQOBTSIEENPXIC-UHFFFAOYSA-N 428.602 4.224 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)[C@H]1CCCOC1 1466780768 RVWWYRUQTOZNFS-NZQKXSOJSA-N 426.557 4.306 10 10 IICE CN1c2ccc(Br)cc2N(C(=O)c2ccc(N=NC(N)=O)cc2)CC1(C)C 1467673139 JQQPNNVMFDRAQW-UHFFFAOYSA-N 430.306 4.487 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](c2ccccc2)c2cnn(C)c2)c(C)n1-c1ccccc1 1469764904 SSPGYULSSYVQTF-VWLOTQADSA-N 427.552 4.459 10 10 IICE CCC(CC)(Cn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1496506277 JOGIPNIVRVWDOQ-UHFFFAOYSA-N 429.609 4.080 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)C[C@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1496759631 CUWZUJZBOUCWIS-VQIMIIECSA-N 444.599 4.075 10 10 IICE CCCCOc1ncccc1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1518717462 FPJDKDIVLFNNRP-UHFFFAOYSA-N 434.584 4.298 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCC1CC1 1525601703 VFRKZBNCQMEKJE-LFIBNONCSA-N 438.640 4.051 10 10 IICE CNC(=O)c1cccc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)n1 1532705565 CYMUTYYUJJYJPH-UHFFFAOYSA-N 449.511 4.364 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC2C[C@H](C)O[C@@H](C)C2)cs1 1542898533 WLHIANQYZIYFRO-HOTGVXAUSA-N 441.601 4.179 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(C)(C)CCOC 1545538224 XPTWTFBYDKFAGJ-GOSISDBHSA-N 447.599 4.329 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)cc2C)CCS1 1546759055 FXXUZMIZWYDQDS-JOCHJYFZSA-N 436.629 4.018 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCC1CC1 1546990823 MBWYKFNHGRSZMP-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CO[C@@H](C)c1nc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cs1 1554588289 RQQLNNICVJLDTC-HNAYVOBHSA-N 443.573 4.074 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@H]2c2ccc(Br)cn2)c([N+](=O)[O-])c1 1559207257 HOEYYRCPOGAVJJ-RDTXFTJFSA-N 432.274 4.280 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)N(CC)C[C@H]2C)sc(C)c1-c1ccccc1 1559712514 OLQCHLQTGCYHJK-IAGOWNOFSA-N 443.613 4.253 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC([C@H](F)c2ccccc2F)CC1 1565127009 HWOMEKIFQMCXNH-DEOSSOPVSA-N 443.538 4.419 10 10 IICE Cc1cc(C(=O)N[C@H](C(C)C)C2(CO)CCC2)c(C)n1-c1ccc(Br)cn1 1569644076 GEIKWKPYKWQJAM-LJQANCHMSA-N 434.378 4.169 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)CCCC1 1570425967 NPLYHOHSULHGCU-ZWKOTPCHSA-N 440.584 4.355 10 10 IICE CCO[C@@H]1CCCC[C@H]1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1583817520 RJZSVOWBVAHFEV-LJSFPGAPSA-N 438.640 4.193 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C2CCOCC2)c(C)n1-c1ccc(Br)cn1 1597807102 ZKYQIYRDVIRPCA-IBGZPJMESA-N 432.362 4.283 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1([S@](C)=O)CCC1 1603303507 RKNPOZAQMHGJCO-HKBQPEDESA-N 443.661 4.014 10 10 IICE COC(=O)c1cc(C(=O)CN(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)c(C)[nH]1 1615886970 KLDBEUOEKCYYQW-RMKNXTFCSA-N 446.503 4.284 10 10 IICE O=C(Cc1cccc(F)c1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616566194 HERIHWTVQVPLRZ-UHFFFAOYSA-N 425.261 4.479 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCO)C1 1619494118 CEQITGOGFOOMSS-QFIPXVFZSA-N 437.588 4.130 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3)CC2)c(C)n1-c1ccccn1 1623702183 MJOCGWTXFRNVEM-UHFFFAOYSA-N 428.458 4.470 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])cc1 1627421743 YUFMBWPDHRGNEI-UHFFFAOYSA-N 437.500 4.363 10 10 IICE COc1ccc(-n2cc(C(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)nn2)cc1 1637244255 YSLCIZRGNWHPDY-SFHVURJKSA-N 428.492 4.385 10 10 IICE CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1cc(Cl)cc(Cl)c1O 1641997557 RDIQDOFFJJCZKP-QGZVFWFLSA-N 439.339 4.451 10 10 IICE COC(=O)[C@](C)(Cc1ccc(F)cc1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1644514109 ZMKNYDUBJQKHMQ-VWLOTQADSA-N 438.499 4.146 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)c3cccc(Cl)c3S2(=O)=O)c1C 1652833740 SVXKEBPUEYECEQ-UHFFFAOYSA-N 442.924 4.083 10 10 IICE CC(=O)N(c1ccc(NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1)[C@@H]1C[C@H]1C 1662054470 QXCJNJDBTOEJRB-QZTZHPFYSA-N 436.556 4.167 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(CCc1ccccn1)Cc1ccncc1 1682101435 QDHUQUSKZUSJRB-NRFANRHFSA-N 431.584 4.237 10 10 IICE CC(C)c1cccc2c1CCN(C(=O)NCc1cc(F)c(N3CCOCC3)c(F)c1)C2 1683018201 ITPVVHCQAVOFFQ-UHFFFAOYSA-N 429.511 4.193 10 10 IICE Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1685328216 SUPOEGJEQSDEAT-DQEYMECFSA-N 448.611 4.174 10 10 IICE Cc1ccoc1Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1692937379 ZHMGPAAGWHJRIL-UHFFFAOYSA-N 442.317 4.327 10 10 IICE Cc1nc(Cc2nnc(N3C[C@H](C)[C@@H](C)C3)n2CCCSc2nccs2)cs1 1693346874 HQZVSOUYLXLNLE-KBPBESRZSA-N 434.660 4.365 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CC[C@H](SCC)C2)n1Cc1ccc(N(C)C)cc1C 1696241878 MUGHMXDHXRDIHE-RTWAWAEBSA-N 431.650 4.348 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1711587536 AMYYHOYXOLBKPX-DEOSSOPVSA-N 443.661 4.182 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC2CC2)n1CCCOC(F)(F)F 1729405263 VDCQBPBFSRVQQE-UHFFFAOYSA-N 437.510 4.394 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765021375 NXLQMKBRILBKJI-XXBNENTESA-N 425.621 4.283 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CC[C@H]3C[C@H](F)C3)CC2)cc1F 1770258467 NYNARCMPFBPPLL-IYARVYRRSA-N 433.547 4.089 10 10 IICE CC(C)(C)NC[C@@H](O[C@@H](CNC(C)(C)C)c1ccc(O)c(O)c1)c1ccc(O)c(O)c1 1848439010 MTOMWRDVPFYJDM-SZPZYZBQSA-N 432.561 4.084 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)/C2=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 1865678035 QEACBDZPZROVNX-XDHOZWIPSA-N 447.422 4.278 10 10 IICE O=c1cc(CNc2ccc(Nc3ccccc3)cc2)n(Cc2cccnc2)cc1OCCO 1870788994 GFYCNVOPIKEQBT-UHFFFAOYSA-N 442.519 4.018 10 10 IICE COc1ccc(CNC(=O)c2ccc3[nH]c(-c4ccc(N(C)C)cc4)nc3c2)cc1OC 1872740645 QSURXUBCEHCRPY-UHFFFAOYSA-N 430.508 4.243 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CC3)C(=O)N(CCOc3ccccc3)C2=O)cc1 1873166957 MPJXHPVUFWGQMC-UHFFFAOYSA-N 441.531 4.005 10 10 IICE CCCCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCCOC)C1=O 1873168346 RXJRTIPJTLYEFY-UHFFFAOYSA-N 437.584 4.380 10 10 IICE COc1ccc(Br)c(CNC[C@@]2(C)CN(Cc3ccccc3)C[C@H]2C)c1O 2236051177 PETGHGXDWMHSQX-ZHRRBRCNSA-N 433.390 4.411 10 10 IICE CCN(CC)CCCNC=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 2293202017 NHOZSQILWMKKKX-UHFFFAOYSA-N 433.581 4.253 10 10 IICE O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)C1=Cc1ccc(N2CCCCC2)cc1 2293769006 IYYOCZGUVYANLI-UHFFFAOYSA-N 425.941 4.162 10 10 IICE Cc1ccc(CN(C)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c(O)c1Br 2307572715 ZTJJXBLCYXURBI-SFHVURJKSA-N 433.346 4.306 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1ccccc1 2314768976 MWNPMLJWFQNOJV-UHFFFAOYSA-N 443.546 4.340 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457139 HMRJNLLOXFBFOO-BSRJHKFKSA-N 428.554 4.258 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc(O)cc3)SC2=S)cc1 15039730 YHYPBORGOOYFBP-AQTBWJFISA-N 428.535 4.021 10 10 IICE CCCCCCN1C(=O)/C(=C2/SC(=S)N(CC(=O)OC(C)C)C2=O)c2ccccc21 33621360 UHOGSPRSMYMWER-VHEBQXMUSA-N 446.594 4.137 10 10 IICE CC[C@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCCO1)c1cc(Br)ccc1O 390650086 VERGSUJZWHIQFJ-RDJZCZTQSA-N 443.382 4.221 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1 435821470 DZHKHSNFWADYFC-FQEVSTJZSA-N 441.579 4.471 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4ccccc4Cl)o3)CC2)cc1 742926793 AUVGWLFEZNWFQE-UHFFFAOYSA-N 439.943 4.161 10 10 IICE Cc1nn(C)c(C)c1[C@H](NC(=O)NCc1ccc(N2CCC(C)CC2)cc1)C(F)(F)F 757894860 UFZGDKHJSVRBKP-FQEVSTJZSA-N 437.510 4.376 10 10 IICE C[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H](c2ccco2)C1 769932959 RPIWGUJAGYMDSO-PBHICJAKSA-N 446.550 4.461 10 10 IICE Cc1cccc(NC(=O)C[C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C 773143689 CCZPPUOSLYOLAA-OAQYLSRUSA-N 434.628 4.342 10 10 IICE C[C@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cc(Br)cc(Cl)c1O 790745593 CHUWSSDVNITBAF-GTNSWQLSSA-N 441.728 4.399 10 10 IICE CN(C)c1ncn(-c2cccc(NC(=O)N(Cc3ccccc3O)C3CCCCC3)c2)n1 799416825 WBYMDQQJMIVUOA-UHFFFAOYSA-N 434.544 4.406 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(CN4CCCCC4)cc3)cc2F)C[C@@H](C)O1 1125258132 DWJWBBMWBFQPDF-WOJBJXKFSA-N 439.575 4.355 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)cc3OC(C)C)CC2)cc1 1127275115 HWRGWQFEDVBWSH-UHFFFAOYSA-N 433.346 4.207 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2OCCN2CCCC[C@H]2C)cc1 1130543900 GTLQHSVFICPKRD-OAQYLSRUSA-N 439.600 4.157 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1 1141549193 YYCAVURTBKTDQS-RUYXUALKSA-N 429.948 4.343 10 10 IICE COc1ccccc1OCCCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1144693258 ZUTSHSNQWDQMGG-UHFFFAOYSA-N 435.568 4.002 10 10 IICE COc1ccc2c(NC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)n[nH]c2c1 1156229907 HADYKUHRBXSSSW-UHFFFAOYSA-N 440.301 4.389 10 10 IICE COC(=O)CN(CCCc1nc(-c2ccc(C)c(F)c2)no1)Cc1cc(Cl)ccc1O 1167735226 VSURSZNHXQJVBA-UHFFFAOYSA-N 447.894 4.151 10 10 IICE COc1cccc(-c2cc(CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)on2)c1 1178967949 DUXUWMGSDFMGCQ-UHFFFAOYSA-N 443.503 4.429 10 10 IICE CCN1CCC[C@H]1CN(CCN(C)C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1292583062 WLXDVCHREKMLMQ-DEOSSOPVSA-N 445.051 4.165 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1302800106 ZXEUFZKETNEITR-UHFFFAOYSA-N 425.602 4.332 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3CC[C@H]2O)c(C)n1-c1ccc(Br)cn1 1304061125 NSIAWCAUQICSED-CTNGQTDRSA-N 440.341 4.030 10 10 IICE Brc1cc(CN2CCCN(C[C@@H]3CCCO3)CC2)ccc1N1CCCCC1 1308649776 XHKXEFHFPVTHJU-FQEVSTJZSA-N 436.438 4.126 10 10 IICE CN(OC1CCCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1314890331 FZLNEZNTTGYILW-UHFFFAOYSA-N 429.634 4.488 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(Cl)cn1 1466940612 ZGULBOQPEQTTLV-NJPLLEPOSA-N 449.960 4.343 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H]2CCN(c3ccccc3F)C2)cc1 1468504380 DANFZSSHMQDMDE-NRFANRHFSA-N 433.527 4.231 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@H]2c2nc3ccccc3[nH]2)N(C)C)cc1 1471548525 VQIGBOXHOMQADV-GOTSBHOMSA-N 434.588 4.168 10 10 IICE C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786228 LNWNSASKSIRDPC-JTSKRJEESA-N 429.511 4.484 10 10 IICE C[C@@H]1CCCN(CCCCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1493794691 XJFBOKJTFIHQLS-NFBKMPQASA-N 441.620 4.374 10 10 IICE CCc1nnc(N2CCO[C@@H](c3cccc(F)c3)C2)n1CCCSc1nccs1 1499215941 IZTYVHQLXLCTKD-QGZVFWFLSA-N 433.578 4.196 10 10 IICE CC(C)CN(c1nnc([C@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C)C(C)C 1509369254 GWVJEOQXIUGUEX-QFIPXVFZSA-N 425.621 4.474 10 10 IICE CN1CCCc2cc(Cn3c(N4CCO[C@@H](C(C)(C)C)C4)nnc3C(C)(C)C)ccc21 1517413438 YPXFZMVGMSGWGC-OAQYLSRUSA-N 425.621 4.258 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C\c1scnc1C)CCC2 1528101145 BMNXGBCMUSPREW-HJWRWDBZSA-N 438.505 4.403 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCOc2cccc(F)c2)NC(=O)OC(C)(C)C)cc1 1544268426 LPURQFSALULZAV-NRFANRHFSA-N 445.535 4.043 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2 1544576909 FAXNCGWNQLZWSR-UHFFFAOYSA-N 443.569 4.147 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2C[C@@H](C)S[C@H](C)C2)cc1 1547447086 OAWCFLXQUVVOIW-QWFCFKBJSA-N 429.634 4.007 10 10 IICE Cc1cc(CN2CCN(C(=O)COc3ccc(Cl)cc3Cl)CC2)ccc1N(C)C 1559758111 VCYJGYDLTIPDAG-UHFFFAOYSA-N 436.383 4.091 10 10 IICE CCCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1cccc(C)c1 1586061293 OUBNOJUKUMJFMI-VWLOTQADSA-N 433.600 4.232 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Br)cc1 1586800955 ZSWAYNFRVUDCTQ-JOCHJYFZSA-N 445.401 4.468 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(c2)COC3)c(C)n1-c1ccc(Br)cn1 1588198734 DIMAOPPDFKXGAA-UHFFFAOYSA-N 426.314 4.212 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)/C=C\c1ccc(S(C)(=O)=O)o1 1597567778 WCPMYSYWGWHYKA-BHEFUSTPSA-N 425.506 4.192 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3sc4ccccc4c3Cl)cc2)CC1 1598009200 KTRWEZSWPSUNAY-UHFFFAOYSA-N 427.957 4.186 10 10 IICE CC[C@@]1(C)CC[C@H](Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)O1 1613684102 FLVJRUXHFYRZGH-XXBNENTESA-N 441.601 4.324 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC34CN(C(=O)OC(C)(C)C)C4)cc2Cl)C1 1617901014 OYWNPRAFFRYEDF-SJLPKXTDSA-N 448.007 4.450 10 10 IICE COc1ccc2c(c1)c(C(=O)N[C@H]1CCCN(Cc3cc(Cl)ccc3O)C1)c(C)n2C 1622635252 VIOSFGQGYBHSBK-SFHVURJKSA-N 441.959 4.249 10 10 IICE CCCNS(=O)(=O)c1ccc(NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1 1625163896 PMWDWMLXUZVLRX-UHFFFAOYSA-N 425.554 4.343 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1[nH]ccc1-c1ccccc1 1625990955 JFDINBMNGCYBPO-UHFFFAOYSA-N 429.442 4.467 10 10 IICE Cc1cc(C(=O)N2CC3(CCOCC3)C[C@H]2C)c(C)n1-c1ccc(Br)cn1 1627329355 MBUYLPYBPYAYDX-OAHLLOKOSA-N 432.362 4.283 10 10 IICE CCN1CCC[C@H]1CN(CCN(C)C)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1627590588 KUUTVZLXIFQXCY-QFIPXVFZSA-N 431.024 4.236 10 10 IICE CCOC(=O)C[C@H]1CCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1634755097 AIZXITKSLUDSRS-MRXNPFEDSA-N 433.346 4.414 10 10 IICE CCC(CC)(CNC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(F)cc1 1635996494 CGDPNQFWQONNFE-UHFFFAOYSA-N 449.517 4.498 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)CC2)cc1 1636706810 HNSWVBFKWBDMKX-SANMLTNESA-N 438.568 4.149 10 10 IICE Cc1cc(CNC(=O)c2cc(Br)cc([N+](=O)[O-])c2N)c(C)n1-c1ccccc1 1643369423 FBTIMHISMSLADX-UHFFFAOYSA-N 443.301 4.277 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(CC3CC3)c3cccc(F)c3)cc2F)C[C@@H](C)O1 1644162482 YKZRVGSBRXPAFY-QZTJIDSGSA-N 443.538 4.111 10 10 IICE Cc1cc(C(=O)N2CCC(c3ncon3)CC2)c(C)n1-c1ccc(Br)cc1 1645023741 XOPUEEHGVXOSIG-UHFFFAOYSA-N 429.318 4.259 10 10 IICE COc1ccc([C@H](CNC(=O)OC(C)(C)C)CN(C)c2ccc(OC)cc2OC)cc1 1652957658 NBIACBJHHRGMNF-GOSISDBHSA-N 430.545 4.457 10 10 IICE CSc1nc(=O)n(CC(=O)c2cc(C)n(-c3ccc(Cl)c(C(F)(F)F)c3)c2C)[nH]1 1656462452 XVBZAVAYXMCVLQ-UHFFFAOYSA-N 444.866 4.256 10 10 IICE COC(=O)c1ccc(C)c(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)c1 1656582530 AGXNGABNMVMSQI-UHFFFAOYSA-N 448.519 4.444 10 10 IICE Cc1cc(Br)c(CNC(=O)NCc2cccc(Br)c2O)s1 1683987226 WUIPKDODOLYMKQ-UHFFFAOYSA-N 434.153 4.287 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1694798092 ZEGCKVWWZAAUKF-UGKGYDQZSA-N 438.620 4.033 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1C 1695437115 ULMQWUCTKAVWKX-PKOBYXMFSA-N 434.588 4.114 10 10 IICE CC[C@@H](C)CN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1708584343 SELNGGGDZXHHCP-LJQANCHMSA-N 439.629 4.298 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1708816397 LCOOWECVTZBCNP-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CCN(c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H](C)C1CCC1 1709956327 ZZISLJVCCFBITN-FXAWDEMLSA-N 429.584 4.440 10 10 IICE CC(C)[C@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CCS1 1723235469 BNTSLUDHEGQRSN-HZPDHXFCSA-N 439.676 4.346 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC(COC)CC2)cc1 1728381592 UODFGXNHHJBYBM-UHFFFAOYSA-N 434.588 4.097 10 10 IICE CC(C)c1nnc(N2CCc3c(ccnc3N(C)C)C2)n1CCCSc1nccs1 1741357523 DJWVAYSEKAOFEA-UHFFFAOYSA-N 443.646 4.064 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1742333355 CBBIPSZAAMQOTQ-OALUTQOASA-N 436.629 4.401 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCC[C@H]1C 1761198007 FMYAEDMKXRHGON-TZIWHRDSSA-N 438.620 4.089 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(c2ccccc2)c2ccccc2)N2CCOCC2)cc1 1858074059 BFRMDQYEWAOPHS-SANMLTNESA-N 443.591 4.074 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3cccc(F)c3)N=C2C(F)(F)F)cc(OC)c1OC 1865668122 HGFJPVLLUQXUDT-NVNXTCNLSA-N 438.377 4.196 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3cccc(F)c3)[nH]n2)N2CCCCC2)cc1 1866138170 SWBWPSMFIAMUNP-DEOSSOPVSA-N 435.547 4.239 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(F)(F)F)c(CO)c1I 2079048167 RKCVNZMHEBVUFF-LLVKDONJSA-N 440.203 4.012 10 10 IICE Cc1nn(Cc2ccc(Br)cc2O)c(I)c1C(C)C 2079588467 IPDSLEYKJCGUEL-UHFFFAOYSA-N 435.103 4.436 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(C)cc3)C2=O)ccc1OCC(=O)O 2314931700 HQYXXNONGDVOIC-UHFFFAOYSA-N 429.519 4.263 10 10 IICE CCOc1ccc(N2C(=O)/C(=C/c3ccc(N4CCOCC4)cc3)N=C2SCC)cc1 4789668 ZMMBZRJGPMUKPH-XLNRJJMWSA-N 437.565 4.419 10 10 IICE Cc1cc(O)c(O)cc1CCNC(=O)CCCOc1ccc(Br)cc1Cl 170202449 DBTOCMHXUUIEPL-UHFFFAOYSA-N 442.737 4.340 10 10 IICE Cc1ccc(NC(=O)Cc2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)cc1 561392017 SATUBIYRKNNISN-UHFFFAOYSA-N 443.551 4.329 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(NC(=O)OC(C)(C)C)cc3)CC2)cc1 729572442 BKRDKWWQILQWSO-UHFFFAOYSA-N 426.517 4.396 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)N[C@@H](C)c1cc(OC)ccc1O)O[C@@H](C)C2 730828272 SFOORTMFRLNWIJ-OACKDKIBSA-N 426.513 4.039 10 10 IICE Cc1ccccc1-c1nc(CS(=O)(=O)CC(=O)c2cc(C)n(-c3ccccc3)c2C)no1 760304951 ODTMFVOWJJFBKE-UHFFFAOYSA-N 449.532 4.250 10 10 IICE COCC[C@@H]1CCCCN(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 768386344 ZNTVFGGVTLMLJB-ZWKOTPCHSA-N 425.520 4.105 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc(OCC(F)F)cc1 768903014 IWOVPSIFECSNLY-UHFFFAOYSA-N 444.526 4.184 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 779506363 PZJGBLMKQLXFRD-CLTKARDFSA-N 431.275 4.267 10 10 IICE Cc1cc(C(=O)CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c(C)n1-c1ccccc1 796152043 QWWAITLCGQNGGX-SFHVURJKSA-N 435.490 4.057 10 10 IICE COc1ccc(N2CCC(N[C@H](C)c3c[nH]ccc3=NC(=O)OC(C)(C)C)CC2)cc1 796743965 KDLWQOYPNNQDMJ-QGZVFWFLSA-N 426.561 4.179 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@@H](C)C2 1124130757 YMVHLCZZOYOVIB-HUUCEWRRSA-N 426.538 4.041 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1cc2c(cc1Br)OCCO2 1124622383 SNVCNBOSNWDPNW-UHFFFAOYSA-N 445.357 4.022 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@]3(C(=O)OC(C)(C)C)CC=CCC3)cc2F)C[C@@H](C)O1 1125188853 VVLBKDYTOOGWQJ-FUMQJTLXSA-N 446.563 4.124 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccc(OCc2ccccc2Br)c1 1153879014 ACWYVXQQKDNNSV-UHFFFAOYSA-N 428.282 4.369 10 10 IICE COc1ccc(C[C@](C)(O)CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc1OC 1160305283 KHUQYXXFIZLWRY-SANMLTNESA-N 436.552 4.143 10 10 IICE COc1cc2oc(=O)cc(C)c2cc1CCC(=O)NCc1cc(Cl)cc(Cl)c1O 1160600693 XQBFGLMYKXTFGW-UHFFFAOYSA-N 436.291 4.371 10 10 IICE CC(=O)NCC(C)(C)C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1182481782 MCVUOHXXYYHCKJ-IBGZPJMESA-N 435.490 4.460 10 10 IICE CN1CCC[C@@H](c2cccc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2)C1 1182951936 NMWXTBGNWIJMJW-NFBKMPQASA-N 442.003 4.249 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc3c(n2)CN(C(=O)OC(C)(C)C)CC3)cc1 1291711878 WPOXIBUGCSHTML-UHFFFAOYSA-N 438.572 4.151 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCCCC[C@@H]3c3ccc(Cl)cc3)nc12 1307472349 IWMBVSLVDFVJNS-LJQANCHMSA-N 428.920 4.382 10 10 IICE CCSCCCn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1314619600 DITNJJDCXVZCKS-UHFFFAOYSA-N 433.597 4.163 10 10 IICE COc1ccc(N2CCN(c3nnc(CC4CC4)n3CC(C)(C)C(C)C)CC2)cc1F 1315517038 ATBROQOGGPOLHA-UHFFFAOYSA-N 429.584 4.387 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C 1315728779 BGCPMPPRXZSUIP-IERDGZPVSA-N 443.592 4.045 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(CCN(C)C)Cc3ccc(F)cc3F)ccc21 1359851982 TVBDMHFRNYJXAN-UHFFFAOYSA-N 443.538 4.387 10 10 IICE CN(C)c1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc2ccccc12 1445884553 PQQLPFVIFQUJHF-GOSISDBHSA-N 438.959 4.054 10 10 IICE Cc1cc(C(=O)N2CC3(CCCC3)OC[C@@H]2CN(C)C)c(C)n1-c1ccc(Cl)cc1 1454063677 KXFRSEZUSXHMOH-NRFANRHFSA-N 429.992 4.463 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1465890300 ZJVMJFRNYSHQLZ-UHFFFAOYSA-N 431.536 4.186 10 10 IICE COCC(=O)N1CCCc2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc21 1472134422 BKTQTHRZSZMCJG-UHFFFAOYSA-N 445.519 4.085 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)c(C)n1-c1ccccc1 1478654615 ZCRZERJJGKSCLM-XPWALMASSA-N 435.572 4.287 10 10 IICE CCOCc1nnc(N2CCCC3(CCOCC3)C2)n1Cc1ccc(N(CC)CC)cc1 1516570709 JCGOTMMJCZXRIS-UHFFFAOYSA-N 441.620 4.106 10 10 IICE COC(C)(C)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1517731086 CMVCZWZUPLCCSO-UHFFFAOYSA-N 434.588 4.310 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H](c3cccc(Cl)c3)C(C)C)CC2)cc1 1523442707 JMTMFBNRQIBMOV-XMMPIXPASA-N 444.019 4.417 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccccc3C(=O)c3ccc(F)c(F)c3)C2)cc1 1531729622 JHHHHLPKYPPFIJ-QGZVFWFLSA-N 436.458 4.213 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]21 1536550938 VLFHOTJCNBPEBN-LBPSXOOBSA-N 427.386 4.457 10 10 IICE CC[C@H](C)NC(=O)c1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1540845500 ZICVDZZRLCXUIW-KRWDZBQOSA-N 431.536 4.365 10 10 IICE Cc1cc(CC(=O)N[C@H](C)C2(N3CCOCC3)CCCC2)c(C)n1-c1ccc(Cl)cc1 1543468541 DKLPYNPHUFEZDQ-HXUWFJFHSA-N 444.019 4.440 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@]3(c4ccccc4)CCN(C(=O)OC(C)(C)C)C3)ccc21 1544164390 HSEBLNUYPQIEOC-MHZLTWQESA-N 449.595 4.264 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)OC(C)(C)C)C[C@H]3C)c2C)cc1 1556078294 CDUPKNNERSCSMC-QGZVFWFLSA-N 427.545 4.184 10 10 IICE O=C(NCC1CC(c2ccccc2)C1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1556324626 BCGMCHJOEGNUSU-UHFFFAOYSA-N 442.562 4.178 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1CCN(c2ccccc2F)C1 1556426672 WTTIFICQJDDXBG-SFHVURJKSA-N 441.547 4.041 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](CO)c2ccccc2C(F)(F)F)cc1 1558507493 HDQOXJAGTZWQAT-JOCHJYFZSA-N 444.453 4.318 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C/[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1F 1585698405 OEBQIYGBIVFTFV-IYPOZPNPSA-N 433.568 4.491 10 10 IICE CSc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)nc1 1585911517 UQJNSMBPQIQXRZ-XNTDXEJSSA-N 433.555 4.173 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccc(Cl)s3)cc2F)C[C@@H](C)O1 1596695240 OBKHRJSALMQPDZ-BETUJISGSA-N 448.951 4.474 10 10 IICE COc1cccc(N2CCC(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c1 1603529048 WTKLLUSWVIRIIP-UHFFFAOYSA-N 431.536 4.314 10 10 IICE CCO[C@H]1C[C@](NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1616581953 UVOPUZQKYQCGQN-CVDCTZTESA-N 432.948 4.224 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1F 1616925355 WPJPREZCNFYOFK-INIZCTEOSA-N 443.510 4.180 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1coc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1 1623387019 OIZPNXVLZXKDHS-IBGZPJMESA-N 428.533 4.085 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1cccc([N+](=O)[O-])c1 1623921316 PTTXBSBBSSCIIR-UHFFFAOYSA-N 430.508 4.212 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(O)cc1Cl 1632717451 BSSIGVOHLBEDML-CXUHLZMHSA-N 436.917 4.415 10 10 IICE Cc1ncc2c(n1)CCC[C@H]2NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1633351118 LPYHBLDWXBFVRA-LJQANCHMSA-N 440.345 4.157 10 10 IICE Cc1ccc(C(=O)N(C)Cc2ccccc2N2CCOCC2)cc1-n1c(C)cc(C=O)c1C 1633421044 JOEBMNGQRAXVNT-UHFFFAOYSA-N 445.563 4.324 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 1636262922 JWDSKYVLPADUIJ-DENIHFKCSA-N 446.599 4.366 10 10 IICE COc1cc(CN(C)C)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1642319193 ZFFQZCMGFQGWMY-UHFFFAOYSA-N 434.584 4.117 10 10 IICE COc1cc(I)c(Cl)cc1C(=O)N[C@H](C)c1ccccc1O 1643738888 WDQRVQINFIJPMO-SECBINFHSA-N 431.657 4.150 10 10 IICE CSc1cc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nc(SC)n1 1650643962 HTDCIKOIBYBFIN-UHFFFAOYSA-N 430.521 4.388 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](NC(=O)c3ccc(Cl)cc3)C2)c(C)n1-c1ccccn1 1652922577 NZGXEQXBLNFQLH-HXUWFJFHSA-N 436.943 4.177 10 10 IICE CN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CC[C@@H](C(F)(F)F)CC1 1681850248 URNAJHGVIWVKMV-GASCZTMLSA-N 435.437 4.064 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1c2ccccc2CC[C@@H]1n1ccnc1 1686826707 NQLFMVYLFOQLTO-PNTFMKQHSA-N 431.584 4.417 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C[C@@H](C)O1 1694919934 KJVGMCVLIQZTTL-KNQAVFIVSA-N 437.588 4.393 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](Cc3cnn(C)c3)C2)n1CCCSc1nccs1 1726933163 SUBJWLRMCGDJFL-SJORKVTESA-N 445.662 4.233 10 10 IICE CN(CCC(F)F)c1nnc(C2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1729497575 ANNXIWWFVQHVKE-UHFFFAOYSA-N 447.574 4.284 10 10 IICE CN(CCc1nccs1)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1729504872 BPYLXWCIISOOAC-UHFFFAOYSA-N 445.643 4.058 10 10 IICE CSc1ncc(C(=O)Nc2ccc(Cc3ccc(N)cc3)cc2)c(=NC2CCCC2)[nH]1 1866051841 OHSLWZMGXAAVJH-UHFFFAOYSA-N 433.581 4.400 10 10 IICE CC(C)(C)OC(=O)NCC1(F)CC(NCc2cc(Cl)cc(Br)c2O)C1 2042930047 YGTWSYPPDIFVAJ-UHFFFAOYSA-N 437.737 4.293 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1CN 2079953974 FWMBVYQOYICLNB-KRWDZBQOSA-N 427.330 4.077 10 10 IICE CCOc1cc(C=C2SC(NC(C)=O)=NC2=O)ccc1OCc1ccccc1Cl 2294208484 IUCMXVFUULMCKB-UHFFFAOYSA-N 430.913 4.424 10 10 IICE COC(=O)c1cc(-c2ccc(C=C3C(=O)NN(c4ccc(C)cc4)C3=O)o2)ccc1Cl 2297296481 BHVYVPKZWPLXFB-UHFFFAOYSA-N 436.851 4.156 10 10 IICE O=C1C(=Cc2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1c(F)cccc1Cl 2332144904 YBHQHNWXEKXKRM-UHFFFAOYSA-N 443.740 4.437 10 10 IICE C[C@@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccccc3Cl)s2)C1=O 11636140 DZMRKRRIFGOMGM-NSHDSACASA-N 440.015 4.355 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccc(F)cc4)C3=O)c2C)cc1C 16455274 USUYAFSEFOLHGA-SANMLTNESA-N 447.510 4.500 10 10 IICE O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccnc1)N1CCc2ccc([N+](=O)[O-])cc21 206434216 MDSSUCFCXOJWPD-LUAWRHEFSA-N 437.459 4.445 10 10 IICE COc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3C)C2=O)ccc1OCc1ccccc1 209558087 QSAOGHVPMLQDOS-ZHZULCJRSA-N 442.471 4.249 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)C1 436021650 JJIXFMNIWHSARW-QFQXNSOFSA-N 431.580 4.444 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cc3cn4ccccc4n3)no2)C1 584745738 RITVKTHPUVQGOL-UHFFFAOYSA-N 426.524 4.078 10 10 IICE CCOCCOc1ccccc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726567866 UWYNMYOOEYQKBY-UHFFFAOYSA-N 434.483 4.102 10 10 IICE CCCN1Cc2cccc(NC(=O)C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2C1 727609887 AKWJHNNDQGVENW-UHFFFAOYSA-N 444.579 4.117 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC1CCN(c2ccccc2)CC1 745738628 WBRKLWHTAVLJQD-UHFFFAOYSA-N 432.362 4.355 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)oc1C 751127286 KPQHGMAHKCIZKW-UHFFFAOYSA-N 446.428 4.025 10 10 IICE CC[C@@H](C)n1ncc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c1C1CC1 763112388 PHOMDMWTXFSVAU-QGZVFWFLSA-N 447.583 4.436 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 765771216 VPRJRZHFYRSJPA-STQMWFEESA-N 430.220 4.473 10 10 IICE CN(Cc1nc2ccccc2s1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769052368 AFOWDFKBBDBWBM-UHFFFAOYSA-N 449.624 4.170 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H](C)Oc2cccc(CO)c2)cc1 777395311 ZXTNQTRTTCVPAJ-LJQANCHMSA-N 434.536 4.254 10 10 IICE Cc1nc(F)ccc1/C=C1\SC(=S)N(C2CCN(Cc3ccccc3)CC2)C1=O 779203527 JGKMLNRHKLDXMC-UYRXBGFRSA-N 427.570 4.395 10 10 IICE CO[C@H](C)c1noc(CN(C)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)n1 799995570 OODLGMUAUVGJST-LSDHHAIUSA-N 435.956 4.008 10 10 IICE Cc1oc2c(CN3[C@H]4CC[C@H]3[C@@H](CO)C4)c(O)ccc2c(=O)c1-c1ccccc1Cl 811797962 XDXIOISIFZOCLQ-SIFCLUCFSA-N 425.912 4.473 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(F)(F)Oc2ccccc2)n1C[C@H]1CCCCO1 812444074 WXGUTHAJLWXSGG-LJQANCHMSA-N 444.482 4.318 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)c(C)n1-c1ccc(Cl)cc1 1136733652 CZYOWIXWROHTPX-FQEVSTJZSA-N 425.891 4.422 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082120 PLEAUEYTXOQFDG-WMLDXEAASA-N 438.906 4.312 10 10 IICE Cc1ccccc1[C@@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1137766231 BSDKZBUOBCIADC-LJQANCHMSA-N 428.330 4.023 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(CCC(F)(F)F)s1 1150353715 GGCNZRUNTBONHE-AWEZNQCLSA-N 447.910 4.391 10 10 IICE CSc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1Br 1167762184 IZMVQHNJEPWPKO-UHFFFAOYSA-N 435.387 4.062 10 10 IICE C[C@@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Cl)ccc1F 1231162612 GNEICDGXYRYXAX-GFCCVEGCSA-N 427.854 4.154 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(OCc4ccccc4F)CC3)C2)cc1 1252114641 DPXUIRRVSYITII-LJQANCHMSA-N 441.547 4.051 10 10 IICE CC(C)Cc1nnc(N2CCC(OC(C)C)CC2)n1Cc1ccc2c(c1)CCCN2C 1287426589 YXCDIKAHGZUSBR-UHFFFAOYSA-N 425.621 4.301 10 10 IICE COc1ccc(Cn2nnc(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)c2C)cc1 1287660796 LNTUYHPRNIROSW-UHFFFAOYSA-N 443.551 4.289 10 10 IICE Cc1ccccc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@@H]1CCC[C@H](C)C1 1293237405 XJYMBZXNQPJHCV-LBUQITIBSA-N 430.570 4.370 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1314480270 SUEYCMKOGDWBAV-GOSISDBHSA-N 425.602 4.331 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)CCC(F)F)cc1F 1314661743 YJZJMYOJEUTQMF-UHFFFAOYSA-N 438.885 4.338 10 10 IICE COc1ccc(CCCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1OC 1357835658 HVDXSSUCCFCRHD-HDICACEKSA-N 444.547 4.096 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(N=S(C)(C)=O)c2)cc1 1359896467 GWDQPQYIYGUBDU-UHFFFAOYSA-N 427.492 4.316 10 10 IICE CCc1c(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)nnn1Cc1ccccc1 1435077192 RNYVWADMSBDESE-UHFFFAOYSA-N 445.489 4.160 10 10 IICE COc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OC(C)C 1445879182 DITPNNGAOKNRRW-LJQANCHMSA-N 432.948 4.236 10 10 IICE C[C@@H](NC(=O)c1ccc(Cn2cc(N)c(C(F)(F)F)n2)cc1)c1ccc(N(C)C)cc1 1447971905 OPWWMGIVTKBXSX-CQSZACIVSA-N 431.462 4.089 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1 1463783117 FTSIRFZZMMROOS-DEOSSOPVSA-N 435.568 4.437 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc(OC(F)(F)F)cc1 1466398992 WBZAUAWNTHZHLM-UHFFFAOYSA-N 445.821 4.079 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(NC(=O)C(C)C)cc1 1467629588 QBQHMKCGCKCTBF-UHFFFAOYSA-N 439.556 4.283 10 10 IICE C[C@@]1(c2ccccc2)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1471562753 SNXZZAFDELWHBH-QFIPXVFZSA-N 442.562 4.406 10 10 IICE CO[C@H](Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1503994610 OGDCLNBWHQRFGU-JTHBVZDNSA-N 441.620 4.080 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)CC1 1517583861 IYQIBRXDBJVUPU-GOSISDBHSA-N 434.588 4.115 10 10 IICE C[C@H]1COc2ccccc2N1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1532846777 FBWDGAQICDZNJU-BXUJETTOSA-N 442.537 4.231 10 10 IICE CC[C@H](Cc1ccccc1Br)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1538747691 UKPJLKZJZBCTEF-AEFFLSMTSA-N 431.374 4.422 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H](CC(C)(C)C)c3ccccc3)CC2)cc1 1540817981 JTIUHMZBJFOFME-XYSUMVETSA-N 449.595 4.194 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc2c(s1)CCN(C(=O)OC(C)(C)C)C2 1556515485 AETHYJLNCIWYOI-UHFFFAOYSA-N 437.558 4.163 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(I)cn3)c2C)cc1 1559376105 UAYYGCKJAIAXAD-UHFFFAOYSA-N 449.292 4.177 10 10 IICE COc1ccc(N(Cc2nc(N)nc(Nc3ccc(F)cc3)n2)Cc2ccco2)cc1F 1559600442 WIHNVCSTFSFMEE-UHFFFAOYSA-N 438.438 4.284 10 10 IICE CCc1nc(C)c([C@H](C)N(C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)s1 1564895796 VBCPMYLZJAVLLG-AWEZNQCLSA-N 438.544 4.031 10 10 IICE O=C(NCC1(c2c(F)cccc2F)CCC1)N(Cc1ccccc1O)C[C@H]1CCCO1 1564931119 NHEITNYTDBCRRX-GOSISDBHSA-N 430.495 4.483 10 10 IICE Cc1cc(C(=O)N(CCO)[C@H](C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1566969384 JHVMVFVSYFDLNP-MRXNPFEDSA-N 442.357 4.447 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3ncn(C)c3=O)cc2)c(C)n1-c1cccc(C(C)C)c1 1566992034 GPTBUKWJSWYPMV-UHFFFAOYSA-N 429.524 4.354 10 10 IICE Cc1cc(CC(=O)N(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)c(C)n1-c1ccccc1 1583181219 YPKMLXQQHFPLPA-NRFANRHFSA-N 442.968 4.277 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCC(=O)N3CCC(c4ccccc4)=N3)c2C)c1 1596472069 LFJNDOWVSJHISH-UHFFFAOYSA-N 442.563 4.436 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2CCCCC2)CCOC1 1610359259 GSNAQFDCMBKGAR-DEOSSOPVSA-N 428.577 4.241 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](C(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1613267248 GSBSZYJNWVJEGQ-MJGOQNOKSA-N 433.547 4.158 10 10 IICE CN(CC(C)(C)C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCSCC2)cc1 1617820296 POAPKCZOKVRKDD-UHFFFAOYSA-N 438.645 4.367 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1 1617879950 QEVGMXYMSSGUTN-IBGZPJMESA-N 444.597 4.255 10 10 IICE COc1cc2c(c(OC)c1)N(Cc1csc(-c3ccc(S(C)(=O)=O)cc3)n1)CCC2 1618569191 PWASQMODZRJYPR-UHFFFAOYSA-N 444.578 4.184 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(N3CCc4ccccc4C3)cc2)N(C)C)cc1 1618635204 GXSUNWCIRHQQHK-MHZLTWQESA-N 442.607 4.348 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](O)COc1ccccc1Br 1629782985 HFSOVYCOJUJMLD-OAHLLOKOSA-N 449.370 4.088 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@H](C(F)(F)F)CN1C(=O)OC(C)(C)C 1631265445 BSSRKHFMFLUEJK-WMZOPIPTSA-N 443.510 4.289 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cccc(C(F)(F)F)c1=O 1631530975 COCXHPFUNHNNNO-MRXNPFEDSA-N 430.426 4.363 10 10 IICE CC(C)([C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1ccc(F)c(F)c1)N1CCCC1 1632651799 MVCYWQOFWYUVQF-LJQANCHMSA-N 429.471 4.473 10 10 IICE COC(=O)c1cn(-c2cccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)c2)nn1 1636413905 SBPBTTCMHZCDEB-UHFFFAOYSA-N 429.480 4.022 10 10 IICE C[C@@H]1Cc2cc(Cl)ccc2N1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1648207579 PEXAGQJYKRBSKL-GFCCVEGCSA-N 448.953 4.499 10 10 IICE CC(=O)N1CCCCC[C@@H]1C1CCN(Cc2cc(Br)cc(F)c2O)CC1 1651748326 IQBGUZMZHCNRBZ-LJQANCHMSA-N 427.358 4.297 10 10 IICE O=C(NCc1cc(Br)ccc1Br)N1Cc2cccc(O)c2C1 1671814092 RNBWICNZDKFNKK-UHFFFAOYSA-N 426.108 4.143 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@H](c4ccc(F)cc4Cl)C3)C2)cc1 1683339855 IATWEZAYSQLTSM-AOMKIAJQSA-N 447.938 4.097 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC[C@H](c3nc(C)no3)C2)cc1 1695622662 XECHYEOYIJWPSM-FQEVSTJZSA-N 437.592 4.371 10 10 IICE C#CCN1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C/C=C\CC)CC1 1705635119 RTHPZZLFUVZJKQ-XFFZJAGNSA-N 428.584 4.074 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1COCCO1 1708575478 XIDQDLRAWFNCLO-PGRDOPGGSA-N 437.588 4.250 10 10 IICE CCOCCN(CC)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1710817281 BLFKQNOAXCEFLZ-UHFFFAOYSA-N 448.615 4.488 10 10 IICE CCc1nnc(N(C)Cc2ccc(C)s2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1762866177 VSLGJKYBCCMGRK-UHFFFAOYSA-N 439.629 4.104 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 1859466351 RMHZIANLWZZDGI-UHFFFAOYSA-N 441.443 4.223 10 10 IICE CC(C)OCCOc1cn(CCO)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1870994543 UORCJQLZDYNHKX-UHFFFAOYSA-N 437.540 4.000 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@]1(C)CNCc1cc(Br)ccc1O 2102786708 RNWZBKBNZFSXRR-QGZVFWFLSA-N 435.309 4.279 10 10 IICE CCCC[C@H](CNC(=O)OC(C)(C)C)NCc1c(Br)ccc(OC)c1O 2227747686 DXOFSYWKKWPCGX-CYBMUJFWSA-N 431.371 4.336 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c1O 2236051495 UHEPAXRVWRPFPB-KBPBESRZSA-N 443.382 4.336 10 10 IICE Cc1cc(N2Cc3ccccc3C2)ccc1C=C1C(=O)NC(=O)N(C2CCCCC2)C1=O 2294581492 MDGANJBJWVBNMS-UHFFFAOYSA-N 429.520 4.310 10 10 IICE CC(C)c1ccc(N2C(=O)NC(=O)C(=Cc3cc4c5c(c3)CCCN5CCC4)C2=O)cc1 2295959127 RVVTTWVPYTWKPM-UHFFFAOYSA-N 429.520 4.175 10 10 IICE COC(=O)c1[nH]c2ccccc2c1C=C1SC(=S)N(c2ccc(C(=O)O)cc2)C1=O 2296599797 ZYIJZYQMDHLRTD-UHFFFAOYSA-N 438.486 4.059 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCCCOc1ccc(OC)cc1 2297347266 UNRWXLDLUFTYNM-UHFFFAOYSA-N 445.562 4.431 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=CNC2Cc3ccccc3C2)cc1 2313710597 IIMKSJVTTBMVMC-UHFFFAOYSA-N 439.515 4.096 10 10 IICE COc1ccccc1C=C1SC(=S)N(CCCC(=O)Nc2ccc(O)cc2)C1=O 2314831703 QFQKRNOOYXNCEF-UHFFFAOYSA-N 428.535 4.021 10 10 IICE O=C(O)C[C@@H](C(=O)O)N1C(=O)C(=Cc2c3ccccc3cc3ccccc23)SC1=S 2314842311 NRVRHHJXLDQJFI-KRWDZBQOSA-N 437.498 4.122 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)cc1 2321614920 TZKMIBMHMZBVCU-UHFFFAOYSA-N 444.553 4.479 10 10 IICE CCOc1cc(C=C2C(=O)N(CC)N=C2c2ccc(OC)cc2)cc(Br)c1O 2332111083 WRBLCXZSGFKKTM-UHFFFAOYSA-N 445.313 4.212 10 10 IICE COc1cc(OC)c(OC)cc1C=C1C(=O)N(Cc2ccc(F)cc2)N=C1C(F)(F)F 2332141206 NGUHMXDEQQTNDK-UHFFFAOYSA-N 438.377 4.196 10 10 IICE CCN(C(=O)OC(C)(C)C)C(C)(C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381135420 QEGZEIJWXICTCU-UHFFFAOYSA-N 443.382 4.457 10 10 IICE CCOc1ccc2ccccc2c1C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1 11853398 BVADDTULRREBRT-UHFFFAOYSA-N 447.579 4.189 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCc2sc(C(=O)N3CCCC3)cc2C1 96398322 OUDVSTYCLXEMQX-IBGZPJMESA-N 437.609 4.006 10 10 IICE Cc1noc(CCNC(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 725870155 BBXZGXCXRXYMCK-SFHVURJKSA-N 447.461 4.415 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC(N(C)C(=O)OC(C)(C)C)CC3)ccc21 730562612 OMAWOSLSWKKISJ-UHFFFAOYSA-N 443.588 4.376 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Cc1ccc(Br)cc1O 781947522 UYHMIJBINNKRFM-UHFFFAOYSA-N 443.135 4.214 10 10 IICE CCCc1ccc(-c2ccc(NC(=O)C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc2)cc1 785296324 CXIWWMQSWLXXPL-KRWDZBQOSA-N 432.520 4.403 10 10 IICE C[C@@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc(N2CCOCC2)cc1 798061021 RIRHQGODAIDQRZ-YSGRDPCXSA-N 431.483 4.041 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3C[C@H](C[C@@H]4COCC(=O)N4)c4ccccc43)c2C)c1 807705042 AXDYEJDANHVLOR-LEWJYISDSA-N 443.547 4.052 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(N3C(=O)N[C@@H](C)C3=O)c2C)c1 813853062 ZMPZUWVZFMGNFI-SFHVURJKSA-N 430.508 4.408 10 10 IICE O=C(/C=C\c1ccc2ccc(Cl)cc2n1)NCc1ccc(N2CCOCC2)c(F)c1 917707559 NKFOAODOEJMIHW-VURMDHGXSA-N 425.891 4.194 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccccc1SCc1cscn1 919767536 QPEOJXALNLDUAY-UHFFFAOYSA-N 425.579 4.202 10 10 IICE Cc1sc2ncc(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)c(=O)n2c1C 1128384014 HWTMQTMESPFGGH-ZDUSSCGKSA-N 444.988 4.193 10 10 IICE COc1csc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1134750678 JGRRACJRXVWDST-UHFFFAOYSA-N 429.299 4.481 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1F 1144977441 HXTMOQNKJYXQMU-QFIPXVFZSA-N 427.520 4.089 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@H](C)NC(=O)c3ccccc3)cc2Cl)C1 1155726750 MCWRUHSFNQJGRG-ROUUACIJSA-N 427.976 4.401 10 10 IICE Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1167762199 JIELFYMTZNKNAC-UHFFFAOYSA-N 439.556 4.233 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 1294859088 HYDOUWJJXLLAEM-ZACQAIPSSA-N 438.877 4.347 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)cc1C 1305463542 NQBJTYNVSXUOQQ-PGRDOPGGSA-N 434.588 4.267 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(C)OC[C@@H]1C 1314479194 HMMLBTWPIXEFDF-IBGZPJMESA-N 437.588 4.393 10 10 IICE NC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)c1 1318191625 RBLOVAYNKVKDET-UHFFFAOYSA-N 435.530 4.377 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1442871060 FAHUTHFGUXPKAL-LJQANCHMSA-N 439.556 4.284 10 10 IICE CN(C)c1ccc([C@H](CNc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)N(C)C)cc1 1458678193 BKBOJLRUUXOAAB-QFIPXVFZSA-N 435.528 4.350 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H](c3ccccc3F)C(C)C)CC2)cc(OC)c1OC 1478939247 WMXRGXPMKPLWEV-JOCHJYFZSA-N 445.535 4.080 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H](OC)C(C)(C)C 1503012581 SUTHUPZWGYGXOV-OAQYLSRUSA-N 429.609 4.112 10 10 IICE C[C@@H]1CN(C(C)(C)Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)C[C@@H](C)O1 1512365919 RAYMIBZXCVBYGA-RTBURBONSA-N 443.636 4.097 10 10 IICE CCc1nnc(N2CCC(C(F)(F)F)CC2)n1Cc1ccc(N2CCSCC2)cc1 1513842691 CWWDQJSPWQDJLE-UHFFFAOYSA-N 439.551 4.221 10 10 IICE COc1cc(C)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1519674528 MJIOOOGIAIZCIV-LDADJPATSA-N 430.526 4.373 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(Br)cnc2F)cc1 1533210421 OBDRODXBQDMGNE-UHFFFAOYSA-N 432.293 4.485 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4cc(C(F)(F)F)ccc4n3C)C2)cc1 1537108760 DGXYLAHBUCNGMG-OAHLLOKOSA-N 431.458 4.462 10 10 IICE CC(C)c1sc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)nc1-c1ccccc1 1542205010 NGXOYOAKHJKRIE-UHFFFAOYSA-N 431.539 4.263 10 10 IICE CCOCCC1(Cn2c(C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCCC1 1548227224 JGXCVOAJQJXCKX-UHFFFAOYSA-N 441.620 4.299 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCc2cn(C)c3cc(Cl)ccc23)cc1 1564568207 UVDJVGJFEARXPD-UHFFFAOYSA-N 428.964 4.161 10 10 IICE CC(C)CCOc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)nn1 1586278077 QHVWGJWNZOSZMH-UHFFFAOYSA-N 435.572 4.261 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccc(F)cc1 1587541285 BKOXELDDKPSUCJ-OAHLLOKOSA-N 428.529 4.170 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3coc4c(C)c(Cl)ccc34)CC2)c(OC)c1 1595996578 HAEAXENBXWKGEX-UHFFFAOYSA-N 428.916 4.303 10 10 IICE O=C(CSc1ccccc1C(=O)NCc1c(O)cccc1O)NC1CCCCCCC1 1597568144 AUCIUSGKNYAIIE-UHFFFAOYSA-N 442.581 4.349 10 10 IICE Cc1c(C(=O)NCc2c(O)ccc3ccccc23)nnn1-c1cccc(Br)c1 1597736340 DJXYOTUTYNNLIE-UHFFFAOYSA-N 437.297 4.127 10 10 IICE Cc1nc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)sc1C 1622142618 IPNNNKRMUNKVJL-UHFFFAOYSA-N 433.375 4.297 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(OCc2cn3cc(C)ccc3n2)cc1 1627026616 QJKODIDRJNHYOY-UHFFFAOYSA-N 436.508 4.343 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(O)cc(Br)c2)cc1 1627204529 BVSOXRCWWMPGRK-HXUWFJFHSA-N 433.346 4.042 10 10 IICE CC(C)COc1ccccc1[C@H](CC(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1629462382 QBQRKGORLZFINM-FQEVSTJZSA-N 448.585 4.316 10 10 IICE C[C@H](NC(=O)Cc1cc(C(F)(F)F)cc(Cl)n1)c1ccc(N2CCOCC2)cc1 1631363643 WVPNEUHKNNRGTC-ZDUSSCGKSA-N 427.854 4.010 10 10 IICE COC(=O)/C=C/c1ccc(N(C)C2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1650893846 POAXWSPHSUYWRW-RSSWOYORSA-N 445.516 4.148 10 10 IICE Cc1cc(CC(=O)NCC[C@H](NC2CC2)C(F)(F)F)c(C)n1-c1ccc(Cl)cc1 1651257708 GYSLDMNDDJMICZ-IBGZPJMESA-N 427.898 4.479 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(O)(c4ccc(F)cc4)C3)cc2Cl)C1 1680563446 XBVHGTWUPZSEPN-MRXNPFEDSA-N 431.939 4.128 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(O)Cc2cc(Cl)cc(Cl)c2)N(C)C)cc1 1687806358 FGDDSVYQZBXHKZ-IBGZPJMESA-N 425.360 4.263 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(c3ccnn3C)CC2)n1Cc1ccc(N(C)C)cc1C 1694052247 XBTMXDUFSJJGLC-GOSISDBHSA-N 435.620 4.332 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(C)C)C1 1706057600 MFBFFQIIHZIHMF-JOCHJYFZSA-N 448.615 4.361 10 10 IICE CCOC1CC(CCn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)C1 1710577889 SYALNZPMTLTULC-UHFFFAOYSA-N 441.620 4.332 10 10 IICE CC(C)(C)c1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCSCC2)cc1 1722897508 DIRNZHYBMJGLOQ-UHFFFAOYSA-N 435.588 4.413 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCC[C@H]1OC 1727004259 VWGCYDWLSNGLNO-BBTUJRGHSA-N 445.583 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2C[C@@H](C)N(CC)C[C@@H]2C)cc1 1728379089 GFOFJFRSXBMRAX-RTWAWAEBSA-N 449.647 4.097 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@]1(O)CCCC1(C)C 1729419346 SHKQACMAARATJB-HSZRJFAPSA-N 441.963 4.277 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1Cc1nnc(C(C)(C)C)s1 1729420784 VNAFZSCCICMMDK-KRWDZBQOSA-N 442.589 4.059 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1746089988 XMGIXRIXVCIXAC-QFIPXVFZSA-N 434.588 4.240 10 10 IICE C[C@H]1C[C@@H]1n1c(C2CCN(C(=O)OC(C)(C)C)CC2)nnc1N(C)Cc1ccccc1O 1752055763 SELWITIFXAPDHU-LPHOPBHVSA-N 441.576 4.316 10 10 IICE C[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C[C@H](C)S1 1752359707 MUDPJOZFERYJAQ-OALUTQOASA-N 443.661 4.082 10 10 IICE CSCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1770598661 NZSZZCGKPDKDFH-GOSISDBHSA-N 425.602 4.331 10 10 IICE CC(C)CN1C(=O)/C(=C\c2ccc(OCC(=O)NCc3ccccc3)cc2)SC1=S 1871287686 UODCZFBBOMKTQE-UDWIEESQSA-N 440.590 4.239 10 10 IICE COc1cc(C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc(OC)c1Br 1891296831 KYEPFIUATDWOEY-YJBOKZPZSA-N 445.357 4.385 10 10 IICE CC(C)(C)OC(=O)N1CC(=O)C[C@@H]1c1cc(Br)cc(Br)c1O 1951977772 PCSRLTNXMUSVMV-GFCCVEGCSA-N 435.112 4.168 10 10 IICE Oc1cccc(Br)c1Cn1ncc(C2CCC2)c1I 2070223585 UDNVQJDBMLTOEQ-UHFFFAOYSA-N 433.087 4.272 10 10 IICE Cc1ccc([C@H](C)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c(O)c1 2084722863 TVSUZTCQYAVNNU-RBBKRZOGSA-N 439.600 4.473 10 10 IICE CNCc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(Br)c1 2186720563 JVUKIHSPHAYTQL-IBGZPJMESA-N 442.323 4.422 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CCCCN2C(=O)OC(C)(C)C)c1O 2236057110 ZPBSCRGUMPBPHK-CQSZACIVSA-N 443.382 4.433 10 10 IICE COc1cc(C=C2SC(=S)N(CNc3cccc(F)c3)C2=O)cc(OC)c1OC 2297322538 ITGJIAQANMFIDY-UHFFFAOYSA-N 434.514 4.122 10 10 IICE C[C@@H](Oc1ccc(C=C2C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1)c1ccccc1 2297358796 HXGJYYUVDGIFGQ-GOSISDBHSA-N 426.472 4.489 10 10 IICE C[C@H]1CN(C2=NC(=O)C(=Cc3cn(-c4ccccc4)nc3-c3ccncc3)S2)C[C@@H](C)O1 2314457975 ZMSDAPPANQSZRZ-CALCHBBNSA-N 445.548 4.014 10 10 IICE CCOc1ccc(C=C2SC(=S)N(Cc3ccc(C(=O)O)cc3)C2=O)cc1OC 2323844217 JWBOAYUPZBMPDQ-UHFFFAOYSA-N 429.519 4.194 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)c(O)c1Br 2381133780 SNHHICIZCKGWKJ-UKRRQHHQSA-N 441.366 4.020 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccc(F)cc4)C3=O)c2C)cc1C 16455275 USUYAFSEFOLHGA-AREMUKBSSA-N 447.510 4.500 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCCC(=O)O 210445041 LDHBHPNGFWCAAS-YVLHZVERSA-N 433.482 4.094 10 10 IICE COc1cc(C)c(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1OC 743070401 JVLPHTHLFFIEME-OAHLLOKOSA-N 435.471 4.404 10 10 IICE CCC(CC)c1cc(CNC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)on1 768730006 MXTBNXAEGHKVJL-UHFFFAOYSA-N 439.604 4.110 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCCOC3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802682731 OLCZDXBWJNLNCZ-GMAHTHKFSA-N 449.599 4.394 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1C[C@H]1c1ccc(Br)cc1 804739800 UDWFHDMOHNBXIE-LSDHHAIUSA-N 425.120 4.337 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCc4[nH]c5ccccc5c4C3)cc2F)C[C@H](C)O1 918223371 ZZZHJGDKNRQUFL-IRXDYDNUSA-N 436.531 4.189 10 10 IICE CCOc1cc(CN[C@@H](C)c2ccc(N3CCOCC3)cc2)cc(Br)c1O 920867916 BMWFPLINJMPHQI-HNNXBMFYSA-N 435.362 4.241 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c1 1136493960 TVYRYLHRWRKUNK-UHFFFAOYSA-N 447.516 4.354 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@]3(C)CC(c4ccccc4Cl)=NO3)CC2)cc1 1136546291 CKPFARFSEJLCFJ-QHCPKHFHSA-N 427.932 4.017 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 1138290318 ZDHWGKJSSXNTGL-FQEVSTJZSA-N 439.556 4.426 10 10 IICE C[C@H](NC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1)c1ccc(N(C)C)cc1 1138364137 SQCRCSVPWIAQCM-INIZCTEOSA-N 449.642 4.306 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 1142352140 SKHZUYFRBQCKKB-AZUAARDMSA-N 439.556 4.330 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(C(N)=O)c(N2CCCCC2)c1 1146488562 LQGNRAJZZGTANH-UHFFFAOYSA-N 444.535 4.248 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1226235794 OPBHBGLYWKGETD-PKOBYXMFSA-N 440.975 4.181 10 10 IICE CCCCOc1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1Cl 1234287717 ZPWLGOQLWOJXLU-UHFFFAOYSA-N 445.991 4.479 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cccc(Oc4ccccn4)c3)cc2F)CC1 1265011927 GWWNLCMLOVTKPX-UHFFFAOYSA-N 434.515 4.085 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C)N(C(=O)OC(C)(C)C)[C@@H](C)C3)ccc21 1265185913 ZXRTXRPEGYZTMB-IRXDYDNUSA-N 443.588 4.374 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC[C@@H]1C 1287363536 JLXKHFQFGFJUOA-RBBKRZOGSA-N 425.621 4.386 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ncsc1Nc1cccnc1 1294860528 VSVXAMMQTUQZHZ-QGZVFWFLSA-N 443.960 4.035 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC[C@H](NC(=O)C(C)C)C2)cc1 1295411473 UCUAJCDKEIBMCA-NRFANRHFSA-N 440.636 4.037 10 10 IICE CN(Cc1ccon1)c1nnc(Cc2ccc(F)cc2)n1CCCSc1nccs1 1298472236 PWYHTHDCUDWQSI-UHFFFAOYSA-N 444.561 4.271 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCn3c(S)nc4ccccc4c3=O)c2C)c1 1306884680 FTMOCKYZHRFJHZ-UHFFFAOYSA-N 446.576 4.108 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1cccc(C(=O)OC(C)(C)C)c1 1312372920 XLBDGMWBKOAHIL-SFHVURJKSA-N 425.573 4.447 10 10 IICE COc1ccc(CCNC(=O)NCc2cc(Cl)cc(Cl)c2O)c(Cl)c1OC 1312759390 WPYNDLVBUQREIG-UHFFFAOYSA-N 433.719 4.412 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CC(F)(F)F)C3)N(C)C)cc1 1313394904 WCCZWJJIJJAHMX-UFYCRDLUSA-N 426.527 4.260 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CCCc1cnn(C)c1 1314736868 NZIBHPBODFTHQG-UHFFFAOYSA-N 435.620 4.179 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1Cc1cc(Br)cs1 1314753216 MQJFEQFNPBFVQZ-UHFFFAOYSA-N 433.375 4.445 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@H](C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CC1=O 1351110874 KVTBEIGISSXLMK-LEWJYISDSA-N 449.595 4.301 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)C2CC2)cc1 1353229844 VOQJXAQQYYPVPD-IBGZPJMESA-N 437.531 4.136 10 10 IICE C[C@H](NC(=O)[C@H](C)Cc1ccc(OC(F)(F)F)cc1)c1ccc(N2CCOCC2)cc1 1356165677 PJSMCNQBZRLPGV-SJORKVTESA-N 436.474 4.478 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1CCC[C@@H]1C1CC1 1436752361 VXAJECIETISHRU-WNDBXZGCSA-N 432.586 4.360 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(S(=O)(=O)C2CCCC2)ccc1F 1440712537 FAXFSQAFPNEDAE-UHFFFAOYSA-N 444.572 4.414 10 10 IICE COc1cccc2ncnc(NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)c12 1458370086 RTMBGUATBLMZOX-LJQANCHMSA-N 437.544 4.382 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@H](CNC(=O)OC(C)(C)C)C3CC3)c2C)cc1 1467312537 DMAGFNXMEJYCLH-JOCHJYFZSA-N 441.572 4.478 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2C)c1 1468017802 PAGSUVMFKBFSKG-RTBURBONSA-N 447.501 4.194 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(=Cc4cccc(OC)c4)CC3)C2)cc1 1470594896 XDEBXRWNYUXPGE-QFIPXVFZSA-N 435.568 4.419 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2C[C@H](O)CC3(CCCC3)C2)nnc1C(C)(C)C 1510684886 YENZQRXOQIVAGQ-OAQYLSRUSA-N 425.621 4.130 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCC1(C)C 1516454070 GHAIABXTPKBGRG-NRFANRHFSA-N 441.620 4.114 10 10 IICE COc1cc(N2CCN(C(=O)C[C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)cc(OC)c1OC 1521836737 LABNXLUWNKTPLO-HZPDHXFCSA-N 444.494 4.120 10 10 IICE CCSCC[C@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1523667031 DGTXAGSPPFDJHX-WIOAZZGGSA-N 426.604 4.065 10 10 IICE Cc1cc(-c2csc(NC(=O)c3nnn(C(C)(C)C)n3)n2)c(C)n1-c1ccc(F)cc1 1525994278 HBEWVUPTARTCBI-UHFFFAOYSA-N 439.520 4.351 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3cccc(OC(F)F)c3)cc2F)C[C@H](C)O1 1527482573 ZFMVCNZQPBOPNA-HOTGVXAUSA-N 436.474 4.290 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)cc1Cl 1527863949 AIRYXPRRTZNSKG-UHFFFAOYSA-N 434.792 4.404 10 10 IICE CCc1nnc(N2CCO[C@H](c3ccccc3C)C2)n1CCCSc1nccs1 1546549286 IKVBKZJLJGHWAA-SFHVURJKSA-N 429.615 4.366 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](CC)Oc1ccccc1F 1556426604 UBIJKGBCRXLKCJ-NRFANRHFSA-N 430.520 4.372 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1 1556897517 MSPCVPRJHBERBU-RLWLMLJZSA-N 429.564 4.228 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)cc1 1557355094 BXUVGYWBUDIZSV-GOSISDBHSA-N 441.572 4.489 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnnn1-c1cc(Cl)ccc1Cl 1585264146 MWTKWWPCYJDPSF-AWEZNQCLSA-N 432.355 4.310 10 10 IICE CCN(C[C@H]1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)C1)CC(F)(F)F 1587635488 MPRRKTJHQWFYDS-HXUWFJFHSA-N 449.517 4.182 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(C3CC3)[C@H](C)c3ccc(Cl)cc3)CC2)cc1 1615906772 GRCYCGDVYFMSPP-NTKDMRAZSA-N 444.019 4.057 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1CCCC2(CCC2)O1 1616245301 LLGGKRBZTWPABX-XIDKLXSXSA-N 448.585 4.025 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCc2ccc(Br)cc2)N(C)C)cc1 1618643943 QIWLMMNHJUGBOS-OAQYLSRUSA-N 432.406 4.257 10 10 IICE Cc1cc(C)cc(-n2ccnc2SCC(=O)NCc2cccc(Br)c2O)c1 1623363572 HPUITLGNYXFNLK-UHFFFAOYSA-N 446.370 4.366 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1csc([C@H](C)NC(=O)OC(C)(C)C)n1 1626722851 LGQDNDGINXCYQA-CVEARBPZSA-N 446.617 4.464 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccccc1Sc1ccc(Br)cn1 1626838232 SPFXXMSRQSHEDU-UHFFFAOYSA-N 431.311 4.337 10 10 IICE C[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(C)c2ccccc12 1630261866 DOIDJNKTUOMWTN-VQIMIIECSA-N 425.960 4.422 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](C(=O)N(Cc3ccco3)Cc3ccccc3O)[C@@H]2C1 1635647590 NLNKQVICDUTDPN-ZVDOUQERSA-N 426.513 4.017 10 10 IICE COC(=O)CC1(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCCC1 1635736612 KACVGAFKFNWMGE-UHFFFAOYSA-N 433.346 4.462 10 10 IICE CCn1cc(CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 1635942014 ZJJASIVPWMPLFU-FQEVSTJZSA-N 425.960 4.344 10 10 IICE COC(=O)c1cc(Br)cc(NC(=O)c2cc3cc(O)c(O)cc3s2)c1C 1638316593 HFLDTAPOADQIBN-UHFFFAOYSA-N 436.283 4.422 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4ccc(C(F)(F)F)cc4nc3O)C2)cc1 1639686581 DDXSWUNTTCFNME-AWEZNQCLSA-N 445.441 4.224 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@@H]2C[C@@H](C)O)c(C)n1-c1ccc(Br)cn1 1640432422 DFWHOVHCBRPLIM-CRAIPNDOSA-N 434.378 4.407 10 10 IICE COc1cc([C@@H](C)NC(=O)c2sccc2-n2c(C)ccc2C)ccc1S(C)(=O)=O 1648129011 YMUWYZKNNFQRGS-OAHLLOKOSA-N 432.567 4.059 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H]3CCCCC[C@@H]3c3ccc(Cl)cc3)nc12 1653588180 HIBPNBXHDPYUOI-QUCCMNQESA-N 442.947 4.471 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)[C@@H](C)Cc3ccccc3)nc12 1654300895 NNHDMWCTQGAAFI-IBGZPJMESA-N 444.535 4.245 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)c1O 1658608031 OVHGYODDHGGWOL-OAQYLSRUSA-N 428.960 4.352 10 10 IICE CC[C@@H](CN(CC)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccccc1 1685244373 PNEAGBFBWDDDRY-NRFANRHFSA-N 436.600 4.114 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCS[C@@H](C)C1 1693006376 XOJMYGCQCMBJMB-KRWDZBQOSA-N 427.643 4.295 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(CC(C)(C)C)n1CCCSc1nccs1 1695696532 BMMFZGGNFGCWBT-UHFFFAOYSA-N 433.651 4.266 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1708362938 WKUPKQSZVDCASC-VMMOAZFZSA-N 444.620 4.336 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@H](C3CCOCC3)C2)cc1F 1711006207 HIYGTIVWHYGTBB-FQEVSTJZSA-N 443.611 4.373 10 10 IICE COCCCCCn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1712362470 SVLJXGAIFMAUQO-UHFFFAOYSA-N 443.636 4.409 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1712776589 BIZCOHLVKOMFEE-WIYYLYMNSA-N 447.624 4.495 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1 1730444671 JHMSWXPZGBFDKH-QGZVFWFLSA-N 434.544 4.260 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1743827894 FBTXKSJKZZOLLA-IBGZPJMESA-N 434.588 4.016 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1744778358 GKZFTICMBJPTIK-JPYJTQIMSA-N 448.615 4.456 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@H](C)O[C@H](C4CC4)C3)nnc2C(C)(C)C)cc1 1764936157 CXYNGTGDRGXQQL-AVRDEDQJSA-N 425.621 4.474 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2(C)CC2)c(CO)c1I 2079025515 NRUQEOKXMZVEHH-AWEZNQCLSA-N 426.298 4.045 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCC[C@H]2CNC(=O)OC(C)(C)C)c1O 2236056752 XHNOWNAACCZUEP-XJKSGUPXSA-N 443.382 4.336 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OC(=O)c1ccccc1Cl 2297347716 WNWZJVHVSOMMKL-UHFFFAOYSA-N 437.839 4.018 10 10 IICE CSCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccccc3F)o2)SC1=S 40567391 LQGYHWGWEKPFSS-KWZJRMENSA-N 437.539 4.493 10 10 IICE O=C(COc1ccc(/C=C2/SC(=S)NC2=O)cc1)Nc1cccc(C(F)(F)F)c1 210893561 RKMLUZZOENPHGQ-OVCLIPMQSA-N 438.452 4.212 10 10 IICE COc1ccc(OC)c(NC(=S)NNc2nnc(-c3ccccc3)n2-c2ccccc2)c1 726456603 GJTJPDLBXWJESE-UHFFFAOYSA-N 446.536 4.265 10 10 IICE C[C@H](Cn1ncc2ccccc2c1=O)N[C@H](C)c1cc(Br)cc(Cl)c1O 756777230 HABZIIATRDVSPH-VXGBXAGGSA-N 436.737 4.257 10 10 IICE COc1c(C)c2c(c(O)c1C/C=C(/C)CCC(=O)N(C)Cc1ccccc1O)C(=O)OC2 767186075 ISMNLPVOYADMOT-DHDCSXOGSA-N 439.508 4.013 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1c(F)cccc1F 768697853 YHEDPPRQELZXET-KRWDZBQOSA-N 428.527 4.057 10 10 IICE O=C(N[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1)c1ccc2ccccc2c1 770306741 PTCTTYWGRPJYGS-RUZDIDTESA-N 429.564 4.071 10 10 IICE COc1cnccc1[C@H](C)NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 783867522 JGMYRQDJQYNTSK-MFVBVHDHSA-N 447.607 4.011 10 10 IICE CC(C)n1ncc2c(C(=O)NCc3cc(Br)ccc3O)cc(C3CC3)nc21 804736719 YQTQYLUGGVHWMW-UHFFFAOYSA-N 429.318 4.288 10 10 IICE C[C@H](Cc1cncc2ccccc12)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 805193943 DVHASHBSECDZNU-OAQYLSRUSA-N 442.607 4.262 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1cc(Cl)ccc1C(=O)c1ccc(F)cc1 808575408 MCUMCZROEUHGTO-UHFFFAOYSA-N 442.299 4.206 10 10 IICE Cc1cc(Br)cc(CN2CC[C@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c1O 856558233 DFJVIXBKIIUWLK-NRFANRHFSA-N 448.405 4.352 10 10 IICE Cc1c(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c2ccccc2n1C 1084097640 ZSNDMPIIWWJJAT-XNTDXEJSSA-N 428.275 4.460 10 10 IICE CCOC(=O)c1c(NC(=O)c2nnn(C(C)(C)C)n2)sc(C)c1-c1ccc(F)cc1 1124557799 DEHBTVHRIAZKMH-UHFFFAOYSA-N 431.493 4.033 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)Nc2cccc(N3CCOCC3)c2)C1 1125848191 CRVJSSYDFYXNJK-UHFFFAOYSA-N 437.540 4.069 10 10 IICE CNS(=O)(=O)c1cccc([C@H](C)NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c1 1136591111 LAPULOFYKLGLEM-SFHVURJKSA-N 439.581 4.110 10 10 IICE O=C(Cc1c[nH]c2nccc(Cl)c12)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1137082416 YRIMTBVSJIQNCB-CQSZACIVSA-N 434.874 4.145 10 10 IICE Cc1ccc(C(=O)NCC2CCN(CC(F)(F)F)CC2)cc1-n1c(C)cc(C=O)c1C 1138240128 BUVBZYRVFOWLGP-UHFFFAOYSA-N 435.490 4.219 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1139897418 KPSMIRZYYHVUPL-QGZVFWFLSA-N 429.561 4.478 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cccc(C(=O)N2CCCC2)n1 1152394291 FJJNMMAMSYDGHO-IBGZPJMESA-N 429.520 4.427 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1294457527 NGEDNRLDWXPLPZ-FPOVZHCZSA-N 426.653 4.382 10 10 IICE COC(=O)[C@@H](Cc1ccccc1O)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1301179174 QEQNSPNQWDILJM-JOCHJYFZSA-N 446.507 4.388 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N(Cc1ccnn1C)C1CC1 1304238522 SXUHCPXFNRXFNX-UHFFFAOYSA-N 435.620 4.192 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)C(C)(C)C 1306785510 PDQRULBXRMVJIX-UHFFFAOYSA-N 436.604 4.361 10 10 IICE COc1ccc(N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1Cl 1307556283 WPWKQQZICWLNSX-UHFFFAOYSA-N 434.879 4.199 10 10 IICE Cc1occ(C(F)(F)F)c1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1354327092 FMHXYQNZSXPXNA-UHFFFAOYSA-N 436.352 4.392 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(F)(F)c3cc(F)cc(F)c3)cc2F)C[C@H](C)O1 1355131082 SNUTUQWVXYGQOU-STQMWFEESA-N 428.401 4.126 10 10 IICE CN(C)c1ccc(CN(C(=O)c2c(F)ccc(S(=O)(=O)CC3CC3)c2F)C2CC2)cc1 1355437046 PSNNOTUQFXVKMX-UHFFFAOYSA-N 448.535 4.019 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(OC2CCCC2)nc1 1435332986 OROAWYMAJMCBBT-QGZVFWFLSA-N 431.483 4.403 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(-c2ccco2)nc2ccccc12 1451909940 ZXKYHZRNQFFDQV-UHFFFAOYSA-N 430.460 4.406 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NC(=O)c3ccc(N=NC(N)=O)cc3)C(C)(C)[C@H]21 1454467462 NMTINWSKUCQVCM-IKGGRYGDSA-N 429.521 4.003 10 10 IICE COc1ccc2c(c1)N(C(=O)c1cccc3c1CCN(C(=O)OC(C)(C)C)C3)C[C@H](C)O2 1456977360 PVSILBNDBKVKGY-INIZCTEOSA-N 438.524 4.416 10 10 IICE COC(=O)/C=C/c1ccc(N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)c([N+](=O)[O-])c1 1458118995 GGOAXVZDZSUUAZ-PKNBQFBNSA-N 438.459 4.379 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(C)cc3Br)CC2)cc1 1466208365 HGZSBXRKDCZBJI-KRWDZBQOSA-N 447.373 4.272 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CCC[C@H](c2ccccc2)C1 1478590017 QFXIBNRWNJFJQT-PMACEKPBSA-N 429.511 4.327 10 10 IICE CCc1nnc(N(C)CC2CCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1498698373 KKNFNAMBNHHXFZ-UHFFFAOYSA-N 425.621 4.114 10 10 IICE CC(C)(C)C1=CCN(c2nnc([C@@H]3CCC(=O)N3)n2CCCSc2nccs2)CC1 1508472875 IVMMEIPALPYJEV-INIZCTEOSA-N 446.646 4.051 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCC[C@@H](C(F)F)C1 1510676329 XJVHEVHMSHRPQR-LJQANCHMSA-N 426.515 4.244 10 10 IICE CCCN(CC)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)cc1C 1514670674 DFFGWUUYVKKRTA-UHFFFAOYSA-N 431.588 4.176 10 10 IICE COc1cc(N2CCN(C(=O)[C@@H](C)c3ccc(CC(C)C)cc3)CC2)cc(OC)c1OC 1514838707 NTNQUCTUZAHQRZ-IBGZPJMESA-N 440.584 4.363 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CC[C@H](C)[C@H]2C)cc1 1515520962 BDPWPSLTUIUUFB-RBUKOAKNSA-N 447.587 4.055 10 10 IICE Cc1sc(CNC(=O)OC(C)(C)C)nc1C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1526184820 FFVOETRKTITZAQ-UHFFFAOYSA-N 444.601 4.347 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1OCC 1530367929 PSUWJQZKGBBFPF-UHFFFAOYSA-N 443.563 4.085 10 10 IICE C/C(=C\C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccccc1C(F)(F)F 1535156960 QYQNDEMZBKKKIF-JQIJEIRASA-N 445.485 4.127 10 10 IICE CC(C)Oc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)ccc1[N+](=O)[O-] 1537458866 PMIICSHHCUZDGG-UHFFFAOYSA-N 449.454 4.382 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(F)c(Br)c(Cl)c2)cc1 1538161429 XSUQENIUIRBADL-UHFFFAOYSA-N 429.717 4.459 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F 1544629886 DIZLLPXSBMGJHR-IEBWSBKVSA-N 434.914 4.389 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3ccc(O)cc3O)[C@@H]2c2cccs2)cc1 1557084923 UHIKWMNRVPQFNN-WMZHIEFXSA-N 436.533 4.268 10 10 IICE O=C(CCSCc1nc(O)c2c3c(sc2n1)CCC3)NCc1cc(Cl)ccc1O 1557386734 XREWODDDCWRNQO-UHFFFAOYSA-N 449.985 4.184 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)N[C@H](C)c2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1 1564427632 JRPAZZGNZBBDNG-XMLVGPMBSA-N 433.911 4.296 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3CO)c2C)c1 1566448080 PPAIETSSMCIYFG-SQHAQQRYSA-N 445.607 4.324 10 10 IICE Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1567294469 BSIVKMOOUZFJCP-CLOONOSVSA-N 429.564 4.465 10 10 IICE CC(C)c1nsc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 1597145972 XJRVTHBOQNHCIJ-FMIVXFBMSA-N 438.625 4.343 10 10 IICE CN(C)c1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 1612345612 SKMZEKDDZGTJAW-SFHVURJKSA-N 445.476 4.247 10 10 IICE COc1ccc([C@@H]2C[C@H]2CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1622634962 NGVNUYSSCVMMFZ-WEYGHZABSA-N 428.960 4.329 10 10 IICE CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623549773 KNFVDWXJTDVINV-UHFFFAOYSA-N 430.892 4.079 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)c1C 1623964326 MJZITMDXWHJHIV-HXUWFJFHSA-N 441.572 4.158 10 10 IICE C[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)N(C(=O)OC(C)(C)C)C1CC1 1626105478 DHGGPOBOANIWFN-XMSQKQJNSA-N 445.604 4.048 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)c1 1627137087 QUQSRKSBEKKQFX-FQEVSTJZSA-N 444.940 4.131 10 10 IICE C[C@@H]1[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)[C@H]1c1ccccc1 1628495579 MVTGATFTDYSXDT-VAFVZNMKSA-N 437.584 4.484 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2nc(CN3CCCCC3)no2)c1 1635309227 JTTZOYQMALAVSR-UHFFFAOYSA-N 427.936 4.046 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 1636234144 RYHZGCYLNPVRFB-WOJBJXKFSA-N 430.593 4.122 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@]2(CC(=O)c3ccccc3O2)C1 1636264119 XUMAVIOTBSMJHX-BCHFMIIMSA-N 435.568 4.202 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@H]1CN(Cc2ccccc2)CC12CCC2 1640087913 MYMSVBJEDNJSPZ-GOSISDBHSA-N 429.358 4.073 10 10 IICE COC(=O)[C@@H]1Cc2ccc(O)cc2CN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1640711989 VPHXKERSUGNRHW-DEOSSOPVSA-N 432.520 4.157 10 10 IICE CSc1cccnc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1640737063 GSZWHHMDKZERJE-SDNWHVSQSA-N 435.621 4.485 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CC[C@@H](C)Sc4ccc(Cl)cc43)nc12 1642211791 SKDYKVZJOYZVOF-GFCCVEGCSA-N 432.933 4.156 10 10 IICE COc1ccc(N(Cc2ccc(C(C)C)cc2)C[C@H]2CCCN(S(C)(=O)=O)C2)cc1 1642222444 FVSBKIZBGRCCRO-OAQYLSRUSA-N 430.614 4.497 10 10 IICE COC(=O)[C@@H](c1cccc(Cl)c1Cl)N1CCN(c2ccc(OC)cc2OC)CC1 1644225429 KZYCLTDOEZZLQR-HXUWFJFHSA-N 439.339 4.047 10 10 IICE C[C@]1(C2CCCCC2)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1650836855 XZMHKBJBPUZDGI-OAQYLSRUSA-N 434.583 4.439 10 10 IICE Oc1ccccc1CN(C[C@@H](O)COc1cc(F)cc(Br)c1)C1CCCC1 1653338963 CICCOWGJCGJBGG-LJQANCHMSA-N 438.337 4.478 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cnccc1C(F)(F)F 1674606973 YXNPZYWMCQGETJ-UHFFFAOYSA-N 432.240 4.300 10 10 IICE COC(=O)c1cccc2c1CCN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)C2 1674923544 JLNUYZMDSQJPNU-UHFFFAOYSA-N 431.536 4.191 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CCCOc4cc(Cl)ccc43)CC2)c(OC)c1 1680772379 RVTUJLJXLSYZQC-IBGZPJMESA-N 445.947 4.103 10 10 IICE CC1=CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1693297916 NYQFALLGXBWIEN-UHFFFAOYSA-N 427.568 4.047 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1csc(COC)n1 1695511996 CDQGKMGYZYWFCH-UHFFFAOYSA-N 436.585 4.460 10 10 IICE C[C@H](C#N)CN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCCSc1nccs1 1706068654 NWVSZXPNFOVQEC-CQSZACIVSA-N 443.558 4.088 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CC[C@H](C(C)(C)C)C2)cc1 1710025767 MLYWHRPDRDTFOS-NRFANRHFSA-N 435.620 4.446 10 10 IICE CCC(C)(C)Cn1c(Cc2ccccn2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1743433015 NLNVKLUGVSIPOD-UHFFFAOYSA-N 448.615 4.425 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](n3cc(C)cn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752755199 GVHDDBVWRZLNHL-QUCCMNQESA-N 439.583 4.391 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CC4)n3C[C@@H](OC)C(C)(C)C)CC2)cc1 1770257500 BPDWETXTDMWFMK-JOCHJYFZSA-N 441.620 4.017 10 10 IICE CN(C)c1ccc([C@H](NC(=O)c2cc(Cl)c(Cl)cc2C(=O)O)c2nccn2C)cc1 1865859234 OJWIMOZAHJJLBO-SFHVURJKSA-N 447.322 4.011 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(Oc2cccnc2)cc1 1891520106 XXJRWLQMHMSAEB-FPOVZHCZSA-N 435.549 4.341 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C3CC3)c(C(=O)O)c2I)c(O)c1 2078993572 GVAPCHVXRICSCN-INIZCTEOSA-N 438.265 4.077 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1O 2227750466 JZNAKZXSHAIMKU-CHWSQXEVSA-N 429.355 4.089 10 10 IICE Nc1nc(-c2ccccc2)c(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)s1 31903259 DGLIRHSDYQKGFP-UHFFFAOYSA-N 425.469 4.420 10 10 IICE COC(=O)c1cccc(-n2c(C)cc(/C=C3\NC(=O)N(Cc4ccc(F)cc4)C3=O)c2C)c1 33332215 AAKHPVAZKAHYMX-XKZIYDEJSA-N 447.466 4.113 10 10 IICE CC(C)(C)C1(C)OC(=O)C(=Cc2cccc(OCc3ccc([N+](=O)[O-])cc3)c2)C(=O)O1 58833771 BWIXHLAPSGPFCB-UHFFFAOYSA-N 425.437 4.420 10 10 IICE CCC(=O)N1CCc2cc(-c3ccc(C(=O)NCCSCc4nc[nH]c4C)cc3)ccc21 65026902 RWDDYJZRHKDRCY-UHFFFAOYSA-N 448.592 4.347 10 10 IICE Cc1nc(C)c(-c2csc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)n2)s1 727248191 IFGUPOSHKCAIJO-UHFFFAOYSA-N 443.959 4.109 10 10 IICE COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)c1 743045381 HPUNFFJVTGHWET-UHFFFAOYSA-N 426.878 4.190 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Nc3csc(-c4ccccn4)n3)cc2F)C[C@@H](C)O1 757964059 JMIGRJZMABRLNO-HUUCEWRRSA-N 441.532 4.280 10 10 IICE CCN(Cc1ccccc1NC(=O)NCCc1ccc(O)c(O)c1)C(=O)OC(C)(C)C 761651327 NTEXXNDEOFOSTD-UHFFFAOYSA-N 429.517 4.219 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc([N+](=O)[O-])c4cccnc34)n2)cc1 766494287 CYNYJOZBSDNJFA-UHFFFAOYSA-N 442.478 4.076 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nnc(C4CCC4)n3C)c2C)cc1 781605731 DIIINXBGFJZUEO-UHFFFAOYSA-N 438.553 4.252 10 10 IICE O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1cc(Cl)ccc1OCC1CCC1 786717626 HLOBEFQUBPIVOC-UHFFFAOYSA-N 436.961 4.156 10 10 IICE O=C(NCc1cccc(OCc2ccccn2)c1)NCc1cc(Br)ccc1O 804916703 JFRAYCCDUZJBDX-UHFFFAOYSA-N 442.313 4.128 10 10 IICE Cc1cc(/C=C2/C(=O)N(C)C(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(N(C)C)cc1 1083916179 CMAIEGPUIKMPDX-KQWNVCNZSA-N 442.519 4.169 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)c2c1 1125188216 NQKTUJZMIWMMLS-HUUCEWRRSA-N 441.478 4.071 10 10 IICE CC(C)(C)C(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cn1 1125877243 BWQWHUNRMUXXKO-UHFFFAOYSA-N 446.498 4.066 10 10 IICE CCCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccccc1C 1129991421 PJFQOBWNMWOCKR-HXUWFJFHSA-N 432.568 4.398 10 10 IICE COc1ccc(N2CCN(Cc3ccc(Br)c(F)c3F)CC2)c(OC)c1 1141751683 CHIAZCFNAWXDLU-UHFFFAOYSA-N 427.289 4.067 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)cc1 1144880327 ZLDOIFVFUGLKIT-UHFFFAOYSA-N 430.263 4.258 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCCN(Cc3noc(C(C)(C)C)n3)CC2)c1C 1147351419 GGTGDTYTHUFLDD-UHFFFAOYSA-N 449.599 4.431 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(C(=O)c4ccco4)c3)cc2F)C[C@H](C)O1 1264688951 FAWUWUMBOPRFOF-IRXDYDNUSA-N 436.483 4.193 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1294455728 ZPMFHWOMXSVHNM-HXUWFJFHSA-N 426.653 4.166 10 10 IICE Cc1cccnc1[C@H](C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1305303904 FWJORZIBQJWPRD-AOHITCTBSA-N 431.608 4.310 10 10 IICE COCCCOc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1354988438 AKLBNSLUTKNXPF-UHFFFAOYSA-N 435.568 4.462 10 10 IICE CC(C)(C)OC(=O)CC1(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CCC1 1435333169 QJCXQFLYFCEAOL-INIZCTEOSA-N 438.515 4.275 10 10 IICE COc1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)nc2)cc1 1444659964 APYFVDIHSWDIMZ-UHFFFAOYSA-N 447.535 4.021 10 10 IICE O=C(CN[C@@H](CC1CCCC1)c1ccccc1)NCc1ccc(N2CCOCC2)c(F)c1 1459860468 XJIGMAYSTFGRME-DEOSSOPVSA-N 439.575 4.190 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@H]1CCC2(CCOCC2)CO1 1473158084 FINLVAXHPLIYBA-NRFANRHFSA-N 430.589 4.440 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)c(C)n1-c1ccccc1 1478654612 ZCRZERJJGKSCLM-VJBWXMMDSA-N 435.572 4.287 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@@H]1COCCO1 1500373182 DNBMHBIAPQFEKM-JOCHJYFZSA-N 437.588 4.394 10 10 IICE C[C@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)C[C@H](C)O1 1512499410 DVUYQPWQIKLBIZ-ROUUACIJSA-N 443.642 4.316 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(Br)cnc2OCC2CC2)cc1 1516599600 OOWLXIMVHMUBGT-UHFFFAOYSA-N 432.362 4.409 10 10 IICE C[C@H](NC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1)c1ccc(N(C)C)cc1 1517377712 XWIZMDIHNYRLAH-DBZAVIBRSA-N 444.564 4.343 10 10 IICE O=C(Cc1ccc(OCc2ccccc2)cc1)NCc1ccc(N2CCOCC2)c(F)c1 1527480939 CDVCFZYOHNVHHB-UHFFFAOYSA-N 434.511 4.100 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc2c(c1)CCCO2 1529350098 LYSQXOXXSVGBGN-XDHOZWIPSA-N 442.537 4.381 10 10 IICE Cc1cc(Cl)cnc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1534519174 WEHBKTMCYDBDFS-OQLLNIDSSA-N 435.933 4.413 10 10 IICE CCN(CC)CCNC(=O)c1ccc(OC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1537876159 CCPFRDNHTBWNGY-UHFFFAOYSA-N 433.552 4.385 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)/C(F)=C\c1ccc(F)c(C(F)(F)F)c1 1542302217 MEORKBSHGZVGLE-XDHOZWIPSA-N 426.385 4.308 10 10 IICE CC(C)(C)OC(=O)N(C1CC1)C1(C(=O)NCc2ccc(N3CCSCC3)cc2)CCC1 1544409105 LFWOKBGUOXKTIQ-UHFFFAOYSA-N 445.629 4.178 10 10 IICE CCN(CC)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1547464932 HBDOYMASCZXSKR-UHFFFAOYSA-N 425.621 4.114 10 10 IICE CCOCc1nnc(N(CC)[C@H](C)C2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1548094090 XBFJZQXRLBKWCR-LJQANCHMSA-N 443.661 4.431 10 10 IICE CN(CC(=O)NCCOc1cccc(C(F)(F)F)c1)c1ccc(-c2nccs2)cc1 1559896404 KIEHZDDWURXBEI-UHFFFAOYSA-N 435.471 4.460 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](OC1CCCC1)c1ccccc1 1583379533 VUTTXERRIRIDGI-QHCPKHFHSA-N 430.495 4.118 10 10 IICE CCOC(=O)c1sc(C2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)nc1C 1587997977 YYPVBCIGZGUYIH-UHFFFAOYSA-N 446.550 4.274 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCCC(=O)c1ccc(F)cc1 1597567330 KCKZACGLYUFERG-UHFFFAOYSA-N 435.879 4.130 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCc3ccccc3C2)NC(=O)OC(C)(C)C)cc1 1618253110 KRWUBGGFLGBRJP-FYYLOGMGSA-N 437.584 4.240 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CCCC1 1624834304 NWNHQERPYVKXJG-UHFFFAOYSA-N 441.572 4.044 10 10 IICE CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)N(CC)Cc1ccc(N(C)C)cc1 1626885961 TUHTYWGDZRDDEB-LEWJYISDSA-N 427.545 4.365 10 10 IICE COCC[C@H](Cc1cccc(Br)c1)C(=O)NCc1ccc2cccnc2c1O 1627072649 CTAZJRIVZDDICS-QGZVFWFLSA-N 443.341 4.215 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccnn2CCc2ccccc2)cc1 1627204899 HZFLCEODCZBYQY-XMMPIXPASA-N 432.568 4.013 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1627390535 FSADHNIALRDAKF-UUOWRZLLSA-N 432.520 4.057 10 10 IICE C[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1)c1ccc(N(C)C)cc1 1638950291 LROIOEDKJXAURM-OAHLLOKOSA-N 429.567 4.106 10 10 IICE COc1ccc(N2CC[C@@H](CNc3ncnc4cc(F)c(Br)cc34)C2)cc1 1640063734 QLUCIXXZCIYXER-ZDUSSCGKSA-N 431.309 4.478 10 10 IICE COc1cc([C@@H](C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)ccc1S(C)(=O)=O 1640751737 SMRIZSIFRUTUDG-QGZVFWFLSA-N 440.565 4.306 10 10 IICE COc1ccc(N(Cc2ccc(C(C)C)cc2)C[C@@H]2CCCN(S(C)(=O)=O)C2)cc1 1642222443 FVSBKIZBGRCCRO-NRFANRHFSA-N 430.614 4.497 10 10 IICE CCOC(=O)c1sc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)nc1C 1643918543 MDGQSAHWDTZCJO-UHFFFAOYSA-N 425.510 4.029 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)c(Cl)c1 1670913570 GQFAESLATRJUBG-AWEZNQCLSA-N 449.382 4.256 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1cccc(COC[C@H]2CCCO2)c1 1673743464 FAURISSFKDBUDI-CJFMBICVSA-N 439.600 4.187 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NCCC1(CNC(=O)OC(C)(C)C)CC1 1674161515 PWPUGNZOXPMXOY-UHFFFAOYSA-N 432.609 4.368 10 10 IICE Cc1cc(CCNC(=O)N(C)C[C@@H]2CCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1683150054 WBFHQRYTOLGDGK-QFIPXVFZSA-N 440.588 4.287 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@]2(C)Cc2ccccc2F)N(C)C)cc1 1684607964 XYPLCQNPLQVWKT-UKILVPOCSA-N 426.580 4.301 10 10 IICE COCCCN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1697982574 DEVITVDTJOWGJT-UHFFFAOYSA-N 434.588 4.097 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1711596677 HZPWMDQIVKLUKI-VWLOTQADSA-N 434.588 4.077 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2cccn2C)n1CCCOC(F)F 1729404843 JXALDYHQZWUQFO-UHFFFAOYSA-N 444.530 4.150 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2C[C@@](C)(O)C(C)C)o1 1742181172 QVASJXGYZUDKED-RUZDIDTESA-N 437.588 4.490 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3cscn3)n2CCCSc2nccs2)n1 1742312838 CDYLRCJHNDSKBT-UHFFFAOYSA-N 443.627 4.380 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1743446318 SLLFDRYPZYJYQH-MHECFPHRSA-N 439.629 4.455 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1749987384 UKBYZLNRCLSZMZ-QUCCMNQESA-N 429.609 4.051 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCOc2ccc(Cl)cn2)o1 1751472716 LTDJKTNOLBJGNN-UHFFFAOYSA-N 439.903 4.316 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)N2CCCCC2)cc1 1866067611 BSCZDMWBKDTPSQ-NRFANRHFSA-N 430.936 4.271 10 10 IICE CC[C@H]1CCCN1c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc(-c2cccnc2)n1 1869373807 SECWZXMSZGHKPZ-NRFANRHFSA-N 444.583 4.253 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@H]2NCc2cccc(Br)c2O)C1 1918886961 BKBFCRMPGMZYOX-UZLBHIALSA-N 425.367 4.424 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1cc(O)ccc1O 1952824080 ROIUWVQTTVQKPC-HYBUGGRVSA-N 445.471 4.495 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@H](CNCc2c(O)cccc2Cl)C1 2025249956 XEYHZDPBWLWMST-LJQANCHMSA-N 445.991 4.257 10 10 IICE CC(C)(C)OC(=O)NC1CCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)CC1 2044631720 WCDHLZNKBQZEOU-UHFFFAOYSA-N 446.592 4.056 10 10 IICE CCc1c(C2CC2)nn(Cc2cc(Br)ccc2O)c1I 2079830269 ZMXUGCQAOCDLEG-UHFFFAOYSA-N 447.114 4.444 10 10 IICE C[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)CCN(C(=O)OC(C)(C)C)C1 2103298766 FSCZLGGIFHGKGT-IUODEOHRSA-N 431.346 4.419 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3ccc(Br)cc3O)C[C@]2(C)C1 2116294341 MTRINBYFJUUOML-YYFZDKIDSA-N 425.367 4.280 10 10 IICE O=C(O)[C@H](Cc1ccccc1)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2293039571 NWNRPXAZPNUBGV-HNNXBMFYSA-N 448.363 4.346 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(O)c(Br)c3)C2=O)c1 2294095294 OMSZOJOXUNIEGS-UHFFFAOYSA-N 449.688 4.091 10 10 IICE COc1cccc(N2C(=O)C(=Cc3cc4cc5c(cc4nc3O)OCO5)SC2=S)c1 2296602911 IWURSGWQTACBQJ-UHFFFAOYSA-N 438.486 4.084 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1cccc(OC)c1 2313577443 WAKBWNVQDLCVQW-UHFFFAOYSA-N 428.282 4.335 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(C)c3)C2)sc2c1CCCC2 11355357 ZXDOMXGRKBHPMW-HNNXBMFYSA-N 426.538 4.104 10 10 IICE O=C(NC[C@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476239 HJGRQAURCQFWEW-PRHHBONVSA-N 435.480 4.036 10 10 IICE COc1ccc(OCCn2cc(/C=C3/C(=N)N4OC(C)=CC4=NC3=O)c3ccccc32)cc1 20236030 YEMARCRLLMFTOX-UDYULTBOSA-N 442.475 4.179 10 10 IICE COc1ccc([C@@H]2Nc3c(C(=O)NC[C@@H]4CCCO4)cccc3[C@@H]3C=CC[C@H]32)cc1OC 20715461 IHMYISQGBICZFI-LUCIHVKJSA-N 434.536 4.439 10 10 IICE CCN1C(=O)/C(=C\c2cc(OC)c(OCc3ccccc3)cc2[N+](=O)[O-])SC1=S 22747878 AALOVFRKXKIOQR-VCHYOVAHSA-N 430.507 4.404 10 10 IICE CCOc1cc(/C=C2/SC(N(C)c3ccc(Cl)cc3)=NC2=O)ccc1OCC(=O)O 96481758 VQCYZORFWOCFLK-WOJGMQOQSA-N 446.912 4.309 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C/c2ccc(OC)c(O)c2)cc1 103578223 FTLFFLGUNHPJEK-DEDYPNTBSA-N 445.431 4.152 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(NC(=O)C3CC3)c2)C1 435625509 LYNXNBZMUYFJHX-UHFFFAOYSA-N 430.552 4.395 10 10 IICE COc1ccc(OC)c(C2=C(O)C(=O)N(c3ccccc3C)[C@H]2c2ccc(O)c(O)c2)c1 526495967 KUJPIJFLTXAROU-QHCPKHFHSA-N 433.460 4.481 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCC(OC4CCC(C)CC4)CC3)CC2)cc1 731120507 BODGCWSGXZPXOJ-UHFFFAOYSA-N 429.605 4.433 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3cc(S(C)(=O)=O)cs3)c2C)cc1F 767850995 YJHRNDHRNZXIBE-UHFFFAOYSA-N 449.525 4.046 10 10 IICE c1ccc(COc2cccc(CNCc3ccc(N4CCN(CC5CC5)CC4)cc3)c2)nc1 768670798 QECRLZXXLKYHMF-UHFFFAOYSA-N 442.607 4.482 10 10 IICE Cc1cc([C@H](CC(=O)NCc2ccc(N(C)C)cc2)NC(=O)OC(C)(C)C)cc(Cl)n1 788137482 XIQNDWFJSIBAKU-IBGZPJMESA-N 446.979 4.382 10 10 IICE CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3c(C)n(C)c4ccccc34)n2)cc1 789724273 DCJWKLKQFVRIID-UHFFFAOYSA-N 440.550 4.369 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)NC(=O)OC(C)(C)C)cc1 796731032 UUQDDACJADCQIB-NUJGCVRESA-N 443.510 4.413 10 10 IICE C[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccc(F)c(F)c1 822086551 ZTBZAFRFCCKEEN-NSHDSACASA-N 436.370 4.139 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)COc3cc(Cl)c(Cl)cc3Cl)C2)cc1 1130827297 YEXQROMXYFVFEA-LBPRGKRZSA-N 429.731 4.429 10 10 IICE CCc1c(Br)cc(C(=O)NCc2cc(O)ccc2O)cc1Br 1153885041 JPKLRCIPKNDXAP-UHFFFAOYSA-N 429.108 4.115 10 10 IICE Cc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1-n1c(C)cc(C=O)c1C 1158717791 RKLZEUURXCCSRQ-AREMUKBSSA-N 446.595 4.314 10 10 IICE Cc1cc(C(=O)CS(=O)(=O)c2cccc(F)c2)c(C)n1-c1ccc(OC(F)F)cc1 1166817002 KWAIWYSHVWSXMR-UHFFFAOYSA-N 437.439 4.491 10 10 IICE Cc1ccccc1N(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C(C)C 1191997938 MVYDIHYUDFGIHN-PMACEKPBSA-N 427.564 4.279 10 10 IICE COCCCC[C@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1 1248459719 JNXALTZZWXHYCW-QFIPXVFZSA-N 447.526 4.159 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@@H]1Cc1ccccc1 1294481916 OVTWOKCKAUCNJC-NGYXKBBWSA-N 440.565 4.261 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3ccccc3)[C@H](C)C2)cc1 1299328790 DKZBMLZAJVIPKE-OAQYLSRUSA-N 429.564 4.182 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCSC(C)C)CC2)cc1 1300248327 ZXGWZSQHAUWZGR-UHFFFAOYSA-N 429.634 4.413 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)cc1C 1305740800 RBAZUWKAJGYSLU-MJGOQNOKSA-N 440.636 4.244 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@H](C1CC1)N(C)C 1314737205 PAYIOWXBFMMORO-QHCPKHFHSA-N 438.664 4.444 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCN1CCCC(C)(C)C1 1314752585 BLXNJQDKWGFLIP-UHFFFAOYSA-N 439.629 4.394 10 10 IICE COCCN(Cc1c(C)nn(C)c1C)C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1436607921 AHFPCEVIZPTKCR-UHFFFAOYSA-N 428.964 4.387 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc(-c4ccccn4)ccc3Cl)cc2)CC1 1439329967 OMJLEBJBPQNZPH-UHFFFAOYSA-N 448.954 4.034 10 10 IICE Cc1nc2cc(F)cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2nc1C 1445889260 XZAWSYBXDYGCLS-GOSISDBHSA-N 442.922 4.139 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CCCN(CC(F)(F)F)C1=O 1446807482 UWJPGLIBFLOSSS-LPHOPBHVSA-N 434.458 4.283 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(c2ccc(OC)cc2)CC1 1464702031 FZGLSLSZXYLXPF-UWJYYQICSA-N 433.593 4.110 10 10 IICE COc1ccccc1N1CC[C@H](NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1466034882 MGILOEMDKISNQL-QFIPXVFZSA-N 431.536 4.232 10 10 IICE Cc1c(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)nnn1Cc1ccccc1F 1467496998 RNAIBTRDNSVGNO-UHFFFAOYSA-N 445.498 4.175 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCOCC3(CCC3)C2)cc1 1501844395 RGPGVLGKTNXJBL-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC(C)(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1F 1524851308 MIIZRCIMTAGJSF-UHFFFAOYSA-N 426.866 4.188 10 10 IICE CNC(=O)c1cc(Br)ccc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1526386896 UHRNIENMUTXTOL-UHFFFAOYSA-N 440.341 4.397 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(Oc4ccc(C)cn4)cc3)c2)CC1 1538714844 YUIHUCLVCQTYNO-UHFFFAOYSA-N 430.508 4.103 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCCN(C)C(=O)c3ccncc3)cc2Cl)C1 1539911878 DJRDAQLLQTVOSC-GOSISDBHSA-N 442.991 4.140 10 10 IICE Cc1nc(CC(F)(F)F)sc1CC(=O)Nc1c(-c2ccccn2)nc2ccccn12 1543447711 SFNVPEFPLFDJEP-UHFFFAOYSA-N 431.443 4.447 10 10 IICE COc1ccc(C)cc1N1C[C@@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 1544245416 BFSDGYGARLLKRV-NRFANRHFSA-N 449.595 4.442 10 10 IICE COC(=O)c1ccc(Br)c(CN(Cc2ccccc2O)C[C@@H]2CCCO2)c1 1559635056 JAWWBGDGPAXMII-SFHVURJKSA-N 434.330 4.123 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCCc2cc(Cl)cc(Br)c2)c1 1565268028 ANPCYEMIOJSFER-NSHDSACASA-N 427.726 4.420 10 10 IICE CC[C@]1(Cc2ccccc2)CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1565364888 YJIOQDZSHOUQOI-HHHXNRCGSA-N 448.611 4.085 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2nc(C(F)(F)F)n3ccccc23)cc1 1583919622 QTCOHNJMNMZGNQ-SFHVURJKSA-N 446.473 4.241 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 1597088742 AGFCALLOSKGZTO-CTNGQTDRSA-N 446.588 4.327 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc4ccccc4cc3OC(F)F)cc2)CC1 1598277799 YOQXMRFPRKJDCD-UHFFFAOYSA-N 425.479 4.123 10 10 IICE C[C@@H]1Nc2ccnn2[C@H](C)[C@@H]1CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1626479141 CFHZJFKMXRUZRV-RZQQEMMASA-N 447.530 4.041 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccc1 1628627326 SDGTTYGAAXGACZ-VGOFRKELSA-N 425.573 4.398 10 10 IICE Cc1cccc(OCCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1628668366 NARMVLNZBGZKSV-UHFFFAOYSA-N 428.330 4.369 10 10 IICE COc1ccc(CCC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(Br)c1 1636951130 PNPOLOZXVNPXMU-IBGZPJMESA-N 448.357 4.304 10 10 IICE CCOc1ccc2nc(NC(=O)CN(Cc3ccccc3O)C[C@@H]3CCCO3)sc2c1 1642199704 LKCOGWGQZAACES-SFHVURJKSA-N 441.553 4.020 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)c3nc(C(F)(F)F)cs3)C2)cc1 1680588820 LXHYTQNMIHSKTR-QWHCGFSZSA-N 428.480 4.057 10 10 IICE CCOC(=O)[C@H]1CN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CCC1(F)F 1683303917 RIBAASMFDKAKGY-HXUWFJFHSA-N 433.499 4.132 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1695727209 QSCDORDJBAAWGU-NRFANRHFSA-N 425.621 4.303 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC[S@@](=O)CC)C1 1709288453 IDWKGJNHJPFFFW-QJWGWKRISA-N 439.629 4.358 10 10 IICE Cc1cccc(-c2nnc(N(C)CC3CC(F)C3)n2CCCSc2nccs2)n1 1724479596 OUGPWGIHHWDDAV-UHFFFAOYSA-N 432.594 4.472 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(O)CCCCCC1 1728982973 SXNZOKKTBOZDAS-UHFFFAOYSA-N 441.620 4.137 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(=O)OC)C1 1745077203 YOAIZCJZSQAHRL-ATYVUACHSA-N 433.556 4.318 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)C(C)(C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1751408855 PNFFRHIBPZJRLG-SFHVURJKSA-N 448.615 4.313 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2C[C@](C)(O)C(C)C)c(C)n1-c1ccccc1 1751411604 IMHODNWMHVQGHQ-DEOSSOPVSA-N 439.629 4.313 10 10 IICE CC[C@H]1CN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1763471436 ZHGLJKBGJOPUHQ-RXVVDRJESA-N 429.634 4.008 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1771453588 SFDSYQUQDOSICI-LJQANCHMSA-N 445.677 4.329 10 10 IICE CN(Cc1cccc(I)c1)c1ccc(CO)c(Br)c1 2265541916 ZELZREKIXMXOFM-UHFFFAOYSA-N 432.099 4.182 10 10 IICE CC[C@H](N[C@@]12CO[C@@H](C1)[C@@H](NC(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2281189061 IWCCMSNPVTUPKI-MZRZTIOWSA-N 441.366 4.020 10 10 IICE CCN1C(=O)C(=Cc2ccc(OCCOc3cccc(OC)c3)c(OC)c2)SC1=S 2293488584 DXHDHBDRNCBFCQ-UHFFFAOYSA-N 445.562 4.383 10 10 IICE COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)C2=CNC2Cc3ccccc3C2)cc1 2313710605 KISFHWMNGPTKBY-UHFFFAOYSA-N 427.479 4.226 10 10 IICE O=C(CN1C(=O)C(=Cc2ccccc2O)SC1=S)Nc1cccc(C(F)(F)F)c1 2314829251 ZYXZYQHISALHER-UHFFFAOYSA-N 438.452 4.251 10 10 IICE COc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3cc(Cl)ccc3O)SC2=S)cc1 2314836550 GPTABDIRCDLIAO-LLVKDONJSA-N 448.953 4.283 10 10 IICE C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 16878177 POEBNCPYPVYAQB-CLOONOSVSA-N 426.605 4.203 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(F)cc2)CC(=O)Nc2ccc(F)cc2)cc1 105424879 BCQGCBMZVWYIQB-UHFFFAOYSA-N 425.435 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)[C@@H]2OCCc3sccc32)C1 561835433 MOPBNBGWPFAYEM-NSYGIPOTSA-N 437.609 4.288 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N(CC(F)F)CC1CCC1 761660778 XMVNXUVGKBSBRR-UHFFFAOYSA-N 435.437 4.119 10 10 IICE Cc1cc(C(=O)N[C@@H](C)Cn2ncc3ccccc3c2=O)c(C)n1-c1ccc(Cl)cc1 765259356 WLLZQWASALGWQV-HNNXBMFYSA-N 434.927 4.276 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccoc4)n3Cc3cccs3)CC2)cc1 812358386 HKBVCTHGUZMBLI-UHFFFAOYSA-N 435.553 4.373 10 10 IICE CCN(Cc1ccccc1)c1ccc(CN2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1 856533379 DUILVINNUVWKJA-IZZNHLLZSA-N 428.580 4.064 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)c1 1125989153 WFHYTHDCZIVYNL-FQEVSTJZSA-N 425.891 4.422 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCS(=O)(=O)C[C@H]2C2CCC2)cc1 1130215479 HVMVXMAHURGHMT-QFIPXVFZSA-N 440.569 4.207 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cncc(C(F)F)c1 1132608469 UMGDOYWIZOGXGU-VIZOYTHASA-N 437.468 4.388 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)Cc3csc4ccc(Cl)cc34)cc2)CC1 1133626431 KSARGSIWRWDSIN-UHFFFAOYSA-N 441.984 4.115 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccc(F)c(F)c1O 1141877091 DNEFQIJPJCBCDE-UKTHLTGXSA-N 440.518 4.352 10 10 IICE COCCN(CC(=O)OC(C)(C)C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1144927783 PBCKSWIKCMEKGZ-UHFFFAOYSA-N 434.964 4.107 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2c(F)cccc2Cl)cc1 1149975644 XEUBVXFVUBCYIX-OAQYLSRUSA-N 428.891 4.091 10 10 IICE COc1cccc(CNC(=O)c2ccc3c(c2)[C@H](CNC(=O)OC(C)(C)C)CCC3)c1O 1150543354 MKHVVNKUWCCIFC-SFHVURJKSA-N 440.540 4.275 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2c(Cl)cccc2nc1C 1152407196 NXFYGHXVSGFAJB-UHFFFAOYSA-N 433.291 4.371 10 10 IICE COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)CC2 1230199251 ALBMXJIVKNPPQX-ROUUACIJSA-N 425.573 4.338 10 10 IICE COc1ccc([C@H](NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)c2ccccc2)cc1 1246300705 BNSQCDNHCVJZBE-AREMUKBSSA-N 444.579 4.036 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(COc4cccc(F)c4)cc3)C2)cc1 1252302621 PZNUPBXOVZKUAM-QFIPXVFZSA-N 449.526 4.491 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cn(-c4ccc(Cl)c(Cl)c4)cn3)C2)cc1 1278861863 PSWLMLKYDKKALA-AWEZNQCLSA-N 431.323 4.196 10 10 IICE CCC[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CCO1 1294095437 PBJIOOMOUASQEQ-HSZRJFAPSA-N 425.621 4.439 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H](Cc4cnn(C)c4)C3)nnc2C(C)(C)C)cc1 1295419859 TWSOBKGNIGJDHH-NRFANRHFSA-N 449.647 4.273 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@@H](C1CCCCC1)N(C)C 1298363598 HNONFRLYUYIPDS-JTHBVZDNSA-N 441.620 4.372 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCCSC3)CC2)cc1F 1300246342 FRCMSBAEPLBBBO-KRWDZBQOSA-N 447.624 4.193 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1301235859 KYTKAEWCLXHMIJ-KRWDZBQOSA-N 444.630 4.232 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2C[C@H]1CNC(=O)NCc1cccc(Cl)c1O 1313232850 RBQPFWPUCCKHRU-SFHVURJKSA-N 445.947 4.207 10 10 IICE CC[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccccc1OCC(=O)NC 1350924589 URYHKCOYALTWQB-QHCPKHFHSA-N 433.552 4.029 10 10 IICE CCOC(=O)[C@]1(COC)CCCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1448188432 HLBFHWCWXVGYGX-XMMPIXPASA-N 446.975 4.108 10 10 IICE CC(C)[C@H]1N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC12CCCC2 1451387921 MXZUICAZIWENBN-LJQANCHMSA-N 434.583 4.295 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2CCCC[C@H]2[C@H]1C(=O)NCc1ccc2cccnc2c1O 1451957621 KCQLMQGTKPZJOT-SCWSEQNSSA-N 439.556 4.372 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C[C@H]1C1CC1 1452647942 IBHXYFNZBQXWIR-VQTJNVASSA-N 445.357 4.128 10 10 IICE CCCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1cccc(F)c1 1461080917 ZYSHISRRFMHYDZ-GOSISDBHSA-N 436.531 4.229 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)[C@H]1CCCOC1 1466780770 RVWWYRUQTOZNFS-REWPJTCUSA-N 426.557 4.306 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)N(C)C)cc1 1471542472 BJXSZLVUXZICTO-RUZDIDTESA-N 433.600 4.426 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 1499765947 NFRYFZGSSZXRNJ-APWZRJJASA-N 443.592 4.188 10 10 IICE CCCCn1c(Cc2csc(C)n2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1514475147 UNYXWFZQDKCXLS-UHFFFAOYSA-N 440.617 4.159 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(COC)CCC1 1519087283 GBBZVLNZJVEYLU-UHFFFAOYSA-N 437.588 4.252 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@]1(c2ccccc2)C[C@@H](F)C1 1525806280 QTIGFUQKWSPHHS-LBZQVFOQSA-N 436.449 4.228 10 10 IICE Cc1csc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1529759311 LIDNFWAYTPHEID-ZENNRRHLSA-N 435.571 4.059 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCCc1cccc(F)c1 1530320463 PYYPBHPLQFKURX-RGEXLXHISA-N 446.544 4.305 10 10 IICE COc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1OC 1537657281 OTQBLSNSAVSVCQ-SFQUDFHCSA-N 446.525 4.073 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1Br 1544720376 BHCROXVTOSHMNP-UHFFFAOYSA-N 442.401 4.220 10 10 IICE CO[C@@H]1CC[C@@H]2CN(c3nnc(CC(C)(C)C)n3Cc3ccc(N(C)C)cc3C)C[C@@H]21 1555778372 UZAYEXWEMVJCNU-BAGYTPMASA-N 425.621 4.151 10 10 IICE Cc1cc(CCNC(=O)c2cc([N+](=O)[O-])ncc2Br)c(C)n1-c1ccccc1 1559022705 UOQLTYGFYUXRLX-UHFFFAOYSA-N 443.301 4.132 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)Cc3cscc3Br)C2)cc1 1564963251 UNFBOPJMQBSWFB-CQSZACIVSA-N 438.391 4.187 10 10 IICE CCON(Cc1ccccc1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1570143682 ZWALEIPLQRWCBY-RGEXLXHISA-N 444.553 4.397 10 10 IICE CCCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1583920126 WRJZEXBKTHAMEY-KNQAVFIVSA-N 447.620 4.296 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(-c4ccc(C)cc4C)s3)CC2)c(OC)c1 1587487327 ZZXQBFFKQKFPOU-UHFFFAOYSA-N 437.565 4.407 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3c(C)cc(C)c(Br)c3C)C2)cc1 1617263608 ZNMRYWHCVYXLJD-KRWDZBQOSA-N 431.374 4.321 10 10 IICE CO[C@]1(C)CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1619027838 VIBNBQOVHBLMAP-WIOPSUGQSA-N 441.620 4.338 10 10 IICE Cc1cc(OCCN2CCNC2=O)ccc1NC(=O)c1cc(C)n(-c2ccccc2C)c1C 1625909134 HLWABTFCJMDQAV-UHFFFAOYSA-N 446.551 4.367 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)nn1-c1ccccc1Cl 1625969611 HFEOZGYXJHERPO-UHFFFAOYSA-N 426.973 4.317 10 10 IICE Cc1cncc(/C=C\C(=O)N2C[C@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)c1 1626448349 QYJMUZYOLADFJM-MTIYJEKLSA-N 425.504 4.273 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)C[C@H](C)NC(=O)OC(C)(C)C)cc1 1630950597 IZMVSXZQBHTJRE-SJORKVTESA-N 441.572 4.257 10 10 IICE Cc1ccc(C)c([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1632016714 UYEFQPKCYJSEMF-OAHLLOKOSA-N 430.551 4.362 10 10 IICE CO[C@@H]1CCC[C@H]([C@@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1632687479 HZENRWFIWABNPR-LDQXTDLNSA-N 449.389 4.153 10 10 IICE CCc1nc(C(=O)NCc2ccc(N(CC)CC)c(F)c2)nn1-c1ccccc1Cl 1633259373 NCSAODHSARXVMT-UHFFFAOYSA-N 429.927 4.398 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 1633351749 AMOREERFBDPYQD-AREMUKBSSA-N 444.510 4.228 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1c(Cl)cccc1-n1ccnc1 1635642151 JZKOSIAVECMYIG-KRWDZBQOSA-N 425.964 4.331 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCCO[C@H]3c3ccc(Cl)cc3)C2)cc1 1636853985 PQGGTMHQVROXFR-QIJUGHKUSA-N 429.948 4.147 10 10 IICE Oc1ccccc1CN(C[C@@H]1CCCO1)c1ncnc2cc(F)c(Br)cc12 1639662003 ZMGSNFZXTTUGPT-AWEZNQCLSA-N 432.293 4.423 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3cc(Cl)cc(Cl)c3O)nn2C)cc1OC 1641996794 ALVHOPNUFQNJSB-UHFFFAOYSA-N 436.295 4.047 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)Nc3cccc(Cl)c3Cl)CC2)c(OC)c1 1644225659 UHKYJCABXIXTMQ-CQSZACIVSA-N 438.355 4.160 10 10 IICE O=C(NCc1c(O)cccc1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 1647269761 LHEDRWLPSGFQEO-UHFFFAOYSA-N 445.319 4.251 10 10 IICE COC[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(Cl)cc1 1653449009 MCOCHCSKTBBETE-QFIPXVFZSA-N 448.906 4.031 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3C[C@H](OCc4ccccc4)C3(C)C)CC2)cc1 1671953973 MDJIASNEBXVNMM-RPWUZVMVSA-N 437.584 4.301 10 10 IICE CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1673472360 IUPSUJVTHJNTPL-HXUWFJFHSA-N 431.527 4.273 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)CCc3ccccc3)cc2Cl)C1 1682023199 BNOFEWNATOPHRE-RXVVDRJESA-N 429.992 4.369 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccn(C)n1 1686035271 ANYZMUBOGCOFIY-UZUQRXQVSA-N 439.991 4.468 10 10 IICE CCN(CC)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N2CCSCC2)cc1 1695633019 NOUKISUBAOSBDR-UHFFFAOYSA-N 442.658 4.082 10 10 IICE COCC1(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCCCC1 1770835876 LCTKOTPGKOTSCV-OAQYLSRUSA-N 428.577 4.459 10 10 IICE CN(C)c1ccc([C@H](NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c2nccn2C)cc1 1865858789 NSPUTQYVGWERDU-FQEVSTJZSA-N 426.948 4.203 10 10 IICE COc1cccc(O)c1CNc1ccc(I)cc1Br 2104441916 DHLLQZBZZUHAMJ-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@@H](NCc1c(O)cccc1Br)C2 2226144527 NXRCYGUWHJYHKF-ZQIUZPCESA-N 425.367 4.280 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)C1=Cc1cccn1-c1ccccc1 2294094925 DUANMVYRDTXZJA-UHFFFAOYSA-N 426.259 4.451 10 10 IICE CCCN1C(=O)C(=Cc2cc(Br)cs2)C(=O)N(c2ccccc2)C1=S 2297358595 NMOBJGXSJKYLPD-UHFFFAOYSA-N 435.368 4.464 10 10 IICE CC[C@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3cccc(C)c3)s2)C1=O 11636313 KSLIHZXGMDRGST-MRXNPFEDSA-N 433.624 4.400 10 10 IICE Cc1cc(C(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1F 26141692 COLYBAACHPHRIF-INIZCTEOSA-N 428.529 4.470 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCC1 226781328 HCTRFWHLEDSEDK-STSQHVNTSA-N 426.538 4.099 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCCC(=O)OC(C)(C)C)C1 618240655 NTPRHTFLJTWNKK-UHFFFAOYSA-N 427.589 4.036 10 10 IICE O=C(NCCCCCNCc1cc(Br)cc(F)c1O)OCc1ccccc1 715788178 IELCFFSLZZXVHM-UHFFFAOYSA-N 439.325 4.480 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3CCC(c4nnc5n4CCC5)CC3)c2C)cc1F 728914964 KEZSTBBZASIUJC-UHFFFAOYSA-N 435.547 4.142 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)nc1-c1c(F)cc(F)cc1F 729112144 HJVSZUZLWCLRMW-UHFFFAOYSA-N 447.391 4.384 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N[C@@H]1C[C@H]1C1CCCCC1 743554425 DTPGPBIDZQYNNA-AZUAARDMSA-N 425.495 4.310 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(C)cc1OC[C@@H]1CCOC1 756080853 OCWBEVZKDHVKBA-OAQYLSRUSA-N 425.573 4.208 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCc3ccc(F)c(F)c3C2)c([N+](=O)[O-])c1Br 767822675 GSYTWOABFJZQOD-UHFFFAOYSA-N 444.188 4.115 10 10 IICE CCc1cccc(C)c1NC(=O)COC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 769665903 XTVHKQXEKXTJBP-UHFFFAOYSA-N 447.579 4.461 10 10 IICE Cc1cc(Br)cc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)c1O 779001808 BSRWSKRBQSCZBJ-XHSDSOJGSA-N 434.378 4.323 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CC[C@@](F)(c4cccc(C(F)(F)F)c4)C3)cc2N1 800884423 GBIBSWYJOKAUQT-SFHVURJKSA-N 425.338 4.020 10 10 IICE Cc1cc(/C=C2/SC(=S)N(CCCN3CCOCC3)C2=O)c(C)n1-c1ccccc1 814286065 WZYBHPQCOVKBDE-LTGZKZEYSA-N 441.622 4.018 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@H](CC)C2 1124312958 DQOBZMCWAHALHP-HOTGVXAUSA-N 440.565 4.431 10 10 IICE O=C(C[C@@H]1CCC[C@H](C(F)(F)F)O1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126583847 UUBDZKWYWUXVAI-RRQGHBQHSA-N 436.421 4.263 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c(C)nn(-c4ccc(F)cc4)c3Cl)C2)cc1 1130185303 DLZHGCRTLHQZSE-MRXNPFEDSA-N 442.922 4.238 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3cccc(C)c3)c2C(F)(F)F)cc1 1130544326 NIYWSLVQYWAFKS-UHFFFAOYSA-N 446.473 4.417 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)COc2ccc(Cl)cc2Br)cc1 1130744829 INWOIMDDKRVAKA-UHFFFAOYSA-N 441.753 4.085 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1135744384 AUDJIRGTFOMDOB-WIYYLYMNSA-N 445.604 4.396 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1136442913 JENPOKBYIBFLDD-WAOWUJCRSA-N 433.593 4.030 10 10 IICE O=C(CCC(=O)c1c(F)cccc1F)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137439878 IBJVLSKYASVJHB-INIZCTEOSA-N 436.886 4.068 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(C(=O)N(C)Cc3ccccc3)CC2)c1C 1141832256 SFQYCURUKABMSE-UHFFFAOYSA-N 444.579 4.412 10 10 IICE Cc1cc(C(=O)NCCCNc2ccccc2)c(C)n1-c1ccc(Br)cn1 1144341139 JNMJRYMIKSYNSY-UHFFFAOYSA-N 427.346 4.484 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN([C@@H](CO)c2ccc(Cl)cc2)CC1 1152994870 ACMCRYRXZSKHLB-NRFANRHFSA-N 444.000 4.300 10 10 IICE O=C(NCc1c(O)cccc1O)[C@@H](Oc1ccccc1Br)c1ccccc1 1156880776 AQYTVCYQQIOWSU-FQEVSTJZSA-N 428.282 4.297 10 10 IICE Cc1cc(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c(C)n1-c1cccc(Cl)c1 1165980579 LAESZAUSBBEDJU-HSZRJFAPSA-N 437.971 4.244 10 10 IICE COC(=O)COc1ccc(N(C)Cc2ccc(I)cc2Cl)cc1 1169187927 NQSDQUDSHPOUBP-UHFFFAOYSA-N 445.684 4.133 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC[C@@H]3CCC4(CCOCC4)CO3)c2C)cc1 1177602104 GMBPCCAXKMKHRS-QFIPXVFZSA-N 426.557 4.198 10 10 IICE COc1cncc(N2CCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CC2)c1 1196962672 SVJGEZRMEOPJOB-UHFFFAOYSA-N 430.512 4.266 10 10 IICE CNc1cc(Cl)ccc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1291639755 RLRFOQROKWQBNF-UHFFFAOYSA-N 427.854 4.167 10 10 IICE COc1cccc(N2CC[C@@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)c1 1292716400 UVOSAHUQUNGGCS-JOCHJYFZSA-N 431.536 4.232 10 10 IICE CCc1nnc(N2CCN(c3ccccc3F)C[C@H]2C)n1CCCSc1nccs1 1293104817 TYVNLZNWPYVMLD-MRXNPFEDSA-N 446.621 4.334 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)c1cccc(Cl)c1 1296398525 AKKRECNATBDSCW-QHCPKHFHSA-N 427.976 4.209 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](OC)C(C)(C)C1 1297551632 IYIXIKPXZOHJQK-QFIPXVFZSA-N 437.588 4.250 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C)[C@H]3C)n2CCCSc2nccs2)n1 1304752542 XMWCTNRGAGTNTO-RHSMWYFYSA-N 431.635 4.013 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCc3ncc(Br)n3C2)c(C)n1-c1cccc(Cl)c1 1305276953 CGSPANWQYZXIFG-OAHLLOKOSA-N 447.764 4.451 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2CC(C)(C)Oc3cc(F)ccc32)N(C)C)cc1 1312342143 MJBSYXGHONINBB-NHCUHLMSSA-N 428.552 4.096 10 10 IICE CO[C@@H](Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1315206119 WUFROFODVYKADH-QHCPKHFHSA-N 434.588 4.248 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)CCOc1ccc(Cl)cc1Br 1360847966 DPLFXMVONYLPCA-UHFFFAOYSA-N 439.737 4.363 10 10 IICE CCc1nccc(C)c1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1440035545 SCMHZMGYBAASDZ-ATVHPVEESA-N 429.542 4.322 10 10 IICE Cc1cc(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)c(C)n1-c1ccc(Cl)cc1 1447369194 OUPICIKPDMDQOL-UHFFFAOYSA-N 425.891 4.376 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc2cccc(C(F)(F)F)c2nc1O 1464259572 JJBCMYYIKBNXQI-UHFFFAOYSA-N 447.482 4.442 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2ncc(Br)cn2)c(C)n1-c1ccccc1 1470968739 GHCGSVKUDWGJRM-UHFFFAOYSA-N 442.361 4.031 10 10 IICE C[C@@H](NC(=O)N[C@@H]1Cc2ccccc2[C@H]1NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1478470990 LLOKHSDKBGDOLE-NPFVIJTESA-N 438.572 4.304 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)c(F)c2)C1 1500703074 LCTHIHMHIIKRGZ-QUCCMNQESA-N 430.616 4.213 10 10 IICE Cc1nc(-c2ccccc2)c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)s1 1527858222 RJYXZFMSQWMXJV-UHFFFAOYSA-N 429.492 4.163 10 10 IICE C[C@@H](COc1ccccc1)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1529037703 NTPLYRQLJPYUCS-SJPXOZHESA-N 444.553 4.001 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](C(C)C)N2CCC(C)CC2)CCCC1 1533659124 ZNFYWZWKSBJSBD-VWLOTQADSA-N 425.617 4.401 10 10 IICE CN(c1ccc(CNC(=O)[C@@H](C[C@@H]2COCCO2)C(F)(F)F)cc1)C1CCCCC1 1542412362 XRRFEMKNJFTPAQ-WOJBJXKFSA-N 428.495 4.056 10 10 IICE O=C(COc1ccc(Cl)cc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1544720363 AGJPZCPSVZXUKX-UHFFFAOYSA-N 448.394 4.221 10 10 IICE CC[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)[C@H](O)c1c(F)cccc1F 1545596737 YFSXLPNWMXPIAV-NLFFAJNJSA-N 442.506 4.435 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1c[nH]nc1-c1ccc(Cl)cc1 1545632967 ZWNMZSXQBZKUFM-SFHVURJKSA-N 445.350 4.484 10 10 IICE CC[C@@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)c1cc2cc(O)c(O)cc2s1 1545993847 GURAAGPECHUYRQ-DNVCBOLYSA-N 439.581 4.389 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)Cc2nccs2)cc1 1547444385 NYXHDSWBQSGWAS-UHFFFAOYSA-N 433.585 4.328 10 10 IICE CO[C@@H](C)c1nc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cs1 1554588290 RQQLNNICVJLDTC-KXBFYZLASA-N 443.573 4.074 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1)c1ccc(N(C)C)cc1 1556259491 ATSWIWMABTYBOI-INIZCTEOSA-N 441.528 4.184 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccn1 1556931093 BLZOFVAFZQCTFD-XOAFGZPJSA-N 431.608 4.392 10 10 IICE Cc1ccc(CNC(=O)NCc2cccc(Br)c2O)cc1Br 1565300080 JYJJHYZAIKNDAW-UHFFFAOYSA-N 428.124 4.225 10 10 IICE COc1cccc(CN(CCN(C)C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1567589193 FATGBXBFJFUCND-UHFFFAOYSA-N 447.579 4.048 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C=C/c2cccnc2C)cc1 1616141613 BHBCTZUWICPZDK-NTCAYCPXSA-N 429.520 4.047 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(Br)cc2OC(C)C)cc1 1616534051 MOOMCDKDXDMOFR-UHFFFAOYSA-N 435.362 4.453 10 10 IICE CC[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(C(F)(F)F)c1 1616600045 RGFQBRPMAOIOCE-NRFANRHFSA-N 447.501 4.217 10 10 IICE CCS(=O)(=O)N(C)c1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1618043148 LSAJOTQWTXHFAT-UHFFFAOYSA-N 425.554 4.061 10 10 IICE O=C(c1cc(OCc2ccccc2)ccc1O)N(Cc1ccccc1O)C[C@H]1CCCO1 1623640718 MOVOOXKWAYMYPR-JOCHJYFZSA-N 433.504 4.498 10 10 IICE Cc1cc(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])OCCCO3)c(C)n1-c1ccccc1 1623739804 YSUSUGDGUDKYCL-UHFFFAOYSA-N 435.480 4.136 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c(C)n1-c1ccc(Br)cn1 1624128268 VJKXRYIQRPTFJA-MSOLQXFVSA-N 434.378 4.121 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(-c3ccc(OC)c(OC)c3)n(C)n2)cc1 1624541210 KYAYQRNQEBIIDS-UHFFFAOYSA-N 436.556 4.223 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCc2ccc3c(c2)CCCN3C)cs1 1626940909 PYUCCVSZVYEBEL-CQSZACIVSA-N 430.574 4.041 10 10 IICE C[C@H](NC(=O)c1coc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1)c1ccc(N(C)C)cc1 1633315824 XWINKAAPOVFFMS-KXBFYZLASA-N 428.533 4.304 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1 1636263874 UFWAPRMWFYTTBL-LJQANCHMSA-N 446.599 4.366 10 10 IICE Cc1cc(C(=O)Nc2cncnc2-n2cccn2)c(C)n1-c1ccccc1Br 1639341296 HPPIHFSRBCNMCK-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CCN(C)c1ccc(CN2CCC[C@H]([C@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)C2)cc1 1659302692 ACYYTNDEBNPPOF-QNWVGRARSA-N 431.621 4.427 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O 1673046636 RLMCXHVYDKNXCG-DYESRHJHSA-N 427.520 4.205 10 10 IICE COc1ccc(CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)[C@@H](C)C2CC2)cc1 1676653829 YPNLCJZIMCWFFT-DFBJGRDBSA-N 438.616 4.374 10 10 IICE COc1ccc([C@H](O)C2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1686827110 WGMDTXYAGWXPFW-CLOONOSVSA-N 439.600 4.156 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2C[C@H](C)N(CC)C[C@@H]2C)cc1 1695618620 BHDMSTGPBNXPBJ-PMACEKPBSA-N 435.620 4.087 10 10 IICE CC[C@H](C)c1nnc(N2CCCC[C@H](COC)C2)n1Cc1ccc2c(c1)CCCN2C 1708501148 CIMJYSXKOSFLCI-FPOVZHCZSA-N 425.621 4.475 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1OCCC1(C)C 1708526974 IVKFALLJWBYTCO-UTKZUKDTSA-N 445.583 4.081 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@]3(CCO[C@@H]3C)C2)n1Cc1ccc(N(CC)CC)cc1 1708562712 QSOQMSQCWZZDNJ-WZOHSFFVSA-N 441.620 4.070 10 10 IICE CCC[C@@H](C)N(C)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1709478606 KMPXOUCPNMJSJO-HXUWFJFHSA-N 440.636 4.326 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCOC(C)(C)[C@@H]1C 1724234912 KZJANSORHPHTPE-IBGZPJMESA-N 425.621 4.437 10 10 IICE C[C@H]1CCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C[C@H]1C 1726618117 CECWHFYYFQVWJO-DLBZAZTESA-N 428.631 4.385 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2c(C)noc2C)cc1 1728383630 QRHNWQKKXYLTND-JOCHJYFZSA-N 438.576 4.265 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@H](C)C1 1748076651 ZBFBLAOCLCVZEL-QZTJIDSGSA-N 448.615 4.217 10 10 IICE CCOCc1nnc(N2CCSC(CC)(CC)C2)n1Cc1ccc2c(c1)CCCN2C 1767979635 JIIDJOHPHWCVFT-UHFFFAOYSA-N 443.661 4.357 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2Br)N2CCCCC2)cc1 1858074119 DZWYCJBFTIXBSL-OAQYLSRUSA-N 430.390 4.472 10 10 IICE CN1CCN(c2ccc(NC(=O)[C@H]3CCc4c(c5cc(Cl)ccc5n4C)C3)cc2)CC1 1858153672 QGQDRLKLZJFJLC-KRWDZBQOSA-N 436.987 4.327 10 10 IICE O=C(CCn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)NCc1ccccc1 1860344996 MCSCGUOLJHCLJX-UHFFFAOYSA-N 448.526 4.281 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)/C2=C/c2ccc(C(=O)O)cc2)cc1 1865675526 MCMUPSDFOLDVTM-HYARGMPZSA-N 430.435 4.363 10 10 IICE CCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCc2cccs2)C1=O 1873164485 DODTYVTWBNZDJE-UHFFFAOYSA-N 433.577 4.478 10 10 IICE O=C(COc1ccc(Cl)cc1C=C1SC(=S)NC1=O)Nc1cccc(Cl)c1 2314488345 WPSLWIPMFRBKPI-UHFFFAOYSA-N 439.345 4.500 10 10 IICE COc1ccc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccccc3C)C2=O)cc1OC 2314836823 KRZDGMJBFBBGLN-AWEZNQCLSA-N 442.562 4.241 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@](NCc3cc(Br)ccc3O)(C2)C1 2333128802 FJOZEHCOORHBFX-JLTOFOAXSA-N 425.367 4.424 10 10 IICE Cc1ccc(CN(C)C(=O)C2(CNC(=O)OC(C)(C)C)CCC2)c(O)c1Br 2381134912 JQTQINMLPOYJFW-UHFFFAOYSA-N 441.366 4.117 10 10 IICE Cc1cc(C)c(S(=O)(=O)Nc2nc(-c3ccc4c(c3)NC(=O)[C@@H](C)O4)cs2)c(C)c1 11857580 SEBMNQGJRJJYCQ-CQSZACIVSA-N 443.550 4.256 10 10 IICE Cc1cc(C)c([C@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@H]32)c(C)c1 14457784 UMFXZUOSQDYRFL-BKSPAHHJSA-N 438.593 4.459 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1Cl)N2)N1CCOCC1 14466044 VPUUIAYDDUFWLK-JKSBSHDWSA-N 430.957 4.187 10 10 IICE COc1cc(/C=C2\SC(N3C[C@H](C)O[C@@H](C)C3)=NC2=O)ccc1OCc1ccccc1 15911903 PERNXZAKWQXXKK-JUFXSQMOSA-N 438.549 4.354 10 10 IICE COc1cccc(OCCCOc2ccc(/C=C3/C(=N)N4C=CSC4=NC3=O)cc2)c1 27572553 XTHAETDLAIMUBR-JFSXHJKUSA-N 435.505 4.320 10 10 IICE COc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3Br)C2=O)cc1 33403249 OKXCHESEHSFJPR-XNTDXEJSSA-N 449.351 4.004 10 10 IICE CCN(CC)c1ccc(/C=C2\C(=O)NN(c3cccc4ccccc34)C2=O)cc1[N+](=O)[O-] 33735393 ZORQNUJLWGZPPE-XMHGGMMESA-N 430.464 4.056 10 10 IICE COc1cccc([C@H]2OC(c3cc(Br)ccc3OC(C)C)=NN2C(C)=O)c1O 64567425 FOSHXEXPELFQTL-HXUWFJFHSA-N 449.301 4.190 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccccc2F)SC1=S)Nc1ccc([N+](=O)[O-])cc1 210723242 TYXLHRGFBPADOZ-SFQUDFHCSA-N 445.497 4.354 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1c(O)ccc3c1CCCC3)O[C@H](C)C2 743600236 SLBUEKXICUJSEG-QOEFQVSFSA-N 436.552 4.348 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCCN(C)C(=O)OC(C)(C)C 743809064 KYUOAWRMMLVPIG-UHFFFAOYSA-N 429.355 4.150 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)Nc3c(Cl)ccc(C)c3C)CC2)cc1 765423607 OEHIBBXAVFVHLS-UHFFFAOYSA-N 430.980 4.299 10 10 IICE Oc1cc2c(cc1CN1CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C1)[C@H](O)CO2 768461791 DZPDKJNAKQRQGU-HRAATJIYSA-N 427.545 4.094 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802680073 SMIOTHGESRNSQP-VXKWHMMOSA-N 435.572 4.147 10 10 IICE C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1)c1ccc(N(C)C)cc1 1128242771 YZLIWFBOZFAGKE-SFHVURJKSA-N 443.613 4.197 10 10 IICE CC(C)(NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@@H]1CCCCO1 1132742624 ZTWZVIGIXSQHPD-KGAUPUERSA-N 438.640 4.193 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cccc(I)c1N 1135746514 SEQNHCHXDRQYLX-UHFFFAOYSA-N 449.336 4.136 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2ccc(N3CCCC3=O)cc2)cc1 1136425000 SSQCDZBRTWXHAK-IBGZPJMESA-N 443.547 4.453 10 10 IICE COc1ccc(CCNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1OC(F)F 1136529244 RXIGCEGWVVAYSN-UHFFFAOYSA-N 442.462 4.489 10 10 IICE CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N(CC)Cc1cc(Br)ccc1O 1137349346 PUVQOEPVQBNCPA-IBGZPJMESA-N 447.373 4.031 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3C[C@H]2O)c(C)n1-c1ccccc1Br 1137385544 UKPXEMUGJYGDQG-RTWAWAEBSA-N 425.326 4.245 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCc3ccccc3OC2)c(C)n1-c1ccc(Br)cn1 1155585007 QIPZBJKITFATHQ-GOSISDBHSA-N 440.341 4.375 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1cccc(Cl)c1 1157103186 VURSYYJAHATGDY-SFHVURJKSA-N 439.936 4.414 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@@H](C(=O)OC(C)(C)C)C[C@@H](C)C2)cc1 1162149129 ORKUDPWUJFNABC-UTKZUKDTSA-N 438.568 4.275 10 10 IICE Cc1cc(C(=O)N2C[C@@]3(C)CS(=O)(=O)C[C@@]3(C)C2)c(C)n1-c1ccc(C(C)C)cc1 1177146516 ICFWJUQZMISTNI-PSWAGMNNSA-N 428.598 4.114 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)N(C)C)cc1 1252261758 SOVSQXNWQZRMQS-REHUZNOOSA-N 448.615 4.257 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1255298819 AGPQRQWERDABSK-TZIWHRDSSA-N 444.620 4.321 10 10 IICE C[C@@H](CN1CCCCC1)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1288703622 XGEBCRDLTHVVKP-IBGZPJMESA-N 439.629 4.394 10 10 IICE CCCN1CCC(N(C)c2nnc(C3CCC3)n2CCCSc2nccs2)CC1 1294683104 LIPLHNWAKQPRRD-UHFFFAOYSA-N 434.679 4.495 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc(Br)cc(N2CCCC2)c1 1352632445 FZEMWXRNXGYHNW-UHFFFAOYSA-N 430.346 4.138 10 10 IICE COC(=O)c1cn(CC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c2ccccc12 1438181011 SZHQPMWJKMAXJB-UHFFFAOYSA-N 429.520 4.194 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)cc2)c(C)n1-c1ccc(Br)cn1 1440644945 IONPBGHMZXFVPX-UHFFFAOYSA-N 427.346 4.248 10 10 IICE CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)Cc1ccc(O)c(O)c1 1464956484 QSHIKVKWHMKXIJ-UHFFFAOYSA-N 444.837 4.188 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccc(F)cn4)CC3)cc2Cl)C1 1478528676 SDBKFWDYQRRPIB-KRWDZBQOSA-N 445.970 4.142 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1 1479002717 NUZYJZZCCWOYOM-DNQXCXABSA-N 436.600 4.414 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)cc1 1516916803 CLYALTBXDZXFGE-LJQANCHMSA-N 443.661 4.398 10 10 IICE COCCC1(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)CCCC1 1518990243 MYCIFEYWMPCXGV-UHFFFAOYSA-N 435.572 4.203 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1530833043 AVFHKOKXGCZERH-LAUBAEHRSA-N 434.367 4.204 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3ccccc3n2Cc2ccncc2)N(C)C)cc1 1539234908 ISKDZQCHTCJAJY-SANMLTNESA-N 441.579 4.183 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H](c3ccc(C)o3)N3CCOCC3)c2C)c1 1540558900 FLCARLKFZJHNDJ-DEOSSOPVSA-N 435.568 4.416 10 10 IICE COCCN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1 1543327286 ZNIDGJOWSIWZAJ-XDJHFCHBSA-N 444.553 4.097 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(F)c(N4CCOCC4)c(F)c3)c2C)c1 1544081529 YAPWPOPQWVNBLL-UHFFFAOYSA-N 439.506 4.447 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H]3CC[C@@H](F)C3)CC2)cc1F 1554960125 AQPAZSIRVWARGK-ZWKOTPCHSA-N 447.574 4.479 10 10 IICE C[C@H](NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)c1ccccc1O 1557967872 NEXGMYLNTCGZMM-HNNXBMFYSA-N 436.961 4.101 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC[C@H](C(F)(F)F)C1 1557968917 OGIHMXDXJSWSFX-LERPTODRSA-N 446.491 4.218 10 10 IICE COC(=O)c1ccc(OC)c2c1CCN(C(=O)c1cc(C)n(-c3ccccc3C)c1C)C2 1558191267 IYQGBSLKFODQSS-UHFFFAOYSA-N 432.520 4.396 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](c3nncn3C(C)C)C2)cc1 1565665848 ZZZIPKSIQWXMDR-NRFANRHFSA-N 433.556 4.028 10 10 IICE COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1568840684 FSOQMYFZYCQPKO-LJQANCHMSA-N 428.838 4.315 10 10 IICE Cc1cc(C(=O)Nc2cccc(CN3CCNC(=O)C3)c2)c(C)n1-c1cccc(C(C)C)c1 1569611872 LDHVGLDLVIJOPN-UHFFFAOYSA-N 444.579 4.402 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@H]2OCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1586619221 FPVKCRXYOREHPU-FCHUYYIVSA-N 439.556 4.096 10 10 IICE COC(=O)c1cc(C)sc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1616596763 OPPSVRUYFFMPEA-UHFFFAOYSA-N 425.554 4.203 10 10 IICE COC(=O)[C@H]1c2ccccc2CCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1620465653 BKFVCGQHYZGUPQ-XMMPIXPASA-N 430.504 4.128 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(Br)cccc2cn1 1623451925 OMUSNQGBWWOTPT-UHFFFAOYSA-N 440.341 4.106 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cc(F)c(F)cc3N3CCOCC3)c2C)cc1 1627044479 QHENIZUFDTWMRB-UHFFFAOYSA-N 441.478 4.470 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1C[C@H]1C1CCCC1 1627953422 JRBUQPHEAUXTIH-MZTIKEQGSA-N 432.586 4.360 10 10 IICE Cc1cc(C(=O)N(C)[C@H](C)C(=O)NC(C)(C)C)c(C)n1-c1ccccc1Br 1633219159 BRELWWMJFLMKQR-OAHLLOKOSA-N 434.378 4.232 10 10 IICE O=C(NCc1cccc(Br)c1O)c1ccc(Cn2cc(Cl)cn2)s1 1634725211 SCBVZJFSNRREKB-UHFFFAOYSA-N 426.723 4.044 10 10 IICE CCN(Cc1nc2c(s1)C[C@H](C)CC2)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1636354501 YZUNBSWRWFZETM-MSOLQXFVSA-N 442.629 4.335 10 10 IICE CC(C)(C)OC(=O)N1CCO[C@@H](CN(Cc2cccs2)c2ccc3c(c2)OCCO3)C1 1642028901 AQGHRSBBSPRHEA-GOSISDBHSA-N 446.569 4.162 10 10 IICE CCSc1nc(C)c([C@@H](CC)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)s1 1642155583 XLAOTJQOEINWSV-LJQANCHMSA-N 433.643 4.335 10 10 IICE CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccccc2O)c1 1643742272 WSLNBSLCSCCQTD-INIZCTEOSA-N 441.505 4.050 10 10 IICE Cc1cc(C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)c(C)n1-c1ccc(F)cc1 1649368499 RBZARLZCYIHMBB-AREMUKBSSA-N 448.586 4.342 10 10 IICE Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)c(C)n1-c1ccc(Cl)cn1 1652102915 RHXMLYJADZOJOO-UHFFFAOYSA-N 436.859 4.192 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@](CO)(C(C)C)C2)sc(C)c1-c1ccccc1 1658832370 BVVKRVDMTOOLAX-DEOSSOPVSA-N 444.597 4.179 10 10 IICE C[C@]1(Cc2ccc(F)cc2)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1674711913 DCONTGFZTVDLAU-RUZDIDTESA-N 425.548 4.094 10 10 IICE COc1ccc(OC2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1682097317 PWDQGXIXRSOZIP-LJQANCHMSA-N 425.573 4.254 10 10 IICE COc1cccc([C@@H](O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1686826689 NKECAWLXVFOCCS-DFBJGRDBSA-N 439.600 4.156 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1695624022 JDZWYIIARYMJQN-GBXCKJPGSA-N 448.615 4.020 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCC(=O)N2)nnc1N(C)[C@@H](C)C1CCCCC1 1707304985 MNRZYXLYWUQLOZ-PGRDOPGGSA-N 438.620 4.057 10 10 IICE CCO[C@H](CCn1c(C(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)C(C)C 1710401069 SOPBPOZGCVEPQG-OAQYLSRUSA-N 447.599 4.327 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1Cc1ccnc(C(F)(F)F)c1 1747749674 CAKILBWDFVBVBI-UHFFFAOYSA-N 428.418 4.077 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1749972020 PPMUNUWKDBOIOT-QUCCMNQESA-N 447.599 4.128 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1 1764677793 FHIZJYXYCDNBPV-UHFFFAOYSA-N 434.588 4.067 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)[C@@H](C)c1ccccc1O 2060123291 GZOUKNYHEFYYBB-NPPFBWRTSA-N 442.556 4.410 10 10 IICE CC(C)NC(=O)[C@H](C(C)C)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2297579955 ACODGNACFTUZCN-HNNXBMFYSA-N 441.416 4.200 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccc(F)cc3)SC2=S)cc1 2314836749 JNEWKRPCIVFFKZ-CYBMUJFWSA-N 430.526 4.453 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]3CC[C@H]32)c(O)c1Br 2352675944 LDKJXXRSNRLQQI-XHSDSOJGSA-N 425.367 4.341 10 10 IICE Cc1ccc(CNC(=O)[C@H](CCNC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2381127652 ZHRIUQQYZKMOAN-OAHLLOKOSA-N 443.382 4.266 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cc(Cl)ccc2O)SC1=S)Nc1ccc(O)cc1 15039871 KRCQPNHUGAQGNP-BOPFTXTBSA-N 448.953 4.371 10 10 IICE O=C1N=C(Nc2cc(C(=O)O)cc(C(=O)O)c2)S/C1=C\c1c(Cl)cccc1Cl 16928371 RKMJSAVVRURSSZ-AUWJEWJLSA-N 437.260 4.472 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)Nc3ccc(C)cc3)c3ccco3)CC2)cc1 38637883 LIUPVFXBVYZCCA-QHCPKHFHSA-N 434.540 4.282 10 10 IICE CCn1c(N2CCCCCC2)c(/C=C2\SC(=S)N(C(C)C)C2=O)c(C)c(C#N)c1=O 39989876 KOYPNCLIIMVMOZ-PDGQHHTCSA-N 444.626 4.038 10 10 IICE Cc1cc(C)c(S(=O)(=O)O)cc1/N=N/c1cc(O)c2ccccc2c1S(=O)(=O)O 70647068 SCXJYXMEOJKLDB-FMQUCBEESA-N 436.467 4.071 10 10 IICE in-vitro CCOc1cc(/C=C2/SC(=S)N(CCC(=O)Nc3cccc(C)c3)C2=O)ccc1O 210691582 ONLCZLUZPJWVDW-CPNJWEJPSA-N 442.562 4.329 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742801282 OUWUIFDUQIRTHC-FYINFDKHSA-N 443.494 4.281 10 10 IICE COC(=O)c1cccc(NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 743099512 YDLPIYXVSFXCCQ-OAHLLOKOSA-N 433.455 4.174 10 10 IICE Nc1c(Cl)cc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Cl 753065021 DTOBCEFJUOAANJ-UHFFFAOYSA-N 448.398 4.429 10 10 IICE C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cc(Br)c(F)cc1O 756419558 VMQQSZZYLJQKFU-MCIONIFRSA-N 438.341 4.153 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)Cc1coc(-c2ccc(S(C)(=O)=O)cc2)n1 761657622 WEYARHABEHGORL-UHFFFAOYSA-N 427.570 4.222 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@@H](c2cccs2)C1 761769990 CNDIKLLNOUQLOK-CRAIPNDOSA-N 437.512 4.101 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 765771213 VPRJRZHFYRSJPA-CHWSQXEVSA-N 430.220 4.473 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc([C@H]2CCCOC2)cc1 779853484 QEUNRVQUIQCJPW-FQEVSTJZSA-N 448.485 4.366 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc([C@@H]4CCCOC4)cc3)cc2F)C[C@@H](C)O1 779857986 STPXDFOICMBCFB-KGVIQGDOSA-N 426.532 4.263 10 10 IICE CC(C)OCc1cc(NS(=O)(=O)/C=C/c2cccc(Br)c2)ccc1O 811704426 GCLLWJZTENYVHL-CMDGGOBGSA-N 426.332 4.492 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](N3CCC3)[C@@H](F)C2)c(C)n1-c1ccccc1Br 819532144 UHVLMRGKBIYHQU-AZUAARDMSA-N 434.353 4.115 10 10 IICE CC1CC(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)(c2cccc(Cl)c2)C1 1125257653 OBHBEMXIFXEYRW-WHEQYPTASA-N 439.987 4.026 10 10 IICE CCc1nc(C)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1128505702 AWSCZGBQJPVTMP-GXDHUFHOSA-N 435.571 4.383 10 10 IICE CN(C)c1ccc(-c2cncc(C(=O)NCc3ccc(N4CCSCC4)cc3)c2)cc1 1141804044 QZTLPLYALCWNFF-UHFFFAOYSA-N 432.593 4.298 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@@H](C)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1146949887 JEBFHZMODZDMCQ-AABGKKOBSA-N 445.604 4.063 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1 1162107235 FLXILTMOWBKSGT-RJDQKLELSA-N 431.536 4.172 10 10 IICE COC(=O)/C=C\c1ccc(N2CC(Cc3ccccc3Br)C2)c([N+](=O)[O-])c1 1187224914 WTQALVLOTIBLBP-CLFYSBASSA-N 431.286 4.222 10 10 IICE CSc1ccc(N2C[C@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1287662385 ZTPZGYFKOBSUBD-HXUWFJFHSA-N 433.577 4.485 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CCc1cccc(F)c1Br 1290324527 UPPSLMBPQGDNKD-UHFFFAOYSA-N 435.337 4.016 10 10 IICE Cn1cccc1-c1nnc(N2CCO[C@@H](C(C)(C)C)C2)n1CCCSc1nccs1 1298861190 ITZNKFMQSGVQLH-QGZVFWFLSA-N 446.646 4.174 10 10 IICE Cc1cc([C@H](CC(=O)N2Cc3cccc(O)c3C2)NC(=O)OC(C)(C)C)cc(Cl)n1 1302786311 HOZOHKFUBNCGCT-KRWDZBQOSA-N 431.920 4.247 10 10 IICE COc1cc(CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c(Br)cc1O 1312966529 NHBFLWQFDUHCKE-UHFFFAOYSA-N 448.361 4.104 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3ncc(-c4ccc(OC)cc4)o3)CC2)cc1 1324627509 UTAWVNFPXFBSAB-UHFFFAOYSA-N 435.524 4.030 10 10 IICE CCC(=O)c1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 1437706692 RTAOECGSPMHARA-UHFFFAOYSA-N 428.400 4.215 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c(O)c(C(C)C)c1 1441944048 GGRKSWOTULFILC-LJQANCHMSA-N 437.584 4.271 10 10 IICE CCCNC(=O)OC[C@@H]1CCCCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1449101297 QRKLMGDVJTWCOO-QFIPXVFZSA-N 439.556 4.346 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCCC[C@@H]2c2ncc(-c3cccc(F)c3)[nH]2)cc1 1460041490 UFNJDOWCMCARSV-HSZRJFAPSA-N 435.547 4.125 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](c1ccc(F)c(F)c1)c1nccn1C 1470556390 TYTCGLMVFBYHGM-OPAMFIHVSA-N 441.526 4.093 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(O[C@@H](C)c4ccccc4)nc3)CC2)c(OC)c1 1470859401 WOVPYZYBPVYSRK-IBGZPJMESA-N 447.535 4.201 10 10 IICE Cc1cc(C(=O)CSc2nc3ccccc3c(=O)n2C)c(C)n1-c1ccc(Cl)cn1 1472934201 BFBKMEPKARRHDM-UHFFFAOYSA-N 438.940 4.364 10 10 IICE CC(C)(NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1479030455 IHIGVXMGXGZGGS-UHFFFAOYSA-N 435.490 4.401 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC[C@@H]1CCCCO1 1495638874 HRFBXWRSYLHRLX-REWPJTCUSA-N 441.620 4.476 10 10 IICE CC(C)CN(c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1)C1CCCC1 1509373122 PCRIQRWKACLGJZ-IBGZPJMESA-N 429.584 4.440 10 10 IICE Cc1cscc1Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1511487023 ZTIBMXMRRSOFGM-UHFFFAOYSA-N 439.629 4.368 10 10 IICE C[C@@H]1N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCOC1(C)C 1512569214 HMSXFYPZCFJQQH-SFHVURJKSA-N 443.661 4.181 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1532655552 MKFDKKAGNIIHKP-YCRPNKLZSA-N 448.350 4.004 10 10 IICE CSc1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)o1 1544267542 GBSMMHPBQJPAOR-GOSISDBHSA-N 433.574 4.372 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)Cc2ccc(Br)c(Br)c2)c1 1545683995 GYPJKVGIRNVXLE-SNVBAGLBSA-N 443.135 4.346 10 10 IICE C[C@H](CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCc2ccccc21 1546185059 GCOFGVBQBQRXFL-QGZVFWFLSA-N 429.511 4.214 10 10 IICE COc1ccc([C@H](CO)N(C)C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1546240753 DKBFHHFPECPQLD-QHCPKHFHSA-N 426.944 4.491 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1sc(C)nc1-c1cccs1 1557115986 ZOMHCOKPPFJWDT-UHFFFAOYSA-N 430.551 4.020 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2C[C@H](C)N(CC(F)(F)F)[C@H](C)C2)CCCC1 1558697004 CCDLGBHONBSCOE-IYBDPMFKSA-N 437.506 4.012 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](C)CN(C)C(=O)OC(C)(C)C 1566306373 JFBNWIMZYLHWCN-ZDUSSCGKSA-N 429.355 4.006 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccc2c(c1)CCO2 1567906198 GPWDNVWSWANBBK-QFIPXVFZSA-N 438.911 4.327 10 10 IICE O=C(NCc1cccc(Br)c1O)c1csc(-c2ccc(F)c(F)c2)n1 1568606013 VYEYAGPULDEPIG-UHFFFAOYSA-N 425.254 4.486 10 10 IICE COc1ccc(CNC(=O)/C=C\C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)cc1 1597567525 QJQQGCMGYVCELA-UAMJFUFUSA-N 444.531 4.363 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N(C)Cc1cnc(C(C)C)nc1 1611963905 FKXKPUJOZSUYSZ-UHFFFAOYSA-N 433.604 4.203 10 10 IICE Cc1cc(CC(=O)N2CCCN(Cc3noc(C(C)(C)C)n3)CC2)c(C)n1-c1ccccc1 1618107727 NEPOGZSZJUQTHZ-UHFFFAOYSA-N 449.599 4.052 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4ccc(F)cc4)nc3)CC2)cc1F 1622564150 QZUAFOVSDQXVKS-UHFFFAOYSA-N 425.435 4.123 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CCc3ncc(Br)n3C2)c1 1623397606 BHGUBBLUMVMUPJ-AWEZNQCLSA-N 447.764 4.451 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(Cl)ccc3-n3cnnn3)cc2Cl)C1 1626168561 AKIFSDCFJKJPJA-CQSZACIVSA-N 445.354 4.135 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1 1629244508 BVFBDSGGAGHXPX-HSZRJFAPSA-N 449.938 4.024 10 10 IICE C[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)N(C(=O)OC(C)(C)C)C1CC1 1631511677 DNHPHDPXBQNRJD-OAHLLOKOSA-N 443.510 4.432 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2cc(Br)ccc2OC(F)F)cc1 1632036155 XQISHPJFAUGXOU-UHFFFAOYSA-N 427.205 4.143 10 10 IICE Cc1cc(C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(C)n1-c1ccc(F)cc1 1633989220 MMPIWBQTAHYCRV-PMACEKPBSA-N 427.520 4.457 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](C)CCCNC(=O)OC(C)(C)C)CCCC1 1637533430 NOISIRRGWJYLST-QGZVFWFLSA-N 443.588 4.338 10 10 IICE Cc1cc(CC(=O)N2CCC([C@]3(C)COC(=O)N3)CC2)c(C)n1-c1ccc(Cl)cc1 1638481540 UGQZPORKCOJGEC-QHCPKHFHSA-N 429.948 4.027 10 10 IICE Cc1cc(C(=O)NCc2ccc(OCC(F)(F)F)nn2)c(C)n1-c1cccc(Cl)c1 1640236891 SSKRUNAATQCOAU-UHFFFAOYSA-N 438.837 4.409 10 10 IICE CCOC(=O)c1cnc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1C 1654546477 RVQMNKHMSQEBNT-UHFFFAOYSA-N 445.317 4.019 10 10 IICE Cc1cc(CN(C)CC(=O)Nc2ccc(Br)cn2)ccc1N1CCCCC1 1657285472 YXOJEIULOFASJG-UHFFFAOYSA-N 431.378 4.213 10 10 IICE CSc1ccccc1OC[C@H](O)CN(C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(C)C 1671844312 NVAVRWLXDBQZCH-GHTZIAJQSA-N 445.629 4.395 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1C 1673745495 VCOQFLNPKKQQDA-OTWHNJEPSA-N 432.609 4.031 10 10 IICE C[C@H]1CC[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CN1C(=O)OC(C)(C)C 1675001287 IGFXYXCOCDVLDF-HKUYNNGSSA-N 430.593 4.215 10 10 IICE CC[C@H](C)CN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)cc1C 1694181056 NJQFEOXUHJBNHS-IBGZPJMESA-N 445.615 4.422 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCC(F)(F)C2)cc1 1695626211 YEERDCLIKPFUQF-UHFFFAOYSA-N 426.515 4.004 10 10 IICE Cn1cc(C[C@@H]2CCN(c3nnc(C(C)(C)C)n3CCCSc3nccs3)C2)cn1 1696856190 DCCIZUCZQRKKNB-INIZCTEOSA-N 445.662 4.017 10 10 IICE COC1(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)CCC(C)CC1 1697234731 CUGGMRVGWLMBRP-UHFFFAOYSA-N 435.572 4.201 10 10 IICE CCC(CC)(Cn1c(CC(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1708678362 MPFSHTFBACOOQO-UHFFFAOYSA-N 443.636 4.407 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H]3OCCC[C@@H]3C2)cc1 1710026986 VCEVOZNNCGRBFQ-FYYLOGMGSA-N 425.621 4.376 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OCC)C1 1710822917 PWJYEDFLMLHCRR-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728920004 BIXKBCDPKFSEHN-FCHUYYIVSA-N 436.604 4.336 10 10 IICE CN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1 1729346283 NUNNTEHNLKOXKT-UHFFFAOYSA-N 429.584 4.369 10 10 IICE CSC1(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)CCN(C)CC1 1731063620 DFVCVQKPOAJNNB-UHFFFAOYSA-N 431.650 4.036 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1744807408 KEEGFXRQDNKCIG-TZMOSPSESA-N 441.620 4.050 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(COCC)n2Cc2ccc(N(C)C)cc2C)CC1 1745848067 DFBFYAWQGPPFNK-JOCHJYFZSA-N 429.609 4.023 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765063936 MIZWCHRYOFRMCQ-NZQKXSOJSA-N 439.648 4.358 10 10 IICE O=C(O)[C@@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 1858591409 KMTFPOHDLIZCQG-AAWPKVBNSA-N 434.882 4.275 10 10 IICE O=C(Cc1ccc(Br)s1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1858765237 RDHCDTJGDNLXBP-UHFFFAOYSA-N 426.291 4.467 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CN3CCN(C(=O)OC(C)(C)C)CC3)cc2)c1 1872881381 OZZGWFJPIFGRHD-UHFFFAOYSA-N 438.572 4.058 10 10 IICE CCN1C(=O)C(Nc2ccc(OC)cc2OC)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422656 IJXKMWCZFPCNKR-UHFFFAOYSA-N 445.519 4.323 10 10 IICE CC[C@@H](NCC1CN(C(=O)OCc2ccccc2)C1)c1cc(Br)ccc1O 1914339323 JSOJSXROGZMWRI-LJQANCHMSA-N 433.346 4.464 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)c1ccc2c(c1)CCN2C 1999507075 GCYLQOISKQUTJJ-IMRHEYAYSA-N 426.557 4.211 10 10 IICE CN1CCCc2cc([C@H](O)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999524187 WJEMGBBYPICRJE-GMAHTHKFSA-N 426.557 4.213 10 10 IICE CCCN1C(=O)C(=Cc2csc(N(C(C)=O)c3ccc(OC)cc3)n2)SC1=S 2042449563 FGEPMQSEKKQGIZ-UHFFFAOYSA-N 433.580 4.448 10 10 IICE COc1ccc(Cn2nc(C3(C)CC3)c(C3(C)CC3)c2I)c(O)c1 2079753307 DGVXGKSPQCIXDI-UHFFFAOYSA-N 438.309 4.353 10 10 IICE C[C@@H]1C[C@@H](NCc2cc(Br)cc(F)c2O)CCN(C(=O)OC(C)(C)C)C1 2103298765 FSCZLGGIFHGKGT-DOMZBBRYSA-N 431.346 4.419 10 10 IICE Oc1cccc(Br)c1CN[C@@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156287992 KDXZOCILBSBFOD-AVRDEDQJSA-N 431.374 4.068 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c1O 2236048570 FCVBNEDONOQGJK-XJKSGUPXSA-N 443.382 4.336 10 10 IICE N=C1C(=Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C(=O)N=C2SC(C(F)(F)F)=NN12 2293559177 FWMQRZSYGKTTBD-UHFFFAOYSA-N 435.343 4.036 10 10 IICE COc1ccccc1C=C1SC(=S)N(NC(=O)c2ccccc2Br)C1=O 2296879820 DYUJASKLDVLUKX-UHFFFAOYSA-N 449.351 4.004 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2ccc(OCc3cccc(C)c3)cc2)SC1=S 206836243 SLRBGRJSBOZXNQ-UYRXBGFRSA-N 427.547 4.338 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(OC)c(O)c1)N2 251354329 NMFAWQPPLQLABQ-OMKFPNQOSA-N 428.554 4.304 10 10 IICE O=C(NCc1cn2cc(Cl)ccc2n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726611604 SLJHHGXSLOOIFZ-UHFFFAOYSA-N 449.889 4.057 10 10 IICE O=C(NCCSCc1ccccc1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726702498 LJVRHAOSJQGXBK-UHFFFAOYSA-N 435.540 4.489 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](c3c(C)nn(C)c3C)C(F)(F)F)c2C)cc1 746447370 YQESCOYSYVRFAB-FQEVSTJZSA-N 434.462 4.486 10 10 IICE C[C@]1(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCCN1C(=O)c1ccccc1 754546886 QQBWRAFDKXODKI-HHHXNRCGSA-N 438.483 4.095 10 10 IICE C[C@H](NCc1ccc(Cn2ccccc2=O)cc1)c1cc(Br)c(F)cc1O 756478153 DISNQXSFLLJPRE-AWEZNQCLSA-N 431.305 4.355 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc([C@H]2CCCOC2)c1 767087692 KQUFKWQQGDDPBN-UGKGYDQZSA-N 428.960 4.334 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@@H]1c1nnc(CC(F)(F)F)o1)c1ccc(N(C)C)cc1 812200067 NTWIEUNWKKSJFT-CZUORRHYSA-N 425.455 4.238 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](Oc3ccc(Cl)cc3)C(C)C)cc2F)CC1 1125906893 DPZWEBPWIFCAJO-QHCPKHFHSA-N 447.982 4.341 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)N3Cc4ccccc4C3=O)cc2Cl)C1 1128384281 KIWTTZGMGCBAPG-IAGOWNOFSA-N 425.960 4.237 10 10 IICE Cc1nc2cccc(Cl)c2cc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549451 LLEJDUVMGSQPAU-UHFFFAOYSA-N 431.870 4.241 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(-c3ccc(C=O)o3)ccc2O)cc1 1142712883 JKKFELKLIDGNBS-OAQYLSRUSA-N 448.519 4.352 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)OCCN(C(=O)c1ccc(N=NC(N)=O)cc1)C2 1152927184 AGSCMUNZAODSLE-UHFFFAOYSA-N 439.472 4.231 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 1156288604 ZUEBWPNFSLVMEP-RTWAWAEBSA-N 439.512 4.087 10 10 IICE Cc1cc(C(=O)N2[C@@H](C)[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccn1 1162925909 LEMPEQLNYRUVSW-SQNIBIBYSA-N 426.561 4.348 10 10 IICE CC(=O)c1cc(F)cc(CN(CCNC(=O)OC(C)(C)C)CCc2ccccc2)c1O 1194299906 JGBKTYTXGLTRAQ-UHFFFAOYSA-N 430.520 4.303 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H](NC(=O)c4ccc(Cl)cc4)C3)cc2)CC1 1198229735 LYOSQPAZGKAWMD-JOCHJYFZSA-N 442.003 4.350 10 10 IICE CC[C@@](CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)(C(=O)OC)c1ccccc1 1275725347 DBJWUGXKVVZONA-SANMLTNESA-N 436.552 4.155 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccccc3OCCOc3ccccc3)C2)cc1 1278861071 GGEUNWDEZHEEDG-FQEVSTJZSA-N 432.520 4.162 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1)C(C)C 1299642853 JFLLLHZAPONUEJ-GGAORHGYSA-N 437.588 4.249 10 10 IICE O=C(CSc1cc(Cl)ccc1Cl)NCc1ccc(N2CCC(O)CC2)cc1 1301348891 BKWRBCDXHFQUIU-UHFFFAOYSA-N 425.381 4.363 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCC=C(Br)C1 1304239749 AGLBDYCPUYCJKN-UHFFFAOYSA-N 430.394 4.142 10 10 IICE CC(C)C1(Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)CC1 1359668027 QEGDBIOLYIPGFS-UHFFFAOYSA-N 425.621 4.485 10 10 IICE Cc1cc(CC(=O)N(C)CCn2cc(Br)cn2)c(C)n1-c1ccc(Cl)cc1 1436594658 AEVHXJPOTYPMBC-UHFFFAOYSA-N 449.780 4.408 10 10 IICE CCn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(-c2ccccc2)n1 1441783744 NKWTVGWIHYXOCS-ROUUACIJSA-N 436.531 4.253 10 10 IICE C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445878787 BWOKVJAXFUYKGT-WMLDXEAASA-N 449.960 4.215 10 10 IICE C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NCc3ccc4cccnc4c3O)cc2[N+](=O)[O-])C1 1451943177 HSTHIJGVNRNUIF-IYBDPMFKSA-N 434.496 4.261 10 10 IICE CCOC(=O)C(F)(F)[C@H](NCc1ccc(N2CCC(OC)CC2)cc1)c1ccccc1 1460134441 HERMYFRKWSEXFD-JOCHJYFZSA-N 432.511 4.331 10 10 IICE COc1ccccc1-c1ccc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)s1 1462801677 BHCWLRMQWRKHHA-UHFFFAOYSA-N 449.576 4.055 10 10 IICE COC(=O)C[C@@H](CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CC1 1470119340 IABRXGWSPRALJA-INIZCTEOSA-N 433.346 4.176 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3cccc(Br)c3)C2)cc1 1470592831 HULXUFWWQKXLDM-KRWDZBQOSA-N 432.362 4.126 10 10 IICE COC(=O)COc1ccc(CN(C)C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1471033808 HZJCULRLUNWRQN-UHFFFAOYSA-N 449.551 4.296 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H]3CCC[C@@H]32)n1Cc1ccc(N(CC)CC)cc1 1496787479 HMRSQNUQJYQLKT-UGKGYDQZSA-N 438.620 4.080 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cc2ccccc2o1 1515589744 UXKFGGAUOISNBU-YBFXNURJSA-N 440.521 4.480 10 10 IICE CC[C@H](CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OC)cc1 1518324460 FERBEAYXISKSCL-HSZRJFAPSA-N 435.612 4.427 10 10 IICE COCC1CCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC1 1518888981 GQRBYYRTBSXJLP-KRWDZBQOSA-N 437.635 4.021 10 10 IICE Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N(C)Cc3ccc(N4CCCC4)cc3)C2)c1 1523554294 SXOZKSBZPNCSGM-QHCPKHFHSA-N 433.596 4.414 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CSCN3C(=O)C(C)(C)C)cc2Cl)C1 1524245939 UGAJMJOFDBPWES-BEFAXECRSA-N 438.037 4.140 10 10 IICE Cc1cc(CC(=O)NCCCNC(=O)c2cccc(F)c2)c(C)n1-c1ccc(Cl)cc1 1531463420 DFWBKPLIDCICHR-UHFFFAOYSA-N 441.934 4.365 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C3(Cc4ccc(OC(F)(F)F)cc4)CC3)C2)cc1 1532105392 LWQMHNRDQPONLK-KRWDZBQOSA-N 434.458 4.312 10 10 IICE CCc1ccccc1N1C[C@@H](C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1534242273 MDNCCIOBCHCOJK-QHCPKHFHSA-N 429.564 4.368 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3cccnc3OCC(F)(F)F)c2C)cc1 1540755202 YWQTYWQLOQFWJP-UHFFFAOYSA-N 433.430 4.369 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC1CCOCC1 1545332435 GWBQMDUKYUCTOH-HXUWFJFHSA-N 441.620 4.081 10 10 IICE Cc1ccc(CN2CC[C@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1556451630 PBGQUWIHNUFVLV-DEOSSOPVSA-N 443.547 4.054 10 10 IICE CCC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)C(C)(C)C 1556659171 VVDWJYDWZZYJCM-IBGZPJMESA-N 449.529 4.046 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1564454299 KFQRSCPPIPECSQ-GOSISDBHSA-N 436.339 4.426 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc4c(cc3Cl)NC(=O)CO4)cc2Cl)C1 1568142314 REINFEJTKBVSPA-ZDUSSCGKSA-N 448.350 4.491 10 10 IICE CCCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1583920128 WRJZEXBKTHAMEY-SIKLNZKXSA-N 447.620 4.296 10 10 IICE C[C@]1(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C[C@]1(F)Cl 1586777706 KWKAAVSHARYUEQ-YLLXALGISA-N 444.956 4.238 10 10 IICE CN(C)c1ccc(CN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C2CC2)cc1 1595318426 RIDNVCDUOPVHPG-UHFFFAOYSA-N 444.457 4.468 10 10 IICE CCOC(=O)c1cnc(NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)s1 1612346016 ZQDUTRJGFMAFDZ-INIZCTEOSA-N 434.562 4.064 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCOC[C@@H]1C 1613295984 TWCILCXKWXNUKH-PCCBWWKXSA-N 441.620 4.190 10 10 IICE CSC[C@@H]1CCCN1c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)cc1C 1620257776 QMMXQEHFQHZADD-QFIPXVFZSA-N 436.629 4.018 10 10 IICE CCCN(Cc1ccccc1O)C(=O)CCNS(=O)(=O)c1c(C)c(C)c(C)c(C)c1C 1622319753 YFGWPPKCJITHPC-UHFFFAOYSA-N 446.613 4.042 10 10 IICE O=C(Cc1ccc(C(F)(F)F)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634769 IFTWFUCJDAQTBZ-SFHVURJKSA-N 426.866 4.388 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H](C)C(=O)c1cccc(F)c1 1626511395 MDUITXIBDNNGQR-KRWDZBQOSA-N 442.531 4.423 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1-c1ccon1 1630281217 YUEDVVDRDPUKAN-INIZCTEOSA-N 430.455 4.082 10 10 IICE Nc1c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc(Cl)c1Cl 1630718792 MJGHDRLTOWPBQG-UHFFFAOYSA-N 433.383 4.038 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3c[nH]c4cc(Br)ccc34)CC2)cc1 1632153924 KHFDGQZNFJXJNV-UHFFFAOYSA-N 442.357 4.220 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(Nc2nccc(C(F)(F)F)n2)c1 1633818472 IXWANLIUVSMJON-LBPRGKRZSA-N 432.402 4.011 10 10 IICE Cc1ccc(CN2CC[C@H](NC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2=O)cc1 1634913770 RHTVKKQGFLLNOG-DEOSSOPVSA-N 430.552 4.003 10 10 IICE O=C(CSc1ccccc1C(=O)NCc1cc(O)ccc1O)NC1CCCCCCC1 1644752826 WBKZYBOMAXPYOZ-UHFFFAOYSA-N 442.581 4.349 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc2nnc(-c3ccccc3F)n2n1 1651627589 MUQFOMQDWWXNLP-UHFFFAOYSA-N 442.292 4.425 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2[C@@H](C)CO)sc(C)c1-c1ccccc1 1654194446 PRSBUNHKDVZAPZ-QFBILLFUSA-N 444.597 4.322 10 10 IICE COc1ccc(N(CC(=O)NCCc2cnn(-c3ccccc3)c2)Cc2ccccc2)cc1 1657745690 KFHLATGPXJEKRL-UHFFFAOYSA-N 440.547 4.246 10 10 IICE COc1ccc(N(CC(=O)NCCOc2cccc(C(F)(F)F)c2)C(C)C)cc1F 1657771322 VNDWSXDVSGZGET-UHFFFAOYSA-N 428.426 4.263 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOc4cc(Cl)ccc43)CC2)cc1F 1670972396 HRVPMQLDYMPVPT-LJQANCHMSA-N 433.911 4.233 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)c2C)c1 1684479065 RILSUDCSGHEHOQ-SFHVURJKSA-N 428.577 4.457 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](c4cccc(C(F)(F)F)c4)C3)cc2)CC1 1684874703 SJTOLQVQKBJKKD-HXUWFJFHSA-N 446.517 4.156 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(c4ccc(Cl)cc4)CCCC3)cc2)CC1 1684970490 PKGSTCQMNBZMOS-UHFFFAOYSA-N 426.992 4.361 10 10 IICE Cc1cc(CNC(=O)NCCc2cccc3c2OC(F)(F)O3)c(C)n1-c1ccccc1 1687099624 TVNSTQMBOKWOSY-UHFFFAOYSA-N 427.451 4.458 10 10 IICE CC(C)N(CCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)C(C)C 1692482161 MBTZZTLLELFEHR-OAQYLSRUSA-N 429.609 4.023 10 10 IICE CC(C)OCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706706432 SSXYTXATZAMDMW-JOCHJYFZSA-N 427.593 4.181 10 10 IICE COc1ccc(-c2nnc(Nc3cnn(C)c3)n2CCCSc2nccs2)cc1 1711782857 DRAJBVSNUGTRDF-UHFFFAOYSA-N 427.559 4.070 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3CCC3CC(OC(C)(C)C)C3)CC2)cc1F 1711865737 FTUOBHXBTFTUKR-UHFFFAOYSA-N 445.583 4.045 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)O[C@H](C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1742119014 HTRAGFDBPHOLGN-WOJBJXKFSA-N 437.588 4.129 10 10 IICE CCS[C@@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1747494063 NCOJVGXPKVHDLK-JOCHJYFZSA-N 443.661 4.398 10 10 IICE Cc1nc(Cc2nnc(N(C)CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1751762386 CFHILADUGQIBOP-UHFFFAOYSA-N 430.597 4.370 10 10 IICE CC(C)c1nnc(N2CC[C@](O)(c3ccc(F)cc3)C2)n1CCCSc1nccs1 1760914593 NLBLXKGXIRTCCK-OAQYLSRUSA-N 447.605 4.277 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763790671 JQLRRRAXPMPZCR-SFHVURJKSA-N 440.567 4.170 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccco2)cc1 1764938333 JSLAEIMNWZGPHI-UHFFFAOYSA-N 430.556 4.388 10 10 IICE COc1cc(N2CCC(NC(=O)c3ccc(Cl)cc3Cl)CC2)cc(OC)c1OC 1858044180 KIFCUJCJNWGQHR-UHFFFAOYSA-N 439.339 4.418 10 10 IICE C[C@H]1CCCN(C(=O)Cn2c3c(c4ccccc42)CCN2C(=O)c4ccccc4N(C)[C@H]32)C1 1860347510 SMFAOHRBFXMGTM-QYBDOPJKSA-N 442.563 4.047 10 10 IICE CN1c2ccccc2C(=O)N2CCc3c(n(CC(=O)NC4CCCCC4)c4ccccc34)[C@@H]21 1860347523 SRTYPUUYWBWKLE-AREMUKBSSA-N 442.563 4.237 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CC3)C(=O)N(CCc3ccccc3)C2=O)cc1 1873166635 DVPFOCYRQZMXSF-UHFFFAOYSA-N 425.532 4.169 10 10 IICE COc1ccc(OC)c2[nH]c(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)cc12 1874179071 LNEWLQHFAWBESU-UHFFFAOYSA-N 426.428 4.213 10 10 IICE CC1(C)CN(Cc2ccccc2)[C@H](CNCc2cc(Br)cc(F)c2O)CO1 2194639829 ZMBOVJDNCPMIIU-GOSISDBHSA-N 437.353 4.063 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S)Nc1ccc(Cl)cc1 2296880211 WITWWJZQBZACJC-UHFFFAOYSA-N 446.937 4.299 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352684932 CBAKFMWBWBHWMZ-BPUTZDHNSA-N 425.367 4.341 10 10 IICE Cc1cc(N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)nc(C(C)C)n1 31493558 JJBXPPWRVNZJSE-UHFFFAOYSA-N 435.547 4.417 10 10 IICE O=C(C1=CN(c2ccc3c(c2)CCC3)c2cc(Cl)ccc2S1(=O)=O)N1CCCC1 33283205 JXACUXUVIHBUMO-UHFFFAOYSA-N 428.941 4.218 10 10 IICE CCOc1cccc(N2C(=O)N=C(O)/C(=C/c3cccn3-c3ccc(C(=O)O)cc3)C2=O)c1 33497899 OBZFKRCINGLCKK-ZHZULCJRSA-N 445.431 4.081 10 10 IICE O=[N+]([O-])c1cccc(/N=N/N(c2cccc([N+](=O)[O-])c2)S(=O)(=O)c2ccccc2)c1 59464952 LRHUUIRALZXRNL-FMQUCBEESA-N 427.398 4.397 10 10 IICE Cc1cc(C(=O)Nc2ccc(Cn3cccn3)cc2)c(C)n1-c1ccc2c(c1)OCCO2 108640160 OSNQWVLTFUNUEV-UHFFFAOYSA-N 428.492 4.362 10 10 IICE CSCCc1ccc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 727944769 PRIRXSMIUUNDNK-UHFFFAOYSA-N 435.593 4.297 10 10 IICE COc1ccc(C[C@@H](C)NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1OC 730131620 SRNNEWDPZIOEMW-LJQANCHMSA-N 425.573 4.467 10 10 IICE O=C(Cc1ccc(Br)s1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 733933396 RLBULEHHLYHNPT-UHFFFAOYSA-N 445.329 4.440 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 764537218 LIPOVBLEQPEDRV-LAUBAEHRSA-N 430.593 4.072 10 10 IICE Cc1ccc(COC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c(C)n1 771985092 MQDZTSASTXVGOZ-BOPFTXTBSA-N 432.592 4.485 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1C[C@H]1c1cccc(Br)c1 804733237 MVGOZBXYNOYLTH-GJZGRUSLSA-N 425.120 4.337 10 10 IICE O=C(NCc1cc(Br)ccc1O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 805004191 LCXAPWNKRJDPDC-ZDUSSCGKSA-N 438.753 4.134 10 10 IICE Cc1cc(C(=O)COC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 811432455 BWWAAMZSCKSRJJ-OAQYLSRUSA-N 444.503 4.025 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1 1125235841 VOJXMDYDGCVMFO-GOSISDBHSA-N 425.520 4.041 10 10 IICE Cc1cc2c(Br)ccc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)c2o1 1132899199 OOXMSKANWRNDBA-UHFFFAOYSA-N 442.357 4.186 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)cc1 1136196000 OUVFOOKYGJPRPR-UHFFFAOYSA-N 437.883 4.072 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1c(O)cc(Cl)cc1Cl 1183006665 COSIPTRKXXZQBC-UHFFFAOYSA-N 434.367 4.161 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc(Br)ccc3Cl)C2)cc1 1230858878 PPYSMYZZWZJGMI-OAHLLOKOSA-N 438.753 4.189 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2cccc(N3CCOCC3)c2)cc1 1251491582 CZXMHGOOPNQLGH-UHFFFAOYSA-N 448.567 4.094 10 10 IICE CC[C@H](C)c1nnc(N2CC(C)(C)OC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1291467990 GDZIIERTZWYVPQ-OALUTQOASA-N 443.661 4.397 10 10 IICE Cc1cc(Br)c(N)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 1292381599 GPTIFLGYLAUPAU-SFHVURJKSA-N 446.389 4.227 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1c(C(F)(F)F)nc2ccccn12 1294686532 XWPYOGUMQGTUQE-UHFFFAOYSA-N 442.235 4.484 10 10 IICE CN(C)c1ccc([C@H](CNc2ncnc3[nH]c(Cl)cc23)NC(=O)OC(C)(C)C)cc1 1307110828 FBKHQGBKPRMMLS-INIZCTEOSA-N 430.940 4.355 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1CCOC1CCCCCC1 1314752634 CHWZHAGEHFMZHQ-HXUWFJFHSA-N 428.577 4.254 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C/[C@]3(C)CC[C@@H](C)C3(C)C)CC2)cc1 1353706656 JCAOKNBRYSWLBF-CWJWPSJBSA-N 427.633 4.342 10 10 IICE COc1ccc(C(C)(C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1OC 1357324283 UUGHJUHRCRBTFN-UHFFFAOYSA-N 429.472 4.396 10 10 IICE Cc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1Cl 1357519668 UMFCPEHWTBIHLP-UHFFFAOYSA-N 426.866 4.363 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)S[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1359794497 XRQNRBKPDCLSFN-OALUTQOASA-N 445.702 4.408 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)C1(C)C 1445636414 AOYSQEQXXZEVOB-UYAOXDASSA-N 428.529 4.453 10 10 IICE CCCN(CC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)Cc1ccccc1O 1459559441 YYZBMGNTUWNDEK-JOCHJYFZSA-N 429.992 4.211 10 10 IICE C[C@@H](CC(=O)NCc1ccc2c(c1)CCCN2C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1464509980 FDLNHBNLGBDVAR-RXVVDRJESA-N 429.605 4.359 10 10 IICE CCc1nsc(N2CCCN(C(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2)n1 1465417094 QUUZCKCSVFCJSQ-UHFFFAOYSA-N 437.613 4.477 10 10 IICE COC(=O)[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)c(C)c1 1466689366 KDKUXXQJCOPJOP-QHCPKHFHSA-N 436.483 4.307 10 10 IICE COC1CCN(c2ccc(CN[C@@H](CO)c3ccc(Br)c(F)c3)cc2)CC1 1473508178 XWSTVEZXOYEFHS-NRFANRHFSA-N 437.353 4.027 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@H]1COC(=O)NC1CCCC1 1478841081 OYKHSCAMJPLPTM-XXBNENTESA-N 444.620 4.225 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCC[C@H](C(F)(F)F)C2)cc1F 1503392013 BIODQTVDZUTIHY-INIZCTEOSA-N 425.474 4.263 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCCCSC)CC2)cc1 1504292042 FSZXEJJSQYXYOA-UHFFFAOYSA-N 429.634 4.414 10 10 IICE O=C(CCCOc1cccc2ccccc12)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261726 OVSNZOBXNYAPAV-UHFFFAOYSA-N 440.490 4.430 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3ccccc3)nc3c2c(C)nn3C)cc1 1530896204 GAFVFTMCIVDYCB-UHFFFAOYSA-N 443.551 4.161 10 10 IICE Cc1cc(-c2nnc(N3CCCCCCC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1542184099 PUOUTUOJCCTMSO-UHFFFAOYSA-N 434.588 4.211 10 10 IICE COC(=O)/C=C/c1ccc(N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c([N+](=O)[O-])c1 1559156695 HHDVRNVGWBVAPK-TZTLJZABSA-N 439.512 4.033 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccccc3OC3CCCCC3)cc2)CC1 1598008903 IQAYLESNNKSMNZ-UHFFFAOYSA-N 435.568 4.030 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCCC(F)(F)F 1603303484 QUQZKTGLIMRYAI-UHFFFAOYSA-N 439.526 4.292 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2nc3c(s2)CN(C(C)C)CC3)cc1 1611533224 JAYJEHRGYGRRMR-UHFFFAOYSA-N 436.581 4.311 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1 1624523564 VAVRNEVQGRPONV-HSZRJFAPSA-N 435.593 4.464 10 10 IICE Cc1ccc(C)c(C2=NO[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)C2)c1 1626106353 NYDTZGQHNWLHPJ-RDGATRHJSA-N 435.568 4.070 10 10 IICE Cc1cncc(/C=C\C(=O)N2C[C@@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)c1 1626448346 QYJMUZYOLADFJM-GNJLHFKMSA-N 425.504 4.273 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(=O)n(C)cc1Br 1632696997 CBLUGOFZQFTTIE-OAHLLOKOSA-N 441.325 4.257 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@]3(C)Cc3ccc(Cl)c(F)c3)nc12 1644178810 KKWWCZIXGHSXPF-JOCHJYFZSA-N 446.910 4.001 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC2(CCN(C(=O)c3cc(O)cs3)CC2)Oc2ccccc21 1648318302 JFMKGSILPIJLJO-QGZVFWFLSA-N 444.553 4.477 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)N(C)C)cc1 1653421827 SQKFDUVRESIUEU-RTWAWAEBSA-N 448.652 4.143 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)C[C@H](O)c1cccc(Br)c1 1673745229 RKQMQXCSGORJBG-KKSFZXQISA-N 448.405 4.130 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H]2[C@H](CCN2C(=O)OC(C)(C)C)C1 1683424805 JATPSODJXDOUTC-DWLFOUALSA-N 444.620 4.033 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3c(C)nn(-c4ccccc4C)c3C)C2)cc1 1683781553 CJSPXOPRNZCHBS-NRFANRHFSA-N 447.583 4.226 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)N(C)C)cc1 1685013860 HANFFHXTGQSXCJ-HBMCJLEFSA-N 434.506 4.229 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3c3ccc(Cl)cc3)cc2)CC1 1685328274 UWRUHYZBAAUXPW-JOCHJYFZSA-N 440.975 4.088 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](CCc3ccccc3)c3ccccn3)C2)cc1 1687025049 LJPMPGCUOICNIQ-PXDATVDWSA-N 430.552 4.342 10 10 IICE Cc1csc(CN(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)c1 1707725304 GNSJCFKRCSRDTB-UHFFFAOYSA-N 425.602 4.293 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@](C)(OC)C1CC1 1708507487 LQDYZWLHRPNUSE-CLOONOSVSA-N 441.620 4.332 10 10 IICE CO[C@@](C)(Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)C1CC1 1711499133 MATVMRQEIVFFBT-ZJCBTPCYSA-N 442.604 4.354 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H](OC)C1 1712389960 KSUULAGOUKRJPD-WZONZLPQSA-N 437.588 4.250 10 10 IICE C[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1743287371 UCKDGIOUXDAASJ-GJZGRUSLSA-N 425.649 4.100 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCCSC1 1747030032 OEXSJXLFOWFICB-FQEVSTJZSA-N 429.634 4.194 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCO[C@@H](C)C2)cc1 1764937272 OLBHCBUEGNADOI-SFHVURJKSA-N 425.602 4.050 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@H]2CCC[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1771166849 UKEVETFXRRNBML-XQFWAAQXSA-N 443.636 4.440 10 10 IICE COc1ccc(-c2cc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)nn2CC(C)C)cc1 1862374651 YDDONPXFCSDWME-UHFFFAOYSA-N 448.567 4.186 10 10 IICE CN[C@H](c1ccc2c(c1)CCCN2C)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044757135 VCWBABHUCHFXJW-LADGPHEKSA-N 439.600 4.440 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1O 2236053994 CUHGDJCKFHSOCU-SJLPKXTDSA-N 433.390 4.411 10 10 IICE O=C1NN(c2ccccc2)C(=O)C1=Cc1cn(Cc2ccc([N+](=O)[O-])cc2)c2ccccc12 2293579767 BLXOFAJPWVBGGZ-UHFFFAOYSA-N 438.443 4.059 10 10 IICE COc1ccc(C=C2N=C(c3ccccc3)N(c3ccc(C(=O)O)cc3)C2=O)cc1OC 2296223329 YHJSSUBDBNNLKW-UHFFFAOYSA-N 428.444 4.237 10 10 IICE CC(C)CNc1nc2ccccn2c(=O)c1C=C1SC(=S)N(C2CCCCC2)C1=O 2296546445 YOXVMOHBPFFLIB-UHFFFAOYSA-N 442.610 4.296 10 10 IICE Cc1cccc(OCCCn2cccc2C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c1 2296557814 CFLLXQSZSXGKGU-UHFFFAOYSA-N 447.466 4.071 10 10 IICE CCOc1cc(C=C2NC(=S)N(C)C2=O)cc(Br)c1OCc1ccccc1 2297344880 GGTSDJPEAVOBKX-UHFFFAOYSA-N 447.354 4.114 10 10 IICE COC(=O)c1ccc(-c2ccc(C=C3C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)c(C)c1 2313560589 YTMACPZOOQKHMO-UHFFFAOYSA-N 444.443 4.050 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@@H]3C=CC[C@H]32)c1O 14459730 BNXIVOFWWPVMKY-WHSLLNHNSA-N 428.554 4.304 10 10 IICE Cc1cc(C)c2c(N)c(C(=O)O[C@@H](C)C(=O)N3CCSc4ccccc43)sc2n1 28776224 GKWNWQVMIOCVDO-ZDUSSCGKSA-N 427.551 4.180 10 10 IICE CCCCCN1C(=O)/C(=C2\SC(=S)N(CCCC(=O)OCC)C2=O)c2ccccc21 40938715 YXJIMKBVRBKPLE-HNENSFHCSA-N 446.594 4.138 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2(c3cccc(F)c3)CCOCC2)C1 435823299 ARZLQBPRDJYEII-UHFFFAOYSA-N 449.570 4.369 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3c(O)cccc3Br)CC[C@H]2C1 706854152 PSUQNMGFYFPUGU-ZNMIVQPWSA-N 425.367 4.280 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)N[C@H](C)c1cc(OC)ccc1O)O[C@H](C)C2 730828274 SFOORTMFRLNWIJ-ZLFYYGENSA-N 426.513 4.039 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2coc(-c3ccc(F)cc3)n2)cc1 733257542 SPUOGTXOLHKLMA-HSZRJFAPSA-N 437.515 4.297 10 10 IICE COc1ccc(N2CCC(NC(=O)CN(Cc3ccccc3)Cc3ccccc3)CC2)cc1 741744341 VRBVKWXJFSMZFA-UHFFFAOYSA-N 443.591 4.483 10 10 IICE CC[C@@H]1CN(C(=O)/C=C\c2cc3cnn(C(C)C)c3[nH]c2=O)c2cccc(Cl)c2O1 753054801 WBCASZBUEWCOLQ-HLRDLLSLSA-N 426.904 4.176 10 10 IICE CC(C)Oc1ccc(NC(=S)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768293649 BRLPXACUKQBFCF-UHFFFAOYSA-N 438.641 4.492 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 775977052 YFUYHAGVTAHYQZ-SFHVURJKSA-N 445.844 4.419 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(-n3ccnc3)ccn2)cc1 778731408 QTEIRLLQPZUXBY-UHFFFAOYSA-N 427.508 4.189 10 10 IICE COc1cc(Br)ccc1/C=C1/SC(=S)N(CC(C)(C)CN(C)C)C1=O 781550149 MOPNLUDKCQPANG-OVCLIPMQSA-N 443.432 4.247 10 10 IICE O=S(=O)(Nc1nc(-c2ccc(F)c(F)c2)cs1)c1c(Cl)nc2ccccn12 917846045 JWLRQTZSAJUQTQ-UHFFFAOYSA-N 426.857 4.190 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccc(NC(=O)Cc3cccnc3)cc2)C2CC2)cc1 1124905338 GGDJALYMCUSHOJ-UHFFFAOYSA-N 428.536 4.134 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(C)cc3N3CCOCC3)c2C)cc1 1137376536 XWCKMFHFJYZTJB-UHFFFAOYSA-N 433.552 4.178 10 10 IICE Cc1nc(CN2CCC(CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)oc1C 1143994289 LCFGZLKLHSTEKG-UHFFFAOYSA-N 434.584 4.270 10 10 IICE CSCC[C@@H](CC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)NC(=O)OC(C)(C)C 1162113437 GWMAJDVOZOJVPQ-MJGOQNOKSA-N 437.650 4.145 10 10 IICE CC(=O)N1CCCCC[C@@H]1C1CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251980948 DTCMUGOUYJKYOL-NBGIEHNGSA-N 442.648 4.205 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](Cc3ccccc3)c3ccccn3)CC2)cc1 1256099381 QFWJOYXMNZEUSE-RUZDIDTESA-N 430.552 4.296 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)N(C)C)cc1 1256231858 HEJWXJWRHYKEPF-FYYLOGMGSA-N 445.007 4.262 10 10 IICE Cc1cc(Oc2ccccc2)ccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1288916794 ZGPJZGCRFVQNNJ-UHFFFAOYSA-N 443.547 4.419 10 10 IICE CC[C@@]1(C)CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1292319962 UASPSCKBFAMUBO-SANMLTNESA-N 439.648 4.459 10 10 IICE CC(C)Cc1nnc(N(C)OC2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1302859830 XNHJCYZNVZKVDK-UHFFFAOYSA-N 429.634 4.389 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCOC3)n2CCCOC(C)C)c(C)n1-c1ccccc1 1304188245 ABKUYNOMLNGVQN-QFIPXVFZSA-N 437.588 4.393 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1(c2ccc(C(F)(F)F)cc2)CC1 1312511934 RYZMBGLNRDLNSM-UHFFFAOYSA-N 447.501 4.198 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)sc2c1CCCC2 1349146737 LWLMZWAFEWEOME-CQSZACIVSA-N 446.956 4.054 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cnc2scc(-c3ccccc3)n2c1=O 1349810571 BOURSBHDESSIAU-UHFFFAOYSA-N 444.560 4.343 10 10 IICE COc1ccc([C@H](CN(C)C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1449330326 HIAGARLYOPJCLC-DEOSSOPVSA-N 433.552 4.256 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@@H]2CCCCN2C(=O)C(F)(F)F)c1 1452189929 MKEAGPPYGOJELP-INIZCTEOSA-N 441.881 4.421 10 10 IICE CC(C)Oc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1[N+](=O)[O-] 1457093814 HSRDWCNASXJBHY-INIZCTEOSA-N 449.454 4.382 10 10 IICE COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 1459178914 RBPCCGHTAKTGCP-VGOFRKELSA-N 441.572 4.074 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)cc1 1459613360 KKTVEVZTZPMKRS-IBGZPJMESA-N 436.383 4.219 10 10 IICE COc1ccc([C@H]2CCCN2C(=O)CN2CCCc3cc(OC(F)F)ccc32)c(OC)c1 1459678327 TYYGAQJMTMPDAT-OAQYLSRUSA-N 446.494 4.422 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC(=O)CC23CCC3)sc(C)c1-c1ccccc1 1460273804 BFWCRXQBGUMRGQ-UHFFFAOYSA-N 440.565 4.426 10 10 IICE Cc1cc(CNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccccc1 1462083168 HQZSEVQRPXVCDO-HSZRJFAPSA-N 429.564 4.192 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1464637735 KUANGWAFAWKBCG-XMMPIXPASA-N 443.547 4.250 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c(C)n1-c1ccc(Br)cn1 1468281098 QYYQXDVQZSDVNY-QRQLOZEOSA-N 432.362 4.017 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OC(F)F)cc3F)cc2F)C[C@H](C)O1 1516809329 AUWJDMPKFQNLSD-STQMWFEESA-N 426.410 4.110 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)COc3ccc4ccc(=O)oc4c3)cc2Cl)C1 1519552131 TUXLZFPTHYKPMN-INIZCTEOSA-N 440.927 4.378 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C(C)=C/c3ccccc3Cl)CC2)cc1 1524981865 CUQKKXLCLHZJLV-VHEBQXMUSA-N 427.976 4.080 10 10 IICE C[C@H](Cc1ccccc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015315 MCJPXMCSIKWADY-LJQANCHMSA-N 426.004 4.367 10 10 IICE Cc1cc(CCNC(=O)c2c(NC(=O)OC(C)(C)C)cnn2C)c(C)n1-c1ccccc1 1534247303 HFPCAQYWUFIXKV-UHFFFAOYSA-N 437.544 4.147 10 10 IICE O=C(Nc1ccccc1NS(=O)(=O)c1ccccc1)c1cc2cc(O)c(O)cc2s1 1544143184 LQIMLRWGTKIHMT-UHFFFAOYSA-N 440.502 4.366 10 10 IICE COC1CCN(C(C)(C)Cn2c(C3CCCC3)nnc2N(C)Cc2ccccc2O)CC1 1555158656 RIPPCXRVNZTEGW-UHFFFAOYSA-N 441.620 4.167 10 10 IICE Cc1cc(CC(=O)N2CCCC[C@H]2C(=O)NCC(F)F)c(C)n1-c1ccc(Cl)cc1 1569197953 KCDXJAXCWKTCAS-IBGZPJMESA-N 437.918 4.052 10 10 IICE COc1cc(CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c(Br)cc1O 1583670075 YWLHKSFQSFRGHK-UHFFFAOYSA-N 443.341 4.430 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@]3(C)CCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1585363906 MBQPAEFRVVAPSS-DEOSSOPVSA-N 427.545 4.232 10 10 IICE CCOC(=O)[C@]1(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CCCOC1 1586248307 JRFLPLOWBZXVSJ-VWLOTQADSA-N 426.557 4.307 10 10 IICE Cc1cc(CCNC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1-c1ccccc1 1595950310 QDSJEBUYZGPDFG-UHFFFAOYSA-N 444.984 4.270 10 10 IICE CCN(CC1CC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1615533820 YXAOFSQAFPDJQR-UHFFFAOYSA-N 439.648 4.360 10 10 IICE O=C(CN1CCCNC(=O)[C@H]1Cc1ccccc1)Nc1ccc(N=Nc2ccccc2)cc1 1618202792 LYZMYIVQIJQVJN-XMMPIXPASA-N 441.535 4.474 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2cccn2C)n1Cc1ccc(N(C)C)c(F)c1 1620262303 FJENZXHMSOICMK-INIZCTEOSA-N 430.597 4.115 10 10 IICE CC(C)(C)OC(=O)NCCc1ccc(C(=O)NCc2cccc(Br)c2O)cc1 1626821730 DKMVXMDABFFRNN-UHFFFAOYSA-N 449.345 4.152 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 1629207742 IKRVQHDGPMHJPY-UHFFFAOYSA-N 439.308 4.161 10 10 IICE Cc1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)nc2)cc1 1629964455 ZDPWPCUVQYGVOQ-UHFFFAOYSA-N 435.499 4.213 10 10 IICE COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)NCc2c(O)cccc2F)cc1 1635361169 YNZNZCVSDIMDTN-UHFFFAOYSA-N 431.467 4.252 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)C1CCN(CCC(F)(F)F)CC1 1637890238 GCJXHKLAVCUQBX-UHFFFAOYSA-N 435.490 4.395 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1 1645913655 YPAQYMQFEWEQLG-UHFFFAOYSA-N 435.490 4.147 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](c3ccccc3)[C@H](O)c3ccccc3)C2)cc1 1682188251 KYSGJFSUJHQGMW-YMSRPXOMSA-N 445.563 4.296 10 10 IICE Cc1cc(F)ccc1C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 1684141785 NEUWYVLOXDHXOD-UHFFFAOYSA-N 425.548 4.184 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccn(C)n1 1686035269 ANYZMUBOGCOFIY-HXOBKFHXSA-N 439.991 4.468 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1698406374 JSDYQIBZJAJVKT-JXFKEZNVSA-N 435.613 4.351 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCS[C@@H](C)C2)cc1 1710026744 OEHJICUITRUWML-AZUAARDMSA-N 429.634 4.008 10 10 IICE COc1ccc(Cn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cn1 1768674805 WODGHUONGNNNAG-UHFFFAOYSA-N 434.588 4.165 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(-c3ccccc3)c2)N2CCOCC2)cc1 1858074889 VTEKOCRCVZVWGD-AREMUKBSSA-N 429.564 4.223 10 10 IICE Cc1cccnc1NC(=O)CCn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860345221 VALRBVDENBSQBX-UHFFFAOYSA-N 449.514 4.307 10 10 IICE CCC(CC)C(=O)Nc1cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccn1 1860500318 HGSOEAYQSJGYKT-UHFFFAOYSA-N 441.487 4.484 10 10 IICE Cc1ccc(C)c2c(=O)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c12 1866417418 CSNVYGWLRHLFEW-QHCPKHFHSA-N 446.595 4.168 10 10 IICE CCOC(=O)Cc1ccc(N2C(=O)C(O)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)cc1 1872957098 WKLFGCJTKRGOEP-UHFFFAOYSA-N 444.487 4.042 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](CNCc1ccc(Br)cc1O)C2 2126081556 GEXNCRFTBSLZLQ-QRTARXTBSA-N 425.367 4.280 10 10 IICE COc1ccc(C=C2C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)cc1CN1CCCCC1 2297507276 BYXMGZWNQSQQSC-UHFFFAOYSA-N 433.508 4.185 10 10 IICE CCCCCOc1ccc(C=C2SC(=S)N([C@@H](C)C(=O)OCC)C2=O)cc1OC 2314740748 MRGGBQIQTQJVAN-AWEZNQCLSA-N 437.583 4.417 10 10 IICE Cc1ccc(CN[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)c(O)c1Br 2352680922 SLTOHMKFPUTWBT-HNNXBMFYSA-N 425.367 4.342 10 10 IICE Cc1ccc(CN(C)C(=O)[C@](C)(NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2380764080 ANJFPTVXEJLPTE-HXUWFJFHSA-N 443.382 4.361 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(OC)c1O)N2 14460112 PJQPMXCRGSUPTR-KHCICDEESA-N 435.568 4.299 10 10 IICE CCOc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccccc2F)SC1=S 33323827 RPROQSMGPNNOED-QGOAFFKASA-N 430.526 4.454 10 10 IICE CCCCCCN1C(=O)/C(=C/c2c(NCC)nc3c(C)cccn3c2=O)SC1=S 33474133 DTOKQILLUATXAD-SSZFMOIBSA-N 430.599 4.216 10 10 IICE O=C1/C(=C\c2ccco2)SC(=S)N1CCC(=O)N1CCCC[C@H]1c1cccnc1 33537039 PKAJEVRUMGRTJD-NAVNFMRLSA-N 427.551 4.020 10 10 IICE CCN(CC)CN1C(=O)/C(=C2\SC(=S)N(c3ccccc3C)C2=O)c2ccccc21 34806919 ONVUYJCLTWPOMR-VXPUYCOJSA-N 437.590 4.417 10 10 IICE COc1cccc(-c2c3c(nc4sc(C(=O)OC(C)C)c(N)c24)CCN(C)C3)c1OC 40570169 COZZHJCAIRCKSJ-UHFFFAOYSA-N 441.553 4.116 10 10 IICE CCOC(=O)CCCN1C(=O)/C(=C\c2cc(Br)ccc2OC)SC1=S 40938862 LSQSMKWWFDCNEQ-GXDHUFHOSA-N 444.372 4.002 10 10 IICE CC(=O)N1CC(C)(C)Oc2ccc(S(=O)(=O)Nc3nc(-c4cccs4)cs3)cc21 71555570 RQRFDRLHTMGGJL-UHFFFAOYSA-N 449.579 4.196 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C\c2ccc(OCCC)c(OC)c2)SC1=S 206871678 FWXURLANTXDFIY-NBVRZTHBSA-N 437.583 4.419 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3cccc(OC)c3OC)[C@@H]2c2ccc(O)c(O)c2)c1 526145663 VFYJVZXKYCQCMD-QFIPXVFZSA-N 449.459 4.181 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)C[C@H]1C2 715737061 KDHDOPQBEYWWHE-NILFDRSVSA-N 429.330 4.171 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(-c4noc(C(F)F)n4)cc3)CC2)cc1F 753884123 DLMFVXKZZRNRQT-UHFFFAOYSA-N 447.417 4.176 10 10 IICE O=C1C[C@H](N2CCO[C@@H](c3ccco3)C2)C(=O)N1c1ccc(N=Nc2ccccc2)cc1 753976818 AYINAQMLBQXWMX-RBBKRZOGSA-N 430.464 4.400 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3ccc(Cl)s3)cc2F)C[C@@H](C)O1 754595621 FPHJAUKKNDDKNP-RBSFLKMASA-N 439.984 4.121 10 10 IICE CN1CCC[C@H](CNC(=O)NCc2cccc(Br)c2O)[C@@H]1c1cccs1 765510822 CSCAHYLHMVMUNM-CXAGYDPISA-N 438.391 4.099 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 766444385 AYFUVMOMPJMBIG-NHCUHLMSSA-N 443.513 4.056 10 10 IICE C[C@H](Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1cc(Br)c(F)cc1O 797141905 BXPBZHSPMZOMOI-VIFPVBQESA-N 425.229 4.259 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CCC([C@@H](F)c2ccccc2F)CC1 804970603 YHMCSZTWNKUARK-HSZRJFAPSA-N 447.501 4.434 10 10 IICE Cc1cc(=O)cc(C)n1CCCC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 811354851 RQKUQOXPNSYYHZ-UHFFFAOYSA-N 438.499 4.218 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1)C(F)(F)F 917845466 ZWUUASSKMWLBAF-UHFFFAOYSA-N 445.419 4.251 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)C(C)C)CC2)c(C)n1-c1ccccc1Br 918064273 AFPZOTSEXCJEOT-UHFFFAOYSA-N 446.389 4.233 10 10 IICE Cc1ccc([C@H]2CCCN2C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1C 920812901 ZWUWLCLSXCJXGK-HSZRJFAPSA-N 425.548 4.450 10 10 IICE CO[C@H](C(=O)Nc1c(-c2ccccn2)nc2ccccn12)c1ccccc1Br 1126783651 LYVGSZPTRZAORQ-IBGZPJMESA-N 437.297 4.485 10 10 IICE COCc1ccccc1COC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1127470193 NMLNMCPJKJOPHO-UNOMPAQXSA-N 445.537 4.307 10 10 IICE Cc1nc(COc2cccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2)cs1 1134682058 RQLBJMNZQAPANJ-HSZRJFAPSA-N 438.597 4.129 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1 1136408786 ADAVWAMDPVCNCO-CJFMBICVSA-N 429.564 4.401 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1137386903 RBMNROGIABENAY-FQEVSTJZSA-N 433.593 4.016 10 10 IICE Cc1ccc(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1142335776 LQHKOEAXHCYKGF-XMMPIXPASA-N 443.547 4.309 10 10 IICE CCN(C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)[C@@H]1CCN(c2ccccc2)C1=O 1144623916 SZXSEHZFLOZIQR-XMMPIXPASA-N 431.536 4.370 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(O)nc2c(Br)cccc12 1162115860 UQAUJJPNSXEXDT-CQSZACIVSA-N 442.357 4.438 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1cccc(=O)n1C 1182482880 RJECJBHAZYBBOY-SFHVURJKSA-N 429.442 4.311 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1)[C@H]1C[C@@H]1C 1218450896 XDUJHHUVXLKCQB-SBUREZEXSA-N 438.597 4.323 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2ccc(N3CCSCC3)cc2)cc1)[C@@H]1C[C@H]1C 1218450897 XDUJHHUVXLKCQB-UZUQRXQVSA-N 438.597 4.323 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1253807788 IFMWZFVNPRFLCF-WMZHIEFXSA-N 438.616 4.363 10 10 IICE Cc1cc(CNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1287661061 MXWFZSAVUNLXKA-OAQYLSRUSA-N 433.527 4.402 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1293586896 LLQBARVVHKRKBM-PMOQBDJRSA-N 441.620 4.418 10 10 IICE CCC[C@@H](NC(=O)NCc1ccc(Br)cc1)C(=O)N[C@@H](C)c1ccccc1O 1302532451 DBGLANMLQFQZTF-KBXCAEBGSA-N 448.361 4.000 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cnc(Cl)cc3C(F)(F)F)cc2F)C[C@@H](C)O1 1350933274 MAQHCGYFUIAMJZ-VXGBXAGGSA-N 445.844 4.437 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCCC[C@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c1O 1460387928 LARCOSXPKSRHEA-KDOFPFPSSA-N 446.897 4.404 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)Sc3ccc(Br)cc3)C2)cc1 1461493865 IUDMEAXCXMYECP-GOEBONIOSA-N 435.387 4.333 10 10 IICE CN1CCC[C@@H](c2cccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)C1 1472521098 LQECSDPLKLTBDQ-RTWAWAEBSA-N 443.538 4.496 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCC[C@@H]1CCCN1C(=O)OC(C)(C)C 1478656188 HHJWNKLQKKIZMD-PZJWPPBQSA-N 446.636 4.471 10 10 IICE CCN(CCn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)CCC(F)(F)F 1502196086 JTQNFBUXQXJEGV-UHFFFAOYSA-N 425.499 4.162 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCN(C)C2CCCCC2)n1 1511084235 QHLMFIFBKLNYTN-UHFFFAOYSA-N 434.588 4.255 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)no2)cc1 1516820070 VWPNLRZQPMQDRD-IYBDPMFKSA-N 439.487 4.033 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@H]1CCCCC1(F)F 1526958707 HBFYGWVKTBNLRV-VQCBNXJZSA-N 442.528 4.359 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3c(C)nn(-c4ccc(Cl)cc4)c3C)C2)cc1 1538746500 KXELNMABFQCTRT-IBGZPJMESA-N 438.959 4.089 10 10 IICE Cc1nc2ccc(O)cc2cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1543113437 IEJKIAGREPLXNC-UHFFFAOYSA-N 445.441 4.034 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC[C@](O)(c2cccc(C(F)(F)F)c2)C(F)(F)F)cc1 1544636508 FIRLZRRIWVUNDZ-INIZCTEOSA-N 448.323 4.048 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CN(C(=O)OC(C)(C)C)Cc3ccccc32)c1 1545684262 QBSZJZHCDXHKNV-YWZLYKJASA-N 426.513 4.113 10 10 IICE Cc1nc(CC(F)(F)F)sc1CC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1546034500 XWSHCECSHUISJA-OAHLLOKOSA-N 428.476 4.012 10 10 IICE Cc1cc(C(=O)N2CCc3cc(Cl)nnc3C2)c(C)n1-c1cccc(Br)c1 1557190869 FTOLMXPIHZBZFZ-UHFFFAOYSA-N 445.748 4.499 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1566298848 SXSJHPAJGIAOLG-LJQANCHMSA-N 426.900 4.455 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(C(F)(F)F)c1O 1566356555 HZWBSLDHWNHVPR-CQSZACIVSA-N 428.838 4.164 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@H]2CCc3sccc3C2=O)cc1 1583919325 NXBKDPXDKGEUKR-UYAOXDASSA-N 426.582 4.157 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(C(=O)OC(C)(C)C)CCCCCC3)C2)cc1 1584444610 UIMLHYBPHOBXPM-IBGZPJMESA-N 430.589 4.320 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCc4cc(Br)ccc43)C2)cc1 1584444735 YZJQUKONGMJPAH-VFNWGFHPSA-N 429.358 4.130 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(Cc1ccccc1)Cc1ccccc1 1585536256 XHORYSSHABAPBC-UHFFFAOYSA-N 428.576 4.366 10 10 IICE Cc1cc(C(=O)NCC(=O)OCc2ccccc2)c(C)n1-c1cccc(Br)c1 1587151136 KDFUVPAQICIVLJ-UHFFFAOYSA-N 441.325 4.330 10 10 IICE CCN(C[C@@H]1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)C1)CC(F)(F)F 1587635487 MPRRKTJHQWFYDS-FQEVSTJZSA-N 449.517 4.182 10 10 IICE CCOCc1nnc(N(CC)C[C@@H]2CCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1616716814 PAQQUBLLECSKPD-QHCPKHFHSA-N 441.620 4.105 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](C3(C)OCCO3)C2)c(C)n1-c1ccccc1Br 1623726612 GOJDHHGTILFRSX-KRWDZBQOSA-N 447.373 4.472 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)C1 1625057053 ADEBDMXEQVZCEV-ZWKOTPCHSA-N 443.548 4.348 10 10 IICE Cc1cc(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c(C)n1-c1ccc(Cl)cc1 1628961585 YIMWXXDDEHRBHT-HSZRJFAPSA-N 437.971 4.244 10 10 IICE CCNS(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)c1 1631531162 JFSDYCWAJDMPQY-GOSISDBHSA-N 438.549 4.094 10 10 IICE CC(C)Oc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)ccc1Br 1633794679 RVMQSLAHYSINEH-UHFFFAOYSA-N 447.373 4.127 10 10 IICE Cc1cc(CC(=O)NC[C@H](O)c2ccccc2Br)c(C)n1-c1ccccc1 1639098051 QODBTHZQMXCGTG-NRFANRHFSA-N 427.342 4.249 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)Cc3cccc4ccccc34)cc2F)C[C@H](C)O1 1644342848 UONLFRYJFLBBTR-PMACEKPBSA-N 449.570 4.341 10 10 IICE C/C(=C\c1ccccc1)CN(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1654137020 QOQNHBZIPDUKMI-CZONRBCFSA-N 439.575 4.091 10 10 IICE Cc1[nH]c2ccccc2c1SCCNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1676936035 MEAOJESGNWQPHG-UHFFFAOYSA-N 438.597 4.247 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc2ccccc12 1677124894 GRNGYPOSNAMPNT-GOSISDBHSA-N 430.552 4.102 10 10 IICE C[C@H]1CCCN(C(=O)CCNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1681827275 DVZFCKADIDTIGP-ROUUACIJSA-N 435.012 4.024 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@]3(C)Cc3cccc(F)c3)C2)cc1 1682188147 HUGWBKSQUKAOIC-NBGIEHNGSA-N 425.548 4.467 10 10 IICE CC(C)(C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1706109598 NYKULWGMUWCUGO-MRXNPFEDSA-N 444.630 4.267 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccco3)n2CCCSc2nccs2)n1 1707816539 UHOSBPRUZWGGSP-UHFFFAOYSA-N 443.602 4.008 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1726902897 AWIYDXAYEJPJCA-QYZOEREBSA-N 429.584 4.440 10 10 IICE CCC(C)(C)Cn1c(-c2ccc[nH]2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1743426743 GHMDIPJBBMUVFK-UHFFFAOYSA-N 426.540 4.184 10 10 IICE CC(C)Cc1nnc(N(C)CC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1760997026 OCFWXPDGUQLUIY-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CC(C)CN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1761106339 WDUXYZPBYODJAQ-UHFFFAOYSA-N 431.600 4.470 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](CC)C2)n1Cc1ccc(N2CCOCC2)cc1 1763471432 ZHGLJKBGJOPUHQ-GHTZIAJQSA-N 429.634 4.008 10 10 IICE CCc1sc(NS(=O)(=O)c2ccc(OC)c(OC)c2)nc1-c1ccc(OC)cc1 1858034521 WEZBQQIIBFRSQS-UHFFFAOYSA-N 434.539 4.199 10 10 IICE CCOC(=O)c1c(-c2ccc([N+](=O)[O-])cc2)csc1NC(=O)COc1ccc(N)cc1 1860083028 BLWLPZVNHPXATL-UHFFFAOYSA-N 441.465 4.100 10 10 IICE CCOC(=O)c1c(C(C)(C)C)nn([C@H](C)c2ccc(OC)cc2O)c1Br 2080056646 WTVUZHWUBGSPBL-LLVKDONJSA-N 425.323 4.443 10 10 IICE COCCN1C(=O)C(=Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C(C(=O)OC)=C1C 2294034678 UNNSOUOVQGTTRC-UHFFFAOYSA-N 428.916 4.067 10 10 IICE CCOC(=O)c1ccccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)o1 2297332348 BWTIJZAEBZXCFF-UHFFFAOYSA-N 444.443 4.098 10 10 IICE CCCCCN1C(=O)C(=Cc2c(NCCC)nc3c(C)cccn3c2=O)SC1=S 2314415064 WDLXUWRAPXGTOF-UHFFFAOYSA-N 430.599 4.216 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccc(O[C@@H](C)C(=O)O)cc3)SC2=S)cc1 2314929288 KMITWFPXVNCILG-ZDUSSCGKSA-N 429.519 4.343 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3ccccc3[N+](=O)[O-])SC2=S)N(C)C)cc1 2323879974 ANTJXZCSOPUGEH-SFHVURJKSA-N 443.550 4.108 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]2C[C@@H]1CNCc1cccc(Br)c1O 2335120059 BPLXWEGFQABZPZ-LXZKKBNFSA-N 425.367 4.422 10 10 IICE CCCNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(C2CCCCC2)C1=O 33343981 PARJXZUDPJJTQA-DTQAZKPQSA-N 428.583 4.050 10 10 IICE CCCc1nn2c(/C=C3\C(=N)N4N=C(CC)SC4=NC3=O)c(-c3ccccc3)nc2s1 102470609 DBDSRDGBQNNABS-CAYKNLLPSA-N 449.565 4.439 10 10 IICE COc1cc(CCNC(=O)c2cc(C)n(-c3ccccc3C)c2C)c([N+](=O)[O-])cc1OC 302844470 LQQJWSIWMKMAPF-UHFFFAOYSA-N 437.496 4.300 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)C1 435819009 RDXIBGJXTRHAMG-SFHVURJKSA-N 443.551 4.335 10 10 IICE C[C@@H](NC(=O)N1CCn2c(cc3cc(Cl)ccc32)C1)c1ccc(N2CCOCC2)cc1 755244443 MEOHENJRSJSFGV-QGZVFWFLSA-N 438.959 4.418 10 10 IICE CN(C)c1ccc(N2C(=O)/C(=C/c3ccc4c(c3)sc(=O)n4C)SC2=S)cc1 773124625 JMXMQGXFLBHHHL-BOPFTXTBSA-N 427.576 4.072 10 10 IICE C[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc2ncsc2c1 776817904 ZDQXHKIPHKTFEB-CQSZACIVSA-N 441.512 4.361 10 10 IICE COC(=O)c1ccc(C)c(NC(=O)C(=O)N(c2ccc(N)cc2)[C@@H](C)c2ccccc2)c1 783484507 DMBPQEFQPCKDIY-KRWDZBQOSA-N 431.492 4.097 10 10 IICE Cc1ccc(C(=O)NCc2cc(Br)ccc2O)cc1NC(=O)c1ccco1 804738121 CNOLMTZXZXMEDJ-UHFFFAOYSA-N 429.270 4.238 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cc(F)ccc1F 1126038710 HVMLXGMRWDGBIR-MFOYZWKCSA-N 436.480 4.012 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N(CCCOc1ccccc1)C1CCOCC1 1138054151 YOBMEQGQYJGKPB-UHFFFAOYSA-N 427.522 4.403 10 10 IICE COC(=O)CCNC(=O)c1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1 1143531843 PZPRGWLBHWRCQR-UHFFFAOYSA-N 447.535 4.256 10 10 IICE Cc1cc(C(=O)N[C@H]2CC[C@H]3CCN(C(=O)OC(C)(C)C)[C@H]2C3)c(C)n1-c1ccccn1 1159887012 XWNXXZNCWNVMCQ-JBACZVJFSA-N 438.572 4.397 10 10 IICE O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1Cc1ccc(N2CCOCC2)cc1 1167749569 HONMROHEIWDAGD-OAQYLSRUSA-N 434.367 4.433 10 10 IICE Cc1cc(S(=O)(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2O)ccc1F 1171717603 WAZJGNPFLBHCHB-OAHLLOKOSA-N 428.485 4.132 10 10 IICE CCCO[C@H](C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(F)cc1C 1265011909 GKUVXJBZRWAGGJ-DEOSSOPVSA-N 445.554 4.199 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC(C(F)(F)F)CC1 1289426952 QAQWGQVAZUSMCN-LJQANCHMSA-N 437.510 4.331 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1ccc(F)cn1 1305503587 DUSBTSUNMITCBO-GOSISDBHSA-N 438.551 4.099 10 10 IICE COc1ccc(CNC(=O)NCC2(c3ccc(Br)cc3Cl)CC2)c(O)c1 1312754394 UCELPMRTJRKWDG-UHFFFAOYSA-N 439.737 4.348 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(C)(C)C)C1 1315042110 FBDIAWUPCYTOAV-HXUWFJFHSA-N 448.615 4.361 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)cc1C 1316438276 GYVVHWBFNZJACE-SFTDATJTSA-N 429.634 4.274 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(-c2ccc(F)cc2)no1 1354783927 IJZHTXNDAATDCE-UHFFFAOYSA-N 449.404 4.266 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCCC(=O)c2ccc3c(c2)OCCO3)cc1F 1443764769 BJWPVMYSRGDRHK-UHFFFAOYSA-N 428.504 4.113 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Cc3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1461982715 NXIVQNUXODGONF-MRXNPFEDSA-N 436.474 4.250 10 10 IICE Cc1cc(C(=O)N[C@@H](CCN(C)C)C(C)(C)C)c(C)n1-c1ccc(Br)cn1 1465069926 IFVHWMYIDGJCPC-SFHVURJKSA-N 435.410 4.348 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1(CC(=O)OC(C)(C)C)CCC1 1465851601 YKROVBLNJPPFIA-UHFFFAOYSA-N 426.351 4.405 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1CCC[C@H]1CCCN1C(=O)OC(C)(C)C 1498676030 WAGAIUDPUDVBSF-LJQANCHMSA-N 443.592 4.362 10 10 IICE CO[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC[C@H]1C 1518623038 UKBNKOVUJUVSKE-BRWVUGGUSA-N 437.635 4.020 10 10 IICE Cc1onc(-c2cccc(Cl)c2)c1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1537483097 LLJIYRDWVURQIA-FQEVSTJZSA-N 426.948 4.402 10 10 IICE Cc1cc(Br)ccc1NC(=O)CN(C)C(=O)c1cc2cc(O)c(O)cc2s1 1538740682 IVDNOAUICADIQA-UHFFFAOYSA-N 449.326 4.094 10 10 IICE Cc1ccc(C[C@H](CO)NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)cc1 1556206519 UIXJOSJWCJXZBC-LJQANCHMSA-N 441.369 4.498 10 10 IICE CC(C)(C)OC(=O)c1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1566357192 YNXZFOHHSCYRNH-HXUWFJFHSA-N 444.959 4.395 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1567998932 DBFYRUFUMOCPHH-QHCPKHFHSA-N 445.519 4.147 10 10 IICE C[C@@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1583318302 JTOXFNTUFBCNOV-NEPJUHHUSA-N 446.381 4.173 10 10 IICE C[C@H]1CN(c2ccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)cn2)C[C@H](C)O1 1583699375 JCCWHBGNJKSDHU-PMACEKPBSA-N 436.600 4.394 10 10 IICE Cc1cc(C(=O)N(C)[C@@H]2CCN(CC(F)(F)F)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1585780922 SEVOYVXCBWWDED-HXUWFJFHSA-N 435.490 4.453 10 10 IICE CC1=C(C)CN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)CC1 1611837206 BITRBVJBLYSNHM-UHFFFAOYSA-N 443.646 4.325 10 10 IICE CC1=C[C@@H]2C[C@H](C)CC[C@@H]2[C@](C)(/C(O)=C2/C(=O)NC(CO)=C2O)[C@@H]1/C=C/C=C/C[C@@H](C)O 1615671367 AJDLKWSYDPWRCH-AFVSZYRUSA-N 443.584 4.208 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)NCc1cccc(OCC(F)(F)F)c1 1615920026 QWRFWWZPROLCIO-UHFFFAOYSA-N 444.400 4.298 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(Br)cc2c1OCCO2 1623471669 KJEORUBAFFCJES-UHFFFAOYSA-N 445.357 4.483 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1624535530 GTOVPEZRLZRWTB-ZBFHGGJFSA-N 433.394 4.102 10 10 IICE COc1cc([C@H](C)NC(=O)c2ccc(N=NC(N)=O)cc2)ccc1OCc1ccncc1 1626040900 PWMOUYQQTITFPD-HNNXBMFYSA-N 433.468 4.323 10 10 IICE Cc1ccccc1NS(=O)(=O)c1cc(C(=O)N(C)Cc2ccccc2O)ccc1Cl 1631154465 CDFXJEMIVSCXEI-UHFFFAOYSA-N 444.940 4.427 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCOc1ccc2ccccc2c1 1631533751 DYNKFOQVXQKNMX-UHFFFAOYSA-N 427.884 4.170 10 10 IICE COc1ccc(N2CCCN(CCOc3ccccc3C(=O)OC(C)(C)C)CC2)cc1 1641554223 GWTNTLYTOYQERU-UHFFFAOYSA-N 426.557 4.242 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1cc(C)ccc1C 1648030259 JFIGEVCZIXUWKZ-REHUZNOOSA-N 441.591 4.413 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNC(=O)NCc1cc(Cl)cc(Cl)c1O 1676182359 OMVQLCQNGJZZGA-DGCLKSJQSA-N 432.348 4.001 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCc2ccccc2SC(F)(F)F)N(C)C)cc1 1676653608 SLUUUPMCBKZVKQ-SFHVURJKSA-N 440.535 4.467 10 10 IICE CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1682096842 BVEXVRWBYRSZRT-OFVILXPXSA-N 437.632 4.083 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)c(C)n1-c1ccccc1 1683149330 OUAGLNDUSMMGPD-OAQYLSRUSA-N 431.458 4.087 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H]4OCCC[C@H]4C3)nnc2C(C)(C)C)cc1 1728383683 RDJDCFAKAKEYOQ-UNMCSNQZSA-N 425.621 4.475 10 10 IICE CC(C)[C@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1741403593 FAIODWLYUKPUHW-GHTZIAJQSA-N 447.624 4.003 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)CCOC)cc1 1746095056 IDIJHYGFHSSHMK-FGZHOGPDSA-N 443.636 4.174 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@@H](C)O[C@H](C4CC4)C3)nnc2C(C)(C)C)cc1 1764936159 CXYNGTGDRGXQQL-GCJKJVERSA-N 425.621 4.474 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCOC1 1771022287 JQRUQQQRULZZOY-NRFANRHFSA-N 437.588 4.252 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4cccc(F)c4)n4ccccc34)CC2)cc1 1858331721 CVQVYDFIEXZVQJ-UHFFFAOYSA-N 430.483 4.111 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ccc(C)cn2)sc(C)c1-c1ccc(F)cc1 1860747047 QWVJLKYSXOXNIX-UHFFFAOYSA-N 441.484 4.320 10 10 IICE COC(=O)c1ccc(/C=C2/C(=O)N(Cc3cccc(F)c3)N=C2c2ccc(OC)cc2)cc1 1865675356 CWQSRIGDALEVRO-HZHRSRAPSA-N 444.462 4.451 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4oc(-c5cccc(OC)c5)nc4c3)CC2)cc1 1865775503 AOZFNUKSRXLIKR-UHFFFAOYSA-N 443.503 4.474 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)nc4c(Br)cccc34)CC2)cc1 1866401660 NHOAQZDGVPXDID-UHFFFAOYSA-N 440.341 4.277 10 10 IICE O=C(NC[C@@H](NCc1cccc(Br)c1O)C(F)(F)F)OCc1ccccc1 1942700267 BGIRGPYKSPOSRK-OAHLLOKOSA-N 447.251 4.102 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C(F)(F)F)c(C(=O)O)c2Br)c(O)c1 2079844685 OJGQEQUHGMXLBP-CYBMUJFWSA-N 449.223 4.466 10 10 IICE CCc1nn([C@@H](CC)c2cc(C)c(C)cc2O)c(I)c1C(=O)O 2079945271 FFQMGOLMWZDYHM-ZDUSSCGKSA-N 428.270 4.070 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)C(=Cc2ccccc2Br)SC1=S 2323866151 WFKCIIITTKPPTO-OAHLLOKOSA-N 448.363 4.346 10 10 IICE CCCN1C(=O)/C(=C2/SC(=S)N(CC(C)C)C2=O)c2cc(Br)ccc21 2509012 ZCQDXMVFLDSNRT-CCEZHUSRSA-N 439.400 4.433 10 10 IICE Cc1cc(C)c([C@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@@H]32)c(C)c1 14457786 UMFXZUOSQDYRFL-WATLYSKOSA-N 438.593 4.459 10 10 IICE Cc1ccc(-c2ccc(/C=C3/SC(Nc4ccccc4C(N)=O)=NC3=O)o2)c([N+](=O)[O-])c1 39869849 CJTDQLUMIMTFOA-YBFXNURJSA-N 448.460 4.345 10 10 IICE COc1cc(N(C)CC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)cc(OC)c1OC 303843848 CDEHKRUGPUJDME-QFIPXVFZSA-N 434.536 4.249 10 10 IICE COc1ccc(N2CCN(C(=O)CSCc3nc(-c4ccsc4)oc3C)CC2)cc1 726796687 KPMOMGINRAQFNN-UHFFFAOYSA-N 443.594 4.302 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCc2ccc(OC)c(OC(F)F)c2)cc1F 731363342 DRJBOCRHYJBUNH-UHFFFAOYSA-N 425.451 4.281 10 10 IICE Oc1cc2c(cc1CN1CCC[C@H](Cc3nc(C4CCCCCC4)no3)C1)[C@H](O)CO2 768461793 DZPDKJNAKQRQGU-IIBYNOLFSA-N 427.545 4.094 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)NCc1ccc(N2CC=CC2)cc1 778289758 PCLCQVHEEBLTCS-UHFFFAOYSA-N 446.345 4.172 10 10 IICE Cc1cc(Br)c(O)c(CN(C)[C@@H]2CS(=O)(=O)c3ccc(Cl)cc32)c1 781908395 HUCFIIYCOWCXLZ-OAHLLOKOSA-N 430.751 4.077 10 10 IICE Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799934425 YEHDJOQGVVUWMT-JKSUJKDBSA-N 432.012 4.357 10 10 IICE C[C@@H]1CC(CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](C)O1 801782995 DAKITQLDAIGXGH-HZPDHXFCSA-N 425.520 4.150 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)NCc2cc(Br)ccc2O)c1C(F)F 804740160 AMJJFISIPUVNQU-UHFFFAOYSA-N 442.182 4.258 10 10 IICE CN1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1c1ccc(F)c(F)c1 805242896 GFVNCDRTXYJUKX-IRXDYDNUSA-N 430.282 4.222 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cc(C2CC2)ccn1 1129512271 NKJGBCFKPMWHGN-BOPFTXTBSA-N 427.526 4.328 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@@H](C(=O)OC)Cc2ccccc21 1134141451 QADKOKMISNNLKB-SQZREULQSA-N 430.504 4.415 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c1 1142848287 GGUGGLJJFAWDRX-UHFFFAOYSA-N 439.506 4.389 10 10 IICE COc1ccc(C(=O)N2CCC[C@H](C(=O)N[C@@H](C)c3ccccc3O)C2)c2ccccc12 1151892328 NVYWFGLWPIOZAW-ROUUACIJSA-N 432.520 4.284 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cc2ccc(Br)cc2c(=O)o1 1162800133 AXNRMRMVXLJIAN-UHFFFAOYSA-N 441.325 4.476 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)c1O 1191899132 JAFRMZKRLNDFQV-SFHVURJKSA-N 426.900 4.389 10 10 IICE COc1ccc(C[C@H](C)CNC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1OC 1225337532 HSRBZCAFQKFFLN-PKOBYXMFSA-N 427.589 4.187 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccccc3)CC3CCOCC3)C2)cc1 1230301025 ORCCOYUUWJOUEQ-HSZRJFAPSA-N 437.584 4.160 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1(C)CCN(C(=O)OC(C)(C)C)CC1 1251988220 HDVZVOMIWBQHAB-GOSISDBHSA-N 432.609 4.081 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2cccs2)n1Cc1ccc(N2CCOCC2)cc1 1291446330 FODZCVVLEQSKOB-SFHVURJKSA-N 425.602 4.374 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)CC2)cc1F 1294825081 ZWXKDYOONJOJRH-UHFFFAOYSA-N 446.237 4.151 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1302710934 DTCGZQZCMBSXFI-KRWDZBQOSA-N 435.613 4.003 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C(F)=C/c3ccc(C(F)(F)F)cc3)cc2)CC1 1303721145 UPHMDVDVJMIJTM-MOSHPQCFSA-N 449.448 4.034 10 10 IICE Cc1cc(C(=O)Cn2c(C)nn(C(C)(C)C)c2=O)c(C)n1-c1cccc(Br)c1 1307325919 FSCJUHWSPWMDSD-UHFFFAOYSA-N 445.361 4.161 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1 1436853515 LMNHVYMWTYGBJX-SIKLNZKXSA-N 429.564 4.315 10 10 IICE C[C@H](C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C(=O)OC(C)(C)C 1439869907 BHZQBDARRHCLLR-GFCCVEGCSA-N 445.317 4.075 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 1440486932 FISRFKPPIZXGID-UHFFFAOYSA-N 429.567 4.192 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1 1441248377 UUQHFJJNWVWLCO-QHCPKHFHSA-N 436.625 4.264 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(Cl)cc4)[nH]n3)cc2F)C[C@@H](C)O1 1441780478 GJUXSPJYNJFYFQ-GASCZTMLSA-N 442.922 4.413 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2C(=O)N2CCOCC2)c(C)n1-c1ccc(C(C)C)cc1 1443137892 GTSIDJIFLZCSCN-XMMPIXPASA-N 437.584 4.071 10 10 IICE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1463780024 UVCZNOYWFJODQY-BMRADRMJSA-N 434.458 4.484 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4cccc(F)c4)s3)CC2)cc1 1464544840 QCSBVUUZCOPUKC-UHFFFAOYSA-N 439.556 4.115 10 10 IICE CCCNC(=O)OC[C@@H]1CCCCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1467823168 XTZGNTGTAGMYPS-QFIPXVFZSA-N 425.529 4.038 10 10 IICE CCC(CC)N(CCOC)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1525186477 GBNNMMNBUIMZBU-NBVRZTHBSA-N 438.590 4.081 10 10 IICE CSc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1525630800 NXAZZMFGGNMUKV-KAMYIIQDSA-N 433.555 4.173 10 10 IICE Cc1cc(CC(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)c(C)n1-c1ccccc1 1532201488 XAJPAEVLONZWLJ-UHFFFAOYSA-N 430.552 4.365 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC(F)(F)c2ccc(F)cc2)C1 1533570339 DWDPZNQPCPROAR-UHFFFAOYSA-N 429.486 4.455 10 10 IICE COc1ccc(N2CCN(C(=O)CCSc3ccccc3Br)CC2)cc1 1535590141 RSWBLHJOMCTVNX-UHFFFAOYSA-N 435.387 4.289 10 10 IICE COc1cccc(C(=O)NCCNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c1 1542584811 AXEHLKSRAUAUOK-UHFFFAOYSA-N 433.552 4.386 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCCS1 1545538234 XXFQMEJVHSPKBE-AEFFLSMTSA-N 433.597 4.162 10 10 IICE CCc1cnc(CN(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)s1 1546344476 DBSXOKQQSYKVFM-UHFFFAOYSA-N 447.612 4.418 10 10 IICE CO[C@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(Br)s1 1566685785 DXNFPKRTWHRSRR-KSSFIOAISA-N 440.359 4.112 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(-c4cccs4)nc3C)CC2)c(OC)c1 1587487250 XBYYYKJHFDZWIA-UHFFFAOYSA-N 429.567 4.160 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1CCC(F)(F)C1 1611964100 LQVFTKBSLPIQQP-WOJBJXKFSA-N 447.574 4.465 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)cc2C)CCO1 1614219421 BLFNXGVCPAFRSY-HXUWFJFHSA-N 440.979 4.031 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)n[nH]2)cc1OC 1616687113 OSZKWLNXCFCAEA-UHFFFAOYSA-N 434.540 4.260 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COC1CN(C(=O)OC(C)(C)C)C1 1623923961 FDZBRQIZSUCPKB-GOSISDBHSA-N 440.540 4.118 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)cc1 1624286050 FMKOGUQNTISPEP-DEOSSOPVSA-N 445.535 4.224 10 10 IICE COc1cc([C@@H](C)NC(=O)c2ccc(N=NC(N)=O)cc2)ccc1OCc1ccncc1 1626040902 PWMOUYQQTITFPD-OAHLLOKOSA-N 433.468 4.323 10 10 IICE COC(=O)C(C)(C)c1csc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1628313779 MMDYHJMMQRBJCG-UHFFFAOYSA-N 425.510 4.066 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1 1631531058 FWFKVNSYTWATGN-KRWDZBQOSA-N 443.463 4.285 10 10 IICE Cc1cc(C(=O)N(C)[C@@H](C)C(=O)NC(C)(C)C)c(C)n1-c1ccccc1Br 1633219158 BRELWWMJFLMKQR-HNNXBMFYSA-N 434.378 4.232 10 10 IICE Cc1cc(C(=O)N[C@H]2CCOC3(CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1636281270 GKZVXFATIDEJHW-KRWDZBQOSA-N 432.362 4.473 10 10 IICE O=C(NCC1(c2ccccc2)CC(O)(C(F)(F)F)C1)c1cc2cc(O)c(O)cc2s1 1640144105 KHBHLCDPPMBVQE-UHFFFAOYSA-N 437.439 4.068 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1cc(=O)c(OCc2ccc(F)cc2)co1 1643398755 WSYIZZLFPXVWDI-UHFFFAOYSA-N 436.483 4.278 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2[C@H](C)CN(C)C)c(C)n1-c1ccc(Br)cn1 1647771272 ZLWFHLYGOMZKPC-QRWLVFNGSA-N 447.421 4.444 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)Cc2ccccc2)cc1 1653738584 WYTGGFSXXBJUFJ-UHFFFAOYSA-N 447.554 4.294 10 10 IICE CCN(CC)CCO[C@@H]1CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1675107607 ARUGRTACZJGZMM-XMMPIXPASA-N 426.605 4.045 10 10 IICE CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1683303107 JZIRFIXYGOBJJJ-HXUWFJFHSA-N 448.571 4.173 10 10 IICE CC1(C)C[C@H](c2ccccc2)N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1684174274 CQCFEVNOFDJAQF-HSZRJFAPSA-N 434.584 4.071 10 10 IICE COCCC1(Cn2c(C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CCCCC1 1697939827 SWECUISHFKDGDG-UHFFFAOYSA-N 445.583 4.048 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1OCCC1(C)C 1708526972 IVKFALLJWBYTCO-DYESRHJHSA-N 445.583 4.081 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@](C)(C(N)=O)C1 1745372054 HVCJWVHWUFXNDM-RUZDIDTESA-N 434.588 4.245 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CCCOCC(F)F 1747720371 LGVFRNREYSBYCT-UHFFFAOYSA-N 435.563 4.484 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1Cc1nc(C(F)(F)F)cs1 1767111847 ICFRBKQOIWNDNB-UHFFFAOYSA-N 446.458 4.206 10 10 IICE CCOC(=O)c1ccc(N2C(=O)/C(=C\c3cccc(OCC)c3O)SC2=S)cc1 1860075426 KOTCRNXXEHCWJM-SFQUDFHCSA-N 429.519 4.373 10 10 IICE Cc1ccc2oc(=O)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(C)c2c1 1866290974 NZDDXONGOJFULP-HSZRJFAPSA-N 447.579 4.433 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@H]2[C@H]1[C@@H]2NCc1cc(Br)cc(F)c1O 1966019272 MNXMHMLOUJHWMH-BMFZPTHFSA-N 429.330 4.171 10 10 IICE C[C@@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(C2CCCC2)c1I 2070258430 GKMRSOZEQAYAOG-JTQLQIEISA-N 427.242 4.368 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3ccc(Br)cc3O)C[C@@]2(C)C1 2116294339 MTRINBYFJUUOML-NBQZKYEYSA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1O 2227749827 VSLZOYAVJQHLSN-STQMWFEESA-N 429.355 4.041 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)CC2)c1O 2236051017 NDQOMUBVUKVLFY-ZIAGYGMSSA-N 443.382 4.479 10 10 IICE CCOc1ccc(C=C2C(=O)NC(=O)N(c3cccc(Br)c3)C2=O)cc1Cl 2294130982 RBIYRYBRJICDNU-UHFFFAOYSA-N 449.688 4.168 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(C(=O)O)[C@@H]1c1cc(Cl)cc(Br)c1O 2308894797 LMNCVRFHJUCLCG-GVLSTKRJSA-N 432.698 4.191 10 10 IICE CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)NC1CC(C)(C)NC(C)(C)C1 2313682277 YZYMADJNTXVVDQ-UHFFFAOYSA-N 427.549 4.270 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)cc1OC 35638735 QBNSGDJZETWEAT-XMHGGMMESA-N 442.562 4.324 10 10 IICE CCCN1C(=O)/C(=C/c2c(C)c(C#N)c(=O)n(CCC)c2N2CCCCC2)SC1=S 39989951 PGWYYOLGXWGWIC-AQTBWJFISA-N 444.626 4.040 10 10 IICE CN1C(=O)c2ccc(C(=O)N[C@H](c3ccccc3)c3c(O)ccc4ccccc34)cc2C1=O 69260849 XXUPIHCXJBOAIB-XMMPIXPASA-N 436.467 4.291 10 10 IICE COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 71801411 RFCHASQOOIQOCA-DEOSSOPVSA-N 445.519 4.098 10 10 IICE C/C(NCCSCc1nc[nH]c1C)=C1\C(=O)N(c2ccccc2)N=C1c1ccccc1 102661102 IGZPPYRJOGIPII-RELWKKBWSA-N 431.565 4.266 10 10 IICE C[C@H]1[C@@H](NCc2ccc(Br)cc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709310384 RFHYNZKXUPRKFY-NKKGCODLSA-N 425.367 4.421 10 10 IICE Cc1ccc(/C=C\C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(Br)c1 728301050 GSWCGHKKZLIPNY-YFHOEESVSA-N 429.358 4.266 10 10 IICE CCOC(=O)[C@H](Cc1ccccn1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 759481389 JXIOHASTLTWTKI-QHCPKHFHSA-N 445.523 4.467 10 10 IICE FC(F)(F)COc1cccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768671289 YIMJVZWYDLGTHO-UHFFFAOYSA-N 433.518 4.450 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCCC[C@H]2CN2CCOCC2)cc1 772141918 JIQQKZXUFKLMAE-QFIPXVFZSA-N 435.572 4.495 10 10 IICE Cc1cc(Br)c(O)c(CN[C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 781637506 WRQNMJJABBHEDR-RTBURBONSA-N 439.781 4.278 10 10 IICE CCOC(=O)c1csc(CCN[C@H](C)c2cc(Br)cc(Cl)c2O)n1 786950331 NYDOIMMTBWXRLW-SECBINFHSA-N 433.755 4.335 10 10 IICE COc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1Cl 1125196875 VASMEYVAXWERMP-UHFFFAOYSA-N 442.865 4.063 10 10 IICE COCCCOc1cccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1127445860 XQJJBZUUBQLUIZ-UHFFFAOYSA-N 436.552 4.260 10 10 IICE COc1ccc(C(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)cc1N1CCNC1=O 1137816075 DERSDFQKUNCLGT-GOSISDBHSA-N 445.519 4.334 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1[C@@H]2CCCC[C@H]2CCN1C(=O)OC(C)(C)C 1146196468 LQUSAPJDPNFCAU-BWAGFHJFSA-N 429.605 4.493 10 10 IICE COC(=O)[C@@H](C)[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1149304938 YSIYEYLZVYKZND-AVRWGWEMSA-N 432.520 4.116 10 10 IICE Cc1ccc(C(=O)Nc2ccc3c(c2)N(C(N)=O)CCC3)cc1-n1c(C)cc(C=O)c1C 1156536238 UVUFGKWIPAKNRL-UHFFFAOYSA-N 430.508 4.299 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(OCCC(C)C)c1 1167761865 BLBMEHHWHHRASD-UHFFFAOYSA-N 426.557 4.011 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCc4cc(Cl)c(Cl)cc4[C@@H]3C)nc12 1168448912 UPKZCVYWPOALET-NSHDSACASA-N 435.311 4.038 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1cccc(S(C)(=O)=O)c1 1188392444 HINOKXNCDGEATC-UHFFFAOYSA-N 430.551 4.037 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Cn2cc([N+](=O)[O-])cc(Br)c2=O)c1C 1188988045 HTTRMXZYGKIYKB-UHFFFAOYSA-N 444.285 4.118 10 10 IICE Cc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2ccc(N3CCCCC3)c(C)c2)CC1 1190994320 IRAHFNREQJIBRP-QHCPKHFHSA-N 435.612 4.405 10 10 IICE COc1ccc([C@@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c2ccco2)cc1 1251937182 UQQLQSVJVNBYGR-ZJSXRUAMSA-N 436.508 4.474 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](c3ccnn3C)C2)n1CCCSc1nccs1 1287205877 GEJDCUHFYQBSON-MRXNPFEDSA-N 431.635 4.158 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CC(C)(C)OC(C)(C)C1 1289423429 KLWCLDHVUBDEDC-OAQYLSRUSA-N 441.620 4.336 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCO[C@@H]2C(C)C)n1 1289919683 RJZIAOZCOFGPSP-NZQKXSOJSA-N 435.572 4.442 10 10 IICE C[C@H]1CN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)C[C@@H](C)S1 1291250607 VXKGSHHRAWYMGX-OWCLPIDISA-N 439.676 4.141 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1 1291361778 SKILETHVLABYNU-XMMPIXPASA-N 434.544 4.138 10 10 IICE CCOCc1nnc(N2CCC(OC(C)(C)C)CC2)n1Cc1ccc2c(c1)CCCN2C 1297176596 RADICWATADZBPA-UHFFFAOYSA-N 441.620 4.029 10 10 IICE COc1cc(NC(=O)CN(C)C(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc(OC)c1 1298831205 FRUYCBSTMSATEZ-UHFFFAOYSA-N 435.524 4.130 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1299769595 DWQDESBXUGGXKS-UXHICEINSA-N 447.620 4.215 10 10 IICE COCC1(CCn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)CCCC1 1301115163 KMWMQWRKALOYAH-UHFFFAOYSA-N 435.572 4.203 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@@H]1C 1301684276 UVGHHPGJPIAGTL-RXVVDRJESA-N 437.588 4.108 10 10 IICE COCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccc(N2CCCCC2)c(C)c1 1308140044 BUTUACSUZCXKIG-QFIPXVFZSA-N 431.621 4.443 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H](CCC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1351112131 YJTGJVWXXAKEJB-NRFANRHFSA-N 433.593 4.063 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(N4CCCCCC4)cc3)cc2F)CC1 1359920045 HEJZFIXEQISFEP-UHFFFAOYSA-N 438.591 4.278 10 10 IICE Cc1cc(CNC(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1438295825 CWKCNYCXYDGDDU-WIYYLYMNSA-N 429.536 4.305 10 10 IICE COC(=O)c1c(C)[nH]c(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1C 1443630426 FJYSUBAXKNZUSO-UHFFFAOYSA-N 435.524 4.340 10 10 IICE Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NCc3cc(Cl)ccc3O)cc2)cc1 1452939845 AQABKIAFJGKJCF-UHFFFAOYSA-N 429.925 4.258 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CSCc3ccc(Cl)cc3)cc2F)CC1 1456130629 PVBBJSWBQMSDJZ-UHFFFAOYSA-N 435.996 4.171 10 10 IICE Cc1cc(C(=O)NCc2csc(N(C)C)n2)c(C)n1-c1ccccc1Br 1465593050 AUKJTINPJGNURG-UHFFFAOYSA-N 433.375 4.309 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CC[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C 1469103487 ILXLDAGTVAVOQK-GHTZIAJQSA-N 447.620 4.260 10 10 IICE CCOC(=O)[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C1CCCCCC1 1469647544 SEDMYASTGSSMGD-VWLOTQADSA-N 438.568 4.467 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)NC[C@H]2CCN(c3ccccc3)C2)cc1 1473250550 MGIQVRADRXDMSY-XMMPIXPASA-N 443.591 4.387 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(OC(C)C)CC2)n1Cc1ccc(N2CCOCC2)cc1 1495499335 OBOBCDAKCPDXRT-HXUWFJFHSA-N 441.620 4.070 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1499762553 IWDSUZQVQBWQLJ-HYBUGGRVSA-N 448.615 4.162 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC[C@H]1C[C@H](F)C1 1513020244 UBBVSDWXQNLWBA-BZSNNMDCSA-N 433.547 4.404 10 10 IICE CSc1cc(Br)ccc1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1526967899 KZGQDUGKBCYWJC-AWEZNQCLSA-N 435.387 4.499 10 10 IICE Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1538975327 CBVPYYMJONHOFP-RTBURBONSA-N 443.613 4.115 10 10 IICE CCC[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(C(F)(F)F)c1 1542741754 RNOLXVIHKQPAJJ-INIZCTEOSA-N 430.448 4.054 10 10 IICE COc1ccc(N2CCN(C(=O)CC[C@H](O)c3ccc(C(C)(C)C)cc3)CC2)c(OC)c1 1557825577 ZOTZJZXWVOLHEP-QHCPKHFHSA-N 440.584 4.164 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@@H]3c3ccc(C(C)C)cc3)CC2)cc1 1559718239 DLEZDGDPEIDBMS-AHKZPQOWSA-N 437.628 4.139 10 10 IICE COC[C@]1(CNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)OCCc2ccccc21 1564860649 YNGAUGPPCJAKMJ-MHZLTWQESA-N 447.579 4.316 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCCc3c[nH]c4cc(F)c(Cl)cc34)C2)cc1 1565055639 HTDOSYWOPJETDA-OAHLLOKOSA-N 430.911 4.090 10 10 IICE COc1cccc([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1 1566336701 CZEALYXNJWTDRE-OAQYLSRUSA-N 443.341 4.329 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)c(Cl)cc2I)c1 1566374683 QISQJFRXHAXWJZ-JTQLQIEISA-N 445.684 4.458 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 1568137537 WESKICVKZKFIIU-HYBUGGRVSA-N 442.556 4.251 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)c2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1 1612211030 BVDBRNOHYVYNNX-IBGZPJMESA-N 442.503 4.232 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCOC1 1618907739 FSGHZQWZUCMZDC-HXUWFJFHSA-N 437.588 4.250 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccc4)nc3)cc2F)C[C@@H](C)O1 1625090764 YAOJPPYTGAOMII-KDURUIRLSA-N 449.526 4.343 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@](CO)(Cc3ccccc3)C2)cc1 1625256787 ATQWHLRLSKYIKG-NDEPHWFRSA-N 444.575 4.293 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(-c4ccc(C=O)s4)cc3)c2)CC1 1625314413 FYNHJRPGNSDELY-UHFFFAOYSA-N 433.533 4.148 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H](O)c2cccc(C(F)(F)F)c2)cc1 1627988526 DRUDFMCFAVPQCI-KRWDZBQOSA-N 434.380 4.396 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 1628565468 OHFWKJXKXXVUPR-NRFANRHFSA-N 443.547 4.348 10 10 IICE CC(C)OCc1c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)oc2ccccc12 1629484266 XJRHRRCYPZMURN-UHFFFAOYSA-N 444.478 4.403 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nn(-c2cccc(F)c2F)c2c1CCC2 1634725431 XROBRPLEONTQRQ-UHFFFAOYSA-N 448.267 4.037 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(Br)cccc3[nH]2)N(C)C)cc1 1637004719 MUHBUIZVCDKEBA-FQEVSTJZSA-N 429.362 4.029 10 10 IICE Cc1cc(C(=O)NCc2nn(C)cc2C(F)F)c(C)n1-c1ccc(Br)cc1 1643821770 BZJJIHYTPYYALK-UHFFFAOYSA-N 437.288 4.458 10 10 IICE COc1ccc(Cn2nnnc2SCC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)cc1 1651717802 CLNMBOSTFQDRRM-UHFFFAOYSA-N 447.564 4.421 10 10 IICE O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NCc1ccc(N2CCCCC2)cc1 1651998679 CMIOUKRXYFAWGU-UHFFFAOYSA-N 443.447 4.491 10 10 IICE O=C(CN1CCNC(=O)[C@@H]1c1ccccc1F)Nc1ccc(N=Nc2ccccc2)cc1 1653853682 ZSKVEKLVJSNUFE-QHCPKHFHSA-N 431.471 4.353 10 10 IICE Cc1cccc(OCCN(C)[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1657005803 VSUDCGVCUDGCMD-SFHVURJKSA-N 442.515 4.108 10 10 IICE C[C@H](NC(=O)NC[C@@]1(C(F)(F)F)CCCN1C(=O)OC(C)(C)C)c1ccccc1O 1685394747 LXMAOUAXVUFHIE-ORAYPTAESA-N 431.455 4.084 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC(c3cccc(C(F)(F)F)c3)C2)N(C)C)cc1 1687806958 LVISSCUOCZGFJS-OAQYLSRUSA-N 434.506 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCC(F)(F)C2)cc1 1695623641 GHDMNJOZMYHHQS-UHFFFAOYSA-N 426.515 4.004 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1Cc1nc(C(C)(C)C)cs1 1696700249 XLTUBUFEXVILHT-UHFFFAOYSA-N 436.585 4.428 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@@H]3CCCCCC[C@H]32)n1CCCSc1nccs1 1723580803 SNPPTKSNDPUJFK-DLBZAZTESA-N 448.662 4.214 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@H](C(F)(F)F)C2)n1CCCSc1nccs1 1727028735 QCKTWSSCEKFFEP-OLZOCXBDSA-N 435.541 4.198 10 10 IICE CS[C@H](C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1731040884 NGYQSCJJQOXMGI-GOSISDBHSA-N 431.650 4.091 10 10 IICE COC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)C[C@@H](C)O1 1749544561 UYAFDQWOFJMGJL-DENIHFKCSA-N 437.588 4.249 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1762723696 KEEDSAMUSUVJGR-NHCUHLMSSA-N 448.615 4.440 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1763291488 TUCQQCBVGDUKLT-UZLBHIALSA-N 439.583 4.018 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1CCc1csc(C(C)(C)C)n1 1767774023 FBYOORYFQBSSPC-UHFFFAOYSA-N 429.590 4.153 10 10 IICE CCOc1cccc(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)c1O 1860083965 IQVAJVWLZHJUBW-CXUHLZMHSA-N 432.479 4.114 10 10 IICE CC(C)(C)C(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 1860548607 RTVIRSDKGMUWCY-UHFFFAOYSA-N 427.460 4.094 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(Cc3cccc(C(=O)O)c3)C2=O)cc1OC 1860825298 YDPDHTIKNANZTB-WOJGMQOQSA-N 429.519 4.194 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3CCCN(Cc4cccc(F)c4)C3)cccc21 1861858431 SAUWFCVNLUCXJL-GOSISDBHSA-N 442.490 4.452 10 10 IICE CN[C@@H](C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccc2c(c1)CCN2C 2044754546 MOMUDPASGRTKCQ-GOTSBHOMSA-N 439.600 4.440 10 10 IICE CCc1nn([C@@H](c2cc(C)c(C)cc2O)C2CCC2)c(I)c1CN 2079954230 JLWJDPKHBLAOTI-GOSISDBHSA-N 439.341 4.221 10 10 IICE CC(C)(C)OC(=O)N1CCCC2(CC(NCc3cc(Br)ccc3O)C2)C1 2103378242 XRWCQLPIUGGIDK-UHFFFAOYSA-N 425.367 4.424 10 10 IICE CN(C)c1ccc([C@H](N)c2cc(I)ccc2Br)cc1 2106804467 BTSGKFULSVPATQ-HNNXBMFYSA-N 431.115 4.168 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2c(O)cccc2Br)[C@H]2CCCC[C@H]21 2122811907 MBHJJSBQUZVEAQ-XOKHGSTOSA-N 425.367 4.422 10 10 IICE CN(Cc1csc(=NCc2cc(Br)ccc2O)[nH]1)C(=O)OC(C)(C)C 2217846798 CSGMHUJDSZWJOB-UHFFFAOYSA-N 428.352 4.012 10 10 IICE COc1ccc(Br)c(CNC[C@@]23CC[C@H]2CN(Cc2ccccc2)C3)c1O 2236054005 CWRQIKYJDXYYAZ-HTAPYJJXSA-N 431.374 4.165 10 10 IICE O=C1NC(=O)N(CCc2ccccc2)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12 2296004728 KSXJCDZCYNDKGP-UHFFFAOYSA-N 449.510 4.394 10 10 IICE CCN1CCN(Cn2cc(C=C3C(=O)N(c4ccccc4)N=C3C)c3ccccc32)CC1 2296362982 VRZILHFLMAUKTG-UHFFFAOYSA-N 427.552 4.042 10 10 IICE Cc1cc(-n2c(C)cc(C=C3SC(=O)NC3=O)c2C)ccc1I 2296554285 HTOASFOEDCGLHJ-UHFFFAOYSA-N 438.290 4.331 10 10 IICE O=C1C(=Cc2ccccc2[N+](=O)[O-])SC(=S)N1C1CCN(Cc2ccccc2)CC1 2323879934 UCWHDOWJBRCTFQ-UHFFFAOYSA-N 439.562 4.461 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@@H](C)CC(=O)NCc1ccc(C)c(Br)c1O 2352942392 DLVNSLFKGKWGNV-ZDUSSCGKSA-N 429.355 4.115 10 10 IICE Cc1cc(NS(=O)(=O)c2cc(Br)sc2Br)cc(C)c1O 2366528723 ROLRBDTYASTEMZ-UHFFFAOYSA-N 441.166 4.396 10 10 IICE CCc1nn(Cc2ccc(C)c(Br)c2O)c(CC)c1I 2380787851 WREAJPMYKYZIQK-UHFFFAOYSA-N 449.130 4.437 10 10 IICE CC(=C\c1ccccc1)/C=C1/SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O 6015832 UNTFIFMQLBMFIN-RZKYTRJLSA-N 425.487 4.435 10 10 IICE Cc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c(C)c1 20356350 FUQMGVSSAVHVNB-DMNVVODESA-N 446.580 4.383 10 10 IICE CC1CCN(C2=NN3C(=N)/C(=C\c4cc(Cl)c(O)c(Cl)c4)C(=O)N=C3S2)CC1 20356712 ZWWMTUAEJVUMKG-OVKBWAAUSA-N 438.340 4.008 10 10 IICE O=C1Nc2ccc(Br)cc2/C1=C1\SC(=S)N(Cc2ccccc2)C1=O 20522420 GJFMAFXKHJXJPC-CCEZHUSRSA-N 431.336 4.173 10 10 IICE Cc1cc(/C=C2/SC(N3CCOCC3)=NC2=O)c(C)n1-c1cccc(C(F)(F)F)c1 96875376 TTWJFBUJJRJZQI-WOJGMQOQSA-N 435.471 4.415 10 10 IICE COc1cc(OC)c(-n2c(C)cc(/C=C3/C(=N)N4N=CSC4=NC3=O)c2C)cc1Cl 97494807 MUJCKHJCMHKQFZ-WCZYSDHJSA-N 443.916 4.014 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)cc3F)[C@@H]2c2ccc(O)c(O)c2)cc1 526549890 CPWFNNRVAZEIRL-OAQYLSRUSA-N 425.387 4.442 10 10 IICE C[C@@]12CN(Cc3ccccc3)C[C@@]1(C)CN(c1ccc(CN)c(Br)c1F)C2 705880036 GHFSWKDVXXLDDM-VXKWHMMOSA-N 432.381 4.395 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(NC(=O)CC4CCCC4)CC3)c2C)cc1 731345270 JNINMLVTTHTKGX-UHFFFAOYSA-N 437.584 4.404 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COc2ccccc21 754880629 MSBAFMVCYDCOFJ-FTRWYGJKSA-N 431.483 4.121 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2ccncn2)c(C)n1-c1cccc(C(F)(F)F)c1 754919488 BWMSQGNWEOMULK-SREVYHEPSA-N 429.398 4.342 10 10 IICE Cc1c(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cnn1-c1ccccc1 768903361 MQOZIMUHOAHWKK-UHFFFAOYSA-N 444.583 4.034 10 10 IICE COc1ccc([C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1NC(C)=O 773145555 JTGXKSUBAREIMM-IBGZPJMESA-N 436.600 4.036 10 10 IICE Cc1cc(CCNC(=O)N2CCC(c3nnc4n3CCCC4)CC2)c(C)n1-c1ccccc1 776106138 CLCGZNRQZUFCHG-UHFFFAOYSA-N 446.599 4.154 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)c3nnc4n3CCCCC4)cc2Cl)C1 799860521 CEZSLLTUIGIKDH-IAGOWNOFSA-N 445.011 4.455 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cnc(-c4c(F)cccc4F)s3)CC2)cc1 1125322724 KKROSSQKRPKLIJ-UHFFFAOYSA-N 429.492 4.449 10 10 IICE CC[C@@H](C(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(Br)cc1 1135732736 DXENTVZSYACDMO-OAQYLSRUSA-N 431.374 4.438 10 10 IICE Cc1cccc(NC(=O)N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1142897927 FOCZODXAXHJFOC-UHFFFAOYSA-N 430.552 4.321 10 10 IICE CCc1ccc([C@H]2CN(C(=O)OC(C)(C)C)CCN2C(=O)Cc2ccc(O)c(O)c2)cc1 1155506813 OXAJLXZEURFXFB-HXUWFJFHSA-N 440.540 4.023 10 10 IICE CCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H](C)c1cccc(O)c1 1167526393 XUGYNVYSXVQWBZ-INIZCTEOSA-N 428.488 4.189 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@@H](CC(C)(C)C)c3ccc(F)cc3)CC2)cc1 1168593958 OEVWNQSIVMLXLA-ZCYQVOJMSA-N 443.607 4.084 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)[C@H](C)C1 1178556734 CJHZOPVWJVDNFD-CZUORRHYSA-N 433.346 4.270 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H](C)c1cccc(OC)c1 1190474109 CXIQWSAQNDACCB-KRWDZBQOSA-N 442.515 4.492 10 10 IICE O=C(CN1CCN(C(=O)Cc2ccccc2)CC1)Nc1ccc(N=Nc2ccccc2)cc1 1193997542 HCCHORVRYQCZFM-UHFFFAOYSA-N 441.535 4.427 10 10 IICE Cc1ccc2[nH]c3c(c2c1)C[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)CC3 1230852148 FMXMIXJZFJLTPE-KBMIEXCESA-N 433.600 4.002 10 10 IICE COCCNC(=O)c1ccc(Cl)c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1264931024 RBCXFKNGCJRKIO-UHFFFAOYSA-N 439.943 4.305 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3ccc(C)cc3O[C@@H]3CCOC3)ccc21 1266122721 PRCHMFOLTBSQOQ-JOCHJYFZSA-N 436.552 4.311 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2nc([C@H](C)OCC(C)C)no2)c1 1293950068 OTKVWWAXVCNDPU-SFHVURJKSA-N 438.528 4.295 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(C)C3CC(NC(=O)OC(C)(C)C)C3)ccc21 1298058416 JKRJBJQBTZBXOL-UHFFFAOYSA-N 429.561 4.032 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 1299328789 DKZBMLZAJVIPKE-NRFANRHFSA-N 429.564 4.182 10 10 IICE Cc1ccc(-n2cnnc2SCC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1C 1299477965 JEIMBOMIGYTPOL-IBGZPJMESA-N 437.613 4.098 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@H]2CCOC2)c(C)n1-c1ccccc1Br 1304201351 ZWESKFUFJGDGTP-QZTJIDSGSA-N 447.373 4.124 10 10 IICE COC(=O)[C@H](Cc1ccc(OC(F)(F)F)cc1)NCc1cc(Cl)cc(C(C)=O)c1O 1308054039 DPSNQMNJAFOBGX-KRWDZBQOSA-N 445.821 4.021 10 10 IICE C[C@@H](NC(=O)NC[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)c1ccc(N(C)C)cc1 1312534858 HUWBDGUQNGDLJX-WBVHZDCISA-N 440.535 4.005 10 10 IICE CCN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1)C1CCCC1 1313574449 FSTWDKNZHFZBRX-UHFFFAOYSA-N 429.584 4.369 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](C)Cn2ncc3ccccc3c2=O)c1 1320384512 DKLSQVBHCFMCOT-HNNXBMFYSA-N 434.927 4.276 10 10 IICE CC1CCC(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)CC1 1350077394 RHHQUTSWULWXOQ-SWCONJRYSA-N 437.584 4.302 10 10 IICE CC(C)CN(C)c1nnc(-c2ccc3c(c2)OCO3)n1CCCSc1nccs1 1359973913 LRPXVRNEOYGDNX-UHFFFAOYSA-N 431.587 4.405 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccoc1C 1361097513 CJKLNVTVDKXPJO-UHFFFAOYSA-N 430.556 4.224 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)c(C)n1-c1ccccc1 1438179641 PKNLJOQTBRDPCC-OAQYLSRUSA-N 427.614 4.091 10 10 IICE COc1ccc(S[C@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952113 VPKHZSWIDYMZTN-CRAIPNDOSA-N 434.989 4.316 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)Oc1ccc(F)cc1 1466568035 YRVXZZIDNUFITB-NRFANRHFSA-N 444.890 4.237 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H](n2cccn2)C(F)(F)F)cc1 1479038594 ROGQETBMAHJRBD-LJQANCHMSA-N 435.450 4.058 10 10 IICE CS[C@H](Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1519869640 XCUFKNQSIZOUKV-HXUWFJFHSA-N 425.602 4.384 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(Cc3ccccc3)C[C@H](C)C(=O)OC)ccc21 1524992337 TUIAGSRNICLGOF-SFHVURJKSA-N 436.552 4.356 10 10 IICE COCCCOc1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1C 1527482291 XMTDMJXQSDDJSC-ROUUACIJSA-N 444.547 4.093 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)/C(=C/c1ccccc1)C(F)(F)F 1535346760 ZAVOGGNLDCRNFE-YBEGLDIGSA-N 426.385 4.064 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4c(Br)c(F)ccc4[nH]3)CC2)cc1 1545931445 IXJMLGBMUMLSHH-UHFFFAOYSA-N 446.320 4.431 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1ccccc1C(F)(F)F 1566155132 NZRDPWFEHIYUAJ-ACJLOTCBSA-N 444.400 4.125 10 10 IICE CC[C@H](O)CN(Cc1ccccc1)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1566545477 HYAUKDQZWKUQTD-QFIPXVFZSA-N 433.596 4.208 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1cccc(C(C)(C)C)c1 1566848966 FCFUWNJEJHNVMA-HNNXBMFYSA-N 433.932 4.312 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H]2CCC3(CC(C(=O)OC(C)(C)C)C3)O2)cc1 1597338155 DHQSNCUOXFWMIX-SANWMBSTSA-N 438.568 4.493 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(OCC(F)(F)C(F)F)nc1 1597801082 WXRIBIPSPVHNJW-CQSZACIVSA-N 427.442 4.096 10 10 IICE CCc1nc(CN(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1613883047 VIJCFJGTPIFLTG-UHFFFAOYSA-N 439.564 4.182 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)cc1C 1615567132 HZMNAGFNEGEJOZ-JOCHJYFZSA-N 434.588 4.077 10 10 IICE C[C@@H]1Cc2cc(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)ccc2O1 1616190227 KUDHPAQULXSHIP-OTGIAGGSSA-N 442.537 4.379 10 10 IICE Cc1cc(C(=O)NC[C@@](C)(O)c2ccccc2)c(C)n1-c1cccc(Br)c1 1628198952 TUIDFFQDSRUXAX-JOCHJYFZSA-N 427.342 4.494 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC(c2ccon2)CC1 1629769603 VSFCGOKTQGJTJR-GHRIWEEISA-N 447.607 4.124 10 10 IICE O=C(CCOc1ccc(F)c(Cl)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1631425495 HIFAFBMPTCCNMG-MRXNPFEDSA-N 441.330 4.388 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@@H](C)C3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1 1632612023 QXSPTOZDAYMJOD-QUCCMNQESA-N 445.604 4.063 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Oc2ccccc2F)nc1 1634424158 UNSCNKZNKITGLN-UHFFFAOYSA-N 439.462 4.043 10 10 IICE CCO[C@H]1C[C@](O)(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1(C)C 1634606699 GAHNRGHHFLQOBK-UGKGYDQZSA-N 449.389 4.153 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(-c2ccc(OC(F)(F)F)cc2)[nH]n1 1636058902 WDLMUUPBGSDLFY-UHFFFAOYSA-N 426.391 4.097 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCN(CCCc2ccccc2)CC1 1636263325 OYHMIVPGTORXAK-HSZRJFAPSA-N 436.644 4.342 10 10 IICE Cc1cccc(-n2c(C)cc(CNc3ncnc4c3c(Br)nn4C)c2C)c1 1652116235 PFUJFAUPSADOSY-UHFFFAOYSA-N 425.334 4.454 10 10 IICE CC(=O)NCc1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1682023886 MDMSQMMUEUXPTD-KRWDZBQOSA-N 442.991 4.212 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1Cc2ccccc2N(C(=O)OC(C)(C)C)C1 1683756822 MOPNSIYOTPSCOP-HXUWFJFHSA-N 438.572 4.260 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(=Cc2ccccc2F)CC1 1686724090 GJBPNJYEXQOMTQ-UHFFFAOYSA-N 445.485 4.330 10 10 IICE Cc1nc(Cc2nnc(N(C)CC3CCC3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1707748523 OPKNOERCJCXSLK-UHFFFAOYSA-N 428.581 4.124 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@@H]4CCCCO4)n3CCC(C)C)CC2)cc1 1711864970 DETJCSBEQPGAKV-QFIPXVFZSA-N 427.593 4.291 10 10 IICE CC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC=C(C)C)CC1 1722780198 FNAYUBUSXJQIPJ-UHFFFAOYSA-N 446.599 4.377 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCCC3)nnc2N2CCN(CC(F)F)CC2)cc1 1746089916 JZCQBCNGYVYYNK-UHFFFAOYSA-N 446.590 4.217 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@@H]1CCO[C@@H](C)C1 1747030681 ZLQQKBMCMQNJOX-LEWJYISDSA-N 441.620 4.256 10 10 IICE CC(C)c1nnc(N(C)[C@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752089944 FGKZPLIGXINOKF-QUCCMNQESA-N 429.584 4.440 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1 1766737432 SWBOGEYPJPMLRZ-OKXSDPAFSA-N 439.629 4.358 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC[C@H]1C 1770652609 NGHFUVWKRMFHAM-VGSWGCGISA-N 439.629 4.214 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3ccc(F)c(F)c3)SC2=S)N(C)C)cc1 1858594069 JSUDTCJEPHCMEG-PYJSORCASA-N 434.533 4.478 10 10 IICE O=C1/C(=C\c2cc3c(cc2[N+](=O)[O-])OCCO3)C(c2ccccc2)=NN1Cc1ccccc1 1865679429 MSVBZCZBVZFPGT-MOSHPQCFSA-N 441.443 4.196 10 10 IICE CC(C)C[C@@H](C(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)N1C(=O)c2ccccc2C1=O 1891452851 UNHBHOLTFBODQG-PTLVVNQVSA-N 445.563 4.002 10 10 IICE O=S(=O)(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccc(OC(F)(F)F)c1 1891728961 SCQDCHYIDMUNJW-RDJZCZTQSA-N 426.460 4.052 10 10 IICE C[C@@H](c1ccccc1O)N(C)C(=O)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2010163423 YDRYHTCTSUAGRI-PXNSSMCTSA-N 428.529 4.022 10 10 IICE CCN(C[C@H](C)NC(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044735886 LXPHGDJPFDKOFT-INIZCTEOSA-N 448.608 4.302 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C(F)(F)F)c(CN)c2Br)c(O)c1 2079864885 YOYGRSMMOYVBPF-AWEZNQCLSA-N 434.256 4.227 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2cccc(C)c2)c1C 2294037588 VTXUGKVHJBBVRP-QFIPXVFZSA-N 434.536 4.254 10 10 IICE CC[C@H](C)Oc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC 2294092679 KLNHNFXKSZEVOS-ZDUSSCGKSA-N 428.872 4.192 10 10 IICE O=C1C(=Cc2ccco2)SC(=S)N1CCC(=O)N1CCCC[C@@H]1c1cccnc1 2296331097 PKAJEVRUMGRTJD-QGZVFWFLSA-N 427.551 4.020 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3CC[C@H]([C@@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2380801707 AHCNGDHBGVHAQJ-LJIGWXMPSA-N 443.357 4.431 10 10 IICE Cc1ccc(CNC(=O)C2CCC(NC(=O)OC(C)(C)C)CC2)c(O)c1Br 2381133783 SNQCKMWPPRAISG-UHFFFAOYSA-N 441.366 4.163 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@H]3c3cnn(-c4ccccc4)c3)ccc21 478010003 PKNBRTCHTBAINZ-BJKOFHAPSA-N 428.536 4.376 10 10 IICE COc1ccc(-c2csc(N3N=C(C)[C@H](N=Nc4cccc(C(=O)O)c4)C3=O)n2)cc1 575732636 IMWHIQLZTOQPKD-SFHVURJKSA-N 435.465 4.392 10 10 IICE COC(=O)c1ccc(Cl)cc1S(=O)(=O)Nc1nc2c(s1)CCc1ccccc1-2 727243948 LYPOEEYBJPSNET-UHFFFAOYSA-N 434.926 4.150 10 10 IICE O=C1NCCc2ccc(S(=O)(=O)Nc3nc(-c4ccc5ccccc5c4)cs3)cc21 734975569 OTDQUFCCLDIBIQ-UHFFFAOYSA-N 435.530 4.050 10 10 IICE COc1ccc(Oc2ccc(S(=O)(=O)Nc3cccc(N4CCOCC4)c3)cc2)cc1 741204769 RBZPJDPEVOJCKF-UHFFFAOYSA-N 440.521 4.125 10 10 IICE COc1ccc(N2CCN(CCNC(=S)Nc3ccc(Cl)c(Cl)c3)CC2)cc1 742910306 DJNCMKPKETXVBM-UHFFFAOYSA-N 439.412 4.111 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@H]1c1ccc(Br)s1 784517354 MNNXFMUXWAIJFS-KRWDZBQOSA-N 436.419 4.372 10 10 IICE O=C(Cc1csc(Cc2ccc(F)cc2)n1)NCc1cc(Br)ccc1O 804735697 DIIQUXGIACDGCF-UHFFFAOYSA-N 435.318 4.200 10 10 IICE COC[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(Cl)c1F 806150035 JWQTWHYIOGGTJI-QHCPKHFHSA-N 431.983 4.488 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(OCc2cccnc2)cc1 806257610 LNCQRTRLXGLKEJ-UHFFFAOYSA-N 428.286 4.450 10 10 IICE C[C@H]1CCC(F)(F)CN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1135067274 PIZQRZUVQKSJBL-GQVHDAKQSA-N 428.501 4.063 10 10 IICE COc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)no2)cc1 1137440233 QQMSIIYJSUUQKR-GOSISDBHSA-N 441.915 4.104 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H](O)c1ccccc1Br 1167512426 MTYJTDYNDUOLDS-QGZVFWFLSA-N 429.152 4.473 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F 1167742353 YOVPPQVNFBIJQF-MGPUTAFESA-N 443.849 4.203 10 10 IICE Cc1ccc(S(=O)(=O)N[C@@H](CCN(C)c2ccc3c(c2)OCO3)c2ccccc2)cc1 1168216049 ZLABHSZIGSPIGI-QFIPXVFZSA-N 438.549 4.270 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(CC2CC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1291401070 GBTYLLFLIFGDNR-UQBPGWFLSA-N 425.621 4.264 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)c(F)cc3Br)CC2)cc1F 1294823755 NMKCQOVLDPEZCM-UHFFFAOYSA-N 445.691 4.352 10 10 IICE COc1ccc(N2CCN(CCNc3cc(SCc4ccccc4)ncn3)CC2)cc1 1306946745 NVIRXQSDXHTVSK-UHFFFAOYSA-N 435.597 4.012 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@H]1CCCCCN1C(=O)OC(C)(C)C 1312884392 JFIGZHGXOKITOF-SIKLNZKXSA-N 446.636 4.471 10 10 IICE CCS[C@H](C)c1noc(CN(C)c2nnc(CC)n2Cc2ccc(N(C)C)cc2C)n1 1314582161 ITFHWZMACQBKDU-MRXNPFEDSA-N 443.621 4.097 10 10 IICE CN(c1ccc(CNC(=O)c2cnn3cc(Br)cnc23)cc1)C1CCCCC1 1442450275 QCSBKNFHMKSYFH-UHFFFAOYSA-N 442.361 4.191 10 10 IICE Cc1nc(C2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)NCc1c(O)cccc1F 1456031015 VWOIVVCVPAXZOH-UHFFFAOYSA-N 449.548 4.341 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2ccc(OCc3c(C)noc3C)cc2)cc1 1461345523 OPHKWSPNQQQWSP-UHFFFAOYSA-N 437.540 4.016 10 10 IICE CCN(CC(=O)NCc1ccccc1O)C(=O)OCC1c2ccccc2-c2ccccc21 1465990142 CKXQPZZJNRLEIR-UHFFFAOYSA-N 430.504 4.279 10 10 IICE CCC(C)(C)Cn1c(-c2cccn2C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1512629860 KGBHFMFRNOZKPQ-UHFFFAOYSA-N 436.604 4.445 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)O[C@H]1COc2ccccc21 1520031444 NGMPMIAWTYSMOJ-PBXDPIQXSA-N 429.494 4.094 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccc4)cn3)cc2F)C[C@@H](C)O1 1526002566 FJRBCFSHDCFSQN-KDURUIRLSA-N 449.526 4.343 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccccc2S(=O)(=O)NC(C)(C)C)cc1 1534930533 TVCIPKPRSXIPDG-UHFFFAOYSA-N 425.554 4.423 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1 1545318296 WTWZDBVFRVYRAW-KRWDZBQOSA-N 428.492 4.371 10 10 IICE COC[C@]1(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)OCCc2ccccc21 1556850885 ZOTAYKBYBCAGAX-MHZLTWQESA-N 446.547 4.059 10 10 IICE COc1ccc(Br)cc1-c1nc(C(=O)N2Cc3cccc(O)c3C2)cs1 1558036186 WHHGZMCNROHNSZ-UHFFFAOYSA-N 431.311 4.443 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CC2=CCSC2)sc(C)c1-c1ccccc1 1560020624 GXMQZBCXPIKASZ-UHFFFAOYSA-N 430.595 4.444 10 10 IICE CCN(C(=O)OC(C)(C)C)C1CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 1564946381 NYYJLJSQCUUIPA-IBGZPJMESA-N 446.636 4.423 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)c(C)n1-c1ccc(F)cc1 1565604966 DOGIKARLJRIEDJ-QFIPXVFZSA-N 440.588 4.013 10 10 IICE Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1566846084 LTVHBXQSMRNBRB-SFHVURJKSA-N 444.535 4.329 10 10 IICE COc1ncc(Br)cc1CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C 1584791548 GZDNBZNKFQXIRG-UHFFFAOYSA-N 428.330 4.499 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCCC[C@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1596733442 RTEQXALHTDRLDO-OFVILXPXSA-N 445.604 4.208 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(OC(F)(F)F)cc1C(F)(F)F 1597493965 OSHCXOTWZMINTF-UHFFFAOYSA-N 448.363 4.371 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccccc4)cc3C)cc2)CC1 1616251738 JOZFLIXWZMNSIY-UHFFFAOYSA-N 443.547 4.386 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@@H]1CCCS1 1617938148 XOEHRVLVULIKKW-HNNXBMFYSA-N 448.390 4.273 10 10 IICE Cc1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(N2CCCC2)n1 1624909414 YTEZXRXHROHJEF-UHFFFAOYSA-N 430.552 4.069 10 10 IICE CCOc1cc(C(=O)N(C)C)ccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1626452214 YHFMJHRZQVFAMV-UHFFFAOYSA-N 447.535 4.188 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@H](CO)C2CC2)c(C)n1-c1cccc(Br)c1 1628157144 STZDBQNVBUXYGH-RTWAWAEBSA-N 431.374 4.384 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)cc1 1628469212 SVWBVDDVBKDYIK-UHFFFAOYSA-N 443.345 4.056 10 10 IICE Cc1ccc(C(=O)NCC(=O)OCc2ccccc2Cl)cc1-n1c(C)cc(C=O)c1C 1633314510 JGQHRYAHQRONIJ-UHFFFAOYSA-N 438.911 4.342 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3(CN4CCOCC4)CCCCC3)c2C)cc1 1635412451 NHXNEAORPMZSDJ-UHFFFAOYSA-N 439.600 4.115 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3ncccn3)C2)c(C)n1-c1ccccc1Br 1635798647 XGOJMFZZYAUIDA-MRXNPFEDSA-N 425.330 4.276 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](n3cc(Cl)cn3)C2)c(C)n1-c1ccc(Br)cn1 1637178086 POAJKGUNMYESCM-MRXNPFEDSA-N 448.752 4.189 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(CO)(c3ccccc3)CC2)cc1 1637891983 DQTFSGURTDVKGX-UHFFFAOYSA-N 430.548 4.002 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3C3CCCCC3)cc2F)C[C@@H](C)O1 1653176138 ZANJSRBFOJIQPB-PWHSHALESA-N 431.596 4.100 10 10 IICE COc1ccc(N2CCN(Cc3c(F)ccc(Br)c3F)CC2)c(OC)c1 1659857674 XZGRROOOTWWYMJ-UHFFFAOYSA-N 427.289 4.067 10 10 IICE COc1ccc(N2CCN(CC(=O)N(Cc3ccccc3)c3ccccc3)CC2)c(OC)c1 1659857697 ZELPRQZCZOTLIT-UHFFFAOYSA-N 445.563 4.059 10 10 IICE COC(=O)CCC1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 1681827845 LOCJPHGIHACYRA-QGZVFWFLSA-N 435.996 4.451 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[S@@](=O)C(C)(C)CC3)cc2Cl)C1 1681828344 SMSNQMOHTJVABA-WVDZOPJMSA-N 426.026 4.019 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(CN(C)C(=O)OC(C)(C)C)CC1 1686826752 OLMYMARDMUITAZ-IBGZPJMESA-N 446.636 4.281 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)C[C@H]1CC=CCC1 1693006370 XKFMECMUOBCUBM-NRFANRHFSA-N 430.600 4.479 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCCn2c(CC3CC3)nnc2N(C)Cc2ccccc2O)C1 1693574822 PUPWNMWPDDZSML-BGYRXZFFSA-N 425.621 4.331 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N(C)[C@@H]3CCOC3)cc2)CC1 1708103954 IHCJIAAGNWVPPX-JOCHJYFZSA-N 425.621 4.376 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCOC(C)(C)C 1708508658 KKOUCHDKMVFUTH-IBGZPJMESA-N 429.609 4.332 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1709330458 AGFWOIVSJMFUHB-QGZVFWFLSA-N 429.565 4.432 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)(C)O)C1 1712051842 RBHJUKAJVAPAIE-OAQYLSRUSA-N 437.588 4.129 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N(C)CC(C)(C)C)cc1 1728384040 WTYPJDUNZOCTHG-UNMCSNQZSA-N 443.636 4.379 10 10 IICE CN(C)c1ccc(Cn2c(Nc3cnn([C@H]4CC4(F)F)c3)nnc2C(C)(C)C)cc1F 1747577541 RCNBDYIRPVJSCW-KRWDZBQOSA-N 433.482 4.349 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1Cc1ccnc(OC(F)F)c1 1747754317 PZNQJRCZRFAPNZ-UHFFFAOYSA-N 443.498 4.398 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cscn3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1751409632 FVFPYIOLWNRFME-SFHVURJKSA-N 449.628 4.396 10 10 IICE CC[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1765156269 DCDZUPOXRCXHEW-LJQANCHMSA-N 425.621 4.069 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)C1 1769404648 ZDZQGQKAHKRZSZ-INIZCTEOSA-N 432.619 4.165 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@@H]1COCCO1 1772872708 KPUDXAGZJUIYFW-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCCN1C(=O)C(NCCOc2ccccc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164949 ZRKHAYKVYZNUFC-UHFFFAOYSA-N 443.547 4.253 10 10 IICE Cc1ccc([C@H](C2CCC2)n2nc(C(F)F)c(N)c2I)c(O)c1 2079052058 PXTDHTIBCVPWOO-AWEZNQCLSA-N 433.240 4.411 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C(C)(C)C)c(C=O)c1I 2079848775 NBKLNLFYNBZCCQ-AWEZNQCLSA-N 442.297 4.311 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]21CNCc1cccc(Br)c1O 2089360182 VCOYUNABVACMHW-QRWLVFNGSA-N 425.367 4.424 10 10 IICE COc1cc(C=C2SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1ccc(C)cc1 2293308448 FOKDBSIPVQNVEY-UHFFFAOYSA-N 443.546 4.259 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccc(F)cc3)C2=O)c(C)n1-c1ccc(F)cc1 2293467594 HKKYSTFNTVOODA-UHFFFAOYSA-N 437.471 4.204 10 10 IICE Cc1cc(C=C2SC(=N)NC2=O)c(C)n1-c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1 2295172608 KCBOLMMDUKXYFN-UHFFFAOYSA-N 435.465 4.328 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccc(NC(C)=O)cc3)C2=O)c(OC)c1OC 2314531698 CWLOAJQRXBTFGV-UHFFFAOYSA-N 444.534 4.077 10 10 IICE CCOc1cccc(C=C2SC(=S)N(c3ccc(N4CCOCC4)cc3)C2=O)c1 2321734477 JNRXCBRMJJWXLB-UHFFFAOYSA-N 426.563 4.328 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2381135044 LMBWBSLGNOZXAG-MRXNPFEDSA-N 443.382 4.361 10 10 IICE Cc1ccc(CNC(=O)[C@@](C)(CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2381136712 IRIXBLOYOOZFQP-HXUWFJFHSA-N 443.382 4.409 10 10 IICE CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CN1C(=O)[C@@H](CC)SC1=S 11635627 MIXWLAIVVUBQSP-CQSZACIVSA-N 448.591 4.169 10 10 IICE CCOc1cccc(CN2CCC[C@@H](c3ccnc(SCCN4CCCC4)n3)C2)c1O 12281203 PWJFGULUYDTZEM-LJQANCHMSA-N 442.629 4.148 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)cc1O 14457127 RCGJMINTISAEHC-IXFSTUDKSA-N 426.538 4.012 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@@H]3C=CC[C@H]32)ccc1O 14459080 GJYFVXFYCNPAAU-YVHKJVDXSA-N 428.554 4.304 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471754 NBKUNXBYLPWQOX-JQVVWYNYSA-N 427.526 4.452 10 10 IICE COc1ccc([C@H]2Nc3c(C(=O)NC[C@@H]4CCCO4)cccc3[C@H]3C=CC[C@@H]32)cc1OC 14479450 IHMYISQGBICZFI-GSRZOBFVSA-N 434.536 4.439 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccccc2O)SC1=S)Nc1ccccc1C(F)(F)F 15035651 BMJQUYFKVKWIBM-DHDCSXOGSA-N 438.452 4.251 10 10 IICE CCOc1ccc(NC(=O)CN2C(=O)/C(=C/c3c[nH]c4ccccc34)SC2=S)cc1 15036186 NEOFOOFFRMCWRM-ODLFYWEKSA-N 437.546 4.407 10 10 IICE COc1ccc([C@@H]2Nc3ccc(C(=O)NC[C@@H]4CCCO4)cc3[C@@H]3C=CC[C@H]32)cc1OC 20716039 WZSJEHQOMYRBNY-OZAHESQGSA-N 434.536 4.439 10 10 IICE COc1ccc(N(CC(=O)N2CCN(c3ccccc3F)CC2)Cc2ccccc2)cc1 22990353 XIYVUYKZZFSCPW-UHFFFAOYSA-N 433.527 4.190 10 10 IICE CC[C@@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C\c2cccc(OC)c2)SC1=S 34990611 URULGDFWBHEZNU-VXNZKSKFSA-N 432.611 4.468 10 10 IICE Cc1ccccc1NC(=O)[C@@H](C)N1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S 47152300 GLXCJURTHRUXAS-GPLLRDDGSA-N 427.507 4.132 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@H]([C@@H]2CCCN2C(=O)OC(C)(C)C)C1 734687108 IEIHYGDUVKYWHY-UNMCSNQZSA-N 444.620 4.382 10 10 IICE CCOc1c(F)cccc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 742551244 GAUIFYVIOLYSGT-UHFFFAOYSA-N 426.410 4.010 10 10 IICE COc1ccc(Oc2ccc(NC(=O)N3CCN(c4ccc(OC)cc4)CC3)cn2)cc1 743195802 HSDVIEYWSZFSPA-UHFFFAOYSA-N 434.496 4.245 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(C(=O)c3cc(C)n(-c4ccccc4Br)c3C)[C@@H]2C1 755203424 PEHUOXSUEVCMPZ-MAODMQOUSA-N 447.373 4.265 10 10 IICE CCn1ncc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1-c1ccccc1 756748048 PZZTZKQHVSMRGE-UHFFFAOYSA-N 443.595 4.032 10 10 IICE Cc1nc(Cl)ccc1CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 764409008 MYDDAEOGAXDHNM-LJQANCHMSA-N 446.979 4.034 10 10 IICE CC(=O)[C@H](C)CCCCC(=O)O[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 783222747 PSLAEILMGXMKSL-NVXWUHKLSA-N 449.503 4.118 10 10 IICE Cc1cc(C)c(N2CC[C@@H](N[C@@H](C)c3ccc(N4CCOCC4)c(F)c3)C2=O)c(C)c1 788983948 PMCFIIWKFCQGCF-SIKLNZKXSA-N 425.548 4.044 10 10 IICE COc1ccc(CNC(=O)C2(c3ccc(OCc4ccccc4)cc3)CCOCC2)c(O)c1 794382756 GWTUJVPKOLRKRS-UHFFFAOYSA-N 447.531 4.344 10 10 IICE C[C@H]1CN(c2ccc(CN3C(=O)[C@@H]4CC[C@@H](c5ccccc5)N4C3=O)cc2F)C[C@@H](C)O1 797133617 BRSZCHGJSMRVJJ-XQYWTEMXSA-N 437.515 4.107 10 10 IICE COc1c(C)cc(C)cc1S(=O)(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 800925982 JZSOWEDMAMLTAV-UHFFFAOYSA-N 433.511 4.453 10 10 IICE C[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(N2CCCOC2=O)cc1 814451379 ZNHWRXZVRDTCQD-CYBMUJFWSA-N 448.317 4.062 10 10 IICE Cc1cc(Cc2nc([C@@H]3COCCN3C(=O)OC(C)(C)C)no2)c(C)n1-c1ccccc1 904701699 FBMRHVYTNOBHGH-FQEVSTJZSA-N 438.528 4.376 10 10 IICE COc1cc(/C=C2/SC(=S)N(CNc3cccc(C)c3)C2=O)cc(OC)c1OC 1084484577 VQMVTWKPLXQRLF-WOJGMQOQSA-N 430.551 4.292 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3cc(C(=O)OC)cc4cccnc34)ccc21 1134088388 DFBWZHMAEOHLIZ-UHFFFAOYSA-N 431.492 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)c2ccc(N3CCOC3=O)cc2)c1 1136424629 GTSJSIQNYFTGRW-KRWDZBQOSA-N 431.492 4.354 10 10 IICE CCC(CC)(CC)CNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1150608252 CPWAIGBEBFUNAH-UHFFFAOYSA-N 449.529 4.047 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCc3nn(C)cc32)c(C)n1-c1ccc(Br)cc1 1155745990 KGVFLXOOZOLYFB-LJQANCHMSA-N 427.346 4.398 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@@H]1CCCO1)NCC1(c2ccc(F)cc2)CCCC1 1192012696 JDMQCXARUHVMCW-QHCPKHFHSA-N 440.559 4.141 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@]2(C)c2cccc(Br)c2)N(C)C)cc1 1289602913 YBJYAPYNACKKHO-FUPPJEDESA-N 444.417 4.212 10 10 IICE O=C(C[C@H]1CCc2sccc2C1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294161600 PMGLQAVQKQLUMW-CABCVRRESA-N 434.508 4.270 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1 1302453734 FZPMCIWRLNETRT-UHFFFAOYSA-N 437.490 4.076 10 10 IICE CCOC(=O)CN(CC(=O)N[C@@H](c1ccccc1)C1CCCCC1)Cc1ccccc1O 1307862260 BLYXXHXCUARVOP-SANMLTNESA-N 438.568 4.195 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCOCC1 1314464930 RFCOUQURRSBAGS-UHFFFAOYSA-N 437.588 4.252 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cccc(OC)c1 1358433071 IZVATJYKUJDGLI-UYRXBGFRSA-N 444.553 4.479 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1ccc(Cn2cc(Br)cn2)cc1 1472085621 XWDKKSQGQBKEPK-UHFFFAOYSA-N 436.309 4.483 10 10 IICE COc1cccc([C@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1473327729 WDBWISXQXZZDLB-JKSUJKDBSA-N 428.488 4.148 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(C4CCCCC4)CC3)cc2F)C[C@@H](C)O1 1473617140 FOASRERZHWGIBS-WOJBJXKFSA-N 445.623 4.348 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC[C@H]1C 1493971219 FNHUUZNZAPCALR-RTBURBONSA-N 443.611 4.373 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC1(OC)CCC1 1512804462 LCGADQYEJIDOQQ-FQEVSTJZSA-N 441.620 4.224 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1(c2ccc(C(F)(F)F)cc2)CCC1 1516809644 CIFCUTGRAWSJTE-UHFFFAOYSA-N 436.449 4.419 10 10 IICE Cc1ccc(CN(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)s1 1542361427 JYTICTFJCSFZOG-UHFFFAOYSA-N 443.592 4.432 10 10 IICE C[C@@H](CC(N)=O)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CCC2 1543524546 DQJDSUUINTULHK-DOMQTXCISA-N 442.563 4.171 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc(-c2cccnc2)n1CCCSc1nccs1 1545157158 RJCSMMAAIZWUSD-LSDHHAIUSA-N 432.644 4.309 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1c2ccccc2C(=O)OC1(C)C 1545509056 XYDVKELRRXXUTI-SFHVURJKSA-N 432.314 4.236 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCCS1 1545538235 XXFQMEJVHSPKBE-FUHWJXTLSA-N 433.597 4.162 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)cc(C)c(Br)c3C)CC2)cc1F 1545606553 SNNHBJVREYTVRL-UHFFFAOYSA-N 435.337 4.484 10 10 IICE CCN(CC)c1nnc([C@H]2COc3ccccc3O2)n1CCCSc1nccs1 1547463042 VGCJBONNRGHKQV-QGZVFWFLSA-N 431.587 4.276 10 10 IICE C[C@@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)C[C@@H]1F 1555949074 LGYFLWQBXVUHGP-AEFFLSMTSA-N 431.606 4.496 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)c3cc(C)n(-c4cccc(C)c4)c3C)CC2)c1 1556674269 BUUBSLNODQCLPI-UHFFFAOYSA-N 434.540 4.253 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1 1565702034 RYCXZGNCCAVLMV-JOCHJYFZSA-N 439.625 4.190 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)cc1S(C)(=O)=O 1570366713 DQAYICOUWSDPHJ-UHFFFAOYSA-N 432.929 4.412 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](C(=O)OC(C)(C)C)c3ccnn3C)c2C)c1 1583522504 HEDBWWASLOCIRI-JOCHJYFZSA-N 436.556 4.257 10 10 IICE C[C@@H](NC(=O)c1cc2c(Br)c(F)ccc2[nH]1)c1ccc(N2CCOCC2)cc1 1583676473 NIBVIXWNUOSEDT-CYBMUJFWSA-N 446.320 4.397 10 10 IICE Cc1cc(CCNC(=O)[C@@H](C(C)C)N2Cc3ccccc3C2=O)c(C)n1-c1ccccc1 1587465541 OUITVCCPRPKLDE-RUZDIDTESA-N 429.564 4.433 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C[C@H]1C 1612829258 OOIWSFHCLFHDLH-ZWKOTPCHSA-N 429.584 4.082 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)N(C1CCCC1)C1CC1 1615478118 YDQMBBGXSSFFHQ-UHFFFAOYSA-N 427.589 4.398 10 10 IICE CCN(CC1CCC1)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1615555226 ZXGBHSLEDDXUCY-UHFFFAOYSA-N 429.584 4.127 10 10 IICE O=C(Cc1nc(C2CCCC2)cs1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634631 DOEYUUHOXGANIJ-GOSISDBHSA-N 434.005 4.483 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@](C)(O)c2ccc(F)c(Br)c2)cc1 1624540729 BKJGBWZJIIOXQS-OAQYLSRUSA-N 437.353 4.301 10 10 IICE Cc1cc(C(=O)NCCCN(C)CC(F)(F)F)c(C)n1-c1cccc(Br)c1 1630035903 DRFOGHGQLQHERP-UHFFFAOYSA-N 446.311 4.471 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)C[C@@]3(O)CCN(Cc4ccccc4)C3)c2C)c1 1630831809 UMDZJSACAUMTBS-NDEPHWFRSA-N 445.607 4.420 10 10 IICE Cc1cc(CC(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1632965122 UEOVWADZNYRJDV-RBUKOAKNSA-N 425.573 4.493 10 10 IICE Cc1ccc(S(=O)(=O)N(CCC(=O)N[C@H](C)c2ccccc2O)c2ccccc2)cc1 1648887459 RMOOHNZNCQNPGO-LJQANCHMSA-N 438.549 4.163 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H](C)CCCCNC(=O)OC(C)(C)C 1673244407 NHNQGGRBXDIVBO-OALUTQOASA-N 434.625 4.375 10 10 IICE COc1ccc(C[C@H]2CCCCN2C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1 1673822422 AYWLGABCTPNUNQ-JTHBVZDNSA-N 437.584 4.337 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCC1 1680665631 LIKHQTKIODJTCJ-NRFANRHFSA-N 432.609 4.368 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCN(Cc1ccccc1)c1ccccn1 1683888144 ZLGFEQLPWKYZHI-UHFFFAOYSA-N 431.584 4.386 10 10 IICE COc1ccc([C@@H]2CN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CCO2)cc1 1684321518 AKTZVOMGOSOAEF-VWLOTQADSA-N 433.552 4.428 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@H]3C[C@@H](O)c3ccccc3)c2C)c1 1684478901 MEWRCZIRWRVJEC-CLJLJLNGSA-N 447.579 4.437 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)C[C@H](C)C3)n2CCCSc2nccs2)n1 1693422861 IOJIRVUUOKSFIK-HOTGVXAUSA-N 445.662 4.261 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(CCOC)CC1 1694134124 MECYAHXHGUAKIF-SFHVURJKSA-N 445.583 4.083 10 10 IICE CCO[C@@]1(c2nnc(N3CCCCCCC3)n2Cc2ccc(N(C)C)cc2C)CCOC1 1696071614 HLHMBERJOKIHMD-VWLOTQADSA-N 441.620 4.123 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N1CC[C@H](C)C1 1707304783 FWZYRCCIQMOIDI-AWEZNQCLSA-N 443.393 4.305 10 10 IICE Cc1ccccc1Cc1nnc(N(C)C[C@@H](C)C#N)n1CCCSc1nccs1 1707657735 CSDAAFVFSQPBLK-INIZCTEOSA-N 426.615 4.412 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1Cc1cccc(C(F)(F)F)n1 1711095694 VDKOZRJQGIDXBZ-UHFFFAOYSA-N 428.418 4.077 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1C[C@@H](C)[C@H](C(F)(F)F)C1 1724236437 VYZIQGBXEQOGJW-ATZDWAIDSA-N 437.510 4.187 10 10 IICE C[C@@H]1CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)CC[C@H]1C 1726618119 CECWHFYYFQVWJO-IAGOWNOFSA-N 428.631 4.385 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)(C)C 1745877633 JVEMQCCVZNEMRD-UHFFFAOYSA-N 436.604 4.313 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCC2(C)C)CCOC1 1746657520 DYDWMTGOFZLJHI-NTKDMRAZSA-N 428.577 4.099 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCC(=O)NC1CCCCC1 1768681662 LQRMHTONQRBHLM-UHFFFAOYSA-N 425.577 4.117 10 10 IICE Cn1c2c(c3cc(Cl)ccc31)C[C@H](C(=O)N1CCN(c3ccc(F)cc3)CC1)CC2 1858153831 WTUQFVBQFSTXPA-MRXNPFEDSA-N 425.935 4.425 10 10 IICE O=C(O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(Br)cc3)cs2)cc1 1859478213 BKDZHKBITVHOHC-UHFFFAOYSA-N 439.312 4.072 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)C23CCC3)c1O 2236044784 MACWTKZSOZIZEA-INIZCTEOSA-N 441.366 4.185 10 10 IICE CC[C@@H](C)Oc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC 2294092677 KLNHNFXKSZEVOS-CYBMUJFWSA-N 428.872 4.192 10 10 IICE CCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314767065 DDYMIEIDWKIVDS-KRWDZBQOSA-N 428.491 4.100 10 10 IICE Cc1ccccc1NC(=O)CCCN1C(=O)C(=Cc2ccc(O)cc2O)SC1=S 2314831539 NAWOYASGVZNTMF-UHFFFAOYSA-N 428.535 4.026 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(O)c3)C2=O)ccc1O[C@@H](C)C(=O)O 2314934655 JJQRNYVMIHTKPX-LBPRGKRZSA-N 445.518 4.049 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2c(O)cccc2Br)C[C@H]2CCC[C@H]21 2335127957 OPIJJOWCZLNPJK-JKIFEVAISA-N 425.367 4.422 10 10 IICE CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352623903 CYFMREYRNBYBFG-CQSZACIVSA-N 429.355 4.163 10 10 IICE CCOc1ccc(NC(=O)CN2C(=O)/C(=C/c3cc(Cl)ccc3O)SC2=S)cc1 15036164 WFSDXFSMXBYRIS-YVLHZVERSA-N 448.953 4.284 10 10 IICE Cc1ccc(-n2c(C)cc(/C=C3\SC(=O)N(CC(=O)OC(C)(C)C)C3=O)c2C)nc1 20290112 PYPGAHZFRISKNL-YVLHZVERSA-N 427.526 4.176 10 10 IICE CCOc1ccccc1N1CCN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 27063119 CAVQSEUEQKYWIQ-UHFFFAOYSA-N 433.552 4.464 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3ccc(I)cc3)N=C2C)ccc1O 96481864 MKTVWZWTXRBAGV-YBEGLDIGSA-N 448.260 4.202 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C1=O 102946246 WSGKQVVMELCKIC-UOEQGAKJSA-N 439.518 4.381 10 10 IICE CC(=O)O[C@H]1[C@@H]2O[C@H](c3ccccc3)OC[C@H]2O[C@@H](Sc2ccccc2)[C@@H]1N=[N+]=[N-] 198637075 BBGNXDOVHXFZJI-UFOPBENGSA-N 427.482 4.228 10 10 IICE C[C@@H](Oc1ccc(Br)cc1)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 248378290 JDAGJBOSPYJZCZ-DNVCBOLYSA-N 434.330 4.130 10 10 IICE O=C(O)/C=C/c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1Br 705929765 IEAMOZGPYMJVRV-YUVOTWOWSA-N 427.342 4.115 10 10 IICE COc1cc(CNCc2cc(Br)ccc2O)ccc1OCc1ccncc1 725846208 XGVSAYGWMUZFIZ-UHFFFAOYSA-N 429.314 4.427 10 10 IICE COC(=O)/C=C/c1ccc(N(C)Cc2cc(OC)c(OC)cc2SC)c([N+](=O)[O-])c1 741244009 SXNPEORHRYJNMG-VQHVLOKHSA-N 432.498 4.157 10 10 IICE COc1cc(N(C)Cc2nc(Cc3cccc(Br)c3)no2)cc(OC)c1OC 741798406 BZQOQPDXSGRSNH-UHFFFAOYSA-N 448.317 4.085 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 742801281 OUWUIFDUQIRTHC-FQELHTAISA-N 443.494 4.281 10 10 IICE COc1ccc(F)c(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 755834993 CLSCNJDOLBSRJT-UHFFFAOYSA-N 427.398 4.011 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)c2)c1C 766387609 MTXYUMBHEKBRDF-UHFFFAOYSA-N 432.568 4.459 10 10 IICE COc1ccc2c(c1)c(C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)c(C)n2C 1126580564 ARIAGBTVDLMRHY-INIZCTEOSA-N 443.494 4.496 10 10 IICE CC[C@@H](NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2)C(=O)NC 1129926294 ZWURRVQULXVJNB-APQDCOLYSA-N 442.563 4.042 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C[C@H]2CCCO2)C(F)(F)F)C1 1130476015 YBPCSGVZBSXALV-IIBYNOLFSA-N 437.506 4.024 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3c4ccccc4C[C@H](C)[C@@H]3C(=O)OC)ccc21 1133471327 KQVLZLALUNUSSI-UPCLLVRISA-N 434.536 4.285 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCN(C(=O)c3cccc(F)c3)CC2)c1 1136156554 BXHUKEVXLYFCSF-UHFFFAOYSA-N 447.510 4.034 10 10 IICE Cc1cc(C(=O)NCCN(C)CC(F)(F)F)c(C)n1-c1ccc(Br)cc1 1144986211 UPHVYJCGTUHPHC-UHFFFAOYSA-N 432.284 4.081 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(Cc3nc(C(C)(C)C)cs3)CC2)cc1 1171892795 BSMNVMZJVJTTLH-UHFFFAOYSA-N 428.646 4.078 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(F)cc(C(F)(F)F)c3)cc2F)CC1 1265012277 UZZKQYQCBPTGJB-UHFFFAOYSA-N 427.417 4.056 10 10 IICE COc1ccc(Cn2ncc(C)c2NC(=O)c2cc3cc(O)c(O)cc3s2)cc1OC 1292795964 MCZSVUSDZOSSMT-UHFFFAOYSA-N 439.493 4.135 10 10 IICE COC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1N 1297139626 GAOMYXCQIOVHMG-UHFFFAOYSA-N 442.313 4.478 10 10 IICE Cc1ccc(C(=O)Nc2ccc(C(F)(F)F)c(I)c2)c(O)c1O 1303877773 GQXORGPSLUJINH-UHFFFAOYSA-N 437.155 4.282 10 10 IICE CC[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@H](C)O1 1306454545 XGSNEFZQFFARKT-WMZHIEFXSA-N 425.621 4.437 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](COC)C1 1316033272 FMICFRSERWVRID-OAQYLSRUSA-N 437.588 4.252 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)[C@@H](C)C2)cc1 1352391207 DFBJQEKNQKILEM-FQEVSTJZSA-N 431.536 4.232 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1358433164 JXPHAOJANWUNAG-HXUWFJFHSA-N 439.556 4.488 10 10 IICE Cc1ccc(N2C[C@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1C 1438177265 HOCXILNPVLQFQJ-HSZRJFAPSA-N 429.564 4.423 10 10 IICE COc1cc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)ccc1OC(F)F 1440619794 WGFLTMWAJDKUIU-UHFFFAOYSA-N 428.435 4.447 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccn1 1454894260 NYBRQNXFNQFZSJ-KRWDZBQOSA-N 426.561 4.255 10 10 IICE COC(=O)COc1ccc([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1466726668 IHAQSMOZWMNHSD-QGZVFWFLSA-N 436.508 4.146 10 10 IICE C[C@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1494242806 FKGMKQMVVFZFLK-AWEZNQCLSA-N 446.983 4.189 10 10 IICE CC(C)OC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1509833669 WYMZLPXALRZUMX-UHFFFAOYSA-N 425.621 4.400 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](CC(N)=O)C3)n2CC(C)C)c(C)n1-c1ccccc1 1510621413 VCHVJRANOKFZQP-FQEVSTJZSA-N 434.588 4.100 10 10 IICE Cc1cnc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1516530922 DBFJMFKXKMAQPO-DGGAMASNSA-N 435.571 4.059 10 10 IICE Cc1cc(Br)cc2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)oc12 1516763220 XYZQPZXZRDPJEP-UHFFFAOYSA-N 447.304 4.409 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1525821831 JSGLKJDHFMTROB-GCJKJVERSA-N 448.563 4.065 10 10 IICE CN(C)C(=O)[C@](C)(NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1)C(F)(F)F 1528150065 UDWKEBLPJKFYET-FQEVSTJZSA-N 435.450 4.307 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3c(Cl)cc(Cl)cc3Cl)cc2)C1 1534540842 RKTBTMSNZAJAFK-ZDUSSCGKSA-N 440.758 4.279 10 10 IICE CCc1nnc(N(CC)[C@H](C)C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1546434299 UCYYLYATRGHUCB-LJQANCHMSA-N 425.621 4.112 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1NC(=O)CC1(C)C 1547083183 CBCJGUVNJRHZGZ-NRFANRHFSA-N 434.588 4.114 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](O)C23CCCC3)sc(C)c1-c1ccccc1 1559875520 YPUDPTZILOXEBK-SFHVURJKSA-N 442.581 4.218 10 10 IICE CCc1ccc(F)cc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1565881902 KHUXRCRMNSVIOD-OAQYLSRUSA-N 429.536 4.450 10 10 IICE CSc1ccc(O[C@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1566356460 FQMHWDPCFITVEN-CRAIPNDOSA-N 434.989 4.316 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3)C2)cc1 1585664606 DGMJABUVZFQWQC-QGZVFWFLSA-N 425.529 4.299 10 10 IICE C[C@H]1CCC[C@H](C2CN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)C1 1587787122 FFHXBCHNMIABDW-GJZGRUSLSA-N 434.583 4.153 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1coc(-c2c(F)cccc2F)n1 1595584499 NVOVLECNOGGKSO-HNNXBMFYSA-N 447.869 4.373 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCCS(=O)(=O)c1ccc(Cl)cc1 1597800518 KOYPOHAAYWWESL-QGZVFWFLSA-N 437.005 4.016 10 10 IICE CC[C@@H](Cc1ccccc1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1615678781 JTFHSEMYBOWHJA-FQEVSTJZSA-N 426.516 4.354 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](F)C1 1619611694 MSVCVZGJPWJWHV-FPDPHYFHSA-N 429.515 4.131 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1623477423 ZDHMGXPJDRJOSM-PZJWPPBQSA-N 433.568 4.230 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)ccc1O 1623733288 QXBAEHOTHPVGMF-UHFFFAOYSA-N 441.553 4.084 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc([N+](=O)[O-])c1 1627824512 MISGXMOJFRYKOB-YVLHZVERSA-N 445.497 4.272 10 10 IICE CCCCC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C(=O)OC 1629606884 MHECFQRGDGCDSF-KRWDZBQOSA-N 436.350 4.103 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630262666 OHKCFRINCXJTOG-IRXDYDNUSA-N 437.371 4.065 10 10 IICE COCCN(CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1)C(=O)OC(C)(C)C 1631531019 DWGNMSPRISOGFY-IBGZPJMESA-N 442.556 4.366 10 10 IICE COc1ccccc1Nc1nc2sc(C(=O)NCc3cc(O)ccc3O)cc2s1 1637122566 IXAJUSLKATVDLV-UHFFFAOYSA-N 427.507 4.451 10 10 IICE CCN1CCO[C@@H](C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)C1 1648493756 LDHGOUYDPBQLFS-TZIWHRDSSA-N 435.490 4.019 10 10 IICE Cc1cc(C(=O)NCCCN(C(C)C)C(C)C)c(C)n1-c1ccc(Br)cn1 1654386482 LIFMACPNNLGIJF-UHFFFAOYSA-N 435.410 4.490 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccc(C)o4)C3=O)c2C)cc1 1656255742 HQQRCLCSSNCZJP-VWLOTQADSA-N 449.507 4.044 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)C(F)(F)F)C3(CCCCC3)C2)c1O 1659212769 NDDBKJOKNIRJAI-UHFFFAOYSA-N 432.870 4.158 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1[C@H]1CCC[C@H](C(F)(F)F)C1 1707860854 RRTQSZWJBWNIDO-ICSRJNTNSA-N 437.510 4.353 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1710386864 QRAOYWJLMLCLJY-NRFANRHFSA-N 437.588 4.393 10 10 IICE Cc1csc(CN(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)c1 1725049481 NPQRUMCPDUAUBZ-UHFFFAOYSA-N 443.592 4.432 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)C(C)(C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1751408854 PNFFRHIBPZJRLG-GOSISDBHSA-N 448.615 4.313 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCO[C@@H](C(C)C)C1 1751432822 NLMVVSJKDPIVMT-HSZRJFAPSA-N 425.621 4.295 10 10 IICE CCCC(=O)N[C@H]1CCCN(c2nnc(C3CCC3)n2CCCSc2nccs2)C1 1765387174 KUNNINYEBYZTGH-KRWDZBQOSA-N 448.662 4.070 10 10 IICE CCOCCN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1768112585 BBSTXMUULUPEOP-QHCPKHFHSA-N 441.620 4.277 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3cccc(NC(=O)C4CCCC4)c3)CC2)cc1 1874728875 UFLRHSSVHGAVQM-UHFFFAOYSA-N 435.568 4.219 10 10 IICE Cc1nn(Cc2ccc(Br)cc2O)c(I)c1C1(C)CC1 2079596088 SJRTWKOTYIOBQE-UHFFFAOYSA-N 447.114 4.364 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@]21CNCc1c(O)cccc1Br 2089369524 ONTTUXGFTIUDRN-XOBRGWDASA-N 425.367 4.424 10 10 IICE CN(C)c1ccc(C=C[C@@]23NC(=O)CN2c2ccc(Br)cc2C3(C)C)cc1 2297471196 KGZUVUNFFZRBDN-JOCHJYFZSA-N 426.358 4.152 10 10 IICE COc1cc(OC)cc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)c1 2321740233 QJLZUVGRNPYVBA-UHFFFAOYSA-N 431.564 4.436 10 10 IICE Cc1ccc(CN[C@@H](C)[C@H]2[C@H]3C[C@H]2N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352946237 HWMLRONLEDLISU-HNKHHVNMSA-N 425.367 4.197 10 10 IICE CCCC1=NN(c2ccc(OC)cc2)C(=O)/C1=C(\C)Nc1ccc(Cn2cnnc2)cc1 17096985 VFAVIQRDUZUHKC-HAVVHWLPSA-N 430.512 4.224 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C\c2ccc(OC(C)C)c(OC)c2)SC1=S 206872120 RKUAEOWYWDPWBI-QGOAFFKASA-N 437.583 4.417 10 10 IICE Nc1ccc(CCC(=O)Nc2ccc(I)cc2Br)cc1 380004601 BOFHGRCIYDBRMX-UHFFFAOYSA-N 445.098 4.207 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCCc3c[nH]c4ccc(F)cc34)cc2F)C[C@@H](C)O1 735096816 ZCUADSBKKRAIEW-IYBDPMFKSA-N 442.510 4.102 10 10 IICE COc1ccccc1[C@@H](O)CNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 799993276 FNUBQBGTWNEDJS-KKSFZXQISA-N 431.964 4.118 10 10 IICE CCc1nc(C)c(NC(=O)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)s1 800636887 QAESDYAXUODFGG-CYBMUJFWSA-N 434.993 4.159 10 10 IICE O=C(N[C@H]1CCCC[C@@H]1c1ccccc1)C(=O)N(Cc1ccco1)Cc1ccccc1O 803131969 VJWULWCOTOMDQP-PKTZIBPZSA-N 432.520 4.357 10 10 IICE CC[C@@H](C)NC(=O)c1cccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1125099390 YOQFPCTYSPFIHC-GOSISDBHSA-N 447.579 4.373 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2occc2CN2c3ccccc3C[C@H]2C)cc1 1130744531 CUDDRGGIZHDCHA-LJQANCHMSA-N 433.552 4.448 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(c4cc(OC)cc(OC)c4)CCCC3)CC2)cc1 1137658530 LJHDSKBWYGJRMY-UHFFFAOYSA-N 438.568 4.263 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](CC(C)C)NC(=O)c2ccccc2C)cc1F 1144977613 JSDWGNIQQKNENM-JOCHJYFZSA-N 427.564 4.441 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3C[C@@H](OC(C)(C)C)[C@H]3n3cccn3)c2C)cc1 1158289804 YOSVBQKOLAJLPG-ZLNRFVROSA-N 436.556 4.226 10 10 IICE Cc1cc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)c(C)o1 1188716591 CEDWWTDKHAJYCP-DEOSSOPVSA-N 437.471 4.093 10 10 IICE COC1CCN(c2ccc(CN3CCC4(CC3)CN(C(=O)OC(C)(C)C)C4)cc2)CC1 1195659670 PFHSPFOEELGBIV-UHFFFAOYSA-N 429.605 4.135 10 10 IICE COc1ccc(CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)[C@H](C)C2CC2)cc1 1233605144 SGYWNMCZMCKPBQ-LJQANCHMSA-N 437.584 4.167 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(COc4ccc(F)cc4)cc3)C2)cc1 1252308150 NEAOLVAMYUEKMD-QFIPXVFZSA-N 449.526 4.491 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3c(Cl)cccc3C(F)(F)F)c2)CC1 1269319201 UYDDPCTZCREYNM-UHFFFAOYSA-N 425.838 4.280 10 10 IICE Cc1ccccc1Oc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)nc1 1275224303 BWMZJKLYOPZJPV-UHFFFAOYSA-N 439.462 4.227 10 10 IICE CC(C)Oc1cc(Br)cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1289600584 UDOQBUSCTZOFNJ-OAQYLSRUSA-N 448.405 4.335 10 10 IICE CC[C@@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1293403449 MTDBBEXUMFJADF-OAQYLSRUSA-N 439.648 4.360 10 10 IICE C[C@@H]1C[C@@H](C)CN(C(C)(C)Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1304913627 WPYRWUSMYPKXCH-WOJBJXKFSA-N 448.615 4.439 10 10 IICE Cc1cc(C(=O)COc2ccc(F)cc2C(N)=O)c(C)n1-c1ccc(OC(F)F)cc1 1307369603 DNJDADIJVRZASP-UHFFFAOYSA-N 432.398 4.195 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3Cc3sccc3C)CC2)cc1F 1315512252 LMXXZQFCULJUPI-UHFFFAOYSA-N 443.592 4.468 10 10 IICE COc1ccc(N2CCC(NC(=O)C(F)(F)c3ccccc3Br)CC2)cc1 1352537887 QCYICAMDRQKPTF-UHFFFAOYSA-N 439.300 4.335 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCC(=O)NCc2ccc(N3CCSCC3)cc2)C1 1441628941 GAIKMFGNMFJSEE-FQEVSTJZSA-N 447.645 4.283 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C/C=C\c2ccccc2)CC1 1443761843 IKNRIKOFJHAZKC-FLIBITNWSA-N 427.548 4.378 10 10 IICE CC(=O)C(C)(C)CCC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1456781620 JIHXMFUZLSSSBF-UHFFFAOYSA-N 429.318 4.493 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3cccc(NS(=O)(=O)C4CC4)c3)c2C)c1 1456997215 WAXAGDUPYCYNCF-UHFFFAOYSA-N 437.565 4.237 10 10 IICE COC(=O)c1cc(OCc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)ccc1N(C)C 1459233293 CJUWBBWNSDKKSL-UHFFFAOYSA-N 440.540 4.411 10 10 IICE COC(=O)c1c(F)ccc(F)c1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1462890942 IGGMJCVFXIWTQH-UHFFFAOYSA-N 428.435 4.232 10 10 IICE Cc1cc(C(=O)N(CCCO)Cc2ccccc2)c(C)n1-c1ccc(Br)cn1 1465882262 JDGIOEJCNSAWGQ-UHFFFAOYSA-N 442.357 4.276 10 10 IICE CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1469852960 CYNLXHJLTDXYMD-QYXIYQDXSA-N 437.632 4.459 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2c(O)ccc3ccccc23)[C@H]1c1ccc(Cl)c(F)c1 1472085258 NVBGCYZAZHWYAI-OPAMFIHVSA-N 426.875 4.174 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)[C@@H]1Oc1ccccc1 1478472885 VUQRCDDFVZUICF-SDHSZQHLSA-N 437.584 4.443 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](N3CCCC3=O)C2)n1CCCSc1nccs1 1512965845 IQMKAKKSVWAVLN-IAGOWNOFSA-N 448.662 4.022 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CCN(C(C)=O)CC1 1514565433 AZRYIRSEVWOVCS-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCOc1ccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c(F)c1 1536636797 XHKANJLBWPYBJP-UHFFFAOYSA-N 434.379 4.160 10 10 IICE Cc1noc(C)c1[C@H](C)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1543377819 PBIWSLNLACHMGX-MRXNPFEDSA-N 432.528 4.014 10 10 IICE CC[C@@H](C)CN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1545635630 HFGFLAKRBLJTPI-GOSISDBHSA-N 449.578 4.252 10 10 IICE CCOCc1nnc(N2CCC(CC)(CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1548122429 KPFQFPKSJUOVHJ-UHFFFAOYSA-N 443.661 4.433 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1555491397 ZAWHICCQWJSFRI-FQEVSTJZSA-N 425.602 4.331 10 10 IICE CNC(=O)OC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1556879718 WUZFTCNCPUJJBQ-INIZCTEOSA-N 448.361 4.207 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC[C@@]2(C)CC)sc(C)c1-c1ccccc1 1559713417 OYGBIFAGBXQFHN-HSZRJFAPSA-N 430.570 4.340 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c(C)n1-c1ccccc1Br 1565611582 KZIBPJNURCOAOR-HOCLYGCPSA-N 446.389 4.376 10 10 IICE Cc1nc(CCC(=O)NCc2ccc(O)cc2O)oc1-c1ccc(Br)cc1 1570462295 MTMZDWVYFJLGDQ-UHFFFAOYSA-N 431.286 4.073 10 10 IICE COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)C1 1583504275 DOJGRDZNSMYWOG-XMSQKQJNSA-N 439.600 4.221 10 10 IICE Cc1ncsc1/C=C/C(=O)N(CCc1ccccn1)c1ccc(Br)cn1 1585706830 FOWCDYKSFGLKEF-SOFGYWHQSA-N 429.343 4.293 10 10 IICE COc1ccc(N2CCN(CC3CCN(C(=O)OCc4ccccc4)CC3)CC2)cc1F 1616274254 AGTXNKCZWYPBCY-UHFFFAOYSA-N 441.547 4.005 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCSC[C@H]2c2cccc(C(F)(F)F)c2)cc1 1617302891 PMPQYOOKAWJLEO-FQEVSTJZSA-N 437.531 4.178 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C 1623451584 IXFVVCSYQYDLIL-NRFANRHFSA-N 447.620 4.153 10 10 IICE Cc1cc(C(=O)N2CCN(C3CCCCC3)CC2)c(C)n1-c1ccc(Br)cn1 1623620823 SKONOCVTKGWRMP-UHFFFAOYSA-N 445.405 4.342 10 10 IICE Cc1ccc(C)c(C2=NO[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)C2)c1 1626106352 NYDTZGQHNWLHPJ-RCZVLFRGSA-N 435.568 4.070 10 10 IICE COC(=O)CCCOc1ccc(CNC(=O)c2sccc2-n2c(C)ccc2C)cc1 1628091482 INGJEZQESMJBGR-UHFFFAOYSA-N 426.538 4.418 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(Cc3cccc(F)c3)C(=O)C2)c1 1629437436 FEGNGMKUUHREMU-UHFFFAOYSA-N 439.918 4.371 10 10 IICE Cc1cc(C(=O)N[C@H]2CS(=O)(=O)Cc3ccccc32)c(C)n1-c1ccc(Cl)cc1 1633651375 WSEGYPKXLPBKIG-NRFANRHFSA-N 428.941 4.147 10 10 IICE C[C@@H](Sc1nc2ccccc2s1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1642155451 SVJMFFHHYLADJV-OAHLLOKOSA-N 427.595 4.054 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]3OCCC[C@H]3C2)sc(C)c1-c1ccccc1 1642219371 XGGFHMWPFJWIEC-OALUTQOASA-N 442.581 4.340 10 10 IICE Cc1ccc(C(=O)N2CCn3nc(C(F)(F)F)cc3C2)cc1-n1c(C)cc(C=O)c1C 1646046774 SKRFYSQJBPKIDS-UHFFFAOYSA-N 430.430 4.086 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c1 1649386101 OERLVEMDWYPJOU-OAQYLSRUSA-N 425.529 4.036 10 10 IICE CCOC(=O)CS[C@@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)C(F)(F)F 1650763485 UBFAFDTUMPYISH-KRWDZBQOSA-N 446.466 4.190 10 10 IICE Oc1ccc2c(c1CNc1ncnc3ccc(I)cc13)CCCC2 1651567785 PDLMCGVPSGACOP-UHFFFAOYSA-N 431.277 4.431 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)c3cccc4ccccc34)cc2F)C[C@H](C)O1 1652347251 INYHOHGFXCRTDX-OALUTQOASA-N 435.543 4.345 10 10 IICE O=C(CN1CCN(C(=O)c2ccc(O)cc2)CC1)Nc1ccc(N=Nc2ccccc2)cc1 1652742416 DQBZPMYBHMHHPI-UHFFFAOYSA-N 443.507 4.204 10 10 IICE C[C@H](NC(=O)NC[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 1671845122 WNRJGZLNBGNVHL-FHWLQOOXSA-N 432.609 4.444 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CCCCCCO)CC2)cc1 1697470063 AIPLWVQMVIGBRC-UHFFFAOYSA-N 441.620 4.214 10 10 IICE CCc1ccc(Cn2c(C(=O)NC(CC)CC)nnc2N(C)Cc2ccccc2O)s1 1708929400 ABGRQVIKAPMMJN-UHFFFAOYSA-N 441.601 4.211 10 10 IICE CO[C@]1(C)CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1711587537 AMYYHOYXOLBKPX-XMMPIXPASA-N 443.661 4.182 10 10 IICE C[C@H]1CCCCN1CCCCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O 1726552964 XNCAYCMERJXSGU-SIKLNZKXSA-N 427.593 4.126 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cncn1 1727043075 CRCAHRSEOKBFOJ-GOSISDBHSA-N 432.576 4.127 10 10 IICE CCC(CC)[C@@H](Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccccc1O)N(C)C 1743992738 DUPVPCVHIHFFNW-JOCHJYFZSA-N 436.604 4.357 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1769637494 JPYNRMMUGYLXNY-QFIPXVFZSA-N 437.588 4.394 10 10 IICE Clc1ccc(-c2nnc(N3CCCOCC3)n2CCCSc2nccs2)cc1 1770685979 KVWWLTCEOYEPOK-UHFFFAOYSA-N 436.006 4.464 10 10 IICE COCC1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CC1 1770930207 FALBRYVQOZZHJQ-UHFFFAOYSA-N 425.621 4.296 10 10 IICE CCOc1cc(N2CCOCC2)c(OCC)cc1NN=NCc1ccc2c(c1)OCO2 1860491492 RESNUHBNOGIPBU-UHFFFAOYSA-N 428.489 4.029 10 10 IICE CCN[C@H](CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1)c1ccc(N(C)C)cc1 2044751577 CBFVATBYBNKEJD-XMMPIXPASA-N 440.632 4.430 10 10 IICE CCc1nn([C@@H](c2ccc(C)cc2O)C(C)(C)C)c(I)c1CN 2079140176 HVGXTGVHEQIUIV-INIZCTEOSA-N 427.330 4.158 10 10 IICE Cc1nn(Cc2cccc(Br)c2O)c(I)c1C1(C)CC1 2079590049 BQNSGGRHEOMKOH-UHFFFAOYSA-N 447.114 4.364 10 10 IICE COc1ccc([C@@H](n2nc(C3CCC3)c(C(N)=O)c2Br)C2(C)CC2)c(O)c1 2080026566 YAHRBUAYZNVHPR-QGZVFWFLSA-N 434.334 4.116 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@@]21CNCc1cc(Br)ccc1O 2089360468 XPTPOBMWCWDEEY-FOIQADDNSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@H](NCc1c(O)cccc1Br)C2 2232271575 SWAPBEOEILJYBN-WRFANHODSA-N 425.367 4.326 10 10 IICE CCOC(=O)COc1ccc(C=C2SC(=S)N(CCCc3ccccc3)C2=O)cc1 2297559829 NDMNMXYBVZSWGE-UHFFFAOYSA-N 441.574 4.463 10 10 IICE Cc1ccc(CNC(=O)C[C@@](C)(NC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380756186 JEYKJYARYLQMAV-HXUWFJFHSA-N 441.366 4.163 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H]2CC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380761831 JLVNDKYROYUHED-UKRRQHHQSA-N 441.366 4.115 10 10 IICE O=C(O)C[C@@H](C(=O)O)N1C(=O)/C(=C/c2c3ccccc3cc3ccccc23)SC1=S 15034704 NRVRHHJXLDQJFI-PGLQMZEQSA-N 437.498 4.122 10 10 IICE Cc1noc(C)c1COc1ccc(C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)cc1 98080325 NOGXFNDKNVPKJK-UHFFFAOYSA-N 445.523 4.434 10 10 IICE COC(=O)c1cc(F)cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1F 478092444 QAPIORXQXYELJG-UHFFFAOYSA-N 441.478 4.111 10 10 IICE CC(=O)Nc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526335762 MTGFQHPIZBVKOY-HSZRJFAPSA-N 430.460 4.422 10 10 IICE C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1cc(Br)cc(F)c1O 756760489 JQUJZUXVKWGQRB-RFAUZJTJSA-N 433.115 4.441 10 10 IICE CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccc(Br)cc1C(F)(F)F 766047404 HIOWFTAWYUPKNZ-UHFFFAOYSA-N 438.221 4.177 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cc1F 768734105 UZYKQEPPYPGZRH-KRWDZBQOSA-N 428.527 4.057 10 10 IICE C[C@@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H](c2ccco2)C1 769932960 RPIWGUJAGYMDSO-RHSMWYFYSA-N 446.550 4.461 10 10 IICE Cc1cc(Br)c(O)c(CN2CCCN(C(=O)c3cccc(Cl)c3)CC2)c1 781901059 LJBSHGGEBGBJGB-UHFFFAOYSA-N 437.765 4.465 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3cc(-c4ccsc4)nn3C)cc2F)C[C@H](C)O1 786189224 FDVNVRLASGFVMD-GJZGRUSLSA-N 443.548 4.223 10 10 IICE C[C@@H](Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1cc(Br)c(F)cc1O 797141903 BXPBZHSPMZOMOI-SECBINFHSA-N 425.229 4.259 10 10 IICE COC[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(Cl)c1F 806150034 JWQTWHYIOGGTJI-HSZRJFAPSA-N 431.983 4.488 10 10 IICE Cc1cc(C(=O)COC(=O)c2csc(-c3cnn(C)c3)n2)c(C)n1-c1ccc(F)cc1 919424922 DJKMKOBDKQXBMB-UHFFFAOYSA-N 438.484 4.130 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@H](C)c3ccc4ccccc4c3)CC2)cc1 1124586035 WCLUVAZIXJOIPF-OAQYLSRUSA-N 431.580 4.280 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccc(Cl)c1 1125325890 RTUXSHNCIQPFEU-SIKLNZKXSA-N 427.976 4.242 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccccc3N3CCOCC3)cc2Cl)C1 1128384074 IYBRQPYGHTYQGH-GOSISDBHSA-N 427.976 4.343 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F 1129661088 FGFBCFDDLGVHBM-WBVHZDCISA-N 438.877 4.404 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1F 1144977814 MQEJMIPZIWCVPT-DEOSSOPVSA-N 445.510 4.039 10 10 IICE CC1(C)CN(C(=O)OCc2ccccc2)[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1160600651 WRWMKCHZWKXRRJ-GOSISDBHSA-N 437.323 4.362 10 10 IICE CCOC(=O)c1ncc(Br)c(N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1 1162195925 XNCOLGALTSNEJQ-UHFFFAOYSA-N 445.292 4.330 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)c4cccc(Cl)c4S3(=O)=O)c2C)cc1 1189320912 HBDVBLSHZVYSQE-UHFFFAOYSA-N 442.924 4.083 10 10 IICE CCc1nc(NC(=O)CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)sc1C 1190934886 PAFZNPDQUNYFOM-UHFFFAOYSA-N 444.601 4.430 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3nc(-c4ccccc4F)cs3)C2)cc1 1248165956 HZBAIGDJPWZYBL-MRXNPFEDSA-N 440.544 4.284 10 10 IICE COC(=O)Nc1ccc(CCNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1265393845 KHLWWDWFPHKTCE-UHFFFAOYSA-N 435.524 4.066 10 10 IICE C[C@H]1CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C[C@@H](C)S1 1291232525 NXVUTMOGDWGTPU-GASCZTMLSA-N 432.644 4.309 10 10 IICE CCOC(=O)C1CCC(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1291886078 ZRNVQUKYMZCTHH-UHFFFAOYSA-N 448.361 4.103 10 10 IICE CC[C@@H]1CCCCN1CCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1293374947 ZLJQEWYQDZHTOI-IFMALSPDSA-N 427.593 4.126 10 10 IICE FC(F)[C@H]1CCCN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)C1 1302950400 SVUXPFHVKPLMQN-GJZGRUSLSA-N 443.589 4.293 10 10 IICE Cc1cc(CC(=O)Nc2ccc(N3CCN(C)CC3)cn2)c(C)n1-c1ccc(Cl)cc1 1306376332 FBPOUVRUJMNGMX-UHFFFAOYSA-N 437.975 4.076 10 10 IICE COCCN(c1nnc(-c2cccnc2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@H](C)C1 1316080425 MECKWSPRELNAIW-YADARESESA-N 448.615 4.404 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@H]2C(=O)Nc3ccc(Br)cc32)cc1 1350863590 BKBODDMOZPXRDE-GOSISDBHSA-N 430.346 4.038 10 10 IICE CC1(C)Cc2cccc(OCC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c2O1 1359864844 FZBXXOCMVYAVLZ-UHFFFAOYSA-N 446.494 4.166 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(C(=O)N4CCCC4)C3)cc2Cl)C1 1436047044 JBDWSARENLJMJQ-ICSRJNTNSA-N 447.023 4.120 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(F)c(I)c2)cc1F 1443769813 IUKBBXYOYBOAMM-UHFFFAOYSA-N 444.263 4.346 10 10 IICE Cc1cc(C(=O)NCc2nnc(C(C)(C)C)s2)c(C)n1-c1ccc(Br)cn1 1446137919 KEFFNGAQZZODIZ-UHFFFAOYSA-N 448.390 4.331 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O 1446795885 BWHYWGYIKYRRRL-COPCDDAFSA-N 434.536 4.047 10 10 IICE COCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1446808514 XPHOISWPVPFTIZ-GHTZIAJQSA-N 442.556 4.412 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)cc1 1450295448 USUWQRLDYJVWDE-UGKGYDQZSA-N 448.454 4.169 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4csc(C)n4)cc3)cc2F)CC1 1456126428 DULCJBYIYWVEAQ-UHFFFAOYSA-N 438.572 4.330 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1c(C)nc2ccc(Br)cn12 1460978727 AGDNLMLBWJJYNV-CQSZACIVSA-N 429.362 4.141 10 10 IICE CCOc1ccccc1CN1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@H](C)C1 1467416837 BWSRCDIYRJQMNV-OAHLLOKOSA-N 426.538 4.058 10 10 IICE Cc1ccc(C(=O)N(CC(=O)N2CCCCCC2)C(C)C)cc1-n1c(C)cc(C=O)c1C 1467880973 RSZZPKGLTGQKKR-UHFFFAOYSA-N 437.584 4.468 10 10 IICE Cc1nnc(N2CCC[C@H](CN3CCCC[C@@H]3C)C2)n1CCCSc1nccs1 1492846357 FPSVYMBHDUWTAM-PKOBYXMFSA-N 434.679 4.316 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1CCCC1CCCC1 1503486897 GQQDHFZRQRQKEQ-UHFFFAOYSA-N 434.544 4.238 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(OC)CCCC1 1512981815 DMZXBQJRHIHCHB-HXUWFJFHSA-N 441.620 4.476 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@](C)(CC)C2)n1Cc1ccc(N(C)C)cc1C 1513345947 MBCGKAQJSGJYRH-VWLOTQADSA-N 440.636 4.246 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)Cc1cnn(C)c1 1516727069 JHDUUCPCCPVKRK-UHFFFAOYSA-N 447.587 4.149 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4c(F)cccc4F)no3)cc2F)C[C@@H](C)O1 1526002546 DZRWNOQDZKJOKK-OKILXGFUSA-N 445.441 4.303 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CSC[C@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1526004332 ZOGPELUQNQFKFU-KJNZLNQQSA-N 428.573 4.202 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1533684241 NQFSNNOPCPPRJX-JLHYYAGUSA-N 444.579 4.105 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N(C)C[C@@H]1CCCCO1 1542228564 NUMXDXQUUVGNCG-QHCPKHFHSA-N 425.621 4.439 10 10 IICE CC1CCN(CCCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)CC1 1544490874 VRHUEYQVJASGMH-UHFFFAOYSA-N 434.588 4.194 10 10 IICE CC(C)(C)Cn1c(O)nc2cccc(C(=O)NCc3cccc(Br)c3O)c21 1556481748 ZUSSJDVTAVNBEU-UHFFFAOYSA-N 432.318 4.186 10 10 IICE COc1ccc2c(c1)CN(C(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)C2 1557207677 VVFQYCVCWKLRDG-UHFFFAOYSA-N 426.314 4.416 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(c2ccc(F)cc2)CCCCC1 1583379488 UBTICJRQVVBHNZ-UHFFFAOYSA-N 432.486 4.459 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)COCCc1ccc(Br)cc1 1584095228 LHKWXTPFUOLHJV-KRWDZBQOSA-N 433.390 4.130 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(C(=O)OC(C)(C)C)nn3C)cc2Cl)C1 1586083269 YIXPAAYFRVICHI-OAHLLOKOSA-N 446.979 4.195 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCS1 1613295205 COIFJOWXDQLEQV-NQIIRXRSSA-N 429.634 4.413 10 10 IICE Cc1cc(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)ccc1N1CCCCC1 1615200849 NUXUZGGGKWJLBK-UHFFFAOYSA-N 442.003 4.362 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C/C=C/c3ccccc3)CC2)c1 1616912730 PSDYOACOGCLVJC-JXMROGBWSA-N 427.548 4.378 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cc(F)ccc2OC(F)F)C1 1623385408 OKRUXQXGUHLUPH-UHFFFAOYSA-N 445.485 4.465 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCCC2)[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1624893126 SROXYZLENWCNEZ-HXUWFJFHSA-N 445.629 4.036 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)nc(C(F)(F)F)c3)cc2F)C[C@H](C)O1 1625090618 VYJPGPVDWFZJIM-RYUDHWBXSA-N 445.844 4.437 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC1(N2CCSCC2)CCCCC1 1627826681 GWNWGASMSAZZAR-UHFFFAOYSA-N 439.625 4.388 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NCc1cc(Cl)ccc1O 1639965098 COFYPNYVQWDKSA-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CCN(C(=O)OC(C)(C)C)C1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1 1640548859 GZILZUPKUGJNNJ-NTMALXAHSA-N 433.505 4.007 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2nc(C3CCOCC3)n[nH]2)cc1 1642400894 ZPFIDTIZXUTUBP-UHFFFAOYSA-N 433.516 4.110 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3nnc(-c4ccccc4[N+](=O)[O-])n3)c2C)c1 1653115092 KSWKNWTYZNMLQZ-UHFFFAOYSA-N 430.468 4.156 10 10 IICE Cc1cc(C(=O)NCC2(OCCO)CCCCC2)c(C)n1-c1cccc(Br)c1 1653208712 AXAXRWAOEUHBCV-UHFFFAOYSA-N 449.389 4.298 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCCC4)C3)cc2F)C[C@@H](C)O1 1653494989 MHDKQSLYHYUYAO-OYRHEFFESA-N 445.623 4.492 10 10 IICE COC(=O)c1ccc([N+](=O)[O-])c(CN(Cc2cccs2)c2ccc3c(c2)OCCO3)c1 1657566746 GSPKTAVOAQOCKD-UHFFFAOYSA-N 440.477 4.421 10 10 IICE C[C@H]1N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCOC1(C)C 1708274178 ZGOJKOMXBOLQLC-QGZVFWFLSA-N 429.584 4.268 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCOC3)n2CCCOC(F)F)c(C)n1-c1ccccc1 1724206462 WADPGCFZHPOHEL-IBGZPJMESA-N 445.514 4.207 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCOC3)n2CCCCCCO)c(C)n1-c1ccccc1 1742118278 YVWMVLAQSUNEGF-QFIPXVFZSA-N 437.588 4.130 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC(F)(F)CO1 1760994063 NUHVDJVYUNTZAX-HXUWFJFHSA-N 433.547 4.137 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC=C(C)C2)n1Cc1ccc(N(CC)CC)cc1 1764140647 FCBOYLPBCXTHIT-UHFFFAOYSA-N 438.620 4.247 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)Cn1c(CC(C)C)nnc1N(C)Cc1ccccc1O 1764672546 UTXMTVAZZMWJMN-GOSISDBHSA-N 445.608 4.464 10 10 IICE Cn1cc(-c2nnc(N3CC[C@@H](C(C)(C)C)C3)n2CCCSc2nccs2)cn1 1769000599 YBXGKOLQFTUWOV-MRXNPFEDSA-N 431.635 4.190 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C[C@@H]1F 1771496338 UUIPQWQECXLUPP-PBHICJAKSA-N 435.569 4.441 10 10 IICE COc1ccccc1-n1c(C)cc(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1C 1874165627 GMQIJZBFUQHEHE-UHFFFAOYSA-N 430.508 4.153 10 10 IICE CC(C)(C)OC(=O)NCCCN(CCC(=O)Nc1ccc(N)cc1)Cc1ccccc1 1999434045 HPXPAUATPBKLFK-UHFFFAOYSA-N 426.561 4.014 10 10 IICE Cc1ccc([C@@H](n2nc(C(F)(F)F)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2079039607 DYQFFTGIQRNDLR-CYBMUJFWSA-N 434.256 4.413 10 10 IICE CCOc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1ccccc1 2297347550 GYIKMVOXMXXNQT-UHFFFAOYSA-N 447.491 4.384 10 10 IICE Cc1ccc(CNC(=O)O[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381142089 INXBAVCXUVWHQG-CQSZACIVSA-N 443.338 4.089 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\c3ccccc3OCCC(=O)O)SC2=S)cc1 16911400 JKNMCOOCJPXKEI-QGOAFFKASA-N 429.519 4.345 10 10 IICE CN(C)c1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)Nc3cccc(F)c3)C2)cc1 65136775 VHRNBFBPQBPRHV-IBGZPJMESA-N 426.536 4.232 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3F)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526202231 ADPXIHWMVJHKNH-JOCHJYFZSA-N 437.423 4.311 10 10 IICE O=[N+]([O-])c1cc(I)ccc1NCc1cccc(Br)c1O 692121177 PPSMIHCUUZNEDP-UHFFFAOYSA-N 449.042 4.280 10 10 IICE CC(=O)NCCCc1ccc(-c2csc(NS(=O)(=O)c3cc(C)sc3C)n2)cc1 731058816 BLAZVSWLLJKVLO-UHFFFAOYSA-N 449.623 4.358 10 10 IICE Cc1cc(Br)c(O)c(CN2CCCC[C@H]2c2nnc(C3CCOCC3)o2)c1 752830150 RDCSJRPMCVILJY-KRWDZBQOSA-N 436.350 4.467 10 10 IICE O=C(N[C@H]1CCCc2cn(C3CCCC3)nc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 764764597 ZRYVUPHFOWVFRQ-VXKWHMMOSA-N 438.572 4.472 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)CSC1CCN(C(=O)OC(C)(C)C)CC1 778607526 WHEDPGIMBRCKEX-UHFFFAOYSA-N 435.634 4.234 10 10 IICE O=S(=O)(Cc1c(Cl)cccc1Cl)NCc1cc(Br)ccc1O 796190952 NZJZWJBVNVIUGE-UHFFFAOYSA-N 425.131 4.081 10 10 IICE O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)N(Cc1ccco1)Cc1ccccc1O 812445186 TZMGMXNVFMDNTD-UHFFFAOYSA-N 434.452 4.329 10 10 IICE CC(C)Cn1cc([C@H]2N(Cc3cccc(Br)c3O)CC23CCOCC3)cn1 849477976 CUHHUEPHGHITBK-HXUWFJFHSA-N 434.378 4.361 10 10 IICE Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C(=O)N(C)C(=O)N(c3ccccc3)C2=O)o1 1084485932 NLECJNRAPKMNMA-CPNJWEJPSA-N 431.404 4.172 10 10 IICE O=C1NC(=S)N(c2ccccc2F)C(=O)/C1=C\c1ccc(OCc2ccccc2)cc1 1084640567 LKCVRKPALNDONP-RGEXLXHISA-N 432.476 4.236 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C 1129820245 SEUCWJZAZJRXSP-CVDCTZTESA-N 439.600 4.449 10 10 IICE O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCCCSc1nccs1 1136661973 WTBIDIHSNNFXDF-UHFFFAOYSA-N 434.465 4.171 10 10 IICE C[C@H](NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]([C@H]2CCCO2)C1)c1ccc(N(C)C)cc1 1154667993 BBJRLHMNPOCSGJ-OZROYSPXSA-N 445.604 4.125 10 10 IICE COc1ccccc1[C@@](N)(C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)C(F)(F)F 1160645355 JGNKZZQHKYMKBU-HSZRJFAPSA-N 449.517 4.497 10 10 IICE COc1ccc(N2CCN(CC[S@@](=O)c3cc(Cl)ccc3Cl)CC2)cc1F 1168067788 KVQSPGDMUIHRMO-HHHXNRCGSA-N 431.360 4.071 10 10 IICE Cc1ccc(C(=O)N2CCN(c3cc(Cl)ccn3)CC2)cc1-n1c(C)cc(C=O)c1C 1178348589 ANFXDJYTMIWNBM-UHFFFAOYSA-N 436.943 4.226 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3c([N+](=O)[O-])cnc(C)c3C)c2C)cc1 1189505190 UWKPGTWDVIWZML-UHFFFAOYSA-N 437.452 4.062 10 10 IICE O=C(NCCN(Cc1ccccc1)c1ccccn1)NCc1c(O)ccc2c1CCCC2 1248458269 MLJNWFRSLWDQIT-UHFFFAOYSA-N 430.552 4.172 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)cc1 1264452339 KLQRRMGDRKBSTN-UHFFFAOYSA-N 440.475 4.302 10 10 IICE C[S@](=O)(=NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccc1 1289018870 JOALZNWTVBSKCO-FKQKNJHDSA-N 448.566 4.101 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)cc1C 1305463541 NQBJTYNVSXUOQQ-GCJKJVERSA-N 434.588 4.267 10 10 IICE Cc1cc(C(=O)CSc2nc3sccc3c(=O)n2C)c(C)n1-c1ccc(Cl)cn1 1307265295 BKWTVYJSQKYHEJ-UHFFFAOYSA-N 444.969 4.426 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1314480271 SUEYCMKOGDWBAV-SFHVURJKSA-N 425.602 4.331 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)CC2)cc1 1356445297 INEAQJFYKSCRLJ-DEOSSOPVSA-N 438.474 4.442 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4ccnc(Cl)c4s3)cc2F)CC1 1360094122 RDPGUSDYBGMIOC-UHFFFAOYSA-N 432.952 4.161 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCC[C@H](C(F)F)C1 1361098368 SQKOBPUZDQTIGD-IBGZPJMESA-N 440.542 4.168 10 10 IICE COc1ccc(N2CCN(Cc3ccc(Br)c(Cl)c3)CC2)c(OC)c1 1460651816 PGFACSXBXXWQBR-UHFFFAOYSA-N 425.754 4.442 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1 1469518678 PGBCDHJPLBFPJA-DFBJGRDBSA-N 446.636 4.328 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@@H]2C[C@@H](N3CCOCC3)C2(C)C)cc1 1469715232 HPPPNOZUNYXLOS-DHIUTWEWSA-N 435.572 4.397 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCn1cccn1)OC 1513446072 XVGJBHQQJPSQDY-JOCHJYFZSA-N 447.587 4.111 10 10 IICE CCC[C@@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1514372780 FHAJBTVNFFQYPR-OAQYLSRUSA-N 429.634 4.008 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@@H](C)N(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1514491945 GPTXHVAAISGOMI-DENIHFKCSA-N 440.636 4.002 10 10 IICE CCO[C@]1(c2nnc(N3CCCCCC3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1516207796 NQKLIOLSTBHYKD-RUZDIDTESA-N 441.620 4.205 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCOCC1 1517767441 ZAYMBAFFDOZXLX-LJQANCHMSA-N 437.588 4.250 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC=C(c2ccco2)C1 1521076951 ZMELVPTXGCQUAA-CPNJWEJPSA-N 442.537 4.326 10 10 IICE CNC(=O)c1ccc(Cl)cc1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1526093567 XIPWOPZOICZDDL-UHFFFAOYSA-N 425.916 4.180 10 10 IICE CC1(C2CC2)CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC1 1527591660 GIDVVRRXNMSMQR-JXAWBTAJSA-N 432.586 4.456 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H]([C@H]2CCOC2)C1 1542226949 NPMYXCOQRNGHLV-RTWAWAEBSA-N 425.621 4.152 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H](Cc1ccccn1)NC(=O)OC(C)(C)C 1556367185 WQUNLDSESAHECQ-HXUWFJFHSA-N 427.545 4.052 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC(O)(c3nccn3C)CC2)cc1 1558180368 MENKGXQZKJQCAZ-UHFFFAOYSA-N 432.528 4.025 10 10 IICE Cc1ccccc1Nc1scnc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1570168101 LGZQUDJOMXAXHS-UHFFFAOYSA-N 444.507 4.240 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CCO[C@H]1c1cncc(Br)c1 1570581759 IGRMGTQQAMFLLR-RTWAWAEBSA-N 444.373 4.228 10 10 IICE Cc1ccc([C@@H](O)[C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1570715647 PUCUJYIOISAMCO-VFNWGFHPSA-N 442.357 4.412 10 10 IICE Cc1ccc(C(=O)NCC[C@@H]2CCc3ccccc3N2C(=O)OC(C)(C)C)c(O)c1O 1583686983 SGOBPQJXBPQYJP-KRWDZBQOSA-N 426.513 4.283 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c(C)nc(C(C)(C)C)nc3SC)C2)cc1 1585665936 XBZJUFUKAICHCI-MRXNPFEDSA-N 428.602 4.069 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1 1595427312 SSMMPEUCUIHBSD-UQBPGWFLSA-N 429.564 4.228 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](O)c3cccc(Br)c3)c2C)cc1 1617387331 GGWDQTVJDCWACK-OAQYLSRUSA-N 443.341 4.329 10 10 IICE Cc1ccc(-c2nc(C)sc2CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1618635726 MTICNMSVPYBMLF-JOCHJYFZSA-N 436.625 4.455 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](O)c1ccc(Cl)c(Cl)c1 1622635234 UQTSUKNYGHJHRF-KXBFYZLASA-N 443.758 4.167 10 10 IICE CCCCOc1ccc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)cc1OC 1623928297 LAYRUKCNQCPYRA-UHFFFAOYSA-N 435.904 4.049 10 10 IICE COc1ccc(CN2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)cc1F 1624367780 MGQODELHAQRLIE-UHFFFAOYSA-N 439.506 4.339 10 10 IICE Cc1cc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)c(C)n1-c1ccc(Br)cc1 1624440909 LQXPXBWMRLCIBU-QFIPXVFZSA-N 430.390 4.415 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CSC[C@H]1c1ccccc1 1630263248 VCCRDECJXKMKMY-PCCBWWKXSA-N 431.001 4.273 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1Cl)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1634535303 IHHHUDROOZBQSX-FQEVSTJZSA-N 425.916 4.047 10 10 IICE CCCCNc1nc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cs1 1635945815 BJGXQXBWDVRJFS-QGZVFWFLSA-N 437.009 4.037 10 10 IICE COc1cccc([S@](=O)CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1639535233 YNTSIUVMVTUHFF-GUNSETOZSA-N 434.989 4.009 10 10 IICE Cc1cc2nc(Cl)cc(NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)n2n1 1639876927 PPCYDKMVHKUYOQ-KRWDZBQOSA-N 444.967 4.435 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C)N(CC(F)(F)F)[C@H](C)C3)ccc21 1640097082 PVGJCUMIRZPOTB-GASCZTMLSA-N 425.495 4.002 10 10 IICE Cc1cccc(-n2c(S)nc3cc(C(=O)N[C@@H](C)c4ccccc4O)ccc3c2=O)c1C 1643742233 UWJLMWKKGSIHFU-INIZCTEOSA-N 445.544 4.488 10 10 IICE CCOC(=O)[C@H](c1cccnc1)N(C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1644580593 KMXYMXQTRKRDMC-QHCPKHFHSA-N 439.943 4.448 10 10 IICE Cc1cc(C(=O)NCc2cc(=O)n(-c3ccccc3)n2C)c(C)n1-c1cccc(Cl)c1 1646067384 JRGWSXPMEAOQBZ-UHFFFAOYSA-N 434.927 4.167 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCN1CCN(c2ccccc2)CC1 1651360214 UQDJTPNZKXCHFC-UHFFFAOYSA-N 430.508 4.060 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(C)c3cccc4ccccc34)cc2F)C[C@@H](C)O1 1652347252 INYHOHGFXCRTDX-RTBURBONSA-N 435.543 4.345 10 10 IICE CC(C)N(C)CCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1692470649 XASUMUMACHCLAH-IFMALSPDSA-N 443.636 4.269 10 10 IICE CC(C)c1nnc(N2CCC(N3CCCCC3)CC2)n1CCCSc1nccs1 1706298085 MSDZTYFPJASRMK-UHFFFAOYSA-N 434.679 4.495 10 10 IICE C[C@H]1CCC[C@@H](N(C)c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)C1 1726527729 XPFAZXMZZCWOID-DLBZAZTESA-N 448.662 4.054 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@H]1OCCC1(C)C 1747755191 ZKEDTZQOSHDMRU-HLAWJBBLSA-N 442.604 4.354 10 10 IICE Oc1cc(Br)ccc1CN[C@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878724094 XVONLBODLYHWEK-IRXDYDNUSA-N 429.280 4.307 10 10 IICE CC(C)CNCc1ccc(N(C)C[C@@H](O)COCc2ccccc2)c(Br)c1 1916394360 MZEKMGZALNGMLR-HXUWFJFHSA-N 435.406 4.209 10 10 IICE O=C(OCc1ccccc1)N1C[C@@H](NCc2cc(Br)ccc2O)C2(CCC2)C1 2028690209 RTENXUHGEBSXFD-HXUWFJFHSA-N 445.357 4.436 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C=Cc3c(Cl)nc4sccn34)cc2F)C[C@@H](C)O1 2041588374 KAVYDEKLLYAIHM-OKILXGFUSA-N 448.951 4.132 10 10 IICE CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CCN1C(=O)[C@H](C)SC1=S 11635974 VSAYTGQSBBJRHX-LBPRGKRZSA-N 448.591 4.169 10 10 IICE COCc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)o1 16197686 NKQUAENFPIVZEW-UHFFFAOYSA-N 433.407 4.475 10 10 IICE COc1ccc(N2CCN(c3ncc4c(n3)CCN(Cc3cccc(Cl)c3)C4)CC2)cc1 21640103 UHIJPOOOPCAKNN-UHFFFAOYSA-N 449.986 4.024 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccc(OCC)cc1)C[C@H](c1ccccc1O)N2 65297908 OUBNMWSWVYDQIG-JOCHJYFZSA-N 437.540 4.263 10 10 IICE biogenic COc1cccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3Br)C2=O)c1 83295120 LUHZVYHTXXUWRM-XNTDXEJSSA-N 449.351 4.004 10 10 IICE O=C1C(O)=C(c2ccc(F)cc2)[C@@H](c2ccc(O)c(O)c2)N1c1ccc2c(c1)OCCO2 526158088 DHTQJRJGRFDLTH-JOCHJYFZSA-N 435.407 4.065 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(NC(C)=O)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526332994 LLELNFMDZPCTFE-HSZRJFAPSA-N 446.459 4.122 10 10 IICE CC[C@H](NC[C@@H]1CN(C)CCN1Cc1ccccc1)c1cc(Br)ccc1O 694741858 MBMMFESSCDTUHC-CTNGQTDRSA-N 432.406 4.012 10 10 IICE COc1ccc(N2C(=O)/C(=C/c3cc(OC)c4c(c3)OCCO4)SC2=S)cc1F 726630154 UACWZCFCHUUTRO-MFOYZWKCSA-N 433.482 4.020 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N(CC(=O)OCC)c1ccc(F)cn1 744369248 RCQUTRHVFSLAFU-XFXZXTDPSA-N 437.471 4.167 10 10 IICE COc1ccc(N2CCN(CCNC(=O)Nc3cccc(C(F)F)c3Cl)CC2)cc1 758220970 UROWIWNEYDYGCR-UHFFFAOYSA-N 438.906 4.230 10 10 IICE Fc1cccc(-c2noc([C@H]3CCCN(Cc4ccc(N5CCOCC5)c(F)c4)C3)n2)c1 769234509 UAOFOUSSFIXSJH-IBGZPJMESA-N 440.494 4.231 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nc4ccccc4oc3=O)cc2Cl)C1 800050026 LZLRJNQXRUSZRT-MRXNPFEDSA-N 439.943 4.327 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@]4(CCOC4)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802695026 PDUMUQRFGAFBLB-BKMJKUGQSA-N 447.583 4.148 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3[C@H]2O)c(C)n1-c1ccc(Br)cc1 1141668764 MASGYPJRFFGMGB-TZIWHRDSSA-N 441.325 4.081 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cn(-c2cccc(Cl)c2)nn1 1149901152 VRMHIHASRPINOB-UHFFFAOYSA-N 435.709 4.051 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CC(c4ccc(Cl)cc4Cl)=NO3)C2)cc1 1162718788 QQAUQAZMMUAFNS-QKKBWIMNSA-N 448.350 4.138 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1180410830 RIIHEYVKYTZWIJ-UZRURVBFSA-N 433.335 4.410 10 10 IICE CCC[C@@]1(CO)CCCN1CC(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OCC 1193962640 HAPPLCCCINWTFT-DEOSSOPVSA-N 444.597 4.466 10 10 IICE C[C@H](NC(=O)N[C@@H](CCO)c1cccc(OC(F)(F)F)c1)c1ccc(N(C)C)cc1 1226646582 CAFXOMMYBHALFB-LIRRHRJNSA-N 425.451 4.135 10 10 IICE COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)CC2 1230199249 ALBMXJIVKNPPQX-MSOLQXFVSA-N 425.573 4.338 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)cc1 1252041015 BCCMJECUMCXFOD-WIYYLYMNSA-N 432.609 4.462 10 10 IICE CC(C)[C@@H]1N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC12CCCCCC2 1313304946 NDEHNFDOICPMSV-QHCPKHFHSA-N 440.632 4.279 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC[C@@H]3CCC4(CCOCC4)CO3)ccc21 1439216817 QSYCFXLASPKYHC-NRFANRHFSA-N 428.573 4.000 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc([C@H]3CCCCN3C(=O)OC(C)(C)C)n2C)cc1 1440648915 UGJSLXUPSUPBPG-OAQYLSRUSA-N 440.588 4.483 10 10 IICE Cc1nc(C)n(Cc2cccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)c2)n1 1445224182 XMHMQGBIEAKMOA-UHFFFAOYSA-N 427.508 4.416 10 10 IICE COc1ccc(N2CCCN(CC(=O)N[C@@H](c3ccc(F)cc3)C3CCCC3)CC2)cc1 1459349979 LLYRHNQRDVZLHO-AREMUKBSSA-N 439.575 4.394 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(CN3CCN(C)CC3)c2)c1 1464784998 KXPXQXJYLNPGPI-UHFFFAOYSA-N 430.596 4.080 10 10 IICE COc1ccc(Cl)cc1[C@@H](O)CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1468017157 KEJVWQCMHRNPHQ-NRFANRHFSA-N 426.900 4.032 10 10 IICE COC(=O)c1cc(Br)cc(C(=O)NCc2ccc(N3CCCCC3)cc2)c1 1469302096 HIYPUPKSACSRQR-UHFFFAOYSA-N 431.330 4.156 10 10 IICE CCOC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1471779850 AGSSVVASAWFBDB-GMAHTHKFSA-N 426.557 4.448 10 10 IICE CCCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)Cc1ccc(F)cc1 1473127503 QEMJIDZHIVAJBW-RTBURBONSA-N 445.554 4.107 10 10 IICE COCCN(Cc1ccc(Br)cc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 1473227813 LWAOEYQKCNCUAS-UHFFFAOYSA-N 425.279 4.028 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1 1504793310 NKPBCJYHPZGRMJ-BGYRXZFFSA-N 437.588 4.393 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)C1 1505221478 YSGUSBJVNQIATK-HOTGVXAUSA-N 439.676 4.143 10 10 IICE CO[C@@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1517828237 JYMVKKDXOUARGX-SFHVURJKSA-N 429.952 4.397 10 10 IICE O=C(/C=C/c1cnc2ccccc2n1)N1CCOc2c(Cl)cc(Br)cc21 1524598281 ZOKQVVRENNVAJA-AATRIKPKSA-N 430.689 4.485 10 10 IICE Cc1nc(-c2ccccc2F)sc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1527864919 YGKIOOXACPPYIH-UHFFFAOYSA-N 447.482 4.302 10 10 IICE CC(C)n1cc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1529076466 BHDCDQBVBQACMR-FNHQQPGVSA-N 446.573 4.072 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2[C@H](C)CC[C@@H]2C(=O)OC(C)(C)C)CCCC1 1538379401 CXNAATTUMLFLJO-OPAMFIHVSA-N 426.557 4.250 10 10 IICE CSc1cc(Br)ccc1C(=O)Nc1cccc(N2CCN(C(C)=O)CC2)c1 1538714431 JOUXKPJDXWSNHF-UHFFFAOYSA-N 448.386 4.092 10 10 IICE C[C@@H](CN1CCCC1)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1541873064 JDAAIWABZOXIQV-SFHVURJKSA-N 425.602 4.004 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H](O)c2ccccc2C(F)(F)F)cc1 1542490643 UHAZKEBKFALXRO-WIYYLYMNSA-N 436.474 4.013 10 10 IICE Cc1cc(C(=O)NCC2(C(=O)N(C)C)CCCC2)c(C)n1-c1cccc(Br)c1 1543405594 AEWASIKHGMYLCG-UHFFFAOYSA-N 446.389 4.235 10 10 IICE CCO[C@H]1C[C@@](CO)(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1556221455 GLBCVLKFBBTPCA-UGKGYDQZSA-N 449.389 4.153 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C(=O)NCC(F)(F)F)C2)c(C)n1-c1cccc(C(C)C)c1 1556288615 BNVQTZJSIKFTJJ-SFHVURJKSA-N 435.490 4.358 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2cc(F)cc(Cl)c2)cc1 1556455495 MSUJLLHJTWOVTI-QFIPXVFZSA-N 428.891 4.091 10 10 IICE O=C(CSCc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1559394150 SEYNJVNDWBIIIV-UHFFFAOYSA-N 432.457 4.242 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccccc2)c(C)n1-c1cccc(Br)c1 1568780122 MWYIGWULQLGAMY-HXUWFJFHSA-N 427.342 4.190 10 10 IICE C[C@@H]1CN(c2ccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)cn2)C[C@@H](C)O1 1583699376 JCCWHBGNJKSDHU-WOJBJXKFSA-N 436.600 4.394 10 10 IICE Nc1ccc(Br)cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1584356821 RRCWSYCBJDQNFZ-UHFFFAOYSA-N 440.288 4.032 10 10 IICE CC(C)N(C)CCCn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1607895380 PTNKHEADZKAAHX-UHFFFAOYSA-N 435.620 4.240 10 10 IICE Cc1nnc(N(Cc2cccs2)C[C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1612547723 UYIUGWWEHVULBH-GOSISDBHSA-N 429.565 4.087 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCNc3ccc(-c4ccccc4)nn3)c2C)cc1 1629643924 HWLGAKLNRMGGIG-UHFFFAOYSA-N 441.535 4.402 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1cc([N+](=O)[O-])ccc1F 1632692345 SPQULFDWXZHDLS-UHFFFAOYSA-N 448.498 4.351 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(F)cc2NC(=O)OC(C)(C)C)N(C)C)cc1 1640235735 LYWOKEDDXSUVRQ-OAQYLSRUSA-N 444.551 4.271 10 10 IICE CC(C)(C)OC(=O)Nc1ccccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1642297938 XTCHJIIXJAWKBQ-UHFFFAOYSA-N 447.482 4.078 10 10 IICE CCCCN(CC(=O)N=c1cc[nH]n1Cc1ccc(C(C)C)cc1)Cc1ccccc1O 1642886377 IJNVHUCIROUPDI-UHFFFAOYSA-N 434.584 4.423 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCCNC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1647746250 OXGMECWMYZOUCP-UHFFFAOYSA-N 444.535 4.065 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)NCc2cnn(-c3ccccc3)c2)cc1 1653680258 RFIOYUAEESFFDH-UHFFFAOYSA-N 440.547 4.246 10 10 IICE COc1ccc(N(C)CCN(C)[C@H](C)C(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1 1659280419 FHZXSCFQFITGDL-MRXNPFEDSA-N 442.560 4.353 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@@]3(C)[C@@H](C2)C3(Br)Br)c1O 1659400725 GTYUAZSMPHTLKA-HIFRSBDPSA-N 435.131 4.062 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)OCC(F)(F)F)sc(C)c1-c1ccccc1 1659810346 AAQOPEXDZHZZBQ-UHFFFAOYSA-N 430.448 4.264 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCN(c4cc(Cl)ccc4Cl)CC3)C2)cc1 1683782447 OEBFNQDUQPMRDO-KRWDZBQOSA-N 449.382 4.113 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(O)Cc2cc(Cl)cc(Cl)c2)N(C)C)cc1 1687806359 FGDDSVYQZBXHKZ-LJQANCHMSA-N 425.360 4.263 10 10 IICE CN(CCOC(C)(C)C)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1696828764 AMOPDIOIPMYHAM-UHFFFAOYSA-N 434.635 4.174 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](c1ccco1)N(C)C 1698263430 BVXPWWPJNFNMNN-OAQYLSRUSA-N 434.544 4.246 10 10 IICE C=CCN(CCOC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1705881079 AEQSNKBKQJKZEU-UHFFFAOYSA-N 425.621 4.499 10 10 IICE CC/C=C\Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1709399082 DEWXTCBAZWADHY-PLNGDYQASA-N 437.613 4.370 10 10 IICE COC[C@H]1CCN(c2nnc(-c3ccccc3C)n2CCCSc2nccs2)C1 1712263991 KVWZHXDVGSBZAV-KRWDZBQOSA-N 429.615 4.365 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1COCCO1 1746011634 BPANUXHKUWDQQN-QFIPXVFZSA-N 437.588 4.250 10 10 IICE CCN(CC1CCC1)c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1746271397 IEASMKXAQPRXJM-UHFFFAOYSA-N 439.648 4.360 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)C[C@@H]2CC=CCC2)cc1F 1768496986 VTNMKVYRGCXVRJ-LJQANCHMSA-N 434.563 4.310 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@H](C1)[C@@H]2CNCc1cc(Cl)cc(Br)c1O 2138818904 RVNRBXLHYHGIGT-KFWWJZLASA-N 445.785 4.401 10 10 IICE COc1ccccc1OCCCOc1ccc(C=C2SC(=S)N(C)C2=O)cc1OC 2297347782 SNRBKDBJZXJHBA-UHFFFAOYSA-N 445.562 4.383 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2F)SC1=S)Nc1ccc(C(=O)O)cc1 2314831005 AHLKYUYHCGLQFM-UHFFFAOYSA-N 444.509 4.144 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCCC(=O)O 2314935747 RZNIYAMNWVOPSC-UHFFFAOYSA-N 447.509 4.484 10 10 IICE Cc1ccc(CN[C@@H]2CCC3(CC3)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352684252 PKONDGZOBWLNNG-OAHLLOKOSA-N 425.367 4.485 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2380740646 YEYJULYZNIPIBQ-AWEZNQCLSA-N 441.366 4.115 10 10 IICE C[C@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S 15047225 BUEMKPCHLLCCSF-FFCYNSPCSA-N 446.937 4.267 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCNC(=O)Nc3cccc(Cl)c3)C2=O)c1 62050149 CFYBZCFVCURFAQ-GZTJUZNOSA-N 447.969 4.372 10 10 IICE CCOc1cccc([C@H]2CC(c3ccc(C)cc3C)=NC3(CCN(C(C)=O)CC3)N2)c1O 65298449 LVNJRDJTCZCHKB-HSZRJFAPSA-N 435.568 4.270 10 10 IICE biogenic O=C(CCc1ncc(-c2ccc(F)cc2)o1)NCc1ccc(N2CCSCC2)cc1 108196704 PSTQOLFAONOBCB-UHFFFAOYSA-N 425.529 4.283 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(F)cc3OCC(F)(F)F)CC2)cc1 303507678 BQWMQYMMQVDSMF-UHFFFAOYSA-N 427.398 4.130 10 10 IICE CCN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1ccccc1Cl 586225486 DSZFIHKLDIADOK-UHFFFAOYSA-N 425.893 4.331 10 10 IICE COc1cccc2c1OCC[C@@H]2NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 683441746 FVSCIDPQOQNJRH-NRFANRHFSA-N 433.552 4.056 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@]2(NCc2cc(Br)cc(F)c2O)C1 715736276 HFSOPBPCPHTCNY-YJYMSZOUSA-N 429.330 4.173 10 10 IICE C[C@H](Cc1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742754899 RNCSEKCGQQEYKW-XMSQKQJNSA-N 425.573 4.313 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(C(=O)c3cc(C)n(-c4ccccc4Br)c3C)[C@H]2C1 755203425 PEHUOXSUEVCMPZ-TYCQWZJGSA-N 447.373 4.265 10 10 IICE CNC(=O)c1cccc(OCC(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 758832265 LAUZAXKYWXCRQC-UHFFFAOYSA-N 446.463 4.022 10 10 IICE CS(=O)(=O)c1ccc(-c2nc(CN3CCCc4cc(OC(F)F)ccc43)co2)cc1 761672913 OJEPBYBWUGRRHO-UHFFFAOYSA-N 434.464 4.299 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@]1(C)CCCN1C(=O)c1ccccc1 769298142 QQBAHQLOYMWUSF-QFIPXVFZSA-N 445.357 4.198 10 10 IICE O=S1(=O)CCN(c2ccc(CN[C@@H](Cc3ccc(F)cc3)c3ccccc3)cc2)CC1 774184051 AMZJEUSSRXVYFY-VWLOTQADSA-N 438.568 4.134 10 10 IICE O=S(=O)(Nc1nc(-c2ccc(-n3cccn3)cc2)cs1)c1ccc2ncsc2c1 775159744 OWGFVVVQWZHTDO-UHFFFAOYSA-N 439.547 4.406 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CO[C@@H]3CCCc4ccccc43)cc2F)C[C@@H](C)O1 797436808 PHRYRZBYVKDTDJ-NXMSCROESA-N 426.532 4.150 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc([C@@H]2COCCO2)n1Cc1ccccc1 802140746 RDXJMUXPKRTYBQ-DEOSSOPVSA-N 447.583 4.041 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)NCc2cc(Br)ccc2O)c1 804736252 ONIJGPRXISUYOF-IBGZPJMESA-N 445.357 4.083 10 10 IICE C[C@@H](N[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2)c1ccc(N2CCOCC2)c(F)c1 813878123 CAAAUZSXLZEDON-UTKZUKDTSA-N 433.568 4.103 10 10 IICE CCN(C)Cc1cc(O[C@@H]2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)C2)ccn1 856642897 UKJFLXVHGDZFGE-RUZDIDTESA-N 432.568 4.234 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCSc3ccc(C)c(C)c3)cc2F)CC1 1125907909 ORDSNPRTIJYSJE-UHFFFAOYSA-N 429.605 4.383 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1([C@@H]2CCCCO2)CCC1 1132710817 JTJPZUIXVZOWRQ-UMADGWCESA-N 448.585 4.025 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(Cl)c(F)cc1Br 1136397261 ZKSPAXFRZGOQKZ-UHFFFAOYSA-N 427.701 4.008 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 1136442883 IRTREAXGGQJULA-HXUWFJFHSA-N 445.563 4.163 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1 1137400085 MLAOWMLTNCQVRF-FQEVSTJZSA-N 432.442 4.283 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(Cl)cc4)c3CC)CC2)cc1 1137658707 SRZDBDKUEGJXTE-UHFFFAOYSA-N 438.959 4.449 10 10 IICE Cc1cc(C(=O)N2CCCc3c(cnn3C)C2)c(C)n1-c1ccc(Br)cc1 1142165619 GUONZFYBNIEOIC-UHFFFAOYSA-N 427.346 4.179 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc2c(c1)ncn2-c1cccc(C)c1 1142690078 HFYANZFGQGLQPW-UHFFFAOYSA-N 443.503 4.245 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCC(=O)c1cc(Cl)sc1Cl 1142691231 XNQXRUYDYXZXIS-UHFFFAOYSA-N 444.336 4.315 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@H](OC(C)(C)C)[C@@H]1n1cccn1 1158288830 OWZAIBIXHJXDMR-AKIFATBCSA-N 434.540 4.030 10 10 IICE COc1c(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cnn1C 1160645153 FLIKKHVRXDAXLM-GOSISDBHSA-N 432.446 4.354 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc(Cl)c(I)c2)cc1 1162568969 TUXOKXDZCMVDPP-UHFFFAOYSA-N 428.617 4.359 10 10 IICE Cc1csc(CC2(O)CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)n1 1166299920 PQALDWNKDJICHV-UHFFFAOYSA-N 427.545 4.208 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N1CCC(CC)(NC(=O)OC(C)(C)C)CC1 1248125652 FSYLVXBVKPJONC-UHFFFAOYSA-N 432.609 4.464 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(-c4ccc(Cl)cc4Cl)on3)cc2)CC1 1288334851 RZLZXCONXSNBEW-UHFFFAOYSA-N 445.350 4.330 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1299538092 IFYHHKVFIGYKSR-ROUUACIJSA-N 425.602 4.329 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)Cc2nnc3n2CCC[C@H]3C(F)(F)F)cc1 1303522635 OUSYOQXHNJETFN-GOSISDBHSA-N 431.462 4.398 10 10 IICE CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCc1c(O)cccc1F 1303879297 WQGRXGSTZFADKV-MRXNPFEDSA-N 445.343 4.006 10 10 IICE CCc1nnc(N(C)CCc2cccs2)n1Cc1ccc(N2CCSCC2)cc1 1306087729 ULTRHNFJBFZZTR-UHFFFAOYSA-N 427.643 4.182 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(Cc3ccc(N4CCOCC4)cc3)CC2)C1 1307922775 AOOLQAAKIFUDHH-HSZRJFAPSA-N 443.632 4.382 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H]3C[C@H]32)c(C)n1-c1ccccc1 1313099198 BSBPFVBVCOYWSC-YADHBBJMSA-N 438.572 4.040 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(Br)c3F)cc2F)C[C@H](C)O1 1357835115 CRHXZAFSFKIJDM-STQMWFEESA-N 439.300 4.271 10 10 IICE CCc1ccccc1-n1cc(O)c(C(=O)N(CC)Cc2cc(Br)ccc2O)n1 1445655863 MTMGRIXJPZLALL-UHFFFAOYSA-N 444.329 4.271 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)nn(-c4ccc(F)cc4)c3Cl)CC2)cc1F 1445844879 PBKUNPQUIVUTKA-UHFFFAOYSA-N 446.885 4.083 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1450410414 MGCIEVVMQGCNAB-FUHWJXTLSA-N 429.521 4.101 10 10 IICE Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NCc3ccc4cccnc4c3O)cc2)cc1 1451954521 MBKFXLJVRDLHCJ-UHFFFAOYSA-N 446.528 4.153 10 10 IICE CCN(CCOc1ccc(C(=O)OC)cc1Cl)Cc1cc(Br)ccc1O 1459573470 NSARBKYLCLZWID-UHFFFAOYSA-N 442.737 4.496 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cnn(Cc2ccccc2)c1Br 1465845611 FFVLEORUNUTIKR-UHFFFAOYSA-N 428.330 4.452 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4C)c3C(F)F)CC2)cc1F 1465930557 WKGFNAQSYFUVCV-UHFFFAOYSA-N 444.457 4.228 10 10 IICE CN1CCC[C@@H](c2cccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)C1 1472521097 LQECSDPLKLTBDQ-NHCUHLMSSA-N 443.538 4.496 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3ccc(Br)c(C)c3)CC2)cc1 1478786650 MHBNJRNYCDSCKJ-UHFFFAOYSA-N 432.362 4.188 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1478956806 JANWONJCSNLMEY-QFIPXVFZSA-N 432.568 4.223 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1495431780 FYIHPTVBCDYJQI-RBBKRZOGSA-N 449.647 4.489 10 10 IICE CN(CCC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1503581085 IADLZTDXWCXSOD-UHFFFAOYSA-N 425.621 4.069 10 10 IICE Cc1ccc(-c2nnc(N3CCSC(C)(C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1510828739 DXKUWWIFGXGYPZ-UHFFFAOYSA-N 429.565 4.432 10 10 IICE CC[C@H](C)c1nnc(N(C)C[C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1512823904 ZREZYQMMUNGUAL-UGKGYDQZSA-N 443.661 4.398 10 10 IICE CC[C@@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1513469286 UQFPQQBFGJSFOU-SFHVURJKSA-N 429.565 4.191 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)COc2cccc3c2OC(C)(C)C3)cc1 1520969444 GOYQYVPAHVSGAP-UHFFFAOYSA-N 436.474 4.436 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C[C@@H]3CCCN(C(=O)NCC(C)C)C3)c2C)c1 1531612955 YUSUWHNAKBNPKR-QFIPXVFZSA-N 438.616 4.486 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@@H]1C(=O)Nc2c(Br)cccc21 1531706977 YPBDNUIOWCTWIP-SFHVURJKSA-N 442.357 4.134 10 10 IICE Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1536924679 KZHMJIZFJBVBQX-UHFFFAOYSA-N 442.922 4.124 10 10 IICE CCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1cccc(Cl)c1 1539236359 SKYTYBKCENVRFQ-HSZRJFAPSA-N 439.991 4.187 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCN(Cc2ccc(-c3cccc(Cl)c3)s2)CC1 1543466275 GWNUFTALZSVRTK-UHFFFAOYSA-N 442.968 4.367 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)N(C)Cc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1544488443 JAJAWUMGYUEABL-UHFFFAOYSA-N 448.542 4.243 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2cccc(F)c2)c(C)n1-c1ccccc1Br 1545584906 KHZLSRKFQMFDTD-FQEVSTJZSA-N 431.305 4.459 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)cc1 1557355665 ICIGLDYWUSDLOQ-QFIPXVFZSA-N 445.991 4.088 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H]2CCCC[C@@H]2OC)sc(C)c1-c1ccccc1 1559785055 NPTKKQSVCALKHB-ROUUACIJSA-N 430.570 4.386 10 10 IICE C[C@@H](NC(=O)N(C)C[C@@H](O)COc1cc(Cl)cc(Cl)c1)c1ccc(N(C)C)cc1 1564597375 LNPPIXDUVKUWBA-AUUYWEPGSA-N 440.371 4.202 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3cccc(F)c3)CC2)N(C)C)cc1 1565453069 RBSQXPWLFCYNLR-DEOSSOPVSA-N 426.580 4.159 10 10 IICE Cc1cc(CC(=O)N[C@H](CO)c2cccc(Br)c2)c(C)n1-c1ccccc1 1566769867 RDNCZCCDWOZUKV-OAQYLSRUSA-N 427.342 4.249 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2cccc(OC(C)(C)C)n2)cc1 1583918283 HJYFKTNLLIZXRA-QHCPKHFHSA-N 439.600 4.465 10 10 IICE CC(C)C[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)cc1 1584506600 DBZVDMSXPCAGSL-QHCPKHFHSA-N 442.003 4.488 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCc1nc2cc(Br)cnc2[nH]1 1586059184 MEPXVYBLGAXCKA-UHFFFAOYSA-N 430.331 4.119 10 10 IICE Cc1cc(C(=O)NCC[C@@H](N(C)C)C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1595137944 UKWPTULKWRHICT-QGZVFWFLSA-N 446.311 4.469 10 10 IICE CC1(C)CC[C@@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)OC1 1596542122 DKFICMSPSSRPSF-LUYJPIOASA-N 438.640 4.051 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3nc(-c4ccc(C(C)C)cc4)no3)C2)cc1 1598364298 PHJPDSXNPTZLRP-LJQANCHMSA-N 448.567 4.444 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@H]2c2cncc(Br)c2)c([N+](=O)[O-])c1 1612954886 HKIGVWZOSLOMPN-WRLNGNIRSA-N 432.274 4.280 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2nc(-c3ccccn3)cs2)c1 1616142981 XSCDPXJHKSGFSP-UHFFFAOYSA-N 430.533 4.398 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(Br)cc3)CC2)cc1 1623429707 MXMFPZUZTZHDKW-UHFFFAOYSA-N 431.374 4.474 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])c1 1632818060 HNIKZQLKGAZYAI-UHFFFAOYSA-N 425.872 4.441 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(I)c(C)cc1C 1636058723 OVVBQNKJHQZSQL-UHFFFAOYSA-N 430.282 4.029 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@H](c2cccc(OC(F)(F)F)c2)C1 1637148471 GJMBRCKHUKPDFK-MRXNPFEDSA-N 439.411 4.425 10 10 IICE Cc1cc(C(=O)NCCn2cc(Br)ccc2=O)c(C)n1-c1cccc(Cl)c1 1637792267 PLPCCBWAFHMCMK-UHFFFAOYSA-N 448.748 4.102 10 10 IICE COC1CCN(c2ccc(CN3CCO[C@@H](c4ccc(OC(F)F)cc4)C3)cc2)CC1 1645163090 KMZJVNBEGKMNSK-HSZRJFAPSA-N 432.511 4.477 10 10 IICE CC(=O)c1cc(F)cc(CN2CCN([C@@H](C)c3ccc(Br)cc3)CC2)c1O 1653371513 PWWMBSSHTJREIX-AWEZNQCLSA-N 435.337 4.375 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(C(=O)c4ccccc4Cl)CC3)C2)cc1 1683945377 RTVMUCIBDLRIAB-GOSISDBHSA-N 441.959 4.232 10 10 IICE Cc1occc1CN(C)c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1724121448 WVHZHPXCIXEXPM-UHFFFAOYSA-N 440.598 4.441 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](C)N(CC)CC 1726982566 BGIMTTNFWSNRAU-LEWJYISDSA-N 442.652 4.247 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccco3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1751767275 SKEORMVEHIILSK-UHFFFAOYSA-N 440.548 4.117 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)C1 1761144577 OVRYBUDUPOEKME-MRXNPFEDSA-N 432.619 4.163 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CCCC(F)(F)F)CC2)cc1F 1770258478 OAVCUBCTJZRHLK-UHFFFAOYSA-N 441.473 4.362 10 10 IICE COC(=O)c1c(NC(=O)c2ccc(S(C)(=O)=O)cc2)sc(C)c1-c1ccc(C)cc1 1866207864 REDFXLXPDQXZGC-UHFFFAOYSA-N 443.546 4.474 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1O 2236051562 VGZHYVJWLITALZ-IMFGXOCKSA-N 431.374 4.164 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(C)C2=O)ccc1OCCOc1ccc(OC)cc1 2978219 FIAGFRVKISFSRZ-XSFVSMFZSA-N 445.562 4.383 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3cc(-c4nc(C)cs4)sc3C)CC2)cc1 33289997 HRNMOLCJIINIOH-UHFFFAOYSA-N 449.623 4.008 10 10 IICE CCOc1cc([N+](=O)[O-])cc(/C=C2/SC(=S)N(CCc3ccccc3)C2=O)c1O 33398509 DGRJKAWNZDOSQR-GZTJUZNOSA-N 430.507 4.143 10 10 IICE CO[C@@H](C)C(=O)Nc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435537494 XHMPQYUMNXJRPM-SFHVURJKSA-N 448.567 4.020 10 10 IICE COC(=O)c1ccccc1N1C(=O)C(O)=C(c2ccc(F)cc2)[C@H]1c1ccc(O)c(O)c1 526480946 PCLCJRJDOPXMRP-OAQYLSRUSA-N 435.407 4.081 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 731479856 YVZLTHMGQALPSP-LSABQMHNSA-N 430.888 4.384 10 10 IICE C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1ccc(N2CCOCC2)cc1 741182961 MEVDGCIIRNMSSI-CWFSZBLJSA-N 434.458 4.403 10 10 IICE O=S(=O)(/C=C\c1cccc(Br)c1)NCc1cccc(Br)c1O 766199831 JNKQVEAJXCJSMW-FPLPWBNLSA-N 447.148 4.008 10 10 IICE Cc1cc(Cl)cc(CNCc2cccc(S(=O)(=O)NCc3cccc(F)c3)c2)c1O 776050553 UKMYWXNAWHDCCQ-UHFFFAOYSA-N 448.947 4.261 10 10 IICE CC(=O)Nc1sc(NS(=O)(=O)c2ccc3nc(C)sc3c2)nc1-c1ccccc1 794029758 PZLJRQGLMXXKKD-UHFFFAOYSA-N 444.563 4.487 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 804734513 OYIXOCGBEGEHEY-KBPBESRZSA-N 430.220 4.473 10 10 IICE Cc1ccc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)c(OC[C@H]2CCOC2)c1 805191982 FSWJOVUTARXMAS-AWEZNQCLSA-N 439.339 4.422 10 10 IICE C[C@@H]1C[C@H]1c1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1125177846 QMKUOTXABLEKQY-PZIHLRSNSA-N 444.553 4.450 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccc(Cn3cccn3)c2)cc1 1142027016 VHJODIWQKDLYNF-UHFFFAOYSA-N 426.520 4.010 10 10 IICE CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H]1CCN(c3ccc(OC)cc3)C1)CCC2 1252114325 CLOANBYASMHARK-OXJNMPFZSA-N 428.602 4.259 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1302010792 AZOODHYTGUESCL-PMACEKPBSA-N 443.636 4.297 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCn1cccn1 1302540084 BMZPNDNBULJWRO-IBGZPJMESA-N 449.628 4.437 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C)c2c(C)noc2C)n1 1304455891 KCDZWAVWVMNECE-OAHLLOKOSA-N 432.528 4.399 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)OC 1313772417 RAZKMUKTESGAPQ-KNQAVFIVSA-N 437.588 4.393 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cccc4c3ccn4CC(C)C)CC2)cc1 1351457496 OCOLSNCIDSMPIZ-UHFFFAOYSA-N 448.611 4.248 10 10 IICE CC[C@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1360528931 SLBHCGZYYDLZGT-XWALVKJWSA-N 443.569 4.422 10 10 IICE CN(C)c1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)nc2ccccc12 1445884558 PQQLPFVIFQUJHF-SFHVURJKSA-N 438.959 4.054 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1446423444 WVJZOKAMTPKITB-NRFANRHFSA-N 447.620 4.406 10 10 IICE CCO[C@H]1C[C@@](CO)(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1447795987 IALPCSXSXNLELT-UGKGYDQZSA-N 449.389 4.153 10 10 IICE COc1ccc([C@@H](NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)cc1 1459861674 JGPGNVRNZDXQKA-VWLOTQADSA-N 442.515 4.396 10 10 IICE COc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1C(F)(F)F 1465952189 XEUWPAPQNLCJBO-INIZCTEOSA-N 442.865 4.467 10 10 IICE C[C@@H](CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(C(F)(F)F)cc1 1469819903 XHTFPCNNCQTZPY-HRAATJIYSA-N 436.522 4.477 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C)c3ccc(Br)cc3)C2)cc1 1470771665 GXBXSQSRHKNYNH-QAPCUYQASA-N 432.362 4.139 10 10 IICE CC[C@H](C)c1nnc(N2CCOC[C@H](C3CCC3)C2)n1Cc1ccc(N(C)C)cc1C 1495930517 CGZQKIKYICQYKO-PGRDOPGGSA-N 425.621 4.467 10 10 IICE CN(CCC(F)(F)F)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1517254976 MCFWBCHNLDGTHY-UHFFFAOYSA-N 428.509 4.368 10 10 IICE CNC(=O)[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)C1 1517502282 GOSUBFLGEWMLNT-NRFANRHFSA-N 448.615 4.361 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCn3cnc4sc(C)c(C)c4c3=O)c2C)c1 1534758759 JRCVWIUTOLIVFE-UHFFFAOYSA-N 448.592 4.497 10 10 IICE O=C(/C=C/c1ccccc1C(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1535345664 JLVGXXDEYGIDFR-AATRIKPKSA-N 426.385 4.150 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCS[C@H](C)[C@H]1C 1542227183 VKNMHOAZFNRJQF-RTBURBONSA-N 436.629 4.017 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C 1543309833 IRUVLJGSBDOESL-FQEVSTJZSA-N 427.545 4.186 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3Cl)CC2)cc1 1544314890 IISATSHLKFGSKF-NHCUHLMSSA-N 448.394 4.044 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ncccc32)c(C)n1-c1ccc(Br)cc1 1544958401 GQHFPHMMNRLAHY-UHFFFAOYSA-N 425.330 4.348 10 10 IICE COc1cc(C)c([S@](C)=O)cc1OC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1557112037 GCXFGRBQLJTBEL-HKBQPEDESA-N 439.533 4.109 10 10 IICE Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)NCc3cccc(O)c3O)cc12 1558159402 FJKXUVSCYBKPOP-UHFFFAOYSA-N 427.913 4.449 10 10 IICE Cc1cc(C(=O)Cn2ncc3cc([N+](=O)[O-])cc(Cl)c32)c(C)n1-c1ccc(F)cn1 1559393750 ZKXSSQDOANDEPC-UHFFFAOYSA-N 427.823 4.422 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccn(-c4ccc(Cl)cc4Cl)n3)C2)cc1 1585987704 GUIYDNHMMDIXDX-HNNXBMFYSA-N 431.323 4.196 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C3CCC(NC(=O)CC4CCCCC4)CC3)C2)cc1 1585988655 OFTUAHSMQRLUPE-LZBANZJXSA-N 441.616 4.036 10 10 IICE CC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)[C@H](C)C1 1596165785 IXUDQZRFBNXHFW-LJQANCHMSA-N 434.588 4.066 10 10 IICE COc1ccccc1OC[C@H](C)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1596598346 XXVKOEJNKMCGNO-HXUWFJFHSA-N 449.595 4.248 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cnc(F)c(Cl)c1 1611252533 YHVDBZYURDAPFU-AUWJEWJLSA-N 439.896 4.243 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](C(=O)OC)C2)n1Cc1ccc(N(CC)CC)cc1 1613266709 BRVKITWUIREUNZ-UYAOXDASSA-N 427.593 4.076 10 10 IICE CCOCc1nnc(N2CCC[C@@H](C(F)(F)F)C2)n1Cc1ccc2c(c1)CCCN2C 1616840996 WGLKRBYWJHIHJB-GOSISDBHSA-N 437.510 4.024 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C(C)(C)C)[C@H](O)C2)c(C)n1-c1ccc(Br)cn1 1624128269 VJKXRYIQRPTFJA-QZTJIDSGSA-N 434.378 4.121 10 10 IICE COc1ccc(C[C@@](C)(O)CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc1OC 1625487306 FJZNPZXDATZXSG-AREMUKBSSA-N 436.552 4.143 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1626722729 HBVDRPKGNPKILS-NQIIRXRSSA-N 429.605 4.145 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1F 1627604658 NIWKEWHOPPKBLF-HNNXBMFYSA-N 435.902 4.134 10 10 IICE Cc1ccc(-c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)n[nH]2)cc1 1629055389 IUAWIFLDYOOJJV-KRWDZBQOSA-N 426.467 4.385 10 10 IICE COc1ccnc(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1F 1629643465 XXSHQQADMGKADM-UHFFFAOYSA-N 432.293 4.329 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)cc1 1637337948 OWUGVNBGKGENIM-AREMUKBSSA-N 430.548 4.249 10 10 IICE CCN(c1ccccc1)S(=O)(=O)c1ccc(N(C)Cc2ccccc2O)c([N+](=O)[O-])c1 1639661793 RSONYCIBYCPFHG-UHFFFAOYSA-N 441.509 4.152 10 10 IICE COc1cc(N2CCN(c3c([N+](=O)[O-])ccc(Cl)c3Cl)CC2)cc(OC)c1OC 1639757889 OHAAUKKDEHSBMV-UHFFFAOYSA-N 442.299 4.254 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN(Cc1ccccc1O)C[C@H]1CCCO1 1642199964 PWXKBYYDNPIHPE-OAHLLOKOSA-N 427.419 4.362 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCc2ccccc2N2CCOCC2)cc1 1644031993 ZSUGKDVEXSIEQQ-UHFFFAOYSA-N 449.517 4.113 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccccc1C(=O)c1ccc(Br)cc1 1644752832 WHHGZGQTTNHYSI-UHFFFAOYSA-N 426.266 4.021 10 10 IICE COC(=O)CCN(Cc1ccc(N2CCC(OC)CC2)cc1)Cc1ccc(F)c(F)c1 1653385261 KVERQNHOYIKILV-UHFFFAOYSA-N 432.511 4.145 10 10 IICE CCOCc1nnc(N2CCC(Cl)=C(Cl)C2)n1Cc1ccc2c(c1)CCCN2C 1696287140 QHTRGFZTSCHFRH-UHFFFAOYSA-N 436.387 4.145 10 10 IICE CCCCn1cc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)c(C)n1 1709636334 IIDLHFLPLIXCFW-JOCHJYFZSA-N 438.576 4.215 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H](C)C2)n1CCCSc1nccs1 1727210569 HRLBPZVWOLSWSD-HNNXBMFYSA-N 436.651 4.072 10 10 IICE CN(CCOC(C)(C)C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1729546796 CVTFKEJBWNSNTA-UHFFFAOYSA-N 445.677 4.428 10 10 IICE COc1ccc([C@@H](CN2C(=O)/C(=C\c3ccc(N(C)C)cc3)SC2=S)N(C)C)cc1 1858594152 NFVZGIWLHBONSY-DOAWATSRSA-N 441.622 4.265 10 10 IICE O=C(Nc1c(Cl)cccc1C(=O)O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O 1859552148 HBOLVFKNSQJHCB-UHFFFAOYSA-N 434.835 4.087 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@H]1CNCc1cc(Br)ccc1O 2095170794 NHDOLHNJFGKCCG-INIZCTEOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC[C@H](CNCc2cc(Br)cc(F)c2O)CC1 2101521606 QOMPXOSPVPNRTJ-NNUKFRKNSA-N 431.346 4.467 10 10 IICE CC[C@@H](c1cc(Br)ccc1O)N1CC(COCc2ccccc2)(C(=O)O)C1 2284125872 QLKBNRSQVRXMNK-SFHVURJKSA-N 434.330 4.209 10 10 IICE Cc1ccc(S(=O)(=O)Oc2ccc(C=C3SC(N4CCCCC4)=NC3=O)cc2)cc1 2297453823 GFBVRKWGLJRHLO-UHFFFAOYSA-N 442.562 4.219 10 10 IICE CCCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(O)c(OC)c2)SC1=S 2314769050 NWKFNCIHMYNRNG-LJQANCHMSA-N 443.546 4.297 10 10 IICE Cc1ccc(CN[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2327802399 YOQIGBQERYKLCD-LLVKDONJSA-N 427.261 4.008 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380721486 KXNWOLYHZDJZKH-OAHLLOKOSA-N 441.366 4.259 10 10 IICE COC(=O)CN1C(=O)/C(=C\c2ccc(OCc3ccccc3Cl)cc2)SC1=S 33326985 JTKQTRYMSPMKHN-LICLKQGHSA-N 433.938 4.293 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCC(NC(=O)CC3CCCC3)CC2)cc1F 731364846 PLQMTPDFEGEYBV-UHFFFAOYSA-N 432.584 4.042 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2[C@H](C)CC(O)C[C@H]2C)sc(C)c1-c1ccccc1 759484668 VNMLVMXRCUCNMX-HZPDHXFCSA-N 444.597 4.463 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc4c(c3)N(C)CCC4)n2)cc1OC 761837409 XQPJIHTXTNUBAR-UHFFFAOYSA-N 445.566 4.011 10 10 IICE COc1cc(O)c(CN(CC(=O)Nc2ccccc2C(F)(F)F)C(C)C)cc1OC 775643523 QEVYEPGQBSKDRH-UHFFFAOYSA-N 426.435 4.277 10 10 IICE O=C1/C(=C\c2cccc3cnccc23)SC(=S)N1CCc1ccc2c(c1)OCCO2 782880245 LUESBYVOFAMOOL-FYJGNVAPSA-N 434.542 4.450 10 10 IICE COc1ccc(OC)c(N2C(=O)/C(=C/c3cc(-n4ccnc4)cs3)SC2=S)c1 783699334 WLUXUNMSJQGDDD-MFOYZWKCSA-N 429.548 4.357 10 10 IICE COC(=O)C[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(C)cc1 1124707551 IADJDYRLGQDRDG-QHCPKHFHSA-N 447.579 4.137 10 10 IICE CCOc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1125277033 IZBVDKNJJKKBFU-LDADJPATSA-N 430.526 4.454 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3nc4ccccc4cc3Br)C2)cc1 1131029979 JCEPXUNVZLZEEP-OAHLLOKOSA-N 426.314 4.015 10 10 IICE CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1132264479 SSSZPSGXMHDTQF-DEOSSOPVSA-N 433.552 4.376 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cncc(C(F)F)c1 1132608467 UMGDOYWIZOGXGU-CHHVJCJISA-N 437.468 4.388 10 10 IICE CCCc1c(C(=O)N(C)Cc2ccc(N(C)C)cc2)cnn1-c1cc(F)c(OC)cc1F 1135690759 YCGUQXMCLASGEM-UHFFFAOYSA-N 442.510 4.450 10 10 IICE CN(C(=O)c1ccnc2c1CC(=O)N2)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 1136838017 UYTGGZIKSXYCSZ-UHFFFAOYSA-N 428.370 4.059 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@H]1CCCOC1 1155617550 FTMHKQNVVTZOPE-OXJNMPFZSA-N 435.362 4.028 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCNc1nccc(C(F)(F)F)n1 1162568832 VEVGYVAQONQHAP-UHFFFAOYSA-N 431.374 4.159 10 10 IICE Cc1cc(CC(=O)N[C@@H](C2CCOCC2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1163530943 HQHIRLWWUSZYSS-DEOSSOPVSA-N 445.003 4.364 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1nc(-c2c[nH]c3ncc(Br)cc23)cs1 1166799718 PQRQOYGIELWQKI-UHFFFAOYSA-N 445.298 4.041 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](n3cccn3)C(F)(F)F)cc2Cl)C1 1235835862 XCZAJDYJZPFMNQ-KSSFIOAISA-N 443.901 4.376 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCc1cccc(Cl)c1 1264227804 LYGOIFMUHLWRSJ-AQTBWJFISA-N 448.972 4.429 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cc3cc(Br)cnc3n2C)C2CC2)cc1 1264414085 OQTICHVCQQDTAP-UHFFFAOYSA-N 427.346 4.207 10 10 IICE CN(C)[C@@H]1CCc2cc(Br)ccc2N(C(=O)/C=C/c2ccc(Cl)nc2)C1 1280507426 KEGFEVQSUVOAKE-PEJPJJPESA-N 434.765 4.420 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)NCc3cccc(Br)c3O)c2)c1C 1297440997 QWWMEKPMXSLSOL-UHFFFAOYSA-N 428.330 4.450 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1F 1298056522 QYPATNKCCRPQOJ-LEWJYISDSA-N 445.583 4.024 10 10 IICE CN(CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1298714264 LYAJPZLCXCOYNP-UHFFFAOYSA-N 431.581 4.076 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCC3(S(=O)(=O)NC(C)(C)C)CCC3)c2C)c1 1303565271 ZQNGXYDGLMJIHI-UHFFFAOYSA-N 445.629 4.081 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H]3CC[C@H](c4cccc(Cl)c4)C3)cc2)CC1 1312848709 ULCLBLIYTGZYOI-RBBKRZOGSA-N 426.992 4.227 10 10 IICE CS[C@H](Cn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1316393863 GDWXBVFNNLLHFB-HXUWFJFHSA-N 442.633 4.259 10 10 IICE CC[C@H](C)NC(=O)c1ccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1355179947 ZMMAHVILYONJBC-SFHVURJKSA-N 447.579 4.373 10 10 IICE COc1cc(OC)nc(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)n1 1358009482 LNPJCSOUNUNHRC-UHFFFAOYSA-N 441.509 4.348 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnn(-c2ccc(F)cc2)c1 1361064279 ZJMKPHNXCBNLPR-KRWDZBQOSA-N 430.430 4.012 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cnn(C(C)(C)C)c2-c2ccccc2)N(C)C)cc1 1439959387 DVBXJXOMRWBFRU-HSZRJFAPSA-N 433.600 4.404 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(O[C@@H]3CC3(F)F)cc2)cc1 1442613885 KKOGMLRUUFAOFQ-FGZHOGPDSA-N 430.495 4.360 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3sc4cc(C)c(C)cc4c3C)cc2)CC1 1447712460 NKZXKYLFDIDQAQ-UHFFFAOYSA-N 435.593 4.425 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nnn1-c1cccc(C(C)C)c1 1458036977 BLGSGRJFJFLPQN-UHFFFAOYSA-N 447.583 4.314 10 10 IICE COc1ccc([C@H](C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1460744413 CXCUUNILPBAMCE-INIZCTEOSA-N 428.488 4.068 10 10 IICE CC[C@H]1COC(C)(C)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1461378135 POQZJKKPVUROAC-LUYJPIOASA-N 438.640 4.146 10 10 IICE Cc1cc(C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c(C)n1-c1ccc(Cl)cc1 1467954780 MCOSKLIDMPTBBH-UHFFFAOYSA-N 449.935 4.389 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Cc2cc(F)ccc2F)CC1 1479030667 OIAIYPBPFKSQHB-UHFFFAOYSA-N 443.538 4.090 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccnc(OC4CCCCC4)c3)cc2F)C[C@H](C)O1 1526002967 KBXIQLRPSRPSHE-ROUUACIJSA-N 441.547 4.476 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 1528925545 ZUNASISGOBGLOJ-OAHLLOKOSA-N 431.462 4.022 10 10 IICE COc1cccc(C(F)F)c1C(=O)Nc1cccc(N(CC(N)=O)Cc2ccccc2)c1 1530461006 ALOYXZCFYYPNEM-UHFFFAOYSA-N 439.462 4.377 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1CCC2(CCCC2)O1 1530756385 QFKDSHVPVWESIJ-XIDKLXSXSA-N 448.585 4.025 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(C(=O)Nc4ccccc4)c3)C2)cc1 1537109464 OYODFKSGTSRIIV-LJQANCHMSA-N 429.520 4.204 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@@H]2C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 1540744379 WIKCOFJCOCQYEG-MRXNPFEDSA-N 434.283 4.399 10 10 IICE CCC(=O)N[C@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(CC)CC)cc2)C1 1545164937 NEZACBLZVGTBIV-FPOVZHCZSA-N 440.636 4.181 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3nn(-c4cccc(C(C)C)c4)cc3O)CC2)cc1 1545931502 KQNVQZHEERSBSZ-UHFFFAOYSA-N 434.540 4.062 10 10 IICE CCN(CC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1547533197 HYEDCJRVUYCOKN-UHFFFAOYSA-N 425.621 4.069 10 10 IICE CSc1ccccc1[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1556367806 VCAVYCNWHAJDHX-ZDUSSCGKSA-N 448.591 4.467 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C4CCN(C)CC4)C3)cc2Cl)C1 1564649501 FHGKOOJAGICNIB-RXVVDRJESA-N 433.040 4.450 10 10 IICE C[C@@H](NC(=O)[C@H]1c2ccccc2OCCN1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1585423741 KUGZYPKYQIRAHN-VGOFRKELSA-N 439.556 4.301 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cccc(SC(F)(F)F)c1 1586864792 SDEKCHNZCTWCJC-UHFFFAOYSA-N 428.451 4.329 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCC(=O)N(c3cccc(F)c3)C2)c(C)n1-c1ccccc1 1587464972 BWCQDRRYQDTNIW-OAQYLSRUSA-N 433.527 4.335 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)/C(F)=C\c1ccc(C(F)(F)F)cc1 1596695026 MAKVVEVCPKRGBB-WOJGMQOQSA-N 426.385 4.308 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCN(c3ccc(C(C)C)cc3)C2=O)cc1F 1616923805 AQQOHPJDAIRVJL-NRFANRHFSA-N 425.548 4.465 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)N(C)C)cc1 1618643663 MHPFJOAUSOMWDQ-JOCHJYFZSA-N 438.959 4.206 10 10 IICE CCOC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)Cc1ccccc1 1626890589 CTAPNEAZRZZHPC-OAQYLSRUSA-N 434.536 4.255 10 10 IICE CC(C)Cc1c[nH]c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1628491742 WLLISGNYLVDLOI-NRFANRHFSA-N 428.577 4.275 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)s2)cc1 1628764348 OLSPUZMYKXFVRH-UHFFFAOYSA-N 439.556 4.457 10 10 IICE Cc1noc(COc2ccc(C(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)cn2)n1 1632697107 FYKTYJXSKCPCDX-KRWDZBQOSA-N 444.491 4.461 10 10 IICE Cc1ccc(C(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1633465576 YUZGPGIPVHYUNR-DEOSSOPVSA-N 443.547 4.483 10 10 IICE Cc1csc(CCCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1634163241 WFDQIQLNNKLHMF-LJQANCHMSA-N 446.617 4.222 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)c1 1635938661 PHAKPLYIYKURTB-DEOSSOPVSA-N 431.580 4.342 10 10 IICE COC(=O)C1(C2(O)CCN(C(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)CC2)CCC1 1640533434 ABYQOPXVCTYHFN-UHFFFAOYSA-N 444.959 4.058 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(c4ccc(F)c(F)c4)CC3)C2)cc1 1673823610 WOUJAFHBIZPPBU-QGZVFWFLSA-N 429.511 4.389 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CSCCN1Cc1ccccc1 1681540989 ZRGNICRVLJNIAR-JOCHJYFZSA-N 427.614 4.322 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1ccc([Si](C)(C)C)cc1 1687084938 GXOKMSRTKFVMOL-UHFFFAOYSA-N 449.465 4.474 10 10 IICE CCC(O)(CC)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1708823700 OGSAMJDYEVHTBI-UHFFFAOYSA-N 448.615 4.052 10 10 IICE CC1CCN([C@H](C)Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CC1 1726591468 FLZXWTFOEIZYLQ-LJQANCHMSA-N 439.629 4.393 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1746600567 DMINEKGQENGJST-UHFFFAOYSA-N 448.365 4.193 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@@H](O)CC3(CCCC3)C2)cc1F 1768496174 AOQBELUZVZLIFR-IBGZPJMESA-N 443.611 4.252 10 10 IICE O=C(O)c1cc(N2C(=O)/C(=C\c3ccccc3Br)SC2=S)ccc1O 1860085721 WEEXXAUAAFVUAJ-VGOFMYFVSA-N 436.308 4.259 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ccccc2OC)sc(C)c1-c1ccc(C)cc1 1860749018 SYOKYBMHPMDGMM-UHFFFAOYSA-N 438.505 4.404 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NCc2cccc(Br)c2O)C12CCC2 2118417125 CAZJWIYDROOFKH-ZBFHGGJFSA-N 425.367 4.328 10 10 IICE CCCCCOC(=O)CN1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2296753654 WOESNNSKQOLSAY-UHFFFAOYSA-N 428.373 4.384 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)ccc1OC 2323756730 XSLWMBVLTQVKSI-UHFFFAOYSA-N 429.519 4.224 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476159 BPZKKQIBBYQNHW-QBCAUPEHSA-N 443.525 4.204 10 10 IICE CCCCN1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(CC)c2N2CCCCC2)SC1=S 33468577 HLNBANUMHBERHG-QGOAFFKASA-N 444.626 4.040 10 10 IICE COC(=O)c1c(NC(=O)[C@@H](C)[C@H]2Sc3ccccc3NC2=O)sc2c1CCCC2 40839478 ONMQFNYVLYYFCE-APPDUMDISA-N 430.551 4.101 10 10 IICE COc1ccc(Br)c(C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)c1 98080348 PRYVPLSRQRHSIT-UHFFFAOYSA-N 429.318 4.021 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(C)c3)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526322168 DHMPMPMJTIFIHU-HSZRJFAPSA-N 433.460 4.481 10 10 IICE CS(=O)(=O)N(Cc1ccc(Cl)cc1F)c1cccc2c1C(=O)c1ccccc1C2=O 586185982 KQGOROIRVUHWNA-UHFFFAOYSA-N 443.883 4.221 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2nc3ccc(Cl)cc3[nH]2)C1 683483128 DNRGCIRGZOMPPT-UHFFFAOYSA-N 435.959 4.254 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 741212399 OEAXJULXVFJKFW-WOJBJXKFSA-N 434.458 4.184 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cccc4c(=O)c5ccccc5[nH]c34)c2)CC1 770683782 UIDBVQQLVDPVPD-UHFFFAOYSA-N 440.547 4.464 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775718499 FOTAGKOEKDROEJ-AWEZNQCLSA-N 436.350 4.423 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@@H](c1cccc(F)c1F)C(F)(F)F 776018246 APPBHIAWWXUSDE-SFHVURJKSA-N 447.379 4.043 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1 781809050 RBHBZICXCYLWOA-OAQYLSRUSA-N 431.458 4.365 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1cnn(-c2ccccc2)c1C(F)(F)F 804735081 KPVBVSIPMDDZNF-UHFFFAOYSA-N 440.219 4.289 10 10 IICE O=C(Cc1c[nH]c2cccc(Br)c12)NCc1cc(Br)ccc1O 804736046 MRCGIEPZGXJRFO-UHFFFAOYSA-N 438.119 4.257 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1cc(Br)ccc1O)c1ccccc1 804737445 RONPYFPCJKYEDA-KRWDZBQOSA-N 449.345 4.427 10 10 IICE CCC(=O)Nc1ccc(Cl)c(NC(=O)NCc2cc(Br)ccc2O)c1 806209470 BQFPGXRHTUIQPM-UHFFFAOYSA-N 426.698 4.478 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)NCc1ccnn1C 916570960 IJDZNGTUOGUSRW-LJQANCHMSA-N 431.462 4.415 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CC[C@H](C)C2 1124129670 OIAZEMSWGKSHCN-UONOGXRCSA-N 444.528 4.180 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3cc(C)cc(F)c3)c3c2CCC3)cc1 1130745269 RZRJOHVJBICLHL-UHFFFAOYSA-N 436.531 4.026 10 10 IICE CN1CCCc2cc(CNC(=O)c3cnnn3-c3cc(C(F)(F)F)ccc3Cl)ccc21 1136436841 MGUGCTRFSZIFRQ-UHFFFAOYSA-N 449.864 4.252 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(-c4noc(C(F)(F)F)n4)c3)CC2)cc1 1151503136 MBNAMFCIMHETFC-UHFFFAOYSA-N 446.429 4.117 10 10 IICE O=C(C[C@@H]1C(=O)Nc2c(Br)cccc21)NCc1c(O)ccc2ccccc12 1157050683 HXULOYVEAIJHHU-HNNXBMFYSA-N 425.282 4.050 10 10 IICE COc1cc(N2C[C@@H](C(=O)OC(C)(C)C)[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC 1186832481 KRYZFVJPYLLCIE-DLBZAZTESA-N 428.485 4.174 10 10 IICE C[C@H](Cc1cn(C)c2ccc(F)cc12)NC(=O)NCc1cccc(Br)c1O 1251843411 JSXGDAOCJJPBRO-GFCCVEGCSA-N 434.309 4.216 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC[C@@H]1CCCS1 1287354384 LGOFVMXZMNEVBW-FRRXJZEGSA-N 426.654 4.131 10 10 IICE COCCN(CCNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)C(=O)OC(C)(C)C 1295950394 FJFCQDFMYDFHGP-UHFFFAOYSA-N 449.979 4.361 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1306270284 AAFLMDZMEWKICH-KKSFZXQISA-N 439.583 4.018 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@@H]1CN(Cc2ccccc2)CCCO1 1307500261 SKHDVXLDVYBSFG-OAQYLSRUSA-N 433.390 4.268 10 10 IICE CC(=O)Nc1ccccc1C(F)(F)C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1352929660 RGZWCLVNDGZOIB-UHFFFAOYSA-N 443.416 4.394 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1[C@H]2CCCC[C@@H]2CCN1C(=O)OC(C)(C)C 1435285137 BKXCCMIFWCPZFN-LZNRXBQRSA-N 443.588 4.294 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(C)C)CN2CCCC2)c(C)n1-c1ccc(Br)cn1 1450417721 CKGVHJVBTSRYIW-IBGZPJMESA-N 447.421 4.492 10 10 IICE CC[C@H](Cc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1464758605 HKSSKVJKUOWFDT-MRXNPFEDSA-N 430.551 4.006 10 10 IICE O=C(N[C@H]1C[C@H](S(=O)(=O)c2ccccc2)C1)N(Cc1ccccc1O)C1CCCCC1 1471129317 CCZATVLKWSOJLD-XYWHTSSQSA-N 442.581 4.241 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H]3CCCC34CCCCC4)cc2F)C[C@@H](C)O1 1473639901 BNHUJXQEEARZFM-DNVFCKCGSA-N 431.596 4.148 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)[C@H]1Oc1ccccc1 1478472889 VUQRCDDFVZUICF-UBFVSLLYSA-N 437.584 4.443 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC(CCc2ccccc2)CC1 1478785974 CUEQIQGVLJXRDZ-UHFFFAOYSA-N 443.538 4.356 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCc2ccc(Cl)cc21 1479030275 GCHIVUOKBWQLLQ-KRWDZBQOSA-N 427.976 4.173 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CC[C@H](C)C3)CC2)cc1F 1504295867 KBVOJHOSONQOFM-OALUTQOASA-N 429.584 4.387 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC(F)(F)CO1 1512804239 JFJNCPDADHUZEA-YLJYHZDGSA-N 433.547 4.452 10 10 IICE CCN(CC(=O)Nc1c(F)cccc1F)C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1524473013 JPRHMCFTYYJOAM-UHFFFAOYSA-N 425.479 4.402 10 10 IICE Cc1cc(CC(=O)NCCn2cc(Br)cn2)c(C)n1-c1ccc(Cl)cc1 1525670476 OOZIWYXJGCPTCQ-UHFFFAOYSA-N 435.753 4.065 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)N(C)C)cc1 1539707864 ULWLUIOQORJBRT-DEOSSOPVSA-N 448.542 4.177 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(C2CCCCC2)[nH]n1 1544433630 BNDLQNONQUHVTL-UHFFFAOYSA-N 436.478 4.243 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)N(C(=O)/C=C/c1ccc(Cl)nc1)CCO2 1544512477 GGIXSKAQLCWGTH-RMKNXTFCSA-N 429.904 4.199 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@H]3CCCSC3)CC2)cc1 1554959356 MLVQKSFKQKEIKE-IBGZPJMESA-N 429.634 4.270 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(C3CC3)[C@H](C)c3ccccc3Cl)CC2)cc1 1559525390 LUDJCQSEZJQAGB-KNQAVFIVSA-N 444.019 4.057 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1564589681 JBMXZMJVCCDUSB-KBPBESRZSA-N 432.348 4.334 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCO[C@H](C)C3)cc2)cc1 1570012194 AQEOSQLYBSLCKM-LJQANCHMSA-N 431.536 4.313 10 10 IICE COC(=O)c1cc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)c(C)[nH]1 1613443107 KVLLDJHUXXQYCF-KRWDZBQOSA-N 439.537 4.127 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3csc(C)n3)nnc2Nc2ccn(C)n2)cc1 1615382236 RBOMVOVQKYFILH-UHFFFAOYSA-N 436.589 4.005 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CC3(SC)CCC3)CC2)cc1F 1619302673 XSVCUMIMVYORDJ-UHFFFAOYSA-N 447.624 4.237 10 10 IICE Cc1cc(C(F)(F)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnc1Cl 1622635237 UTNLYTSFBCLZES-INIZCTEOSA-N 444.309 4.275 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCc2c(F)cccc21 1626109743 NZCCEOXXDFBVNA-LPGQDOADSA-N 444.528 4.360 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)c(Cl)cc3N)cc2F)C[C@H](C)O1 1626158010 HUSWLOHDOMTOBP-RYUDHWBXSA-N 426.319 4.258 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)C[C@@H](C)NC(=O)OC(C)(C)C 1627448071 JYYCIASWBPOHRY-HZPDHXFCSA-N 427.545 4.328 10 10 IICE Cc1cc(CC(=O)N[C@@H](c2cnn(C)c2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1628292084 HPYITMIYLDYZGE-QHCPKHFHSA-N 440.975 4.044 10 10 IICE CCc1cccc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1629679139 LPQTUSTTXVFHQB-JOCHJYFZSA-N 425.573 4.240 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)c2ccccc21 1638348520 SXALCNCCAUKFHW-SJLPKXTDSA-N 440.540 4.464 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1640257650 YGAJUPBSSSNGQQ-YFPIXMDGSA-N 447.959 4.242 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2[C@@H](O)CC)sc(C)c1-c1ccccc1 1644679197 QNQGKCHZBJJVNU-MOPGFXCFSA-N 444.597 4.464 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@](C)(C(F)(F)F)C3)cc2Cl)C1 1682023661 ICSBKEMKYYHTGQ-LIRRHRJNSA-N 433.902 4.439 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1693937243 PAACTXLEEUCOLQ-FQRUVTKNSA-N 448.615 4.374 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCN(C(C)C)C2)n1 1724477843 IVXMLHUADSJTGU-FQEVSTJZSA-N 434.588 4.111 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC(F)C3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1742117779 SQTXYWCAMGTBCZ-KMFTYDHNSA-N 438.595 4.487 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)[C@@H](C)C1 1760822973 ORYLVHKNCFMILF-FQEVSTJZSA-N 446.599 4.376 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2nccs2)cc1 1764938696 PDENENROXAFKPQ-IBGZPJMESA-N 440.617 4.160 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)c1cccc(C)c1 1857996961 RSDYBLOAGXBKSC-UHFFFAOYSA-N 429.473 4.418 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)cc1OC 1860087080 YBPLCZAOCOBBAH-LDADJPATSA-N 425.535 4.024 10 10 IICE COc1ccc(OCc2ccc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)cc2)cc1 1872871262 QKVFMEPZKBIFLA-UHFFFAOYSA-N 432.520 4.245 10 10 IICE COc1ccc([C@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@H]2C(=O)O)c(O)c1 1952762781 MQKDKURUMGSHGH-BKMJKUGQSA-N 445.471 4.239 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@H](CN)c1ccn(Cc2ccccc2)n1 2078949530 XRNKOICOXVWBNC-QHCPKHFHSA-N 435.572 4.092 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCC[C@H]1CNCc1cc(Br)cc(F)c1O 2087520721 PYBXVZOEWQIBMI-LRDDRELGSA-N 431.346 4.467 10 10 IICE CCN(CC)c1ccc(C=C2SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1 2297219749 OHYBOMZCZSGJCB-UHFFFAOYSA-N 425.579 4.387 10 10 IICE CC[C@@H](C)Oc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 2297561643 QODOHLZCALGJDV-CQSZACIVSA-N 442.562 4.419 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(Cc4ccc5c(c4)OCO5)C3=O)n12 2318684211 UIVIMROTXQLYBM-UHFFFAOYSA-N 449.966 4.488 10 10 IICE COC(=O)c1ccc(C=C2C(=O)N(Cc3ccccc3)N=C2c2ccc(OC)cc2)cc1 2332139343 WCKGLOMHYXWCFN-UHFFFAOYSA-N 426.472 4.312 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352685303 DSAXSZIUGOLHOP-VNQPRFMTSA-N 425.367 4.341 10 10 IICE O=C(COc1ccccc1/C=C1\SC(=S)NC1=O)Nc1ccccc1C(F)(F)F 15056141 RICPORNHGWYTAG-DHDCSXOGSA-N 438.452 4.212 10 10 IICE CCSc1nnc2c(n1)O[C@H](c1ccc(N(C)C)cc1)N(C(C)=O)c1ccc(C)cc1-2 32997504 XXNBTSPIHTVSAM-JOCHJYFZSA-N 435.553 4.469 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4ccc5c(c4)OCCO5)s3)CC2)cc1 248125889 HKUGOWPUNVEBTA-UHFFFAOYSA-N 436.533 4.157 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc4nc(O)[nH]c4c3)no2)C1 554807773 RBGICIIILUZRRM-UHFFFAOYSA-N 428.496 4.088 10 10 IICE COc1ccccc1N1CCC(NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)CC1 731049778 OCFPFCQZVYYUMO-UHFFFAOYSA-N 436.600 4.400 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2\SC(=S)N(CCc3ccccn3)C2=O)cc1 764886745 SHHJQCVRVYXJSN-JXAWBTAJSA-N 426.563 4.481 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCCCNC(=O)OC(C)(C)C 782010849 FDKFVUHHENDQFI-UHFFFAOYSA-N 429.355 4.198 10 10 IICE Oc1c(Br)cc(Br)cc1CN1CC[C@H](Cc2ccncc2)C1 783598214 QZOSHICCWPPELF-CYBMUJFWSA-N 426.152 4.377 10 10 IICE CN(C)c1ccc(CN(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)C2CC2)cc1 792276203 SBCGZXOXGKYNBL-UHFFFAOYSA-N 438.538 4.232 10 10 IICE Cc1cccc([C@@H](NC(=O)NCc2cc(Br)ccc2O)c2ccccn2)c1 807046808 JHSZVTBNJMMDFI-HXUWFJFHSA-N 426.314 4.447 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@]3(C)Cc4ccccc4C(=O)O3)cc2Cl)C1 1128490452 SXQTUQACALFFKD-VOIUYBSRSA-N 426.944 4.364 10 10 IICE CCc1cccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1130634208 SZQXFEFNMHAKKO-CPNJWEJPSA-N 428.554 4.296 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CSc2ccccc2Br)N(C)C)cc1 1134882440 PYUXRWUAKNWWTN-SFHVURJKSA-N 436.419 4.026 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCCN(CCc2ccccc2)C1 1137351154 ZEGHFEZFHRDSOW-LJQANCHMSA-N 445.401 4.458 10 10 IICE CC[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C[C@@H](C)[S@@]1=O 1157481653 CAPKRZJTMTZFGE-BWXRKXKISA-N 437.403 4.228 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@](C)(O)c3cccc(F)c3)cc2Cl)C1 1227207082 CAPHXNXNRKSKTQ-QMHKHESXSA-N 433.955 4.422 10 10 IICE C[C@@H](CCc1ccc(I)cc1)NC(=O)N[C@@H](C)c1ccccc1O 1227642959 GEVSIEFPRJOIMB-KBPBESRZSA-N 438.309 4.378 10 10 IICE CC1=CCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1290256173 FLPSBBFJDXCLRW-UHFFFAOYSA-N 426.927 4.403 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)c(C)n1C[C@@H]1CCCOC1 1291627619 NCIHBSLYKZHISG-NRFANRHFSA-N 427.614 4.015 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(Br)ccc2O)cc1 1292381806 IUHVNWUUGNRWMD-SFHVURJKSA-N 433.346 4.042 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccsc2)cc1F 1298055567 FJCUVEKLHURDEV-GOSISDBHSA-N 429.565 4.123 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCC[C@]2(C)NC(=O)OC(C)(C)C)cc1 1300282625 WRITUBYKKMSIDM-RDPSFJRHSA-N 433.593 4.063 10 10 IICE CN1C(=O)CC[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(C(F)(F)F)cc1 1305085102 QOHPMZSNDLVJGU-CRAIPNDOSA-N 440.849 4.290 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3nc4cnccc4n3C)c2C)cc1 1307406043 JWRIFVYNZYMUIV-UHFFFAOYSA-N 434.521 4.137 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)[C@H](C)c1cccc(N2CCOC2=O)c1 1312886031 TXWKDMGOKPDIDV-RBUKOAKNSA-N 438.572 4.351 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1313121149 VRURGYCQHNVSLM-SQJMNOBHSA-N 435.616 4.168 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC[C@H]1CC[C@H](C(F)(F)F)O1 1313268646 KPLVUKBKXXUCET-UKRRQHHQSA-N 439.272 4.186 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)Oc3ccccc3Cc3ccccc3)C2)cc1 1437573439 BSYDATJRSIGJJH-NZQKXSOJSA-N 430.548 4.448 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N(Cc1ccoc1)C1CC1 1439650951 BJLHGAUKPSYIAW-WOJGMQOQSA-N 430.526 4.201 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCCOC3)C2)c(C)n1-c1ccccc1Br 1448546494 YTZKTTMFASEBMB-KSFYIVLOSA-N 447.373 4.267 10 10 IICE Cc1ccc2oc(-c3ccc(NC(=O)c4cc(NS(C)(=O)=O)ccc4O)cc3)nc2c1 1455983464 JXJWPJIKSAVXDC-UHFFFAOYSA-N 437.477 4.133 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3coc4c3C(=O)NCC(C)(C)C4)cc2Cl)C1 1459590786 XOIPYVOMLMHRKE-HNNXBMFYSA-N 443.975 4.411 10 10 IICE CN(C)c1ccc(CNC(=O)CN[C@@H]2c3cccc(Br)c3CC2(C)C)cc1 1460163595 VMWNBZKRIYTDLW-OAQYLSRUSA-N 430.390 4.045 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCN2CC(F)F)c(C)n1-c1ccccc1Br 1470151451 WCTNFGLOBQTHCW-OAHLLOKOSA-N 440.332 4.316 10 10 IICE CCN(Cc1nc2c(s1)C[C@H](C)CC2)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1471546480 CENPLUVERVVQBZ-DYESRHJHSA-N 443.661 4.168 10 10 IICE CC[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cc(F)ccc1OC 1473813108 HCAMIKAYYNTVLI-JOCHJYFZSA-N 446.478 4.289 10 10 IICE Cc1cc(CCNC(=O)N(C)C2CCN(CC(F)(F)F)CC2)c(C)n1-c1ccccc1 1479063681 KHWJYCHFSALQOH-UHFFFAOYSA-N 436.522 4.305 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H]2Cc2ccccc2Cl)N(C)C)cc1 1479533658 ICUQKCFBNQQLHN-GMAHTHKFSA-N 429.008 4.425 10 10 IICE CCCN(CCc1cccs1)c1nnc(CC)n1Cc1ccc(N2CCOCC2)cc1 1500859156 OXJUJYDPHRPXPF-UHFFFAOYSA-N 439.629 4.246 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C 1517428819 VUSURTCTFLBRDI-UHFFFAOYSA-N 436.604 4.217 10 10 IICE Cc1ccc(Oc2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)nc2)cc1 1524851406 QGUTUHSOMCABEJ-UHFFFAOYSA-N 439.462 4.227 10 10 IICE Cc1ccc(OCCCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)c1 1526015706 XMUNGFNRBLWFRG-UHFFFAOYSA-N 435.612 4.311 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C3(c4ccc(Br)cc4)CCC3)C2)cc1 1528317503 KYCSPAGOQHSRDA-SFHVURJKSA-N 429.358 4.275 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)N(C)C)cc1 1537482601 HBOXKQCTVDJNTH-JOCHJYFZSA-N 449.599 4.424 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H](N2CCCCC2)C1 1542227197 VRZMHXXRRVDPTA-QHCPKHFHSA-N 438.664 4.354 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(S(C)(=O)=O)c(Cl)c2)c1 1542914305 BJMYHVDBINJCBY-UHFFFAOYSA-N 430.913 4.216 10 10 IICE COc1ccc(CN2C[C@@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1544080738 PXNRMUDFEFLTFE-QHCPKHFHSA-N 445.563 4.076 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](n3cncn3)C2)n1Cc1ccc(N(CC)CC)cc1 1545484631 UESPDPGDOIMTQB-UGKGYDQZSA-N 436.608 4.119 10 10 IICE C[C@@H](c1cccc(O)c1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1545505023 QUWZBKXAJLRWRO-BXUJETTOSA-N 444.553 4.342 10 10 IICE Cc1cc(C(=O)N2CC[C@@]3(CCCN(C)C3)C2)c(C)n1-c1cccc(Br)c1 1556774864 POKMLBDEHAKXLA-JOCHJYFZSA-N 430.390 4.415 10 10 IICE Cc1ccc(N2CCC[C@@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1566112946 SRCOVFPOTUBSPX-XMMPIXPASA-N 443.547 4.449 10 10 IICE Cc1cc(C(=O)NCc2ccc([C@@H](C)O)cc2)c(C)n1-c1ccc(Br)cn1 1566184257 ZFQQDCMHHDKOQL-OAHLLOKOSA-N 428.330 4.235 10 10 IICE COc1ccc(C2(CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CCOCC2)cc1 1583355600 XKVIGFXFFBZDMR-UHFFFAOYSA-N 446.547 4.393 10 10 IICE O=C(c1cccn2ncc(Br)c12)N(Cc1ccco1)Cc1ccccc1O 1588146473 YQANUPAEPLQNFC-UHFFFAOYSA-N 426.270 4.238 10 10 IICE Cc1nc2cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)ccc2n1-c1ccccc1 1627464291 LJVXEVVHPSOTFR-AREMUKBSSA-N 441.579 4.433 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3C[C@H]4COC[C@@]4(C(=O)OC(C)(C)C)C3)c2C)c1 1628939020 BXMCYRNXRVSKGZ-FNZWTVRRSA-N 438.568 4.141 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]nc1-c1ccccc1F 1629056032 YEJCDSWXKGWSQZ-AWEZNQCLSA-N 430.430 4.216 10 10 IICE O=C(CCCOc1ccc2c(c1)CCC2)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257437 WJQJLAJUPGKRFU-QFIPXVFZSA-N 442.987 4.474 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)[C@H]1c1ccc(Cl)c(Cl)c1 1630273299 MPLXPKDTMMYNDI-KSFYIVLOSA-N 447.362 4.414 10 10 IICE Cc1cc(C(=O)NCCC2CCN(C(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1634486163 HUVFZBSWFWKXGE-UHFFFAOYSA-N 447.421 4.492 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCc3c(OC)ccc4ccccc34)C2)cc1 1636354182 SWAQAVQDWWULAZ-LJQANCHMSA-N 433.552 4.225 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)CSc1ccc(F)cc1 1637247936 VWDZRDFLZYKFLK-ZDUSSCGKSA-N 425.909 4.115 10 10 IICE CCCCc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n[nH]1 1639307817 GKMMBMDWQIKZCV-WJDWOHSUSA-N 432.546 4.121 10 10 IICE COC(=O)/C=C/c1ccc(N2CC[C@@]3(CCCCN3C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 1643220487 WGHMAIFYRCQZIA-LBQODKDLSA-N 445.516 4.151 10 10 IICE Cc1ccccc1OCCCN(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1652310559 LAUGQRIZTOABDN-UHFFFAOYSA-N 442.515 4.110 10 10 IICE COc1cc(N2CCC[C@@H]([C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1655512818 YVEGKZPWBBOWOQ-SJORKVTESA-N 449.548 4.476 10 10 IICE Cc1cc(CCNC(=O)NCc2ncccc2Br)c(C)n1-c1ccccc1 1674930149 MKGAPELMPUIVJI-UHFFFAOYSA-N 427.346 4.294 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1csc(NC(=O)OC(C)(C)C)n1 1687799209 HGELSNSBEWXIQF-UHFFFAOYSA-N 433.578 4.288 10 10 IICE C[C@H]1CC[C@H](C)N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1693607258 PYLAMPQZPOHLAB-ROUUACIJSA-N 429.584 4.224 10 10 IICE C[C@H](CC#N)N(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1706750094 KKUJUAFGFLBPKW-LJQANCHMSA-N 438.645 4.351 10 10 IICE CC(C)c1ncc(CN(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)cn1 1723133890 NJJPGAYIVOKNLO-UHFFFAOYSA-N 437.567 4.349 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@H]1OCCC1(C)C 1747755193 ZKEDTZQOSHDMRU-HMXCVIKNSA-N 442.604 4.354 10 10 IICE CCOC(=O)c1c(CN(C)C)n(C(C)C)c2cc(-c3cccnc3)c(O)c(CN(C)C)c12 1857514672 FSWHEQBTZMTKJC-UHFFFAOYSA-N 438.572 4.290 10 10 IICE CN(C)c1ccc([C@H](NC(=O)CCCOc2ccccc2Cl)c2nccn2C)cc1 1865935060 OUDYFXAIBUMXAW-QFIPXVFZSA-N 426.948 4.204 10 10 IICE CCOC(=O)N1CCN([C@@H](c2cccc(C)n2)c2cc(Cl)c3cccnc3c2O)CC1 2059179278 HKSLDXZEOXQWGZ-OAQYLSRUSA-N 440.931 4.161 10 10 IICE COc1ccc2nc(C=C3SC(=S)N(c4ccc(O)c(C(=O)O)c4)C3=O)ccc2c1 2296601261 WNPDXSOOKJCXBN-UHFFFAOYSA-N 438.486 4.053 10 10 IICE COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)C1=Cc1cccc(Br)c1 2297322811 ZWXRHCOCPAZQET-UHFFFAOYSA-N 426.310 4.364 10 10 IICE CCOc1ccccc1C=C1C(=O)N(c2ccc(I)cc2)N=C1C 2297349367 WYMKHHJIODBCQV-UHFFFAOYSA-N 432.261 4.496 10 10 IICE COCCN1C(=O)C(=Cc2cc3cccc(C)c3nc2N2CCCCC2)SC1=S 2314647983 NBSDIZJNDMZFFS-UHFFFAOYSA-N 427.595 4.381 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(Br)o2)SC1=S)c1ccccc1Cl 2314717687 MGCNUUSURQTEHQ-UHFFFAOYSA-N 443.731 4.242 10 10 IICE CCCN1C(=O)/C(=C2\C(=O)N(CCC)c3ccc(Br)cc32)SC1=S 2508983 FAYUWCPXHWUSLW-BUHFOSPRSA-N 425.373 4.187 10 10 IICE COc1cccc(/C=C2\C(=O)N(c3ccc(Br)c(C)c3)C(=O)N=C2O)c1OC 33323177 KWUNHDIAPICNFZ-UVTDQMKNSA-N 445.269 4.281 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1 110149501 AKPOONPOOFLFMY-DKLXNKCPSA-N 435.568 4.169 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3cn(C)nc3C(F)(F)F)no2)C1 426221260 ABVVNNQCZQIOHD-UHFFFAOYSA-N 444.461 4.258 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(C(C)=O)c3)[C@H]2c2ccc(O)c(O)c2)c1 526437858 QBQGFIVVGLSFKB-QHCPKHFHSA-N 431.444 4.366 10 10 IICE Cc1cnn(-c2ccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)c1 742807011 WKKIGTUSRUXIED-SFHVURJKSA-N 426.467 4.181 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)cc1 751060332 ATCVVICAQYVKRS-VJBMBRPKSA-N 439.987 4.496 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cccc2cnncc12 754580695 BBRMITZQXCZYTJ-YVLHZVERSA-N 440.575 4.311 10 10 IICE C[C@H]1CN(Cc2c(O)ccc3ccc(O)c(CN4C[C@@H](C)O[C@@H](C)[C@H]4C)c23)[C@@H](C)[C@@H](C)O1 783547470 XFDKZDPKCUJOHY-XETNVZRVSA-N 442.600 4.246 10 10 IICE CCS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 800049768 VUISKDJIOJZRMZ-KRWDZBQOSA-N 449.016 4.229 10 10 IICE Cc1cc(C)c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1Br 1129549424 KBLBNEIUSKBZFY-UHFFFAOYSA-N 439.300 4.111 10 10 IICE Cc1cc(CCNC(=O)c2cc(Br)cnc2N(C)C)c(C)n1-c1ccccc1 1132011179 ISZCFSQEILXHCA-UHFFFAOYSA-N 441.373 4.290 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CCCC1 1134881666 CVJJXWPSIJSCCB-AREMUKBSSA-N 448.611 4.014 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(C)[C@@H](C)c3ccc(-c4ccccc4)cc3)nc12 1191287508 AJHPPWKMXVZIOL-KRWDZBQOSA-N 430.508 4.472 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1 1230200330 IIGADZKSXGEGLC-VQIMIIECSA-N 432.971 4.363 10 10 IICE C[C@@H]1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)CN1C(=O)OC(C)(C)C 1234107048 OMZAYGNCMLPAOM-RISCZKNCSA-N 432.348 4.286 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CC=C(C(F)(F)F)CC1 1289423002 FYQXHIXYWJHPIB-UHFFFAOYSA-N 442.489 4.462 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 1290332458 YYCUQIVMXFOMCC-UHFFFAOYSA-N 447.539 4.411 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2ccccc2C)cn1 1295591182 WKKIQKPNPLGCSV-UHFFFAOYSA-N 440.883 4.357 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)/C(=C\c3ccc(O)c(OC)c3)c3ccccc3)C2)cc1 1300633916 NMYKVGYRPBRETR-SSHUPFPWSA-N 444.531 4.345 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)C2)cc1 1300634434 UHUMWBNJLCONDT-SNVBAGLBSA-N 428.247 4.058 10 10 IICE CSC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)O 1302698377 VVSUGFGFNSWYSW-FQEVSTJZSA-N 439.629 4.455 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](c3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1305433242 LQASIIAPDMKQFL-CTNGQTDRSA-N 435.620 4.414 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@](C)(O)c1ccsc1 1306078339 QQPIJDNRJASNIN-HSZRJFAPSA-N 425.602 4.046 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CCN(C(=O)c2ccc(F)cc2F)CC1 1349107038 VERPRGNWLLYACZ-UHFFFAOYSA-N 441.522 4.076 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cccc(Br)c2)C1 1358104825 XXSSOEGPPQWDHI-UHFFFAOYSA-N 440.385 4.487 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1CSCCN1C(=O)OC(C)(C)C 1441913961 LZMRXDOQZJMORX-FQEVSTJZSA-N 435.634 4.232 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)ccc21 1442402867 SCORONQCPYBGKV-KRWDZBQOSA-N 432.351 4.045 10 10 IICE Cc1cc(CC(=O)NC[C@H](CC(=O)O[C@H]2CCOC2)CC(C)C)c(C)n1-c1ccccc1 1469530495 GDYHAWAJMDGIQV-URXFXBBRSA-N 440.584 4.137 10 10 IICE C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1469708542 LKCNFNMCBSFCDF-OPAMFIHVSA-N 429.511 4.314 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)CCc4ccccc43)cc2Cl)C1 1524705183 UUOMEJRKVOWDBW-QGZVFWFLSA-N 425.960 4.172 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCc3cccc(C(F)(F)F)c3)cc2F)CC1 1530376669 LAEMMDWERZIHKR-UHFFFAOYSA-N 437.481 4.235 10 10 IICE CC(C)c1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(F)cc1 1539705002 DQCMOWKDNQGHNG-HSZRJFAPSA-N 437.563 4.234 10 10 IICE C[C@@H]1CCC(F)(F)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1540141156 WMFMVOAVQKPHHM-XTCQQWIJSA-N 430.567 4.376 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Oc2ccc(F)cc2)nc1 1544537476 DNNZDMNTWHXEPV-UHFFFAOYSA-N 435.499 4.152 10 10 IICE C[C@H]1N(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCOC1(C)C 1545141562 PKPBVXZKMTZAQL-GOSISDBHSA-N 425.621 4.301 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1545623541 CCZMJNBLFPPSAN-LJQANCHMSA-N 436.629 4.424 10 10 IICE COC(=O)/C=C/c1ccc(N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c([N+](=O)[O-])c1 1559156696 HHDVRNVGWBVAPK-XYJBSGBBSA-N 439.512 4.033 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(-c2cccc(O)c2)on1 1584356814 RIEMWAQVXPZPGE-UHFFFAOYSA-N 429.423 4.047 10 10 IICE COc1ccc(CCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1595585011 RMULXWZKGSMYNN-FQEVSTJZSA-N 446.975 4.166 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCc1cnc(C2CC2)o1 1596761486 PQDNEMPYOVOOFB-OQLLNIDSSA-N 434.564 4.338 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)CC(F)(F)F)cc1 1615382104 MLWJNMPSJMABII-UHFFFAOYSA-N 432.494 4.157 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C(=O)c1cc(C)ccc1-n1c(C)ccc1C 1625027417 JSRVNKWOPSOOPS-UHFFFAOYSA-N 447.535 4.275 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](C(=O)N(C)c2ccccc2)C1 1626441214 RJDSQVNYIKNPLW-FQEVSTJZSA-N 429.520 4.032 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 1630533055 TUAVWMSNCGXMJB-UHFFFAOYSA-N 428.448 4.391 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC(C)(C)C(=O)NCC2CCCCC2)cc1 1631268927 QFEAPXFMPRYXKQ-UHFFFAOYSA-N 437.584 4.040 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3c(Br)cccc3[nH]2)N(C)C)cc1 1637004720 MUHBUIZVCDKEBA-HXUWFJFHSA-N 429.362 4.029 10 10 IICE C[C@@H](CCO)n1c(C(F)(F)F)nc2cc(NC(=O)c3ccc(N=NC(N)=O)cc3)ccc21 1637005355 JMFBFWCLEYZELA-NSHDSACASA-N 448.405 4.413 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CCCC1 1649072604 LCPHVHNMMSDBKN-VWLOTQADSA-N 440.971 4.292 10 10 IICE FC(F)(F)c1cc(N2CCOCC2)ccc1CNc1cc(Cl)nc([C@H]2CCCO2)n1 1650644187 RRGYLBAKYKEKQB-MRXNPFEDSA-N 442.869 4.449 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2C[C@](C)(O)C(C)C)n1 1724477207 LOMRKSBYUVKPTC-SANMLTNESA-N 448.615 4.292 10 10 IICE C[C@H]1CCC[C@H](N(C)c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1726520848 MHPDLCACMIUGRT-IRXDYDNUSA-N 448.662 4.168 10 10 IICE BrC1=CCCN(c2nnc(C3CC3)n2CCCSc2nccs2)C1 1740535219 SVJVOMONRFXYMY-UHFFFAOYSA-N 426.409 4.283 10 10 IICE CCOC1(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)CCCC1 1746754460 FOAPSYYOPGODDA-UHFFFAOYSA-N 441.601 4.325 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@@H]3OCC[C@@H]3C2)cc1F 1747571123 CISQALAMAXDCFZ-NQIIRXRSSA-N 429.584 4.125 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCN([C@@H](C)c3ccsc3)CC2)cc1 1764934630 XXILQKZGCJVMHK-IBGZPJMESA-N 438.645 4.426 10 10 IICE CCCN1N=C(C(F)(F)F)/C(=C/c2cc(Br)c(OCC)c(OC)c2)C1=O 1865671322 VRUAIDJYFJUDBN-XFFZJAGNSA-N 435.240 4.410 10 10 IICE COCCCN1C(=O)C(NCc2ccccc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164262 SRIQCDYEAQOEEM-UHFFFAOYSA-N 443.547 4.000 10 10 IICE COc1ccc2sc(N3CC(C(=O)NCc4ccc(N5C[C@H]6CC[C@H]5C6)cc4)C3)nc2c1 1891608834 WCXWASJRROUHSU-PXNSSMCTSA-N 448.592 4.046 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1O 2227750468 JZNAKZXSHAIMKU-OLZOCXBDSA-N 429.355 4.089 10 10 IICE COc1ccc(Br)c(CNC[C@]23CC[C@H]2CN(Cc2ccccc2)C3)c1O 2236054006 CWRQIKYJDXYYAZ-JTSKRJEESA-N 431.374 4.165 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccccc3O)C2=O)cc1 2296796021 SCYQZWFWWYTENA-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CCN1C(=O)C(=Cc2cc(Br)ccc2OCc2ccc(F)cc2)NC1=S 2313653067 KGRNRFRAZSQXIF-UHFFFAOYSA-N 435.318 4.245 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(NC(=O)OC(C)(C)C)C[C@H]2C(C)C)c(O)c1Br 2380753151 CMZXUJIXLISUGZ-VBKZILBWSA-N 441.366 4.019 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2C[C@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381130886 GJARBRXKMMGLFG-SWLSCSKDSA-N 441.366 4.067 10 10 IICE CCCCN1C(=O)/C(=C2\C(=O)N(CC)c3ccc(Br)cc32)SC1=S 2508987 VPKARDAXXOERHZ-BUHFOSPRSA-N 425.373 4.187 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14471398 MGYCDGRZADLPHE-QYWGDWMGSA-N 427.888 4.451 10 10 IICE CCN(CC)CCCN/C=C1\C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 100191008 NHOZSQILWMKKKX-ZPHPHTNESA-N 433.581 4.253 10 10 IICE C[C@@H](NC(=O)Nc1ccc(OCc2cccnc2)cc1)c1ccc(N2CCOCC2)cc1 728693260 ONVKSRSGQCCGBU-LJQANCHMSA-N 432.524 4.380 10 10 IICE CN(c1ccc(CNC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cc1)C1CCCCC1 734273294 MCZWMRPEERMMSJ-DEOSSOPVSA-N 434.584 4.228 10 10 IICE COc1cc(/C=C2/SC(=S)N([C@H]3CCOc4ccccc43)C2=O)cc2c1OCCO2 743284437 MRUWETFTNWANRI-UZUMKDMXSA-N 441.530 4.191 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CSCc1cc(-c2cccs2)on1 747150130 ANJIEVJTJBUTBM-UHFFFAOYSA-N 443.594 4.132 10 10 IICE O=C1[C@H]2C[C@@H](C3CCCCC3)CN2C(=O)N1C1CCN(c2ccc(OC(F)F)cc2)CC1 761158675 KZGJSALXHKMQKP-DYESRHJHSA-N 447.526 4.490 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 764537220 LIPOVBLEQPEDRV-UWJYYQICSA-N 430.593 4.072 10 10 IICE CCOc1ccc(SCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768532425 FQGOTWDXGPOKPB-UHFFFAOYSA-N 439.625 4.026 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)c(OC)c1 777665350 GEQDQCLKTYWLFP-UHFFFAOYSA-N 434.539 4.254 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(C)(C)O[C@]4(CCOC4)C3)cc2Cl)C1 799994580 RJAAMIQPRZLGGJ-UZUQRXQVSA-N 435.996 4.056 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C2C[C@@H]3CCC[C@H](C2)C3NC(=O)OC(C)(C)C)c1 802781938 JGUOACUBZKJTSG-XLYVFHMYSA-N 432.561 4.298 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](CO)c3nc(-c4ccccc4)no3)c2C)c1 804122459 DFLHVQSPSOGZIF-QFIPXVFZSA-N 430.508 4.224 10 10 IICE CCc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 917380833 NSAPFCOBBIOHJW-UHFFFAOYSA-N 448.485 4.384 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)N3Cc4ccccc4C3=O)cc2Cl)C1 1128384279 KIWTTZGMGCBAPG-DLBZAZTESA-N 425.960 4.237 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)C1 1138498386 VGMLCHRAHBHULM-DHIUTWEWSA-N 443.632 4.382 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)N(C)C)cc1 1158717283 LZWVWOPLHJRJFQ-VWLOTQADSA-N 427.552 4.329 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NCc1cccc(Cl)c1O 1180409872 HGBSOGLLSKOFKS-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CCC[C@](C)(NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1198632886 MXQJNZVEWHDATB-KYTVRQNUSA-N 441.591 4.361 10 10 IICE CCC[C@H](NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2)C(N)=O 1271906009 LZNFOSRZKQMQOY-BZNBOCDVSA-N 442.563 4.171 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1291361142 HPFMFZNTWNLQOB-HYBUGGRVSA-N 439.629 4.455 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)C1 1295406942 ZXOMRZRMKXRPPL-HJBLQDPUSA-N 444.572 4.103 10 10 IICE CSC[C@H]1CCCN1c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1302706359 JCRUZVFDVYREFT-QGZVFWFLSA-N 446.671 4.235 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@H](C)O[C@H](C3CC3)C2)cc1 1313679625 OXVSNUXNODXCPS-CVDCTZTESA-N 425.621 4.375 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc([S@](C)=O)cc2)n1CCCSc1nccs1 1359681013 MJNDKOABTVOJSL-LJAQVGFWSA-N 449.671 4.414 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCCCCC[C@H]1NC(=O)OC(C)(C)C 1360847931 CMVFTSVHKCCMCB-RTBURBONSA-N 431.577 4.342 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H]3C(C)C)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1361049368 BKEOSMDQLRRDJK-QFIPXVFZSA-N 434.588 4.066 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@@H](CO)C2CC2)c(C)n1-c1ccccc1Br 1450039810 UMIVBJODPPRBKL-GHTZIAJQSA-N 431.374 4.384 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3nn(-c4ccccc4F)c(C)cc3=O)c2C)c1 1462078063 AHHCRAWFRSXKPG-UHFFFAOYSA-N 444.510 4.326 10 10 IICE CC(C)Cc1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n[nH]1 1469557041 QGAOBIJGAKCFQH-PTNGSMBKSA-N 434.612 4.290 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CC(C)(C)Oc4ccc(F)cc43)CC2)cc1F 1470707176 QXQCGVLOBIXUIW-IBGZPJMESA-N 431.483 4.107 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3C[C@H](C)C[C@@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1473455749 OQJVUZDSOSWLRE-MVOHMCPASA-N 439.575 4.139 10 10 IICE CC(C)(C)[C@@H]1CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CCO1 1541167589 IWRYPPPPLJVRAJ-KRWDZBQOSA-N 444.630 4.230 10 10 IICE COc1nn(C)c2nc(C)c(CCC(=O)NCc3cc(C)n(-c4ccccc4)c3C)c(C)c12 1544079427 HIBPZZIWGAPKJU-UHFFFAOYSA-N 445.567 4.250 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2c(F)cccc2F)c1 1545683911 DHOUQHWCRPEIDT-BUXKBTBVSA-N 436.455 4.122 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC(c3ncc(Br)cn3)C2)c1 1558042003 DNQPZEQUPHQQFV-UHFFFAOYSA-N 425.330 4.195 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C3)cc2)CC1 1559754247 MFINDNNCXHZDHN-HSZRJFAPSA-N 431.621 4.379 10 10 IICE CCC[C@H]1CCCC[C@@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 1564927237 PJVORPXGTLUWAP-RBUKOAKNSA-N 433.593 4.151 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(N(C)C(=O)OC(C)(C)C)CC1 1564946016 WYPAEBRUQPYWAW-SFHVURJKSA-N 432.609 4.033 10 10 IICE Cc1cc(CNC(=O)N2CCC(NC(=O)c3ccsc3)CC2)c(C)n1-c1ccccc1 1565192790 GNHGQIXODRASLF-UHFFFAOYSA-N 436.581 4.260 10 10 IICE C[C@H](NC(=O)[C@@H]1Cc2ccc(O)cc2N1C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1567777340 SXDRWSJBPMUHNW-BTYIYWSLSA-N 425.529 4.002 10 10 IICE COCCO[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1568055856 LHOTUTJICRRSSA-IBGZPJMESA-N 435.362 4.124 10 10 IICE Cc1cccc2c1OC[C@H](NC(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)C2 1570036014 IQRMJCDJFKRJJM-GOSISDBHSA-N 440.341 4.294 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@H](C(=O)OC(C)(C)C)CC[C@@H]2C)cc1 1570475133 GUUPHJVIJRTQHH-LAUBAEHRSA-N 438.568 4.418 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnnn2-c2cccc(Cl)c2Cl)cc1F 1585698252 LNSUYGGQTMXTDH-UHFFFAOYSA-N 436.318 4.489 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@]2(C)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1586619618 LBKFXPXEWQLZNG-AOJNWGRGSA-N 437.584 4.412 10 10 IICE CCOc1ccc(N2C[C@@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1596471871 JHZDPRWKXIUHRB-QFIPXVFZSA-N 445.563 4.471 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H]3CN(Cc4ccccc4)C[C@H]3CC(C)C)C2)cc1 1598363560 GUHMSIWFRQFXFV-CLCZQPDDSA-N 449.639 4.432 10 10 IICE COc1ccc(N2C[C@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)CC2=O)cc1 1612591698 BXLAZYIYNSEFFG-QGZVFWFLSA-N 431.448 4.052 10 10 IICE Cc1cc(C(=O)Nc2cccc3nc(O)oc23)c(C)n1-c1ccc(Br)cn1 1625761996 VFNXJDQFLNTWBL-UHFFFAOYSA-N 427.258 4.351 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CC2(NC(=O)OC(C)(C)C)CCC2)cc1 1627205540 RUUJIHWYOMVMCQ-NRFANRHFSA-N 445.604 4.098 10 10 IICE Cc1cc(C(=O)NCc2nn(C)cc2C(F)F)c(C)n1-c1cccc(Br)c1 1632348619 DFFPWEQMYDRGSQ-UHFFFAOYSA-N 437.288 4.458 10 10 IICE Cc1cc(C(=O)N2CCO[C@H](COC(C)C)C2)c(C)n1-c1cccc(Br)c1 1634448346 QLFRXQRQUVQQEB-IBGZPJMESA-N 435.362 4.123 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@@H](Oc1ccccc1Br)c1ccccc1 1639444585 QNMNTFFNWBRDIP-FQEVSTJZSA-N 428.282 4.297 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC(=O)N3CCCCc4ccccc43)c2C)cc1 1648161022 SJFQRCIJIWYFGR-UHFFFAOYSA-N 431.536 4.202 10 10 IICE CCO[C@H]1C[C@@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1653657509 SYLFOHGMKIUTJO-YADHBBJMSA-N 448.563 4.316 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC[C@@H](C)c2ccc(Br)cc2)cc1 1676410384 UXZDULYWSWYCOC-MRXNPFEDSA-N 434.378 4.339 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C(C)C)[C@@H](O)c3ccc(Cl)cc3)C2)cc1 1682188139 HNIFTBHLRIPNON-ZQMYSKGWSA-N 445.991 4.232 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3C[C@@H]4C[C@H]3CN4C(=O)OC(C)(C)C)c2C)c1 1683303902 QZUUJCVUAWGPTC-VXKWHMMOSA-N 438.572 4.306 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1686096061 DLBVBYDNIILYFM-UKILVPOCSA-N 427.564 4.197 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1686856088 HAUNWYMWIIXHMP-PZJWPPBQSA-N 434.584 4.334 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)c2C)c1 1687284566 DYIFNWDFICEIIH-UHFFFAOYSA-N 447.539 4.343 10 10 IICE Cc1cccc(-c2nnc(N3CCSC(C)(C)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1693197922 HOHYRSCWKSMVNI-UHFFFAOYSA-N 440.592 4.234 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H](CC)C2)n1Cc1ccc(N(C)C)cc1C 1694846679 CFPCFYKFLAEEKS-LJQANCHMSA-N 440.636 4.246 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1695093709 USJMDHXOACSIAW-UGKGYDQZSA-N 438.620 4.139 10 10 IICE Cn1cc(C[C@H]2CCN(c3nnc(C(C)(C)C)n3CCCSc3nccs3)C2)cn1 1696856191 DCCIZUCZQRKKNB-MRXNPFEDSA-N 445.662 4.017 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](CC)C1 1705895527 JSORBAAYYQGUAQ-OAQYLSRUSA-N 446.599 4.281 10 10 IICE CCn1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)cn1 1710178503 BBEMKPNFSYLPKH-IBGZPJMESA-N 447.587 4.240 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H](C)C(=O)NC 1727847334 GZTSHEZBMIXXFQ-RXNMKEHESA-N 434.588 4.137 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCC[C@H]1CC 1767936403 MBKPCODPJGYFDW-MOPGFXCFSA-N 445.583 4.115 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CC[C@H](F)C3)CC2)cc1 1770258296 NKEJFBNDYRTCHV-MOPGFXCFSA-N 429.584 4.439 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)C3CCN(Cc4ccccc4F)CC3)cccc21 1861858351 OGBVIOBQBABMEC-UHFFFAOYSA-N 442.490 4.452 10 10 IICE O=C1C(=Cc2ccc(Cl)cc2Cl)SC(=S)N1N1C(=O)[C@@H]2CCCC[C@H]2C1=O 2040742038 FBHINWQNCQTZNB-VXGBXAGGSA-N 441.361 4.285 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C(C)(C)C)c(C(=O)O)c2I)cc1C 2080011793 FWURYTDCZSCZAZ-NSHDSACASA-N 442.297 4.415 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C2CC2)c1O 2236051516 UKUBKTXSCPSUGM-DOTOQJQBSA-N 441.366 4.041 10 10 IICE Cc1ccccc1N1CCN(C2=NC(=O)C(=Cc3c[nH]nc3-c3ccccc3)S2)CC1 2296917066 BGJZUKQPXNZDLQ-UHFFFAOYSA-N 429.549 4.178 10 10 IICE CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1ccc(Cn2cnnc2)cc1 2313682175 WWVYESAKTYFLEW-UHFFFAOYSA-N 445.483 4.123 10 10 IICE O=C(O)c1cc(C(=O)O)cc(N2C(=O)C(=Cc3c(F)cccc3Cl)SC2=S)c1 2314539257 OKDGJXMNTAGDPI-UHFFFAOYSA-N 437.857 4.281 10 10 IICE CCCN1C(=O)/C(=C/c2c(NC3CCCCC3)nc3c(C)cccn3c2=O)SC1=S 33459289 XDZUJPMYPDMPFA-LGMDPLHJSA-N 442.610 4.359 10 10 IICE CN(C)c1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)Nc3ccc(F)cc3)C2)cc1 65136477 KWMNSUZGOHDREV-LJQANCHMSA-N 426.536 4.232 10 10 IICE CCCCn1nc(C)c(/C=C/C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1Cl 109180061 QPEWKTJASLCOBV-DVQDXYAYSA-N 430.980 4.372 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccccc3N3C[C@H](C)O[C@@H](C)C3)CC2)cc1 195547123 BXGMNFONZMIIKH-PMACEKPBSA-N 438.572 4.053 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccc(O)cc3)SC2=S)cc1 210721019 YVIKFUMCWYNAFD-XMHGGMMESA-N 442.562 4.411 10 10 IICE CCOC(=O)[C@@H](NCCCN=[N+]=[N-])c1cc(Br)c(Br)s1 227903052 CBSIIAOBRPGDFG-VIFPVBQESA-N 426.134 4.167 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)c2C)cc1 302879334 OJAFXOGZROUHPP-UHFFFAOYSA-N 431.536 4.137 10 10 IICE C[C@@H](NC(=O)N1CCC(N2c3ccccc3C[C@H]2C)CC1)c1ccc(N2CCOCC2)cc1 728747853 VFSALWYVIJHWMK-NHCUHLMSSA-N 448.611 4.209 10 10 IICE COc1ccc2c(c1)CCN2C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 746792258 UVLLIUSFBNZMEO-QGOAFFKASA-N 444.603 4.327 10 10 IICE COc1cc(N2CCN(c3ncccc3OCc3ccccc3)CC2)cc(OC)c1OC 760600725 UCLBQBWSYGPPPN-UHFFFAOYSA-N 435.524 4.013 10 10 IICE COc1ccc(CN2CCN(Cc3ccc(N4CCCCC4)cc3)CC2)c(OC)c1OC 768205853 APJHSJMTGKJODK-UHFFFAOYSA-N 439.600 4.021 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 768239994 YGDDBXFXZWIXIF-IRLDBZIGSA-N 447.595 4.274 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H](c3ccc(Br)cc3)C3CC3)cc2)C1 774392552 PDUNCIXCGGENJR-KNQAVFIVSA-N 442.401 4.392 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CCCOc2c(Cl)cccc21 775776765 FUSYYGHZJSZMAB-OAQYLSRUSA-N 429.948 4.232 10 10 IICE Cc1cc(CCNC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)c(C)n1-c1ccccc1 781137248 RZGCAZVVJYEBNF-UHFFFAOYSA-N 438.593 4.178 10 10 IICE O=C(NCCCSc1nccs1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1 781940301 VURMSZSMUATRSY-HNNXBMFYSA-N 431.505 4.427 10 10 IICE CCn1cc([C@H](O)CN(Cc2ccccc2)Cc2cc(C)cc(Br)c2O)cn1 792188195 NHMNNFVZEBPGQH-OAQYLSRUSA-N 444.373 4.415 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(CCc2ccco2)n1C[C@H]1CCCO1 802681785 OZLCGZBENNJZHE-XMMPIXPASA-N 449.599 4.462 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(N3C(=O)N[C@H](C)C3=O)c2C)c1C 811538129 UJYNFOLUUYPXKW-QGZVFWFLSA-N 430.508 4.408 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3c4c(nn3C)CCCC4)cc2Cl)C1 812909312 VAANLUQAGZZNFA-MRXNPFEDSA-N 429.996 4.188 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c(C)n1-c1ccc(F)cc1 918576147 PMISKQHIGCCVHX-ROUUACIJSA-N 436.531 4.172 10 10 IICE C[C@@H](NC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(C)(C)C 1130614186 RHWAJCMHJSJNLB-ZECSTPGPSA-N 441.416 4.201 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(C)nn(Cc4ccccc4)c3Cl)CC2)cc1 1137658558 MWXSEOKETFKXGG-UHFFFAOYSA-N 438.959 4.254 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)NCc1cc(C)ccc1O)NC(=O)OC(C)(C)C 1147962526 XDIQGVOJGOSWKB-LJQANCHMSA-N 428.529 4.372 10 10 IICE CC1(C)CN(C(=O)CSC2=NC(=O)/C(=C\c3csc4ccccc34)S2)CCO1 1166269262 YLHYSVMGMLKRKG-CXUHLZMHSA-N 432.592 4.242 10 10 IICE COc1ccc(CN2CC[C@@H]2CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1 1253283711 WBLJTASIWUTXMV-XMMPIXPASA-N 436.600 4.101 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2C[C@]2(O)CCSC2)c(C)n1-c1ccccc1 1289352975 KRBLVMZBEXYQSM-XMMPIXPASA-N 439.629 4.313 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2nn(-c3ccccc3F)cc2O)cc1 1290756423 FFTJQYYZAAMDOM-UHFFFAOYSA-N 434.471 4.219 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc(Cn4cc([N+](=O)[O-])cn4)cc3)cc2)CC1 1293145517 PXNGAFDJRQVITE-UHFFFAOYSA-N 433.512 4.006 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CC[C@H](OCC(C)C)C2)cc1 1295413574 AJYAULRCGJKZGH-QFIPXVFZSA-N 436.604 4.419 10 10 IICE Cc1cc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)ccc1F 1298686837 NSVQAQZKKBVRNM-CYBMUJFWSA-N 434.514 4.193 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1)C(C)C 1299642846 JFLLLHZAPONUEJ-FYYLOGMGSA-N 437.588 4.249 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1302010794 AZOODHYTGUESCL-VQTJNVASSA-N 443.636 4.297 10 10 IICE CC[C@@H]1c2ccc(OC)c(OC)c2CCN1c1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-] 1307158739 SIGBBVPPBJGWNA-RLGIIYIFSA-N 426.469 4.312 10 10 IICE CC(C)N1CCN(CCCSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)CC1 1307286633 NHSNALUEXNPOJV-JOCHJYFZSA-N 428.646 4.237 10 10 IICE C[C@H](OC(=O)CC1(C(F)(F)F)CC1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1324491745 XUMWFZHOJUVHRD-LBPRGKRZSA-N 445.393 4.065 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)oc1Br 1361063455 OCZNUTNPFLOVRL-GFCCVEGCSA-N 429.261 4.351 10 10 IICE CCOc1ccc([C@]2(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2(Cl)Cl)cc1 1464453437 QWGLBEBEGBBBCO-QFIPXVFZSA-N 449.378 4.054 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)Cc1ccc2ccccc2c1 1465043569 QJMRYAAADOHONG-SFHVURJKSA-N 435.501 4.227 10 10 IICE CC(C)CC(=O)N1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 1469959353 KDCVZKUNNKXDHX-LJQANCHMSA-N 449.039 4.366 10 10 IICE COc1cccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1473327726 WDBWISXQXZZDLB-HOTGVXAUSA-N 428.488 4.148 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](c2cccs2)N(C)C)n1 1511083112 IUHOKCNFZCMOQB-HXUWFJFHSA-N 448.596 4.355 10 10 IICE CCc1nnc(N(C)Cc2cc(Cl)ccn2)n1Cc1ccc(N2CCSCC2)cc1 1513808221 REJRUBHKRYUWNA-UHFFFAOYSA-N 443.020 4.127 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@]23CCC(=O)N2c2cc(Cl)ccc2S3)cc1 1516599633 OVNWSKOIOIHMMS-JOCHJYFZSA-N 429.973 4.431 10 10 IICE O=C(/C=C\c1cnc2ccccc2n1)N1CCOc2c(Cl)cc(Br)cc21 1524598285 ZOKQVVRENNVAJA-WAYWQWQTSA-N 430.689 4.485 10 10 IICE Cc1cc(CC(=O)N2CSC[C@H]2C(=O)Nc2cccc(F)c2)c(C)n1-c1ccccc1 1530215089 QBAKXHVSEBBWOY-QFIPXVFZSA-N 437.540 4.316 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(NC(=O)c4cccs4)c(C)c3)C2)cc1 1532106018 PPXVSAOAIPDSMD-GOSISDBHSA-N 435.549 4.326 10 10 IICE O=C(CCn1cc(Cl)cn1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1537250866 DXAFBHUHGJXTPY-UHFFFAOYSA-N 445.708 4.038 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cccc(CN(C)Cc4ccccc4)c3)C2)cc1 1538747068 OUTGXKJOXVDYPG-XMMPIXPASA-N 429.564 4.336 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(NC(=O)OC(C)(C)C)nn1C 1540464827 UGOAPUPYOHHDHN-UHFFFAOYSA-N 427.549 4.030 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CC[C@H](C(C)(C)C)C1 1542226974 OMTDHNOOMSJGFG-RTWAWAEBSA-N 425.621 4.467 10 10 IICE Cc1ccnc(Nc2cccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)c2)n1 1542490350 LEIGQTZBQIGUQZ-XMMPIXPASA-N 445.567 4.416 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2nc3cc(Br)cnc3[nH]2)c1C 1543501574 QQLRKFMZXMCQNS-UHFFFAOYSA-N 438.329 4.366 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(C)(C(=O)OC(C)(C)C)CC2)cc1 1570646683 RUUATFJVQBTZSE-UHFFFAOYSA-N 438.568 4.420 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](c2c(F)cccc2F)N(C)C)cc1 1586376080 TWNYNSWPQUDKBK-HSZRJFAPSA-N 439.506 4.146 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)[C@@H](C)C3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1611935371 PGZHGOBCGUWOLN-OALUTQOASA-N 448.615 4.360 10 10 IICE CC[C@H](C)CN(CC)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1613397327 TYLRXSFMOGBSCI-PZJWPPBQSA-N 443.661 4.256 10 10 IICE CCC[C@@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1614402630 HHGAWSLRRITPCN-QFIPXVFZSA-N 436.604 4.335 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2CCC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1618254200 YJKXTTMMHXYVEI-WOJBJXKFSA-N 433.593 4.030 10 10 IICE Cc1ccc(C(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1624197712 IWGOXERAQVSBQW-MRXNPFEDSA-N 427.545 4.248 10 10 IICE CCc1c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnn1C(CC)CC 1625090574 UOAYLSJADUCRIY-CALCHBBNSA-N 430.568 4.489 10 10 IICE O=C(NCc1cccc2ccccc12)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1627446253 AAMNMPJZDKTHHL-UHFFFAOYSA-N 438.530 4.338 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(S(C)(=O)=O)c(Cl)cc2Cl)cc1F 1628769668 FLEZCXJSUGCEQA-UHFFFAOYSA-N 447.359 4.312 10 10 IICE COCCO[C@H]1CCCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1634971231 XAIZVPTYRNYJBS-IBGZPJMESA-N 435.362 4.124 10 10 IICE O=C(CCc1cc(Br)c(Br)s1)NCc1c(O)cccc1F 1635366870 PCQZASXOHFUBMD-UHFFFAOYSA-N 437.128 4.367 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@]2(CC(=O)c3ccccc3O2)C1 1636264118 XUMAVIOTBSMJHX-AFMDSPMNSA-N 435.568 4.202 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(C[C@H]2C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1641997641 SYMUQFFZCPOOAC-XOBRGWDASA-N 429.344 4.352 10 10 IICE CCc1nc(C)c([C@H](C)N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)s1 1652550922 VLXUCTLPTXBTDK-HNNXBMFYSA-N 447.560 4.421 10 10 IICE O=C(CN1CCN(C(=O)c2cccc(O)c2)CC1)Nc1ccc(N=Nc2ccccc2)cc1 1652770358 ONCWZAKUBPQLAX-UHFFFAOYSA-N 443.507 4.204 10 10 IICE Cc1cc(C(=O)Nc2cn(-c3ccccc3)nn2)c(C)n1-c1ccc(Br)cn1 1653991365 BICPJBLEDDDYAW-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NCc1ccn(-c2ccc(Br)cc2)n1 1676045435 VZQRRERKKJRPIK-UHFFFAOYSA-N 443.345 4.462 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCCOc3cccc(Cl)c3)C2)cc1 1682188621 WJHSWSNBXYPRPX-SFHVURJKSA-N 431.964 4.285 10 10 IICE CCc1ccc2ccccc2c1CNC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1683974095 VXVJAGZTSXFDPC-UHFFFAOYSA-N 444.579 4.103 10 10 IICE C[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(OC(F)(F)F)cc1 1686351671 FBUGCULBMKYLNV-MGPUTAFESA-N 438.494 4.314 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@@H]2C[C@H](Oc3ccccc3)C2(C)C)N(C)C)cc1 1687807578 UNFWAPNDNCMPCA-VXNXHJTFSA-N 438.616 4.243 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@@H]1CCCO[C@H]1C(C)(C)C 1711095220 FKGNUNGEHHRSNL-GBXCKJPGSA-N 449.599 4.447 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2CC2(C)CCC2)c(C)n1-c1ccccc1 1724206116 TZBYYBBHXGSLSE-QGZVFWFLSA-N 434.588 4.243 10 10 IICE CCOCC(C)(C)Cn1c([C@@H](C)CC)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1766186772 LWDQLCMSJZDAHV-SFHVURJKSA-N 447.599 4.329 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C2CCC2)n1CC[S@@](=O)C(C)(C)C 1768651701 VSLIBULNMHGGSY-WJOKGBTCSA-N 443.661 4.329 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1 1770725258 ZUQNQRBXKLVIKY-GOSISDBHSA-N 437.588 4.250 10 10 IICE CN1CCN(c2ccc(N3C(=O)/C(=C\c4ccc(Cl)cc4)SC3=S)cc2)CC1 1860085325 DRZYELUXDQBJPJ-XMHGGMMESA-N 429.998 4.498 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)/C2=C/c2ccc(O)c([N+](=O)[O-])c2)cc1 1865677944 LPIAFCYAKTZWDR-UDWIEESQSA-N 447.422 4.278 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(O)c3cccc(F)c3n2)N2CCCCC2)cc1 1866484836 DHKBUIZWWAIIFO-JOCHJYFZSA-N 436.531 4.103 10 10 IICE C[C@H]1C[C@](CN)(N(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)CN1Cc1ccccc1 2074363420 DLOOKSOZJSCXIK-RXFWQSSRSA-N 438.616 4.139 10 10 IICE CN(C)c1ccc([C@H](N)c2ccc(I)c(Br)c2)cc1 2106792259 BBSGDUYXMVMTAL-HNNXBMFYSA-N 431.115 4.168 10 10 IICE COC1(CCNCc2cc(Cl)cc(Cl)c2O)CN(C(=O)OCc2ccccc2)C1 2111369127 GIVUOTCJSCTVSO-UHFFFAOYSA-N 439.339 4.216 10 10 IICE COCC[C@]1(NCc2c(O)cccc2Br)CCCN(C(=O)OC(C)(C)C)C1 2157552030 DWJJNTHJSNYKRA-HXUWFJFHSA-N 443.382 4.051 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@@H](NCc1cc(Br)ccc1O)C2 2226142888 BYPHLRYZZDBAPD-ZQIUZPCESA-N 425.367 4.280 10 10 IICE COc1cc(C=C2SC(=S)N([C@H](C)[C@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 2323680405 DABHEVGAQJTHJY-UVLXDEKHSA-N 434.539 4.335 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@H]3CCC[C@@H]23)c(O)c1Br 2352679350 IZKRGAUKCKENQN-XHSDSOJGSA-N 425.367 4.341 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(NC(=O)OC(C)(C)C)C[C@@H]2C(C)C)c(O)c1Br 2380753150 CMZXUJIXLISUGZ-JLTOFOAXSA-N 441.366 4.019 10 10 IICE C[C@@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S 15047221 BUEMKPCHLLCCSF-OKHBPPCESA-N 446.937 4.267 10 10 IICE N=C1/C(=C\c2cccn2-c2ccccc2F)C(=O)N=C2SC(COc3ccccc3)=NN12 32964236 CBZJJAVBUAXJGE-IXLJKPNMSA-N 445.479 4.315 10 10 IICE CCCOc1cc(N(CC)CC)ccc1/C=C1/C(=O)NN(c2ccc(Cl)cc2)C1=O 33726571 PNWVLGMADZQHID-ZHZULCJRSA-N 427.932 4.436 10 10 IICE CCN1CCc2cc(/C=C3/C(=O)N(c4ccc(Br)cc4)C(=O)N=C3O)ccc21 34378153 AFMDZDBNWKQAKB-SFQUDFHCSA-N 440.297 4.338 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@H](C(=O)NCc4cccc(F)c4)[C@@H]3C2)cc1 96456586 IVXDRHJUAOJLMH-AHWVRZQESA-N 445.538 4.018 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C/c2ccc(OCCC(=O)O)cc2)SC1=S 210412991 MUDFEEWHOIJLNF-AQTBWJFISA-N 429.519 4.345 10 10 IICE CN1CCC[C@H](CNC(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H]1c1cccs1 743555503 ZYMMLJADUYEPBE-DENIHFKCSA-N 444.670 4.184 10 10 IICE COC(=O)C(C)(C)[C@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1 767146199 VZKZHHHOVOKJKF-RBBKRZOGSA-N 440.540 4.023 10 10 IICE CNC(=O)CN(Cc1cccc(C(F)(F)F)c1)Cc1cc(C)cc(Br)c1O 781912326 PCJURZCVXOSQGQ-UHFFFAOYSA-N 445.279 4.230 10 10 IICE O=C1/C(=C\c2cc(Br)ccc2O)SC(=S)N1c1ccc([N+](=O)[O-])cc1 1084602851 AXYOCGMTLHWKBT-RIYZIHGNSA-N 437.296 4.469 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc(Br)ccc1OC(F)F 1125849269 UCDQLKNDUPMUPE-UHFFFAOYSA-N 427.245 4.139 10 10 IICE CC(C)n1nccc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1134751126 TVJKZGSXNMMYKL-UHFFFAOYSA-N 425.290 4.189 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CSC[C@H]3C(=O)Nc3ccccc3)c2C)cc1 1136158765 JOZNIWWTKFSTDH-QFIPXVFZSA-N 435.549 4.257 10 10 IICE Cc1ccc(O)c(CNC(=O)c2nn(-c3cc(Cl)c(Cl)cc3Cl)cc2O)c1 1184014821 OOQHAPLNKRYGSB-UHFFFAOYSA-N 426.687 4.482 10 10 IICE Cc1cc(CNC(=O)NCc2ccc(N3CCN(C)CC3)cc2)ccc1-c1ccccc1 1235015447 NEHJBAMNYXRKHT-UHFFFAOYSA-N 428.580 4.413 10 10 IICE CC(=O)c1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)ccc1C 1277482809 AWCNBYYHPWPMMV-UHFFFAOYSA-N 428.400 4.134 10 10 IICE COC(=O)[C@@]1(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CCCC(C)(C)C1 1279802787 NNKOAJZJBMQRFO-AREMUKBSSA-N 439.600 4.036 10 10 IICE CCOCn1nc(C)c(C[C@@H](C)C(=O)N(Cc2ccco2)Cc2ccccc2O)c1C 1294673142 ZLNMIANCMPWSMS-QGZVFWFLSA-N 425.529 4.200 10 10 IICE CCCC(C)(C)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)Cc1cccs1 1307712656 KPFSUUKEVSONNI-UHFFFAOYSA-N 447.620 4.421 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H]2CCO[C@@H](c3cccnc3)C2)cc1 1312903543 BAGIMDOTVUZHFS-ZJSXRUAMSA-N 434.540 4.373 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1315246983 IGRSLUSCFIMACK-NRFANRHFSA-N 444.630 4.293 10 10 IICE CC[C@@H](Cc1ccccc1Br)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1356036692 LRUIVMOZQGXSGT-KRWDZBQOSA-N 449.364 4.310 10 10 IICE Cc1cc(C)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(C)n1 1356366734 XENAWZXLTNMEMC-GZTJUZNOSA-N 429.542 4.376 10 10 IICE CC(C)[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1359743413 JMFNTSFFZFLMCV-HXUWFJFHSA-N 443.611 4.373 10 10 IICE CCc1nc2ccccc2n1CCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445887860 VRHWNTFQGGZWGW-LJQANCHMSA-N 440.975 4.129 10 10 IICE COCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1446808520 XPHOISWPVPFTIZ-RXVVDRJESA-N 442.556 4.412 10 10 IICE C[C@@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)cc1 1460741806 QRGVSCZIJKKTPF-CYBMUJFWSA-N 428.401 4.240 10 10 IICE C[C@@H](COCC1CCCCC1)N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1460812720 DOHCVIOCPOGAKD-ZWKOTPCHSA-N 448.563 4.364 10 10 IICE COC(=O)C[C@H](CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CC1 1470119341 IABRXGWSPRALJA-MRXNPFEDSA-N 433.346 4.176 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccc(Cl)c(Cl)c3)C3CC3)nc12 1473114649 CCLMLBNFCAALOQ-UHFFFAOYSA-N 435.311 4.083 10 10 IICE C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1478810286 CVACNFCOOXBTGY-LAUBAEHRSA-N 439.531 4.345 10 10 IICE Cc1csc(CN(C)c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)c1 1492647492 NHPAEWBRSLQQOS-HNNXBMFYSA-N 435.644 4.427 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC2(O)CCCCCC2)cs1 1492665541 MLIATGPFRJZGOV-UHFFFAOYSA-N 441.601 4.061 10 10 IICE C[C@H]1CCC[C@@](Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1493505648 BHGFGPJUSZQIMZ-UQBPGWFLSA-N 436.604 4.136 10 10 IICE CCN1CC[C@@H](Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)C1 1502276254 ODUPFQREZNDYPY-JOCHJYFZSA-N 438.664 4.445 10 10 IICE Cc1ccc([C@@H](CN2CCOCC2)NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1532383010 WDJNGKBVWWSYKJ-AREMUKBSSA-N 431.580 4.135 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1C(F)F 1537482794 ITDJGBRBZFRYMP-NRFANRHFSA-N 441.526 4.217 10 10 IICE CC(C)c1noc2nc(C3CC3)cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c12 1537483284 NXXRLFAMFMIYCT-OAQYLSRUSA-N 435.572 4.322 10 10 IICE CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1538422010 RTTKBMLXFVYULX-BJLQDIEVSA-N 434.024 4.477 10 10 IICE CC(C)N1CCC(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CC1 1538920991 ZTSAWALKTZZPEI-UHFFFAOYSA-N 442.361 4.218 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CCN(CCc2ccccc2)CC1 1543569770 CXSRIZSANNMWIR-UHFFFAOYSA-N 429.564 4.344 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)CN2CCc3ccccc3C2)c(C)n1-c1cccc(C(C)C)c1 1556724008 XSQSBFWUJWZBOJ-AREMUKBSSA-N 445.607 4.367 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C2)CCCC1 1557184952 WJAYRLJPVQHGQG-UWJYYQICSA-N 440.584 4.355 10 10 IICE Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1584515398 QBEFHDCSVYUXAY-QGZVFWFLSA-N 432.511 4.317 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(NC(=O)c4cccs4)c3)C2)cc1 1585664598 DCAODBIIRTVRTG-QGZVFWFLSA-N 435.549 4.265 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(C)nc4cc(Br)ccc34)C2)cc1 1585990149 WSHUMCFMNKCQGN-INIZCTEOSA-N 440.341 4.323 10 10 IICE COC(=O)c1cc(C(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)c(C)[nH]1 1613443108 KVLLDJHUXXQYCF-QGZVFWFLSA-N 439.537 4.127 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)N1c2ccccc2NC(=O)C[C@H]1C(F)(F)F 1616410947 MPDOCNMLRQJOAZ-FQEVSTJZSA-N 447.457 4.144 10 10 IICE CCC[C@]1(CO)CCN(CC(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OCC)C1 1618265096 HENVHUNKWIRCMI-DEOSSOPVSA-N 444.597 4.323 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(Nc2nccs2)c1 1623928847 QNWYSGVFXXLUME-UHFFFAOYSA-N 431.901 4.061 10 10 IICE O=C(CN(Cc1ccc(Cl)cc1)C(=O)Cc1ccc(O)c(O)c1)Nc1ccccc1F 1624991609 FSTXNHPATRLOSI-UHFFFAOYSA-N 442.874 4.100 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@@H](C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)s1 1627007021 ONYWAVWNJNJEAC-HZPDHXFCSA-N 439.585 4.210 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@@H](NC(=O)OC(C)(C)C)C3(C)C)ccc21 1627064655 ZIQHONINBQKIAK-NHCUHLMSSA-N 443.588 4.326 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1F 1627604659 NIWKEWHOPPKBLF-OAHLLOKOSA-N 435.902 4.134 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)NCC2CC2)c(C)n1-c1ccc(C(C)C)cc1 1628986610 HAPTVNJYPSGYBK-QFIPXVFZSA-N 425.598 4.259 10 10 IICE CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NCc1ccc(N2CCCCC2)cc1 1630698193 NVNYQDDRXSKDPM-HXUWFJFHSA-N 434.005 4.463 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CNC(=O)c3cc(-c4ccccc4)on3)c2C)c1 1631794247 QBMITTPZWYTALH-UHFFFAOYSA-N 442.519 4.104 10 10 IICE CCOC(=O)c1c[nH]nc1[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1634178587 WHKDCCRBOANWFB-MRXNPFEDSA-N 440.931 4.277 10 10 IICE O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1)N(Cc1ccco1)Cc1ccccc1O 1635647213 BISAGAMQEYYAQK-UHFFFAOYSA-N 436.399 4.061 10 10 IICE Cc1cc(C(=O)N2CCN[C@H](c3ccccc3)C2)c(C)n1-c1ccc(Br)cn1 1642842998 LMOMQHLZGJVDSU-FQEVSTJZSA-N 439.357 4.038 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)[C@H](C)c3cccs3)nc12 1652367121 PAHDDJNXXGDVHI-MRXNPFEDSA-N 436.537 4.437 10 10 IICE COC1CCN(c2ccc(CN3CC[C@H](CNC(=O)OC(C)(C)C)[C@@H](C)C3)cc2)CC1 1656339491 RZMUPVWCFNRBNG-PZJWPPBQSA-N 431.621 4.285 10 10 IICE C[C@H](NC(=O)N1CC[C@]2(CCCCN2C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671852178 SHMYBQZZOONZPF-MHECFPHRSA-N 430.593 4.389 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](C)NC(=O)OC(C)(C)C 1682101863 VXJMHLFPRGTQBT-JQVVWYNYSA-N 446.636 4.469 10 10 IICE C=CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(=O)NC)CC1 1705812207 TUAIOWYQOXGECT-UHFFFAOYSA-N 446.599 4.281 10 10 IICE CCN(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1709923136 KWRPBWBWQAMKBX-NHCUHLMSSA-N 443.661 4.254 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@H]1OC 1710030986 ZJISOVNWOCLFNI-NFBKMPQASA-N 437.588 4.250 10 10 IICE CN(CC1CC(F)(F)C1)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1711128826 VDUXKYOYEAIDEV-UHFFFAOYSA-N 438.573 4.404 10 10 IICE CCc1nn(C)c(OC)c1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC 1744509745 PHYSKSNSJDKIML-UHFFFAOYSA-N 447.587 4.162 10 10 IICE CCOCc1nnc(N2CCC(C(F)(F)F)CC2)n1Cc1ccc2c(c1)CCCN2C 1747090065 MZNODTLFOKTBAA-UHFFFAOYSA-N 437.510 4.024 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCOc3ccc(OC)cc3)C2=O)ccc1O 1858587099 NNDBTIUIOBABGZ-CPNJWEJPSA-N 431.535 4.080 10 10 IICE CCN(CC)CCCN1C(=O)/C(=C\c2c(Cl)nc3scc(C)n23)SC1=S 1858589081 HPHAIQSGOICRLW-UKTHLTGXSA-N 429.036 4.291 10 10 IICE CCOC(=O)C(=O)Nc1sc(CC)c(-c2ccc(Br)cc2)c1C(=O)OC 1860738248 XOMOTSKKFYJUIN-UHFFFAOYSA-N 440.315 4.028 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H](NCc2cc(Br)cc(F)c2O)C1 1962885065 TZUJVLOERPYHBO-SWLSCSKDSA-N 431.346 4.467 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccccc2)[C@H](CNCc2ccc(Cl)cc2O)C1 2025245975 GFNZTFZRSGASRX-OAQYLSRUSA-N 445.991 4.257 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C3CCC3)c(CN)c2I)c(O)c1 2079013180 GNXXSFLXCQHZLD-GOSISDBHSA-N 437.325 4.227 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CCN(Cc4ccccc4)[C@H]3C2)cc1Br 2188882060 DIGWJFYXHGJLDC-RXVVDRJESA-N 427.342 4.258 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)C(=CC=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2293175918 LAVLUVFDSPKJCP-QGZVFWFLSA-N 440.502 4.048 10 10 IICE Cc1ccc2nc(NCC(C)C)c(C=C3SC(=S)N(C4CCCC4)C3=O)c(=O)n2c1 2296732260 NUAJXFAGSVMBAJ-UHFFFAOYSA-N 442.610 4.215 10 10 IICE COc1ccc(N2CCOCC2)c(NC(=O)C=Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 2313685397 DETTWCZBOTXQNN-UHFFFAOYSA-N 449.463 4.352 10 10 IICE COC(=O)CCCCCN1C(=O)C(=Cc2ccc(O)c(Br)c2)SC1=S 2314717830 ZSUWIQYSRUMNPL-UHFFFAOYSA-N 444.372 4.089 10 10 IICE COc1cc(N2C(=O)C(=Cc3ccc(N(C)C)cc3)SC2=S)cc(OC)c1OC 2318753359 JQLBFEREWNFBBH-UHFFFAOYSA-N 430.551 4.184 10 10 IICE CN1N=C(c2ccccc2)C(=Cc2cc(Br)cc(Br)c2O)C1=O 2332131652 PKXZNYFQRGONES-UHFFFAOYSA-N 436.103 4.177 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(NC(=O)OC(C)(C)C)CC[C@H](C)C2)c(O)c1Br 2380754042 MMJQEBYTBCMAGC-FKIZINRSSA-N 441.366 4.163 10 10 IICE CC[C@@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCCN1C(=O)OC(C)(C)C 2381133933 VHGYHMFWOFMQOY-FQEVSTJZSA-N 441.366 4.259 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 14550795 WQXCMCBHUSCVAL-DXIQSLLYSA-N 427.526 4.452 10 10 IICE CN(C)c1ccc(CN2CCCN(c3ccc(NC(=O)c4ccccc4F)cn3)CC2)cc1 34681719 LPSKYSZWJZBXHZ-UHFFFAOYSA-N 447.558 4.251 10 10 IICE N=C1/C(=C\c2ccc(OC(=O)c3ccc(Cl)cc3Cl)cc2)C(=O)N=C2SC=NN12 102469556 BDGZPLSSLMTESI-JXPUQCIKSA-N 445.287 4.462 10 10 IICE O=[N+]([O-])[C@H]1CCc2c(c(S(=O)(=O)O)cc(O)c2/N=N/c2c(O)ccc3ccccc23)C1 390822315 FEHJAXFOIHYSTA-PIBWJKQFSA-N 443.437 4.047 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)C1 444017747 FZWYZVCPPPAHKX-HXUWFJFHSA-N 448.586 4.190 10 10 IICE O=C1c2ccccc2C(=O)c2c1cccc2N(CCF)S(=O)(=O)c1ccccc1Cl 586225912 QPZDCGSTYMJAHK-UHFFFAOYSA-N 443.883 4.280 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N(C[C@H]3CCCO3)C3CCCC3)cc2F)C[C@@H](C)O1 749553608 JFYCIUKYUDPMBB-LVCYWYKZSA-N 433.568 4.073 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H](C(F)(F)F)[C@H]3C)cc2F)C[C@@H](C)O1 773234297 AKSANXBJKCDQIP-ANQUJSFKSA-N 431.474 4.312 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cc(Br)cc(C)c2O)C1 775725210 QONDXJHLFLZNEK-ZDUSSCGKSA-N 437.300 4.086 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1Cc1ccco1)N1CCO[C@@H]2CCCC[C@@H]21 917205084 BYQLXDUIEJBFRK-RBBKRZOGSA-N 437.565 4.454 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(Cc4ccccc4)C[C@@H](C)C3)ccc21 1128961603 VIIKMNPIYNBAQL-HXUWFJFHSA-N 433.596 4.499 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 1136140151 JTLWJBVYQGTMKU-NRFANRHFSA-N 441.409 4.441 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)cc1F 1142566148 YUEHWESGZGKKPM-QGZVFWFLSA-N 427.520 4.437 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC4(CC(OC)(OC)C4)[C@@H]3C(C)C)ccc21 1163813011 OOCKBARNSXPETO-QFIPXVFZSA-N 428.573 4.154 10 10 IICE CCOC(=O)[C@H](CC1(OC)CCC1)NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1164627040 MNOAYHBRWKUYPH-QFIPXVFZSA-N 426.557 4.332 10 10 IICE CCN(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)c1cc2ccccc2o1 1190528851 NBRSWAAEHZGUIW-REWPJTCUSA-N 437.584 4.007 10 10 IICE O=C(NCCc1ccc(Cl)c(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229781595 OFPCTXPNADIPQK-UHFFFAOYSA-N 444.309 4.150 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4cccc(OC)c4)CC3)C2)cc1 1230300966 NDUSANBKNVDVPQ-QFIPXVFZSA-N 437.584 4.194 10 10 IICE CCCc1c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccccc1C 1264822445 QZROGOZKOZSSPY-HXUWFJFHSA-N 432.568 4.461 10 10 IICE Cc1ccc(-c2nnc(N3CC[C@@H](OCC(C)C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1289576308 HSRONNIWGWVEHS-LJQANCHMSA-N 441.551 4.351 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1OCCC1(C)C 1305379983 BZMBIJHVJPDLLC-DENIHFKCSA-N 441.620 4.080 10 10 IICE Cc1cnn([C@@H]2CCN(Cc3ccccc3)C2)c1NC(=O)c1ccc(N=NC(N)=O)cc1 1306772012 MQBPOCWQXNFGEG-HXUWFJFHSA-N 431.500 4.053 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)N(C)C)cc1 1313419942 WGQQAPRUFHIJDD-OFVILXPXSA-N 433.600 4.426 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CC[C@@H](C)C2 1349305235 VCMQORUTIANCHC-GMRIPVOYSA-N 446.613 4.415 10 10 IICE CCC1(CC)[C@H](NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)[C@@H](C)[C@H]1OC 1357950340 JXMURIGKPYKXEL-ZYKLXPEUSA-N 425.617 4.364 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Oc3c(OC)cc(C(C)=O)cc3OC)ccc21 1437033784 IFMPASDCWDKSEX-UHFFFAOYSA-N 425.481 4.344 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cnc2c(c1)c(C(F)(F)F)nn2C 1440679297 BNMBVWXFQIQYAC-UHFFFAOYSA-N 431.462 4.250 10 10 IICE CCO[C@H]1C[C@@](NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)(C(=O)OC)C1(C)C 1447836872 XNSAFCJYSFGHLO-WMZHIEFXSA-N 432.948 4.224 10 10 IICE CC(C)[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)N1C[C@H](C)O[C@@H](C)C1 1448454199 UFINYULIKBVNHO-XQQXVUDOSA-N 436.040 4.326 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc2c(c1)OC(F)(F)O2 1456078278 VUPSYDVFUUIIRA-UHFFFAOYSA-N 426.366 4.008 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3C[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C3)c2C)cc1 1456630575 SSPFJPWQZQRDNW-VQIMIIECSA-N 441.572 4.336 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)Nc1cnccn1 1458848958 XGLXWNUVOGOILM-UHFFFAOYSA-N 446.374 4.489 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(Br)c(Cl)c3F)C2)cc1 1461498207 YGRSJWJZJGOSGZ-LLVKDONJSA-N 427.701 4.259 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cc(C(F)(F)F)ccc4n3C)CC2)c(OC)c1 1461985783 ZCUDVYYXSUJANE-UHFFFAOYSA-N 447.457 4.177 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(CN3C(=O)c4ccccc4C3=O)cc2)cc1 1464301041 QWHWMAKXPLWWFK-UHFFFAOYSA-N 441.531 4.259 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)cc1F 1464540883 HROSECJKSKCVGK-NRFANRHFSA-N 427.520 4.042 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)c(OC(F)F)c(C)c1 1466397939 FTTYWMYYPRQRJU-UHFFFAOYSA-N 427.831 4.079 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(Cc2ccccc2Cl)CC1 1470556567 XOXWOUOGOLHUSN-LJQANCHMSA-N 429.008 4.173 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3)Cc3ccccc3F)cc2)CC1 1479185268 DVVFNEYICWIWSA-UHFFFAOYSA-N 446.570 4.490 10 10 IICE COc1ccc([C@H](NC(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C2CCC2)cc1 1479470771 ALLXQBLLISIZBV-XMMPIXPASA-N 439.556 4.085 10 10 IICE CC[C@H](C)c1nnc(N2CCC(N(C)C(C)=O)CC2)n1Cc1ccc(N(CC)CC)cc1 1495454884 PENNXYUMTGRUPM-IBGZPJMESA-N 440.636 4.133 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C(C)C)C1 1503930422 NSJHVJAXQWEAPS-CVDCTZTESA-N 437.588 4.249 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@](C)(OC)C1 1519072408 WGAUZERSORXIJW-VWLOTQADSA-N 437.588 4.394 10 10 IICE COC(=O)[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(C)c(C)c1 1523710608 TZEPLYHSLSCZRC-VWLOTQADSA-N 434.536 4.176 10 10 IICE CN(CCc1ccccc1C(=O)N(C)c1ccc(C(F)(F)F)nn1)C(=O)OC(C)(C)C 1530893910 CKBGQSVLAZFPMW-UHFFFAOYSA-N 438.450 4.181 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(\C)c3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1534277740 BHRBPESWCCQAAN-JQIJEIRASA-N 434.458 4.475 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1Cc2cc(F)ccc2N(C(=O)/C=C/c2cncc(F)c2)C1 1538219172 WNSZEMJCTWZABO-IEXSPKMKSA-N 429.467 4.103 10 10 IICE Cc1noc(C(C)C)c1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1538292311 ADFWXRMEOKNPQO-XNTDXEJSSA-N 433.530 4.476 10 10 IICE CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1538422018 RTTKBMLXFVYULX-WSTZPKSXSA-N 434.024 4.477 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CCOC1 1541715747 RNTULIVNNGYMJX-DEOSSOPVSA-N 447.599 4.054 10 10 IICE CC1=CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)NC(C)C)C1 1542795575 YJGYAAHHWKKREF-UHFFFAOYSA-N 432.572 4.034 10 10 IICE CC(C)c1csc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1545390789 MISLIZYNHXPZOF-SXGWCWSVSA-N 449.598 4.313 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1CCCCCN1CCCCC1 1554174968 NJZPGZMUASJWFL-UHFFFAOYSA-N 434.588 4.338 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCCN1CCCCCC1=O 1554175753 VSCCCTMGEFMXDI-UHFFFAOYSA-N 427.593 4.001 10 10 IICE Cc1ccc(C(=O)CC(C)(C)CC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1556946276 CANHQUGGOZWFOP-UHFFFAOYSA-N 444.522 4.415 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnc3cc(OC)ccn23)cc1 1585492867 PUGGMWAHWMLNAH-UHFFFAOYSA-N 430.508 4.265 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc4c(c3)CCN4C(=O)OC(C)(C)C)C2)cc1 1585988717 QHXJXAPAVLBVRG-LJQANCHMSA-N 437.540 4.002 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)c1ccccc1C(F)(F)F 1595410891 RBKZXOLDVCEDAN-NRFANRHFSA-N 430.426 4.389 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1615770687 AZXIILMVDXODRP-RBUKOAKNSA-N 442.627 4.183 10 10 IICE Cc1cc(C(=O)N2CCC([C@@H](O)c3cc(F)ccc3F)CC2)c(C)n1-c1ccccn1 1626254957 JZIUCJQYYRFGFP-HSZRJFAPSA-N 425.479 4.353 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H](CS(C)(=O)=O)c1ccccc1 1632697021 DAGRUDHBUAVJHE-AUSIDOKSSA-N 437.561 4.310 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@](CO)(Cc3ccccc3)C2)c1 1637843580 JCVGHEVQZNSFAH-HHHXNRCGSA-N 430.548 4.364 10 10 IICE CCOc1ccc(CN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C(C)C)cc1 1638918498 WDABXJZQKBLTQS-XMMPIXPASA-N 426.605 4.374 10 10 IICE CCOC(=O)c1cnc(C)c(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1639535166 XJXMMVKHQLGNRK-HNNXBMFYSA-N 429.948 4.386 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C)Oc1ccc(Cl)cc1Br 1640256944 IJFBZBAEMBXWJV-NSHDSACASA-N 433.726 4.378 10 10 IICE O=C(Cc1ccc(Br)c(Br)c1)NCc1cc(Cl)ccc1O 1640923913 CSFQZBLHGOFLMF-UHFFFAOYSA-N 433.527 4.430 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3ccco3)n2)c(C)n1-c1ccc(OC(F)(F)F)cc1 1643967809 HYSITBUFIZDMSP-UHFFFAOYSA-N 431.374 4.122 10 10 IICE CCc1ccc([C@H](NC(=O)CN2CCOc3cc(N(C)C)ccc32)c2cccs2)cc1 1653144943 RKVFEMRYAMPABH-VWLOTQADSA-N 435.593 4.481 10 10 IICE CCC(C)(C)c1ccc(CNC(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cc1 1680608786 VPLMKXOIWZWHDZ-UHFFFAOYSA-N 425.573 4.423 10 10 IICE Cc1cc(-c2nnc(N3CCN(C(=O)C(C)C)CC3)n2CC(C)C)c(C)n1-c1ccccc1 1692988003 YRQNQJXYAGNDHO-UHFFFAOYSA-N 448.615 4.313 10 10 IICE Cc1csc([C@H](C)Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)n1 1693317305 HKRWHQWQWFKKDV-MRXNPFEDSA-N 434.569 4.175 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1)OC 1694370419 SOBDPFFSXUYEGW-XQBPLPMBSA-N 437.588 4.391 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](COC)C1 1696425064 YRBWORSDQGVEDM-NRFANRHFSA-N 437.588 4.252 10 10 IICE CC(C)c1nnc(N2CCC(c3ccnn3C)CC2)n1CCCSc1nccs1 1706294702 ZEUIEWSETSZCOB-UHFFFAOYSA-N 431.635 4.158 10 10 IICE CCc1nnc(N2CC[C@@]3(C)[C@H](C2)C3(Cl)Cl)n1CCCSc1nccs1 1709098870 AGYVIJJNYNJGEL-LRDDRELGSA-N 432.446 4.500 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCS[C@H](C)[C@@H]2C)cc1 1710027014 VPIYFYSNNGZOHT-NLWGTHIKSA-N 429.634 4.007 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC 1728447789 NHXVSIITOVKDNV-UHFFFAOYSA-N 447.587 4.149 10 10 IICE Cc1ccc(-c2nnc(N3CC(C)(C)OC(C)(C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1742187907 XNYVEFGYLHEEIZ-UHFFFAOYSA-N 441.551 4.494 10 10 IICE CC[C@@H](C)c1nnc(N(C)C2CCC(NC(C)=O)CC2)n1Cc1ccc(N(C)C)cc1C 1752617445 SQTCAGDOIUJLTC-PPNDLDFTSA-N 440.636 4.098 10 10 IICE CC(C)c1nnc(N(C)C2CCC3(CC2)OCCO3)n1CCCSc1nccs1 1760891859 RIKMRQTZHABZHN-UHFFFAOYSA-N 437.635 4.162 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC1CCOCC1 1763747102 BXPQEHTUKIIVGE-SFHVURJKSA-N 445.583 4.083 10 10 IICE CCN1C(=O)C(Nc2ccc3c[nH]nc3c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422557 CTKVINRZXLYUIE-UHFFFAOYSA-N 425.492 4.182 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCCOc1cccc(OC)c1 2293418003 URZZYGRYUSAMCD-UHFFFAOYSA-N 431.535 4.041 10 10 IICE O=C1N=C(N2CCN(c3ccccc3[N+](=O)[O-])CC2)SC1=Cc1ccccc1Cl 2296065476 FAVBBYSXLBXXLD-UHFFFAOYSA-N 428.901 4.041 10 10 IICE CC(C)OC(=O)c1ccc(-c2ccc(C=C3C(=O)NN(c4ccc(F)cc4)C3=O)o2)cc1 2297297841 DDQDBCSRNXRAFZ-UHFFFAOYSA-N 434.423 4.112 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)NC3CCCCC3)C2=O)cc1OC 2297349594 GIJMYVTYEJIAMN-UHFFFAOYSA-N 448.610 4.134 10 10 IICE Cc1nc2scc(C)n2c1C=C1SC(=S)N([C@@H](C(=O)O)c2ccccc2)C1=O 2323865374 ULBHJBNOFRUUBG-OAHLLOKOSA-N 429.548 4.040 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14473541 USBAQQJDZNTAJR-VWKPWSFCSA-N 427.888 4.451 10 10 IICE O=C(O)CCN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)SC1=S 40567379 BTRATZLNTUNBNE-ZSOIEALJSA-N 438.870 4.184 10 10 IICE COc1cc(NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)ccc1NS(C)(=O)=O 72028223 NCIJYOGIEMGVOY-UHFFFAOYSA-N 447.944 4.380 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3CC(=O)N(c4ccc(Cl)cc4)C3)cccc21 170557069 WEMJZDBSLQBUSA-CQSZACIVSA-N 444.874 4.107 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccccc3O)SC2=S)cc1 210717961 CUUWXURSHKUJJU-QGOAFFKASA-N 428.535 4.021 10 10 IICE COC(=O)c1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526355036 PSGBOQVGDOVMFX-JOCHJYFZSA-N 431.444 4.250 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)cc1 727249727 HHAJAQJJDOQPIC-UHFFFAOYSA-N 426.878 4.190 10 10 IICE CCO[C@@H](C)c1nc(CN(C)C(=O)NCc2ccc(N3CCSCC3)cc2)cs1 743555411 XYYCNAXAAVWQEX-INIZCTEOSA-N 434.631 4.135 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)Cc1cccc2c1N(C(=O)OC(C)(C)C)CC2 768208440 PPFNUJFIXBUCOD-UHFFFAOYSA-N 437.584 4.453 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(OC(C)C)cc3)n2)cc1OC 773364122 MSALEIVCOHDYKQ-UHFFFAOYSA-N 434.539 4.415 10 10 IICE Fc1cc(CNCc2nc3ccc(Br)cc3s2)ccc1N1CCOCC1 774973721 CRYFIGPJDLZTRG-UHFFFAOYSA-N 436.350 4.324 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1 779401781 YCEDBJBLGNKGBT-RPBOFIJWSA-N 436.600 4.271 10 10 IICE CCOc1ccc(OCC)c(NC(=S)NCc2ccc(C(=O)OC)c(C3CC3)n2)c1 779718796 MFCYAWZJYVPFIO-UHFFFAOYSA-N 429.542 4.030 10 10 IICE C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 780840407 GXINXPVQVBDKES-YLJYHZDGSA-N 438.538 4.091 10 10 IICE COc1cc(Br)ccc1/C=C1/SC(=S)N(CCc2ccccn2)C1=O 781549413 FBLOPONLWKJIDB-MHWRWJLKSA-N 435.368 4.297 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2CC(F)F)c(C)n1-c1ccccc1Br 804725858 YHFAAKYOWURETN-AWEZNQCLSA-N 427.289 4.353 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3ccc(OCc4ccccn4)cc3)CC2)cc1 918015948 HQDHPDDNDZBMJK-UHFFFAOYSA-N 446.551 4.091 10 10 IICE Fc1cc(CNc2ncnc3cc(Cl)ccc23)ccc1N1CCN(c2ncccn2)CC1 919723470 PWPBSPARNDODQZ-UHFFFAOYSA-N 449.921 4.151 10 10 IICE C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 919895901 YXPXFTIOOLAMAH-UUOWRZLLSA-N 432.568 4.065 10 10 IICE CC(C)CN1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@@H](C)C3)CC1=O 1128878686 BFBFNPMEVNADKD-CABCVRRESA-N 434.602 4.271 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4cccc(Cl)c4)nc3O)CC2)cc1F 1137422802 JRGGQYYLRFPWPC-UHFFFAOYSA-N 441.890 4.218 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1F 1144977815 MQEJMIPZIWCVPT-XMMPIXPASA-N 445.510 4.039 10 10 IICE C[C@H](N[C@@H](C)c1ccc(F)c(F)c1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1168759013 YCTFEDHKNQBXIB-KBPBESRZSA-N 434.442 4.418 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CSC[C@@H]2C(=O)NCCC(C)C)c1 1264970122 NUBKVCHHANWXIT-HXUWFJFHSA-N 434.005 4.425 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCC[C@@H](NC(=O)OC(C)(C)C)C3)ccc21 1296625795 SYSZWAGROOKRDX-WOJBJXKFSA-N 443.588 4.470 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@H](C(F)(F)F)C1 1304071865 FYSARWMZWMYGHC-KWJWQAOWSA-N 434.530 4.140 10 10 IICE CCc1nnc(N2CCN(Cc3ccccc3)C[C@@H]2C)n1CCCSc1nccs1 1306205705 SLACDCNXQUUGLZ-SFHVURJKSA-N 442.658 4.190 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCCCC[C@H]3c3ccc(Cl)cc3)nc12 1307472347 IWMBVSLVDFVJNS-IBGZPJMESA-N 428.920 4.382 10 10 IICE CCCN(Cc1ccccc1O)C[C@@H](O)COc1ccc(Cl)cc1Br 1307500509 FBPQNKROUYIDHQ-MRXNPFEDSA-N 428.754 4.460 10 10 IICE Cc1cc(CC(=O)N[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c(C)n1-c1ccccc1 1356002498 RHWPFUXGITYSEJ-HSZRJFAPSA-N 443.469 4.172 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(-c4cccc(Cl)c4F)no3)CC2)cc1 1358140321 KGXWSGSGRRXMRX-UHFFFAOYSA-N 429.879 4.495 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2ccc(Br)cc2F)N(C)C)cc1 1439959371 DPKPMQFAQVGXPU-FQEVSTJZSA-N 436.369 4.006 10 10 IICE Cc1ccc(C(=O)NCCNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1F 1440968095 VNYQYIQXSUWRHT-UHFFFAOYSA-N 427.907 4.355 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 1446711389 NBUPBXWMIXODMJ-UHFFFAOYSA-N 441.553 4.083 10 10 IICE Cc1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c(C)n1C[C@H]1CCCOC1 1466290283 VNJAETVHPMLPAN-IRLDBZIGSA-N 426.557 4.059 10 10 IICE CCOc1c(Br)cc(C(=O)NCc2ccc3cccnc3c2O)cc1OC 1469247581 CIFJVIOPMHMOIC-UHFFFAOYSA-N 431.286 4.040 10 10 IICE Cc1cc(C(=O)CSc2cccc(Cl)c2)c(C)n1-c1ccc(S(N)(=O)=O)cc1 1472984414 JDRCRWQGWFMRLW-UHFFFAOYSA-N 434.970 4.370 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1512865454 QNJJMAINBIZOLL-RBUKOAKNSA-N 443.661 4.397 10 10 IICE CCCCCN(c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(C)C)cc1C)C(C)C 1514399709 VPWREMXPFYHVKY-UHFFFAOYSA-N 440.636 4.342 10 10 IICE Cc1cnc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1516530923 DBFJMFKXKMAQPO-KMHUVPDISA-N 435.571 4.059 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1[C@@H]1CCC[C@H](C(F)(F)F)C1 1517143211 YHKUUVOTEVRQQN-DLBZAZTESA-N 434.466 4.314 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)[C@@H](Cc3ccccc3)C(=O)OC)ccc21 1525821939 KXGZVBSAPHQLJR-WZONZLPQSA-N 436.552 4.055 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cc(Br)ccc4o3)CC2)c(OC)c1 1530968161 KGDVTYJATOCPSO-UHFFFAOYSA-N 445.313 4.175 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@@H]1c1ccccc1 1540812609 NOWWZBVWZGFMPV-XWALVKJWSA-N 426.538 4.391 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)c1 1545370689 RXFLPMKEEANOFZ-NRFANRHFSA-N 443.547 4.189 10 10 IICE CCc1nnc(N(CC)C2CCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1546434009 KPFVFMUPEJCWLZ-UHFFFAOYSA-N 425.621 4.257 10 10 IICE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1558709650 FGUYRNHTVWSDLC-HXUWFJFHSA-N 446.511 4.416 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CCC3)c3ccccc3)cc2F)C[C@H](C)O1 1559619786 ZOYGHQJFUBOVAY-PMACEKPBSA-N 439.575 4.362 10 10 IICE Cc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1566356748 NCZHJPVYCKUUFJ-HNNXBMFYSA-N 438.311 4.310 10 10 IICE Cc1cc(C(=O)N(C)[C@H]2CCN(CC(F)(F)F)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1585780921 SEVOYVXCBWWDED-FQEVSTJZSA-N 435.490 4.453 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2ccc(F)c(F)c2)c2nccn2C)c1 1603572884 UPRULEDUBBMBQO-HSZRJFAPSA-N 448.473 4.438 10 10 IICE COCCN(c1nnc(C(C)C)n1Cc1ccc2c(c1)CCCN2C)[C@@H]1CC[C@H](C)C1 1619885345 FURNIJIHZUEHLQ-SIKLNZKXSA-N 425.621 4.474 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C2CC2)CC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1624892065 AIENTYJEKYJISO-LEWJYISDSA-N 445.629 4.034 10 10 IICE COc1ccc(N2CCN(CCNC(=O)CC(C)(C)Cc3ccc(Cl)cc3)CC2)cc1 1627050049 GMTJOROQMCUFML-UHFFFAOYSA-N 444.019 4.246 10 10 IICE Cc1ccc(CN2CCOCC2)cc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1628312896 VBKHYTKKEXWDJF-UHFFFAOYSA-N 445.563 4.228 10 10 IICE Cc1cc(C)n(-c2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cn2)n1 1628643116 VJPWCVDUUDOWEJ-UHFFFAOYSA-N 427.508 4.285 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)c1 1630152151 NUJVMWJDKZQWDL-NRFANRHFSA-N 430.426 4.389 10 10 IICE COc1cc(OC)c(C2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)c(OC)c1 1630271091 IDYRXKGRXROQNT-UHFFFAOYSA-N 443.521 4.358 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)cc1-n1c(C)cc(C=O)c1C 1630645431 AONYZSAUDNXMPP-QFIPXVFZSA-N 447.510 4.280 10 10 IICE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](C)c1ccccc1O 1632254498 CDNGMUDDNXUAAZ-IRXDYDNUSA-N 430.504 4.497 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(F)(F)c1cc(F)cc(F)c1 1635947257 SMQWJDQWFYGBHY-QGZVFWFLSA-N 430.829 4.196 10 10 IICE C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635992304 CALBDSWDEDRZPO-QAPCUYQASA-N 433.474 4.028 10 10 IICE C[C@H]1CCc2ccccc2[C@@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1637301321 WBBGTCJLFPEPTG-LHSJRXKWSA-N 442.562 4.308 10 10 IICE Cc1cc(CCNC(=O)NCCc2ccc3c(c2)OCCCO3)c(C)n1-c1ccccc1 1637411086 WWSXCNAQDKFBGY-UHFFFAOYSA-N 433.552 4.340 10 10 IICE CCN(Cc1cc(Br)ccc1O)Cc1cc(Br)cnc1OC 1641893029 WNJVGZYWSZSRJC-UHFFFAOYSA-N 430.140 4.343 10 10 IICE Cc1cc(C(=O)COc2ccccc2S(N)(=O)=O)c(C)n1-c1ccc(C(C)C)cc1 1643770638 LEBHTVGPSXLPPD-UHFFFAOYSA-N 426.538 4.127 10 10 IICE CCOC(=O)c1sc([C@H]2CCN(Cc3ccc(N4CCC(OC)CC4)cc3)C2)nc1C 1644349378 WTVIIJMEZTUSJG-IBGZPJMESA-N 443.613 4.233 10 10 IICE C[C@@]1(NC(=O)/C=C/c2ccc(O)c(O)c2)CN(Cc2ccccc2)C[C@H]1c1ccccc1 1645813045 JJSHUEVJUPJNGB-HFRKSLPGSA-N 428.532 4.286 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](N(C)Cc3ccc(N4CCCCC4)c(C)c3)C2=O)c1 1653713394 YJKDCOYOSMFSAM-RUZDIDTESA-N 437.584 4.240 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)c2nccnc2C)sc(C)c1-c1ccccc1 1654711282 CXJAEPWNYZHYAG-OAHLLOKOSA-N 438.553 4.288 10 10 IICE CC(=O)N1CCc2cc(S(=O)(=O)N(Cc3ccccc3O)C3CCCC3)c(Cl)cc21 1660451216 DWDNOTJPAVPPFE-UHFFFAOYSA-N 448.972 4.088 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(C(F)(F)F)cc3C)CC2)cc1F 1671687763 CCJAPWGZPFFWLZ-UHFFFAOYSA-N 425.426 4.193 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)C1CCC1 1693003812 MCAOWGAGSGNUPI-UHFFFAOYSA-N 443.393 4.447 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1693937247 PAACTXLEEUCOLQ-RXFWQSSRSA-N 448.615 4.374 10 10 IICE CN(CCOC(C)(C)C)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1696829965 ABDUBKJMNXHCFW-MRXNPFEDSA-N 439.651 4.410 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCN1C(=O)OC(C)(C)C 1706280528 FQAZIVQLVMEWCC-GOSISDBHSA-N 429.565 4.143 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCO[C@@](C)(C(C)(C)C)C2)cc1F 1729330221 VDUDEBVXIHBGNZ-HYBUGGRVSA-N 445.583 4.024 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)/C2=C/c2ccc(O)c(OC)c2)cc1 1865675509 LOLHJNMKXXWROI-FYJGNVAPSA-N 432.451 4.379 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)n1sc2ccccc2c1=O 1874179103 NQERAAQBPWWLAV-ZDUSSCGKSA-N 428.469 4.038 10 10 IICE C[C@@H](C(=O)Nc1ccc(N)cc1)N(CCCNC(=O)OC(C)(C)C)Cc1ccccc1 1999434447 LTMGFYXRTOPYEB-SFHVURJKSA-N 426.561 4.013 10 10 IICE CN1CCCc2cc([C@@H](O)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999524188 WJEMGBBYPICRJE-JTHBVZDNSA-N 426.557 4.213 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)[C@H](C)c1ccccc1O 2060114829 GZOUKNYHEFYYBB-KGVIQGDOSA-N 442.556 4.410 10 10 IICE CN(C)C1=NC(=O)/C(=C2/C(=O)N3c4c2cccc4[C@](C)(c2ccccc2)CC3(C)C)S1 2185889190 IYHAOEREACNPBD-CSJPXGCCSA-N 431.561 4.424 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@@H]32)c1O 14459687 AFGIGDYJTCHWBK-IUKKYPGJSA-N 440.565 4.402 10 10 IICE CCOC(=O)c1cccc(-c2ccc(C=C3C(=O)OC(C)(c4ccccc4)OC3=O)o2)c1 59567558 ONVHAVSMRDIMLW-UHFFFAOYSA-N 432.428 4.480 10 10 IICE COc1ccc(-c2ccc(/C=C3/C(=O)N(c4ccc(C(=O)O)cc4)N=C3C)o2)c([N+](=O)[O-])c1 100316438 CEZYHUNXQSPGPL-YBFXNURJSA-N 447.403 4.368 10 10 IICE NC(=O)c1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)cc1 111084584 AIISUIZVVYZHBT-UHFFFAOYSA-N 447.560 4.061 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccc(O)cc3)SC2=S)cc1 210717729 YHYPBORGOOYFBP-QGOAFFKASA-N 428.535 4.021 10 10 IICE Cc1noc(C[C@H]2CCOC3(CCN(C(=O)c4ccc(-n5c(C)ccc5C)cc4)CC3)C2)n1 575546777 ZDBBSMKDHIZCOT-OAQYLSRUSA-N 448.567 4.430 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@@H]2CN(Cc3ccccc3)C[C@H]2C1 705620108 NRPWCQFWSGDKJW-PMACEKPBSA-N 426.402 4.269 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sccc3SC(F)F)cc2F)CC1 730498789 ZBPFUWWOVRKFIA-UHFFFAOYSA-N 429.533 4.274 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)c1 734014833 FBMXDSABCKBPKZ-GOSISDBHSA-N 439.339 4.169 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H]2CCC3(CCOCC3)[C@@H]2O)cc1 802244425 URBGUTCRFCHHNR-WZONZLPQSA-N 436.556 4.466 10 10 IICE CCN(C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(OC)c(OC)c1 1124885655 ALUQGXZFWIRDAE-UHFFFAOYSA-N 435.568 4.478 10 10 IICE CC[C@@H](C)Oc1ccccc1/C=C\C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549038 BBRCMLHDIOIPMF-XZVRFQMRSA-N 430.495 4.308 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3csc(Cc4ccc(Cl)cc4)n3)C2)cc1 1130826646 GALZCSPLRMMBMZ-QGZVFWFLSA-N 427.957 4.405 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCc3ncc(-c4ccc(Cl)cc4)o3)C2)cc1 1130826926 NLNKLFXHHRFRQW-GOSISDBHSA-N 425.916 4.331 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N(C[C@H]2CCN(Cc3ccccc3)C2)CC(F)(F)F)cc1 1137032468 PNZPZWZSRCILHO-KRWDZBQOSA-N 447.461 4.376 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)c2cccc(O)c2O)[C@@H](c2ccccc2Cl)C1 1138981236 VYHMANQGPIURTL-QGZVFWFLSA-N 432.904 4.185 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)[C@@H]1SC 1143121186 BADINUHOTZZBML-QRVBRYPASA-N 437.403 4.495 10 10 IICE Cc1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c(-n2cc(Cl)cn2)n1 1154391094 OVHMEWLIDVTBKG-UHFFFAOYSA-N 447.926 4.379 10 10 IICE COC(=O)c1cnc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C(F)(F)F)c1 1162205927 LAVSVFKXYPZAER-CHWSQXEVSA-N 441.425 4.252 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCNC(=O)[C@H]3c3cccs3)cc2Cl)C1 1227207229 FACSRQKZKPQBPX-FOIQADDNSA-N 447.004 4.021 10 10 IICE CCc1nc2c(s1)[C@@H](N(C)C(=O)NC[C@@H]1CCN(c3ccc(OC)cc3)C1)CCC2 1252114324 CLOANBYASMHARK-JXFKEZNVSA-N 428.602 4.259 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(Br)ccc2O)cc1 1292381805 IUHVNWUUGNRWMD-GOSISDBHSA-N 433.346 4.042 10 10 IICE COCC1(CCn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCC1 1301107083 KYXOTZNAVPJEHI-UHFFFAOYSA-N 441.620 4.081 10 10 IICE CS[C@@H](C)Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1302551974 BJMPUWOONZEJBY-ICSRJNTNSA-N 429.634 4.160 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1314270684 BVZGBIIHIFHQQM-JOCHJYFZSA-N 434.588 4.240 10 10 IICE Cc1cc2occ(CC(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)c2cc1C(C)C 1439315627 WNXQSZJMCJJZEV-UHFFFAOYSA-N 447.579 4.425 10 10 IICE Cc1cc(Br)c(CC(=O)NCc2ccc(N3CCSCC3)cc2)s1 1441632572 REQILMTVTHXVJW-UHFFFAOYSA-N 425.417 4.231 10 10 IICE Cc1ccccc1C1(NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCC1 1460330501 FUBIRNCBGWZLFH-PMACEKPBSA-N 439.575 4.033 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2C)c1 1468017797 PAGSUVMFKBFSKG-RBUKOAKNSA-N 447.501 4.194 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)c1ccc(N2CCCNC2=O)cc1 1468514575 FONNAJAHDYGQGR-SFHVURJKSA-N 444.535 4.317 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(-c2ccccc2C(F)(F)F)on1 1470448194 XWWUYFJCYRDKPZ-UHFFFAOYSA-N 445.441 4.252 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[C@H]1COCCO1 1500373183 DNBMHBIAPQFEKM-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCOC1CC(CCn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)C1 1502935088 NXRKAXDZWSVLOZ-UHFFFAOYSA-N 441.601 4.181 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCCSC3)CC2)cc1 1504292870 UQGRFRYDAPBHQJ-IBGZPJMESA-N 443.661 4.444 10 10 IICE C[C@H]1CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C[C@@H](C)S1 1512486751 NLSDRDPYZRUWPU-IYBDPMFKSA-N 446.671 4.233 10 10 IICE CCC1(Cn2c(C(=O)Nc3ccccn3)nnc2N(C)Cc2ccccc2O)CCCC1 1513603381 LCISDUAHHRQTIO-UHFFFAOYSA-N 434.544 4.238 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(=O)NC)CC1 1514465661 WOWQMPDJKKORAT-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cc(Br)c3nccnc3c2)C2CC2)cc1 1526187176 YZKSRIOUZSABDS-UHFFFAOYSA-N 425.330 4.263 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(Br)cc(N2CCCC2)c1 1532655575 NAIIJSQDGNOTFG-UHFFFAOYSA-N 430.346 4.155 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)oc2ccc(Br)cc12 1536924131 DDNBWGHNGTUOAN-UHFFFAOYSA-N 442.357 4.186 10 10 IICE CC(=O)CCc1ccc2oc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c(C)c2c1 1537477557 CYRIINGMVPCRHR-QHCPKHFHSA-N 435.568 4.362 10 10 IICE C[C@H]1CCC(F)(F)CN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1540141153 WMFMVOAVQKPHHM-GVIGZQTCSA-N 430.567 4.376 10 10 IICE CCOC(=O)[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1542488998 VRDVLWNVWIWLRS-IBGZPJMESA-N 433.346 4.414 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2CCN(c3cccc(F)c3)CC2)cc1 1544030960 LMWZXDYKBMCDPQ-UHFFFAOYSA-N 433.527 4.373 10 10 IICE CCn1cc([C@H](O)CN(Cc2ccccc2)Cc2ccc(N3CCC(OC)CC3)cc2)cn1 1559747166 VATUUXSSOLQDNR-HHHXNRCGSA-N 448.611 4.254 10 10 IICE CCc1ccc(C(C)(C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1566215435 KRNUUUFMUUBLFF-UHFFFAOYSA-N 444.578 4.482 10 10 IICE Cc1cc(C(=O)N2CCN(c3ncccc3[N+](=O)[O-])CC2)c(C)n1-c1cccc(Cl)c1 1570092383 OLCNUEXVQKTTCI-UHFFFAOYSA-N 439.903 4.013 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@H]3c3ccc(Br)cc3)C2)cc1 1585665305 QDTRSHBPUZTLFC-GQWLDOHISA-N 429.358 4.204 10 10 IICE CCC(O)(CC)Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1613669401 HXOYCOUFLGSZGI-UHFFFAOYSA-N 441.620 4.212 10 10 IICE CCO[C@H](CCn1c([C@H]2CCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1616101338 RRGOCAZBNQZYAX-RBBKRZOGSA-N 428.577 4.109 10 10 IICE Cc1cc(C(=O)N[C@@H](CCC(C)(C)C)C(N)=O)c(C)n1-c1ccc(Br)cc1 1626298913 DQKDGUFNNPBHQR-SFHVURJKSA-N 434.378 4.267 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(C(=O)c3ccccc3)c[nH]2)cc1 1627205383 PWOGJSGILZUCHE-QHCPKHFHSA-N 431.536 4.133 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1631425332 CCIYBMKQNMVFLL-FQEVSTJZSA-N 444.959 4.395 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)COc2cccc(C(F)(F)F)c2)cc1 1631607804 HIWICSWHJLIGOG-OAQYLSRUSA-N 436.474 4.358 10 10 IICE COC(=O)[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(C)c(C)c1 1633608633 YEEIRJFXYUCYRB-DEOSSOPVSA-N 432.520 4.476 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](c3ccccc3)[C@H](O)c3ccccc3)C2)cc1 1636853918 NSKIGOZBKYKNIK-IEZKXTBUSA-N 431.536 4.048 10 10 IICE Cc1cc(C(=O)Nc2cccc(CN3CCCS3(=O)=O)c2)c(C)n1-c1ccc(F)cc1 1640271604 PPVWQRUBHIQPFR-UHFFFAOYSA-N 441.528 4.021 10 10 IICE O=C(Nc1nc(-c2c[nH]c3ncc(Br)cc23)cs1)c1c(F)ccc(O)c1O 1641748374 BOMHBAACCFFJBP-UHFFFAOYSA-N 449.261 4.252 10 10 IICE Cc1cc(C)n2c(SCC(=O)c3cc(C)n(-c4ccc(Cl)cn4)c3C)nnc2n1 1651616735 AOSNGHFQJUPYKN-UHFFFAOYSA-N 426.933 4.172 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@@H](CC3CC3)c3ccccc3)cc2F)C[C@@H](C)O1 1658037657 HBQNEIXHPDBWRI-GLDPYIMESA-N 439.575 4.187 10 10 IICE CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)o1 1684280788 QKPVWBFNEWBZNU-JPYJTQIMSA-N 425.573 4.486 10 10 IICE Cc1cc([C@@H]2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)C2)c(O)cc1Cl 1685686641 NWMIASYWBXJMKF-XMSQKQJNSA-N 445.007 4.222 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC(Cc2ccccc2C(F)(F)F)C1 1687155559 QPXQCTUIGSHOKZ-UHFFFAOYSA-N 447.501 4.051 10 10 IICE CCNC(=O)C1(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CC)CCC1 1695920052 KYQBEACIFIVUBT-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3[C@H]3CCC[C@@H](C(F)(F)F)C3)CC2)cc1F 1697471467 BURGCRKMOAVWFH-WBVHZDCISA-N 441.473 4.354 10 10 IICE COc1ccccc1CN(C)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1697595589 ROUPLHWZWJKYFH-QGZVFWFLSA-N 445.614 4.066 10 10 IICE CCO[C@@H](CCn1c(C(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)C(C)C 1710401068 SOPBPOZGCVEPQG-NRFANRHFSA-N 447.599 4.327 10 10 IICE C[C@@H]1N(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCOC1(C)C 1726759637 BAYRWQDJVFKTTN-HOTGVXAUSA-N 437.635 4.162 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(=O)C1CCC1 1728271577 OAWRMFRVYUXCSQ-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CS[C@H](C)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1731043224 PGIOXRLFDRFTIX-LJQANCHMSA-N 436.629 4.252 10 10 IICE Cc1cccc(-c2nnc(N3CCO[C@H](C(C)(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1751623562 QVMSSNPAPWQWPS-QHCPKHFHSA-N 448.615 4.323 10 10 IICE C[C@@H]1CCCN(CCCCn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752174929 OGSVRFZPFJHNRR-IFMALSPDSA-N 441.620 4.026 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N3CCO[C@H](C)C3)cc2)CC1 1762950287 QPPPEGUFUJYCKO-HXUWFJFHSA-N 425.621 4.376 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3cccc(Br)c3O)CCC[C@@H]12 2087283118 VBQQKEBABXIVNR-OXQOHEQNSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)NCC1CC2(C1)CC(NCc1cccc(Br)c1O)C2 2108259180 PTSPXUVZCULOKO-UHFFFAOYSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](C2CC(NCc3cc(Br)cc(F)c3O)C2)C1 2280151184 DRSOJPHGVVPYQL-FUJMWEONSA-N 443.357 4.419 10 10 IICE CCOc1ccc(NC(=O)CN2C(=O)SC(=Cc3cc(C)n(CC)c3C)C2=O)cc1 2293999038 RKTLIQIWBRAYEZ-UHFFFAOYSA-N 427.526 4.199 10 10 IICE COc1ccc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)c(OC)c1 2321647227 IELDEHHJMKYMOT-UHFFFAOYSA-N 431.564 4.436 10 10 IICE COc1cc(C=C2SC(=S)N(CCc3ccc(F)cc3)C2=O)cc(OC)c1OC 2323858620 UJCYEWGASFAVLR-UHFFFAOYSA-N 433.526 4.295 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC(C)(C)N2C(=O)OC(C)(C)C)c(O)c1Br 2381131274 LLXQQWVSOBOTND-AWEZNQCLSA-N 441.366 4.257 10 10 IICE CCCCCN1C(=O)/C(=C\c2c(N3CCCCC3)nc3ccccn3c2=O)SC1=S 33468500 DRISZKNJQGSWKZ-BMRADRMJSA-N 442.610 4.076 10 10 IICE COC(=O)CCCN1C(=O)/C(=C/c2ccc(OCCc3ccccc3)cc2)SC1=S 40938628 LBJFYOCDWMQAJA-SILNSSARSA-N 441.574 4.463 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccccc2F)SC1=S)c1ccc(Br)cc1 40940409 RUCQGECDUAYSRS-NTEUORMPSA-N 437.315 4.134 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)c1OC 526175741 HPNUDNUISNJTJA-OAQYLSRUSA-N 437.423 4.311 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2nccn2Cc2ccccc2)C1 561858541 OATXKMPGALWTIY-UHFFFAOYSA-N 427.552 4.291 10 10 IICE CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 745649772 XQNDRYVLGRACIK-QHCPKHFHSA-N 431.527 4.210 10 10 IICE CCC(C)(C)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1 752222826 RMOIANRMORMSRH-OAQYLSRUSA-N 436.600 4.075 10 10 IICE CC(C)C(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768868666 PLOULUUJZBQDAO-UHFFFAOYSA-N 449.599 4.135 10 10 IICE CCOC(=O)C[C@@H]1C[C@H](OC)CN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 775971940 AYJJWAMWIKVEFD-PMACEKPBSA-N 438.528 4.351 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cnn(Cc2ccccc2)c1Cl 795330021 VKNQEYSDQWKEOI-UHFFFAOYSA-N 426.973 4.068 10 10 IICE CC(C)C(=O)c1ccc([C@H](C)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 801915722 MWRYIRRAKGXMOO-KRWDZBQOSA-N 426.532 4.045 10 10 IICE Cc1cccc([C@H](NC(=O)NCc2cc(Br)ccc2O)c2ccccn2)c1 807046807 JHSZVTBNJMMDFI-FQEVSTJZSA-N 426.314 4.447 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O 1139123189 DXIXAZFCBUVIPR-LJQANCHMSA-N 445.357 4.337 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCCc1ccccc1 1168942711 YPSMDWNYXNFIQP-SFHVURJKSA-N 426.516 4.354 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1O 1191711026 GGXSHMPESXEWEW-UHFFFAOYSA-N 440.849 4.225 10 10 IICE C[C@@H](NC(=O)N[C@H](CCO)c1cccc(OC(F)(F)F)c1)c1ccc(N(C)C)cc1 1226646579 CAFXOMMYBHALFB-AUUYWEPGSA-N 425.451 4.135 10 10 IICE COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1233603433 DKVPKCBAOPKBIL-YADARESESA-N 437.584 4.339 10 10 IICE CCC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc(C)n(-c2ccccn2)c1C 1296254265 LJPOTGXJDMECDH-IBGZPJMESA-N 426.561 4.351 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1 1299438832 GHRYHCKHARONKF-NQIIRXRSSA-N 439.556 4.330 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCSC3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1304189581 NYMOBFAIDLRFRB-FQEVSTJZSA-N 439.629 4.455 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C[C@@H]3OCc4cc(Cl)ccc43)cc2F)C[C@@H](C)O1 1350931713 BVFNOCAPIWFPHW-HLFMIMNKSA-N 432.923 4.371 10 10 IICE Cc1cccc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1I 1353910013 DVIBWDLVQRCSIC-UHFFFAOYSA-N 434.321 4.472 10 10 IICE Cn1cc(CCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc21 1361062931 ILWCSPFOPLQFHV-GOSISDBHSA-N 427.495 4.498 10 10 IICE COc1ccc(CN2CC[C@@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2=O)cc1 1458181369 IJPCVZDXHONMQP-HSZRJFAPSA-N 445.475 4.047 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3sc(COc4ccc(F)cc4)nc3C)C2)cc1 1461498206 YEJVLCQWDXBUAL-QGZVFWFLSA-N 441.528 4.187 10 10 IICE CN(c1ccc(CNC(=O)CN2C(=O)C(F)(F)Oc3ccccc32)cc1)C1CCCCC1 1464540906 RKHPLBRLOIKYOF-UHFFFAOYSA-N 443.494 4.090 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1469683748 IMZJXPXDCYGZFK-HNNXBMFYSA-N 446.693 4.096 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCC3(CCOCC3)O2)c(C)n1-c1ccc(Br)cc1 1472174525 XKKPMYOXBAJNJZ-LJQANCHMSA-N 447.373 4.315 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC(N(CC)CC)CC2)cc1 1501839641 UQSUJXTXKCMINK-UHFFFAOYSA-N 449.647 4.478 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C(F)(F)F)O[C@H](C)C2)n1CCCSc1nccs1 1509156660 JSGSVFGNSBZCBB-KGLIPLIRSA-N 449.568 4.272 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCN(CCC(C)(C)C)CC2)cc1F 1517003916 SRJZKPORARJTGH-UHFFFAOYSA-N 442.627 4.042 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@@]1(O)CCCC1(C)C 1517146019 DFFYTHHXJCZRKN-QHCPKHFHSA-N 426.586 4.214 10 10 IICE CC(=O)c1ccsc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1527076081 HZVCDHDBYAIGLY-GDNBJRDFSA-N 434.539 4.320 10 10 IICE CC(C)(C)c1ccnc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1539344122 TVFHFLAACRFBEF-QINSGFPZSA-N 444.557 4.143 10 10 IICE CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1539911724 CGCLAOHXCIVOPT-FGSXEWAUSA-N 449.039 4.413 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2F)n1 1540543177 CILCFQNWYWJCEA-UHFFFAOYSA-N 437.475 4.182 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)NC3CCCCC3)CC2)c1 1542629232 JPCGYFMCHLGKTE-UHFFFAOYSA-N 435.568 4.208 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1CCCCN1Cc1cccc(F)c1 1544408805 IUUZEUBMHYGSJI-HSZRJFAPSA-N 427.589 4.050 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3cccc(-c4cccc(C)c4)c3)cc2)CC1 1556199352 IQTKKYWUOKQOIQ-UHFFFAOYSA-N 427.548 4.261 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4F)C3)c2C)c1 1587880547 DEGGRYRJKOJINW-LJQANCHMSA-N 437.490 4.350 10 10 IICE Cc1ccc(C(=O)N2CCC([C@](C)(O)C(F)(F)F)CC2)cc1-n1c(C)cc(C=O)c1C 1611137703 RLAQGSPWGFAPMY-QFIPXVFZSA-N 436.474 4.381 10 10 IICE Cc1ccccc1-c1nnc(N2CCC(CO)CC2)n1CCCSc1nccs1 1612267093 QNTWIFHUUZBFJZ-UHFFFAOYSA-N 429.615 4.101 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@H]2c2cncc(Br)c2)c([N+](=O)[O-])c1 1612954888 HKIGVWZOSLOMPN-YERXGYGTSA-N 432.274 4.280 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1613554048 RXHDWWKXLWFUNW-OXQOHEQNSA-N 444.599 4.075 10 10 IICE CC(C)Oc1cccc(CN(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1616905688 OVFOBNABCRWNPF-UHFFFAOYSA-N 442.515 4.320 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCNc2ncc(Cl)cc2Cl)cc1 1625742117 XUGKZVJUAQZEFO-UHFFFAOYSA-N 445.350 4.379 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C 1629969639 YZJFGJGXHSTLGZ-BBRMVZONSA-N 441.366 4.149 10 10 IICE Cc1csc(CNc2cccc(C(=O)NCc3cccc(Br)c3O)c2)n1 1634725016 NSOLLVCYFNKTFD-UHFFFAOYSA-N 432.343 4.462 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(CC(=O)NCc3cccc(Cl)c3O)cccc2C1 1637232080 IPHNSRNCCHJZBC-UHFFFAOYSA-N 430.932 4.198 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@@]1(C)CCNC(=O)C1 1638240763 GWVYFJNPBHWMCR-GCJKJVERSA-N 433.474 4.214 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c(O)c(C(C)C)c1 1638488354 GAXIWCGQWWBRLC-UHFFFAOYSA-N 437.584 4.271 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4)c3C)C2=O)c(C)c1 1643806375 RUYRJXMAFMHPAL-SANMLTNESA-N 429.520 4.361 10 10 IICE CCOC(=O)c1nn(CC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)c2ccccc2c1=O 1651807325 DYFADWLNZUCEBB-UHFFFAOYSA-N 443.503 4.172 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3cccc(C)c3)c3ccccn3)CC2)c(OC)c1 1681007802 JUZHDIGNWFGZIP-RUZDIDTESA-N 446.551 4.028 10 10 IICE COC[C@H](NC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)c1cccc(Br)c1 1682102207 YKWCQAZGMDLCOF-IERDGZPVSA-N 448.405 4.441 10 10 IICE C[C@H]1SCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)[C@@H]1C 1693877652 SHWXNSZQUQQAIG-HUUCEWRRSA-N 432.644 4.309 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC(COC)CC2)cc1 1695622931 AVTFUMZWARBVER-QHCPKHFHSA-N 441.620 4.277 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1707254444 XCOLJXXCCNFZBZ-INIZCTEOSA-N 434.510 4.301 10 10 IICE CN1CCCc2cc(Cn3c(N(C)CCC4CCOCC4)nnc3C(C)(C)C)ccc21 1711278261 AEMQMBJUMOKZOI-UHFFFAOYSA-N 425.621 4.259 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CC(C)(C)CN1CCCC1 1747753030 BARLFFDQZKINJD-UHFFFAOYSA-N 439.629 4.394 10 10 IICE CC(C)Cc1nnc(N(C)CCc2cnccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1750712605 JDRMVEJHMBLZGM-UHFFFAOYSA-N 447.631 4.230 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)Cc2c(C)noc2C)cc1 1764934676 ZWLPHTUBZKYLEV-UHFFFAOYSA-N 447.587 4.419 10 10 IICE C[C@H](Oc1cccnc1NC(=O)Oc1ccc(N)cc1)C(=O)Nc1ccc(Cl)cc1 1858685315 LCTDFLUPIFRCLT-ZDUSSCGKSA-N 426.860 4.334 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C)sc(C)c1-c1ccc(Br)cc1 1866208304 NHGMBNLCEZBXLJ-UHFFFAOYSA-N 425.348 4.163 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3cccc4c(Br)n[nH]c34)cccc21 1866212195 JTSYZJXTPZSJLE-UHFFFAOYSA-N 446.260 4.353 10 10 IICE COC(=O)c1ccc(C=C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)cc1 2296652627 KVSGULIWADGJLQ-UHFFFAOYSA-N 427.416 4.216 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3cccc(O[C@@H](C)C(=O)O)c3)SC2=S)c1 2314932405 VPTUKLDPWHTETC-ZDUSSCGKSA-N 427.503 4.147 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](C)CCCNC(=O)OC(C)(C)C)c(O)c1Br 2380760084 UNRFNLACKRIDSB-AWEZNQCLSA-N 443.382 4.363 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(NC(=O)OC(C)(C)C)CCC[C@@H]2C)c(O)c1Br 2381141882 FYAYIETURILUFQ-RNODOKPDSA-N 441.366 4.163 10 10 IICE COC(=O)[C@@H](C)N1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S 34860202 ORPCSXKGDSGQEN-ONDHQXCVSA-N 443.546 4.037 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C\c2ccc(OCCc3ccccc3)cc2)SC1=S 206842630 AIAUHAFIHLKSDP-CAPFRKAQSA-N 441.574 4.463 10 10 IICE O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccnc1)N2 226897083 HEPZVZBTBUTURQ-OTNCWRBYSA-N 431.561 4.429 10 10 IICE C[C@@H](NC(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1)c1ccc(N2CCOCC2)cc1 750625082 NKDJUGHNTKZWGJ-ILHIWHGASA-N 441.475 4.033 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(c2ccccn2)CC1 754663162 PEXYIACIKKWDEN-GOSISDBHSA-N 430.499 4.241 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(Cc3c(O)ccc4c(=O)c(-c5ccccc5)c(C)oc34)[C@H]2C1 754800043 UJTTZSWBAOHIFP-JZWVFAODSA-N 435.520 4.242 10 10 IICE COc1cc(OC)cc(N2CC[C@H](CN[C@H](C)c3ccc(Br)cc3O)C2)c1 756648938 BIDWIVUGLFOHRW-HUUCEWRRSA-N 435.362 4.349 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2/SC(=S)N(CCc3cccnc3)C2=O)cc1 764886782 SUYNPRLRLMQSHW-QGOAFFKASA-N 426.563 4.481 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 793801402 VIIBNCCRMGBGKX-OAHLLOKOSA-N 426.513 4.147 10 10 IICE CCCc1c(NC(=O)NCc2ccc(OC)cc2O)cnn1-c1cc(F)c(OC)cc1F 797683750 PZVSHDPCPOKFDJ-UHFFFAOYSA-N 446.454 4.148 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCC1CC(c3ccccc3)C1)c2[N+](=O)[O-] 801722728 OFTBOLDXVIJPRP-UHFFFAOYSA-N 440.455 4.294 10 10 IICE COc1cccc(N2C(=O)/C(=C\c3ccc(I)o3)SC2=S)c1 917643265 YGEUBXAWYLCUDK-XYOKQWHBSA-N 443.287 4.299 10 10 IICE Cc1cc(C(=O)Nc2c(Cl)ccc3nonc23)nn1-c1ccc(Br)cc1 1117548801 WFWUCUNPUOIOPN-UHFFFAOYSA-N 432.665 4.385 10 10 IICE COCc1nc(C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c(-c2ccccc2)s1 1130185928 WNGJUAYDQZQVPU-KRWDZBQOSA-N 437.565 4.221 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)C2)cc1 1130826922 NIQGHQXMBYFHLM-KRWDZBQOSA-N 433.464 4.404 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccnc(F)c1F 1131428820 JZTYQJVJHQOOLQ-FMIVXFBMSA-N 425.507 4.041 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cccc(S(=O)(=O)C(F)F)c3)c2C)c1 1132044155 QLFYYVLVEHIIHG-UHFFFAOYSA-N 432.492 4.329 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(F)cc2Br)cc1 1136480288 HUXTWGRGSFVODJ-FQEVSTJZSA-N 449.364 4.405 10 10 IICE Cc1onc(-c2cccs2)c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150352867 BFESGEIWDMLBGR-MRXNPFEDSA-N 431.945 4.465 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)cc1 1152988825 NXHIGDXIAKPRSS-XMMPIXPASA-N 437.971 4.239 10 10 IICE C[C@H](N[C@H](CF)c1ccc(F)cc1)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1197135210 IMJMKPNTDOSCSB-RCDICMHDSA-N 434.442 4.229 10 10 IICE COc1ccc(CN2CC[C@H]2CNC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1 1253283710 WBLJTASIWUTXMV-DEOSSOPVSA-N 436.600 4.101 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3C[C@@H](c4ccccc4)[C@@](F)(CO)C3)c2C)c1 1254073431 IBRCZSBAZSBESX-AHWVRZQESA-N 435.543 4.412 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCc1ccc2c(c1)OC(F)(F)O2 1294684292 FMCIJMIAUGXOPI-UHFFFAOYSA-N 442.256 4.458 10 10 IICE C[C@@H]1N(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCOC1(C)C 1305244975 YHDYCHUCHGKLTI-INIZCTEOSA-N 443.592 4.188 10 10 IICE CC[C@@H](C)CN(CC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1305611482 WBTVWCUKMGYXSJ-OFNKIYASSA-N 441.620 4.277 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1[C@@H]1CCC[C@H](C(F)(F)F)C1 1314750903 MTYQFLKEXALDKQ-JKSUJKDBSA-N 432.450 4.371 10 10 IICE Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1352634126 BZMZJCVALOPXDX-YVLHZVERSA-N 445.497 4.272 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CN(Cc4ccccc4)CCO3)cc2Cl)C1 1436046197 AVUKQKYGVWZOPT-DVECYGJZSA-N 442.003 4.094 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(c3ncccc3F)C2)c(C)n1-c1ccc(Cl)cc1 1457701624 WPCBDBIRPAFYBR-IBGZPJMESA-N 426.923 4.219 10 10 IICE COC1CCN(c2ccc(CN(C3CCC3)C3CN(C(=O)OC(C)(C)C)C3)cc2)CC1 1460361443 IBUQQDGUBPLMQC-UHFFFAOYSA-N 429.605 4.276 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4C(=O)OC(C)(C)C)ccc21 1472244974 DPDBDIRHEJIUHT-UZKOGDIHSA-N 441.572 4.175 10 10 IICE COc1cc(OC)c(C[C@H](C)NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c(OC)c1 1478667819 VCDYDUHUKHZIKS-SFHVURJKSA-N 441.572 4.085 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccn3)n2Cc2ccc(N(C)C)cc2C)n1 1492500117 QPQXKUSTZZRQGY-UHFFFAOYSA-N 427.556 4.103 10 10 IICE COc1ccc(-c2nc(C)c(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)s2)cc1 1529404502 VJGUBQIZFUKVQT-KRWDZBQOSA-N 437.565 4.392 10 10 IICE CCN(CC)[C@@H](C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1)c1cccc(C(F)(F)F)c1 1531729989 OIFXTTYAHNIHNP-SIKLNZKXSA-N 449.517 4.492 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3F)n2)cc1 1540459850 ZHOPRHRJDGVVDL-UHFFFAOYSA-N 425.464 4.038 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1545410183 GDAZKRWOIWWVOC-WFXMLNOXSA-N 429.584 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)Cc2cccs2)cc1 1547443787 DGHDKIKTWFEBPC-UHFFFAOYSA-N 440.617 4.009 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCc3c(ccnc3O)C2)cc1 1547447011 MWYIPCQBCJEAOL-UHFFFAOYSA-N 448.615 4.425 10 10 IICE CO[C@]1(C)CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1554692705 ZHHUQNWPXAZVPK-ZJSXRUAMSA-N 445.583 4.169 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(Br)cc1N 1556426501 PFRKXOLORLXGSH-UHFFFAOYSA-N 448.361 4.034 10 10 IICE CSc1ccc([C@@H](CNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)N(C)C)cc1 1564814835 PYXYOSZQIIIRRF-HSZRJFAPSA-N 426.630 4.453 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnn(-c2ccc(Cl)cc2)n1 1566306800 VVJUBKQZQHGSMW-UHFFFAOYSA-N 435.709 4.051 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1614103448 QOGIHMWQCBIGIJ-FPOVZHCZSA-N 438.620 4.033 10 10 IICE Cc1cc(C(=O)NCc2ccnc(OCCN(C)C)c2)c(C)n1-c1ccc(Cl)cc1 1624327406 DANZOAYFYDLRTF-UHFFFAOYSA-N 426.948 4.013 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cccc(NCc4nc(C)cs4)c3)c2)CC1 1625671351 NQVWKLNZXWNEBI-UHFFFAOYSA-N 435.597 4.458 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])c4nsnc4c3)cc2Cl)C1 1626168851 HQCYYSGNSLYHRG-LBPRGKRZSA-N 445.932 4.419 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1 1626995292 OBZGMVFIVSWTPC-BXKMTCNYSA-N 438.568 4.418 10 10 IICE COCCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1628079807 PZLOJZUEIPHNJE-FQEVSTJZSA-N 426.479 4.229 10 10 IICE COc1ccc(F)c2[nH]c(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc12 1629055194 DKZVNGFLOODFTJ-ZDUSSCGKSA-N 433.430 4.316 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)c(-n4cccc4)cc3OC)CC2)cc1F 1631376800 AODVJCJBXQPJMG-UHFFFAOYSA-N 443.906 4.249 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)Cc1cccc(F)c1 1632807421 XQOHQGNTSPJIJJ-LJQANCHMSA-N 438.499 4.004 10 10 IICE COc1cc(N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)ccc1F 1633948751 VSKUJLHYSGMGEY-UHFFFAOYSA-N 449.526 4.325 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(C)(NC(=O)OC(C)(C)C)CC1 1636262964 KRBQJLXXJFKTHC-GOSISDBHSA-N 432.609 4.081 10 10 IICE C[C@H](CCO)n1c(C(F)(F)F)nc2cc(NC(=O)c3ccc(N=NC(N)=O)cc3)ccc21 1637005354 JMFBFWCLEYZELA-LLVKDONJSA-N 448.405 4.413 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@H](C)c3ccc4c(c3)CCCC4)CC2)cc1F 1657763980 ZCXMLTGQQITABT-MOPGFXCFSA-N 439.575 4.101 10 10 IICE COC(=O)C1CC2(C1)C[C@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)CCS2 1685660966 NFHDMUXGPXSJLG-IQJRZOLZSA-N 446.613 4.454 10 10 IICE Cc1cc([C@H]2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)C2)c(O)cc1Cl 1685686639 NWMIASYWBXJMKF-PGRDOPGGSA-N 445.007 4.222 10 10 IICE CC(C)NC(=O)c1nnc(N(C)[C@@H]2CCC[C@@H](C)C2)n1CCCSc1nccs1 1743021878 MGVAVKFOEYITFQ-HZPDHXFCSA-N 436.651 4.070 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](c3cnn(C)c3)C2)n1CCCSc1nccs1 1763598537 OVFXRIFWYBULSF-JKSUJKDBSA-N 431.635 4.158 10 10 IICE CC[C@H](C)CN(CC)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763880479 JGSOXYSZZARYJW-SFHVURJKSA-N 429.584 4.442 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)c2ccccc2C(=O)c2ccccc2)c2nccn2C)cc1 1865887642 SVJVBBFPXJXRRN-XMMPIXPASA-N 438.531 4.237 10 10 IICE CC[C@H](NCC1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]12)c1cc(Br)ccc1O 2087331294 ZMYHVLIPPBDIGL-ULQDDVLXSA-N 425.367 4.308 10 10 IICE CN(Cc1ccc(I)cc1)c1ccc(CO)c(Br)c1 2265598986 LWBVQQKURYWLMD-UHFFFAOYSA-N 432.099 4.182 10 10 IICE O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1ccc(-c2cccc(C(=O)O)c2)o1 2297311173 IHYWLSDTYNUGHP-UHFFFAOYSA-N 443.242 4.413 10 10 IICE CCN(CC)CN1C(=O)C(=C2SC(=S)N(c3ccccc3C)C2=O)c2ccccc21 2313621523 ONVUYJCLTWPOMR-UHFFFAOYSA-N 437.590 4.417 10 10 IICE CC(NCCSCc1[nH]cnc1C)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 2313682768 KIHIZGBIOGSSQE-UHFFFAOYSA-N 449.555 4.405 10 10 IICE C[C@H]1Oc2ccc(-c3csc(NS(=O)(=O)c4ccc(Cl)cc4)n3)cc2N(C)C1=O 11857483 HMGGENJJZHCPQY-LLVKDONJSA-N 449.941 4.008 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCC(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 15037518 BNCXCBWQQLRVNM-BOPFTXTBSA-N 448.953 4.284 10 10 IICE COc1ccc([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)c1 44546905 HBWFYRSPPHDDAH-QFIPXVFZSA-N 433.460 4.455 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1ccc2c3c(cccc13)C(=O)N(C)C2=O 101351073 WUZRJTDCYBDFKU-BKUYFWCQSA-N 438.487 4.401 10 10 IICE COC(=O)CCCN1C(=O)/C(=C\c2ccc(OCCc3ccccc3)cc2)SC1=S 206862003 LBJFYOCDWMQAJA-CAPFRKAQSA-N 441.574 4.463 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)NCc1ccc(N3CC=CC3)cc1)O[C@H](C)C2 740915401 PPVICHVWXNVLKW-FRGLQRNOSA-N 433.552 4.140 10 10 IICE C[C@H](Cc1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742754895 RNCSEKCGQQEYKW-GCJKJVERSA-N 425.573 4.313 10 10 IICE C[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1cn(-c2ccccc2)nn1 761787803 TYLGEWIWTSKLKK-LJQANCHMSA-N 444.539 4.399 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccnc(O)c2Br)cc1 770825430 TWMYHKGINJAOPA-UHFFFAOYSA-N 430.302 4.051 10 10 IICE O=C(NCCCSc1nccs1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1 781940304 VURMSZSMUATRSY-OAHLLOKOSA-N 431.505 4.427 10 10 IICE C[C@H](Nc1ccc(F)c(N2C(=O)CCC2=O)c1)c1ccc(N2CCOCC2)cc1Cl 797144986 POVBXQCDWNVWHL-AWEZNQCLSA-N 431.895 4.142 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1C[C@@H]1c1cccc(Br)c1 804733236 MVGOZBXYNOYLTH-CABCVRRESA-N 425.120 4.337 10 10 IICE O[C@@H](CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)CN1CCc2ccccc2C1 920091593 JPLSALVPSCYZRY-DNQXCXABSA-N 449.620 4.240 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N(C)Cc3ccc(N4CCCC4)cc3)C2)c1 1135800950 XJOHNTGZIAYGLS-QFIPXVFZSA-N 434.584 4.498 10 10 IICE CN1CCCc2cc(CNC(=O)Cc3ccc4c(c3)N(C(=O)OC(C)(C)C)CC4)ccc21 1136436883 NWQBZHJNCDFYCC-UHFFFAOYSA-N 435.568 4.226 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-c2cccc(C)c2)n1C 1137817655 DFUBLLKVUZLBKU-UHFFFAOYSA-N 426.900 4.175 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCn1c2ccccc2c2ccccc21 1142690743 NXPLARRNKQJAHB-UHFFFAOYSA-N 430.504 4.482 10 10 IICE CC1=CCN(c2nnc(Cc3csc(C)n3)n2CCCSc2nccs2)CC1 1290264642 PQDUZZFFSHTZHV-UHFFFAOYSA-N 432.644 4.429 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)[C@@H](CO)c2ccc(Cl)cc2)CCCC1 1298309875 GVWWLCJFYLDNLE-QHCPKHFHSA-N 426.944 4.374 10 10 IICE COC1(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCC(C)CC1 1299809277 NPHYCEKBUCPKFP-RKRRMPDFSA-N 428.577 4.109 10 10 IICE CO[C@@]1(C)CCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CC1 1315256361 MBCSZQPEMUONQK-UZLBHIALSA-N 437.635 4.164 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3ccccc3OC)n2CCCSc2nccs2)C1 1315912003 XZEDEGJRCDNQSO-MRXNPFEDSA-N 445.614 4.065 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)cc1 1444141741 DRZXUHMNZGIDIQ-QFIPXVFZSA-N 449.938 4.024 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cc(I)ccc3N)c2)CC1 1444425306 HCTLRMJGEQQGNA-UHFFFAOYSA-N 435.309 4.362 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(Cl)ccc1OC(F)F 1458020705 PRYFFCAYRSUQDZ-UHFFFAOYSA-N 449.929 4.403 10 10 IICE Cc1c(Br)cnn1CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1459584345 POENELQHFPNAEV-CYBMUJFWSA-N 439.785 4.160 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnnn1-c1c(Cl)cccc1Cl 1460983919 QTUMDRKUIIDXFP-CQSZACIVSA-N 432.355 4.310 10 10 IICE CC[C@@H](CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)N1CCc2ccccc2C1 1464099344 KPMVKGROBYVILP-VWLOTQADSA-N 429.564 4.473 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 1466289716 DPQUEJDGLVGTPU-RUZDIDTESA-N 446.547 4.363 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(c3nnc(C(F)(F)F)s3)CC2)c1C 1467229456 OZONAXCIECKNGZ-UHFFFAOYSA-N 449.502 4.235 10 10 IICE CCOc1cc(C(=O)N(C)C)ccc1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1517717072 UEBARUNEAGIDNX-UHFFFAOYSA-N 449.551 4.268 10 10 IICE CN(C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(Br)cn1 1534101304 VXOIKHRQAUNPEL-UHFFFAOYSA-N 446.345 4.414 10 10 IICE COC(=O)c1coc(/C=C\C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 1565655926 GZFSQKSZALPVHX-YPKPFQOOSA-N 434.492 4.387 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(Cc4ccccc4Cl)C3)cc2)CC1 1565662978 GISHUJHZCWGNDF-NRFANRHFSA-N 439.987 4.241 10 10 IICE Cc1ccc([C@@H]2C[C@H]2NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1585848108 RTYOWSOHDMWKMG-YFHHABKASA-N 440.565 4.398 10 10 IICE CCCCn1cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)n1 1586620049 RMGXKGPHKBDTND-OAQYLSRUSA-N 443.592 4.053 10 10 IICE C[C@@H]1CCCN(C(C)(C)Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)C1 1612775999 GMYAMWUAROGJAY-HXUWFJFHSA-N 448.615 4.116 10 10 IICE CCCc1noc2nc(C3CC3)cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c12 1616858498 NHICUYMWQYCPFX-JOCHJYFZSA-N 435.572 4.151 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N[C@@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1616947302 VRVNKLMQJSYRED-YWZLYKJASA-N 434.005 4.423 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCCc1ccccc1 1616958025 NZPSFDGUJYVDDK-SFHVURJKSA-N 426.516 4.354 10 10 IICE CC(C)(C)c1coc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1617017570 KGQLGHGMJOJVQB-GDNBJRDFSA-N 447.557 4.019 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)c1cc(Cl)cc(Cl)c1 1630261892 FSGBHTJNTYCOHH-QGZVFWFLSA-N 441.742 4.316 10 10 IICE COc1cccc(CNC(=O)c2cc(Br)c(C)cc2Br)c1O 1631539673 BDIYLHPBHKAHBI-UHFFFAOYSA-N 429.108 4.164 10 10 IICE COc1ccc(Oc2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)nc2)cc1 1632399085 NDBNRBKNBGLSSC-JOCHJYFZSA-N 434.492 4.410 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H]3CC(c4ccc(C)c(C)c4)=NO3)ccc21 1633764220 DDVALCISQSUHTG-JOCHJYFZSA-N 433.552 4.444 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1=CCN(C(=O)OC(C)(C)C)CC1 1635677112 XJNWCKNNPNSIJG-UHFFFAOYSA-N 439.350 4.070 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCSc3c(C)[nH]c4ccccc34)C2)cc1 1636353974 NIXFSVFLCRZEEM-GOSISDBHSA-N 438.597 4.403 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CC(=O)NCc2ccc3cccnc3c2O)c2ccccc21 1638573240 OGGCWISKIKJXDP-GOSISDBHSA-N 433.508 4.486 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cc1 1639923633 WBOPFJJGGJYNLE-SBUREZEXSA-N 438.568 4.275 10 10 IICE CC1(c2ccccc2)CCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1673472099 ALODNMGUIIQBRH-UHFFFAOYSA-N 429.511 4.065 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](c1ccccc1)c1cccc(F)c1 1674711952 DNIABVZUZZLILL-RUZDIDTESA-N 433.527 4.376 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3ccc(OC)cc3Br)C2)cc1 1680922000 PHHWXIDCDVHXMX-GJZGRUSLSA-N 448.361 4.105 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H](CNc4ccc(Cl)cc4)C3)C2)cc1 1683787772 QDUMHRAUTDJTHV-RXVVDRJESA-N 442.991 4.461 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](C)Cn3ncc4ccccc4c3=O)c2C)c1 1685748231 QXZBRLXLFJTZTD-GOSISDBHSA-N 443.551 4.000 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCCn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)C1 1726465420 RYRBERFWVYOULM-TXTKFYIRSA-N 441.620 4.230 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1726833898 SLBMAGONLZKPLT-KBMIEXCESA-N 441.620 4.068 10 10 IICE CCc1nn(C)c(CC)c1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)OC 1744501944 BMRIJCAQNKSWMN-UHFFFAOYSA-N 447.587 4.257 10 10 IICE CCCCN(CC)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1745452361 UKOCGIZPPBJHSB-OAQYLSRUSA-N 429.634 4.358 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1752696595 QAUOPSKSZBJCQZ-AZUAARDMSA-N 430.616 4.213 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)[C@H]2CCSC2)cc1 1764938196 GRLQZKHMWMCGTD-LEWJYISDSA-N 429.634 4.356 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)cc1 1860074928 ARXOHIFBXHMXSB-CPNJWEJPSA-N 444.553 4.479 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCC3)C(=O)N(Cc3ccco3)C2=O)cc1 1873165066 AOOYYVAADQUJOS-UHFFFAOYSA-N 429.520 4.499 10 10 IICE CCN1C(=O)C(Nc2cc(OC)cc(OC)c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422907 VMAJOMNCXMCJDI-UHFFFAOYSA-N 445.519 4.323 10 10 IICE O=C(NOCCCNCc1cccc(F)c1O)OCC1c2ccccc2-c2ccccc21 1928765341 ODBAYZDVENHENN-UHFFFAOYSA-N 436.483 4.481 10 10 IICE CN(C[C@@H]1CCN1C(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044762931 QPYSHYZVGNYFLJ-INIZCTEOSA-N 446.592 4.008 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNCc1cc(Br)ccc1O)CC(F)(F)F 2053667896 RSVFBZAGMYRVPP-LBPRGKRZSA-N 427.261 4.090 10 10 IICE Cc1c(C(C)C)nn(Cc2cc(Br)ccc2O)c1I 2079777312 QDSFWKJFBJSMBH-UHFFFAOYSA-N 435.103 4.436 10 10 IICE Oc1ccc(CNc2ccc(Cl)c(I)c2Cl)c(O)c1O 2150346766 MWBROGDPLAOEQY-UHFFFAOYSA-N 426.037 4.327 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCN(C(=O)OCc3ccccc3)C2)c1O 2220462563 NIKFVTVZRYIUNJ-INIZCTEOSA-N 449.345 4.054 10 10 IICE Cc1cccn2c(=O)c(C=C3SC(=S)N(C(C)C)C3=O)c(Oc3ccccc3)nc12 2296709089 SPZLIGOHWNFGIP-UHFFFAOYSA-N 437.546 4.405 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)cc1OC)C(=O)O 2314932154 LGGQKSMCROMSCL-OAHLLOKOSA-N 447.509 4.482 10 10 IICE Cc1ccc(CN[C@H]2CC[C@H]3C[C@H]2CN3C(=O)OC(C)(C)C)c(O)c1Br 2352932569 ORHGOJCRNSJNLE-JYJNAYRXSA-N 425.367 4.341 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CC[C@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2380760982 BYGBITGEVJTZOK-ZFWWWQNUSA-N 441.366 4.210 10 10 IICE CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)c1cc(C)n(-c2ccc(C)c(F)c2)c1C 8760846 LBPXZPPRJQYEPF-CFRMEGHHSA-N 448.494 4.445 10 10 IICE CC(C)(C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)NC(=O)CO4)cs2)cc1 11858042 SGWYOBHCGNOAGF-UHFFFAOYSA-N 443.550 4.239 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1c[nH]c3ccccc13)N2 14545095 BMMHOFXNJOFTPA-KRBQOJCGSA-N 449.576 4.452 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3ccc(OC)c(OC)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526145293 PEJJIKBRJGBIEV-QHCPKHFHSA-N 449.459 4.181 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SC[C@@H](O)COc1ccc(C)cc1 726856393 JOVWQKWDRXTTQV-SFHVURJKSA-N 426.538 4.182 10 10 IICE CC(C)N(C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C1CCOCC1 740789692 UTSZCQOEWKWJST-GHRIWEEISA-N 438.640 4.146 10 10 IICE COCc1ccccc1S(=O)(=O)Nc1nc(-c2c(F)cc(F)cc2F)c(C)s1 778660059 AQAVQDUAPOPFQW-UHFFFAOYSA-N 428.457 4.483 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)c([N+](=O)[O-])c1 782381280 ZQZZYBOGLWLBFX-VZJZHNIPSA-N 436.386 4.378 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)C12CC(c3ccccc3)(C1)C2 790351595 BIZAGXBWAUFRDD-UHFFFAOYSA-N 430.470 4.280 10 10 IICE C[C@H]1CN(Cc2ccccc2NC(=O)NCc2cc(Br)ccc2O)C[C@H](C)O1 806212898 FQTOSXJXGWQJEA-GJZGRUSLSA-N 448.361 4.086 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1 810075272 IVWOOWAAHGQDBP-OAQYLSRUSA-N 445.535 4.079 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@]2(CCCOC2)C1 812147948 OJYCSVNKXXHWKN-RUZDIDTESA-N 435.572 4.006 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)N1CCC(OCc2ccccc2)CC1 919802898 HMUALZWNZNXAAW-UHFFFAOYSA-N 430.495 4.248 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCc2ccc(F)cc21 1125965789 QPVWEYYYLTYNSD-PYJSORCASA-N 444.528 4.360 10 10 IICE O=C(C[C@@H]1CCC[C@@H](C(F)(F)F)O1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126583844 UUBDZKWYWUXVAI-JQFCIGGWSA-N 436.421 4.263 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4cc(F)ccc4F)CC3)ccc21 1126845796 CGHUVBMPWZGLIR-UHFFFAOYSA-N 427.495 4.145 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](C)[C@@H]3C(=O)OC(C)(C)C)ccc21 1129949597 ABZISCVDVRXXCC-KSFYIVLOSA-N 428.573 4.487 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)N2C[C@H](C)Cc3cc(C(F)(F)F)cc(Cl)c32)c1 1133395339 ZDGGUFNTRWSPRC-AAOUONPWSA-N 437.849 4.352 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)n1C1CCOCC1 1136311121 GWAJAEXGJCYOCI-QZTJIDSGSA-N 443.563 4.139 10 10 IICE Cc1ccc(C(=O)NC2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)s1 1136492372 ZWNCWCFNHPPVBF-UHFFFAOYSA-N 449.576 4.311 10 10 IICE Cc1cc(C(=O)N2CCN(CCN3[C@@H](C)CC[C@H]3C)CC2)c(C)n1-c1cccc(Cl)c1 1136563776 KBPFKUHMJGRNOH-KDURUIRLSA-N 443.035 4.378 10 10 IICE COc1ncc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cn1 1160646830 VTHPTXGKEUFTLO-GOSISDBHSA-N 430.430 4.411 10 10 IICE C[C@H](NC(=O)N[C@H](CCO)c1cccc(OC(F)(F)F)c1)c1ccc(N(C)C)cc1 1226646580 CAFXOMMYBHALFB-IFXJQAMLSA-N 425.451 4.135 10 10 IICE C[C@@H](NC(=O)NCc1cccc(Br)c1O)c1ccc(F)cc1OC(F)F 1231412015 LFHYYYOXWKZJRH-SECBINFHSA-N 433.224 4.456 10 10 IICE CCOc1ccc(-c2nc(C(=O)NC[C@@H]3CCN(c4ccc(OC)cc4)C3)cs2)cc1 1276831865 HLNZGASHWFZVAH-KRWDZBQOSA-N 437.565 4.474 10 10 IICE Cc1cc(CC(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)c(C)n1-c1ccccc1 1290473283 OMFFATABSYXKTO-UHFFFAOYSA-N 430.552 4.365 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1295414497 IWKFCRYFABWHMD-VJBMBRPKSA-N 441.620 4.275 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1297371858 OCCWZUFGBJBYFE-QFIPXVFZSA-N 448.615 4.488 10 10 IICE CSCCCN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1302790178 XHSRKMYUQUKMLQ-UHFFFAOYSA-N 449.640 4.080 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305487553 HSHCFCKKFIAPQY-QAPCUYQASA-N 441.555 4.120 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCN(c4ccc(C)c(C)c4)C[C@@H]3C)C2)cc1 1312902843 QIQYBVFURRQCAZ-FCHUYYIVSA-N 436.600 4.059 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)c(C)n1-c1ccccc1 1313101468 XNRSYOGIDGWWPH-AZGAKELHSA-N 431.580 4.444 10 10 IICE C[C@H]1Cc2ccccc2N1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1351559122 YHJZILVZRBDIIZ-QIQQCEGHSA-N 426.538 4.395 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cnc(OC3CCOCC3)c(Cl)c2)C2CC2)cc1 1355436983 OXFGAFCTMJITEE-UHFFFAOYSA-N 429.948 4.164 10 10 IICE Cc1cn2cc(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)ccc2n1 1357170097 CWUSJRGBMDHDRP-LICLKQGHSA-N 440.525 4.012 10 10 IICE Cc1nn(C2CCOCC2)c(C)c1C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1359897897 ZTQDSWJYUQMMDO-UHFFFAOYSA-N 438.494 4.122 10 10 IICE CC[C@@H](C)Oc1ccccc1/C=C\C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1360094100 QRAJBGFGTPHDGC-DDNJPHGJSA-N 439.575 4.475 10 10 IICE Cc1ccc(CN(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)s1 1361255542 YZCOXNGRYOZYKX-UHFFFAOYSA-N 443.627 4.380 10 10 IICE C[C@@H](NC(=O)c1cc(I)ccc1Br)c1ccccc1O 1454807255 RGHKLYZRBPCEHJ-SECBINFHSA-N 446.082 4.250 10 10 IICE COc1cccc(C2=NO[C@H](C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)C2)c1 1459579157 LEQYKXGQXFOCCQ-HJPURHCSSA-N 441.959 4.394 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)cc1)C1CCCCC1 1464544312 XYHGVDYYJZBPRN-UKILVPOCSA-N 437.559 4.430 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C)n(-c2ccccc2Br)n1 1467839993 ILBKDFJZEJOONW-UHFFFAOYSA-N 435.318 4.065 10 10 IICE C[C@@H](NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccccc1O 1471194399 SQWDEDQCOKPUDG-CQSZACIVSA-N 430.913 4.337 10 10 IICE O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1NCc1cccc(Cl)c1O 1472899021 MHFQHTIYBTWZKS-UHFFFAOYSA-N 439.921 4.131 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H](C)CNC(=O)OC(C)(C)C)cc2Cl)C1 1478424758 LNTPJKZCLDFYCJ-HOTGVXAUSA-N 439.000 4.289 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(NC4CCOCC4)CC3)cc2Cl)C1 1478528656 RIGRVGQMDXAHBR-GOSISDBHSA-N 449.039 4.019 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCCC1(F)F 1513904959 WZDPPZHEIOWYBG-GOSISDBHSA-N 433.547 4.391 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(OC(F)(F)F)c(Cl)c1 1516814608 KWMQHYBDYHFMSC-UHFFFAOYSA-N 432.801 4.144 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@@H]1CSCCS1 1517146868 HJWVXXBVHGNBOP-QGZVFWFLSA-N 432.640 4.121 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCc3ccc(OCC(F)(F)F)nc3)ccc21 1523593727 SWMWILGUTODMTB-UHFFFAOYSA-N 449.473 4.213 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1c(Cl)cccc1C(F)(F)F 1524851187 GTAYEFSVDHZZLK-UHFFFAOYSA-N 434.792 4.404 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCc2nc(-c3ccc(C(C)C)cc3)no2)cc1 1531375446 YRSFOQYBPLGAHM-UHFFFAOYSA-N 436.556 4.396 10 10 IICE COc1ccccc1C(F)(F)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1531502505 HADNWPALHAJXRR-CQSZACIVSA-N 426.410 4.174 10 10 IICE CC/C=C\Cn1c(Cc2ccsc2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1546798747 ZIEIBVUYSJGFAG-PLNGDYQASA-N 441.576 4.371 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCN(C(C)=O)C1 1547019927 IMGDRMLPILULRZ-QFIPXVFZSA-N 448.615 4.457 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2NC(=O)OC(C)(C)C)N(C)C)cc1 1558722778 BZSMQXGGJXBNSH-NRFANRHFSA-N 426.561 4.132 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](CC)Nc1cccnc1Cl 1568379341 XYLGTOSXXYUNNR-SFHVURJKSA-N 446.979 4.314 10 10 IICE Cc1cc(C(=O)N2CC[C@@H]3[C@H](CCCN3C)C2)c(C)n1-c1ccccc1Br 1587989993 JPKOGANRWOXUCS-YLJYHZDGSA-N 430.390 4.413 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1 1625794934 YLXNWGKMDWKOTR-GCJKJVERSA-N 431.939 4.113 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)CC(=O)c1ccc(F)cc1 1626516968 WBBTWHQCZSCUFE-KRWDZBQOSA-N 442.531 4.423 10 10 IICE Cc1nc(C2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)N1Cc2cccc(O)c2C1 1632708980 JMWABKYAXGWDRO-UHFFFAOYSA-N 443.569 4.428 10 10 IICE C/C=C\C[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C(=O)OCC 1633749481 NZZXSLAKUVEKNK-SUOMESGTSA-N 433.346 4.484 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CNC(=O)NCc1ccc(F)cc1 1637244287 ZWDGEXBDALRFLG-SFHVURJKSA-N 435.499 4.121 10 10 IICE Cc1ccc(O)c(CNC(=O)c2csc(C3CCN(C(=O)OC(C)(C)C)CC3)n2)c1 1641733404 UQILHZNOLZQQJK-UHFFFAOYSA-N 431.558 4.202 10 10 IICE COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)NCc2ccc3cccnc3c2O)cc1 1643282845 BPHFKUMUQRNTBW-UHFFFAOYSA-N 445.450 4.270 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@@H](CC(C)C)C(N)=O 1648494036 RHXMBSYXTPTVAD-RBUKOAKNSA-N 435.490 4.446 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCc3ccccc3)c3ccccn3)C2)cc1 1687025046 LJPMPGCUOICNIQ-OFVILXPXSA-N 430.552 4.342 10 10 IICE Cc1cc(CCNC(=O)NC[C@](C)(O)c2ccccc2Cl)c(C)n1-c1ccccc1 1687217056 ODOBRXPVBWEYRM-DEOSSOPVSA-N 425.960 4.497 10 10 IICE CC[C@]1(C)CCN(c2nnc([C@@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1694431961 JIFAMHHXZLEAJR-NTKDMRAZSA-N 429.609 4.051 10 10 IICE CCCCN(CC)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1695208714 OPHVMGQYJXLBFM-UHFFFAOYSA-N 436.604 4.157 10 10 IICE CCCN(CC)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N2CCOCC2)cc1 1695294993 AUFUEODNTZTOPO-UHFFFAOYSA-N 440.979 4.115 10 10 IICE C=CCN(CC=C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1705870289 QLUBFMUNGAQIFE-SANMLTNESA-N 444.583 4.009 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1CC 1705895792 SEQHYAZJYHYKFP-MBSDFSHPSA-N 446.599 4.280 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@](C)(O)c2cc(C)oc2C)o1 1707345665 BJLOBSRESYZJBB-XMMPIXPASA-N 436.512 4.306 10 10 IICE CCOCCN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1710812036 JEODQCOKDNRWFL-UHFFFAOYSA-N 429.634 4.010 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1Cc1cnc(C)s1 1727002851 NQVIEDYDWUAGRG-HNNXBMFYSA-N 444.580 4.079 10 10 IICE Cc1cc(-c2nnc(N3CCC(CO)CC3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1761676551 MPSMSSWSMVNGMY-UHFFFAOYSA-N 433.478 4.124 10 10 IICE C[C@@H]1CC(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C[C@@H](C)O1 1762752358 CDFVYOQQDRGWBS-IAGOWNOFSA-N 426.586 4.476 10 10 IICE CCc1nc(CCn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)cs1 1764623018 CFDKRMRXVDHZIW-UHFFFAOYSA-N 434.569 4.252 10 10 IICE COc1cc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)SC2=S)cc(OC)c1OC 1860087607 JQLBFEREWNFBBH-VCHYOVAHSA-N 430.551 4.184 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CNC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cc2)c1 1860881864 XNDLWRZFEVCLHC-XNTDXEJSSA-N 444.491 4.243 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2(C)C)c1O 2236038523 ACRQTFLZYWGQDB-MRXNPFEDSA-N 443.382 4.431 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](C2CC(NCc3c(O)cccc3Br)C2)C1 2265423211 IOCOEKMCKXCNGQ-WLYUNCDWSA-N 425.367 4.280 10 10 IICE Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCCCC3)o2)C1=O 2294034167 KXAUIEKYLFYWTE-UHFFFAOYSA-N 427.888 4.288 10 10 IICE N=C1C(=Cc2coc3ccccc3c2=O)C(=O)N=C2SC(Cc3ccc(Cl)cc3)=NN12 2297350845 QFLPUKVBJBYMAV-UHFFFAOYSA-N 448.891 4.308 10 10 IICE Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c1C 2313549355 ULJYHABMKGDJIN-UHFFFAOYSA-N 431.404 4.138 10 10 IICE CCN(CCC(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2352944094 CNOYWYRXDLGVDZ-UHFFFAOYSA-N 429.355 4.069 10 10 IICE Cc1ccc2ccc([C@H](Nc3ccc(S(N)(=O)=O)cc3)c3cccs3)c(O)c2n1 54621250 QFKZQGWEEIDESC-FQEVSTJZSA-N 425.535 4.159 10 10 IICE O=C(NN1C(=O)S/C(=C\c2ccc(Br)cc2)C1=S)c1ccccc1O 97539584 NTHDMIOVZHDKBY-ZROIWOOFSA-N 435.324 4.337 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC3(CC2)C[C@H](Oc2cnccn2)CCO3)cc1 675022468 PHPBPENQDOFAIM-HSZRJFAPSA-N 446.551 4.117 10 10 IICE C[C@@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1cccnc1 742754946 SETJLVSRAOBJON-UWJYYQICSA-N 426.561 4.023 10 10 IICE Cc1cc2nc(C)c(CCC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c(C)n2n1 746424333 LNYJJHWOLVMMMC-UHFFFAOYSA-N 429.568 4.354 10 10 IICE C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1c2ccccc2CC[C@@H]1C 751930645 GXERSDGMUJSIAR-HOTGVXAUSA-N 435.549 4.229 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(OCc4cccnc4)cc3)CC2)cc1F 753883249 HIKOPKFMVCDQOL-UHFFFAOYSA-N 436.487 4.162 10 10 IICE O=S(=O)(/C=C/c1cccc(Br)c1)NCc1cccc(Br)c1O 766199829 JNKQVEAJXCJSMW-BQYQJAHWSA-N 447.148 4.008 10 10 IICE COc1cc(Br)ccc1/C=C1\SC(=S)N(CCc2ccccn2)C1=O 781549415 FBLOPONLWKJIDB-YBEGLDIGSA-N 435.368 4.297 10 10 IICE CCO[C@H]1C[C@@](NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)(C(=O)OC)C1(C)C 781997817 PBPMPPLWLVNFAT-GBXCKJPGSA-N 438.528 4.377 10 10 IICE CN(Cc1ccccc1O)C(=O)c1cc(Br)cc(I)c1 797189982 NBDXZTDLNFLDAY-UHFFFAOYSA-N 446.082 4.032 10 10 IICE Cc1noc(CSc2ccccc2C(=O)NCc2cc(Br)ccc2O)n1 804736309 PWEJEEVWGKHLKH-UHFFFAOYSA-N 434.315 4.068 10 10 IICE COc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1OCC(F)(F)F 806189360 IZBBVEQSWLDMOU-UHFFFAOYSA-N 449.223 4.426 10 10 IICE CC(=O)N(Cc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1)C(C)C 806273965 BBRQNEVLFKYHJA-UHFFFAOYSA-N 434.334 4.233 10 10 IICE CCc1nc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cs1 1126259797 HDXSNQWTHNPFGM-KPENOIPVSA-N 449.598 4.313 10 10 IICE Cc1cc(CC(=O)NCCNc2ccc(-c3ccccc3)nn2)c(C)n1-c1ccccc1 1137259083 LRPUQFJGLURWMT-UHFFFAOYSA-N 425.536 4.322 10 10 IICE COc1ccccc1C/C(C)=C\C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438539 NDVYRSWNSILNSK-WYPWOVKWSA-N 428.960 4.324 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1cccnc1 1160197640 NYHHQGKGWWYBBY-QHCPKHFHSA-N 425.916 4.351 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)c2cccc(F)c2Cl)CCCC1 1170278969 RLXKYBRJLNPWDN-UHFFFAOYSA-N 428.891 4.320 10 10 IICE CN(C)c1ccc([C@@H](CNc2nnc(C(F)(F)F)s2)NC(=O)OC(C)(C)C)cc1 1186367823 JCORFTHGCCBFQS-CYBMUJFWSA-N 431.484 4.301 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CCc2ccccn2)sc(C)c1-c1ccccc1 1192261788 IUGUUMHADMAMNT-UHFFFAOYSA-N 437.565 4.408 10 10 IICE COC[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(Cl)cc1 1228558136 USJCQGFBCPMHLO-TZIWHRDSSA-N 432.948 4.166 10 10 IICE CC(C)COc1ncc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1264689024 GYYHNQKMBZFDRW-HZPDHXFCSA-N 449.954 4.453 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C3)ccc21 1265185911 ZXRTXRPEGYZTMB-CALCHBBNSA-N 443.588 4.374 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)cc(C)c3C)CC2)c(OC)c1 1287484720 LHFVQNACVKDBHA-UHFFFAOYSA-N 433.346 4.046 10 10 IICE C[C@@H](CCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N1CCCCC1 1288567432 VCHRHRAGFVCLAD-SIKLNZKXSA-N 427.593 4.126 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(N3CCCC3=O)CC2)n1CCCSc1nccs1 1291509138 YISRWSPLDRDXOR-MRXNPFEDSA-N 448.662 4.022 10 10 IICE Cc1cc(C(=O)NCCNC(=O)OC(C)(C)C)c(C)n1-c1cccc(Br)c1 1292278853 ZIADFYZEKDHGFI-UHFFFAOYSA-N 436.350 4.111 10 10 IICE CCOCc1nnc(N(C)C[C@H]2CC=CCC2)n1Cc1ccc(N2CCSCC2)cc1 1297069809 CMJGFOCSOSUZPS-FQEVSTJZSA-N 441.645 4.209 10 10 IICE CC(C)(C)OC(=O)NCCCN(CC1CCCC1)C(=O)c1ccc(N=NC(N)=O)cc1 1297642019 YVNUXHCRASXORC-UHFFFAOYSA-N 431.537 4.396 10 10 IICE CCO[C@@]1(c2nnc(N3CCC[C@H]3CC)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1314128315 JPNHUQYCKFVBQT-BWKNWUBXSA-N 441.620 4.204 10 10 IICE CC(=O)c1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1F 1436198935 OVPIANPKEMHBAP-ZDLGFXPLSA-N 446.500 4.397 10 10 IICE CC[C@](O)(C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cccc(Cl)c1 1441783719 MXUZUGJSRBZSTL-PBPSECFOSA-N 434.939 4.007 10 10 IICE COc1ccc(-c2cncc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c2)c(C)c1 1444668851 ZWBCJQOWYZMYIC-UHFFFAOYSA-N 445.563 4.204 10 10 IICE CCCc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)[nH]c(C)c1C(=O)OC 1444993329 ZTQOUMRWIHHJBV-HNNXBMFYSA-N 449.498 4.062 10 10 IICE CO[C@@H]1C[C@@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1449632415 QIHHACXFTRTBAR-QZTJIDSGSA-N 432.362 4.281 10 10 IICE CCN1CCC(N2CCCN(C(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)CC2)CC1 1451672174 INXGZMMLDNOUMG-UHFFFAOYSA-N 443.035 4.380 10 10 IICE Cc1cc(C(=O)N2CCO[C@@]3(CCSC3)C2)c(C)n1-c1cccc(Br)c1 1452080047 MNUBZOWKNUPMKN-FQEVSTJZSA-N 435.387 4.205 10 10 IICE COc1ccc(N(CC(=O)N[C@H](C)Cc2c(F)cccc2F)Cc2ccco2)cc1F 1459671253 LMGUYIQYNRZDRU-OAHLLOKOSA-N 432.442 4.460 10 10 IICE COc1ccc([C@H](NC(=O)Cc2ccc(O)c(O)c2)c2ccccc2)cc1Br 1464875083 TUAKOVYCHSYAFE-JOCHJYFZSA-N 442.309 4.317 10 10 IICE CN(CC(C)(C)C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1503449930 DZDFMDDMUGKAEM-HXUWFJFHSA-N 429.634 4.213 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(Cc2ccccc2)CCOCC1 1514714826 GBGJGLNUEYFGLA-HXUWFJFHSA-N 444.522 4.413 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3CC(OCc4ccccc4)C3)cc2F)C[C@H](C)O1 1516815578 MSMSTGCYFKXJSR-HTAFUYNTSA-N 426.532 4.051 10 10 IICE COCCCS(=O)(=O)c1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1520991159 MCTCUSXWCFNPHG-UHFFFAOYSA-N 440.565 4.086 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3cc(Br)ccc3Cl)CC2)cc1 1527714740 GHXFYIUNJQMYMR-UHFFFAOYSA-N 437.765 4.393 10 10 IICE Cc1cccc(Cl)c1CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1534129878 QOIAXWIFCFOATR-UHFFFAOYSA-N 426.866 4.363 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(c3ccc(SC)cc3)C2)cc1 1540459543 LZKUJXJZDKQREE-LJQANCHMSA-N 425.598 4.266 10 10 IICE CCn1c(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cnc1Br 1540799986 AVCIVRAHNOJMDL-UHFFFAOYSA-N 431.334 4.167 10 10 IICE COc1ccc(C)cc1N1C[C@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)CC1=O 1544245417 BFSDGYGARLLKRV-OAQYLSRUSA-N 449.595 4.442 10 10 IICE CO[C@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)(C)C 1554652070 UQKQLJRAQJRVNN-JOCHJYFZSA-N 441.620 4.080 10 10 IICE COCCC(C)(C)Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1555414432 SYECLEKHYYOYNM-OAQYLSRUSA-N 441.620 4.081 10 10 IICE C[C@@H]1CN(C(=O)CSc2ncc(-c3ccccc3)n2CC(F)(F)F)CC(C)(C)O1 1559366197 MSFZHZJWJOWAIV-CQSZACIVSA-N 427.492 4.230 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCOc2ccccc2F)NC(=O)OC(C)(C)C)cc1 1565881376 BOVVTNUNWPHXEM-FQEVSTJZSA-N 445.535 4.043 10 10 IICE COc1ccc2c(CC(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)coc2c1C 1566356913 RKCHCFIQVNOAPE-LJQANCHMSA-N 442.943 4.432 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CC23CN(C(=O)OC(C)(C)C)C3)cc1)C1CCCCC1 1583698853 BERDMEOHZIKEKJ-NRFANRHFSA-N 427.589 4.329 10 10 IICE CC(C)=CCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1597899081 JPKYTXWFWFITGY-UHFFFAOYSA-N 446.599 4.093 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3ccccc3[C@H]2O)c(C)n1-c1ccc(Br)cc1 1606756842 WZRBQIJJNORQFB-NHCUHLMSSA-N 425.326 4.245 10 10 IICE O=C(CN1CCCNC(=O)[C@@H]1Cc1ccccc1)Nc1ccc(N=Nc2ccccc2)cc1 1618202791 LYZMYIVQIJQVJN-DEOSSOPVSA-N 441.535 4.474 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC=C(C(F)(F)F)CC1 1624624541 YLJFRWDPEGLGHY-RVDMUPIBSA-N 444.475 4.138 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3(Cc4ccccc4)CCOCC3)cc2F)C[C@@H](C)O1 1626159054 QREYUOPUGMWLTO-WOJBJXKFSA-N 440.559 4.095 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCC(CN(CCO)C(C)C)CC3)c2C)c1 1627220677 DQNGTEIQTRXPRV-UHFFFAOYSA-N 425.617 4.266 10 10 IICE CCc1nc(C(=O)NCc2cc(Cl)cc(Cl)c2O)nn1-c1ccccc1Cl 1629132008 AKAXBCNGEJWECN-UHFFFAOYSA-N 425.703 4.426 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1631211080 CKROANCZMVERKL-RTBURBONSA-N 439.600 4.072 10 10 IICE Cc1cccnc1Oc1ccc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cc1 1634350911 KISJNPGXVCYTFW-UHFFFAOYSA-N 431.536 4.321 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(O)(Cc3ccc(F)cc3)CC2)cc1 1634399188 AGKFOIQLPZMCCR-UHFFFAOYSA-N 448.538 4.184 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cc3c(cc2OC(F)F)OCO3)c1 1636221186 UMNVWKGFXMSJES-UHFFFAOYSA-N 442.418 4.167 10 10 IICE COC(=O)/C=C/c1ccc(N2CC[C@]3(CCCCN3C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 1643220489 WGHMAIFYRCQZIA-YIEPXFBBSA-N 445.516 4.151 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCc2c(C)nn(Cc3ccc(C)cc3)c2C)cc1 1644438029 IXVBKOLLXWVZFU-UHFFFAOYSA-N 448.611 4.393 10 10 IICE CC(C)C[C@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 1645076208 LZYTWFJEZIUKJA-QFIPXVFZSA-N 447.982 4.309 10 10 IICE CCN(CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)Cc1cc(Br)ccc1O 1657428167 SQKFSAKEMRRZMP-UHFFFAOYSA-N 442.697 4.177 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O)c1ccc(N(C)C)cc1 1681780225 ZEVZEUXHZFSEJZ-PNLZDCPESA-N 426.536 4.004 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCCCC[C@H]1c1ccncc1 1686724383 ZJDIFDAFLCFQKC-NRFANRHFSA-N 430.499 4.023 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(COC[C@@H]2CCCO2)c1 1687128646 SHLRPYCEJAEMLT-VWLOTQADSA-N 437.584 4.324 10 10 IICE CC[C@H](C)CN(C)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1708572040 MAROZQCTWPQEBD-IBGZPJMESA-N 440.636 4.183 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(F)(F)C1 1749300510 UNDQQSHVJRUECE-INIZCTEOSA-N 429.515 4.481 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(C)CCOCC1 1761877109 GGCCJFANZSIHHG-GOSISDBHSA-N 445.583 4.083 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CCC1(O)CCC1 1768651293 MNZWXQIKTDVPKF-UHFFFAOYSA-N 425.621 4.408 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)ccc1OC 1860087081 YCSCAPCSLAMONM-CPNJWEJPSA-N 439.562 4.414 10 10 IICE CC(C)(C)OC(=O)N1CC2(CC(NCc3cc(Cl)cc(Br)c3O)C2)C1 1918426438 AVHPRZYDYGIDEH-UHFFFAOYSA-N 431.758 4.297 10 10 IICE COC(=O)c1c(C(C)C)nn([C@@H](C)c2cc(C)c(C)cc2O)c1I 2079956725 HNZWBNLGIFICDR-LBPRGKRZSA-N 442.297 4.329 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C2(C)CC2)c(CN)c1I 2080001472 JFSFVHCMRACJKD-OAHLLOKOSA-N 439.341 4.320 10 10 IICE CN(C)c1ccc([C@H](O)c2cc(I)ccc2Br)cc1 2106799070 RPHVRDKFFDHYFT-HNNXBMFYSA-N 432.099 4.201 10 10 IICE CC[C@@H](NC[C@@H]1COCCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2158553305 IEVBYRXILFMCBO-WMLDXEAASA-N 443.382 4.079 10 10 IICE Cc1ccc(CN[C@@H]2[C@H]3CCCCN(C(=O)OC(C)(C)C)[C@H]32)c(O)c1Br 2352944474 INFAQYIMIVLQFG-DJIMGWMZSA-N 425.367 4.341 10 10 IICE CC(/C=C1\SC(=S)N([C@@H]2CC(=O)N(c3cccc(C)c3)C2=O)C1=O)=C\c1ccccc1 15051065 VQIDPVVZENGYDS-KCZJJQALSA-N 448.569 4.475 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)OC(C)(C)C)[C@H]1N[C@H](CC)c1cc(Br)ccc1O 380974468 WWSASLYMAMJXGM-CYGHRXIMSA-N 443.382 4.266 10 10 IICE Cc1nc(-c2ccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)cc2)n[nH]1 435695926 OQJHJSITNFVHNS-UHFFFAOYSA-N 428.540 4.140 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(OC)cc3OC)[C@@H]2c2ccc(O)c(O)c2)c1 526329229 VNVDBTHWVGAKKW-HSZRJFAPSA-N 449.459 4.181 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(NC(C)=O)c3)[C@H]2c2ccc(O)c(O)c2)c1 526394844 XEAGXTWWDWDXMV-QHCPKHFHSA-N 446.459 4.122 10 10 IICE Cc1cc(C(=O)COC(=O)c2cnc(-c3cnn(C)c3)s2)c(C)n1-c1cccc(F)c1 732687606 UWRSZXRCDAJDEL-UHFFFAOYSA-N 438.484 4.130 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N(Cc1ccco1)Cc1ccco1 769047657 GUOUAABYZLASIC-UHFFFAOYSA-N 448.567 4.317 10 10 IICE C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 792034358 YOSALVKNWKGTCN-SWLSCSKDSA-N 439.400 4.024 10 10 IICE O=C(NCc1cc(Br)ccc1O)N[C@H]1CCCc2cn(C3CCCC3)nc21 807112750 CLNSPJSEFKHTMQ-KRWDZBQOSA-N 433.350 4.343 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3cccc(N4C(=O)N[C@@H](C)C4=O)c3C)c2C)cc1 813852294 APJWUMLDQGNJPG-INIZCTEOSA-N 446.507 4.108 10 10 IICE COc1ccc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1124864581 ZIXUFVWXPQTQFX-NFECSFHCSA-N 444.553 4.303 10 10 IICE O=C(CCc1ccc(-c2ccccc2F)o1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549255 NGFLTLQBPMUKLF-UHFFFAOYSA-N 444.453 4.450 10 10 IICE Cc1cc(CCNC(=O)[C@@H](C)CS(=O)(=O)c2ccc(F)cc2)c(C)n1-c1ccccc1 1131782160 VZLBXNDGGJWOQF-KRWDZBQOSA-N 442.556 4.002 10 10 IICE COC(=O)[C@@H]1CCc2sc(NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)nc2C1 1142601171 AARWAPXWXRWONI-CQSZACIVSA-N 427.501 4.220 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1 1162107223 FLXILTMOWBKSGT-FEQHDXENSA-N 431.536 4.172 10 10 IICE COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1c(O)ccc2ccccc12 1179033458 XGIVKXMEVXYWKC-JOCHJYFZSA-N 436.508 4.436 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cc4cc(Br)ccc4[nH]3)C2)cc1 1225808152 PGYVREHPFFRWGB-INIZCTEOSA-N 443.345 4.017 10 10 IICE COC[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(Cl)cc1 1228558133 USJCQGFBCPMHLO-CTNGQTDRSA-N 432.948 4.166 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@@H](OCC1CCCC1)c1ccccc1 1264688127 YEQPZOBGTWDESR-DEOSSOPVSA-N 426.532 4.227 10 10 IICE CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1287659688 APEWPNNAVXAWIS-RNXNDPNCSA-N 425.598 4.277 10 10 IICE Cc1nc(Cc2nnc(N3CCCCCC3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290428861 ROFBGXGOVOODDQ-UHFFFAOYSA-N 428.581 4.268 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](c3cccc(C)c3)N3CCOCC3)c2C)cc1 1290861714 YKWQJNTYEAXTPV-SANMLTNESA-N 447.579 4.214 10 10 IICE Cc1cnc(NC(=O)[C@H]2CSCN2C(=O)c2cc(C)n(-c3ccccc3C)c2C)s1 1292841941 SJMKVJIIKRNJGN-LJQANCHMSA-N 440.594 4.321 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCSC3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1304189583 NYMOBFAIDLRFRB-HXUWFJFHSA-N 439.629 4.455 10 10 IICE CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCc1cccc(Br)c1O 1312558078 OUNKCCOKVZCZOH-LJQANCHMSA-N 434.378 4.111 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1312903146 VOFTZILFZOAHJT-OAQYLSRUSA-N 432.568 4.428 10 10 IICE COc1ccc2cccc(CC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)c2c1 1355129597 HIHGBVGODWYNQF-HDICACEKSA-N 436.527 4.460 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1437494533 BLFNVYHHVLNWKB-IBGZPJMESA-N 431.964 4.416 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C\Sc1cc(F)ccc1F 1446818597 WWXFOMRTOXYMAS-SREVYHEPSA-N 427.856 4.131 10 10 IICE COc1cccc(CN(CCN(C)C)C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1447700458 GDNCCEYQMTXIGY-UHFFFAOYSA-N 447.579 4.428 10 10 IICE Cc1cc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2=O)c(C)o1 1458936078 ONWWXCOAPVSDFR-RUZDIDTESA-N 433.508 4.262 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cncc(-c4ccc(Cl)cc4)c3)cc2)CC1 1462808750 PWBAAFPHSYQXBD-UHFFFAOYSA-N 448.954 4.034 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2CCNS(C)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1464312380 NPMWETUHMRJFPZ-OAQYLSRUSA-N 445.629 4.152 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCC(=O)c2c(F)cccc2F)cc1 1464600243 BLHGCYVZJFTIEI-IBGZPJMESA-N 430.495 4.202 10 10 IICE CCCCc1ccc(C(=O)CCC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cc1 1465930613 YQDLCRHOANZSLW-UHFFFAOYSA-N 426.532 4.489 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1C 1466592332 KTLMQSKDRVVIIM-QFIPXVFZSA-N 431.536 4.252 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c(C)n1-c1ccccc1Br 1467747972 ZKCXTDICARWTFI-JIGPKXGUSA-N 447.373 4.265 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@H]2c2nc3ccccc3[nH]2)N(C)C)cc1 1471548527 VQIGBOXHOMQADV-XZOQPEGZSA-N 434.588 4.168 10 10 IICE CCO[C@]1(c2nnc(N(CC(C)C)C(C)C)n2Cc2ccc(N(C)C)c(F)c2)CCOC1 1502657473 YHCMGBXGOIVBBR-XMMPIXPASA-N 447.599 4.054 10 10 IICE CC[C@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1514120361 GVSQVNMVFKOKGB-NQIIRXRSSA-N 429.634 4.008 10 10 IICE C[Si](C)(C)c1ccc(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1514716287 QWDCADNKLUDOLJ-SFHVURJKSA-N 432.587 4.161 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H](OC)C(C)(C)C)CC2)cc1F 1518310358 WCOGDQURSCORHK-FQEVSTJZSA-N 447.599 4.111 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC[C@@H](OCC2CC2)C1 1542226712 GVYUHUICOSXJHC-HSZRJFAPSA-N 425.621 4.295 10 10 IICE Cc1ccc(NC(=O)N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)cc1 1565737192 GMICHOOKUGKUAW-UHFFFAOYSA-N 444.535 4.205 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Cl)c2ccccc2c1O 1570168147 OVEFNYRVXTWZCE-UHFFFAOYSA-N 432.854 4.244 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cncc(C(=O)OC(C)(C)C)c2)cc1 1570813222 HBLIARRMWIHSSQ-UHFFFAOYSA-N 433.508 4.438 10 10 IICE Cn1cc(CN(C(=O)/C=C/c2ccc(Cl)nc2)c2ccc(Br)cc2)cn1 1596434689 RYNRPAHEEOHYCV-YCRREMRBSA-N 431.721 4.478 10 10 IICE O=C(CSc1cccc(Br)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1597090136 PDQQZGVNFKNTAH-KRWDZBQOSA-N 436.371 4.455 10 10 IICE CC(C)=CCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1597893136 QCANQCHQWQTHTJ-JOCHJYFZSA-N 439.604 4.001 10 10 IICE CN(C)c1ccc(CN2C[C@@H](O)C[C@H]2c2nc(-c3ccc(C(F)(F)F)cc3)no2)cc1 1616155431 XBZOHASLKVUNOC-OALUTQOASA-N 432.446 4.129 10 10 IICE Cc1cc(C)n(CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1618368304 DTGPNADSODOJCH-UHFFFAOYSA-N 439.317 4.001 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)[C@H]1Oc1ccccc1 1625824293 YXTAEPGYSFHJAW-UBFVSLLYSA-N 432.520 4.261 10 10 IICE C[C@@H]1Nc2ccnn2[C@H](C)[C@H]1CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1626479143 CFHZJFKMXRUZRV-YRNRMSPPSA-N 447.530 4.041 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1(N(C)C(=O)OC(C)(C)C)CCC1 1629968978 POUMDUHALKCNGJ-UHFFFAOYSA-N 441.366 4.293 10 10 IICE CCN(CCc1ccccn1)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1630830153 KPJZWKOPPICNQT-UHFFFAOYSA-N 427.346 4.351 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3[C@H]4CCN(C(=O)OC(C)(C)C)C[C@H]43)cc2)CC1 1633110536 BRVBMBSHCNCPAG-BDTNDASRSA-N 427.589 4.042 10 10 IICE CCc1ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(O)c1 1634162725 NGRHLUDMTBFGRS-HXUWFJFHSA-N 427.545 4.016 10 10 IICE COCCS(=O)(=O)c1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1 1638422654 DYZWHNFVIGXVMY-UHFFFAOYSA-N 440.565 4.383 10 10 IICE Cc1ccc([C@@H]2[C@@H](C)CCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1644683109 ZAKDXRFCDIANNW-FNZWTVRRSA-N 439.575 4.060 10 10 IICE COc1cc(Br)cc2sc(NC(=O)c3ccc(N=NC(N)=O)cc3)nc12 1647835529 JTAGSVCLFFTOTP-UHFFFAOYSA-N 434.275 4.482 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](c2nccc(C(F)(F)F)n2)C1 1648027575 DZOHUEIWDUVCPF-INIZCTEOSA-N 442.441 4.345 10 10 IICE Cc1cc(C(=O)Cn2cc(I)cn2)c(C)n1-c1ccc2c(c1)CCC2 1652677667 YWFHBTFOIOQLTN-UHFFFAOYSA-N 445.304 4.267 10 10 IICE Cc1ccc(C)c([C@H](C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1653167436 XGXDSYCWBSTXHH-ZCNNSNEGSA-N 427.564 4.023 10 10 IICE COc1ccc(C[C@H](C)CNC(=O)NCc2cc(Cl)cc(Cl)c2O)cc1OC 1679670719 UZKKJPIFUYRNLE-LBPRGKRZSA-N 427.328 4.394 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCC(F)(F)C1 1693006346 WBNHCUANNZHOCI-UHFFFAOYSA-N 432.906 4.262 10 10 IICE CCc1nnc(N(C)[C@H](C)c2cccs2)n1Cc1ccc(N2CCOCC2)c(F)c1 1744525974 JATNNHGRDJGAAD-MRXNPFEDSA-N 429.565 4.123 10 10 IICE COCCCN(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1749691910 AEQDDSZHWVEFEH-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763246304 DCXSWEBVKYKFTM-RDPSFJRHSA-N 439.648 4.358 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1)OC 1765557524 NZPCAQSQVIRKMP-VXKWHMMOSA-N 437.588 4.393 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)/C2=C/c2ccc3c(c2)OCCO3)cc1 1865671447 BIQCUJWVUMJYHN-KGENOOAVSA-N 444.462 4.436 10 10 IICE CCOC(=O)c1c(NC(=O)/C=C\C(=O)O)sc(C)c1-c1ccc(Br)cc1 1865983949 JHUZWDNNEQBVKT-HJWRWDBZSA-N 438.299 4.242 10 10 IICE Nc1ccc(Oc2ccc(NC(=O)c3ccc(N4CCOCC4)c([N+](=O)[O-])c3)cc2)cc1 1866021099 VCGLDZSOZWDVQM-UHFFFAOYSA-N 434.452 4.058 10 10 IICE CCc1nc(N2CCN(c3ccc(OC)cc3)CC2)cc(N2CCCc3ccccc32)n1 1867958249 RRVAEWWUBDQSEJ-UHFFFAOYSA-N 429.568 4.459 10 10 IICE COc1ccc(NC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(C3CC3)C2=O)cc1 1873422220 MCEWABGMVGXORJ-UHFFFAOYSA-N 427.504 4.457 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](NCc2c(O)cccc2Br)(C(F)(F)F)C1 2103578594 YTMUUYBKNNAJGS-MRXNPFEDSA-N 439.272 4.186 10 10 IICE COc1ccc(Br)c(CN[C@H](C)CCCN(C)C(=O)OC(C)(C)C)c1O 2227751923 SNQMNBZEQVYONU-CYBMUJFWSA-N 431.371 4.289 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)C1=Cc1ccc(C(=O)OC)cc1 2294037576 URRGNTSZOLHAEN-UHFFFAOYSA-N 441.867 4.012 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1cccc(C)c1 2297347601 LWSDVBWAXUTWSB-UHFFFAOYSA-N 447.491 4.302 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(O)c1Br 2352677162 XFFXORAWGBFMTH-PHZGNYQRSA-N 425.367 4.483 10 10 IICE COC(=O)c1c(-c2ccc(Cl)cc2)noc1N1CCN(c2ccc(OC)cc2)CC1 8599695 WXDAKFOQOHGHKZ-UHFFFAOYSA-N 427.888 4.117 10 10 IICE COc1ccc(-n2cccc2/C=C2\C(=N)N3N=C(Cc4ccccc4)SC3=NC2=O)cc1 20211231 KTLZIVWTJLVAPU-NCNWTYLVSA-N 441.516 4.348 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OCC 33337796 FTGHVTVMQUERGB-AQTBWJFISA-N 428.535 4.030 10 10 IICE CC(=O)N1C(=O)/C(=C2/SC(Nc3ccc(Cl)cc3Cl)=NC2=O)c2ccccc21 33341800 QVZBFBXUKRTWES-FOCLMDBBSA-N 432.288 4.339 10 10 IICE CCOC(=O)COc1ccc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)cc1OC 33436637 FQRBVEMDIKTYCV-ZDLGFXPLSA-N 447.509 4.182 10 10 IICE Cc1cc(CCNC(=O)N2CCC(OC[C@H]3CCCCO3)CC2)c(C)n1-c1ccccc1 750634481 KPAMHRFDPCSZQW-RUZDIDTESA-N 439.600 4.396 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)NCc1ccc(N3CCC(C)CC3)cc1)CC2 758487985 VGNGIRJBDMAMNV-SFHVURJKSA-N 446.517 4.461 10 10 IICE O=S(=O)(/C=C\c1ccc(Br)cc1)NCc1cccc(Br)c1O 766201923 XVKRZUKLHARCPP-HJWRWDBZSA-N 447.148 4.008 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H]3CCCOc4cc5c(cc43)CCCC5)cc2)C1 768508972 NULXNXYZXFPHRP-WIOPSUGQSA-N 433.596 4.271 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(N2CCOC2=O)cc1 773143683 CBOCBIRLCSLZLI-HXUWFJFHSA-N 434.584 4.026 10 10 IICE Cc1nc2ccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)cc2o1 792200320 WIFMOSZQKTWGQT-HXUWFJFHSA-N 438.528 4.198 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccc(F)cc2)c1 792238327 PPVZQBKJBUYSGF-AUUYWEPGSA-N 432.492 4.026 10 10 IICE CC(C)(C)OC(=O)N1CCN(C2CCC(NCc3cc(Cl)cc(F)c3O)CC2)CC1 812803197 XJUKADNKWJDEOH-UHFFFAOYSA-N 441.975 4.138 10 10 IICE CCN1CCN(c2ccccc2NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1 915323529 JHYZZVKNYZIVKC-UHFFFAOYSA-N 435.616 4.483 10 10 IICE CC(=O)NCc1ccc(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)s1 917218601 YYYUIFAOPVGNRA-UHFFFAOYSA-N 443.575 4.462 10 10 IICE CC(C)(C)OC(=O)[C@@H]1CC[C@H](C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C1 1125877244 BXWFIIPIXYXBRH-JKSUJKDBSA-N 438.515 4.131 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CC(=O)N(C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 1126079540 DALQMHUQSNRXOT-WMZHIEFXSA-N 445.966 4.468 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)C(=O)NCCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1128929840 MFDQVPQCGYMBBI-SFHVURJKSA-N 437.971 4.154 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cc(-c2cccc(O)c2)on1 1137081624 ICUIRGAJNZASMZ-HNNXBMFYSA-N 429.423 4.047 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnn(-c3ccncc3)c2)cc1 1144710455 DGFJTSQNXFMFGC-UHFFFAOYSA-N 427.508 4.189 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751051 SVVWEUHZVJTEKY-UHFFFAOYSA-N 433.499 4.019 10 10 IICE CCN(CC)CCNC(=O)c1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1264360824 FYGIFZJLFGWLGX-UHFFFAOYSA-N 446.595 4.347 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1276283383 FLJYRBDWURXBLA-IUGBQFMMSA-N 449.595 4.157 10 10 IICE Cc1cc(CNC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c(C)n1-c1ccccc1 1287662314 XGDOFEHVSMHAJJ-NRFANRHFSA-N 435.955 4.412 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCOc2cccc(C(F)(F)F)n2)c1 1296006070 KRRQUNVESLYGNL-UHFFFAOYSA-N 431.414 4.129 10 10 IICE CN(c1nnc(-c2cccc(Cl)c2)n1CCCSc1nccs1)[C@H]1CCOC1 1298118220 PTLFGLWTVODBEY-INIZCTEOSA-N 436.006 4.463 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(C)c3ccccc3Oc3ccccc3)CC2)cc1 1307541170 HECICGVREDUZDT-HSZRJFAPSA-N 447.579 4.107 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CCCC2 1353748099 JRJANUGZJVDXRU-HNNXBMFYSA-N 432.586 4.312 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(F)c3OC(F)(F)F)cc2F)C[C@H](C)O1 1354659623 XAAZAXYHFJUZQN-STQMWFEESA-N 444.400 4.407 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C(N)=O)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1361049566 IVZVYXZOWMSPEJ-OAQYLSRUSA-N 448.615 4.491 10 10 IICE CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NCc1c(O)ccc2ccccc12 1456311083 SCHXOZKKVDAPQK-UHFFFAOYSA-N 446.528 4.301 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H]1C[C@@H](OCC)C1(C)C 1459521468 BEYYVAONJMCWHW-XZOQPEGZSA-N 448.563 4.316 10 10 IICE CC[C@@H](CC(F)(F)F)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1465325387 PWCOJWXLDHAGIQ-YOEHRIQHSA-N 431.499 4.413 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1c(Cl)cccc1Br 1465394804 BGSBPLCVFHUYSC-UHFFFAOYSA-N 437.765 4.241 10 10 IICE Cc1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(C)c(O)c2O)c(Br)c1 1467620712 RFLODSXOHWZCGJ-INIZCTEOSA-N 434.330 4.299 10 10 IICE CS[C@@H](Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1519869639 XCUFKNQSIZOUKV-FQEVSTJZSA-N 425.602 4.384 10 10 IICE CCCCc1ccc(N2C[C@H](C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2=O)cc1 1528554583 JCTPEIHGIMGNJY-NFBKMPQASA-N 449.595 4.096 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3cc(Br)ccc3Cl)CC2)cc1 1537034321 USPJSBSQIMRLEK-UHFFFAOYSA-N 437.765 4.439 10 10 IICE CC[C@@H](CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)N1CCc2ccccc2C1 1540749015 PAQPOJUFTZZZAG-SANMLTNESA-N 443.591 4.402 10 10 IICE O=C([C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)N(Cc1ccco1)Cc1ccccc1O 1545496451 MCHXGUREYAUSOQ-MRXNPFEDSA-N 442.874 4.360 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(F)cc(Br)c1 1545632750 UUEPDYYYOIIRDN-QGZVFWFLSA-N 441.728 4.342 10 10 IICE CO[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1555181400 ACQNQPQFOOAQHV-NRFANRHFSA-N 429.584 4.125 10 10 IICE CCO[C@@H]1C[C@](CO)(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1556221452 GLBCVLKFBBTPCA-DENIHFKCSA-N 449.389 4.153 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@H]2Cc3c(Br)cccc3[C@H]21 1556481697 YUVBPNZXXWJESY-APHBMKBZSA-N 437.131 4.119 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@](C(=O)NCc2ccc3cccnc3c2O)(c2ccccc2)C1 1557123477 PDJXBCKKMLJXNR-AEEMYVKYSA-N 447.535 4.182 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(C)cc4ccccc34)CC2)cc1 1569275156 NCQPGLZFNSTGND-QXMHVHEDSA-N 429.520 4.000 10 10 IICE Cc1ncc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1596446815 KOJQNTLJZVQMQK-ZRRZQRFHSA-N 435.571 4.059 10 10 IICE Cc1cc(C(=O)Nc2ccccc2-c2nc[nH]n2)c(C)n1-c1ccc(Br)cn1 1596580758 LJCBWRGHOQDCQF-UHFFFAOYSA-N 437.301 4.289 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cc(N3CCCC3=O)ccc2F)cc1 1596952373 CJHSGKMAXLEVCY-UHFFFAOYSA-N 433.483 4.354 10 10 IICE Cc1ccc(-c2nnc(N(C)C[C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)o1 1612018459 RFKBITMCDUDMPS-SFHVURJKSA-N 427.524 4.105 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cc(N(C)C)nc3ccccc23)cc1 1618608085 GTJKZLWYSKPYIU-UHFFFAOYSA-N 440.547 4.380 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(C)c1O 1622493028 HWYKUCNPKWNPTQ-BOPFTXTBSA-N 430.526 4.378 10 10 IICE Cc1cc(CNC(=O)c2cc(C)n(-c3ccccn3)c2C)ccc1I 1626506994 BEHPMNUPINRYPD-UHFFFAOYSA-N 445.304 4.332 10 10 IICE CN(c1ccc(CNC(=O)c2ccccc2S(=O)(=O)C(F)F)cc1)C1CCCCC1 1627005611 APPJQDUCFVDGOL-UHFFFAOYSA-N 436.524 4.382 10 10 IICE Nc1cc(Br)ccc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1629055350 ICLNYOPIEMEQJL-ZDUSSCGKSA-N 440.288 4.032 10 10 IICE COC(=O)c1cnc(NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)c1 1639876486 JWGOEJXPYKHXIW-GOSISDBHSA-N 448.951 4.266 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1640257648 YGAJUPBSSSNGQQ-QTJNJRLBSA-N 447.959 4.242 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)Cc1ccccc1 1644441698 YYMZAHJOXRHENJ-SFTDATJTSA-N 441.591 4.214 10 10 IICE O=C(Nc1cccc(-c2ccon2)c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1646445086 KBJALVWTUBXIRS-UHFFFAOYSA-N 441.490 4.162 10 10 IICE COC(=O)/C=C\c1ccc(N2CCCC[C@H]2c2ncc(Br)cn2)c([N+](=O)[O-])c1 1652248683 LGLSPQWLEKGZAC-IOBAAEILSA-N 447.289 4.065 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccc(OCc4ccccc4)cc3)CC2)cc1F 1652874039 PMZUBWDZMCAZHT-UHFFFAOYSA-N 449.526 4.174 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@@](C)(C(F)(F)F)C1 1655517784 DXJGXBKKVHZHFA-MCMMXHMISA-N 430.426 4.063 10 10 IICE Cc1cc(C(F)(F)F)nn1CCNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1676077596 GEQKEHZQZPPWGT-UHFFFAOYSA-N 449.477 4.281 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CC[C@@H](OCC(C)C)C1 1693006258 SOVOTAOEMUTEJU-DHIUTWEWSA-N 441.620 4.194 10 10 IICE Cc1cccc(OCc2nnc(N3CCOC[C@@H]3C)n2CCCSc2nccs2)c1 1707630682 DZOMHDWJWASKPE-KRWDZBQOSA-N 445.614 4.030 10 10 IICE CCC[C@@](C)(O)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709446577 MUEIPGIVSLDLQM-RCZVLFRGSA-N 441.620 4.307 10 10 IICE C[C@@H]1CSCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1726750427 AWAZKUGMDQJCDE-QGZVFWFLSA-N 431.675 4.119 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)CC[C@H]1C 1728258766 XTMUAKKMWRYVAU-RBUKOAKNSA-N 448.615 4.456 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCS[C@H](C)C2)cc1 1728383140 SEIXUNKJTIDZPI-NQIIRXRSSA-N 429.634 4.356 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCOCC1 1730431673 LTWAEXBWYJSRFD-UHFFFAOYSA-N 437.588 4.252 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC[C@H](c3ccnn3C)C2)nnc1C(C)(C)C 1742141178 AJBVNLJQVIQMOH-FQEVSTJZSA-N 435.620 4.116 10 10 IICE CCO[C@@]1(c2nnc(N3CCC[C@H](C)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1746714892 LZADUKCCYVIYED-CPJSRVTESA-N 441.620 4.061 10 10 IICE Cc1ccccc1CN(C)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1762124300 SLYPYJFMNJPPOV-UHFFFAOYSA-N 439.614 4.262 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@](C)(OC)C1 1768137515 CLIPAHXMOSAEHV-VWLOTQADSA-N 437.588 4.394 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CCCNC2)sc(C)c1-c1ccc(Br)cc1 1865973725 CSKABGDBLAUYIZ-CYBMUJFWSA-N 437.359 4.211 10 10 IICE CC(C)(C)OC(=O)NCc1ncc(NCc2cc(Cl)cc(Br)c2O)cn1 2134942130 QJWGOMKEOVVGLD-UHFFFAOYSA-N 443.729 4.235 10 10 IICE CCCNC(=O)[C@H](C(C)C)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2297580177 XUGHMYKZIYLHOF-HNNXBMFYSA-N 441.416 4.201 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=C(C)Nc2ncccc2C)cc1 2313683156 SSGFISQIIDZYIR-UHFFFAOYSA-N 443.463 4.444 10 10 IICE COc1cc(Br)cc(C=C2C(=O)N(CC(C)C)N=C2c2ccccc2)c1O 2332124813 SBRVRIIFKKQIGH-UHFFFAOYSA-N 429.314 4.449 10 10 IICE CC[C@@H]1C[C@@]1(NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380764275 BXOIAODYDQEPPL-VLIAUNLRSA-N 441.366 4.115 10 10 IICE O=C(O)CCOc1ccc(/C=C2/SC(Nc3ccc(Br)cc3)=NC2=O)cc1 16908063 PIEFBUCCXWQYJP-LFIBNONCSA-N 447.310 4.385 10 10 IICE Cc1cc(C(=O)NCCNC(=O)c2ccccc2)c(C)n1-c1ccc(Br)cc1 31031950 FYZCQIJADIPCAW-UHFFFAOYSA-N 440.341 4.016 10 10 IICE O=C(CCCOc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 96746838 LELJSXPTJKJUIA-UHFFFAOYSA-N 430.416 4.168 10 10 IICE C/C(NCCc1ccccc1)=C1\C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 205951327 CVWASZPPDWZGMD-PTGBLXJZSA-N 426.476 4.452 10 10 IICE CCc1ccccc1N1C(=O)/C(=C/c2ccc(OCC(=O)O)c(OC)c2)SC1=S 210452164 PVXHDEPIBIDJER-WQRHYEAKSA-N 429.519 4.127 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(OC)c(O)c1)N2 251354331 NMFAWQPPLQLABQ-ZFTZODIFSA-N 428.554 4.304 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)c(Br)c1 705850452 WVHSIMNWRXTZQZ-DYQZNNLLSA-N 427.386 4.288 10 10 IICE COc1ccc([C@@H](C)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1F 726609972 FMUXPXVGSAHTTR-CQSZACIVSA-N 437.462 4.465 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)cc1Cl 749736919 CNPOAYNUEZKTER-UHFFFAOYSA-N 440.905 4.498 10 10 IICE O=C(Cc1ccc(Br)s1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768916452 QUTNFWJQAUAPJJ-CQSZACIVSA-N 443.794 4.193 10 10 IICE CC(C)(C(=O)NCCc1ccc(O)c(O)c1)[C@H](O)c1ccc(OCc2ccccc2)cc1 778914451 OIMUNUMOLULBDC-XMMPIXPASA-N 435.520 4.095 10 10 IICE CCN1CC[C@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)[C@H]1c1cc(F)c(F)c(F)c1 782749266 HFSXZJZBQDYNTG-NZQKXSOJSA-N 442.485 4.472 10 10 IICE COc1ccc(N(CC(=O)Nc2cccc(F)c2)CC(=O)Nc2cccc(F)c2)cc1 794246057 BXCOKWLMKXSRQA-UHFFFAOYSA-N 425.435 4.057 10 10 IICE Cc1cc(C(=O)COC(=O)CCCCC(N)=O)c(C)n1-c1ccc(Cl)c(Cl)c1 805565865 WQDLOJNXMWWMSH-UHFFFAOYSA-N 425.312 4.173 10 10 IICE CC[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(C(F)(F)F)cc1O 810224342 VJLAQYYAPBZFFM-ZJOUEHCJSA-N 447.501 4.051 10 10 IICE CCN(CCC(F)(F)F)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1125502414 NAZMIGZUWBDHOX-SDNWHVSQSA-N 434.480 4.218 10 10 IICE COc1cc(N)c(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)cc1Br 1135964435 ARJKLQUMVKEILO-UHFFFAOYSA-N 432.362 4.302 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(Cl)cc(Cl)c1O 1136285267 XRXLRVLYJLLMFK-UHFFFAOYSA-N 449.256 4.484 10 10 IICE COc1ccc(C(=O)C[C@H](C)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1137081312 CZWUYJATMSHKOZ-FUHWJXTLSA-N 446.494 4.291 10 10 IICE Cc1cc(CC(=O)N(CCO)Cc2cc(Br)cs2)c(C)n1-c1ccccc1 1138202393 GUXGOPAVHSUGAC-UHFFFAOYSA-N 447.398 4.482 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2C[C@@H]3CC[C@H](C2)S3)NC(=O)OC(C)(C)C)cc1 1147516899 ALGQCCLJIAXTNL-ZNBHLAFESA-N 433.618 4.109 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nccnc1-c1nc2ccccc2s1 1162115160 REYYTBNLWAIMQL-MRXNPFEDSA-N 431.565 4.489 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)C2(OC)CCC2)sc(C)c1-c1ccccc1 1171208091 KEAUVOFHWMEEJR-INIZCTEOSA-N 430.570 4.386 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3cc(F)cc(F)c3)C2=O)c(C)n1-c1ccccc1 1188987831 GOQGVRHLFIUBGK-DEOSSOPVSA-N 437.446 4.022 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCc4cc(C)c(Br)cc4C3)C2)cc1 1252924854 VPKKEPFZFXUHBQ-SFHVURJKSA-N 444.373 4.113 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)C[C@H](C)c1nccs1 1289424719 ZWYWOXPODRYLBZ-SFHVURJKSA-N 447.612 4.459 10 10 IICE CCCCC1CCC(CNC(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 1292057859 IJKUJIDVDUGTMM-CCEZHUSRSA-N 441.616 4.013 10 10 IICE C[C@@H](NC(=O)C1(C(=O)OC(C)(C)C)C(C)(C)C1(C)C)c1ccc(N2CCOCC2)cc1 1292235345 HHGANIJIFUPOFO-QGZVFWFLSA-N 430.589 4.095 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1294234429 JLJIBMCWEOBINL-UHFFFAOYSA-N 432.576 4.156 10 10 IICE CN(Cc1ccc([S@](C)=O)cc1)c1nnc(C2CC2)n1CCCSc1nccs1 1298322093 XUAFEQAQWHWTSS-LJAQVGFWSA-N 447.655 4.168 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(N(C(=O)OC(C)(C)C)C2CC2)CCC1 1299478281 LKEVWBXCMPGWQV-SFHVURJKSA-N 429.605 4.430 10 10 IICE CCOC(=O)C1=CC[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1300804968 YDJSYWKZUJZGAV-KRWDZBQOSA-N 431.330 4.238 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)c2cc(OC)ccc2O)sc2c1CC[C@@H](C)C2 1307628325 HTQPFNWIWYTAAY-ZIAGYGMSSA-N 446.569 4.053 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc(OC(F)(F)F)c1 1354328459 LRLVUFMCOVSDOC-UHFFFAOYSA-N 448.363 4.371 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)OCC23CCC3)sc(C)c1-c1ccccc1 1460346337 WVWRTCXDAXBNIE-INIZCTEOSA-N 442.581 4.482 10 10 IICE CCc1ccc(-c2nc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)cs2)cc1 1462806995 NKHIMYJEGVJEHH-UHFFFAOYSA-N 448.592 4.004 10 10 IICE CCCCn1cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(C)n1 1466447752 KNXSZINFCWCUCQ-UHFFFAOYSA-N 444.377 4.487 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](C)C[C@@H]2[C@@H](C)O)sc(C)c1-c1ccccc1 1473390024 BAJCDVAAZALRIE-FRQCXROJSA-N 444.597 4.320 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C(=O)OC)C(C)(C)C)sc(C)c1-c1ccccc1 1473714748 XJHJCVFLLMHMNS-LJQANCHMSA-N 446.569 4.016 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCN1CCOC1=O 1501853887 QRKMJTYOUFTTLD-UHFFFAOYSA-N 436.560 4.041 10 10 IICE CCc1nnc(N(C)C2CCC(C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1513783854 JVOMEGBLZZGXHN-UHFFFAOYSA-N 425.621 4.112 10 10 IICE COc1ccc(-c2nnc(N3CCOC(C)(C)C3)n2CCCSc2nccs2)cc1 1518173972 KHWSPFXNYSQZKR-UHFFFAOYSA-N 445.614 4.208 10 10 IICE Cc1cn(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nc1C(F)(F)F 1530425124 OAEWPXOQZBVYFI-CYBMUJFWSA-N 428.886 4.416 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Sc3nc4ccccc4s3)CC2)c(OC)c1 1534586604 FSFQSSLPDKMDDT-OAHLLOKOSA-N 443.594 4.143 10 10 IICE CC1CCC(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)CC1 1537497434 HRHUFUGKALBLCI-KGXSXCIVSA-N 439.522 4.071 10 10 IICE CC(C)c1nnc(N2CCN(CC3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1541366994 WHHUAMXPARPEGU-UHFFFAOYSA-N 442.627 4.357 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)cc2F)C[C@@H](C)O1 1544675936 FMPYYVAOHGCVGC-VXGBXAGGSA-N 439.846 4.070 10 10 IICE Cc1ccc(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)cc1-n1c(C)cc(C=O)c1C 1556738398 HNEPKQPQVRCQFF-DEOSSOPVSA-N 431.536 4.034 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCOc1cccc([N+](=O)[O-])c1 1559341613 XBPZLJSDLJMLAN-UHFFFAOYSA-N 427.482 4.421 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN1CCN(c2ccc(OCC)cc2)CC1 1559667956 LMXGCPAOKTZUMF-UHFFFAOYSA-N 426.435 4.196 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](C(=O)NCC4CC4)C3)cc2Cl)C1 1564650449 XAQWQUAZKPVRIZ-FXAWDEMLSA-N 447.023 4.024 10 10 IICE CN(C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccc1 1565746651 VFIOYNVGMQBRSI-IBGZPJMESA-N 446.528 4.317 10 10 IICE Cc1ccc(C(=O)NC[C@H](O)COc2c(C)cccc2C)cc1-n1c(C)cc(C=O)c1C 1566334988 ROAZCAYLSMOKPP-QHCPKHFHSA-N 434.536 4.002 10 10 IICE CC(=O)NCc1ccc(-c2csc(NC(=O)c3cc4cc(O)c(O)cc4s3)n2)cc1 1585250055 FAYRZSUUZLHXKG-UHFFFAOYSA-N 439.518 4.324 10 10 IICE Cc1ccc([C@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCOCC2)cc1 1596952969 JEGOERXEPPIGLP-SANMLTNESA-N 445.563 4.018 10 10 IICE CC(C)[C@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1598296396 PEFPDFDPOZFUGL-NRFANRHFSA-N 439.629 4.393 10 10 IICE COc1cc(N2CCN([C@@H](C)c3nc4ccccc4s3)CC2)c([N+](=O)[O-])cc1OC 1611745642 ZJTVAENCDWBGHX-AWEZNQCLSA-N 428.514 4.105 10 10 IICE CC[C@H]1CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)CCS1 1614250883 SWNDTIOBYVEGGE-KRWDZBQOSA-N 446.671 4.235 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC(Cc4cc(OC)cc(OC)c4)C3)c2C)cc1 1620710306 QPUVAZKFGHEXIX-UHFFFAOYSA-N 434.536 4.435 10 10 IICE COc1cccc([C@@H](CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)N(C)C)c1 1623420047 FOZZUQLDGJUWKK-RUZDIDTESA-N 433.552 4.256 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc3cc(O)c(O)cc3s2)c1C 1626906995 YRXHHYUJYOJBGI-HNNXBMFYSA-N 428.535 4.083 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](OC3CCC3)C2)c(C)n1-c1ccc(Br)cn1 1628116900 NDDBYEAKIHJYGY-GOSISDBHSA-N 432.362 4.425 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2CCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1628495393 KYROVLGREYBJFO-WMZOPIPTSA-N 425.520 4.260 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(C(C)C)cc1 1630762953 HVEMVGRNXKWVDJ-JOCHJYFZSA-N 426.557 4.400 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)CCCC1 1631328582 KIPSUOLWETUTSY-UHFFFAOYSA-N 441.572 4.092 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@]2(C)CCc3c(C)c(O)c(C)c(C)c3O2)cc1 1639814436 YLXWQCTWTKVHDG-RUZDIDTESA-N 426.557 4.005 10 10 IICE O=C(NCc1c(O)cccc1F)c1cc(I)c(Cl)cc1Cl 1645051053 UNBQKVDFCPMHEM-UHFFFAOYSA-N 440.039 4.373 10 10 IICE C[C@@H](C(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)N1CCOc2cc(N(C)C)ccc21 1645147761 LMBQPBAKXQDGJG-ZDUSSCGKSA-N 444.507 4.380 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3C[C@@H](OCc4ccccc4)C3(C)C)CC2)cc1 1671953972 MDJIASNEBXVNMM-DNQXCXABSA-N 437.584 4.301 10 10 IICE C[C@H](NC(=O)NC[C@](C)(C(=O)OC(C)(C)C)c1ccccc1)c1ccc(N(C)C)cc1 1681778357 ALJCZHBTXVOUBK-BVZFJXPGSA-N 425.573 4.412 10 10 IICE COC[C@@H](NC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)c1cccc(Br)c1 1682102209 YKWCQAZGMDLCOF-IIBYNOLFSA-N 448.405 4.441 10 10 IICE CC(C)c1ccc(O[C@@H](C)CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1682216583 PFQMNKZERMHOMS-IBGZPJMESA-N 425.573 4.038 10 10 IICE CC1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1693722398 YODMYZPBIUJUHP-UHFFFAOYSA-N 439.648 4.360 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCc2cccs2)n1Cc1ccc(N2CCOCC2)cc1 1743582646 HBCNWVLGPNZEEE-LJQANCHMSA-N 439.629 4.417 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1 1745837599 OGSAWUCMDUCYKG-HSZRJFAPSA-N 441.620 4.072 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCc1ccccn1 1747754989 WYXFSPUTXMXWPW-IFMALSPDSA-N 435.572 4.176 10 10 IICE CS(=O)(=O)c1ccc2nc(Nc3cccc4c3C(=O)c3ccccc3C4=O)sc2c1 1859832760 KLPLRASBICOBLW-UHFFFAOYSA-N 434.498 4.219 10 10 IICE CCOC(=O)c1ccccc1N1C(=O)C(O)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1872957907 KJTKHBKADIWZEC-UHFFFAOYSA-N 430.460 4.113 10 10 IICE Cc1ccc([C@@H](C2CCC2)n2nc(C3CC3)c(CN)c2I)c(O)c1 2078999423 PIJWUMUCAYMVAH-GOSISDBHSA-N 437.325 4.227 10 10 IICE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=O)NC(=O)N([C@@H](C)c3ccccc3)C2=O)o1 2297348023 SDSPCQIJGZJSFK-HNNXBMFYSA-N 445.431 4.386 10 10 IICE COC(=O)C1=C(C)N(CCc2ccc(OC)c(OC)c2)C(=O)C1=Cc1ccccc1Cl 2313510748 MAADCEFXAYFTNV-UHFFFAOYSA-N 441.911 4.273 10 10 IICE COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)Nc1ccc(Cl)cc1C 2313682554 FYPKFPIDTZHGIL-UHFFFAOYSA-N 427.888 4.309 10 10 IICE CC(C)Oc1cccc(C=C2SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)c1 2323866057 MNFHHQDMIUFQFN-SFHVURJKSA-N 427.547 4.371 10 10 IICE Cc1ccc(CNc2ccc(N)cc2I)c(O)c1Br 2352626079 PSHRAKPRQLXFDK-UHFFFAOYSA-N 433.087 4.262 10 10 IICE Cc1cc(C(=O)COC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)c(C)n1-c1ccc(F)cc1 12656401 XCADRQFULCKUOX-HXUWFJFHSA-N 438.430 4.224 10 10 IICE COc1ccc(N2CCn3c(nc4ccccc43)C2)cc1NC(=O)COc1cccc(C)c1 19855491 GMAPANGILZAWHX-UHFFFAOYSA-N 442.519 4.391 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3ccc(F)cc3)=NN2C(=O)COc2cccc(C=O)c2)cc1 72413289 JVCPAMOYSYQBFE-VWLOTQADSA-N 445.494 4.461 10 10 IICE COc1ccc(N2CCN(Cc3cc(=O)c(OC/C=C\c4ccccc4)co3)CC2)cc1 97571353 DVMLPYZYOKRJOE-YVMONPNESA-N 432.520 4.063 10 10 IICE O=C1N=C(N2CCN(Cc3ccccc3)CC2)S/C1=C/c1ccc(N2CCCCC2)o1 205773608 KZGIYFXQXAMQOZ-HEHNFIMWSA-N 436.581 4.058 10 10 IICE CN(C)c1ccc(CN(C2CC2)S(=O)(=O)/C=C/c2cccc(Br)c2)cc1 727448605 LSQBICNEKVJJAP-OUKQBFOZSA-N 435.387 4.480 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1c(O)ccc3c1CCCC3)O[C@@H](C)C2 743600235 SLBUEKXICUJSEG-OHEPNIRZSA-N 436.552 4.348 10 10 IICE C[C@@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)c1cccc(NS(C)(=O)=O)c1 745671507 NHTPXAGESYALBV-QGZVFWFLSA-N 445.585 4.369 10 10 IICE Cc1ccc(/C=C/C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c(Br)c1 749626018 GLVJSEYWMBMKSV-FMIVXFBMSA-N 445.357 4.039 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@@H]2[C@H]2CNC(=O)C2)c(C)n1-c1ccc(F)c(Cl)c1 764465945 NELXJHDNGDUPMS-IIBYNOLFSA-N 431.939 4.060 10 10 IICE Cc1nn(C(F)F)c(C)c1COC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 774204093 VMEFALPNPZQQMW-UHFFFAOYSA-N 430.499 4.360 10 10 IICE CN1[C@H]2CC[C@H]1CC([C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc(Cl)cc1)C2 802409032 PEFVXCHSGKLPMO-GCJBGDAQSA-N 426.944 4.495 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)C1 802680071 SMIOTHGESRNSQP-FCHUYYIVSA-N 435.572 4.147 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(Br)c(OC(F)(F)F)c1 1126523473 NBAHHUDSKMAHSG-UHFFFAOYSA-N 445.235 4.453 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)O[C@H]1CCOc2ccccc21 1127802628 ZTRSTFQLJDPQCA-DYGKOUCMSA-N 443.521 4.484 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(C(=O)N(C)CC(C)(C)C)c2)cc1 1130745112 QHEZTXIPTNEZKR-UHFFFAOYSA-N 425.573 4.022 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COc3ccccc3C2)c(C)n1-c1ccc(Br)cn1 1135724548 DUSPKMSDJUMKDS-MRXNPFEDSA-N 440.341 4.233 10 10 IICE O=C(CC1CCN(CC(F)(F)F)CC1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1143192382 XUEZAXSKDOUVOV-UHFFFAOYSA-N 449.464 4.037 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1F 1150241362 YWAAIDCURCFLNR-UHFFFAOYSA-N 435.499 4.017 10 10 IICE COCCOc1cccc(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1270439102 JFTBUIFCDQHYFM-SFHVURJKSA-N 430.976 4.460 10 10 IICE CC(C)N(C)CCCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1287896603 INPFTVPJDKXJMB-UHFFFAOYSA-N 428.968 4.066 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N1CCCCc2cccnc21 1288202338 DSTAXVDYTJEICX-SAPNQHFASA-N 443.619 4.494 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](c1cccc(Br)c1)N1CCCC1 1290288757 AIWAOSQNYNDUMG-NRFANRHFSA-N 430.390 4.311 10 10 IICE CCN(c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1)C1CCCCC1 1295189255 DDWKQQOYNLVIPG-UHFFFAOYSA-N 431.635 4.477 10 10 IICE CC(C)Cc1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1302876804 RICBDKSZVDBAEB-UHFFFAOYSA-N 443.611 4.373 10 10 IICE CCn1cc(CN(C)c2nnc(CC(C)(C)C)n2CCCSc2nccs2)cn1 1313839775 BEVIMBMHUJUXJT-UHFFFAOYSA-N 433.651 4.358 10 10 IICE CN(Cc1ccco1)c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1314758088 UJQIZMXGAGKYGC-UHFFFAOYSA-N 426.571 4.132 10 10 IICE CN(C)c1ccc(CNC(=O)Cc2ccc(Br)c(Br)c2)cc1F 1351738761 QRTLTTBQGVBBFJ-UHFFFAOYSA-N 444.142 4.276 10 10 IICE Cc1cc(C(F)(F)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cnc1Cl 1355130410 LXVQNGHQUINXCW-ZIAGYGMSSA-N 441.881 4.204 10 10 IICE C[C@H](c1cccnc1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1434936160 BCCMXOWEYDFFKU-CRRKTRLDSA-N 429.542 4.032 10 10 IICE Cc1ccc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)nc1C 1436631183 KWBPJONOHRSFSA-BOPFTXTBSA-N 431.608 4.058 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccn(-c3ccc(Cl)cc3)n2)cc1 1442621121 XMCZNEQQUPMKBV-JOCHJYFZSA-N 438.959 4.413 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(CCc3ccccc3)ccc2O)N(C)C)cc1 1456938867 ZWUXPJGKSGTAJN-RUZDIDTESA-N 431.580 4.276 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1cccc(C(N)=O)n1 1457576763 VICSAFNPWCVRAB-KRWDZBQOSA-N 442.441 4.106 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1ncnc2ccc(I)cc12 1458084494 NLBFGDYILJUXJC-UHFFFAOYSA-N 444.320 4.471 10 10 IICE CCCc1csc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1458499183 VRLPDCWJTIFSEH-XNTDXEJSSA-N 435.571 4.465 10 10 IICE Cn1c(-c2ccccc2)cnc1SCC(=O)Nc1ccc(I)cc1 1458856193 LRLUWVJMKDWTRV-UHFFFAOYSA-N 449.317 4.423 10 10 IICE Cc1cc(C(=O)NC2CC(C)(C)NC(C)(C)C2)c(C)n1-c1ccc(Br)cn1 1463899237 AYPIKNZRJSMVCN-UHFFFAOYSA-N 433.394 4.291 10 10 IICE COc1ccc(C(=O)c2ccccc2C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1469280256 MFWKLBGLRFNKPT-LJQANCHMSA-N 444.531 4.191 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)c1C 1473008328 ZYULTJSZESQVNX-UHFFFAOYSA-N 432.436 4.010 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N2CCN(c3ccc(F)cc3)CC2)cc1 1473250287 FWOAXMJFDXWYIO-UHFFFAOYSA-N 447.554 4.232 10 10 IICE CC(C)N1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1509561631 SXSAVRBWRGMQPY-UHFFFAOYSA-N 438.664 4.218 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCC[C@H](C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1510600403 CPYJQRFFOZODOI-PGRDOPGGSA-N 448.615 4.456 10 10 IICE COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)O1 1519283112 OWGCLQKDBBJKHS-AMAIZTLDSA-N 444.959 4.000 10 10 IICE COc1c(C)cccc1CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1530621297 NBBXVZAJHYSXEQ-PDGQHHTCSA-N 444.553 4.050 10 10 IICE Cc1ccn([C@@H](C)CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1539360614 DDJOTWKANOQWRG-AWEZNQCLSA-N 439.317 4.254 10 10 IICE CCOc1ccc(CN2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1539576386 UHNKOWGBAQJWLM-UHFFFAOYSA-N 445.563 4.263 10 10 IICE CCN(CC)c1ccc(CNC(=O)/C=C\c2ccc(I)o2)cc1F 1543251654 WMZKFUSXSSBBTM-YFHOEESVSA-N 442.272 4.199 10 10 IICE CCc1nnc(N2CCO[C@](C)(C(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1546547236 OQBQPNGMKPBZHM-DEOSSOPVSA-N 443.661 4.083 10 10 IICE COCCC(C)(C)Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1555414431 SYECLEKHYYOYNM-NRFANRHFSA-N 441.620 4.081 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)cc1C 1555749536 ISTKPCSGUBWFEW-GMAHTHKFSA-N 441.620 4.195 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCN(CC3CC3)C2)c(C)n1-c1ccc(Br)cn1 1557683937 OGUVGADHXXUQKP-GOSISDBHSA-N 445.405 4.103 10 10 IICE Cc1ccc(-c2csc(NC(=O)CN(Cc3ccccc3O)C[C@@H]3CCCO3)n2)cc1 1559635599 XSZQXAXHWLGYIH-FQEVSTJZSA-N 437.565 4.444 10 10 IICE CC(=O)N/C(=C\c1ccccc1)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1568142091 MYGMBNATPMGCOV-CPEHUTGBSA-N 425.960 4.370 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4cc(F)cc(Br)c4)CC3)C2)cc1 1585664803 GMFUYVGMUAIZPI-HNNXBMFYSA-N 447.348 4.271 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3Cl)CC2)c(OC)c1 1595989928 MJSJXFNMZSRKLO-MSOLQXFVSA-N 435.351 4.463 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4ccccc4C)cn3)CC2)c(OC)c1 1595997581 XMXXQSANOCGGRO-UHFFFAOYSA-N 433.508 4.162 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1 1598022629 KTAMUYODUZMNRZ-PXNSSMCTSA-N 439.556 4.282 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2cscn2)cc1 1615381021 OQZIRDSXZATAAZ-LJQANCHMSA-N 440.617 4.160 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@@H]2[C@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1625680342 VCUMCNUXCQZQIR-MJGOQNOKSA-N 432.362 4.281 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCc3ccc(-c4ccccc4F)o3)cc2)CC1 1626090793 XMTBBBFCESGSGL-UHFFFAOYSA-N 449.526 4.036 10 10 IICE COc1cc(CNC(=O)c2cc3cc(O)c(O)cc3s2)ccc1OCc1cccnc1 1628457752 MLGRHQCFQMAVIC-UHFFFAOYSA-N 436.489 4.225 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)c(C)n1-c1ccccc1 1634632831 GNFDZSLYPDHUTB-HSZRJFAPSA-N 445.567 4.242 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](c2ccccc2)C(C)(C)CO)C1 1635891665 DUTDNGKCRAWGJN-SANMLTNESA-N 433.596 4.284 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCO[C@@H](c2cccnc2)C1 1636379007 VRVXBWYXRKROLD-IEBWSBKVSA-N 434.334 4.002 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)C[C@@H]1CCC(=O)NC1 1638241819 XHSOBWCISQIYLM-KXBFYZLASA-N 433.474 4.214 10 10 IICE CCN(CC(=O)N(C)CCOc1cc(C)cc(C)c1)Cc1cc(Br)ccc1O 1641893186 XSTRATIXUFBZOH-UHFFFAOYSA-N 449.389 4.131 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C2CCCC2)[C@@H](C)CO)sc(C)c1-c1ccccc1 1642726365 KNXYWYAIUTWKGP-INIZCTEOSA-N 444.597 4.464 10 10 IICE CCCC1(CCC)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)C1=O 1643337645 BXCQILGEIVMFJV-UHFFFAOYSA-N 430.936 4.216 10 10 IICE Cc1cc(CNC(=O)[C@]2(C)C[C@@H](NC(=O)OC(C)(C)C)CCO2)c(C)n1-c1ccccc1 1643369370 CRHDDPOJLZDUPQ-CPJSRVTESA-N 441.572 4.173 10 10 IICE CON(Cc1ccc(C)o1)C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1644990906 FBDKDNAOBKGEJF-LFIBNONCSA-N 436.580 4.221 10 10 IICE Cc1cc(C(=O)N2CCO[C@@](C)(C(F)F)C2)c(C)n1-c1ccc(Br)cc1 1646124404 SJKKAXYYJCFVPZ-LJQANCHMSA-N 427.289 4.353 10 10 IICE COC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCN(c2ccc(OC)cc2OC)CC1 1648083991 AQKWCCNJOVTSQT-FQEVSTJZSA-N 439.339 4.047 10 10 IICE CCCCOc1ccc(-c2nnc(COc3ccc(N(C)C)c(C(=O)OC)c3)o2)cc1 1653037342 YHHVHJCKNXPICQ-UHFFFAOYSA-N 425.485 4.347 10 10 IICE CC(=O)N1CCN(c2cccc(NCc3cc(Cl)cc(Br)c3O)c2)CC1 1657802383 XXVDGEUIIAJDOA-UHFFFAOYSA-N 438.753 4.089 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCCNC(=O)c3ccccc3)cc2Cl)C1 1671669488 RZUUNEZFGAUBST-GOSISDBHSA-N 442.991 4.196 10 10 IICE O=C1C[C@@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CN1c1c(F)cccc1F 1679599970 XTAUNWXJJKGQST-QGZVFWFLSA-N 443.494 4.320 10 10 IICE CCCN(Cc1ccc(F)cc1F)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1681850012 NEVDMHOTHKEJOB-UHFFFAOYSA-N 439.453 4.201 10 10 IICE C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C[C@H](c2ccccc2)C1 1683300713 UHADICKTVCFEGB-WUMKDDEVSA-N 448.611 4.160 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@H]2Cc2cc(F)ccc2F)N(C)C)cc1 1685609215 MEWMHWAKANSMHJ-GMAHTHKFSA-N 430.543 4.050 10 10 IICE CNC(=O)CC1(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CCCCC1 1686268918 INCCTIUWMVYLIY-SFHVURJKSA-N 449.039 4.462 10 10 IICE CC1CCC(N(C)c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)CC1 1708018759 QTNUTZDGWGLWFP-UHFFFAOYSA-N 448.662 4.168 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2cc(Cl)ccn2)cc1F 1711006238 UEWOTCCNUSUYEI-HXUWFJFHSA-N 444.942 4.068 10 10 IICE Cc1nnc(N2CCN(c3ccccc3F)C[C@@H]2C)n1CCCSc1nccs1 1751929808 WBEKXUXQOJFVFD-HNNXBMFYSA-N 432.594 4.080 10 10 IICE Cc1cccc(-c2nnc(N3CCC(F)(F)CC3)n2Cc2ccc(N(C)C)c(F)c2)n1 1761941979 WHZJZIIWXRQXCY-UHFFFAOYSA-N 430.478 4.137 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@H](C)[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1761960127 DKIGXFXWXPVZTL-IAGOWNOFSA-N 440.592 4.232 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCO)CCO1 1763476431 OFICPIHQZQQNIE-QFIPXVFZSA-N 437.588 4.130 10 10 IICE COc1ccc(OC)c(N2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)c1 1860084855 RSOWJGDBSMHZPE-LZYBPNLTSA-N 431.564 4.436 10 10 IICE CC(C)Cc1cnn(Cc2cc(Br)ccc2O)c1I 2070297283 GQXKCURDYAAJOH-UHFFFAOYSA-N 435.103 4.203 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(F)CCC[C@@]2(NCc2ccc(Br)cc2O)C1 2126045739 GJMOXUNVQAAFTO-RBUKOAKNSA-N 429.330 4.126 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 2193233499 KTROGDVRQUTJNG-RDJZCZTQSA-N 447.270 4.446 10 10 IICE COc1ccc(Br)c(CNC[C@@]2(C)CCCN2C(=O)OC(C)(C)C)c1O 2227752761 XMKHKGYEIGUCNM-LJQANCHMSA-N 429.355 4.043 10 10 IICE Cc1cc(C)cc(OCCOc2cccc(C=C3C(=O)NN(c4ccccc4)C3=O)c2)c1 2293500561 DBRPBDYBKLBTIN-UHFFFAOYSA-N 428.488 4.223 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3nnc(C)s3)C2=O)cc1 2295914201 MIHINEJWNCWXET-UHFFFAOYSA-N 432.596 4.029 10 10 IICE C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(Br)cc3)o2)SC1=S 2295923772 VNJRMAWKUKKZSC-VIFPVBQESA-N 438.324 4.383 10 10 IICE COc1cc(C=C2C(=O)N(Cc3cccc(Cl)c3)N=C2C(F)(F)F)cc(OC)c1O 2332147471 GDFDHDOSJZPDRS-UHFFFAOYSA-N 440.805 4.407 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccc(F)cc1)C[C@H](c1cccc(OC)c1O)N2 65298203 GFSCHOHYTHORSQ-HXUWFJFHSA-N 441.503 4.012 10 10 IICE biogenic CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(OC)c1O)N2 251401551 ZDWGRAJKBSZWAF-KXXRBXEXSA-N 428.554 4.304 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(F)c3)[C@H]2c2ccc(O)c(O)c2)c1OC 526150436 BCHALAWVVOYERH-NRFANRHFSA-N 437.423 4.311 10 10 IICE COc1ccc2c(CC(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)coc2c1 742799341 JQQKAPBADJGHIG-INIZCTEOSA-N 430.451 4.371 10 10 IICE O=C(N[C@H]1CCN(c2ncccc2Cl)C1)N(Cc1ccco1)Cc1ccccc1O 757763118 NFYUYVSCXUGRTJ-KRWDZBQOSA-N 426.904 4.024 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1COc2c1ccc(Cl)c2Cl 764790286 JDPXDXJLHMHQAY-GFCCVEGCSA-N 432.101 4.394 10 10 IICE Cc1ccc(C)c(NC(=O)COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 769665459 SGBLZEMWRNBBBM-UHFFFAOYSA-N 433.552 4.207 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(C)c(C)c3)cs2)c(OC)c1 777666586 ZTHRKRIQEWZSRW-UHFFFAOYSA-N 434.539 4.254 10 10 IICE Cc1nc([C@H]2CCCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 814679479 GPWLYBFKRDJICR-PZJWPPBQSA-N 443.613 4.233 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Oc2ccc(Cl)cc2)cn1 1125187278 NCMDJIHXLQTGCH-UHFFFAOYSA-N 441.890 4.433 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(NC(=O)C2CC2)s1 1125877536 GMJCLJWXCLNJNN-UHFFFAOYSA-N 435.496 4.097 10 10 IICE Cc1ccc(-c2nc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cs2)n1C 1126580478 ACZJJJQQLGVRMW-HNNXBMFYSA-N 446.523 4.457 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(Br)c2nccn2c1 1135968334 RSANRWYAKWEPAN-UHFFFAOYSA-N 427.346 4.359 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H](C)CC(=O)c3ccc(F)cc3)cc2F)C[C@@H](C)O1 1141901652 JUFMGSRMOPBJEX-BRWVUGGUSA-N 430.495 4.104 10 10 IICE COC(=O)c1cc(-c2ccccc2CNC(=O)c2ccc(-n3c(C)ccc3C)cc2)[nH]n1 1152733337 HPXKPMARYFJJQK-UHFFFAOYSA-N 428.492 4.201 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC(C)(C)CCNC(=O)OC(C)(C)C)cc1 1162197139 QRBSHHPVSTXUME-UHFFFAOYSA-N 441.572 4.259 10 10 IICE CC1(C)C[C@@H](NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2cc(F)ccc2O1 1230648299 JNNKYCMHWHQMNC-JOCHJYFZSA-N 441.547 4.136 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(NCc4ccccn4)c3)cc2F)C[C@@H](C)O1 1291756371 PWXQBKKKWDDFJN-RTBURBONSA-N 448.542 4.376 10 10 IICE CCCCN(CCOC)c1nnc(-c2cccc(C)n2)n1Cc1ccc2c(c1)CCCN2C 1294252213 IPJMWRUBINFSFC-UHFFFAOYSA-N 448.615 4.332 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CC=C(C(F)(F)F)CC1 1304238576 VDAQXAWALDXCNT-SFHVURJKSA-N 449.521 4.294 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCN(CC(C)C)CC1 1304239852 DVZNJBHRBDYQEP-UHFFFAOYSA-N 438.664 4.212 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1305381518 IRZOEMHIZWYLRB-KRWDZBQOSA-N 441.551 4.353 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccccc1O 1307502547 XZIKBAJCCFTFQI-UHFFFAOYSA-N 428.488 4.018 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3cc(Cl)cc(Cl)c3C2)N(C)C)cc1 1313410861 GJWBEDFXHJXINU-NRFANRHFSA-N 435.399 4.430 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@H](C3CC3)O[C@H](C)C2)cc1 1313679623 OXVSNUXNODXCPS-AUSIDOKSSA-N 425.621 4.375 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)C1(C)C 1314257654 RYXQBHVHAOVINU-LEWJYISDSA-N 443.661 4.082 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3ccc(Br)cc3)cc2F)C[C@H](C)O1 1350933302 MSJVAQWWTTUJRA-HOTGVXAUSA-N 449.364 4.451 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCCC[C@@H]2N2CCOCC2)c(C)n1-c1ccc(Cl)cc1 1355606067 UAHQDIDJVCOKBK-PKTZIBPZSA-N 429.992 4.050 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(S(=O)(=O)C(F)(F)F)c1 1358371039 IJFQMELKJPOCQY-UHFFFAOYSA-N 428.476 4.097 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccnc(Cl)c1F 1460809136 YAIRUMXMTBQVHB-LCYFTJDESA-N 439.896 4.243 10 10 IICE Cc1cc(C(=O)NC[C@H]2COC3(CCCC3)O2)c(C)n1-c1ccccc1Br 1466426087 IFSSXBNUOHGLBU-INIZCTEOSA-N 433.346 4.272 10 10 IICE Cc1ccc(CN2CC[C@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2=O)cc1 1472773603 BJDSHYZYUBJKPO-QHCPKHFHSA-N 429.476 4.347 10 10 IICE C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1478786229 LNWNSASKSIRDPC-VGOFRKELSA-N 429.511 4.484 10 10 IICE COCCN(Cc1ccc(F)c(Cl)c1)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1478860642 QBOWTETUKJTVDW-GOSISDBHSA-N 449.954 4.172 10 10 IICE Cc1nc(C[C@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)no1 1492686042 RFYGPAHZWYHWES-MRXNPFEDSA-N 447.634 4.191 10 10 IICE CCCCN(CCOC)c1nnc(-c2cccnc2)n1Cc1ccc2c(c1)CCCN2C 1500451103 YJPKCACBNFLSBS-UHFFFAOYSA-N 434.588 4.024 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)cc2C)o1 1510857745 LYNNNKRUYDDLAX-UHFFFAOYSA-N 430.556 4.224 10 10 IICE Cc1nsc(C)c1COC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1526736273 HZIBMSCHDGONBE-CXUHLZMHSA-N 436.555 4.234 10 10 IICE C/C=C/COc1cccc(CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1535561612 PZPIENITZWTLOE-NSCUHMNNSA-N 433.596 4.032 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CC(c3ccccc3)c3ccccc3)cc2)CC1 1537839975 SXZSSNGZUAIXRX-UHFFFAOYSA-N 441.575 4.227 10 10 IICE Cn1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c(C(F)F)n1 1540300213 PCVVUXBDILLWOV-WQLSENKSSA-N 442.538 4.039 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1c[nH]cc1Cc1ccccc1 1543114452 VUDFTUUFZBYMSO-UHFFFAOYSA-N 443.469 4.391 10 10 IICE COC(=O)CCOc1ccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1544430838 HYQYMLXVQJQJDC-UHFFFAOYSA-N 434.492 4.030 10 10 IICE CC(C)N(CCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)C(=O)OC(C)(C)C 1544524002 MIILJPILOPIPSW-JOCHJYFZSA-N 447.620 4.296 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1CC(F)(F)C1 1545332814 OUWNCJJARPUVMZ-KRWDZBQOSA-N 433.547 4.310 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)CC1 1547310904 IZNWWXBMFQNFIP-IBGZPJMESA-N 448.615 4.457 10 10 IICE COC[C@@H](C)Cn1c(CC2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1555240435 BMEJNOVBECFHJZ-FQEVSTJZSA-N 441.620 4.019 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(c4ccc(F)cc4F)CCCC3)CC2)cc1F 1564602741 JTTJTCWAOPTLKR-UHFFFAOYSA-N 447.501 4.456 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCOc2cc(Br)ccc2C1 1564946163 KYSFBGODPKSEEL-INIZCTEOSA-N 446.389 4.359 10 10 IICE CN(Cc1cscc1Br)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1565452362 ASYAXTPMEZHTKX-GOSISDBHSA-N 439.423 4.021 10 10 IICE Cc1cc(C(=O)Nc2cnn(CC(F)(F)F)c2)c(C)n1-c1ccc(Br)cn1 1565707528 AVLJNEMTNGYHRO-UHFFFAOYSA-N 442.239 4.263 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@H]2CCc3sccc3C2=O)cc1 1583919324 NXBKDPXDKGEUKR-QUCCMNQESA-N 426.582 4.157 10 10 IICE Cc1cc(C(=O)NCCN2Cc3ccccc3OCC2=O)c(C)n1-c1ccc(C(C)C)cc1 1595511937 OUMGXZVGWWUYQO-UHFFFAOYSA-N 445.563 4.369 10 10 IICE CCOC(=O)c1cnc(NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)s1 1612346017 ZQDUTRJGFMAFDZ-MRXNPFEDSA-N 434.562 4.064 10 10 IICE Cc1ccc(C(=O)N2CCC(c3nncn3C(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1616276226 XQRCILUTUQQBPX-UHFFFAOYSA-N 433.556 4.407 10 10 IICE Cc1cc(C(=O)N2C[C@H](C(F)(F)F)OC[C@H]2C)c(C)n1-c1ccc(Br)cn1 1623755829 YGUMIUBLNOWJTL-IAQYHMDHSA-N 446.267 4.043 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]nc1-c1ccccc1F 1629056033 YEJCDSWXKGWSQZ-CQSZACIVSA-N 430.430 4.216 10 10 IICE CCc1csc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1630684005 MCSDTEIGIHXXGW-HMHNVIDESA-N 449.598 4.313 10 10 IICE Cc1ccc(OCCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(Br)c1 1632398686 JPDVAHTXVRFHNU-GOSISDBHSA-N 448.357 4.440 10 10 IICE O=C(NCc1cc(O)ccc1O)c1c(C(F)(F)F)nn(-c2ccccc2)c1C(F)(F)F 1633594937 BRDWGIPZEGBUEL-UHFFFAOYSA-N 445.319 4.251 10 10 IICE Cc1ccc(C(=O)N2CCC(CNC(=O)OC(C)(C)C)(c3ccccc3)CC2)c(O)c1O 1639681290 TXEPYZQWNJIWSB-UHFFFAOYSA-N 440.540 4.105 10 10 IICE O=C(CSc1ccc(Cl)cc1Cl)NCc1ccc(N2CCOCC2)c(F)c1 1643931824 FNQOXJMRBNJFIW-UHFFFAOYSA-N 429.344 4.378 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C)c4ccccc43)cc2F)C[C@@H](C)O1 1645224451 VDXCJPDIDAFTKG-VAMGGRTRSA-N 439.575 4.459 10 10 IICE Cc1ncc(CNC(=O)CCSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)s1 1651743098 NGIVTTSFNWZBLT-GOSISDBHSA-N 442.610 4.293 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)O[C@H](CC)C2)sc(C)c1-c1ccccc1 1653392635 ZLVDXOBEANSHPO-MAUKXSAKSA-N 430.570 4.338 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(=O)NC)C1 1695226173 NNCAGEYBHRWSJJ-HXUWFJFHSA-N 434.588 4.115 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@@H]1OC 1710030988 ZJISOVNWOCLFNI-OFNKIYASSA-N 437.588 4.250 10 10 IICE Cc1nnc(N(C)[C@@H](C)c2cccs2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1762502783 PXYGIOJCSPULCP-KRWDZBQOSA-N 425.602 4.102 10 10 IICE CCN1C(=O)Cc2cc(-c3csc(NS(=O)(=O)c4ccc(Cl)cc4)n3)ccc21 1859572266 VNOLBJJNEAUIEU-UHFFFAOYSA-N 433.942 4.173 10 10 IICE CCN(CC)c1ccc(/C=C2/SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1 1860085783 ZZSVIXVIGPJLTP-WOJGMQOQSA-N 428.535 4.342 10 10 IICE O=C(CCn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)NC1CCCC1 1860345058 QGTDSEXWWNBJLE-UHFFFAOYSA-N 426.520 4.023 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)CCc2ccc(-c3cccnc3)cc2)c2nccn2C)cc1 1866179807 IAPZDMJLLQSWRC-AREMUKBSSA-N 439.563 4.387 10 10 IICE COc1cn(CCCN2CCCC2=O)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1870992832 GQRTUQRBVBVSGK-UHFFFAOYSA-N 446.551 4.225 10 10 IICE COc1ccc(OC)c2c1cc(C(=O)Nc1cccc3c1C(=O)c1ccccc1C3=O)n2C 1874179420 CYXINFBWMZJWRH-UHFFFAOYSA-N 440.455 4.223 10 10 IICE CCc1nn(Cc2cc(Br)ccc2O)c(I)c1CC 2079671271 YAYMEDCVDKAZFG-UHFFFAOYSA-N 435.103 4.129 10 10 IICE COc1ccc(Br)c(CNCCCCC2CN(C(=O)OC(C)(C)C)C2)c1O 2236053955 CGPZIOXOVNZVNJ-UHFFFAOYSA-N 443.382 4.290 10 10 IICE CC[C@]1(NCc2c(Br)ccc(OC)c2O)CCCN(C(=O)OC(C)(C)C)C1 2236054361 HOKPXCSONUOMRS-FQEVSTJZSA-N 443.382 4.433 10 10 IICE Cc1cccc(N2C(=O)C(=Cc3ccc(-c4ccccc4C(=O)O)o3)C(=O)NC2=S)c1C 2293779510 XETJVQMWQQRQOI-UHFFFAOYSA-N 446.484 4.093 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(NC(C)=O)cc3)C2=O)cc(OC)c1OC 2297478191 HKSMMECTIDTHMY-UHFFFAOYSA-N 444.534 4.077 10 10 IICE CCCCCCN1C(=O)C(=Cc2c(NCC)nc3ccc(C)cn3c2=O)SC1=S 2314414530 BRRSVZVOAHLCGW-UHFFFAOYSA-N 430.599 4.216 10 10 IICE CCc1ccc(Oc2nc3ccccn3c(=O)c2C=C2SC(=S)N(CC)C2=O)cc1 2314504319 DGMZSSBENTUKJA-UHFFFAOYSA-N 437.546 4.270 10 10 IICE CCCOC(=O)CCN1C(=O)C(=Cc2ccc(OC)c(Br)c2)SC1=S 2314740476 JJDBCJYYMPJFRV-UHFFFAOYSA-N 444.372 4.002 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(c3ccc(C(=O)O)cc3)C2=O)c1)C(=O)O 2314928439 VRBRTTPDTYDOGH-INIZCTEOSA-N 443.502 4.033 10 10 IICE CCN(CC)CCNC(=O)c1ccc(N=NN2CCN(CC=Cc3ccccc3)CC2)cc1 2330149543 REMLJXRQARDRAF-UHFFFAOYSA-N 448.615 4.088 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccc([N+](=O)[O-])cc2)cc1 2332148097 IPHHYOFQEHQVIZ-UHFFFAOYSA-N 429.432 4.447 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1cccc(Br)c1 1009695 USIIKMKRMPCCRR-OQLLNIDSSA-N 433.352 4.289 10 10 IICE CC(C)C(=O)Nc1cccc(OCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 39891030 BDSHAMWMJMWFOM-UHFFFAOYSA-N 442.471 4.074 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@H](c2ccccn2)c2ccc3cccnc3c2O)c1 54620930 QXUWBVRXJYJUHU-QFIPXVFZSA-N 443.459 4.110 10 10 IICE Cc1ccccc1N1C(=O)N=C(O)/C(=C\c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1=O 59859929 LUPBFVBZXJGVHX-GHRIWEEISA-N 434.452 4.400 10 10 IICE O=C1N=C(O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C(=O)N1CCc1ccccc1 59861856 LJIOANKXQVHXNW-XMHGGMMESA-N 431.404 4.400 10 10 IICE Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 109179985 FQWRFUSRZTUENS-MRXNPFEDSA-N 429.586 4.369 10 10 IICE C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(N2CCCCC2)cc1 773104205 NILVTSRFZXEGJZ-OAQYLSRUSA-N 441.641 4.453 10 10 IICE COC(=O)/C=C/c1ccc(N2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c([N+](=O)[O-])c1 776818311 VMTSMIJFQLFQRR-PBBIBXJJSA-N 449.507 4.053 10 10 IICE O=C(N[C@@H]1C[C@H]1C1CCN(Cc2c(O)ccc3ccncc23)CC1)OCc1ccccc1 793667477 JBTZTANDCKPZLW-XUZZJYLKSA-N 431.536 4.467 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cnnn2-c2c(Cl)cccc2Cl)C2CC2)cc1 1124905298 DXXLLXQKYADQHB-UHFFFAOYSA-N 430.339 4.445 10 10 IICE CCC(C)(C)c1ccccc1C(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 1127837604 ZPDJRZYJNBXQJN-UHFFFAOYSA-N 426.557 4.362 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1cccc(Br)c1 1137345321 CJCBPTZLPAOSPD-SFHVURJKSA-N 449.345 4.379 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1 1138047184 IQHBXZKAIZMKSR-BCHFMIIMSA-N 429.564 4.086 10 10 IICE CCC1(CC)CCCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 1169301720 XRWPCEHVUVDOAN-BGYRXZFFSA-N 433.612 4.348 10 10 IICE COc1ccc(N(CCC(C)C)CC(=O)Nc2ccccc2S(=O)(=O)C(F)F)cc1 1169980363 YPTPEGQYUFXCAJ-UHFFFAOYSA-N 440.512 4.183 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CC[C@@H](C)N(C(=O)OC(C)(C)C)C2)cc1 1234098044 XNPVCGWHVNRYNL-UYAOXDASSA-N 432.609 4.462 10 10 IICE COc1ccccc1[C@H](CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)OC(C)C 1235033763 VXISWMLXPIBFAU-CYFREDJKSA-N 427.589 4.466 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC(C)C)C1 1302390567 OSBGHIUJHLNRND-QFIPXVFZSA-N 437.588 4.393 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)N[C@H](C)c3ccccc3O)cc2)c1 1302530341 LZGNUCVOEDQNQJ-QGZVFWFLSA-N 425.506 4.268 10 10 IICE Cc1ccc(C(=O)NCCc2ccnn2-c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1303756453 BMEALOWAERVCFL-UHFFFAOYSA-N 426.520 4.373 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCc3ncc(Br)n3C2)c1C 1305281333 SPKGKWRVVOXUQD-INIZCTEOSA-N 427.346 4.106 10 10 IICE Cc1ccc(S(=O)(=O)NC[C@H](NCc2ccc(N(C)C)cc2)c2ccccc2)c(C)c1 1307626751 MXOSGXSFZHMVJB-DEOSSOPVSA-N 437.609 4.179 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)[C@@H](C)c1cccc(N2CCOC2=O)c1 1312886030 TXWKDMGOKPDIDV-OALUTQOASA-N 438.572 4.351 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@@H](CC)C2 1348205180 JXPTVOQFXZYMHW-CABCVRRESA-N 432.586 4.169 10 10 IICE COC(=O)C[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(C)cc1 1352506193 HSFAFXFOYYXAAW-JOCHJYFZSA-N 434.536 4.258 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1sc2ncccc2c1Cl 1446815213 JQRGKSVWGRDIPU-UHFFFAOYSA-N 425.293 4.124 10 10 IICE Cc1cc(C(=O)NC[C@H]2COC3(CCCC3)O2)c(C)n1-c1cccc(Br)c1 1446850574 XLAJUAQUEFDVOS-SFHVURJKSA-N 433.346 4.272 10 10 IICE C/C(=C\C(=O)N1C[C@@H](C)N(C(=O)OC(C)(C)C)Cc2ccc(F)cc21)c1cnccn1 1458091377 DNWGDNQNHZXMBZ-AAGJOFLKSA-N 426.492 4.191 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1459588885 SZLLSOJMJUYCHF-MJGOQNOKSA-N 425.960 4.246 10 10 IICE Cc1cc(CC(=O)NCC2(N(C)Cc3ccccc3)CCOCC2)c(C)n1-c1ccccc1 1462646639 WOXNPTGNNGGXBC-UHFFFAOYSA-N 445.607 4.434 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSc2nccn2Cc2ccccc2)cc1F 1465004803 HRDXDDHLQYCMBS-UHFFFAOYSA-N 426.561 4.325 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](c2ccc(Cl)c(F)c2)c2nn[nH]n2)c1C 1466725542 SOMQCQSSFUSJJH-FQEVSTJZSA-N 438.894 4.228 10 10 IICE CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 1478471042 MRQSYWQFTLIMOB-FUHWJXTLSA-N 442.526 4.036 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC[C@@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1479535050 RVWYZOLORRZBMN-ZEQKJWHPSA-N 445.611 4.076 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc4c(Br)cncc4s3)CC2)cc1 1517328915 XYHXWBBLLIGSLV-UHFFFAOYSA-N 446.370 4.420 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)OCc1nc(C2CC2)cs1 1537026588 JIRACYKTDJFMIR-CXUHLZMHSA-N 448.566 4.494 10 10 IICE Cc1ccc(C(=O)NC2CCN(Cc3ccncc3)CC2)cc1-n1c(C)cc(C=O)c1C 1544728325 MGUABJOOXIVRMV-UHFFFAOYSA-N 430.552 4.004 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1ccc(C(C)C)c(C)c1 1546151962 NGDJBTGJMJIYAP-INIZCTEOSA-N 433.932 4.447 10 10 IICE CCCN(CCC)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1547134860 JUPUZOMPUDDTFL-UHFFFAOYSA-N 425.621 4.429 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(-c2cccc(Cl)c2)c1 1566357085 WJUQAYZEEWNGPV-IBGZPJMESA-N 445.350 4.279 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(OCc2cccs2)c1 1570514972 WRDONEXSCIPLGY-UHFFFAOYSA-N 425.506 4.238 10 10 IICE CC(C)(C)OC(=O)NCCc1ccc(CNC(=O)c2cc3cc(O)c(O)cc3s2)cc1 1584229972 WQUOBXWCGRXJSW-UHFFFAOYSA-N 442.537 4.310 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(-c4ccccc4)cc3)CC2)c(OC)c1 1595996903 MROOXGPYPIELNP-FQEVSTJZSA-N 446.547 4.487 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC(F)(C2CC2)CC1 1616431688 JOIGBKKLZUXGRT-GHRIWEEISA-N 436.549 4.158 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(-c4cccc(Cl)c4)on3)cc2F)CC1 1616496418 PWTJHWVUFJIRLE-UHFFFAOYSA-N 442.922 4.206 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1csc(Cc2ccc(C)cc2)n1 1623928066 CZDULZJEHWTKDJ-UHFFFAOYSA-N 444.940 4.217 10 10 IICE CN(C)c1ccc(CN(C(=O)CN(C)c2ccc(C(F)(F)F)cc2C=O)C2CC2)cc1 1624262021 GNGWTWTUDONLJW-UHFFFAOYSA-N 433.474 4.211 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2cccc(OCCN3CCOCC3)c2)c1C 1626830219 MYSUTOQWQDZXDC-UHFFFAOYSA-N 447.579 4.044 10 10 IICE CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1627590587 KUUTVZLXIFQXCY-JOCHJYFZSA-N 431.024 4.236 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1nccn1Cc1ccccc1 1630188293 HIDSYPKIPKECJW-UHFFFAOYSA-N 426.520 4.424 10 10 IICE CC(C)C[C@H](CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)OC(C)(C)C 1636957997 YOKYCZTUBYIAKN-UXHICEINSA-N 434.577 4.229 10 10 IICE CC(=O)c1cc(Br)ccc1OCC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1642997832 OVJFYPQHDVGYED-HNNXBMFYSA-N 447.373 4.152 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1 1644865780 HSGLEIIAYDSENG-UHFFFAOYSA-N 431.492 4.242 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4ccc(C=O)s4)cc3)CC2)c(OC)c1 1648344079 KBTXAOIHEDFNEG-UHFFFAOYSA-N 436.533 4.207 10 10 IICE COc1cccc(S(=O)(=O)CCN(Cc2ccccc2)c2ccc(OC)c(OC)c2)c1 1648669638 YOEUAEZTLYKDLB-UHFFFAOYSA-N 441.549 4.193 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1cccc(COC[C@H]2CCCO2)c1 1673743467 FAURISSFKDBUDI-NBGIEHNGSA-N 439.600 4.187 10 10 IICE Cc1ccc(SC[C@@H](C)NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1686149652 GNRRSZDNMUXBER-MRXNPFEDSA-N 435.540 4.090 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc(F)c(C(F)(F)F)cc2F)cc1 1686387565 WGYQFMLFLRXYHG-UHFFFAOYSA-N 431.405 4.270 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(N)=O)CC1 1706206435 UUMJTKKWNIWKHE-UHFFFAOYSA-N 446.599 4.411 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2=CCCCC2)CCOC1 1706663544 MSIOGMHCNCVRMI-DEOSSOPVSA-N 426.561 4.161 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@@H](C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1707274215 SRZVWMIMFHNQBN-OALUTQOASA-N 437.588 4.127 10 10 IICE Cc1cnn([C@@H]2CCCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)c1 1707701026 AXVDQEOOUGUKFS-LJQANCHMSA-N 439.583 4.175 10 10 IICE CCC[C@H](C)N(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1709492499 DWGYCWPTHAOFHR-KRWDZBQOSA-N 427.572 4.018 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C(C)C)C1 1728197980 IZRRSEVCMJKBCT-NRFANRHFSA-N 448.615 4.361 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C(C)C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1742118843 LURUJKUETVSTFX-OAQYLSRUSA-N 448.615 4.313 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)NC(C)C)nnc1N(C)[C@@H](C)c1cccs1 1742138868 GKWAZCTYYKPCBF-KRWDZBQOSA-N 440.617 4.098 10 10 IICE CC(C)CN1CCC[C@@H](Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1761116834 OQCJRWSUBIBAFF-NFBKMPQASA-N 441.620 4.230 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H]3CCC=CO3)CC2)cc1 1768705150 XKQVSDGXBNOGDY-JOCHJYFZSA-N 439.604 4.285 10 10 IICE Cc1nc2scc(C)n2c1/C=C1/SC(=S)N([C@@H](C(=O)O)c2ccccc2)C1=O 1858591616 ULBHJBNOFRUUBG-UJMHRVFCSA-N 429.548 4.040 10 10 IICE CSc1ccc(CNCCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1860711692 IVCQXWUKCXMFQQ-UHFFFAOYSA-N 430.529 4.302 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccc(F)cc3)C(=O)N(C3CC3)C2=O)cc1 1873164846 VPEJDRSHYYVKSO-UHFFFAOYSA-N 429.495 4.265 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2ccc(Cl)c(C(=O)O)c2)o1 2297342024 BPZYGICGBZZDQD-UHFFFAOYSA-N 442.855 4.093 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N([C@@H](CC(C)C)C(=O)O)C1=O)C(C)=O 2314928475 WLWXDLWPFVEKKL-JKSUJKDBSA-N 435.567 4.134 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@H](NCc1cc(Br)ccc1O)C2 2333628607 BYPHLRYZZDBAPD-CKEIUWERSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2c(O)cccc2Br)C[C@@H]2CCC[C@H]21 2335127956 OPIJJOWCZLNPJK-GRDNDAEWSA-N 425.367 4.422 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccco3)C2=O)c(C)n1-c1ccc(F)c(Cl)c1 24504292 VBKRZFKSGWJJQA-QFIPXVFZSA-N 443.862 4.130 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C\c2ccccc2[N+](=O)[O-])c(C)n1-c1ccc2c(c1)OCO2 34767782 GQCCHOQNHPSRMR-YFHOEESVSA-N 448.431 4.170 10 10 IICE CC[C@H](NCC[C@@H]1CN(Cc2ccccc2)CCO1)c1cc(Br)ccc1O 312364340 YZMXFGVAKPZJJZ-CTNGQTDRSA-N 433.390 4.487 10 10 IICE O=C(Nc1ccccc1Br)C1CCN(Cc2cc3c(cc2O)CCC3)CC1 738149790 VZEAEGXTFDZHKK-UHFFFAOYSA-N 429.358 4.494 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)c2cccs2)NC(=O)OC(C)(C)C)cc1 742755131 WAWHKEXISBUXLJ-GOSISDBHSA-N 431.602 4.474 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cn2cc(Cl)ccc2n1 745429138 LOTKVBULNPMMNO-UHFFFAOYSA-N 437.725 4.188 10 10 IICE COc1ccc(Br)cc1S(=O)(=O)N(Cc1ccccc1O)C1CCCC1 751355777 HWEKDYFARPMTEP-UHFFFAOYSA-N 440.359 4.297 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)c1 769529501 CMVROKPTHWFITH-NDXORKPFSA-N 442.943 4.144 10 10 IICE COc1cccc(CNC(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1O 777750258 HZPFXEKQRPSLJK-QUCCMNQESA-N 435.927 4.217 10 10 IICE C[C@@H](NC(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1)c1ccc(N(C)C)cc1 791722124 WZGTYVUUTVEAQI-IIBYNOLFSA-N 429.536 4.377 10 10 IICE COc1ccc(C(=O)CCC(=O)NCc2cc(Br)ccc2O)c(Cl)c1 804736618 WBHFVHYZGNMVMZ-UHFFFAOYSA-N 426.694 4.096 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](Oc4ccc(C5CC5)cn4)C3)ccc21 858074885 LYHUKZIOEXZNOT-QFIPXVFZSA-N 433.552 4.470 10 10 IICE COc1ccc([C@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)c2ccc(C)cc2)cc1 920056515 WASNTJPHZAWHJZ-AREMUKBSSA-N 445.563 4.429 10 10 IICE COc1ccc2cc(/C=C3/SC(=S)N([C@H](C(=O)O)C(C)C)C3=O)c(Cl)nc2c1 1081155532 PKTBUNATOUCKBJ-LULHVWEPSA-N 436.942 4.207 10 10 IICE O=C(/C=C\c1cnc2ccccc2n1)N(C[C@@H]1CCCO1)c1ccc(Br)cn1 1130008418 KHHAWNFNPSKAKE-PXAMLJHWSA-N 439.313 4.013 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)c(C)n1-c1ccccc1 1132011380 MTQPIRNDJULACX-HXUWFJFHSA-N 435.955 4.459 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2c[nH]c3nccc(Cl)c23)cc1 1142712942 KVLWKNCGXPUHSC-LJQANCHMSA-N 426.948 4.033 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3ccc(Br)c(F)c3C2)c([N+](=O)[O-])c1 1187647869 RFQKKTCOLWYPLL-XVNBXDOJSA-N 435.249 4.245 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nc2ccccc2o1 1264331095 GNLQGVHVMNZTFR-ATVHPVEESA-N 441.509 4.221 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)OC(C)(C)C 1295093764 WFJRNFSTRMULKO-UHFFFAOYSA-N 438.576 4.333 10 10 IICE COc1cc(OCCN(C)C)ccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1299360937 YKXJVPNYLMAZSJ-UHFFFAOYSA-N 449.551 4.037 10 10 IICE COC(=O)CN(Cc1ccc(C(=O)Nc2ccccc2)cc1)Cc1cc(Cl)ccc1O 1307539854 QXOPBEVHLALULQ-UHFFFAOYSA-N 438.911 4.473 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Cl)cc(Br)c2O)C2(CC2)C1 1308977909 CUSBCKRNGZAOAR-AWEZNQCLSA-N 431.758 4.297 10 10 IICE CC(C)(C)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1Cl 1355064591 KJVCRXDWFGBFDS-SFHVURJKSA-N 427.976 4.269 10 10 IICE CCCOc1c(Cl)cc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1OCC 1438886577 KHWCNQMJUWJLEH-UHFFFAOYSA-N 445.991 4.209 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3nc(C4CCCCC4)cs3)CC2)c(OC)c1 1454466112 HXTDJYMHTLPJOP-UHFFFAOYSA-N 429.586 4.099 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(Br)c(OC(F)(F)F)c1 1467840178 KRAMHWHOWNNPPM-UHFFFAOYSA-N 439.224 4.469 10 10 IICE C[C@@H](NC(=O)N1C[C@@]2(C)CN(C(=O)OC(C)(C)C)C[C@@]2(C)C1)c1ccc(N(C)C)cc1 1478471481 YHDADHNFDCRVLD-VEYWIMSWSA-N 430.593 4.102 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N(C)CC2CCCC2)cc1 1501829980 DQANDGTVNMKGBM-UHFFFAOYSA-N 438.620 4.035 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)C2CCC(C)CC2)n1Cc1ccc(N(C)C)cc1C 1504943963 MGULSKXBCSJDCH-JGBTYHIZSA-N 443.636 4.440 10 10 IICE COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1523488589 PLCSLOQBASDOCD-DEOSSOPVSA-N 429.520 4.018 10 10 IICE COc1ccc2c(c1)OC[C@@H](C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)C2 1530426868 WQHXDXXGTIBGRP-LPHOPBHVSA-N 428.960 4.452 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cccc(NC(=O)c4ccc(F)cc4)c3)C2)cc1 1538747318 QBJGAODPBPZMQK-OAQYLSRUSA-N 433.483 4.095 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1539583004 XPINNHRZEXPJII-QGZVFWFLSA-N 444.457 4.320 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)Oc2ccc(C(F)(F)F)cc2)N(C)C)cc1 1539707850 UKHSEXZRQBUEPX-HXUWFJFHSA-N 437.506 4.348 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccccc3N3CCN(C)CC3)cc2Cl)C1 1539913406 RWESOAJFHLEOCM-IBGZPJMESA-N 441.019 4.258 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](c2ccccc2)C(C)(C)CO)cc1 1545942519 XTVBVXGFZBPYLN-RUZDIDTESA-N 432.564 4.368 10 10 IICE CCCCn1cc(Cn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)c(C)n1 1547036622 OPGQVYNBAOFKSC-UHFFFAOYSA-N 445.571 4.344 10 10 IICE CC(C)OC(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1 1564649752 LWBMBBHVRXANJZ-QGZVFWFLSA-N 435.996 4.450 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](C(=O)OC(C)(C)C)c3ccnn3C)c2C)c1 1583522505 HEDBWWASLOCIRI-QFIPXVFZSA-N 436.556 4.257 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)C2)cc1 1585665968 XXZIOLLFHCJZCG-NQIIRXRSSA-N 445.604 4.063 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C3=NN(c4ccc(F)cc4)C(=O)CC3)c2C)c1 1596483067 RCRVPMPTDYUWDA-UHFFFAOYSA-N 432.499 4.341 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2cccc(F)c2)c(C)n1-c1cccc(Br)c1 1597357473 YLQYKZWJCJWCOT-HXUWFJFHSA-N 431.305 4.459 10 10 IICE CS[C@@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C[C@@H]1N1CCCC1 1611064579 LHWGZWLNOKHAGS-FCHUYYIVSA-N 432.033 4.328 10 10 IICE CN(C)c1ccc(CN(C)c2ncnc3c2cnn3-c2cccc(Br)c2)cc1 1611738043 SFLMNCINUMRSSJ-UHFFFAOYSA-N 437.345 4.280 10 10 IICE CO[C@@]1(C)CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1619027835 VIBNBQOVHBLMAP-DHLKQENFSA-N 441.620 4.338 10 10 IICE COc1ccc(OC)c(C2=NO[C@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2)c1 1624070258 QJYRHCWCPUGEFM-VWLOTQADSA-N 447.535 4.229 10 10 IICE Nc1c(Cl)c(F)cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1Cl 1625567425 JANXRBXHORYJAJ-UHFFFAOYSA-N 437.346 4.499 10 10 IICE Cc1cc(C(=O)N(C)C[C@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1627022703 PKIYDRNQMZXJFO-QFIPXVFZSA-N 442.357 4.231 10 10 IICE Cc1cc(C(=O)Nc2ccc([S@](C)=O)cc2)c(C)n1-c1ccc(Br)cn1 1629045615 HOXBXUAVWRJTLA-SANMLTNESA-N 432.343 4.241 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(C)n(-c4cccc(C(C)C)c4)c3C)CC2)nn1 1630144499 IWIRMGLJUFVGLY-UHFFFAOYSA-N 447.583 4.369 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(COc4cccc(C=O)c4)c3)C2)cc1 1630618914 NCJKKFCEEGHJSO-QFIPXVFZSA-N 444.531 4.343 10 10 IICE COc1ccc(Br)cc1-c1ncc(C(=O)N2Cc3cccc(O)c3C2)s1 1632709255 QIWFKBYDCLZEBV-UHFFFAOYSA-N 431.311 4.443 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCCCSc1nccs1)c1ccc(F)cc1F 1632807228 QWNLUKZKKHZMBU-OAHLLOKOSA-N 443.541 4.286 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)c2)CC1 1633073257 RRWFWRONZAPMAT-UHFFFAOYSA-N 430.552 4.323 10 10 IICE Cc1ccc(C(=O)N2CCN(CCCOC(C)(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1633221648 LYQQIFODHXQDKN-UHFFFAOYSA-N 439.600 4.178 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)cc1F 1634885049 QMMBHCDODQENBG-IBGZPJMESA-N 435.499 4.473 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cccc(CN4CCOCC4)c3)cc2Cl)C1 1635127376 XDASCTFCGXZISL-IBGZPJMESA-N 442.003 4.339 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)[C@]12CCCO2 1638250236 JCQDPNSWITVUAA-TUNNFDKTSA-N 447.373 4.313 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2(C(=O)OCc3ccccc3)CCC2)c1 1638749169 JACSTBBSHZAZHY-UHFFFAOYSA-N 430.504 4.303 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc2nnc(-c3cccc(F)c3)n2n1 1639621925 ACCSKQLRPIHAEM-UHFFFAOYSA-N 442.292 4.425 10 10 IICE COc1ccc(N(CCc2ccccc2)Cc2ccc(S(=O)(=O)NC3CC3)cc2)cc1 1642153645 UDQXSZIAYKTZSZ-UHFFFAOYSA-N 436.577 4.385 10 10 IICE Cc1cc(CN(Cc2ccccc2)CC2(O)CN(C(=O)OC(C)(C)C)C2)ccc1N(C)C 1644365042 HGWDHENYJQCIQK-UHFFFAOYSA-N 439.600 4.045 10 10 IICE Cc1cc(C(=O)N2Cc3cncnc3[C@H](C)C2)c(C)n1-c1ccccc1Br 1650871663 LCYHQDJKHBFEOO-CYBMUJFWSA-N 425.330 4.406 10 10 IICE COc1cccc2c1CC[C@@]2(CO)NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1654642039 XGCIVGZRKCBUJF-VWLOTQADSA-N 430.508 4.473 10 10 IICE COc1ccc(N2CCCN([C@H]3CCN(c4ccc(Cl)cc4Cl)C3=O)CC2)cc1 1657024002 QITAZBAADKOXOM-NRFANRHFSA-N 434.367 4.320 10 10 IICE CCOc1ccc(N2CCN([C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3=O)CC2)cc1 1657875959 KLLWNMCUEMJWHZ-JOCHJYFZSA-N 445.510 4.004 10 10 IICE O=C(NCC[C@@H]1CSc2ccccc2O1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1673863786 VAIOTVOVCLRMOZ-RBUKOAKNSA-N 428.554 4.026 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3ccc(F)cc3F)cc2Cl)C1 1680561661 CTYSCSXXDFXMER-VLIAUNLRSA-N 437.918 4.387 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4c(Br)cccc4C3)C2)cc1 1682188719 ZBUOAQVWUDYPTO-INIZCTEOSA-N 444.373 4.052 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CC[C@@H](CSc2ccccc2)C1 1683195509 DNTXUCGWIOMTCG-QGZVFWFLSA-N 447.551 4.125 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCc2cc(Cl)cc(Cl)c2F)N(C)C)cc1 1683436587 ACQUUNKSRFHYSM-SFHVURJKSA-N 427.351 4.301 10 10 IICE CC(C)OC1CCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CC1 1692600651 YZLDNQVAWUQEJK-UHFFFAOYSA-N 444.630 4.373 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCN(c4ccccn4)CC3)nnc2C(C)(C)C)cc1 1728383959 VAJVTBGVASBIHD-UHFFFAOYSA-N 447.631 4.192 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1744807406 KEEGFXRQDNKCIG-BPCBYJRWSA-N 441.620 4.050 10 10 IICE CSC(C)(C)Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1750225703 JHNYIDYACYWRBW-UHFFFAOYSA-N 445.677 4.481 10 10 IICE CC1=C(Br)CN(c2nnc(C3CC3)n2Cc2ccc(N(C)C)cc2C)CC1 1751312238 QPUDBENTFLGOPV-UHFFFAOYSA-N 430.394 4.457 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1765427019 CQZAEWDTVDAEKX-SQJMNOBHSA-N 437.588 4.129 10 10 IICE CN(C[C@@H]1CCOC1)c1nnc(-c2ccccc2F)n1CCCSc1nccs1 1768809156 CGLIGVAARCGQHV-HNNXBMFYSA-N 433.578 4.196 10 10 IICE CC(C)C(=O)NCc1ccc(OC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1858891240 LTNFOXGMLAEZBC-UHFFFAOYSA-N 442.471 4.345 10 10 IICE COc1ccccc1OCC(=O)N(c1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 1859889041 GKDLNIGGTIKPPB-UHFFFAOYSA-N 429.472 4.291 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccccc3Cl)N=C2C(F)(F)F)cc(OC)c1O 1865679944 OQVBZQCBXKZKFA-XFFZJAGNSA-N 426.778 4.411 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2cc(Br)ccc2O)CC12CC2 2115365696 FIRBFWGBVHVYET-AWEZNQCLSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CNC2CCCN(C(=O)OC(C)(C)C)CCC2)c1O 2284548149 LWCCVQIAORPFDZ-UHFFFAOYSA-N 443.382 4.433 10 10 IICE O=C(CN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccccc1Br 2296807625 JREOHDARBSNHKK-UHFFFAOYSA-N 439.381 4.351 10 10 IICE CCOc1cc(C=C2SC(=S)N(C3CCCC3)C2=O)ccc1O[C@H](CC)C(=O)O 2314935752 SBBCRTQRZOELKT-OAHLLOKOSA-N 435.567 4.471 10 10 IICE Cc1cccc(NC(=O)COC(=O)c2ccc3c(c2Cl)C(=O)c2ccccc2C3=O)c1 10732643 WNBUDQGPYHHTMH-UHFFFAOYSA-N 433.847 4.219 10 10 IICE CC(=O)N[C@H](CC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1cccs1 11942815 CRCOBWNOEJAXLR-HXUWFJFHSA-N 442.512 4.288 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccccc3F)SC2=S)cc1 15039789 BTRRDBYQAJEANQ-AQTBWJFISA-N 430.526 4.454 10 10 IICE COc1ccc(CC2CCN(C(=O)NC3CCN(c4ccc(OC)cc4)CC3)CC2)cc1 726713737 QONRRHWIYIGZNE-UHFFFAOYSA-N 437.584 4.337 10 10 IICE O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N(Cc1ccco1)Cc1ccccc1O 739064169 NPHDPPAUAJODNA-UHFFFAOYSA-N 447.535 4.249 10 10 IICE Cc1cc(C(=O)COC(=O)CCc2nc(-c3ccoc3)no2)c(C)n1-c1ccc(F)cc1 740284029 JXOZNSBTNNNHMY-UHFFFAOYSA-N 437.427 4.235 10 10 IICE O=C(NC[C@H]1CCCCN1Cc1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 743358986 PLKDNLUQZNURKP-RPWUZVMVSA-N 437.584 4.138 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)NC(=O)NCc2ccc(N3CCSCC3)cc2)c(C)c1 749788477 KMMLMULJRHLOFJ-XMMPIXPASA-N 449.624 4.294 10 10 IICE Cc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1[C@H](C)C1CC1 752842622 WKXDNHKAMRAJFY-YESZJQIVSA-N 429.540 4.237 10 10 IICE CCN1CCN(c2ccc(CN[C@@H](c3ccc(Cl)cc3)c3ccn(C)n3)cc2F)CC1 756551401 ALOBDCQEERPMMX-DEOSSOPVSA-N 441.982 4.234 10 10 IICE CCOc1cc(C(=O)NCc2cc(Br)ccc2O)cc(OCC)c1OCC 804734642 URFRRBNYCAZADS-UHFFFAOYSA-N 438.318 4.281 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 916378347 XTIBBHVETGLNOS-UHFFFAOYSA-N 449.521 4.367 10 10 IICE Cc1nn(C)c(C)c1-c1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)n[nH]1 919323194 OFTRPMNWPHABIO-UHFFFAOYSA-N 449.486 4.013 10 10 IICE COC(=O)c1cc(F)c(C)c(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1127198408 XMJGQAMOXCZOBP-UHFFFAOYSA-N 438.499 4.248 10 10 IICE CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661620 QCNQBQYGGUSMPU-OAQYLSRUSA-N 438.902 4.175 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2N(C(=O)OCc3ccccc3)CC2(C)C)C2CC2)cc1 1136181018 YESCBWBILZEFKX-QHCPKHFHSA-N 435.568 4.291 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1[C@H]2CCCC[C@H]2CCN1C(=O)OC(C)(C)C 1146196504 LQUSAPJDPNFCAU-NYVOZVTQSA-N 429.605 4.493 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@@H]1CCCOC1 1155617553 FTMHKQNVVTZOPE-OXQOHEQNSA-N 435.362 4.028 10 10 IICE CC(C)(C)OC(=O)N1CCOc2cc(C(=O)NCc3cccc(Cl)c3O)ccc2C1 1159041587 TURVVQGPUUHYGX-UHFFFAOYSA-N 432.904 4.105 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1 1230200824 MIGNFKLAVWFKNJ-QGZVFWFLSA-N 425.577 4.232 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC[C@H]1C 1287363534 JLXKHFQFGFJUOA-IFMALSPDSA-N 425.621 4.386 10 10 IICE CC1=C(C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1289130838 NNLNWGKSIJXOPX-UHFFFAOYSA-N 441.595 4.437 10 10 IICE O=C(C[C@H]1CCc2sccc2C1=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1292594893 ZOUCMWQWJLVIKY-CQSZACIVSA-N 434.508 4.270 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2c1 1294860486 UIRSYGICZYQOHN-INIZCTEOSA-N 443.906 4.141 10 10 IICE Cc1ccc(C)c(C(=O)CCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1295116516 CYVLJIAAAWAWGT-UHFFFAOYSA-N 433.596 4.115 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3cc(F)ccc3Br)CC2)cc1 1295271935 BXPUXQJUFYCZFF-UHFFFAOYSA-N 435.337 4.268 10 10 IICE CN(Cc1ncc(Cl)n1C)c1nnc(C(C)(C)C)n1CCCSc1nccs1 1298448330 RMHDAUBQNBYKFN-UHFFFAOYSA-N 440.042 4.238 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1cc(Cl)cc(Cl)c1F 1313211480 FXZSWOUKEQMUNG-CQSZACIVSA-N 439.362 4.445 10 10 IICE CN(C)c1ccc(Cn2c(CC3CC3)nnc2N2CCC[C@H](OC(C)(C)C)C2)cc1F 1314659343 WBNKXDRDGBVKHR-IBGZPJMESA-N 429.584 4.268 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3C[C@H](OC)C(C)(C)C)CC2)cc1F 1315512238 LDLLWXCISMMIGS-NRFANRHFSA-N 445.583 4.081 10 10 IICE CC(C)(C)N1CCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CC1 1359549502 RJKJIEGFCGRNRQ-UHFFFAOYSA-N 434.679 4.495 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)cc1 1444974359 JHARWZXBIBYOID-HRFSGMKKSA-N 443.591 4.476 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3cccc(S(=O)(=O)NC4CC4)c3C)c2C)c1 1450707998 RYFYMRIZJYYGDH-UHFFFAOYSA-N 437.565 4.404 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1451666074 HEFDCIMBDFJOET-VQIMIIECSA-N 439.547 4.001 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@H]1CCCC1(F)F 1460197415 BLYWYNBXRFPTEP-XTCQQWIJSA-N 430.567 4.281 10 10 IICE CCc1ccc(-c2nc(C(=O)N3CCN(c4ccc(OC)cc4OC)CC3)cs2)cc1 1461981504 LOUOIMLBULAZGT-UHFFFAOYSA-N 437.565 4.352 10 10 IICE COc1ccc(N2CCN(CCNc3nc(C)nc4scc(CC(C)C)c34)CC2)cc1 1472675829 XJUUGMXUJMPFQX-UHFFFAOYSA-N 439.629 4.441 10 10 IICE CCOC(=O)C[C@H](SCC(=O)c1cc(C)n(-c2cccc(F)c2)c1C)C(=O)OCC 1473026088 OXDKBPLJJVEAOE-FQEVSTJZSA-N 435.517 4.034 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1495379026 BEYSLBVJXQZKEY-GOSISDBHSA-N 429.584 4.442 10 10 IICE CCCC(=O)N[C@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1499876257 SVWYKCGODOAMIK-RXVVDRJESA-N 440.636 4.099 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@@H]2CC[C@H](C3CC3)N2C(=O)OC(C)(C)C)C2CC2)cc1 1524793235 CPDUEDSSVDCWGI-YADHBBJMSA-N 427.589 4.422 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/c3csc(C(F)(F)F)c3)CC2)c(OC)c1 1534283046 MNYRCKHYCXNOON-ZZXKWVIFSA-N 426.460 4.146 10 10 IICE CC(C)SCCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1541771199 LZJVDQBVPZALSN-UHFFFAOYSA-N 445.677 4.481 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCS[C@@H](C)[C@@H]1C 1542227181 VKNMHOAZFNRJQF-OALUTQOASA-N 436.629 4.017 10 10 IICE Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1542567870 FRSUJAFDHPLUDL-HSZRJFAPSA-N 447.560 4.369 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H](c1cccs1)N(C)C 1546418551 DAAPZDLBTNODEQ-OAQYLSRUSA-N 438.645 4.442 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C1 1548046868 LVYNRBWHVHLOCO-NRFANRHFSA-N 437.588 4.129 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C1 1548212810 AYCKJDSQAWZQLK-NRFANRHFSA-N 437.588 4.252 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1 1555333882 HWFBIZZGNPQGFZ-HXUWFJFHSA-N 434.588 4.016 10 10 IICE Cc1cc(C(=O)N2Cc3c[nH]nc3C[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1558315007 BOONXNAAHYYOTB-ZDUSSCGKSA-N 427.346 4.414 10 10 IICE Nc1cc(Cl)c(Cl)cc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1566434238 KEWHASCISJOTAC-UHFFFAOYSA-N 433.383 4.038 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1 1587923809 UHOVOZMFLRRPAV-UHFFFAOYSA-N 443.016 4.361 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ncccc1NCC1CCC1 1595584023 LIKNIRYLNFNVFU-LJQANCHMSA-N 428.964 4.047 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccc(C)c(F)c4)CC3)c2C)cc1 1596625994 ZARHVKLSJOYVNQ-UHFFFAOYSA-N 449.526 4.148 10 10 IICE Cc1csc(CNc2cccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2)n1 1603554772 KLPXLJRPYVQLCV-QFIPXVFZSA-N 437.613 4.162 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](O)CC3(CCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1613206628 IILUOPURVFNDBX-PGRDOPGGSA-N 425.621 4.346 10 10 IICE CC[C@H](C)CN(CC)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1613396473 GNELUDOKUNMERG-NRFANRHFSA-N 448.615 4.021 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1F 1616266036 PCCWIIGPMCSPAP-UHFFFAOYSA-N 445.844 4.267 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1Cc1nc(C(F)(F)F)cs1 1617940384 NTENVDQSMJURNW-UHFFFAOYSA-N 446.458 4.206 10 10 IICE Cc1cccc(OCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1618369579 YDRRCDWGLBMFOZ-UHFFFAOYSA-N 437.297 4.485 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2CCC(C(C)(C)O)CC2)NC(=O)OC(C)(C)C)cc1 1628495917 PQJKJJFYWADBJW-GRERDSQWSA-N 447.620 4.012 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2Cc3c(C)cccc3N2C(=O)OC(C)(C)C)c1 1631542946 NOHNUBHTKWUPNJ-QRWLVFNGSA-N 426.513 4.253 10 10 IICE CC[C@@H](CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)NC(=O)OC(C)(C)C 1635466847 OUFLHNYNHQATGS-IBGZPJMESA-N 444.576 4.361 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCc3ccc(Cl)c(C(F)(F)F)c3)cc2)CC1 1637361884 CGQDBMCQPPFAOZ-UHFFFAOYSA-N 440.897 4.110 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nccnc1SCc1ccccc1 1640083543 BJHMBDIEJPFXNX-UHFFFAOYSA-N 430.327 4.167 10 10 IICE Cc1cc(C(=O)Cn2cnc(-c3ccccn3)n2)c(C)n1-c1ccc(Br)cc1 1641043654 NQEYQAIHDNGAIW-UHFFFAOYSA-N 436.313 4.393 10 10 IICE Cc1cccc2c1C[C@H](NC(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CO2 1641114868 ULSYFJOWEDIJPJ-KRWDZBQOSA-N 440.341 4.294 10 10 IICE CC(C)c1ccc(O[C@H](C)CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1682216584 PFQMNKZERMHOMS-LJQANCHMSA-N 425.573 4.038 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(C)C)cc1C 1694049701 RLADTLAAKVFRDI-UYAOXDASSA-N 435.620 4.017 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC1 1729911813 SPHSXDHUSMPXIZ-DEOSSOPVSA-N 443.661 4.398 10 10 IICE CC(C)[C@@H]1OCCC[C@H]1Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1750692077 CBHCCKVWGKXIQH-URXFXBBRSA-N 435.572 4.057 10 10 IICE CC1(C)CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)CCO1 1751295051 CDFCVQBBAKARSY-UHFFFAOYSA-N 433.578 4.338 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](N3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752710173 YKSXSBBTDUFMCO-QUCCMNQESA-N 428.600 4.110 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1765124943 OURJEOQGQSDDKX-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CCOCCCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1766524184 DIEGVGZAABQBDO-TZIWHRDSSA-N 430.593 4.355 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)[C@H]2CCSC2)cc1 1766615436 XIVPFYDTNRRLMX-FPOVZHCZSA-N 429.634 4.008 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1CCCO[C@@H]1CCOC1 1767080816 PCXUMSHSFZDMMD-JOCHJYFZSA-N 441.620 4.008 10 10 IICE Cc1cccc(CNC(=O)C2(NC(=O)OCC3c4ccccc4-c4ccccc43)CC2)c1O 1902251915 KDFGVUJVTJOWJH-UHFFFAOYSA-N 442.515 4.388 10 10 IICE COc1cccc(O)c1[C@@H](C(=O)O)N(C)C(=O)OCC1c2ccccc2-c2ccccc21 1958766089 VYTZJFSLVQZPLM-QHCPKHFHSA-N 433.460 4.407 10 10 IICE C[C@H](C(=O)Nc1ccc(N)cc1)N(CCCNC(=O)OC(C)(C)C)Cc1ccccc1 1999434446 LTMGFYXRTOPYEB-GOSISDBHSA-N 426.561 4.013 10 10 IICE CN1CCCc2cc([C@@H](N)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044755722 BLICWUWNRBSIIC-QHCPKHFHSA-N 438.616 4.096 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C(F)F)c(CN)c2I)cc1C 2079853574 GAKIYOBFKCBRCG-OAHLLOKOSA-N 447.267 4.206 10 10 IICE Cc1cccc(OCCOCCOc2cccc(C=C3SC(=S)N(C)C3=O)c2)c1 2293161044 XZNYOKLJYPUUBT-UHFFFAOYSA-N 429.563 4.300 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1ccc2c(c1)OCO2 2296754917 ROIUGNWIQOEQIA-UHFFFAOYSA-N 446.937 4.299 10 10 IICE CCCCCN1C(=O)C(=C2SC(=S)N(CCCC(=O)OCC)C2=O)c2ccccc21 2314761863 YXJIMKBVRBKPLE-UHFFFAOYSA-N 446.594 4.138 10 10 IICE Cc1ccc(CN(C)C(=O)CC(C)(C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2380787363 RUSVEGUBJYQYFJ-UHFFFAOYSA-N 443.382 4.457 10 10 IICE CCOc1cccc(N2C(=O)NC(=O)/C(=C/c3ccc(Sc4ccccc4)o3)C2=O)c1 6573631 VLMLUDYSBBWVRZ-RGEXLXHISA-N 434.473 4.496 10 10 IICE CCN(CC)c1ccc(/C=c2/sc3nc(-c4cccc5ccccc45)nn3c2=O)cc1 33168342 LKTVLPWSWKEIJK-CJLVFECKSA-N 426.545 4.365 10 10 IICE CCCN1C(=O)/C(=C\c2c(Oc3ccccc3C)nc3ccccn3c2=O)SC1=S 39835863 QDIXGQWWRKUDPX-GHRIWEEISA-N 437.546 4.406 10 10 IICE CN(C)c1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)COc2cccc(C=O)c2)cc1 72413066 LEZABKDBRRQQIG-RUZDIDTESA-N 427.504 4.322 10 10 IICE Cc1nc(C2(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)CCCCCC2)no1 435543320 VIGQVMSGMSSMAL-UHFFFAOYSA-N 449.599 4.465 10 10 IICE C[C@H](NC(=O)N[C@H]1COc2c1ccc(Cl)c2Cl)c1ccc(N2CCOCC2)cc1 745779040 MGEWAAJNPXPTKI-UGSOOPFHSA-N 436.339 4.324 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(NC(=O)C(C)(C)C)cc3C)CC2)cc1F 753741053 BAMGWEWDLLVVCW-UHFFFAOYSA-N 433.549 4.151 10 10 IICE Cc1cc(C(=O)[C@H](C)OC(=O)CCc2ccnn2C)c(C)n1-c1ccc(OC(F)F)cc1 772773134 LYFDKPOYDJJNQI-INIZCTEOSA-N 445.466 4.176 10 10 IICE CC[C@@H](NCc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1)c1cc(Br)ccc1O 775486765 FFJHRCUVBGAWRU-ZRGWGRIASA-N 434.378 4.404 10 10 IICE O=C(Cn1c(SC(F)F)nc2ccccc21)NCc1cc(Br)ccc1O 804734247 GNALFWGRBSDSIN-UHFFFAOYSA-N 442.285 4.136 10 10 IICE CN1CCN(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c2cc(F)ccc21 1126642633 DRYREOCCMHCZAZ-UHFFFAOYSA-N 425.504 4.216 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H](c1ccccn1)C1CC1 1134170550 NKIMPXXKTDEOQF-ITICKHJUSA-N 441.553 4.080 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1c(F)ccc(I)c1Cl 1135914505 IKQUMZOLDWXRHN-UHFFFAOYSA-N 446.691 4.422 10 10 IICE Cc1cccc2c1C[C@@H](C(=O)NCc1ccc3cccnc3c1O)N2C(=O)OC(C)(C)C 1162612661 NXBSXQMJZQFYLX-FQEVSTJZSA-N 433.508 4.231 10 10 IICE COC1CCN(c2ccc(CN[C@H]3CCN(C(=O)OC(C)(C)C)CC3(C)C)cc2)CC1 1169745533 QXRDZGTYSBYIFA-QFIPXVFZSA-N 431.621 4.427 10 10 IICE CCN(CC(=O)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCO2)c1ccc(OC)cc1 1191838894 NGNHIQYZTQZVEY-UHFFFAOYSA-N 447.491 4.141 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1ccc(COC2CCOCC2)cc1 1230706965 POVBDZJALDDNCT-FQEVSTJZSA-N 439.600 4.187 10 10 IICE O=C(COc1cc(Cl)c(Cl)cc1Cl)NCc1ccc(N2CCC(O)CC2)cc1 1301350772 YZADEHZLHFOSLN-UHFFFAOYSA-N 443.758 4.303 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC3CC(C)(C)C3)CC2)cc1F 1315513526 VWTXFZJAQDOEKX-UHFFFAOYSA-N 429.584 4.486 10 10 IICE Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1357835135 CXWXTHUQMYFKNE-HOTGVXAUSA-N 429.492 4.203 10 10 IICE CON(C)S(=O)(=O)c1cc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)ccc1Cl 1360867598 YOIRYJMGRWGFEL-UHFFFAOYSA-N 447.944 4.182 10 10 IICE CC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@@H](O)C(F)(F)F 1447072292 MEYYRNZLALZKNV-HZPDHXFCSA-N 433.268 4.288 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCN(C)C)Cc2ccc(F)cc2)CCCC1 1456060645 WFIHHFAELKYCGS-UHFFFAOYSA-N 437.559 4.258 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3ccc(Cl)cc3Br)CC2)cc1F 1465930555 WIJVCCUWUSUBMD-UHFFFAOYSA-N 441.728 4.142 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1ccc([Si](C)(C)C)cc1 1467630834 FSKSYKPOEXZYHL-UHFFFAOYSA-N 440.660 4.163 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H]1CCc2sccc2C1=O 1467631686 OXTLWUXDAHHSBI-MRXNPFEDSA-N 442.581 4.272 10 10 IICE CCCOc1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)cn1 1501257144 WGPMNJZNSLHOHX-UHFFFAOYSA-N 444.539 4.223 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2C[C@H](C)O[C@H](C)C2)cc1 1515532876 SYLXQXDQRCUNJR-XQBPLPMBSA-N 427.593 4.028 10 10 IICE Cc1cc(Cl)nc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1518613107 HJBHDFJUVCBPGU-MHWRWJLKSA-N 449.960 4.090 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1520962438 UZDXPTGGVLZMCB-OAHLLOKOSA-N 431.499 4.289 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(-c2c(F)cccc2F)n1 1533328982 KXQUWCDXSLHCEE-CQSZACIVSA-N 448.420 4.151 10 10 IICE COc1ccc(N2CCN(C(=O)CCCc3cccc(C(F)(F)F)c3)CC2)c(OC)c1 1534281996 AXHWQHWHNMGLHD-UHFFFAOYSA-N 436.474 4.394 10 10 IICE Cc1cc(CNC(=O)[C@H]2CO[C@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1535142454 BILBLVGQJWMVBA-IFMALSPDSA-N 426.557 4.237 10 10 IICE CN(C)c1ccc(F)cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1537145804 WWWBOEXBXNJPSK-WQRHYEAKSA-N 447.532 4.261 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3cc(C(=O)OC)ccc3C)c2C)cc1 1559360379 OJBQCJGWVVLJLQ-UHFFFAOYSA-N 435.476 4.237 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)[C@H](C)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1564800805 BXKCFHGOOJFDSQ-ROUUACIJSA-N 444.576 4.359 10 10 IICE CCc1ccc(CN2CCN(C(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)CC2)s1 1586477125 RKUPYDLVOYMMMX-UHFFFAOYSA-N 439.625 4.486 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)CC1 1613059612 OKXBHLABTONLMO-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COc1cc(Br)cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 1625567095 CWNUPZSWGGPUOD-UHFFFAOYSA-N 444.373 4.242 10 10 IICE O=C(CN[C@@H](c1ccccc1)C(F)(F)F)Nc1c(-c2ccccn2)nc2ccccn12 1629108135 VEGQGBHFTWTSLQ-FQEVSTJZSA-N 425.414 4.228 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@](O)(CC)c1ccccc1 1634385252 VAPDKYAOJAIHFP-RUZDIDTESA-N 426.557 4.063 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1634720396 VLIQFCWOERBIBQ-FXAWDEMLSA-N 447.982 4.366 10 10 IICE COC(=O)c1ccc2c(c1)CCCCN2C(=O)/C=C\[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1636044038 LSURKXYZNWVSFE-ADYSOMBNSA-N 442.556 4.346 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnn2c1N[C@@H](C1CC1)C[C@H]2C(F)F 1638305080 FBNCJZDYOOMQNB-KGLIPLIRSA-N 431.270 4.226 10 10 IICE COC(=O)C1=C(CSc2ncc(-c3ccccc3)n2C)N(C)C(=O)N[C@H]1c1ccccc1 1651686428 SQRAMVKKGXEVJL-NRFANRHFSA-N 448.548 4.003 10 10 IICE Cc1cc(COc2ccc(C=O)cc2)oc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1653421778 QKYYBOAYCCCMNV-DEOSSOPVSA-N 449.551 4.078 10 10 IICE CC(C)N(CC(=O)NCc1cccc(OCC(F)(F)F)c1)Cc1ccc(N(C)C)cc1 1657023761 PGEYVTSPZUSBID-UHFFFAOYSA-N 437.506 4.221 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1708739901 GNUVBOZIRRUYAT-QGZVFWFLSA-N 444.599 4.076 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCO)CCO1 1763476430 OFICPIHQZQQNIE-JOCHJYFZSA-N 437.588 4.130 10 10 IICE CC[C@H](Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1764241390 UVZQZQFWZNCMIU-JOCHJYFZSA-N 434.588 4.310 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccccc3OC)n2CCCSc2nccs2)CCO1 1765251270 BQLYZGKLIAERLH-MRXNPFEDSA-N 445.614 4.208 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2C[C@H](C)S[C@H](C)C2)cc1 1766614405 LUQOXLWNWADWMP-ZVDOUQERSA-N 443.661 4.397 10 10 IICE COc1ccccc1-c1nnc(N2C[C@H](C)O[C@H](C)C2)n1CCCSc1nccs1 1768892746 KSHJADLZSLUMGZ-IYBDPMFKSA-N 445.614 4.206 10 10 IICE C[C@H](Oc1cccnc1NC(=O)Oc1ccc(N)cc1)C(=O)Nc1ccccc1Cl 1858687492 LUMPMRHQTMZNCZ-ZDUSSCGKSA-N 426.860 4.334 10 10 IICE CCN1N=C(C(F)(F)F)/C(=C/c2cc(Br)cc(Br)c2O)C1=O 1865673192 VKJGQUZBAWUGJC-YWEYNIOJSA-N 442.029 4.081 10 10 IICE COC(=O)c1c(NC(=O)c2ccc(O)nn2)sc(C)c1-c1ccc(Br)cc1 1866108488 SBRZFOXSXBRQQJ-UHFFFAOYSA-N 448.298 4.021 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2060621975 UJSPYAYJXPYYHJ-IHPCNDPISA-N 445.564 4.424 10 10 IICE Cc1ccc([C@@H](C2CCC2)n2nc(C(F)(F)F)c(C(N)=O)c2Br)c(O)c1 2079037185 DYMXSKDLJVXVLS-CYBMUJFWSA-N 432.240 4.167 10 10 IICE Cc1ccc(CN[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(F)F)c(O)c1Br 2352952844 QCOVNILGBADWDS-DLBZAZTESA-N 425.317 4.318 10 10 IICE CCOC(=O)c1c(C)nc2c(c1-c1cc(OC)c(OC)c(OC)c1)C(=O)c1ccccc1-2 988594 XZCKNNRUYNZIHR-UHFFFAOYSA-N 433.460 4.471 10 10 IICE COc1ccc(/C=C2\SC(=S)N(CC(=O)OCc3ccc(Cl)cc3)C2=O)cc1 12555790 KALSZGNTULLPJR-YVLHZVERSA-N 433.938 4.293 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCCC(=O)Nc3ccc(C)cc3)C2=O)ccc1O 15039311 HMPLPWOVCWTNGS-UYRXBGFRSA-N 442.562 4.329 10 10 IICE CCCOC(=O)CCN1C(=O)/C(=C/c2ccc(OCCC)c(OCC)c2)SC1=S 40938253 CWVTVGWRMVIKTF-JXAWBTAJSA-N 437.583 4.419 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1c1cccc(F)c1 96624577 JBPMGHWANSIARB-XFFZJAGNSA-N 431.251 4.429 10 10 IICE CCOc1cccc(CNCC2(N(Cc3ccccc3)Cc3ccccc3)COC2)c1O 705699143 UPZMAHDLRHABHJ-UHFFFAOYSA-N 432.564 4.352 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3c(C)nn(C(C)C)c3C)n2)cc1OC 734739806 GKHINKBQVVLGDD-UHFFFAOYSA-N 436.559 4.022 10 10 IICE O=C(CSCc1cc(-c2cccs2)on1)NCc1cccc(Br)c1O 765736499 MPHJBJQCTAUGKU-UHFFFAOYSA-N 439.356 4.421 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 768239997 YGDDBXFXZWIXIF-UNMCSNQZSA-N 447.595 4.274 10 10 IICE C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 779706658 VWWDNPVAZLFRSY-FXAWDEMLSA-N 443.544 4.343 10 10 IICE C[C@@H](NC(=O)C1(c2ccccc2Br)CC1)c1ccc(N2CCOCC2)cc1 788832017 MGMMZRNLRXMWHE-MRXNPFEDSA-N 429.358 4.195 10 10 IICE O=C1N/C(=C/c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C(=O)N1c1cccc(Cl)c1 794709753 CKXLFKNCMYPHSV-GZTJUZNOSA-N 426.860 4.336 10 10 IICE Cc1cc(C(=O)NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c(C)n1-c1ccc(F)cc1 804647061 CMWDUBIDJALKLJ-UHFFFAOYSA-N 442.922 4.249 10 10 IICE COc1ccc2c(c1)c(C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)c(C)n2C 1126580568 ARIAGBTVDLMRHY-MRXNPFEDSA-N 443.494 4.496 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCCOc2ccccc2Br)cc1 1130544756 SSUSYOZZELSHHJ-UHFFFAOYSA-N 435.362 4.212 10 10 IICE Cc1cc(CCNC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)c(C)n1-c1ccccc1 1132015628 YKFCLEVOLHNZLC-UHFFFAOYSA-N 430.474 4.157 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1 1135946495 UMDUTEKVCLSNJS-NRFANRHFSA-N 446.016 4.360 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(c4nc(F)c(F)cc4F)CC3)c2C)c1 1138201041 IJQIKMYUFXTFMR-UHFFFAOYSA-N 428.458 4.177 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCOc1c(C)cccc1C 1139585323 PXVVNENIQTVAMM-UHFFFAOYSA-N 426.557 4.461 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(F)cc1NC(=O)c1ccc(OC)cc1 1157101526 AKVBTFBLRSLPCT-UHFFFAOYSA-N 443.471 4.208 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)c1O 1167935408 BONSJZMKKBDPPA-HNNXBMFYSA-N 433.911 4.421 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3c[nH]c4c(Cl)cccc34)CC2)cc1F 1233937844 WZZLLEMZOHRGOP-UHFFFAOYSA-N 430.911 4.043 10 10 IICE COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 1253509587 AMEXYMCYRBPGDZ-OAQYLSRUSA-N 437.584 4.136 10 10 IICE COc1ccc(F)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1265896643 ZDGDEGYTWDIYIB-YVLHZVERSA-N 434.489 4.203 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3csc(-c4ccc(Cl)cc4)n3)C2)cc1 1278862194 ZYBDMLFKNIOCEE-KRWDZBQOSA-N 427.957 4.410 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC[C@H]2CC[C@@H](C(F)(F)F)O2)C1 1288684286 LHMFOVIFZCSPHU-IERDGZPVSA-N 437.506 4.024 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCOc2ccc(F)cc2)NC(=O)OC(C)(C)C)cc1 1293793261 NAQLDCOFGOWBEC-OAQYLSRUSA-N 445.535 4.043 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1296752746 VWFNZJUNJULGRY-RUZDIDTESA-N 446.547 4.461 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1CC(F)(F)C1 1305527372 OOILMNBXUHZJQE-OAHLLOKOSA-N 437.510 4.311 10 10 IICE C[C@@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F)c1ccc(N(C)C)cc1 1312538087 YBVCOGLNHXYYHJ-MAODMQOUSA-N 434.506 4.176 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(OC2CCCC2)nc1 1352891092 BKDWUEJICWHTDS-UHFFFAOYSA-N 431.483 4.403 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)C2)cc1 1452036444 YEULQFFEFHICSA-AFMDSPMNSA-N 438.568 4.052 10 10 IICE COc1ccc(CCCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1OC 1457100256 OUQKPGPCUNYIRG-GOSISDBHSA-N 448.510 4.413 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCC[C@@H]3COC(=O)NC3CC3)c2C)c1 1471033855 IRPSHGNFNVUQQO-HSZRJFAPSA-N 438.572 4.355 10 10 IICE CN1CCC[C@H](c2cccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2)C1 1472521096 LQECSDPLKLTBDQ-LEWJYISDSA-N 443.538 4.496 10 10 IICE CC[C@H](C)c1nnc(N2CCOC[C@@H](C3CCC3)C2)n1Cc1ccc(N(C)C)cc1C 1495930515 CGZQKIKYICQYKO-AVRDEDQJSA-N 425.621 4.467 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1499727659 HPIUIMXULVHDLQ-FPOVZHCZSA-N 429.634 4.008 10 10 IICE CCc1nnc(N2CCN(CCC(C)(C)C)CC2)n1Cc1ccc(N(CC)CC)cc1 1513931073 LXKAAMKPKJJYOK-UHFFFAOYSA-N 426.653 4.293 10 10 IICE COc1ccc2c(c1)C[C@@H](C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)CO2 1524245225 KLAUHZVFVJNQIG-QFBILLFUSA-N 428.960 4.452 10 10 IICE Cc1ccc(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1-n1c(C)cc(C=O)c1C 1540334293 AQFYKDLOJUBTET-UHFFFAOYSA-N 446.507 4.086 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)[C@H](C)C1 1545187512 GIWXHXVPXIJXFU-LJQANCHMSA-N 448.615 4.456 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)C(=O)NC)C1CC1 1547347292 OFHOCAJJYIXERT-UHFFFAOYSA-N 434.588 4.114 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cccc(OCCN(C)C(=O)OC(C)(C)C)c2)c1 1566374691 QSACQLQMXSJJDD-INIZCTEOSA-N 444.528 4.138 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@H](O)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1566636715 LPKHSIUYVNSAEF-SJORKVTESA-N 445.279 4.384 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1583569238 FCWWLPYZMQUMBE-JOCHJYFZSA-N 425.573 4.237 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCOc2ccc(Cl)c(F)c2)C1 1587529937 QJJNCGOPFHXNHZ-UHFFFAOYSA-N 443.950 4.396 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)CC[C@H]3C)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935051 FLHNVQCILTVGIT-QZTJIDSGSA-N 434.588 4.066 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 1617591980 KTCBCVMDQYQORR-HXUWFJFHSA-N 435.911 4.095 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3CC(C)(C)c3cccs3)CC2)cc1 1619301758 XALMGPBEVHVZBF-UHFFFAOYSA-N 425.602 4.351 10 10 IICE C[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)N1CSCCSC1 1635126501 MFNCZZBQCLARNP-CVEARBPZSA-N 428.067 4.278 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC[C@H](O)c1ccccc1 1635488935 CCNAPZYSOKGPEV-QHCPKHFHSA-N 426.557 4.279 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](C)SCC(=O)Nc1ccc(F)cc1 1638239131 HRXDPNDJLGXWPI-IAGOWNOFSA-N 431.577 4.008 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cc1 1639923632 WBOPFJJGGJYNLE-HXOBKFHXSA-N 438.568 4.275 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC(=O)N2CCCCc3ccccc32)c1 1653079914 RXTXCQWSSNBIGN-UHFFFAOYSA-N 429.520 4.006 10 10 IICE CCOC(=O)c1sc(C2CCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)nc1C 1671851011 ACDPOSUKOKGMDX-OAHLLOKOSA-N 444.601 4.344 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C)Cc3cn(C)c4ccc(F)cc34)C2)cc1 1681963970 MQJSMNFQUMOHBS-ZWKOTPCHSA-N 438.547 4.083 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C 1682097107 JZELQVZGHOPAJN-UZKOGDIHSA-N 444.620 4.175 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(c2ccc(F)c(F)c2)CC1 1684280230 IRKGXHIBPJQJNZ-UHFFFAOYSA-N 429.511 4.015 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](c3ccc(C)cc3)c3ccccn3)C2)cc1 1686356411 YGSIZBVHUJAYFB-NLFFAJNJSA-N 430.552 4.314 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCN(c4ccc(Cl)c(Cl)c4)CC3)C2)cc1 1687024244 ZUWGYIUMCZHYEV-INIZCTEOSA-N 449.382 4.113 10 10 IICE CN(CCOC(C)(C)C)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1696829964 ABDUBKJMNXHCFW-INIZCTEOSA-N 439.651 4.410 10 10 IICE CCOCc1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1710678102 ZVLMKTVUMOHILY-LJQANCHMSA-N 443.661 4.289 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCO[C@@H]1C 1728026847 JOGGHDNVCQRQRD-CJFMBICVSA-N 437.588 4.129 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1Cc1nnc(C(C)(C)C)s1 1729420785 VNAFZSCCICMMDK-QGZVFWFLSA-N 442.589 4.059 10 10 IICE CCOCc1nnc(N2CCCC[C@H](SCC)C2)n1Cc1ccc(N(C)C)c(F)c1 1747170871 VRBUEOOLSIHMCO-SFHVURJKSA-N 435.613 4.180 10 10 IICE CN(C[C@H]1CC=CCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1747822533 AUWKBNKRZPFPCO-IBGZPJMESA-N 441.595 4.392 10 10 IICE CN(CCc1nccs1)c1nnc(-c2ccc[nH]2)n1CCCSc1nccs1 1747904394 HTYXGWZMQZIOCL-UHFFFAOYSA-N 431.616 4.048 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1763242617 QJMGWISCEWCZSX-KNQAVFIVSA-N 425.621 4.376 10 10 IICE CCCCNC(=O)C(=O)Nc1sc(C)c(-c2ccc(OCC)cc2)c1C(=O)OCC 1860762292 AWECPYIGFLBXRL-UHFFFAOYSA-N 432.542 4.154 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3ccc(NC(=O)c4ccccc4)cc3)CC2)cc1 1874755185 HYADIJREFIDWAF-UHFFFAOYSA-N 443.547 4.343 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNCc1cc(Br)cc(F)c1O)CC(F)(F)F 2117334167 ACCWBESMMHHCSJ-NSHDSACASA-N 445.251 4.229 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C1(C)C 2127901023 YBFADBIKEYDNNL-WFASDCNBSA-N 431.346 4.323 10 10 IICE COc1ccc(Br)c(CN[C@@H](C)[C@@H]2CCCN2C(=O)OC(C)(C)C)c1O 2271310715 GASPOEBEUJEQQJ-WFASDCNBSA-N 429.355 4.041 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3SC(N4C[C@H](C)O[C@@H](C)C4)=NC3=O)o2)cc1 2314433843 VFYXBXWQEYPVBT-GJZGRUSLSA-N 440.521 4.203 10 10 IICE Cc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccc(O)cc3O)SC2=S)cc1 2314831657 PLEGDTAHYFGHES-UHFFFAOYSA-N 428.535 4.026 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccccc3F)SC2=S)cc1 2314837960 YZLRGYISSHDSDR-CYBMUJFWSA-N 430.526 4.453 10 10 IICE Cc1ccc(CNC(=O)[C@@H](C(C)C)[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2380721824 MRSJUOAHODHUPR-HIFRSBDPSA-N 443.382 4.265 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc(Br)ccc1O)N2 14461313 AICSEQBLSFOIPN-GCKMJXCFSA-N 443.341 4.357 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\c3cccc4nccnc34)SC2=S)cc1OC 102731745 RFHXNPQOHBOOHB-CPNJWEJPSA-N 437.546 4.091 10 10 IICE CSC1=NSC2=NC(=O)/C(=C/c3ccc(OC(=O)c4ccc(C)cc4)cc3)C(=N)N12 104372292 ULJJPJQFVCKCDY-YHIMZFEVSA-N 436.518 4.154 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3cccc(NC(=O)Cn4cccn4)c3)c2C)c1 108674210 ZPVNBUYIAHGQAI-UHFFFAOYSA-N 441.535 4.168 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc([N+](=O)[O-])c1O 207099761 MDAVEUHNNXDADN-DHDCSXOGSA-N 447.450 4.013 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 226845659 ZWDZWAUVKNZVHK-JLHGSKIFSA-N 443.525 4.157 10 10 IICE Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1C(=O)N(C)C 435806993 HEIATIPAOSUWLZ-UHFFFAOYSA-N 432.568 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cncc(Br)c2)C1 436052870 QFNCSWKUCCNUQK-UHFFFAOYSA-N 427.346 4.204 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526226230 FDKTVBNQRMLPRG-JOCHJYFZSA-N 437.423 4.311 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 742805147 HBVKOQXVDHCBHP-CYBMUJFWSA-N 430.411 4.076 10 10 IICE Cc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1[C@@H](C)C1CC1 752842621 WKXDNHKAMRAJFY-ULQDDVLXSA-N 429.540 4.237 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(CC(=O)c3cc(C)n(-c4cccc(SC)c4)c3C)[C@H]2C1 755053506 KNCVVRKXWGDWFE-WNOPAQSVSA-N 428.598 4.267 10 10 IICE Brc1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1Br 757683661 KNRZAEWLDFNFCG-UHFFFAOYSA-N 440.179 4.338 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCc3nc(C)nc(C(F)(F)F)c3C2)cc1F 758480226 GYNKVXJJEINRLE-OAHLLOKOSA-N 438.469 4.210 10 10 IICE CCCc1c(NC(=O)N2CCN(c3ccc(OC)cc3)CC2)cnn1-c1ccc(F)cc1 760146785 BKHWBRUIWXUPRS-UHFFFAOYSA-N 437.519 4.327 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccccc3F)cs2)c(F)cc1Cl 795555155 RZPFMGCDLPWDOE-UHFFFAOYSA-N 444.868 4.329 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCOc2cccc(F)c2C1 802092635 WXODSBHSLNNWFF-UHFFFAOYSA-N 435.446 4.000 10 10 IICE Cc1cc2c(cc1C)N(C(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)CC2 804320822 XZGSQHNJBMPFFK-UHFFFAOYSA-N 428.535 4.074 10 10 IICE O=C(O)/C=C/c1ccc(N2CCc3[nH]c4ccc(Br)cc4c3C2)c([N+](=O)[O-])c1 917054555 QOFOELOAMUABTG-QHHAFSJGSA-N 442.269 4.499 10 10 IICE Cc1cc(/C=C\C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)c(C)n1-c1ccccc1 1086953160 FUQLPJIRQBWFAX-FLIBITNWSA-N 427.426 4.280 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc4c(Br)cccc4cn3)C2)cc1 1131029976 JBUBUEYASRGHQI-HNNXBMFYSA-N 426.314 4.015 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CC(C)(C)CNC(=O)OC(C)(C)C)cc1 1136480234 GFCVVJUORBXGQW-OAQYLSRUSA-N 447.620 4.201 10 10 IICE CCOc1ccc(C[C@H](CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)C(=O)OC)cc1 1142335222 ALXMNMJKWRGDEU-HSZRJFAPSA-N 448.563 4.183 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(-c3ccc(C=O)o3)ccc2O)cc1 1142712882 JKKFELKLIDGNBS-NRFANRHFSA-N 448.519 4.352 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2C)cc1 1144880324 ZKNWLGLDBUTLAS-QFIPXVFZSA-N 441.572 4.164 10 10 IICE O=C(NC[C@@H](c1ccccc1)C1CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1159628492 ZVHWFNWVYNVNPR-IBGZPJMESA-N 442.562 4.178 10 10 IICE Cn1nc(C(C)(C)C)cc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1264259192 HUEVJNCNARURKR-PTNGSMBKSA-N 446.573 4.087 10 10 IICE CC(C)CN1C[C@H]2CN(C(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)CCN2C1=O 1271319247 YDCSRGXEKUFCTR-OAQYLSRUSA-N 448.571 4.386 10 10 IICE CCCCOCCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1294415157 JFWZELINVQULTH-UHFFFAOYSA-N 429.609 4.118 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCC(F)(F)F)CC2)cc1 1315514970 ATKMYYFFLREUBP-UHFFFAOYSA-N 425.499 4.469 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1c(Cl)cc(F)cc1Br 1355131557 WXRJCFQYVLVDBH-UHFFFAOYSA-N 445.691 4.147 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccccc3C(=O)N3CCN(C)CC3)c2C)c1 1441255242 WGLQLCZYHWSGLY-UHFFFAOYSA-N 444.579 4.351 10 10 IICE O=C(CCc1ccc(OC(F)F)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445886164 SAXMTFNHHWNMQY-SFHVURJKSA-N 438.902 4.360 10 10 IICE Cc1cc(CNC(=O)[C@@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1454622752 CUVWANBOUPKNPJ-RXVVDRJESA-N 441.572 4.471 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCn3cc(Br)ccc3=O)c2C)c1 1468494836 XWGJNVOVDYSWHG-UHFFFAOYSA-N 442.357 4.065 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCC[C@@H]1c1ccc(F)cc1F 1470904061 CXONYOAHGNFTJL-HSZRJFAPSA-N 429.511 4.363 10 10 IICE CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1470968877 LKDWMHMHPBKMQP-CVDCTZTESA-N 438.616 4.363 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCC[C@H]1CCCN1C(=O)OC(C)(C)C 1478656187 HHJWNKLQKKIZMD-FPOVZHCZSA-N 446.636 4.471 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1499936707 AQBDCYBNFPTAJH-DFBJGRDBSA-N 437.588 4.129 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1 1503693794 OYMBUENEGBTBFJ-UHFFFAOYSA-N 448.615 4.361 10 10 IICE Cc1ncc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)s1 1511599789 PSPFQUKPMNCKFI-UYAOXDASSA-N 441.601 4.352 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)OC)CCO1 1514122851 KEHSGKOXRWPLRB-NRFANRHFSA-N 437.588 4.393 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc3c(cc2OC)OCO3)cc1 1543115882 YAFKFYVNFNYIGD-UHFFFAOYSA-N 434.492 4.346 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)c2ncc(C=O)n2c1 1543356618 KCBJWVBGLBACQN-UHFFFAOYSA-N 443.345 4.026 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ccc3nc(C(C)(C)CO)[nH]c3c2)cc1 1543541314 UIPJXRZICXYSRB-UHFFFAOYSA-N 446.551 4.334 10 10 IICE C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]1C 1544412787 VZSUWJCWPGACAW-WOJBJXKFSA-N 439.648 4.358 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC(C)(C)c3cn(-c4ccccc4)nn3)c2C)cc1 1545471468 GEBIHXQOBPUZJF-UHFFFAOYSA-N 429.524 4.349 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cnc(CNC(=O)OC(C)(C)C)nc3)c2C)c1 1557888834 UWANZCRSFFBLOK-UHFFFAOYSA-N 449.555 4.147 10 10 IICE CCOC(=O)c1cc(CC)sc1NC(=O)CSc1nc2cc(F)c(F)cc2[nH]1 1559357202 OOQIXQMSVCNMAK-UHFFFAOYSA-N 425.482 4.373 10 10 IICE CC[C@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1cccc2ccccc12 1560151048 ULPBRLIRPULJQY-HOFKKMOUSA-N 433.596 4.072 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](OCC3CCCC3)c3ccccc3)CC2)cc1F 1566347840 XHOMIOWRZNEJFK-XMMPIXPASA-N 426.532 4.431 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CC1(NC(=O)OC(C)(C)C)COC1 1566849041 HHFPSDVDDLKPCI-SFHVURJKSA-N 440.540 4.166 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N1CCSC[C@H]1C1CC1 1583270359 NZJORSNASLSUHJ-KFXIKWRMSA-N 438.665 4.084 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](C[C@@H](C)CC)NC(=O)OC(C)(C)C)CC2)cc1 1596732701 GDYGBPMNHAQHJS-RXVVDRJESA-N 433.593 4.063 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCCc2cccnc21 1616408141 BGEBXMFXBTYBPB-XIDKLXSXSA-N 441.553 4.006 10 10 IICE CC(C)(C)OC(=O)NCC(C)(C)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 1620626285 NXFOPZFKSYZSTM-UHFFFAOYSA-N 431.621 4.286 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1624538128 XPFSDQJGTPHBDC-UHFFFAOYSA-N 433.643 4.237 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(I)cc2F)cc1F 1627604506 KUAFWQSPWGBCNB-UHFFFAOYSA-N 444.263 4.346 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)SCc2nc(O)c3ccccc3n2)cc1 1628857813 NFRXPUYFXFTMTN-QGZVFWFLSA-N 438.597 4.462 10 10 IICE Cc1cc(C(=O)N2CCO[C@@](C)(C(F)F)C2)c(C)n1-c1ccccc1Br 1630010957 GDHZOPYERJEEAP-LJQANCHMSA-N 427.289 4.353 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)cc1 1632044526 OJNVHSYGULWLPP-UHFFFAOYSA-N 445.563 4.243 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(CC(C)C)C[C@@H](O)c3ccc(F)cc3)C2)cc1 1636353650 GBEXXNNDVQIQMY-NTKDMRAZSA-N 443.563 4.062 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCO[C@H](c4ccc(F)c(Cl)c4)C3)C2)cc1 1636354353 XQWFPGUBVSABQQ-AOMKIAJQSA-N 447.938 4.097 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)c2C)cc1 1641362415 NXXGFAPVTIOSFB-PMACEKPBSA-N 439.556 4.327 10 10 IICE Cc1cc(CCNC(=O)c2ccc(NCc3cnn(C)c3)cc2)c(C)n1-c1ccccc1 1643017497 FQEGIJSILABJQG-UHFFFAOYSA-N 427.552 4.412 10 10 IICE Cc1c(C(=O)NCc2ccc3cccnc3c2O)cnn1-c1cccc(C(F)(F)F)c1 1643283238 MJHIGBQIFHOLOY-UHFFFAOYSA-N 426.398 4.383 10 10 IICE Cc1ccc2nc(SCC(=O)c3cc(C)n(-c4ccc(F)cn4)c3C)n(C)c(=O)c2c1 1643644094 MYSJYFNTNQOXTP-UHFFFAOYSA-N 436.512 4.159 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cnc4cc([N+](=O)[O-])ccc4c3=O)c2C)c1 1656186553 CEYGHAHLIHSMJJ-UHFFFAOYSA-N 430.464 4.212 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(Cl)c(C(F)(F)F)c3)C2)cc1 1682646131 NZHWIULMOWBEDQ-CQSZACIVSA-N 427.854 4.446 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]2[C@H]1CCN2C(=O)OC(C)(C)C 1683254377 PMUOBRXBDOLYMJ-VLCRHTCISA-N 444.620 4.175 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1686096059 DLBVBYDNIILYFM-ILBGXUMGSA-N 427.564 4.197 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](Cc3cnn(C)c3)C2)n1Cc1ccc(N(C)C)cc1C 1694049695 RLADTLAAKVFRDI-AZUAARDMSA-N 435.620 4.017 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1cccnc1OCC(F)F 1696699424 ASZIKWBNUYAIPE-UHFFFAOYSA-N 431.487 4.005 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N(CCC#N)CCC(C)C 1707304757 FEWBXZWEDIRWBG-JOCHJYFZSA-N 438.620 4.361 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC3(CCC3)C2)n1CCCSc1nccs1 1744057371 GFIDEYDGCSFKCI-UHFFFAOYSA-N 448.662 4.216 10 10 IICE Cc1occc1CN(C)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1751356690 QBSYYYRQGGRABW-UHFFFAOYSA-N 441.551 4.038 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1761674670 HMABMICPSDMAPU-UHFFFAOYSA-N 434.544 4.138 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC(c2ccnn2C)CC1 1761697628 BFVSMPXERMEBFF-UHFFFAOYSA-N 435.620 4.017 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(OC)CCOC1)C(C)C 1764747264 ODMHMTUPJAITRU-VWLOTQADSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCC[C@@H]2CSC)cc1 1764939963 ZKRZGOYQUDXMMB-RBBKRZOGSA-N 443.661 4.398 10 10 IICE COCCN(Cc1ccc(C)o1)c1nnc(C(C)C)n1Cc1ccc(N(C)C)cc1C 1769823275 ZVJFYSCDUSLXCC-UHFFFAOYSA-N 425.577 4.379 10 10 IICE Cc1nc2scc(C)n2c1/C=C1/SC(=S)N(Cc2ccc3c(c2)OCO3)C1=O 1858589239 SHEKPZSSXQPJHG-OMCISZLKSA-N 429.548 4.143 10 10 IICE COc1ccc(N2CCN(c3nc(Nc4cc(C)ccc4C)ncc3[N+](=O)[O-])CC2)cc1 1871311898 SALADWWQDIHKED-UHFFFAOYSA-N 434.500 4.080 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C(F)(F)F)c(N)c2I)cc1C 2080038966 UPFSTAGQKDKHTQ-QMMMGPOBSA-N 425.192 4.020 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C2CCC2)c(N)c1I 2080043360 TUADXSVWDLVCGH-CYBMUJFWSA-N 427.286 4.051 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3cc(Br)ccc3O)CCC[C@H]12 2087290593 WRHGHJHGIXZORY-FXAWDEMLSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCCC[C@H]2NC(=O)OC(C)(C)C)c1O 2236054303 HBRLNUGTQHDNQQ-JKSUJKDBSA-N 443.382 4.479 10 10 IICE CCCN1C(=O)C(=Cc2c(NC3CCCCC3)nc3ccc(C)cn3c2=O)SC1=S 2314415105 XSPVNIUILPEKQV-UHFFFAOYSA-N 442.610 4.359 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H](C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2352945793 BESIJYYOEZEFHG-ZDUSSCGKSA-N 429.355 4.067 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccccc3C)[C@@H]2c2ccc(O)c(O)c2)c1OC 526496123 MNSUPLPHZCHEDQ-JOCHJYFZSA-N 433.460 4.481 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(CN2CCCC2)c1 742800044 FIDAWAMGHZNRJG-FQEVSTJZSA-N 429.511 4.283 10 10 IICE CC[C@H]1CN(C(=O)/C=C\c2cc3cnn(C(C)C)c3[nH]c2=O)c2cccc(Cl)c2O1 753054807 WBCASZBUEWCOLQ-QWGSZXSUSA-N 426.904 4.176 10 10 IICE Cc1noc(C)c1CO[C@@H]1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 762998894 XCVKCYWJDXPZTB-HSZRJFAPSA-N 436.556 4.242 10 10 IICE Cc1cccc2c(CCC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)c[nH]c12 768531855 FAJXFIAHVBNUON-UHFFFAOYSA-N 430.596 4.257 10 10 IICE C[C@H](NC(=O)C1(c2cccc(OC(F)(F)F)c2)CC1)c1ccc(N2CCOCC2)cc1 1125451803 MBOWYPNCGHVQKO-INIZCTEOSA-N 434.458 4.331 10 10 IICE CN(C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1cccc(Br)n1 1128322339 XAIABLHYEFFBGD-UHFFFAOYSA-N 446.345 4.414 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccccc3Sc3ccccc3)cc2)CC1 1133626285 DVJRGTMNTGWCNK-UHFFFAOYSA-N 445.588 4.470 10 10 IICE CC(=O)N1C[C@@H](C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)Oc2ccccc21 1137816969 WXUVGEQZEJAOAX-BVZFJXPGSA-N 430.504 4.296 10 10 IICE CCC(CC)[C@@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1147517073 CLFKBXFUMRZXIC-KRQKXCKJSA-N 449.595 4.194 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3C[C@H](OC(C)(C)C)[C@H]3n3cccn3)c2C)cc1 1158289802 YOSVBQKOLAJLPG-VJBWXMMDSA-N 436.556 4.226 10 10 IICE COc1ccc(C[C@](C)(CO)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1234325353 CTIWKBQEZAGIRV-AREMUKBSSA-N 435.568 4.204 10 10 IICE C[C@H](NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)c1ccc(N2CCOCC2)cc1 1264822104 DSASNVXPNNUDLN-SFHVURJKSA-N 439.556 4.386 10 10 IICE C[C@H]1CCc2nc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)sc2C1 1306228447 JRLOLUGPIOYGCZ-NSHDSACASA-N 449.579 4.088 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C(C)(C)C)c(C)n1-c1ccc(OC(F)F)cc1 1307276311 BIRCKKXEGHPURL-UHFFFAOYSA-N 435.500 4.412 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1312903145 VOFTZILFZOAHJT-NRFANRHFSA-N 432.568 4.428 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(c3ccc4[nH]ccc4c3)CC2)N(C)C)cc1 1313394129 JERPKKSYJFXIHF-RUZDIDTESA-N 433.600 4.426 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(Cn3cc(Br)cn3)cc2)cc1 1350864875 RBQOYTFVHROCTF-UHFFFAOYSA-N 441.373 4.470 10 10 IICE Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)cc2)nn1 1355131255 VAXRWTSLLUIEAK-QZTJIDSGSA-N 434.515 4.135 10 10 IICE CCCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)c(OC(C)C)c1 1438183489 AWRWNXRSGJGDGI-UHFFFAOYSA-N 442.556 4.242 10 10 IICE COc1cc(CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)ccc1OCCN(C)C 1443407784 LKPBKQZZDIBDSV-UHFFFAOYSA-N 435.568 4.282 10 10 IICE O=C(NCC1(C(=O)NCc2ccc3cccnc3c2O)CCCC1)OCc1ccccc1 1451965247 YDBSCNPIXILRIU-UHFFFAOYSA-N 433.508 4.043 10 10 IICE COC(=O)c1cnc([C@H]2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)s1 1456548541 JXJGJIITYAJPEQ-HNNXBMFYSA-N 427.501 4.106 10 10 IICE CCOC(=O)c1c(C)oc2nc(CN3C[C@H](C(C)C)Cc4cc(OC)ccc43)nc(N)c12 1473569481 HJWOYOAHQUCTCR-MRXNPFEDSA-N 438.528 4.134 10 10 IICE CC1CCN(c2ccc(Cn3c(N4CCN(C(C)C)CC4)nnc3C(C)(C)C)cc2)CC1 1493873039 JDIMAJIMKAHFOG-UHFFFAOYSA-N 438.664 4.391 10 10 IICE C[C@@H](NC(=O)c1cc(F)c(Br)cc1F)c1ccc(N2CCOCC2)cc1 1528554990 RDFMLEITFUAPKN-GFCCVEGCSA-N 425.273 4.055 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1532104276 ALOBGNMDAMFTLK-GOEBONIOSA-N 435.337 4.171 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3sc(SC4CCCC4)nc3C)C2)cc1 1532105301 KFWVOLOCVYBBSY-INIZCTEOSA-N 431.627 4.432 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCCN(C)C(=O)c3ccncc3)cc2Cl)C1 1539911879 DJRDAQLLQTVOSC-SFHVURJKSA-N 442.991 4.140 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1N(C(=O)OCc2ccccc2)CC1(C)C 1557063272 JPYUZWVYTQYFBI-AUSIDOKSSA-N 437.584 4.155 10 10 IICE CC1CC(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)(c2cccc(Cl)c2)C1 1596684563 SEZFKAASPBVCDA-UHFFFAOYSA-N 434.914 4.439 10 10 IICE Cc1cccc(-c2nnc(N3CCOC(C)(C)[C@@H]3C)n2CCCSc2nccs2)n1 1612212788 RFGDUOAPXQZTGY-INIZCTEOSA-N 444.630 4.291 10 10 IICE COCCCN(Cc1c(O)ccc2c(C)c(C)c(=O)oc12)C[C@@H]1CCCN2CCCC[C@@H]12 1614472433 IIQYOXGMHYEWRT-REWPJTCUSA-N 442.600 4.218 10 10 IICE CCC[C@H](C)N1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CC1=O 1616620601 WUXQDJDRTISGPL-PZJWPPBQSA-N 437.584 4.332 10 10 IICE C[C@H]1CC[C@H](c2nc(CC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cs2)CC1 1618648571 RDUHZUBDJKDJRO-SAABIXHNSA-N 445.604 4.396 10 10 IICE CCO[C@H](C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)C1CCCC1 1628496398 XMXJVYFSILNYCK-RTWAWAEBSA-N 433.593 4.030 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C)c2C)cc1 1635143404 VLJDAHGUYWGDEF-VQIMIIECSA-N 441.572 4.336 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@H](O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cn1 1635867985 OZIGXCFZSCUCBG-XCLFUZPHSA-N 446.320 4.243 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cccc(Cl)c1 1644808638 UHTWBULBFURASZ-IRXDYDNUSA-N 433.955 4.235 10 10 IICE Oc1ccccc1CN(C[C@H](O)COc1cc(F)cc(Br)c1)C1CCCC1 1653338962 CICCOWGJCGJBGG-IBGZPJMESA-N 438.337 4.478 10 10 IICE Cc1cc(CC(=O)NC2(C)CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1653814177 LANYJRHPSSVSFR-UHFFFAOYSA-N 431.964 4.416 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cn(C(F)F)c4ccccc34)C2)cc1 1673826503 NGFLZWJVQIDUCH-INIZCTEOSA-N 428.483 4.371 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1C 1680465757 DAFURCHABRQGLJ-HSZRJFAPSA-N 446.551 4.404 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC(=O)Nc4ccccc4C3)cc2Cl)C1 1681827717 KWXNJCWYUXUEFB-INIZCTEOSA-N 426.948 4.240 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@](CO)(C(F)(F)F)C3)cc2Cl)C1 1682024387 RPGBDNORCCJSFZ-IFXJQAMLSA-N 433.902 4.033 10 10 IICE Cc1cc(CCNC(=O)N2C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccc1 1687219679 WLSYFOOWEDZZED-VGOFRKELSA-N 440.588 4.191 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1694821299 FLRRTKULUKPAQO-WOIUINJBSA-N 441.620 4.058 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H]3CCC[C@H]3OC)CC2)cc1 1711865236 OBEJACVOAADVJA-NFBKMPQASA-N 441.620 4.017 10 10 IICE CCC[C@H](C)N(C)c1nnc(C(=O)NC(CC)CC)n1Cc1ccc2c(c1)CCCN2C 1727936169 MRWFAVXKHZVANS-SFHVURJKSA-N 440.636 4.252 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)NC(C)C)nnc1N(CC(C)C)C1CCCC1 1742139790 VKGJHSXMCFZAGI-UHFFFAOYSA-N 440.636 4.244 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)c3ccco3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1751415173 IAIXRDUENRLSOZ-IBGZPJMESA-N 446.555 4.231 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)C[C@H]1CCCCO1 1761698400 NIQONHUPBIJDCE-JOCHJYFZSA-N 439.629 4.358 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1Cc1nc(C(C)(C)C)cs1 1768681912 PYUIIKNKHADFKG-UHFFFAOYSA-N 448.596 4.408 10 10 IICE Cc1cc(O)c([C@@H](C(C)C)n2nc(C3CC3)c(CN)c2I)cc1C 2079978632 DRMQNILHJZYLJW-GOSISDBHSA-N 439.341 4.392 10 10 IICE COc1ccc(Br)c(CNC[C@@H](CC(C)C)NC(=O)OC(C)(C)C)c1O 2227738171 SFMFTUOJGZNPTP-CYBMUJFWSA-N 431.371 4.192 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(C(=O)OC(C)(C)C)CCC2(C)C)c1O 2236050877 LPIXMRPHLBSOGK-INIZCTEOSA-N 443.382 4.289 10 10 IICE CCC1=NN(Cc2cccc(F)c2)C(=O)C1=Cc1cc(Br)cc(OC)c1O 2332124736 KIWMPZUPGRNFPM-UHFFFAOYSA-N 433.277 4.494 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380747395 TWOOHGXVPYQCSD-OAHLLOKOSA-N 441.366 4.117 10 10 IICE Nc1ccc(-n2nnc(S(=O)(=O)c3cccc(C(F)(F)F)c3)c2-c2ccccc2)cc1 11730791 XNCKQCAWWGJKLW-UHFFFAOYSA-N 444.438 4.368 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1/C=C1/SC(=S)N(C(C)C)C1=O 33489107 BYNMFNGUMIVZJM-LFIBNONCSA-N 430.599 4.215 10 10 IICE CCCCOC(=O)C(=O)c1cc(-c2ccc(S(C)(=O)=O)cc2)n(-c2ccccc2)c1C 138055744 SFDGTKQUXCYQEK-UHFFFAOYSA-N 439.533 4.382 10 10 IICE O=C(NC[C@@H]1CCCO1)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1O)[C@@H]1CC=C[C@H]21 250225166 WAVNCFHPGJQZAM-JAOIYPECSA-N 435.480 4.036 10 10 IICE O=c1c(Cl)c(NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cnn1-c1ccccc1 301938446 UQXXSVPZHLLZFD-UHFFFAOYSA-N 449.986 4.030 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)C1 436021646 JJIXFMNIWHSARW-HFZDXXHNSA-N 431.580 4.444 10 10 IICE O=C(O)CCN1C(=O)/C(=C/c2ccc(-c3ccccc3Br)o2)SC1=S 504752753 GNWFYBKIAHJCMZ-ZROIWOOFSA-N 438.324 4.385 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3CCC(NC(=O)c4ccoc4C)CC3)c2C)c1 727437830 ZBWOCWXTEJPWAG-UHFFFAOYSA-N 433.552 4.381 10 10 IICE CN(C)c1ccc(CN(C2CC2)S(=O)(=O)/C=C/c2ccccc2Br)cc1 727447875 AWQLHJLERGMDTB-BUHFOSPRSA-N 435.387 4.480 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@H](O)c1ccc(Br)cc1 743871135 RZBCJYHEZNTNMT-KRWDZBQOSA-N 429.152 4.473 10 10 IICE O=C(NCc1ccccc1)C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 768206789 HNBJEXVWQXZPOK-UHFFFAOYSA-N 436.556 4.114 10 10 IICE CCN1CC[C@H](NC(=O)N[C@@H](C)c2cc(OC)ccc2O)[C@@H]1c1ccc(Cl)c(F)c1 773808786 GQDYPCGOVVGHCT-LPLGYCIKSA-N 435.927 4.389 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3cc(F)cc(Br)c3F)CC2)cc1 786477921 KPAZQQLRDCHRQN-UHFFFAOYSA-N 440.288 4.480 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(O)cc(C(F)(F)F)c1 816890103 XZTBAPHRSHPBPC-UHFFFAOYSA-N 448.363 4.196 10 10 IICE O=C(NCc1ccccc1CN1CCCCC1)N(Cc1ccccc1O)C[C@H]1CCCO1 916221590 QNOVAKYHSSNCNB-XMMPIXPASA-N 437.584 4.269 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3cccc(OC(F)(F)F)c3)cc2F)C[C@H](C)O1 1125188840 VNTIJDINTIONPL-GJZGRUSLSA-N 440.437 4.197 10 10 IICE C[C@H]1CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c2ccccc2O1 1126262729 UKAOAAJFWRRTRS-YQNUULROSA-N 442.537 4.231 10 10 IICE Cc1ccc(-n2cnnc2SCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1132011702 UWXXROIXNUMHMC-UHFFFAOYSA-N 445.592 4.434 10 10 IICE Cc1cc(CNC(=O)CCCNC(=O)c2ccc(F)cc2F)c(C)n1-c1ccccc1 1132048206 MQDRKIMLMPPTSO-UHFFFAOYSA-N 425.479 4.199 10 10 IICE Cc1ccc(NC(=O)c2cccc(O)c2O)cc1S(=O)(=O)Nc1ccc(Cl)cc1 1135467575 FNZVTQPYAULBQZ-UHFFFAOYSA-N 432.885 4.113 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(Cl)cc(Cl)c2O)c1 1136700616 UAJBCTRCUGFYRE-UHFFFAOYSA-N 444.318 4.443 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccccc2C(=O)NCC(C)C)cc1 1141302884 XPCXQPYUCHDBLZ-UHFFFAOYSA-N 431.536 4.474 10 10 IICE Cc1cc(C(=O)N(C)[C@H]2CS(=O)(=O)c3ccc(Cl)cc32)c(C)n1-c1ccc(F)cc1 1151918942 XQXMYUGXDUSMNS-FQEVSTJZSA-N 446.931 4.487 10 10 IICE COC(=O)[C@](C)(CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1154462238 QQHIYLWKPFDTQS-AREMUKBSSA-N 432.520 4.076 10 10 IICE Cc1cc(CNC(=O)[C@@H](Cc2ccccn2)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1170859375 SZBAAMSNAZFVMI-HSZRJFAPSA-N 448.567 4.241 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@@H]3CCN(c4ccccc4Cl)C3)C2)cc1 1230300641 HRDMBQVYQJKXEI-MOPGFXCFSA-N 442.991 4.001 10 10 IICE CCOc1ccc(-c2nc(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)cs2)cc1 1276831866 HLNZGASHWFZVAH-QGZVFWFLSA-N 437.565 4.474 10 10 IICE COC(=O)[C@H]1CN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c2ccc(F)cc2O1 1300194504 LBBGDZVCXOOWHE-OAQYLSRUSA-N 442.874 4.467 10 10 IICE CN(OC1CCCC1)c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1314891832 DAISSCCWIGCIDR-UHFFFAOYSA-N 430.603 4.213 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(NC(=O)OC(C)(C)C)Cc3ccccc3C2)cc1 1355910075 IBKAKTBVFQBEEW-UHFFFAOYSA-N 437.584 4.211 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)c(C)n1-c1ccccc1 1357577573 ZLFHXAWJQJHMBB-IBGZPJMESA-N 445.563 4.171 10 10 IICE Cc1cc(CCNC(=O)c2cc(Br)cn3ccnc23)c(C)n1-c1ccccc1 1438178804 OZJWZSJWZHCIDT-UHFFFAOYSA-N 437.341 4.477 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1Cc2ccc(Cl)cc2C1 1451164170 HCIIMQJSHJOWEF-UHFFFAOYSA-N 434.926 4.064 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1462086953 RGXKQBLTQLJCSR-UHFFFAOYSA-N 426.520 4.396 10 10 IICE CC[C@@H](C)[C@H](NC(=O)c1ccc(C)c(O)c1O)C(=O)N1CCC(Cc2ccccc2)CC1 1465004300 NREUZUNWDOFMFH-VGSWGCGISA-N 438.568 4.032 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@H](CCc2ccccc2)c2ccccn2)N(C)C)cc1 1471081672 FZBQBIYLJOTFCM-FTJBHMTQSA-N 445.611 4.424 10 10 IICE COc1ccccc1[C@@](N)(C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1472608775 JRWWACRVAGULHI-HSZRJFAPSA-N 445.485 4.444 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1 1478840985 MSLKMLZJDYUNHT-SFHVURJKSA-N 432.609 4.129 10 10 IICE CCOCc1nnc(N2C[C@H](CC)O[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1516498625 WKHREXKMGHIVDH-OFNKIYASSA-N 441.620 4.103 10 10 IICE COc1cccc(-c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)on2)c1 1531504504 RTFCWYNDBIGSJS-MRXNPFEDSA-N 443.450 4.350 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CC3CCC(c4ccccc4)CC3)cc2)CC1 1537839015 HQFVZKBKYFSNOH-UHFFFAOYSA-N 433.596 4.369 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H](NC(=O)OCc3ccccc3)C(C)C)cc2)CC1 1543143093 SVXOCXXEWDTSLY-DEOSSOPVSA-N 437.584 4.490 10 10 IICE C[C@@H]1CCCCN1CCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1544027910 ZABIITVSGKHQQP-KNQAVFIVSA-N 427.593 4.126 10 10 IICE C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632882 YBJPMXFCCHEESX-IIBYNOLFSA-N 428.960 4.082 10 10 IICE COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559698131 QKALLVIGFUUMLS-HOTGVXAUSA-N 428.488 4.148 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2C[C@H](OC)C2(C)C)sc(C)c1-c1ccccc1 1559845936 QWFCKQSDXHCGEV-SJORKVTESA-N 430.570 4.242 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3C[C@H]2O)c(C)n1-c1cccc(Br)c1 1566324643 JRNPKXHNUWDBMK-NHCUHLMSSA-N 425.326 4.245 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3cc(F)ccc32)c(C)n1-c1ccc(Br)cn1 1587229428 ZAUNKJFCRYOOLX-UHFFFAOYSA-N 443.320 4.487 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccccc3Br)CC2)c(OC)c1 1587491034 WQPVGIOXAYFXMG-UHFFFAOYSA-N 447.373 4.093 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CCCN(c3ccccc3)C2=O)cc1 1595385215 LNRJSUWRRBSMKB-DEOSSOPVSA-N 431.536 4.318 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C3(C)OCCO3)C2)c(C)n1-c1cccc(Br)c1 1597233179 YGSNRJCYAGYWMR-QGZVFWFLSA-N 447.373 4.472 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O)C(C)C 1615201298 CNOJOCBPWJBTJP-RUZDIDTESA-N 434.588 4.066 10 10 IICE CCO[C@H]1C[C@@](O)(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1626720590 VEGXLSVZEIUDGQ-SIKLNZKXSA-N 449.389 4.153 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)cc1F 1627604333 DQEGSVXCXCZYTO-KDURUIRLSA-N 427.564 4.211 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nccc2c(Br)cccc12 1634725617 ZOFJSJBHBLOUHP-UHFFFAOYSA-N 436.103 4.395 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1635623321 UEEWITLGKVJROA-NRFANRHFSA-N 440.927 4.383 10 10 IICE CCN(Cc1nc2c(s1)C[C@@H](C)CC2)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1636354504 YZUNBSWRWFZETM-ZWKOTPCHSA-N 442.629 4.335 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)nc3Cl)cc2F)C[C@@H](C)O1 1638197323 YHVKYTWTAJAUJZ-TXEJJXNPSA-N 445.844 4.437 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC[C@]2(C)C(=O)OC(C)(C)C)C1 1640978968 OHZSFKAVUBHXAH-AREMUKBSSA-N 439.600 4.131 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)[C@H](O)c1ccc(Cl)cc1 1641948694 QMAXGJACVQHQNN-FCHUYYIVSA-N 440.927 4.143 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)COC)CCO1 1694919812 JVPHSGFOASNACZ-XMSQKQJNSA-N 437.588 4.250 10 10 IICE CCCN(C)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N2CCSCC2)cc1 1695278590 MJWULWWZTQPUMX-UHFFFAOYSA-N 443.020 4.441 10 10 IICE Cc1ccccc1CN(C)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1742437542 JZDBKCKHPUTECX-SFHVURJKSA-N 429.615 4.366 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCN(CC(F)(F)F)C2)o1 1761737571 KCCPUMJCEMQAMP-INIZCTEOSA-N 449.477 4.073 10 10 IICE Cc1ccccc1Cc1nnc(N2CCOC[C@H]2C)n1CCCSc1nccs1 1762118239 RMZMGYFMIUBPKL-QGZVFWFLSA-N 429.615 4.041 10 10 IICE C[C@@H]1CN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C[C@@H](C)S1 1763102949 VAWUMJYPCGWZPJ-HUUCEWRRSA-N 434.660 4.253 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](CNC(C)=O)C1 1764371308 KUCINAODRHUDKX-NRFANRHFSA-N 434.588 4.115 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1CCOc1cccc(C(F)(F)F)n1 1767113796 XTQIPLFARLBAQJ-UHFFFAOYSA-N 447.461 4.065 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)NCCCCN=[N+]=[N-])C1 2010405648 KFKZUKHVPSARGF-QFIPXVFZSA-N 431.537 4.037 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)c1ccc2c(c1)CCCN2C 2044730429 OIXBSIVGNREZCO-VWNXMTODSA-N 439.600 4.128 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNCc1c(O)cccc1Br)CC(F)(F)F 2053661999 KGDHADBSSUSTAF-JTQLQIEISA-N 427.261 4.090 10 10 IICE Oc1c(Br)cccc1Cn1nc(C2CCC2)cc1I 2070170772 RDUYDVQLCAFHOK-UHFFFAOYSA-N 433.087 4.272 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CNCc3cc(Br)cc(F)c3O)C[C@H]21 2140716807 FKAYPIZKHYUZDO-DJSGYFEHSA-N 429.330 4.029 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 2294133709 BLYHNAATXSVOGF-UHFFFAOYSA-N 437.795 4.175 10 10 IICE CCCC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cc(OC)c(OC)cc1C(=O)OC 2313682088 UXURQRSMQVZPEU-UHFFFAOYSA-N 437.496 4.379 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(c3ccccc3OC)C2=O)c1)C(=O)O 2314931420 NZXCFINWDBVDFE-INIZCTEOSA-N 429.519 4.343 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(c2ccc3c(c2)OCO3)C1=O)C(=O)O 2314933082 SKJWHVSYBBHSKW-AWEZNQCLSA-N 443.502 4.063 10 10 IICE COc1ccc(C=C2SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)cc1OC 2321736695 OQVGCVCTXHMYLI-UHFFFAOYSA-N 447.534 4.135 10 10 IICE Cc1ccc(CNC(=O)[C@H](CC2CCC2)NC(=O)OC(C)(C)C)c(O)c1Br 2380748300 CQEBLDYXGHJLCP-HNNXBMFYSA-N 441.366 4.163 10 10 IICE NC(=O)c1ccccc1NC1=NC(=O)/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)S1 208335190 IBOOATYFQHCIMU-WQRHYEAKSA-N 434.433 4.036 10 10 IICE Cc1nn(CC(=O)N[C@@H](c2ccccc2)c2c(O)ccc3ccccc23)c(=O)c2ccccc12 248050212 WXOSZLUMZNWWKD-MHZLTWQESA-N 449.510 4.470 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C[C@H]2CCCC[C@H]21 727134560 ZYJSRSINQFTJAR-FCEUIQTBSA-N 427.589 4.471 10 10 IICE C[C@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)N(C)Cc1c(F)cccc1Cl 734155525 FMJNGJYRHVHGHQ-SJORKVTESA-N 433.955 4.013 10 10 IICE COc1cc(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc(OC)c1O 742819816 TVRZAFLWSVPKPE-UHFFFAOYSA-N 428.916 4.329 10 10 IICE C[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1ccc(-n2ccnn2)cc1 756756488 QHHKEZJCJHFFPS-LJQANCHMSA-N 444.539 4.399 10 10 IICE CN(C)CC(C)(C)CN1C(=O)/C(=C\c2ccc(Br)c(F)c2)SC1=S 763109331 RPESJRGRJIYCRX-RIYZIHGNSA-N 431.396 4.377 10 10 IICE COc1ccc(N2CCC(NC3CCN(c4ccc(C(F)(F)F)cn4)CC3)CC2)cc1 764938417 FRGAGXMMHXDNRJ-UHFFFAOYSA-N 434.506 4.336 10 10 IICE CCC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccc(OC)c(OC)c3)cs2)c1 772828835 TWKGUMCWUOHCBN-UHFFFAOYSA-N 432.523 4.221 10 10 IICE CCCN(Cc1ccccc1O)C(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1 787428505 XWGQVQSRHKFWDI-UHFFFAOYSA-N 430.574 4.449 10 10 IICE O=C1N[C@@H](Cc2cccc(Cl)c2)C(=O)N1[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804174531 GLFKBORFZXCWHY-MJGOQNOKSA-N 449.885 4.073 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC(C(=O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])c1 917077826 UIPXQEZVENVDLP-XVNBXDOJSA-N 430.407 4.159 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3ncc(-c4ccc(F)cc4F)o3)C2)cc1 1129991698 VFEPIOFKNZWVMI-INIZCTEOSA-N 441.478 4.204 10 10 IICE CN(C(=O)c1cn(C)nc1[C@H]1CCCN(C(=O)OCc2ccccc2)C1)c1ccsc1 1130660636 KQKKMTQUVBZGLD-SFHVURJKSA-N 438.553 4.274 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@@H](c2ccco2)C1 1136805024 QWGWJEYODVEBJT-PWDRBQJJSA-N 430.526 4.026 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCCN(Cc2ccccc2)C1 1137438610 OYEAVEGXIWOVKG-OFNKIYASSA-N 442.003 4.038 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Cl)cc(Br)c1 1137816704 OXDUBJDKXAQWHF-UHFFFAOYSA-N 447.112 4.277 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)cc1 1141566475 NWJJPDDXPZFTQR-SFTDATJTSA-N 449.511 4.016 10 10 IICE O=S(=O)(c1ccc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1)C(F)F 1162436738 APUUWCGQTNUFNT-MRXNPFEDSA-N 430.904 4.118 10 10 IICE COc1cc([C@@H](C)NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc2ccccc12 1253511240 JVWAZHWDKGRNMF-GOSISDBHSA-N 433.552 4.370 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H]2C(=O)NCc2ccco2)c(C)n1-c1ccc(Cl)cc1 1264400829 XEQQSPOWKXIYFF-QFIPXVFZSA-N 439.943 4.190 10 10 IICE CCCN(CC)c1nnc(Cc2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1294497423 LXMBEDKVCJLWJY-UHFFFAOYSA-N 436.629 4.102 10 10 IICE CCN(CC)c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1295421955 ZSEHWLMYKYEQEP-UHFFFAOYSA-N 447.587 4.056 10 10 IICE Cc1cnn(CC2CCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)cc3C)CC2)c1 1304599981 HIAXBLXUCQELFL-UHFFFAOYSA-N 435.620 4.246 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](C)c1nc(C)cs1 1306178273 CAJUJCQEWRCHQO-KRWDZBQOSA-N 440.617 4.134 10 10 IICE CN(C)c1ccc(CN(C(=O)Cc2noc3ccc(Br)cc23)C2CC2)cc1 1354140696 CBSJCECJFWEJCX-UHFFFAOYSA-N 428.330 4.390 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccccc2Cl)[nH]n1 1445880049 FMRJKTDQOPYBSA-INIZCTEOSA-N 445.350 4.484 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1446423450 WVJZOKAMTPKITB-OAQYLSRUSA-N 447.620 4.406 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3cccc(OCc4cccc(C)c4)c3)CC2)cc1 1458046273 VPNHUPGZSFINPO-UHFFFAOYSA-N 430.548 4.474 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1458223142 ZBORFCWRNLEOEP-HNNXBMFYSA-N 434.487 4.459 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](Cc3ccncc3)C(=O)OC(C)(C)C)c2C)c1 1469464843 ZUKWXKDZRPAQQP-HSZRJFAPSA-N 433.552 4.480 10 10 IICE CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1470968879 LKDWMHMHPBKMQP-XXBNENTESA-N 438.616 4.363 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@H]4CCOC4)n3CCCC(C)(C)C)CC2)cc1 1518310596 ZNKNFKQZZINLTC-FQEVSTJZSA-N 441.620 4.334 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)C(=O)N3c4ccccc4C[C@H]3C)ccc21 1526200172 LDIPFIKPCHTWMP-SJLPKXTDSA-N 433.552 4.001 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(C(=O)N(C)c3ccccc3)c2)cc1 1527594341 AATRAHZAHIUYSU-UHFFFAOYSA-N 431.536 4.180 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N[C@@H](c1ccccc1)C(F)F)c2[N+](=O)[O-] 1533857806 KORGGSRKMDHCHT-SFHVURJKSA-N 436.370 4.106 10 10 IICE CC[C@@H](C)c1nc(C)c(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)n1 1542490212 HOALLWSVNKWETG-WZONZLPQSA-N 438.616 4.423 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3cccc(CN4CCN(C)CC4)c3)c2C)c1 1542812511 UKGYFZYTOMJVBO-UHFFFAOYSA-N 430.596 4.080 10 10 IICE Cc1cc(NC(=O)Cc2ccc(O)c(O)c2)n(-c2cc(C(F)(F)F)ccc2Cl)n1 1565563846 ZHLLWWSKPUUNDQ-UHFFFAOYSA-N 425.794 4.445 10 10 IICE Cc1nc(-c2ccn(C)n2)sc1CC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1583704787 VKTWEFPVYPIZNL-UHFFFAOYSA-N 437.613 4.480 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc2[nH]cc(I)c2c1 1587404748 KHCGMAOONCEYCV-UHFFFAOYSA-N 433.293 4.111 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(-c2ncnn2CC)cc1 1588193197 OLQGGHRYZBHYKD-UHFFFAOYSA-N 429.318 4.095 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)O[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1613201883 JMEJNSITAUZYHA-IPMKNSEASA-N 429.634 4.007 10 10 IICE O=C(CCN1CCCCC1)Nc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1 1626437497 UGHICPMCXNYHBV-UHFFFAOYSA-N 439.537 4.379 10 10 IICE CCc1ccc(-c2ccc(C(=O)NCCN3CCN(c4ccc(OC)cc4)CC3)o2)cc1 1627050124 JANRFFVBANWZPY-UHFFFAOYSA-N 433.552 4.070 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2N(C)C(=O)c2cccs2)cc1 1628469129 QOKTYQJWGGUEBH-UHFFFAOYSA-N 437.565 4.242 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1(CC(=O)OC(C)(C)C)CCOCC1 1628873571 DTPOYUKWFKBQLR-UHFFFAOYSA-N 430.589 4.164 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C2)cc1 1639923631 WBOPFJJGGJYNLE-GAJHUEQPSA-N 438.568 4.275 10 10 IICE O=C(NCc1c(O)cccc1O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 1647270641 VOQIETOAQCLVKG-UHFFFAOYSA-N 441.281 4.043 10 10 IICE COC(=O)CN(Cc1ccc(OCc2ccccc2)nc1)Cc1cc(Cl)ccc1O 1653611964 SRJSVSKSYLNFML-UHFFFAOYSA-N 426.900 4.195 10 10 IICE COC1CCN(c2ccc(CN3CC[C@H](C(F)(F)F)C4(CCOCC4)C3)cc2)CC1 1653845299 NJTQCJUVWKJHNY-NRFANRHFSA-N 426.523 4.483 10 10 IICE O=C(NCC[C@@H]1CSc2ccccc2O1)N(Cc1ccccc1O)C[C@H]1CCCO1 1673863787 VAIOTVOVCLRMOZ-RTBURBONSA-N 428.554 4.026 10 10 IICE CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)CCC2 1676653740 WFYBTPKKKKCGGD-WOJBJXKFSA-N 429.634 4.093 10 10 IICE CC(C)(C)c1ccc2c(c1)CCN2C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725849 XULRQZYZHATUGZ-UHFFFAOYSA-N 429.511 4.371 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](N3CCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694100711 ZVYQHEVIIVLLIA-QUCCMNQESA-N 428.600 4.110 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1698406377 JSDYQIBZJAJVKT-UZLBHIALSA-N 435.613 4.351 10 10 IICE Cc1ccc(CN(C)c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)cc2)s1 1707488248 ZJQYMYBKNHTJMW-UHFFFAOYSA-N 439.629 4.368 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C1 1709695159 XUIKEPBZLSQHSE-QGZVFWFLSA-N 436.695 4.383 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)O 1726426010 IGCXYDJISCEMCP-UHFFFAOYSA-N 448.571 4.365 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1727053183 XLYXDMGKLBXVRV-FQEVSTJZSA-N 448.615 4.079 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1763291174 RWQNADLGOGVUPO-YJBOKZPZSA-N 445.662 4.403 10 10 IICE CCN(Cc1ccccc1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1765072313 AEURTKNWDFIBDX-UHFFFAOYSA-N 437.598 4.401 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)(C)O)CCO1 1765220140 AKVBZTFNPFHESQ-NRFANRHFSA-N 437.588 4.129 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(Cl)cc4Cl)n(C)n3)CC2)cc1 1862331580 CHCOSFMSWUVVTK-UHFFFAOYSA-N 445.350 4.365 10 10 IICE Cc1cc(C)cc(OCCN2C(=O)C(O)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)c1 1872958176 VHDISEKZUBZQIM-UHFFFAOYSA-N 430.504 4.428 10 10 IICE CC(C)(C(=O)O)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)nc(O)c1 1952461732 ARHXPJKQMGONHN-JOCHJYFZSA-N 448.475 4.183 10 10 IICE COc1ccc(O)c(CNc2ccc(Br)cc2I)c1 2231657339 UKESAGORIQWNGM-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CC(=O)N3CCCc4ccccc43)C2=O)cc1 2296881663 UYASDLSKAHRBJN-UHFFFAOYSA-N 438.574 4.266 10 10 IICE Nc1ccc(OCCOCc2ccc(I)c(Br)c2)cc1 2377625168 PXOGMPJNQLGLFK-UHFFFAOYSA-N 448.098 4.232 10 10 IICE COc1cc(/C=C2/SC(=S)N(C)C2=O)ccc1OCCOCCOc1ccccc1 27531663 DGUQLDRATCQVNF-HMMYKYKNSA-N 445.562 4.001 10 10 IICE O=C(/C(=C/c1ccc(N2CCCCCC2)cc1)c1nc2ccccc2[nH]1)N1CCOCC1 139149853 FPXYNMZKXISJLX-ZBJSNUHESA-N 430.552 4.343 10 10 IICE CC[C@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(C)nn(C)c1C 743694800 MCQYGCBFFWTJRV-IBGZPJMESA-N 435.519 4.058 10 10 IICE CC(C)CC[C@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 743774508 ADQSDCVKPIMJGZ-WNJRYGEDSA-N 440.656 4.033 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(F)c(Br)cc3F)CC2)cc1 753324390 AOMZATSJIDAPCR-UHFFFAOYSA-N 426.261 4.090 10 10 IICE O=C(CCCc1ccc(F)c(F)c1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 755196121 AZABDTXCJSXTAJ-UHFFFAOYSA-N 442.428 4.459 10 10 IICE CCOC(=O)[C@H](Cc1ccccn1)NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 760628322 RIBHKRXCQXNKMC-NRFANRHFSA-N 425.916 4.047 10 10 IICE CC(C)(C)OC1CC(CCNC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 763480350 MGHOOYHHEZEPAD-UHFFFAOYSA-N 442.648 4.002 10 10 IICE CN1CCC[C@@H](CNC(=O)NCc2cccc(Br)c2O)[C@@H]1c1cccs1 765510831 CSCAHYLHMVMUNM-SUMWQHHRSA-N 438.391 4.099 10 10 IICE COc1ccc([C@H](C)N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 769054695 KJMNIUOROVWACV-FQEVSTJZSA-N 436.600 4.130 10 10 IICE Cc1csc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1Br 792610027 QHWBFBIQANUIAF-UHFFFAOYSA-N 448.430 4.281 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCS(=O)(=O)C[C@@H]2C2CCC2)cc1 1130215478 HVMVXMAHURGHMT-JOCHJYFZSA-N 440.569 4.207 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)c(C)n1-c1ccccc1 1132011379 MTQPIRNDJULACX-FQEVSTJZSA-N 435.955 4.459 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(-c4cc(F)c(F)c(F)c4)cc3)cc2)CC1 1132899316 SAXYNIUNTBUWRF-UHFFFAOYSA-N 439.481 4.453 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)c(C)n1-c1ccc(Br)cn1 1141695484 ZFFVUDVQPMERLK-ZBFHGGJFSA-N 433.394 4.244 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1 1142418541 FZJJBKWEPSATIC-CQSZACIVSA-N 432.446 4.491 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC(OCCCOc4ccccc4)C3)c2C)cc1 1148675690 ZXPCBNPRRNUFPX-UHFFFAOYSA-N 434.536 4.413 10 10 IICE COc1ccc(Cn2cc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cn2)cc1 1157175597 KJMZXAUPNUTNMP-UHFFFAOYSA-N 428.492 4.412 10 10 IICE Cc1cccc(CN2CCO[C@@H](CNC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)c1 1171793626 MQWGCXUDAUSQST-DEOSSOPVSA-N 435.543 4.172 10 10 IICE COC(=O)c1ccc2c(c1)N(C(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)CCC2 1176534325 SLNFRKJMDUCXAD-UHFFFAOYSA-N 430.504 4.215 10 10 IICE CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)C1=O 1187965367 WWUOLHUUVRKMLP-VWLOTQADSA-N 448.498 4.058 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](c3ccccn3)c3ccccc3OC)C2)cc1 1225526591 QAHYXGKXMVZRLF-CLOONOSVSA-N 446.551 4.014 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(CNC(=O)OC(C)(C)C)cc3)CC2)cc1 1253443371 UVGFTWWZRKVDLM-UHFFFAOYSA-N 439.556 4.072 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCc2c(NC(=O)OC(C)(C)C)cnn2C)cc1F 1293225515 XADCKKNEJGDNDK-UHFFFAOYSA-N 447.555 4.001 10 10 IICE COc1cc(CN2CC[C@@H](NC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)cc(OC)c1 1294644717 FHMPXGHMCYMYHH-JOCHJYFZSA-N 447.579 4.424 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCO[C@@H](C(C)(C)C)C2)cc1F 1298056525 QYPATNKCCRPQOJ-NHCUHLMSSA-N 445.583 4.024 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C1 1302729178 AWBWWCXHJGPFCS-FQEVSTJZSA-N 436.579 4.390 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1306274821 KNHWEJDRMCOHGS-YJBOKZPZSA-N 445.662 4.403 10 10 IICE CC[C@@H](Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1360091515 VVQUTTSZFKNFMV-OAQYLSRUSA-N 433.955 4.095 10 10 IICE CC(C)N(Cc1ccco1)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1360119501 CWDRJUKCVSGPPJ-MRXNPFEDSA-N 433.603 4.429 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)[C@@H](C)c1ccco1 1361098093 NTUILQWZZMWVKE-IBGZPJMESA-N 430.556 4.477 10 10 IICE CCc1cc(C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c2c(CC(C)(C)C)noc2n1 1437581336 STEHZDVMNOBFNY-KRWDZBQOSA-N 436.556 4.391 10 10 IICE CC(C)Oc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1[N+](=O)[O-] 1457093821 HSRDWCNASXJBHY-MRXNPFEDSA-N 449.454 4.382 10 10 IICE C[C@@H](NC(=O)c1cc(Br)nc(Br)c1)c1ccc(N(C)C)cc1 1459178485 MOXOEMSACOJEBP-SNVBAGLBSA-N 427.140 4.164 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccccc1OCCF 1460298537 PKYADEPFJUXOBQ-AQTBWJFISA-N 448.516 4.404 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H]2CC(=O)N(c3ccccc3F)C2)c1 1460434917 VXVNJBCUJLPCEV-MRXNPFEDSA-N 425.891 4.422 10 10 IICE Cc1c(Br)cc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c(=O)n1C 1464535261 JDSBXUXZTRHXRF-UHFFFAOYSA-N 446.389 4.155 10 10 IICE CCCN1CC[C@@H](Cn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)C1 1514875613 PZLDUAWYSIKXHD-HSZRJFAPSA-N 438.664 4.445 10 10 IICE COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)CO2 1524245222 KLAUHZVFVJNQIG-APWZRJJASA-N 428.960 4.452 10 10 IICE CC[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)[C@H](CC)CO1 1531531946 GZGXILYCWWIEDI-FNBYNPPRSA-N 438.640 4.146 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(NC(=O)c3cccs3)c2)N(C)C)cc1 1537482086 AXKQBEOCEQXYHQ-OAQYLSRUSA-N 436.581 4.099 10 10 IICE CCc1c(C(=O)N(C)CCN(C)c2ccc(OC)cc2)cnn1-c1cccc(Cl)c1 1538160261 LVXABHFKWORZMK-UHFFFAOYSA-N 426.948 4.305 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@H](C)c3ccc(F)c(Br)c3)C2)cc1 1538745525 FCRDAXAIHULCJD-GOEBONIOSA-N 435.337 4.486 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@@]2(F)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1544267347 DSQIYLAHBNYHNA-STWLZBDKSA-N 441.547 4.320 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCOC3(CCCC3)C2)NC(=O)OC(C)(C)C)cc1 1544267800 IIDINVWWJRTRAO-TZIWHRDSSA-N 445.604 4.174 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3Cc3c(C)coc3C)CC2)cc1F 1554961135 XTKJXRXMJZVGGK-UHFFFAOYSA-N 441.551 4.209 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2C[C@@]3(CCN(C(=O)OC(C)(C)C)C3)CO2)C2CC2)cc1 1559492461 QFQKEJODABXVOO-WIOPSUGQSA-N 429.605 4.133 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1cc(Br)cc(F)c1F 1559607764 WTIPXUUVCSGVQB-UHFFFAOYSA-N 434.664 4.262 10 10 IICE O=C(NC1CCCCC1)OC[C@@H]1CCCCN1C(=O)c1cc2cc(O)c(O)cc2s1 1570019020 GHGRYBGYGPQXAF-INIZCTEOSA-N 432.542 4.366 10 10 IICE COc1cccc(Oc2ccc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)nc2)c1 1597090265 ULANRBLMUNICGB-JOCHJYFZSA-N 434.492 4.410 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3C(=O)Nc4ccc(F)cc43)cc2Cl)C1 1617901180 PZNUBVGIXIDCTE-KDOFPFPSSA-N 429.923 4.458 10 10 IICE Cc1ccc(C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)cc1-n1c(C)cc(C=O)c1C 1624986905 NZDBOKVWFUZMAM-UHFFFAOYSA-N 443.425 4.001 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](c2ccccc2)c2cnn(C)c2)cc1 1625045025 WBQMGPFAMFGKAU-SANMLTNESA-N 426.520 4.088 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1Cc2ccccc2N(C(=O)C(F)(F)F)C1 1632317132 ZEJVFIUZKNBGIP-MRXNPFEDSA-N 447.482 4.406 10 10 IICE COC(=O)CC[C@@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1633716682 IJGDDTFZVDSXKL-INIZCTEOSA-N 448.361 4.057 10 10 IICE O[C@H](COc1cc(F)cc(Br)c1)CN1CCCc2cc(OC(F)F)ccc21 1644807028 ZHYXUASUPICWBL-HNNXBMFYSA-N 446.263 4.382 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cnn(Cc2ccccc2)c1Br 1645443915 YSUJLVPQRIUBCG-UHFFFAOYSA-N 436.309 4.483 10 10 IICE COC(=O)c1cnc(CCNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)s1 1648160979 QBFZFUPLHJUEOT-UHFFFAOYSA-N 425.554 4.433 10 10 IICE NS(=O)(=O)c1cc(CSC2=NC(=O)/C(=C\c3csc4ccccc34)S2)co1 1656597618 WYBGZVMZNDPDNW-MKMNVTDBSA-N 436.561 4.045 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCC2(c3ccc(F)cc3F)CCCC2)N(C)C)cc1 1681588523 WMYPOUVQRMUOAV-QHCPKHFHSA-N 444.570 4.445 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCN(CC(F)(F)F)CC3)cc2Cl)C1 1682023082 ACXCRQAQTOCSHD-MRXNPFEDSA-N 446.945 4.356 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCCn3cc(Br)cn3)c2C)c1 1683020610 ALBDAZILPXPFTI-UHFFFAOYSA-N 444.377 4.251 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@H]1CN(c2ccc(Cl)cc2)CCO1 1683875410 XJPPXUCARGSFQY-INIZCTEOSA-N 444.746 4.057 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)C[C@@H]1CC=CCC1 1693006371 XKFMECMUOBCUBM-OAQYLSRUSA-N 430.600 4.479 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS(=O)CC1 1695171811 GNELWBUEXMNLHF-UHFFFAOYSA-N 425.602 4.112 10 10 IICE Cc1cc(-c2nnc(N(C)C3CC3)n2CCC(=O)NC(C)(C)C)c(C)n1-c1ccccc1 1707251161 DDSSKZJMKJILPM-UHFFFAOYSA-N 434.588 4.256 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1CCCCCN1CCCCC1 1711097040 VXYFUMGCGSOAJH-JOCHJYFZSA-N 427.593 4.128 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3Cc3cscc3C)CC2)cc1F 1711866189 RZDDLFNVGRDNGK-UHFFFAOYSA-N 443.592 4.369 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H]2CSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1726984537 RETWBBZROAQTJE-PKOBYXMFSA-N 447.624 4.147 10 10 IICE Cc1nnc(N2CCC(OC3CCC(C)CC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1751909680 KSGXAEKMEFWRAX-UHFFFAOYSA-N 429.584 4.404 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1nccs1 1761844278 WCDBUVDPOHQUCK-KRWDZBQOSA-N 426.590 4.022 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCC[C@@H]1CC 1764083325 CVYXVNFRIWIEQG-ZWKOTPCHSA-N 427.593 4.365 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1766514527 QITHXUZXXBVUIP-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCOCc1nnc(N2CCSC[C@@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1767982674 PLFNXIJQORAACC-IBGZPJMESA-N 429.634 4.041 10 10 IICE O=c1cc(CNc2ccc(Nc3ccccc3)cc2)n(C[C@@H]2CCCO2)cc1OCCCO 1871263487 DHJIHCZYBABJAS-DEOSSOPVSA-N 449.551 4.144 10 10 IICE [N-]=[N+]=NCCN[C@@H](C(N)=O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1 2071354759 LCIAOMDVLMVQRU-HSZRJFAPSA-N 431.496 4.271 10 10 IICE CCCN(Cc1ccc(N)cc1)c1ncc(I)cc1Br 2189909766 YBUUFGXPEMUWIU-UHFFFAOYSA-N 446.130 4.448 10 10 IICE CC[C@H]1[C@H](NCc2c(Br)ccc(OC)c2O)CCN1C(=O)OC(C)(C)C 2227747972 HZUCBALKDQHDRB-CABCVRRESA-N 429.355 4.041 10 10 IICE CCOc1cc(C=C2C(=N)N3N=C(c4ccccc4Cl)SC3=NC2=O)ccc1O 2293199826 LXPKSCNVLCYNIF-UHFFFAOYSA-N 426.885 4.112 10 10 IICE CCOc1cc(C=C2C(=N)N3C(SCc4ccccc4)=NSC3=NC2=O)ccc1O 2293532013 WOHIECLTMZBJRI-UHFFFAOYSA-N 438.534 4.301 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)C1=Cc1ccc(Br)cc1 2294034559 DCPRCMVYYLHPTP-UHFFFAOYSA-N 428.282 4.335 10 10 IICE CCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3Cl)C2=O)cc1OC 2296882338 POLLVMZFQDHLQU-UHFFFAOYSA-N 448.953 4.294 10 10 IICE Cn1cccc1C=C1SC(=S)N(NC(=O)c2ccc(OCc3ccccc3)cc2)C1=O 2297555011 ZQZCNQIXXFGHPP-UHFFFAOYSA-N 449.557 4.150 10 10 IICE CC[C@H](C)N1C(=O)C(=Cc2cc3cc(C)ccc3nc2N2CCOCC2)SC1=S 2314647600 FCWKYZIWHVLXCT-HNNXBMFYSA-N 427.595 4.380 10 10 IICE CCc1ccc(N2C(=O)C(=Cc3ccc(OCC(=O)O)c(OC)c3)SC2=S)cc1 2314933123 TYIWOAUGRFIKCA-UHFFFAOYSA-N 429.519 4.127 10 10 IICE NC(=O)c1ccc(N2C(=O)C(=Cc3ccc(Br)cc3F)SC2=S)cc1 2321576589 UBRKRSKEWLNKHD-UHFFFAOYSA-N 437.315 4.093 10 10 IICE Cc1ccc(CNC[C@H]2C[C@@H]3[C@H]2CCN3C(=O)OC(C)(C)C)c(O)c1Br 2352690260 RFELEVNRMAJEKF-OWCLPIDISA-N 425.367 4.198 10 10 IICE CC[C@H](C)N(CC(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2380760594 YUWMSEYFPOSIQL-AWEZNQCLSA-N 443.382 4.457 10 10 IICE CN1CCN(c2cc(N3CCc4ccccc43)c3c4c(onc24)-c2ccccc2C3=O)CC1 9612345 WFXHPGXYMDYRTR-UHFFFAOYSA-N 436.515 4.485 10 10 IICE COc1cc([N+](=O)[O-])cc(CN2CCCn3cccc3[C@@H]2c2cccc([N+](=O)[O-])c2)c1O 36347330 JZUOARFVPGQWJH-NRFANRHFSA-N 438.440 4.014 10 10 IICE COCCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(Cl)cc3)c2C)C(C(=O)OC)=C1C 96822611 UNNSOUOVQGTTRC-DEDYPNTBSA-N 428.916 4.067 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)cc3F)[C@H]2c2ccc(O)c(O)c2)cc1 526549889 CPWFNNRVAZEIRL-NRFANRHFSA-N 425.387 4.442 10 10 IICE CC(C)NC(=O)Nc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 586610355 RLIFTFMDQNMFAO-UHFFFAOYSA-N 427.460 4.244 10 10 IICE Nc1cc([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)cc1F 687755310 ZLFFUJXYVSRZMH-OAQYLSRUSA-N 436.439 4.168 10 10 IICE CC1(CNCc2cc(Br)cc(F)c2O)CCN(C(=O)OC(C)(C)C)CC1 715812282 JRGBSXPCXKYPRE-UHFFFAOYSA-N 431.346 4.421 10 10 IICE C[C@H](NC[C@H](CO)c1ccccc1)c1cc(Br)cc(Br)c1O 756636915 XSQJNGXOIWNPEF-WCQYABFASA-N 429.152 4.344 10 10 IICE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1[C@H]1CCCc2cn(C3CCCC3)nc21 762327770 PRZXFDZTXLNAKZ-SFHVURJKSA-N 428.920 4.199 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 764754876 BSBNGLOLYOTZPC-QHCPKHFHSA-N 437.588 4.054 10 10 IICE Cc1ccc(C(=O)N(C)C)cc1OC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 766408102 QMXGHNQLEIAPFD-UHFFFAOYSA-N 433.552 4.024 10 10 IICE Cc1ccc(CN[C@H](C)c2ccc(N3CCOCC3)c(F)c2)c(OC[C@H]2CCOC2)c1 766557801 SFWHUWJARKWWRS-UXHICEINSA-N 428.548 4.237 10 10 IICE CCN(C)C(=O)c1cccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 766684870 ITDWPKNFTCOAFY-UHFFFAOYSA-N 433.552 4.105 10 10 IICE Cc1cc([C@@H](CC(=O)NCc2ccc(N(C)C)cc2)NC(=O)OC(C)(C)C)cc(Cl)n1 788137483 XIQNDWFJSIBAKU-LJQANCHMSA-N 446.979 4.382 10 10 IICE CCN1CCN(c2ccc(CNCc3ccc4c(c3)CCN4Cc3ccccc3)cn2)CC1 796267812 ZSPSVRIYZRHVSX-UHFFFAOYSA-N 441.623 4.076 10 10 IICE CC(=O)Nc1ccc(-c2csc(NS(=O)(=O)c3cc(C)sc3C)n2)c(F)c1 798156430 IYGCHBOWIHWEGG-UHFFFAOYSA-N 425.532 4.387 10 10 IICE COC(=O)c1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)s1 1129717801 WOTDNRQXKXPHNQ-UHFFFAOYSA-N 425.554 4.203 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)Nc2ccccc2)NC(=O)OC(C)(C)C)cc1 1136904799 ZMZUQFCTQOTLPE-NRFANRHFSA-N 440.588 4.325 10 10 IICE Cc1cc(Cn2nnc(C(=O)N(Cc3ccccc3O)[C@H](C)c3ccccc3)c2C)no1 1137816769 QWYYHUVWGQKIHF-QGZVFWFLSA-N 431.496 4.040 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCCN(c3ccccc3F)CC2)cc1 1140147152 PEUGTAQXOISXEA-UHFFFAOYSA-N 433.527 4.327 10 10 IICE CC(C)(C)OC(=O)N[C@H](Cc1ccc2cc[nH]c2c1)C(=O)NCc1cc(Cl)ccc1O 1165508034 KNLMITTUJSSVMI-LJQANCHMSA-N 443.931 4.279 10 10 IICE COc1cc(N2CCC[C@H]([C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1186469726 FQZBGMXQJFSTOU-JKSUJKDBSA-N 435.521 4.085 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)c2C)c1 1254072447 BCKSQYGDZSDAMO-UHFFFAOYSA-N 447.539 4.343 10 10 IICE Cc1cc(C(=O)NCC(=O)Nc2cccc(F)c2)c(C)n1-c1cccc(Br)c1 1292423565 ZQWDOANKPRNRJR-UHFFFAOYSA-N 444.304 4.364 10 10 IICE CCOC[C@H]1CCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1297416823 YCIUHXLMQIRJKU-GMAHTHKFSA-N 441.620 4.277 10 10 IICE Cc1cc(CC(C)(C)NCC(=O)NCc2ccc(N(C)C)cc2)ccc1Br 1307811457 FMNHGKFTPMXSOE-UHFFFAOYSA-N 432.406 4.051 10 10 IICE Cc1ccc(C2(NCC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)CCC2)cc1 1307897674 RVPFSXNKDYLDGX-BGYRXZFFSA-N 439.575 4.033 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H]1/C=C\c1ccccc1 1312833195 GJYYIMHOOMEFFV-ZTBDEIDFSA-N 427.495 4.189 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 1435285204 CINUHLMZVORZNU-MRXNPFEDSA-N 425.529 4.378 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccnn1CCc1ccccc1 1435332277 JZUUQXPUFSLIDZ-LJQANCHMSA-N 440.494 4.126 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](c2c(F)cccc2F)N(C)C)CCCC1 1444269284 XSLPRHLVBMOFID-HSZRJFAPSA-N 441.522 4.226 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@H](C(C)(C)C)c4ccccc43)CC2)cc1 1448666674 DXWJXQJNBAJXPA-ZVQQDINOSA-N 447.579 4.077 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1449406667 HMIZNQTUXMGKOW-JPYJTQIMSA-N 432.520 4.057 10 10 IICE COc1cc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)cc(OC)c1OCc1ccccc1 1453973312 PFNFOLAJRPPRHA-PKNBQFBNSA-N 449.503 4.066 10 10 IICE CCOC(=O)CN(CC(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1)Cc1ccccc1O 1460281454 YVXOSMPZAKGZND-NRFANRHFSA-N 444.547 4.190 10 10 IICE COCCN(C(=O)OC(C)(C)C)C1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)CC1 1460334833 HHGKNTFREJQNPU-UHFFFAOYSA-N 440.968 4.096 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1nc(CNC(=O)OC(C)(C)C)sc1C 1464507386 QNMLVUHZEBUQAE-UHFFFAOYSA-N 432.590 4.205 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)[C@@H]1SC 1478528352 NNFVNCYSZXXUFW-JRJVTICQSA-N 426.026 4.285 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCOC(C)(C)C 1495753089 OXGOFWJAAMJECM-QGZVFWFLSA-N 433.572 4.081 10 10 IICE CCNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=CCC1 1502370879 UNVMVFZOODUGRO-UHFFFAOYSA-N 446.599 4.281 10 10 IICE COC1(Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)CCCC1 1504060874 WNXSEDVUHCVILZ-UHFFFAOYSA-N 441.620 4.008 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1C[C@H](C)S[C@H](C)C1 1510675550 SPSOKKGNEYCQQX-KDURUIRLSA-N 436.629 4.017 10 10 IICE COCCCN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCC(C)CC2)cc1 1519048667 DDUMXLBYTWFFOS-UHFFFAOYSA-N 448.615 4.406 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4ccc(F)cc4)CCCC3)cc2F)CC1 1521009395 IOBYEEXIKHGBMW-UHFFFAOYSA-N 427.539 4.235 10 10 IICE C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1537839445 MYLYVXVMKXDKSX-OAHLLOKOSA-N 448.394 4.190 10 10 IICE CC(C)C(C)(C)Cn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 1541291571 BLLZCOKFARHPDO-UHFFFAOYSA-N 441.601 4.294 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3c(C)nn(C)c3Sc3ccccc3)CC2)cc1 1545931368 GLQWBILSJUUBNV-UHFFFAOYSA-N 436.581 4.241 10 10 IICE CC[C@]1(C)CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CCO1 1546097454 KQSZPTOUQWZGOW-XMMPIXPASA-N 439.629 4.358 10 10 IICE CCOC(=O)[C@@H](CCOC(C)(C)C)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1546271532 GIFCSSJGAREWIF-OAQYLSRUSA-N 442.556 4.082 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CCC3)c3ccccc3)cc2F)C[C@@H](C)O1 1559619785 ZOYGHQJFUBOVAY-BGYRXZFFSA-N 439.575 4.362 10 10 IICE C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1CC(=O)NCc1ccc(N(C)C)cc1 1560061677 PRGVVLGVGCQCAF-VQIMIIECSA-N 430.390 4.009 10 10 IICE COC[C@H](CNC(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 1564777541 NFUPNKSNTPBPGE-IBGZPJMESA-N 431.964 4.001 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(C)(C)C 1566686228 KNYKIXOAJJUUQQ-AZUAARDMSA-N 434.577 4.229 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(C(=O)N2CCOCC2)cc1 1566845755 IABJUTPLCMXKQQ-FQEVSTJZSA-N 444.531 4.268 10 10 IICE CCOC(=O)C[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 1584035373 MSKZHRUNVBUEPY-QFIPXVFZSA-N 439.943 4.496 10 10 IICE Cc1cc(C(=O)N2CCOc3ncccc3C2)c(C)n1-c1ccccc1Br 1611113377 YHCGZOCPYJQAEI-UHFFFAOYSA-N 426.314 4.286 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)CCC1CCOCC1 1611962852 CXZSTERBKBEJIQ-UHFFFAOYSA-N 434.588 4.016 10 10 IICE CCCOc1ncccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1615022400 DLTOQEWFBHDICA-NRFANRHFSA-N 437.544 4.094 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1Cc1ccc(OC(C)(C)C)nc1 1617940643 QBXRWZDOEMORPF-UHFFFAOYSA-N 432.528 4.236 10 10 IICE C[C@@H](Cc1cccc(F)c1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1618431076 JDBFYSRPXQFQOS-INIZCTEOSA-N 430.479 4.103 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(CC3CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1620755404 GMNDZOBEUFFTIN-LJQANCHMSA-N 445.405 4.246 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CC(=O)N(c2ccc(C)c(C)c2)C1 1629968262 CRRSAHNVUHEIHJ-KRWDZBQOSA-N 445.357 4.173 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 1631157147 MZTIBVSYNGJKNQ-VWLOTQADSA-N 436.939 4.228 10 10 IICE CCOC(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n[nH]1 1632129608 SATQBAYWUIRHCJ-UHFFFAOYSA-N 431.290 4.009 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1ccc(OC)c(O)c1 1633328237 ZESCEAPWLGBJLA-QHCPKHFHSA-N 436.508 4.069 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)[C@H](OC)c3ccccc3Cl)CC2)cc1F 1634425035 KZMBTZDACSHXSN-BTYIYWSLSA-N 435.927 4.096 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1cccc(Cl)c1 1636130912 IOIXMEGCJBAUDU-HUUCEWRRSA-N 440.931 4.241 10 10 IICE Cc1cc(CC(=O)N(C)C[C@H](O)COCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1638544743 NIKQKYDTIGAAHW-DEOSSOPVSA-N 440.971 4.326 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)COCc2ccccc2)c(C)n1-c1cccc(Cl)c1 1638544968 VJICHNCVIQNTLB-JOCHJYFZSA-N 426.944 4.397 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@H](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1639814274 RACKZUJDPWATLA-VQTJNVASSA-N 447.620 4.263 10 10 IICE Cc1cc(C(=O)Nc2cc([C@H]3CCCOC3)[nH]n2)c(C)n1-c1ccc(Br)cn1 1639924955 BHAMGNMMQXWOSS-AWEZNQCLSA-N 444.333 4.121 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)c2ccc(O)cc2)c(C)n1-c1ccc(Br)cc1 1640103605 BSSMKNBBTSZFGO-QFIPXVFZSA-N 443.341 4.200 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccc(OCC(F)(F)F)nn2)c1 1641192356 XFSBPSHJKPRKII-UHFFFAOYSA-N 438.837 4.409 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)cc1 1654114115 FOSOQDNPNNFCID-MHZLTWQESA-N 443.591 4.238 10 10 IICE COc1ccc(N(CCC(C)C)CC(=O)Nc2cc(C)nn2-c2nc(C)cc(C)n2)cc1 1654362047 GERYUAIYPGETOI-UHFFFAOYSA-N 436.560 4.087 10 10 IICE Cn1ccnc1[C@H](Cc1ccccc1)NC(=O)N(Cc1ccco1)Cc1ccccc1O 1683570416 QFEHISFIFCIRDJ-QFIPXVFZSA-N 430.508 4.415 10 10 IICE C=CCCCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1705807147 USNIVGMOBUMBSU-QHCPKHFHSA-N 439.604 4.349 10 10 IICE CO[C@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC[C@H]1C 1712070150 BWKBOQYSHLEXKM-PBHICJAKSA-N 433.603 4.347 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728936679 YKXYPPIZAJKGIP-VXKWHMMOSA-N 425.621 4.293 10 10 IICE CC(C)CN(c1nnc(C2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1741545405 DQOWJLCUYHMWEG-UHFFFAOYSA-N 425.621 4.283 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC(c3ccnn3C)CC2)nnc1C(C)(C)C 1742141198 AYWLLCRKJBZTPN-UHFFFAOYSA-N 435.620 4.116 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CCCSC1 1747030033 OEXSJXLFOWFICB-HXUWFJFHSA-N 429.634 4.194 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752135355 NQIXWPVMLSGTRE-FPOVZHCZSA-N 441.620 4.025 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1761052234 RVRAKLAHHSDJSC-FQEVSTJZSA-N 429.584 4.298 10 10 IICE CCCN(CCC)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1764349876 LNBCVDWWNIBXLX-UHFFFAOYSA-N 435.620 4.197 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC[C@@H](C)C1 1767766291 DNPNAMLOTYJVPL-WIYYLYMNSA-N 448.615 4.361 10 10 IICE CN(CCC1CC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1768867523 QPURQJRULBPUAG-UHFFFAOYSA-N 439.648 4.360 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@H]3CCCSC3)CC2)cc1F 1770259720 WWEQYIIIMHIDLP-QGZVFWFLSA-N 433.597 4.019 10 10 IICE Cc1ccc(O)c([C@H](c2sc3nc(C4CCCCC4)nn3c2O)N(C)CCC(=O)O)c1 1857927672 KBMNVHOQSRNRDM-GOSISDBHSA-N 444.557 4.054 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C\c2cc(OC)c(O)c([N+](=O)[O-])c2)SC1=S 1860083949 HTSZUZOHWPBTBZ-MHWRWJLKSA-N 432.479 4.114 10 10 IICE C[C@@]1(NCc2cccc(Br)c2O)CCCN(C(=O)OCc2ccccc2)C1 1940887326 KMVAXLGQSOYLEW-OAQYLSRUSA-N 433.346 4.436 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@H]1c1cc(Br)cc(F)c1O 1952850194 CSUJEDLWBQBODS-XJKSGUPXSA-N 438.249 4.078 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C(C)C)c(CO)c1I 2079958757 RDLYVQDDGVYJBV-HNNXBMFYSA-N 428.314 4.425 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C3CCC3)c(C(=O)O)c2I)cc1C 2079983711 FXTJHARWJAOCTD-NSHDSACASA-N 440.281 4.385 10 10 IICE CN(C)c1ccc([C@@H](N)c2cc(I)ccc2Br)cc1 2106804468 BTSGKFULSVPATQ-OAHLLOKOSA-N 431.115 4.168 10 10 IICE CCN1C(=O)C(=Cc2cc([N+](=O)[O-])ccc2OCCOc2ccccc2)SC1=S 2293245299 YRGPCTXCPBZJFZ-UHFFFAOYSA-N 430.507 4.274 10 10 IICE CC1=NN(c2ccc(Br)cc2C)C(=O)C1=CNc1cccc2nsnc12 2297316904 LYUVNJYEEIVOCT-UHFFFAOYSA-N 428.315 4.481 10 10 IICE O=C(CN1C(=O)C(=Cc2cccc(O)c2)SC1=S)Nc1ccccc1C(F)(F)F 2314828233 RPFUIWYLPPIPOZ-UHFFFAOYSA-N 438.452 4.251 10 10 IICE Nc1ccc(CC[C@@H](O)Cc2ccc(I)c(Br)c2)cc1 2377263713 MVNDALCAJYNFPD-CQSZACIVSA-N 446.126 4.172 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cn(CC(C)C)c(=O)c4ccccc34)CC2)cc1 8595668 ZJQPKMSELIJEJW-UHFFFAOYSA-N 434.540 4.020 10 10 IICE COc1cc(N2CCN(C(=O)Nc3c(C)cccc3C(C)C)CC2)cc(OC)c1OC 33871842 JPWQJNXKQKDGAU-UHFFFAOYSA-N 427.545 4.498 10 10 IICE O=c1cc(CN(Cc2ccccc2O)C[C@H]2CCCO2)c2ccc(Br)cc2o1 96971044 KJLYUTQZTPJVRK-GOSISDBHSA-N 444.325 4.442 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCCN(c4cccc(OC)c4)C3)ccc21 303662990 HVLNHJBGUPTHRE-NRFANRHFSA-N 435.568 4.312 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](NCc1cc(Br)cc(F)c1O)C2 715736014 DGANROPJQOVIIQ-XZJROXQQSA-N 429.330 4.171 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H]3C(=O)Nc3ccc(OC)cc3)ccc21 728464931 BFUWKIJPJPNUNK-XMMPIXPASA-N 449.551 4.156 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ncoc1-c1ccccc1Cl 743314535 OSNWGEDOXZRJSM-UHFFFAOYSA-N 429.879 4.025 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnc2c(cnn2CC(C)C)c1 743808971 IMEJHWZOHMCAGR-UHFFFAOYSA-N 431.334 4.218 10 10 IICE CCN1CCN(c2ccc(CN[C@H](c3ccc(Cl)cc3)c3ccn(C)n3)cc2F)CC1 756551402 ALOBDCQEERPMMX-XMMPIXPASA-N 441.982 4.234 10 10 IICE CN(CC1(c2ccccc2)CC1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 780584044 XNNHSPPKYNOLCL-UHFFFAOYSA-N 432.612 4.092 10 10 IICE CC(C)Cn1c([C@H]2Cc3ccccc3O2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802662374 OMWXIDZCIHZSMH-XMMPIXPASA-N 447.583 4.083 10 10 IICE Oc1ccc(Br)cc1CNC[C@@H]1CN(Cc2ccccc2)CC12CCOCC2 815149374 KTFLHWLGFQYRLL-HXUWFJFHSA-N 445.401 4.173 10 10 IICE CC(=O)Nc1ccccc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1131161204 ZUGFZAWDQSWMPY-SFQUDFHCSA-N 445.591 4.327 10 10 IICE CCCc1nc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)co1 1134542150 JUJUBLLJHXLUQE-UHFFFAOYSA-N 426.274 4.352 10 10 IICE CC(C)C(=O)c1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1144006302 MBVKDXLTGMRCLS-UHFFFAOYSA-N 444.534 4.346 10 10 IICE CCc1ccc(O)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1147508023 UBVANQIYDBWECX-FQEVSTJZSA-N 427.545 4.016 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1F 1150239393 GLVYVOJRYDXHQJ-XMSQKQJNSA-N 447.348 4.223 10 10 IICE Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NCc1ccc(O)cc1O 1162278756 LHCIUYCWNDAYPD-UHFFFAOYSA-N 434.876 4.443 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2sccc2-n2c(C)ccc2C)C[C@H]1c1ccc(F)cc1F 1162488346 QJWYCEQVDOJEBP-ZWKOTPCHSA-N 444.503 4.463 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC(Cc3cccc(C(F)(F)F)c3)C2)N(C)C)cc1 1251501191 NZNIDUKRLBAKRF-JOCHJYFZSA-N 448.533 4.258 10 10 IICE Cn1ccnc1[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)c1ccc(F)cc1F 1256217323 KUVCCFSTGRGGJQ-INIZCTEOSA-N 441.265 4.300 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccn3cc(C(F)(F)F)nc3c2)cc1 1292382119 MYYIPUNJPVSYNC-IBGZPJMESA-N 446.473 4.241 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCN(C(C)=O)C1 1294418939 MQLIKRYIEUFBDD-JOCHJYFZSA-N 448.615 4.457 10 10 IICE CO[C@@H](Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1299705837 WAUVQYQXHYWJHD-IBGZPJMESA-N 429.590 4.037 10 10 IICE C[C@@](CO)(NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)c1cccc([N+](=O)[O-])c1 1307999609 LBQQAMPVDSBAKL-QHCPKHFHSA-N 433.468 4.446 10 10 IICE Cc1cc(C(=O)Cc2nc(O)c3ncccc3n2)c(C)n1-c1ccc(Br)cc1 1343634576 MDWVZIOGBWKQJO-UHFFFAOYSA-N 437.297 4.326 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(OCc4ccccc4)ccn3)cc2F)C[C@H](C)O1 1354658483 PCHHKCDEUHTTCE-OALUTQOASA-N 449.526 4.343 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 1357723390 UJQZJKJALBVWTK-VCRXTVNUSA-N 446.544 4.476 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C/c1cnccc1C)CCC2 1358157034 YCNZTOQHJMZQFJ-CMDGGOBGSA-N 432.476 4.341 10 10 IICE Cc1cc(CCNC(=O)CCCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccccc1 1438179005 RIPMNTFJEHBBMU-UHFFFAOYSA-N 443.547 4.219 10 10 IICE CC1(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC(F)(F)C1 1438939969 PFFXOVAFZAOAAH-JYRVWZFOSA-N 430.567 4.281 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(CN3CCOC3=O)cc2)cc1 1441919269 NSAHSNFTBTYZPB-UHFFFAOYSA-N 431.492 4.040 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4ccccc4F)o3)cc2F)CC1 1456126848 GSBVWSUUUCCUSX-UHFFFAOYSA-N 425.479 4.297 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2cc(Cl)ccn2)cc1F 1503393589 NHOWLXBFNPTNNW-UHFFFAOYSA-N 439.926 4.211 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1511703838 QGKLBKPSQCRMJD-UHFFFAOYSA-N 435.620 4.189 10 10 IICE CC[C@@H]1[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1525593832 MYNSMEMDIMMRGC-TZIWHRDSSA-N 448.519 4.436 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(S(C)(=O)=O)c(Cl)cc1Cl 1525762378 OPWZXSYBMVTHLV-CYBMUJFWSA-N 443.396 4.132 10 10 IICE COc1ccc(F)cc1CN1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CC1 1540421705 OWRFYKBDNIKQGR-UHFFFAOYSA-N 449.526 4.012 10 10 IICE Cc1cc(C(=O)NCCOc2cccc(F)c2)c(C)n1-c1ccc(Br)cn1 1543597575 CUXUOSTYXQLZDY-UHFFFAOYSA-N 432.293 4.200 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1cnc(C)s1 1545503501 BPWAMEPHYJIMHD-QGZVFWFLSA-N 440.617 4.330 10 10 IICE CCCN1CCC(N(C)c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1547185016 MNNMUYPLRSOHOV-UHFFFAOYSA-N 444.643 4.431 10 10 IICE CC[C@H](c1ccccc1OC)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559879501 KYTLGODJPYACSJ-JOCHJYFZSA-N 442.515 4.492 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(Cc4cc(F)ccc4F)CC3)C2)cc1 1565055643 HTVFGEOUGGTXQW-HXUWFJFHSA-N 429.511 4.216 10 10 IICE CC1CCN(c2ccc(CNC(=O)Cc3ccccc3I)cc2)CC1 1565663072 LJSBRQYAHZJGNN-UHFFFAOYSA-N 448.348 4.386 10 10 IICE COc1ccc(OC)c([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1566331671 MYBJNJPDPFZZEG-NRFANRHFSA-N 428.916 4.228 10 10 IICE COC(=O)[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1cc(C)cc(C)c1 1567906065 DVAUAYUUNBZLDQ-DEOSSOPVSA-N 432.520 4.476 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc2n(n1)C[C@@H](C)N(C(=O)OC(C)(C)C)C2 1568137612 YZMDSGPTIPJNOG-QGZVFWFLSA-N 442.560 4.170 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](NC(=O)c1cccc(O)c1O)CC(C)(C)O2 1569885365 QIYOSAGJWDOAEL-INIZCTEOSA-N 428.485 4.477 10 10 IICE CCS(=O)(=O)Cc1ccc(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cc1 1585182682 JPQZZBYPZLYUSP-UHFFFAOYSA-N 428.554 4.092 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)cc1F 1616924174 GXRXMAAOGHUQLQ-UHFFFAOYSA-N 427.501 4.454 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2ccc(Cl)nc2)C1 1624671159 SYOJLLIKTFIXOL-CCCPALQASA-N 427.932 4.478 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)c1 1627920490 BBFZFVOGIMMBDQ-UHFFFAOYSA-N 439.556 4.378 10 10 IICE CCCN(CC)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 1630551065 YXQMKLYQKDJAAS-HDICACEKSA-N 428.552 4.001 10 10 IICE COc1ccc(N2C[C@H](NC(=O)c3cc(C)n(-c4cccc(Cl)c4)c3C)CC2=O)cc1 1632492989 GWUCCJKRNCOKNG-GOSISDBHSA-N 437.927 4.291 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N(C)CCN3CCN(Cc4ccccc4)CC3)c2C)c1 1635182959 HNAMNMZXLSPINF-UHFFFAOYSA-N 444.623 4.292 10 10 IICE O=C(Nc1ccc(O)c(C(=O)NCc2c(O)ccc3ccccc23)c1)OCC(F)(F)F 1635964909 DUWICJXQJRGOCT-UHFFFAOYSA-N 434.370 4.292 10 10 IICE COC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CCOCC1 1640373797 FNSAROVFEKAMDN-HXUWFJFHSA-N 435.362 4.028 10 10 IICE COc1cc(N2CCN(Cc3cc(Br)ccc3C)CC2)cc(OC)c1OC 1642657089 DUADWPYCRNVRCY-UHFFFAOYSA-N 435.362 4.106 10 10 IICE CCC1CCC(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C2CC2)CC1 1652305786 XUJKEGNFCFHZHH-YDPTZXBUSA-N 445.623 4.489 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)Nc2ccccc2C(=O)NC2CC2)cc1 1653680446 YWXWHSZLILIFLY-UHFFFAOYSA-N 443.547 4.275 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCSC[C@@H]3c3ccccc3)C2)cc1 1682188163 ILIWDYBTJAQZJM-AUSIDOKSSA-N 425.598 4.411 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)Cc1cc(F)cc(OC)c1 1686754884 CTRPEIKBMXOFTP-ZDUSSCGKSA-N 439.325 4.465 10 10 IICE Cc1cccc(OC[C@@H](O)CN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C(C)C)c1 1686826442 IHLJBWBYEUEGPU-URXFXBBRSA-N 441.616 4.160 10 10 IICE CCC[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1695156003 POFPMTVVCQDSQA-IRXDYDNUSA-N 437.635 4.164 10 10 IICE C=CCO[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)COC)C1 1705916857 OUXGRKNRDKVVGO-CVDCTZTESA-N 449.599 4.416 10 10 IICE CCOCc1nnc(N2CCS[C@@H](C(C)C)C2)n1CCCSc1nccs1 1710753988 CWRSJTSQLQPQJI-OAHLLOKOSA-N 427.665 4.031 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1746931082 UMNJAZYKBWEBJB-LEWJYISDSA-N 440.567 4.166 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@H]1CCSC1 1747749843 FBMVBGGKNDKTKW-CYBMUJFWSA-N 448.390 4.131 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1752696598 QAUOPSKSZBJCQZ-UYAOXDASSA-N 430.616 4.213 10 10 IICE CC(C)Cc1nnc(N2CCO[C@@H](C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1761042077 MWIWDFVRWPXPDU-JOCHJYFZSA-N 425.621 4.159 10 10 IICE CC[C@@]1(C)CCN(c2nnc(Cn3nc(C)cc3C)n2Cc2ccc(N(C)C)c(F)c2)C1 1764348509 PNBBQPJWCGWJRS-DEOSSOPVSA-N 439.583 4.020 10 10 IICE CCOCCn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1768159088 MJOQHBDZMHVYMA-UHFFFAOYSA-N 425.602 4.204 10 10 IICE CC[C@H](C)N1C(=O)C(NCc2ccccn2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164201 QOIMAXARYCWOHU-KRWDZBQOSA-N 428.536 4.157 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@]1(CN)CC[C@@H]1OCc1ccccc1 2018785599 FAKPVRXSDHLTBM-WIOPSUGQSA-N 425.573 4.224 10 10 IICE COc1ccc(Br)c(CNC[C@@]2(C)CN(Cc3ccccc3)C[C@@H]2C)c1O 2236051174 PETGHGXDWMHSQX-AOMKIAJQSA-N 433.390 4.411 10 10 IICE Cc1ccc(CN[C@H]2CCCN(C(=O)OCc3ccccc3)C2)c(O)c1Br 2307565730 BBKUOOIGSSARRH-SFHVURJKSA-N 433.346 4.354 10 10 IICE Cc1c(Br)ccc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccccc34)C2=O)c1C 2313549196 PPRMUDANVKPMIB-UHFFFAOYSA-N 438.281 4.214 10 10 IICE COC(=O)CC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)NC1CCCCCC1 2313682030 TUHINCUQQKDYHR-UHFFFAOYSA-N 426.542 4.148 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 14472868 WRJUHDOLWODIRD-BXTJHSDWSA-N 433.917 4.325 10 10 IICE CCS(=O)(=O)c1ccccc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 17212612 DTDFMQWUENOHKW-UHFFFAOYSA-N 443.496 4.067 10 10 IICE CCCCCN1C(=O)/C(=C\c2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 33766796 RJVORJUGJLEWAM-GZTJUZNOSA-N 444.626 4.462 10 10 IICE Cc1c(N/C=C2/C(=O)N(c3ccccc3)N=C2c2ccccc2)c(=O)n(-c2ccccc2)n1C 100271287 ZZKBABNHKBTLJY-PTGBLXJZSA-N 449.514 4.231 10 10 IICE CCOc1cc2c(cc1/C=C\C(=O)NC1CCN(c3ccc(OC)cc3)CC1)O[C@H](C)C2 207253367 DPGWCIFGPWUITF-PRCIHIDRSA-N 436.552 4.216 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1Cl)N2)N1CCOCC1 226745250 VPUUIAYDDUFWLK-JLHGSKIFSA-N 430.957 4.187 10 10 IICE CC[C@@H](NCCN1CCN(Cc2ccccc2)CC1)c1cc(Br)ccc1O 390702649 UKEOSIALHFWJJR-OAQYLSRUSA-N 432.406 4.013 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@@H]2c2ccc(O)c(O)c2)c1 526282177 JXYPWSJAJJCVGG-JOCHJYFZSA-N 429.432 4.040 10 10 IICE CN(C)c1ccc(CN(Cn2nc(-c3ccc(F)cc3)ccc2=O)CC(F)(F)F)cc1 728904852 WAWDVBRSFAHXNA-UHFFFAOYSA-N 434.437 4.137 10 10 IICE CCN(C(=O)NCc1ccc(N2CCSCC2)cc1)[C@@H](C)Cc1ccc(OC)cc1 731401220 CSEFZJDKHPIFFS-IBGZPJMESA-N 427.614 4.411 10 10 IICE C/C=C\c1ccc(OCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 742805564 LRBLALASPCGZPH-AJNOYIKESA-N 446.494 4.494 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(c2ccccn2)CC1 754351704 KWLVLMRKIQXMFF-KRWDZBQOSA-N 439.515 4.064 10 10 IICE C[C@@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)ccc1O 757638916 SVMBZVQLSPXKEH-MLGOLLRUSA-N 431.309 4.218 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Br)cc1 770994391 VUFDIJQOOHLELJ-KRWDZBQOSA-N 445.401 4.468 10 10 IICE O=C(N[C@@H]1C[C@@H]1C1CCN(Cc2c(O)ccc3ccncc23)CC1)OCc1ccccc1 793667478 JBTZTANDCKPZLW-ZJSXRUAMSA-N 431.536 4.467 10 10 IICE CC[C@H](C)c1nc(C)c(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(C)n1 1125256475 IIEXGOIPNSAFHH-GVDBMIGSSA-N 442.579 4.219 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3csc(-c4ccccc4C)n3)cc2F)CC1 1125975927 FHDOHWMMDCEPMP-UHFFFAOYSA-N 438.572 4.330 10 10 IICE C[C@H](NC(=O)[C@@H](Cc1ccccc1)N1Cc2ccccc2C1=O)c1ccc(N(C)C)cc1 1128135266 AFKCWODOODEBAY-UQBPGWFLSA-N 427.548 4.197 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)NCc1cc(C)n(-c2ccccc2)c1C)NC(C)=O 1132048394 TWJMAOLUAOELCV-XMMPIXPASA-N 433.552 4.377 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1136442914 JENPOKBYIBFLDD-WFXMLNOXSA-N 433.593 4.030 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)ccc3Cl)CC2)cc1F 1150239878 KBLWOOHXVKCINX-UHFFFAOYSA-N 427.701 4.213 10 10 IICE Cc1cc(CC(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C)n1-c1ccc(Cl)cc1 1151319078 FREORERMWHAJFA-OAQYLSRUSA-N 435.955 4.491 10 10 IICE CC(C)[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1287288822 TYUHISWIJZMZFJ-DLBZAZTESA-N 437.635 4.020 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@@H]1CCCC1(F)F 1288283236 FYVUFAOVABMAAL-QXPQOBGOSA-N 442.528 4.359 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)CCCc3ccc4ccccc4c3)cc2)CC1 1288913353 SHLYZRBJFZJDQU-UHFFFAOYSA-N 429.564 4.181 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)C[C@@H]2CCCCO2)cc1 1295413909 UZPBVVCYQXAICO-QFIPXVFZSA-N 436.604 4.183 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCOC1 1306565550 DSXDHCCTSSCPBA-AVRWGWEMSA-N 437.588 4.129 10 10 IICE CCCN1C[C@H](C(=O)Nc2sc(C)c(-c3ccc(F)cc3)c2C(=O)OCC)CC1=O 1349145530 BBYTYUSZIUBPLC-OAHLLOKOSA-N 432.517 4.236 10 10 IICE CC(C)NC(=O)c1nnc(N(C)[C@H](C)c2ccccc2)n1CCCSc1nccs1 1360161880 IBKUDWNLSWIWLY-MRXNPFEDSA-N 444.630 4.253 10 10 IICE C[C@@H](Oc1ccc(F)cc1)c1nnc(N2CCOCC2)n1CCCSc1nccs1 1360751286 YBHAPIRCMYTPQC-OAHLLOKOSA-N 449.577 4.033 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(CC(=O)NCc3ccc(N4CCCC4)cc3)cc21 1441191152 YNAUPGLZMXUFJY-UHFFFAOYSA-N 435.568 4.443 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3=C(c4ccccc4)SCCO3)cc2F)C[C@@H](C)O1 1441780415 FLAXVWSEUJYAHB-IAGOWNOFSA-N 442.556 4.188 10 10 IICE CC1CCN(c2ccc(CNC(=O)C[C@H]3CSCCN3C(=O)OC(C)(C)C)cc2)CC1 1443666507 RKYCZQVKALQVRT-NRFANRHFSA-N 447.645 4.282 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C[C@@H](O)c2ccco2)c(C)n1-c1ccc(Br)cn1 1445498637 VMEJTOPWVIZWCT-YVEFUNNKSA-N 432.318 4.087 10 10 IICE CCOC(=O)N1CCC([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 1448168548 SQKXOOPMRXDJCQ-QGZVFWFLSA-N 427.545 4.090 10 10 IICE O=C(c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)N1Cc2cccc(O)c2C1 1455036313 GJHJFHNFRMFJBH-UHFFFAOYSA-N 428.897 4.002 10 10 IICE CNC(=O)c1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1C 1464131689 RPDIFFLNVVAMBM-UHFFFAOYSA-N 441.329 4.172 10 10 IICE CCOCCCNC(=O)c1cccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1464270677 GYGCCGIEXZVIEJ-UHFFFAOYSA-N 447.535 4.315 10 10 IICE O=C(NCC1CCN(Cc2ccncc2)CC1)N(Cc1ccco1)Cc1ccccc1O 1470726659 DOPBNBUTVXUOAW-UHFFFAOYSA-N 434.540 4.004 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)N[C@@H](C)c3ccc4ccccc4c3)CC2)c(OC)c1 1473732275 FOLSOUBZXLJKNB-PMACEKPBSA-N 447.579 4.245 10 10 IICE Cc1cc([C@](C)(O)CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c(C)o1 1478527927 JAIZZHVEAUYJCG-IQMFZBJNSA-N 433.980 4.493 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)[C@H]1C 1500312147 INLYRHLGLQGQPW-HXUWFJFHSA-N 434.588 4.210 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)CC2CCOCC2)cc1 1501843872 AFJOUUQUACKRLU-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CC[C@H](F)C1 1509131294 FDCAOIWEFUWDAS-RTWAWAEBSA-N 429.584 4.088 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CCN(c2ccncc2)CC1 1512810440 VOZNELZSFMMVHO-LJQANCHMSA-N 434.588 4.445 10 10 IICE CCC1(CC)CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1513597898 CNKLNCVCSQUGDB-UHFFFAOYSA-N 429.619 4.391 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]3CCC[C@H]32)n1Cc1ccc(N(C)C)c(F)c1 1519302278 GDJLPZULUPCJEP-SLYNCCJLSA-N 445.583 4.024 10 10 IICE COc1cc(N2CCN(C(=O)C[C@H]3CCC[C@H](C(F)(F)F)C3)CC2)cc(OC)c1OC 1521836736 LABNXLUWNKTPLO-HOTGVXAUSA-N 444.494 4.120 10 10 IICE Cc1cc(CC(=O)NCCCn2cc(Br)cn2)c(C)n1-c1ccc(Cl)cc1 1527981924 VWPDJWVXQUDNLC-UHFFFAOYSA-N 449.780 4.456 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C2)cc1 1529706827 IQHFEAYCPQDIIB-RXVVDRJESA-N 447.620 4.213 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ncc(F)cc1Cl 1530163862 WCDVZVGVPWGTQH-AUWJEWJLSA-N 439.896 4.243 10 10 IICE Cc1cc(C2(NC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CCOCC2)on1 1530867331 BJUQBGDNVNTYGT-UHFFFAOYSA-N 427.932 4.409 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCCc3ccc(C(N)=O)nc32)cc1 1531630550 JUOMASZJNBNGRX-UHFFFAOYSA-N 428.496 4.255 10 10 IICE Cc1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)nn1-c1cccc(C(F)(F)F)c1 1532656498 UKRLUUPAMTULPO-UHFFFAOYSA-N 430.430 4.305 10 10 IICE Cc1cnc(Cl)c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1537393379 INVHHLAIZJWLLQ-OQLLNIDSSA-N 435.933 4.413 10 10 IICE CCOC(=O)N[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1540841776 BMFYDBTZZUMRJM-KRWDZBQOSA-N 448.361 4.207 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CCC[C@@H](C(F)F)C1 1542226818 KFGZYORLQALBDG-RTBURBONSA-N 433.547 4.076 10 10 IICE CCOC(=O)[C@H](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)Cc1ccccc1 1542372205 FTDRILXMNYMSFC-NRFANRHFSA-N 432.520 4.058 10 10 IICE CCOc1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)ccc1C 1544519996 QINQTFUUUXFVDQ-UHFFFAOYSA-N 430.416 4.330 10 10 IICE CC[C@H](C)c1nnc(N2CCCO[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1545509613 LBTMJTKQVGVRLR-OALUTQOASA-N 429.634 4.008 10 10 IICE COc1cc(C)c([S@@](C)=O)cc1OC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1557112038 GCXFGRBQLJTBEL-WJOKGBTCSA-N 439.533 4.109 10 10 IICE CC(=O)c1cc(F)cc(CN[C@@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1O 1559751100 YMZONURECFLPME-CTNGQTDRSA-N 436.886 4.367 10 10 IICE Cc1cccn2c(NC(=O)CCCN3C(=O)/C(=C/c4cccs4)SC3=S)cnc12 1586286602 UXWAASXAXIFZFU-PTNGSMBKSA-N 442.591 4.324 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1606711123 KDXJZDFZBYHNFP-OAQYLSRUSA-N 425.621 4.333 10 10 IICE C[C@@H](c1ccco1)N(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)c(F)c1 1611263905 WBRPJZZKYYWIDX-KRWDZBQOSA-N 434.519 4.308 10 10 IICE Cc1cc(-c2nnc(N3CCCC[C@H](C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935295 MOGPRGSFPNHFLC-SFHVURJKSA-N 434.588 4.067 10 10 IICE CCC(C)(C)Cn1c(CN2CCCC2=O)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1613067668 MDDHWAIYIBTMRP-UHFFFAOYSA-N 438.620 4.073 10 10 IICE CC1=C[C@@H]2C[C@H](C)CC[C@@H]2[C@](C)(/C(O)=C2/C(=O)NC(CO)=C2O)[C@@H]1/C=C/C=C/C[C@H](C)O 1615671372 AJDLKWSYDPWRCH-SFOPQYNTSA-N 443.584 4.208 10 10 IICE CCCCN(Cc1ccccc1O)[C@@H](C)C(=O)N1CC(=O)Nc2cc(C(F)(F)F)ccc21 1617538585 FSZQXQNPTQBROL-HNNXBMFYSA-N 449.473 4.387 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)CCNC(=O)Nc1ccc(Br)cc1 1639521872 BPZJMNNSVQVAMR-UHFFFAOYSA-N 448.361 4.495 10 10 IICE Cc1ccc(C(=O)Nc2cccc([C@]3(C)COC(=O)N3)c2)cc1-n1c(C)cc(C=O)c1C 1644585937 UUKIBSGNYOGFJU-VWLOTQADSA-N 431.492 4.422 10 10 IICE Cc1ccccc1[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CC1 1653026502 DDUDTBPHMMFQKO-LJKQEARRSA-N 439.575 4.105 10 10 IICE COC(=O)[C@@H](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)CC1CCCC1 1653439633 BTQQHJBOFGJPMD-GOSISDBHSA-N 426.557 4.014 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2CC(=O)NCc1ccc(CN2CCCC2)cc1 1659084302 PGYBIPNARKDWMB-DEOSSOPVSA-N 435.612 4.242 10 10 IICE Cc1cccc(C(=O)NCCNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1672133484 UVSUIVDHULFAIO-GOSISDBHSA-N 442.991 4.114 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC3CC(F)(F)C3)CC2)cc1 1711865479 WYBPVSXYJZVODT-UHFFFAOYSA-N 433.547 4.346 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1712726117 KPJOAJZOTLWTOR-XLIONFOSSA-N 425.602 4.329 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CSCCS1 1750160516 YQCDJKCZYCUJPT-SFHVURJKSA-N 429.615 4.199 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@@H]2CC=CCC2)c(C)n1-c1ccccc1 1751414143 DITIDHWSVKNBFL-WIYYLYMNSA-N 446.599 4.409 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](NC(C)=O)C1 1763605768 LOFZIFIMDPANEP-MOVYNIQHSA-N 446.599 4.424 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](C)C1 1768082714 FJECPDCVKHATRX-PMACEKPBSA-N 437.588 4.393 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cnccn4)n3CCCC(C)(C)C)CC2)cc1 1768703295 IHUYYMVHCYEAQH-UHFFFAOYSA-N 449.603 4.287 10 10 IICE Cc1nc2scc(C)n2c1/C=C1/SC(=S)N(c2ccc(CC(=O)O)cc2)C1=O 1860073553 QILTZZUKCOKCEH-OVCLIPMQSA-N 429.548 4.046 10 10 IICE CCN1C(=O)C(Nc2ccc3nc[nH]c3c2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422552 CQTABLHUVFIOJY-UHFFFAOYSA-N 425.492 4.182 10 10 IICE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044754828 PZURYZPXUYJBMJ-VWNXMTODSA-N 439.600 4.440 10 10 IICE COCCNCc1ccc(N(C)[C@@H]2CC[C@@H]2OCc2ccccc2)c(Br)c1 2156439607 XNIGBJLNVXXOKK-YADHBBJMSA-N 433.390 4.369 10 10 IICE CC[C@H](NC[C@@H]1CO[C@@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2159115560 XCGDBCWRNCSNRZ-UNEWFSDZSA-N 443.382 4.125 10 10 IICE O=C1NC(=O)N(c2ccc(OCc3ccccc3)cc2)C(=O)C1=Cc1ccc(O)c(Cl)c1 2297342015 NEIVFUIEOSJVNE-UHFFFAOYSA-N 448.862 4.291 10 10 IICE CC(C)=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2381139018 ZGGURVPSXXQCGC-OAHLLOKOSA-N 441.366 4.329 10 10 IICE COCCNC(=O)c1cccc2c1N[C@@H](c1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC=C[C@H]21 14473354 ZALBRIVEQAUVNA-IVZHQMGZSA-N 427.888 4.451 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N(C)C)CC2)c(C)n1-c1ccc(Cl)c(Cl)c1 727237121 BWTSVGMQIFBRNE-UHFFFAOYSA-N 436.383 4.384 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(OCC(F)(F)F)n1 743808729 COWLAJMMJXEFIU-UHFFFAOYSA-N 433.224 4.153 10 10 IICE Cc1cc(C(=O)COC(=O)c2nnn(C3CC3)c2C(F)(F)F)c(C)n1-c1ccccc1 745776482 SWCXBFBVVZFNMN-UHFFFAOYSA-N 432.402 4.079 10 10 IICE COc1cc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cnc1Cl 767671652 NDFBZLZDEOJGCB-UHFFFAOYSA-N 449.863 4.394 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC(C)(C)O[C@@]4(CCOC4)C3)cc2Cl)C1 799994579 RJAAMIQPRZLGGJ-SBUREZEXSA-N 435.996 4.056 10 10 IICE COCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)sc2cccc(F)c12 1134681770 HDAQRYOICUDHTN-LJQANCHMSA-N 429.561 4.286 10 10 IICE C[C@@H](C(=O)NCc1ccc2cccnc2c1O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 1142728198 ODXWFLRFHCVWCQ-OXQOHEQNSA-N 435.524 4.459 10 10 IICE Cc1cc(C(=O)Nc2n[nH]cc2I)c(C)n1-c1cccc(Cl)c1 1148279810 AKKMVXIIBSNSKX-UHFFFAOYSA-N 440.672 4.328 10 10 IICE Cc1cc(Br)ccc1SCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1148700998 JLNJRQANSHJANK-UHFFFAOYSA-N 449.414 4.127 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Sc3ccc(Cl)cc3)cc2F)CC1 1265012042 LQYGOITZEDOKCS-INIZCTEOSA-N 435.996 4.418 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccoc3)n2CCCSc2nccs2)n1 1290599401 FPGXHWONYVQMDJ-UHFFFAOYSA-N 443.602 4.008 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)c1 1292247725 IMZCLTOYJQZWPO-SFHVURJKSA-N 437.490 4.441 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1F 1293225330 QQTRDHRGHPYYJA-DNVCBOLYSA-N 437.556 4.049 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCC[C@](C)(OC)C2)cc1 1295420897 ZFAWSDUEPPFWCS-SANMLTNESA-N 448.615 4.164 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCN(C)C(=O)OC(C)(C)C)o1 1304299777 GMJXEEHANOVSCY-UHFFFAOYSA-N 441.532 4.055 10 10 IICE CC/C=C/Cn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1306483518 CBIGJVWKLHBNRH-VOTSOKGWSA-N 433.604 4.343 10 10 IICE CCCN(Cc1ccccc1O)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307502515 XIIDNZWZMNJQJY-KRWDZBQOSA-N 442.515 4.407 10 10 IICE CCN(CC)[C@@H](C)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1313660758 VCRFRINHHUIINN-NRFANRHFSA-N 449.647 4.251 10 10 IICE Cc1cc(C(=O)N[C@H](C)C[C@@H](O)c2ccco2)c(C)n1-c1ccc(Br)cn1 1445498629 VMEJTOPWVIZWCT-SJKOYZFVSA-N 432.318 4.087 10 10 IICE CCOc1ccc(Nc2ncccc2C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1453982250 LRCMJYSPCQXORT-UHFFFAOYSA-N 446.551 4.115 10 10 IICE CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1463280896 KIBSHOFHNPKYNJ-NRFANRHFSA-N 430.980 4.033 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 1465993563 TUYZLESBTBNZOF-NSHDSACASA-N 431.382 4.180 10 10 IICE Cc1cc(CNC(=O)NCCOc2ncccc2C(F)(F)F)c(C)n1-c1ccccc1 1469453940 KOZCKJMHRBLGMM-UHFFFAOYSA-N 432.446 4.386 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)c4ccccc4C(F)(F)C3=O)c2C)cc1F 1473015669 LFZGYAWMZKRZGE-UHFFFAOYSA-N 440.421 4.499 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCOCC1 1517767440 ZAYMBAFFDOZXLX-IBGZPJMESA-N 437.588 4.250 10 10 IICE CSC1(Cn2c(C3CCCC3)nnc2N(C)Cc2ccccc2O)CCN(C)CC1 1519965483 ICLGBLULHXJTHY-UHFFFAOYSA-N 429.634 4.105 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCN(C(=O)C(C)(C)C)CC2(C)C)CCCC1 1520557970 MPVSWNKTBJCJKB-UHFFFAOYSA-N 439.600 4.024 10 10 IICE Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1521688772 CSWFAHUSZCIYSZ-UHFFFAOYSA-N 431.536 4.056 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3nc(Br)sc3C3CC3)C2)cc1 1529705895 BQCHQLVXKLREIO-LBPRGKRZSA-N 436.375 4.048 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccccc3Cc3ccccc3)cc2F)CC1 1537534490 BINDUAONVRZOOP-UHFFFAOYSA-N 431.555 4.488 10 10 IICE Cc1cccc([C@@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)N2CCOCC2)c1 1540945063 KJAYULQEAAKGAN-AREMUKBSSA-N 445.563 4.018 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)CC(C)(C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1543033261 HSYUMGBECLKCRQ-GOSISDBHSA-N 449.647 4.435 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](O)c2cc(Cl)c3c(c2)OCCO3)c1 1545522020 FSCDBDGGMACIDY-NRFANRHFSA-N 440.927 4.291 10 10 IICE COCCN(c1nnc(-c2ccccn2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@H](C)C1 1555537008 WWBHATSPRIHELP-CVDCTZTESA-N 448.615 4.404 10 10 IICE CC(C)(C)OC(=O)NC[C@@]12CCCC[C@H]1CN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1558856723 GWIWXUDPLHFPGM-NPMXOYFQSA-N 446.569 4.470 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@]3(Cc4ccc(Cl)cc4)CCCOC3)C2)cc1 1565055827 LQONRJBALYANEJ-HYBUGGRVSA-N 443.975 4.018 10 10 IICE Cc1sc(CNC(=O)OC(C)(C)C)nc1C(=O)NCc1cc(Cl)cc(Cl)c1O 1570029328 WFPZTVUXDRQNCN-UHFFFAOYSA-N 446.356 4.419 10 10 IICE Cc1nccn1-c1ccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1F 1597314301 VZAINHGZICBZLC-UHFFFAOYSA-N 430.483 4.470 10 10 IICE CC(=O)c1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)s1 1618368691 JNVQRXSNLLWVOB-UHFFFAOYSA-N 442.298 4.070 10 10 IICE COC(=O)[C@@H](C)Oc1ccc(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1F 1629557773 WKTQQSITYSIYFR-MRXNPFEDSA-N 440.471 4.434 10 10 IICE CSc1c(F)cccc1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1632682614 FYSLZODSSBSWKJ-UHFFFAOYSA-N 438.527 4.368 10 10 IICE Nc1cc(F)c(Br)cc1C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1638272730 BEWDQBFMPRYIMB-UHFFFAOYSA-N 426.249 4.132 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3cc(Br)cc(F)c3C2)c([N+](=O)[O-])c1 1642505805 KGHIHZZFRLYCKM-HWKANZROSA-N 435.249 4.245 10 10 IICE C[C@@H](NC(=O)N1CCOC[C@@H]1c1ccc(Br)cc1)c1ccc(N(C)C)cc1 1686173061 AANSYJIZDRORMT-FOIQADDNSA-N 432.362 4.359 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@@H](C)O[C@@H](C(F)(F)F)C3)cc2Cl)C1 1686269461 PYYFWBIUFMGNHN-HBUWYVDXSA-N 433.902 4.438 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1686856089 HAUNWYMWIIXHMP-TZIWHRDSSA-N 434.584 4.334 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2CC2(C)CC2)c(C)n1-c1ccccc1 1692982177 KVTWHDYOYVZECC-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CO[C@@H]1CC[C@@H]2CN(c3nnc(CC(C)(C)C)n3CCCSc3nccs3)C[C@@H]21 1698279059 MHFZWGGPZFWSAA-IXDOHACOSA-N 435.663 4.367 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCCSC 1761877980 LHFGCQXNDAZUBJ-QGZVFWFLSA-N 435.613 4.409 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2cc(Cl)ccn2)sc(C)c1-c1ccc(C)cc1 1860749879 FEMUKBIHJFPTEL-UHFFFAOYSA-N 443.912 4.444 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2nc(C)cs2)sc(C)c1-c1ccc(F)cc1 1860765896 VQSSJZDQBYOFED-UHFFFAOYSA-N 447.513 4.381 10 10 IICE CCOc1ccc(/C=C2/C(=O)N(c3ccccn3)N=C2c2ccc(OC)cc2)cc1OC 1865669046 DCQKCJORXHSLEM-HMMYKYKNSA-N 429.476 4.332 10 10 IICE O=C(OCC1c2ccccc2-c2ccccc21)N1CC[C@](C(=O)O)(c2cccc(O)c2O)C1 1951727008 YLGRMNIFAYMSPH-AREMUKBSSA-N 445.471 4.075 10 10 IICE COc1ccc(Br)c(CN[C@H]2[C@@H]3[C@@H]2CCCCN3C(=O)OC(C)(C)C)c1O 2236055447 PWDXRZLZMBBDPX-JLZZUVOBSA-N 441.366 4.041 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)ccc1OCc1ccccc1 2313557763 LISUFUNYDLRMRF-UHFFFAOYSA-N 446.434 4.080 10 10 IICE Cc1ccc(CN(C)C(=O)CN(CC(C)C)C(=O)OC(C)(C)C)c(O)c1Br 2380785291 YHVYXNPCAJCQMF-UHFFFAOYSA-N 443.382 4.315 10 10 IICE COc1ccc(N2CCn3c(nc4ccccc43)C2)cc1NC(=O)c1ccccc1OC 19855472 RUOZTZOLPLFNFM-UHFFFAOYSA-N 428.492 4.326 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3ccc(OCc4ccccc4[N+](=O)[O-])c(Cl)c3)C(=N)N2O1 20236884 DZZRGWHGTHTCIL-IOBVOHSESA-N 438.827 4.278 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCCC(=O)N3CCCCCC3)C2=O)cc1OC 33436471 BKUFSCPMKZKFSQ-XDJHFCHBSA-N 448.610 4.088 10 10 IICE Cc1ccc(NC(=O)CN2C(=O)N/C(=C\c3cc(C)n(C4CCCCC4)c3C)C2=O)cc1 96594471 IOJWFASFEASWMA-HMAPJEAMSA-N 434.540 4.450 10 10 IICE CC(/C=C1\SC(=S)N([C@H]2CC(=O)N(c3ccc(C)cc3)C2=O)C1=O)=C\c1ccccc1 101154648 MHYXYOUEGHKRLY-NCPJYLQSSA-N 448.569 4.475 10 10 IICE COCCN1C(=O)/C(=C\c2cc3cccc(C)c3nc2N2CCCCC2)SC1=S 208277227 NBSDIZJNDMZFFS-NBVRZTHBSA-N 427.595 4.381 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CC(=O)Nc3ccccc3F)no2)C1 579821251 LBSXJYRSGYDYKR-UHFFFAOYSA-N 447.514 4.159 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2ccc(C)cc2)cs1 761343171 QPLAMXKJLDQFJN-UHFFFAOYSA-N 443.550 4.276 10 10 IICE Cc1noc(C)c1CO[C@H]1CCN(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)C1 762577838 XMAOAACBJRNTPN-QFIPXVFZSA-N 426.561 4.028 10 10 IICE C[C@@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1Cl 766094571 MPPGFRIRBJWHEQ-LJQANCHMSA-N 442.003 4.380 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(Oc2cccnc2)cc1 768543491 LGIAAMAWGXAVOR-UHFFFAOYSA-N 442.563 4.336 10 10 IICE CCc1ccccc1NC(=O)C[C@H](C)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 773147822 VPJCLCSWMRDQFH-NRFANRHFSA-N 434.628 4.288 10 10 IICE Oc1nc(/C=C\c2ccc3c(c2)CCN3Cc2ccccc2)nc2c1cnn2-c1ncccn1 794704248 YOFTZYQETHHOMV-NTMALXAHSA-N 447.502 4.044 10 10 IICE CC[C@H](C)NS(=O)(=O)c1cccc(NCc2cc(C)cc(Br)c2O)c1 796430563 MRCVOFKWYIWAFN-ZDUSSCGKSA-N 427.364 4.152 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCOC2)CC[C@@H]1C 802761100 KDTYFKKMUQJEKV-NSXLHWASSA-N 449.599 4.250 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3CCOc4ccc(Br)cc43)CC2)cc1 1125322722 KJYWVYOZKLODHS-IBGZPJMESA-N 445.357 4.063 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@]2(c3cnn(C)c3)CCCO2)cc1 1134581782 NNYMSFNYDVLTIZ-XMMPIXPASA-N 432.528 4.337 10 10 IICE CCc1ccc(-n2nc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c3c2CCC3)cc1 1134681844 KAPXXDJHJXLZSR-RUZDIDTESA-N 445.611 4.022 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@]3(C)C[C@H](NC(=O)OC(C)(C)C)CCO3)cc2)CC1 1136705127 BPBVETZUBBVMKW-NLFFAJNJSA-N 445.604 4.002 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4c(F)c(Br)ccc4[nH]3)CC2)cc1 1143190317 ARCBDLQTNUAAOY-UHFFFAOYSA-N 446.320 4.477 10 10 IICE Cc1cc(C(=O)NCCOc2ncccc2F)c(C)n1-c1ccccc1Br 1151396840 SIRHMKWKLJLFMU-UHFFFAOYSA-N 432.293 4.200 10 10 IICE C[C@@H](NC(=O)c1cccc(Br)c1I)c1ccccc1O 1151885697 CQNOLBNCCLEACR-SECBINFHSA-N 446.082 4.250 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2C(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cn1 1154302102 YXEZYTVGRDJVDV-QGZVFWFLSA-N 448.361 4.198 10 10 IICE COc1ccc(N2CCN(CCNc3c(Cl)cc([N+](=O)[O-])cc3Cl)CC2)cc1 1162308003 KTCSOPHYEAERKL-UHFFFAOYSA-N 425.316 4.144 10 10 IICE Cc1cc(C(=O)CN2C(=O)NC3(C[C@@H](C)C[C@H](C)C3)C2=O)c(C)n1-c1ccc(Cl)cn1 1189005454 VFGUIRNEJPCVAE-KBPBESRZSA-N 442.947 4.072 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(CO)(C(F)(F)F)CC3)cc2Cl)C1 1235832763 GRTGIBDMOVJOHJ-HNNXBMFYSA-N 447.929 4.423 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1CC2(CCOCC2)Oc2ccccc21 1235838420 XWWPQYHRAQUHOB-QGZVFWFLSA-N 447.329 4.027 10 10 IICE O=C(NCC(F)(F)c1ccc(F)cc1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 1255010490 MSDIESCEXWMWGJ-INIZCTEOSA-N 426.410 4.153 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cccc(Br)n1 1291444954 DECWZAVCQURMIS-CQSZACIVSA-N 430.350 4.339 10 10 IICE Cc1cc(C(=O)Nc2cc(Br)c(=O)n(C)c2)c(C)n1-c1cccc(Cl)c1 1294599193 YCKJVKYOJMRYOB-UHFFFAOYSA-N 434.721 4.461 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@]1(C)CCCN1C(=O)OC(C)(C)C 1294685060 LNUFGUNGRXNTQW-HXUWFJFHSA-N 441.366 4.293 10 10 IICE Cc1cc(C(=O)NCc2nc(COc3ccccc3)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1296650148 JAGZSCKOWQQFEJ-UHFFFAOYSA-N 435.915 4.375 10 10 IICE Cc1cc(C(=O)NCc2cc(C3CC3)n(C)n2)c(C)n1-c1cccc(Br)c1 1304065327 AVZSDYLCVDRJOZ-UHFFFAOYSA-N 427.346 4.398 10 10 IICE C[C@H](NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F)c1ccc(N(C)C)cc1 1312538089 YBVCOGLNHXYYHJ-ZLGUVYLKSA-N 434.506 4.176 10 10 IICE CN(CC1CC(F)C1)c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1314785434 LFTQSGTXESPURS-UHFFFAOYSA-N 432.594 4.087 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2C[C@@H](C)[C@H](C(=O)OC)O2)sc(C)c1-c1ccc(C)cc1 1350796025 ANXMWMZMPQDLIV-VVFCZOMOSA-N 445.537 4.114 10 10 IICE Cc1cc(CC(=O)Nc2ccccc2S(=O)(=O)NC(C)(C)C)c(C)n1-c1ccccc1 1351383601 ZLNQKWAJKJIFDC-UHFFFAOYSA-N 439.581 4.352 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CCCC2 1351557951 MLFCJPAORMDPMG-PCKAHOCUSA-N 432.586 4.169 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@@H]1c1cccnc1 1351683053 ISNQWNITSGCYRJ-UIMCMNAESA-N 441.553 4.176 10 10 IICE CNC(=O)c1ccc(Cl)c(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1355534354 RODUUPOCLUVHBT-UHFFFAOYSA-N 425.916 4.180 10 10 IICE CCC(CC)[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)N1CCOCC1 1448445681 CASUKZCEEGDXFU-WZONZLPQSA-N 436.040 4.330 10 10 IICE C[C@H](CNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(C(F)(F)F)cc1 1469819905 XHTFPCNNCQTZPY-IIBYNOLFSA-N 436.522 4.477 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cc(Cl)cc(Br)c3)C2)cc1 1470539166 LOXBFXLEVFHLMY-MRXNPFEDSA-N 438.753 4.189 10 10 IICE CCCCN1CCCC[C@H]1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1500541004 YXAPPDACOKYVLZ-QHCPKHFHSA-N 448.615 4.261 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC1CCN(c2ccncc2)CC1 1512810436 VOZNELZSFMMVHO-IBGZPJMESA-N 434.588 4.445 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(C2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1516917120 FZPKRAHHNPGZPS-QGZVFWFLSA-N 447.624 4.147 10 10 IICE CC(C)(C)OC(=O)[C@]1(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1(C)C 1524065974 BEYQQQDSLCVPLV-IQMFZBJNSA-N 438.515 4.131 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)c(OC(F)F)c(C)c3)cc2F)CC1 1537534760 IXMGHSLAMVDGOA-UHFFFAOYSA-N 435.490 4.116 10 10 IICE C[C@@H]1CCCN(c2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccn2)C1 1539583078 XZSLUMUCIYMYRB-MJGOQNOKSA-N 444.526 4.318 10 10 IICE O=C(C[C@@H](c1ccc(O)cc1)C1CC1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1543114448 VRVNSZYJQYAJCC-OAQYLSRUSA-N 448.485 4.448 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cnc4c(c3)c(C(F)(F)F)nn4C)cc2)CC1 1543146186 OGGCQJUZZZGWPZ-UHFFFAOYSA-N 431.462 4.153 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(\C)c3ccccc3OC(F)F)CC2)c(OC)c1 1543632937 SKUADFRNBWGGCU-JQIJEIRASA-N 432.467 4.057 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543756495 CBMOZTWKGZYZGF-VQTJNVASSA-N 425.621 4.283 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CSc1ccc2ccccc2c1 1546152114 SSJZPTBKNYCRBB-UHFFFAOYSA-N 429.925 4.493 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(C2CC2)n1Cc1ccc(N2CCOCC2)cc1 1552595020 RSZXFRJWMRPCIH-GOSISDBHSA-N 429.634 4.008 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccnc(-c2ccccc2)n1 1556426212 BTYLAEMDPNSXBM-UHFFFAOYSA-N 432.524 4.146 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@](C)(O)c3ccc(F)cc3F)c2C)c1 1565193358 WHWBQYQHUSXEOH-XMMPIXPASA-N 427.495 4.388 10 10 IICE Cc1cc(Cl)ccc1C1=CCN(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)CC1 1565273443 ZFJLQGFKTUMGCF-UHFFFAOYSA-N 439.003 4.399 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1 1565702035 RYCXZGNCCAVLMV-QFIPXVFZSA-N 439.625 4.190 10 10 IICE C[C@@H](NC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)c1)c1ccccc1O 1587444285 BGTIIFXOHNQNLP-IAGOWNOFSA-N 436.533 4.023 10 10 IICE Cc1cc(C(=O)NC[C@@H]2OCCc3ccccc32)c(C)n1-c1ccc(Br)cn1 1617100258 VUXJRINOLNNKHL-FQEVSTJZSA-N 440.341 4.295 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1csc(Cc2ccc(F)cc2)n1 1623928261 KOLBCLBYOVHGKM-UHFFFAOYSA-N 448.903 4.047 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CNc2cccc(C(F)(F)F)c2)cc1 1627205581 TXODSHRJCPFBSV-OAQYLSRUSA-N 435.490 4.391 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1 1634624627 MEYGTSSGMCOMOS-DEOSSOPVSA-N 446.551 4.404 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OCC(F)(F)F)cc1 1635941314 QAGSUFFXAPWUJM-KRWDZBQOSA-N 442.865 4.381 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@]1(F)c1ccccc1 1639654186 SYGOVPONFHSMAT-ZIZHVNKESA-N 444.528 4.171 10 10 IICE COc1ccc(N(Cc2nnc(C(=O)NCc3ccc(C)cc3)s2)C(C)C)cc1F 1653759447 YZUOGDCMJSHAOR-UHFFFAOYSA-N 428.533 4.339 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC(Cc4cccc(C(F)(F)F)c4)C3)C2)cc1 1682645232 BMGQZFCUOPGMOY-IBGZPJMESA-N 433.474 4.177 10 10 IICE C[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(F)cc1OC(F)F 1685993911 ISDGJGKZMQERLF-LIRRHRJNSA-N 438.494 4.156 10 10 IICE CC[C@H]1CCN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)C1 1727768282 NPEBPQIPHCADQX-KRWDZBQOSA-N 431.635 4.015 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752742262 JIEBKHIBZNYLQC-OALUTQOASA-N 429.584 4.442 10 10 IICE C[C@]1(NCc2c(O)cccc2Br)CCCN(C(=O)OCc2ccccc2)C1 1940869086 YRSADENLQAUKIV-NRFANRHFSA-N 433.346 4.436 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1ccc2oc(=O)ccc2c1 2296552713 FAKUIOIIOOKXFZ-UHFFFAOYSA-N 440.502 4.006 10 10 IICE O=C1C(=Cc2cc3cc4c(cc3nc2O)OCO4)SC(=S)N1CCc1ccccc1 2296595327 SNLMGLQZBGPONQ-UHFFFAOYSA-N 436.514 4.113 10 10 IICE CCCCCN1C(=O)C(=Cc2c(NCCC)nc3ccc(C)cn3c2=O)SC1=S 2314414767 LRALOXDXXLXZFF-UHFFFAOYSA-N 430.599 4.216 10 10 IICE CCCOc1cccc(C=C2SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 2323812682 UDGAVSGMHHUXHT-SFHVURJKSA-N 443.546 4.078 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380721485 KXNWOLYHZDJZKH-HNNXBMFYSA-N 441.366 4.259 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380748061 ZCBPHZYOCWMOGX-DZGCQCFKSA-N 441.366 4.163 10 10 IICE Cc1ccc(CN=c2[nH]c(Cl)nc(Cl)c2Br)c(O)c1Br 2381138390 OBAAKCGZHAZKTO-UHFFFAOYSA-N 441.938 4.356 10 10 IICE Cc1cc(C(=O)Nc2cccc(NC(=O)C3CC3)c2)c(C)n1-c1ccc2c(c1)OCCO2 29170263 UYVSNIVTBXBQHT-UHFFFAOYSA-N 431.492 4.466 10 10 IICE COc1ccc(N2CCCN(Cc3nc(-c4ccc(C(F)(F)F)cc4)no3)CC2)cc1 108094032 YIHDHBKNGINAIK-UHFFFAOYSA-N 432.446 4.476 10 10 IICE CCN(C(=O)NCc1ccc(N2CCSCC2)cc1)[C@H](C)Cc1ccc(OC)cc1 731401223 CSEFZJDKHPIFFS-LJQANCHMSA-N 427.614 4.411 10 10 IICE COc1ccccc1CCN(C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 745904411 PYNQFSREXOEHKX-GOSISDBHSA-N 433.499 4.150 10 10 IICE C[C@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1c2ccccc2CC[C@H]1C 751930640 GXERSDGMUJSIAR-CVEARBPZSA-N 435.549 4.229 10 10 IICE O=S(=O)(Nc1nc(-c2ccc3ccccc3c2)cs1)c1ccccc1Cn1cncn1 758386194 WTSSOPVTUMFSTG-UHFFFAOYSA-N 447.545 4.404 10 10 IICE Fc1cc(CN[C@H]2CCCOc3ccc(Br)cc32)ccc1N1CCOCC1 765117126 AYWYJDHUFZCXJX-IBGZPJMESA-N 435.337 4.428 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1 802236740 QVZCYDCEEXJAMR-IBGZPJMESA-N 441.572 4.248 10 10 IICE S=C(NNc1nnc(-c2ccccc2)n1-c1ccccc1)Nc1ccc2c(c1)OCCO2 915121938 UIFTZNUKNHVZFM-UHFFFAOYSA-N 444.520 4.019 10 10 IICE Oc1ccc2cc(Br)ccc2c1CN1CCC(c2nnc3n2CCC3)CC1 918755658 SOPPFYQQLZKLFW-UHFFFAOYSA-N 427.346 4.225 10 10 IICE CC(C)O[C@@H]1CCCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C1 1130762856 DJOYWNWNQJKCDL-YHZJOHHESA-N 438.640 4.146 10 10 IICE C[C@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1134686728 UGHSPYZJNSPGSW-IIBYNOLFSA-N 437.506 4.249 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccccc3-n3ccc(C(N)=O)n3)c2C)c1 1136796636 PHVHXTRILCZQHV-UHFFFAOYSA-N 427.508 4.248 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccnc1Oc1ccc(F)cc1Br 1142534053 XTFTYUZPTNHOJP-UHFFFAOYSA-N 433.233 4.117 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc4c(cc3Br)OCO4)cc2)CC1 1144771987 GCNUPIUXCZVTKH-UHFFFAOYSA-N 431.330 4.344 10 10 IICE O=C(Cc1ccc(I)cc1)N(Cc1ccco1)Cc1ccccc1O 1149856785 DGSFEJSSFZZAHL-UHFFFAOYSA-N 447.272 4.361 10 10 IICE COC(=O)/C=C/c1ccc(N(CCCO)Cc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 1162773116 AHYNXYDXJRURGT-VMPITWQZSA-N 439.295 4.477 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccncc3)noc2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 1165626696 NQHUYGYYCVPBGC-UHFFFAOYSA-N 443.290 4.496 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)c1O 1167935409 BONSJZMKKBDPPA-OAHLLOKOSA-N 433.911 4.421 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC(C)(C)[C@@H]2C)sc(C)c1-c1ccccc1 1191539159 DRFDDMQQBGSLQQ-INIZCTEOSA-N 430.570 4.338 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)Cc3nnc4n3CCCCC4)cc2Cl)C1 1227206897 BCOFMBNOQIVZKY-QGZVFWFLSA-N 445.011 4.236 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CSc4ccc(Br)cc43)C2)cc1 1248182872 HNRZRLODSMOAMZ-RDTXWAMCSA-N 448.386 4.183 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1C(C)C 1266258689 FWICNDLPMYGLFJ-UHFFFAOYSA-N 435.612 4.346 10 10 IICE Cc1cc(C2CC2)nc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1274888271 BTWWOSGVCBRTCD-BOPFTXTBSA-N 442.541 4.032 10 10 IICE CNS(=O)(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)s1 1290627093 ZREDDDCUSKMCIV-UHFFFAOYSA-N 445.610 4.117 10 10 IICE CC[C@H](C)CN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1291726071 MXAPKOLMBKVKLB-FQEVSTJZSA-N 425.621 4.378 10 10 IICE CCSCCCn1c(-c2ccc[nH]2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1297920684 IWPAUOFUCBNFIZ-UHFFFAOYSA-N 440.617 4.142 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(C)CCCC1 1314373381 AHHLJRGDGWOKER-UHFFFAOYSA-N 427.593 4.120 10 10 IICE Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1355131587 XPLNBRAVGZOJFH-BRWVUGGUSA-N 434.939 4.485 10 10 IICE O=C(CN1CCCCCC1)Nc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1 1441587271 CFNGJECCMCNRSD-UHFFFAOYSA-N 439.537 4.379 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNC(=O)NCc3c(O)ccc4c3CCCC4)CCC[C@@H]12 1471270611 IRXHEGAMHCVJCQ-PXDATVDWSA-N 443.588 4.250 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2nccc(C(F)(F)F)n2)cc1 1478828430 HBYMBQCTRPQISQ-UHFFFAOYSA-N 433.434 4.066 10 10 IICE CCOCc1nnc(N2CCSC3(CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1503129840 PVEXFNBTFJPZCR-UHFFFAOYSA-N 447.624 4.324 10 10 IICE CN(C)c1ccc(CNC(=O)c2c(F)ccc(I)c2Cl)cc1 1524861923 RABXCKJIJJNNOT-UHFFFAOYSA-N 432.664 4.080 10 10 IICE O=C(COc1ccc2c(c1)CCCC2)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1539582070 OLJUIWUOEABCRV-LJQANCHMSA-N 430.495 4.331 10 10 IICE Cc1ccccc1-n1ncc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1C(F)F 1540536440 DGABSTBZMWQIKG-UHFFFAOYSA-N 440.494 4.227 10 10 IICE C[C@@H]1CCC[C@](Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1543885591 LQDFULBKCUDMID-WPWBMXPQSA-N 441.620 4.372 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1544010922 AMQQMGZRWSOPDT-XMSQKQJNSA-N 437.584 4.372 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)c1 1544645187 KJMUNZWSZJIKLB-UHFFFAOYSA-N 445.991 4.283 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1COc2ccc(Cl)cc2C1 1545632837 WZKRIWXQLHBOEE-LPHOPBHVSA-N 435.351 4.031 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3CCCOC(C)C)CC2)cc1 1554960005 WBCOFTXBJVZVJU-UHFFFAOYSA-N 441.620 4.476 10 10 IICE COc1cccc(CN(C)c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)c1 1555023003 RJKVYNPYYOQOGF-KRWDZBQOSA-N 445.614 4.066 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCC4)C3)cc2F)C[C@@H](C)O1 1559528939 YCPKAOZZODXWLI-BGYRXZFFSA-N 431.596 4.102 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H]2C[C@H](OC)C2(C)C)sc(C)c1-c1ccccc1 1559845933 QWFCKQSDXHCGEV-IRXDYDNUSA-N 430.570 4.242 10 10 IICE CC[C@H](OC1CCCC1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1565882036 NTLRKAGVIMLYKQ-RTWAWAEBSA-N 433.593 4.172 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)c2C)c1 1596471495 FPBGLKFJNPJEAC-JOCHJYFZSA-N 444.579 4.034 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc4c(c3[N+](=O)[O-])OCCCO4)c2C)c1 1596481808 GNVYTRMGILRZPG-UHFFFAOYSA-N 435.480 4.402 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3C(=O)CCC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1607505212 RGIOMCZEGHLYOG-UHFFFAOYSA-N 429.476 4.121 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1612891698 BSKNEYKYTOUZLY-QZTJIDSGSA-N 431.675 4.333 10 10 IICE CCCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1cccc(F)c1 1618642614 HJMQEJOJNPTWJK-XMMPIXPASA-N 437.563 4.063 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2NC(=O)OC(C)(C)C)cc1 1624540783 CXRXVRACGKNLSU-MPJJRAAHSA-N 429.605 4.431 10 10 IICE C[C@H](CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCc2ccccc21 1629055437 JHOJDPXBBVTBAB-MJGOQNOKSA-N 429.511 4.214 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCn4ncc(Br)c4C3)c2C)c1 1632943499 GZNJMIHYNFHGGX-UHFFFAOYSA-N 427.346 4.326 10 10 IICE C[C@@H](CNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)NC(=O)OC(C)(C)C 1634720229 RHHJJWPGNMMPLM-CVEARBPZSA-N 439.000 4.289 10 10 IICE COC[C@@]1(CNC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)OCCc2ccccc21 1635796106 DOZJADIRXQKRRT-HHHXNRCGSA-N 447.579 4.050 10 10 IICE COc1cc(CCNC(=O)NCc2ccccc2O)cc(OC)c1OCc1ccccc1 1637229312 YNONVCWVQXSNDT-UHFFFAOYSA-N 436.508 4.030 10 10 IICE Cc1ccccc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)C1CCC(C)CC1 1644355212 ZVHYVEYFPLEBLP-SGHZUCRHSA-N 430.570 4.370 10 10 IICE Cc1ccc(-n2cnnc2SCC(=O)NCc2c(O)ccc3ccccc23)cc1Cl 1645440637 LPBKFGRTHXQWBO-UHFFFAOYSA-N 438.940 4.496 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCOCCN(C)C(=O)OC(C)(C)C)c1 1645739465 ZSGVEHAZTZVPEY-UHFFFAOYSA-N 429.561 4.016 10 10 IICE COCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H](C)c1ccccc1 1652382825 HVICDNHFOBFNEH-SFHVURJKSA-N 442.515 4.110 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@@]2(C)C1 1673743794 GVHDOXKRGABLOC-DBTWGZIYSA-N 434.628 4.156 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](N3CCCCC3)C2)n1CCCSc1nccs1 1694061251 GOTSYFXTBLKQBE-ZWKOTPCHSA-N 434.679 4.495 10 10 IICE CCN(C)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N2CCSCC2)cc1 1695519508 OIWBICVTDAVMNR-UHFFFAOYSA-N 428.993 4.051 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)C[C@H]2CCOC2)cc1 1710025701 KAVZIXINBHUGCT-OAQYLSRUSA-N 434.588 4.016 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1712508369 NNWJFSJKAMMVKF-KRWDZBQOSA-N 433.572 4.024 10 10 IICE C[C@@H]1CCC[C@H](N(C)c2nnc(CN3CCCC3=O)n2CCCSc2nccs2)C1 1726527737 XPFAZXMZZCWOID-SJORKVTESA-N 448.662 4.054 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1730432075 RAKZSCPPFXYFMN-LJQANCHMSA-N 437.588 4.250 10 10 IICE CCN(CC)[C@@H](C)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1746075509 ZQKHGKYUCVKGSJ-FQEVSTJZSA-N 442.652 4.031 10 10 IICE CC(C)c1nnc(N2CCN(C3CCC3)C[C@@H](C)C2)n1CCCSc1nccs1 1763061307 YXSFQOFMHICNMH-QGZVFWFLSA-N 434.679 4.351 10 10 IICE CCCO[C@@H]1CCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1766328293 HZTKNCYZEPEJEI-DHIUTWEWSA-N 441.620 4.338 10 10 IICE COc1ccccc1Cc1nnc(N2CC[C@H](C)C2)n1CCCSc1nccs1 1768913621 AFPSNOWQJRSHKG-INIZCTEOSA-N 429.615 4.363 10 10 IICE Cn1cc(Nc2nnc(COc3ccc(F)cc3)n2CCCSc2nccs2)cn1 1769022435 ITILQXQOIUYUPA-UHFFFAOYSA-N 445.549 4.112 10 10 IICE COc1ccc([C@H](Cc2cccs2)C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1 1858086382 HRHLSEWMGQOQQA-DEOSSOPVSA-N 436.577 4.440 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3nc(C(F)(F)F)n4ccccc34)cccc21 1868181442 CNQDRCYUMJOTAH-UHFFFAOYSA-N 435.361 4.381 10 10 IICE CN(CCN(Cc1ccccc1)c1cc2c(cc1Cl)[C@@H](O)C(=O)N2)Cc1ccccc1 1946813334 PSXKTXJGSTVMEB-XMMPIXPASA-N 435.955 4.464 10 10 IICE CN(Cc1ccccc1)C[C@H](NC(=O)OC(C)(C)C)[C@H](O)c1ccc(N2CCCC2)cc1 2044730822 RKDMDGBOSPOCLR-BJKOFHAPSA-N 439.600 4.346 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC12CCC(NCc1cccc(Br)c1O)CC2 2090479646 UOBSVRQRZYWITJ-CZDRUDQFSA-N 425.367 4.470 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1O 2236050945 MILLPPJMCGGETF-AWEZNQCLSA-N 443.382 4.290 10 10 IICE CCOC(=O)CN1C(=O)SC(=Cc2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)C1=O 2293983728 UBLUEFMPLUDSER-UHFFFAOYSA-N 436.892 4.486 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)C2=CNCc2ccco2)cc1 2297313683 MBMMXFXAFOETOV-UHFFFAOYSA-N 430.489 4.323 10 10 IICE CCOc1cc(C=C2C(=O)N(Cc3ccccc3F)N=C2C)cc(Br)c1O 2332111102 YMODUJQAMILVSY-UHFFFAOYSA-N 433.277 4.494 10 10 IICE Cc1ccc(-c2cc(C(F)(F)F)on2)cc1S(=O)(=O)NCc1ccc(N(C)C)cc1 33173479 MYNUZNHFAJDVQC-UHFFFAOYSA-N 439.459 4.213 10 10 IICE CCOC(=O)c1ccc(NC(=O)CN2C(=O)/C(=C\c3ccc(C)cc3)SC2=S)cc1 33319549 ZLIYVWRDARUKMR-LDADJPATSA-N 440.546 4.012 10 10 IICE CCCCCCN1C(=O)/C(=C2\SC(=S)N(CCCC(=O)OC)C2=O)c2ccccc21 40938529 HXOUHBMZQWUZQM-HNENSFHCSA-N 446.594 4.138 10 10 IICE Cc1cc(Br)cc(C)c1NC(=O)CCCOC(=O)/C=C\c1ccc(O)c(O)c1 759598698 XPLKZPUDSJJPKI-VURMDHGXSA-N 448.313 4.452 10 10 IICE Cc1ccc(/C=C\C(=O)N(C)c2ccc(CNC(=O)/C=C/c3ccc(C)nc3)cc2)cn1 765480553 MSSJRWKFIQVYOL-AIWUCEOPSA-N 426.520 4.099 10 10 IICE CC(C)(C)OC(=O)N[C@](C)(C(=O)NCc1cccc(Br)c1O)c1ccccc1 768300981 FNBLIRKXCBADNK-NRFANRHFSA-N 449.345 4.211 10 10 IICE CN(C(=O)OC(C)(C)C)C1CCN(Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1 769386604 CIXJYAYURCBYGE-UHFFFAOYSA-N 432.565 4.416 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2nc(O)c3ccccc3n2)c(C)n1-c1ccccc1 789918269 RVNQBACJJJWXEL-UHFFFAOYSA-N 429.524 4.127 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@@]4(CCO[C@H](C)C4)C3)n2C)c(C)n1-c1ccccc1 800747813 RASNTDMMKGLMQK-HHJKRLRDSA-N 435.572 4.052 10 10 IICE Cc1ccc(-c2nc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)cs2)n1C 1125258388 HVAWBVPZBSWBDE-HOTGVXAUSA-N 442.560 4.140 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(Cl)c1 1127268084 QVSPMFIZWBTCJU-UHFFFAOYSA-N 426.004 4.466 10 10 IICE Cc1ccc(OCCC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134681866 KPPZHEWICQVUFW-HXUWFJFHSA-N 448.405 4.012 10 10 IICE C[C@@H](NC(=O)[C@H]1CCCN1Cc1ccc(Cl)cc1)c1ccc(N2CCOCC2)cc1 1136442955 KKXVLRFUSZIISH-WZONZLPQSA-N 427.976 4.018 10 10 IICE Cc1cc(C(=O)NCC[C@@H](C)N2CCCCC2)c(C)n1-c1ccc(Br)cn1 1154078673 PFNHSYRJRZIAGI-OAHLLOKOSA-N 433.394 4.246 10 10 IICE O=C(NCc1c(O)cccc1O)c1cccc(NC(=O)c2cccc(Br)c2)c1 1156881038 MKAQZPKXFUESBY-UHFFFAOYSA-N 441.281 4.043 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2c2ccc(Br)cc2)c(C)n1-c1ccccn1 1165658321 SGMCUXZNSKSUDG-HXUWFJFHSA-N 440.341 4.465 10 10 IICE CCOC(=O)CN(Cc1csc(-c2ccc(OC)cc2OC)n1)Cc1ccccc1O 1171390361 KCRZDEJEWYVQHS-UHFFFAOYSA-N 442.537 4.098 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1ccc(COC2CCOCC2)cc1 1230706966 POVBDZJALDDNCT-HXUWFJFHSA-N 439.600 4.187 10 10 IICE C[C@@H]1C[C@H](CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCO1 1291018488 GUEAUSNQPVIRML-QZTJIDSGSA-N 426.586 4.478 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1293621032 JSJPYYKEBUCLHG-QFIPXVFZSA-N 439.629 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N2CCC(C)(COC)CC2)cc1 1295418267 DPAISTFOCQJQNJ-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C 1297793006 JJWQVVWFXCSLBA-BJLXPSRBSA-N 425.602 4.110 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)cc1 1300454663 AYDIPGYOQDJEIO-IBGZPJMESA-N 441.453 4.344 10 10 IICE Cc1cc(C(=O)N2CCc3ccnc(N)c3C2)c(C)n1-c1cccc(Br)c1 1302093580 HLIBWBUHPSXLDV-UHFFFAOYSA-N 425.330 4.032 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C1 1302667024 ANDFLGDLBSPCGF-GOSISDBHSA-N 440.592 4.315 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)(C)O)no1 1304199170 SLMLADISNJOABA-UHFFFAOYSA-N 448.571 4.446 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@](O)(CC)C2)sc(C)c1-c1ccccc1 1307992870 CYTKPHQCPJOWAC-QHCPKHFHSA-N 430.570 4.076 10 10 IICE C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1312363174 CRDKCQNLRVCHKA-KKSFZXQISA-N 436.522 4.305 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(N4CCOCC4)c(F)c3)cc2Cl)C1 1436048771 RGKSVBGPAOVJBF-KRWDZBQOSA-N 445.966 4.482 10 10 IICE CC(C)[C@H]1N(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC12CCC2 1450392299 GCNYKKIZDKTALY-LYPXWFNGSA-N 432.586 4.454 10 10 IICE COCCCOc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 1457106484 YGSWYDZEKUFBHF-GOSISDBHSA-N 448.510 4.411 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(c3ncccc3F)C2)c(C)n1-c1ccc(Cl)cc1 1457701630 WPCBDBIRPAFYBR-LJQANCHMSA-N 426.923 4.219 10 10 IICE COc1ccccc1-c1csc([C@H]2CCCN(C(=O)c3c(F)ccc(O)c3O)C2)n1 1457783236 SMMOTVNCISDHHA-ZDUSSCGKSA-N 428.485 4.389 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(CC(F)(F)F)CC1 1460084430 BJDKHXJRWXGZQY-CQSZACIVSA-N 444.453 4.453 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3CCSCC3)cc2)ccc1Br 1464260620 MALMCLGVEGZIPM-UHFFFAOYSA-N 435.387 4.006 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CCC3(CCOCC3)CO2)cc1 1479198021 BULUQEWLDKQNKF-QFIPXVFZSA-N 441.572 4.033 10 10 IICE CCN(C)c1nnc(-c2cc(Br)c[nH]2)n1CCCSc1nccs1 1515326378 ROTBJFLBDQRXIY-UHFFFAOYSA-N 427.397 4.131 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCc3cccc(C)n3)CC2)cc1 1518310554 YZWJERLUNUALJS-UHFFFAOYSA-N 434.588 4.073 10 10 IICE Cc1sc(NC(=O)Cn2nnnc2C(C)C)c(C(=O)OC(C)C)c1-c1ccccc1 1524673303 WCTJTCSYAOQLNN-UHFFFAOYSA-N 427.530 4.037 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@H](C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 1526247583 ZABMZAAEFTUTBL-PWRODBHTSA-N 449.595 4.204 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(NC(=O)C2CC2)s1 1533328776 KWCAAUCKWZRCMW-AWEZNQCLSA-N 435.496 4.097 10 10 IICE COc1cc(CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)ccc1OCCN(C)C 1542924130 SYGRFTKLIPIWBV-UHFFFAOYSA-N 435.568 4.282 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H]2CCN(c3ccccc3Cl)C2)cc1 1544529701 JFJJASBAJHGYHW-IFMALSPDSA-N 442.003 4.440 10 10 IICE CCC(CC)NC(=O)[C@H]1CN(C(=O)c2cc3cc(O)c(O)cc3s2)c2ccccc2O1 1546276135 SPSJPAAYUGMFTC-LJQANCHMSA-N 440.521 4.025 10 10 IICE CN(C)c1ccc([C@H](CNc2ncc(Cl)cc2[N+](=O)[O-])NC(=O)OC(C)(C)C)cc1 1559184052 SPAUIMPTKOTIBF-INIZCTEOSA-N 435.912 4.387 10 10 IICE COc1ccc(N2CCN(Cc3nnc(-c4c(Cl)cccc4Cl)o3)CC2)c(OC)c1 1560082614 HTCCXJQLOONOGJ-UHFFFAOYSA-N 449.338 4.383 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 1564944996 DBYXZJRMAQXYBC-WAOWUJCRSA-N 432.609 4.079 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3cscc3Br)C2)cc1 1564963250 UNFBOPJMQBSWFB-AWEZNQCLSA-N 438.391 4.187 10 10 IICE CC[C@H](C)[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C(=O)OC(C)(C)C 1567204404 MOQHOURTFRZEFS-HJPURHCSSA-N 426.557 4.322 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Br)c(Cl)cc2OC)cc1 1585449266 JIKHUNWHJSKYME-UHFFFAOYSA-N 441.753 4.328 10 10 IICE Cc1cc(C(=O)Nc2ccn(CC(F)(F)F)n2)c(C)n1-c1ccc(Br)cn1 1596748382 KIXJAXUMKYIFTI-UHFFFAOYSA-N 442.239 4.263 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](CO)c1ccccc1C(F)(F)F 1597333245 PGTYOYWZPFMAGG-FQEVSTJZSA-N 430.426 4.389 10 10 IICE FC(F)(F)c1ncnc(NCc2ccc(N3CCSCC3)cc2)c1Br 1611815173 RBIIYTYYMLTPLZ-UHFFFAOYSA-N 433.297 4.423 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1Cc1nccc(C(F)F)n1 1617939820 AGVGKWAYCAQTJJ-UHFFFAOYSA-N 442.495 4.048 10 10 IICE COc1ccc(N(CC(=O)Nc2cccc(C(=O)N(C)C)c2)Cc2ccccc2)cc1OC 1620685529 KSTFAUNLIZQWGZ-UHFFFAOYSA-N 447.535 4.051 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cn(CC(C)C)c4ccccc34)CC2)cc1 1623436655 OELSYWZMMMSKQL-UHFFFAOYSA-N 448.611 4.248 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nn(-c2ccc(Cl)c(F)c2)c2c1CCC2 1627026822 YUYRDRHXBOZSBL-UHFFFAOYSA-N 434.895 4.275 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@@H](O)c3ccc(OCc4ccccc4)cc3)C2)cc1 1629083175 HOGPGTMLLQKWLI-ATIYNZHBSA-N 446.547 4.093 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](C)NC(=O)c1n[nH]c2ccccc12 1631531142 IZYVOMFEMWXBEZ-MSOLQXFVSA-N 442.519 4.177 10 10 IICE C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(Br)cc1)c1ccc(N(C)C)cc1 1634434724 FXRVLOQBNUOREB-QGZVFWFLSA-N 447.421 4.350 10 10 IICE Cc1cc(C)nc(N2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)n1 1637071636 YTEBVEUIJWYRLX-UHFFFAOYSA-N 437.975 4.046 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)c1 1640585024 INFYOIMSCOBQFL-FQEVSTJZSA-N 441.572 4.158 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F 1643283430 VURQCZNHVXIHPF-UHFFFAOYSA-N 430.361 4.214 10 10 IICE C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)OCc1ccccc1)c1ccccc1O 1643744710 AHWOLHJUAUVNJE-XGHQBKJUSA-N 428.529 4.068 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1c(O)cccc1F)c1ccccc1C(F)(F)F 1646034883 NINFQSBCNXLAOP-QGZVFWFLSA-N 442.409 4.432 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1cccc(Cl)c1O)c1ccc(F)cc1F 1648609168 SJQLSOFSWWXXNN-INIZCTEOSA-N 426.847 4.206 10 10 IICE COc1ccc(NC(=O)NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)cc1 1648668997 SWHJQIWWDAGZQI-UHFFFAOYSA-N 449.507 4.067 10 10 IICE C[C@@H](c1cc(F)ccc1F)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1657000679 FEOZTHYRGFJBHZ-AWEZNQCLSA-N 434.442 4.372 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCc1c(O)cccc1Br)C2 1658447759 RRNGBWXZIMHKSR-QDMKHBRRSA-N 425.367 4.422 10 10 IICE Cc1cccc(OC[C@H](O)CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1672133534 WDXKJVOCOPZDLL-AZUAARDMSA-N 445.991 4.124 10 10 IICE CCCCNC(=O)OC[C@@H]1CCCCN1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1682101218 MYQKTULANLQKOM-KNQAVFIVSA-N 432.609 4.082 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C(=O)c4cccc(F)c4)CC3)c2C)c1 1684600403 SSLQFAUKLOHSCI-UHFFFAOYSA-N 448.542 4.209 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C(=O)OC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1694046942 YDVLOILCYCCPES-FPOVZHCZSA-N 439.604 4.076 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(SC)CCOCC1 1698263964 HDPQIAJHTUOTEV-UHFFFAOYSA-N 441.601 4.262 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS(=O)CC1 1726789326 JVKSYDQSHJQFJI-UHFFFAOYSA-N 439.629 4.358 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1747355164 ZIKYJKBIPHIDIL-FQEVSTJZSA-N 425.602 4.331 10 10 IICE C[C@H]1CCCN(CCCCn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)C1 1752174931 OGSVRFZPFJHNRR-RBBKRZOGSA-N 441.620 4.026 10 10 IICE CCN(c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1764788737 RIAQOCFLCFMQFX-HSZRJFAPSA-N 441.620 4.011 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCCOCC1CCOCC1 1767112006 MULLXNUSJHMSJS-UHFFFAOYSA-N 428.577 4.111 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCCOCC1CC1 1768682998 CLNPFPVVPVCIET-IFMALSPDSA-N 442.604 4.355 10 10 IICE O=C(O)CCc1sc(NS(=O)(=O)c2cccc(Cl)c2)nc1-c1cccs1 1858070561 STTYQFXMKJIUOQ-UHFFFAOYSA-N 428.944 4.343 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCOc3ccccc3)C(=O)N(C(C)C)C2=O)cc1 1873164519 FWGRDGDKTJPAKE-UHFFFAOYSA-N 443.547 4.251 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C2(C)CC2)c(CO)c1I 2080004297 YNMIPDOEOVUGIG-HNNXBMFYSA-N 440.325 4.353 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CNCc2c(O)cccc2Br)CC12CCC2 2116697743 DLZMLSZQYPFEJN-CQSZACIVSA-N 425.367 4.424 10 10 IICE CC[C@@H](NCCO[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2165422727 ORNVESKWYKENGR-DOTOQJQBSA-N 443.382 4.221 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3C(=N)N4C(SC)=NSC4=NC3=O)o2)cc1 2297333715 IPLBNCMLNFDBDF-UHFFFAOYSA-N 440.506 4.063 10 10 IICE CCCCOc1ccc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1OC 2313548254 QEDYQUYCPNXGGT-UHFFFAOYSA-N 428.872 4.194 10 10 IICE CCc1ccc(C=C2C(=O)NC(=O)N(c3cc(C)c(C)cc3Br)C2=O)cc1 2313548505 WQZFNODVQAGICZ-UHFFFAOYSA-N 427.298 4.295 10 10 IICE COc1cc(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc(OC)c1O 2313609301 GXERRFZRYFRWJX-UHFFFAOYSA-N 432.479 4.032 10 10 IICE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1ccc(Cl)cc1C 2313683180 TZUBCBLGSXEMAR-UHFFFAOYSA-N 442.859 4.208 10 10 IICE O=C1C(=Cc2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1ccc(Cl)cc1 2332144840 SBISVWVVOQZDEI-UHFFFAOYSA-N 425.750 4.298 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1ccc(Br)cc1O)[C@H]2F 2333286527 ZAPHLZQKQDAQHM-PNBKFKSVSA-N 429.330 4.123 10 10 IICE COc1ccc(N2CCN([C@H](c3cccs3)[C@H](C)NC(=O)c3ccco3)CC2)cc1 4057489 YALGGFXFIBVQKV-JTSKRJEESA-N 425.554 4.032 10 10 IICE Cc1ccccc1COc1ccc(/C=C2\C(=N)N3N=C(N4CCCC4)SC3=NC2=O)cc1 20356297 HGKWEXHGXYANAV-BJRGRWSZSA-N 445.548 4.246 10 10 IICE CN1C(=O)/C(=C2\SC(=S)N(c3ccccc3)C2=O)c2cc(Br)ccc21 40845314 DXFYNWQVBNOABH-PFONDFGASA-N 431.336 4.202 10 10 IICE C[C@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S 47152315 TYZFVOUQVNMBCV-FFCYNSPCSA-N 447.925 4.477 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\[C@H]3C(=O)N(c4ccccc4)N=C3C)SC2=S)cc1 102616615 NMGBCVZMTCOMBW-UIMCMNAESA-N 437.546 4.373 10 10 IICE C[C@H](N[C@H](C)C(=O)N(C)Cc1c(F)cccc1Cl)c1ccc(N2CCOCC2)cc1 734155518 FMJNGJYRHVHGHQ-DLBZAZTESA-N 433.955 4.013 10 10 IICE Cc1noc([C@@H](OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c2ccccc2)n1 766805597 RZOAGKMTKGFBKZ-VWLOTQADSA-N 444.535 4.432 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)NCc2ccc(N3CCSCC3)cc2)c1C(F)F 769125739 BSXPRLDBIJGTFG-UHFFFAOYSA-N 448.461 4.343 10 10 IICE COc1cccc(CNC(=O)C2(c3ccc(OCc4ccccc4)cc3)CCOCC2)c1O 769499437 ZYRKHMINFSHORV-UHFFFAOYSA-N 447.531 4.344 10 10 IICE C[C@@H]1C/C(=C/c2ccc(N(C)C)cc2)c2nc3ccccc3c(C(=O)N3CC(CO)C3)c2C1 773957531 VEFORKKRLPZRES-MKYLKIGJSA-N 441.575 4.488 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1C[C@@H]1c1cccc(Br)c1 804733238 MVGOZBXYNOYLTH-HUUCEWRRSA-N 425.120 4.337 10 10 IICE O=C1COc2cc(N[C@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)ccc2N1 917640079 ZVFCYVFYCCEEFG-FQEVSTJZSA-N 441.447 4.177 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c(C)n1-c1ccc(F)cc1 918576146 PMISKQHIGCCVHX-QZTJIDSGSA-N 436.531 4.172 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1 1124549526 LTIAYNGVPZBELH-DEOSSOPVSA-N 435.568 4.437 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2csc3nc(-c4ccccc4)cn23)cc1 1130745519 ZNUDHDQCVYNZSQ-UHFFFAOYSA-N 434.565 4.209 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(-c4cccc(Cl)c4)s3)CC2)c(OC)c1 1131806188 BJHDWQRSITYBPM-UHFFFAOYSA-N 443.956 4.443 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 1135914799 QMRXUFGZHLJQJK-FOVJLYNBSA-N 433.596 4.495 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](C(=O)NCc2ccc(N3CCCC3)cc2)(c2ccccc2)C1 1136190302 ZXHNJPVAGQXVFV-MHZLTWQESA-N 449.595 4.482 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccc(N4CCOCC4)cc3)C2)C1 1138498387 VGMLCHRAHBHULM-GOTSBHOMSA-N 443.632 4.382 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CCC(=O)OC(C)C)c(C)n1-c1ccc(Br)cn1 1139819549 UAWNOVIJJYFISB-ZDUSSCGKSA-N 436.350 4.102 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C(=O)CCC2CCCC2)CC1 1141527817 COVTYULTYAQKKZ-UHFFFAOYSA-N 435.568 4.161 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)Nc2ccc(C(=O)N(C)C)cc2)cc1 1191891771 LQXKSIYXZZNRHG-UHFFFAOYSA-N 431.536 4.085 10 10 IICE Cc1cc(C[C@@H](C)NC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)n(-c2ccccc2)n1 1224439392 CIMUESGRVJFDOS-VQTJNVASSA-N 433.600 4.417 10 10 IICE C[C@H](NC(=O)C1(C(=O)OC(C)(C)C)C(C)(C)C1(C)C)c1ccc(N2CCOCC2)cc1 1292235344 HHGANIJIFUPOFO-KRWDZBQOSA-N 430.589 4.095 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(N)=O)C1 1294121120 JVFPBEPYIYFAGH-FQEVSTJZSA-N 434.588 4.245 10 10 IICE Cc1ccc(C(=O)NCCOc2ncccc2C(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1295224728 HPYVHHRRPYFDFP-UHFFFAOYSA-N 445.441 4.438 10 10 IICE CCN1C[C@H](C)N(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@@H]1C 1295985281 QYZYFYJDHBYUPM-HOTGVXAUSA-N 446.646 4.404 10 10 IICE CCc1cc2oc(=O)cc(CN3CCN(c4ccc(OC)cc4OC)CC3)c2cc1Cl 1308014345 NWBLCYVDUBFESF-UHFFFAOYSA-N 442.943 4.348 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)cc2)CC1 1438888136 SLAATSYNUYGIHD-UHFFFAOYSA-N 445.523 4.020 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H](c3ccc(Cl)cc3)N(C)C)cc2F)C[C@@H](C)O1 1441786034 POZUSQLFMOWCNG-MCFFVMPBSA-N 433.955 4.012 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1442247074 JBMVLLRAPHFFPB-HSZRJFAPSA-N 432.520 4.119 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](c2ccccc2)C2(CO)CCC2)cc1 1452439829 OTTHPUGSBFQADS-AREMUKBSSA-N 430.548 4.469 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)sc1-c1ccccc1 1462806270 LMUHIDWELUAEOV-UHFFFAOYSA-N 433.577 4.355 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1478448213 LCIIXWPBPUKZKD-HXUWFJFHSA-N 426.561 4.293 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@]2(CCCOC2)C1 1510677046 ZTICGAIGMCKTHF-VWLOTQADSA-N 425.621 4.296 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](OC)C(C)(C)C1 1517763664 KTFRXUQRHVGQSO-GCJKJVERSA-N 437.588 4.249 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc(N3CCCC3)c2)c1 1537583472 PMXPSLRBWIBRFT-UHFFFAOYSA-N 428.536 4.031 10 10 IICE CC(C)(C)Cc1nnc(N2CCO[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1541187832 WFRRIYMIPHNLAX-CYBMUJFWSA-N 449.568 4.273 10 10 IICE C=CC(=O)N1CCC(C(=O)NCc2ccc(N(CC)CC)c(F)c2)(c2ccccc2)CC1 1543251567 SQXKLGKKFCNBBS-UHFFFAOYSA-N 437.559 4.035 10 10 IICE CC[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)[C@H]1CN(Cc2ccccc2)CCO1 1543744722 PVLNGIOVPAAYSM-RRPNLBNLSA-N 445.607 4.432 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCC(=O)c3ccc(Br)cn3)c2C)c1 1558338625 HXWIEWVZCHWZAS-UHFFFAOYSA-N 440.341 4.481 10 10 IICE COC(=O)[C@H](C[C@@H]1CCCc2ccccc21)NC(=O)c1cc(C)n(-c2ccccn2)c1C 1567365484 VCVVZYVHKBIFSM-REWPJTCUSA-N 431.536 4.271 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1584178289 JXVLCCHWVKSZNA-JOCHJYFZSA-N 425.573 4.495 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)cc1 1587686546 ALYSFWTVNLFMBO-FZEVHQGJSA-N 436.577 4.406 10 10 IICE CCCOc1ncccc1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1615022401 DLTOQEWFBHDICA-OAQYLSRUSA-N 437.544 4.094 10 10 IICE COc1ccccc1N1CC[C@H](NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1=O 1622888799 ZXTMZHMWWVAAOP-QFIPXVFZSA-N 431.536 4.255 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H](Cc2cc3ccccc3o2)NC(=O)OC(C)(C)C)cc1 1623316035 NNQANYZEFTUENH-NRFANRHFSA-N 437.540 4.251 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 1623331245 LFOYWMTUVVSAEX-UHFFFAOYSA-N 447.501 4.442 10 10 IICE C[C@@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCC(Cc2ccccc2)CC1 1623641595 WEOUNNBJFZKCJT-OFVILXPXSA-N 436.596 4.243 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C1 1624220630 KTMFXJNXCAMXRX-PKOBYXMFSA-N 439.556 4.282 10 10 IICE C[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)Sc1ccccc1 1629076685 BBOAWSOQYUQNOV-AWEZNQCLSA-N 448.591 4.165 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3[C@H](CCCN3C)C2)c(C)n1-c1cccc(Br)c1 1629819313 QQUMNWKVVCNNRU-UTKZUKDTSA-N 430.390 4.413 10 10 IICE Cc1cc(C)c(C)c(OCCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1630549853 BBXKHQPYHLWPDL-KDURUIRLSA-N 428.548 4.450 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC[C@H](S(=O)(=O)Nc3ccccc3)C2)cc1 1632902041 JLUINSNDFMAISO-QHCPKHFHSA-N 437.565 4.141 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(Oc3ccc(F)nc3)CC2)cc1 1632950486 TWDVDHZBAUWSPN-UHFFFAOYSA-N 435.499 4.053 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)NCc3cccc(Br)c3O)on2)c1 1635839852 MRPPVYTVGQGMHK-UHFFFAOYSA-N 437.677 4.402 10 10 IICE CCCN(C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)C(C)C 1639281129 LXPNGAQSMZPVIZ-GDNBJRDFSA-N 441.416 4.297 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCCN(C(=O)OC(C)(C)C)C1CC1 1639853678 PCKXQWLQQQGKBC-UHFFFAOYSA-N 439.556 4.426 10 10 IICE CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)NCc2cccc(Br)c2O)CC1=O 1640083609 DVUNNTOBAUMQEA-GDBMZVCRSA-N 445.357 4.338 10 10 IICE CO[C@H](C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)[C@@H]1CCOC1 1641202974 PVAJTXXSPZVLRR-VMRPVKRXSA-N 436.474 4.350 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(Cl)cc(Br)c3O)C2)cc1 1641656667 MUUGEQBHAVXQQZ-GFCCVEGCSA-N 439.737 4.073 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)N=S(C)(C)=O)c(C)n1-c1ccc(C(C)C)cc1 1642217205 GCGVPNJHGHNYGI-NRFANRHFSA-N 429.586 4.076 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H]1CCCC[C@H]1c1ccccc1 1676126817 XUYKQHRYPLNZET-DQEYMECFSA-N 448.611 4.256 10 10 IICE Cc1nc(CC2CCN(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)CC2)no1 1681827441 HCDJXNSYCJJURT-INIZCTEOSA-N 445.995 4.432 10 10 IICE CN(Cc1ccccc1)C1(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)CCC1 1682443429 BLJSOYQEVSHMMH-HSZRJFAPSA-N 437.584 4.138 10 10 IICE COc1ccc(N2CCN(C(=O)NCCCCc3ccc(Cl)s3)CC2)c(OC)c1 1682479644 KKMCYXCEPUQUSO-UHFFFAOYSA-N 437.993 4.273 10 10 IICE CCCN(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1683420938 BDVRZPNTLWLYRZ-SIKLNZKXSA-N 446.636 4.423 10 10 IICE Cc1cc(CNC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(C)n1-c1ccccc1 1684603780 DIEXVRPNYXABBP-VXKWHMMOSA-N 438.572 4.387 10 10 IICE C=CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1705894006 KNWGPXVNWYKIBT-FGZHOGPDSA-N 439.604 4.108 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(C)(=O)=O 1709729432 NMELOPCWMODING-UHFFFAOYSA-N 443.617 4.024 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1C[C@](C)(O)c1ccsc1 1711097039 VVBAQOMNXBAQRI-QHCPKHFHSA-N 426.586 4.322 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCOC(C)C 1726986196 LYBPTBCVSGCDAZ-FQEVSTJZSA-N 429.609 4.332 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC[C@@H]3OCC[C@@H]3C2)cc1 1728380983 CNKCRTUSOFVTTG-GGAORHGYSA-N 425.621 4.376 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)NC(=O)OC(C)(C)C 1743567104 NBYBFXCPFMADEF-INIZCTEOSA-N 431.581 4.437 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCC[C@H](OC)C2)cc1 1746091661 DOCJKQPLRQWOTH-VXKWHMMOSA-N 427.593 4.029 10 10 IICE CC(C)N(CCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)C(C)C 1761180142 SBVNEOXUOFXZIK-QFIPXVFZSA-N 429.609 4.371 10 10 IICE CCO[C@H]1CCCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1766170194 XUERQAHISSGLSC-INIZCTEOSA-N 433.603 4.491 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1767706182 WZFKOWYYKVIHAV-DENIHFKCSA-N 437.588 4.393 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)N2CCCCC2)cc1 1866067612 BSCZDMWBKDTPSQ-OAQYLSRUSA-N 430.936 4.271 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](NC(=O)[C@H](C)C3CCCC3)c3ccccc3)CC2)cc1 1868891449 UJSFSJADNYVSHJ-NLFFAJNJSA-N 449.595 4.028 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(CCNCc2cccc(Br)c2O)C1 2140326524 BJAYPIBNJRQKOA-FOIQADDNSA-N 425.367 4.282 10 10 IICE Cc1cccc(C)c1OCCOc1ccc(C=C2C(=O)NN(c3ccccc3)C2=O)cc1 2293641200 AMGINXQIINXRIG-UHFFFAOYSA-N 428.488 4.223 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)C1=Cc1c[nH]c2ccc(Br)cc12 2294137649 UGIJQVYAVKJXCE-UHFFFAOYSA-N 444.672 4.250 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4cccnc4)SC3=NC2=O)c(C)n1-c1ccccc1F 2297468668 UFMVVKSPJMITBV-UHFFFAOYSA-N 444.495 4.296 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1c(O)cccc1Br)[C@H]2F 2333274430 IVIAUTWDKGZDHT-DUUDNCRHSA-N 429.330 4.123 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@H]3C=CC[C@H]32)ccc1O 14459081 GJYFVXFYCNPAAU-JKSBSHDWSA-N 428.554 4.304 10 10 IICE CCOC(=O)[C@H](OCC)c1cc(-c2ccc(S(C)(=O)=O)cc2)n(-c2ccccc2)c1C 40955950 RSDWFRPCZDPSCL-HSZRJFAPSA-N 441.549 4.497 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)c2C)c1 57496418 PPCVUDLRKDFEMI-RUZDIDTESA-N 447.560 4.466 10 10 IICE O=C1/C(=C/NC2Cc3ccccc3C2)C(C(F)(F)F)=NN1c1nc2ccccc2s1 206229575 JNTWXYBYIYVRMS-RVDMUPIBSA-N 428.439 4.202 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnc(-c3cnn(C)c3)s2)cc1 732658451 CEYGHSXCMJEDMT-UHFFFAOYSA-N 447.564 4.465 10 10 IICE C[C@@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)c1nnc(-c2cccs2)o1 745884835 ILAXJAIAMYHEIZ-LLVKDONJSA-N 445.456 4.074 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCC[C@@H](C(F)(F)F)[C@@H]2C)c([N+](=O)[O-])c1Br 775547458 PHBSDYGNYQCKAR-JGVFFNPUSA-N 442.188 4.441 10 10 IICE C[C@@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(N2CCOCC2)cc1 777811678 VPASZSRTUJIJDF-KNQAVFIVSA-N 436.600 4.207 10 10 IICE CCCCNS(=O)(=O)c1cccc(NCc2cc(C)cc(Br)c2O)c1 796402980 UVIPSJIQQYZGEF-UHFFFAOYSA-N 427.364 4.154 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C2CCCC2)n1Cc1ccccc1 802187561 LDADLJOUBIHYQO-UHFFFAOYSA-N 431.584 4.457 10 10 IICE CCOc1ccccc1N1C[C@@H](C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1=O 1131782006 SLVQZVQTZUFINW-QFIPXVFZSA-N 445.563 4.205 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)NCc1ccc(N(C)C)cc1)NC(=O)OC(C)(C)C 1135643316 SGNNZQMIVBTZHQ-OAQYLSRUSA-N 441.572 4.424 10 10 IICE COC(=O)C1(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCCCC1 1136330143 BSFWOTXRICPBGR-UHFFFAOYSA-N 433.346 4.462 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CSCN2C(=O)c2ccc(Cl)cc2)cc1F 1136729468 CBLQZTVYLOVTAL-FQEVSTJZSA-N 449.979 4.157 10 10 IICE Cc1ccc(CNC(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1139137372 BOPBTGCCDOBAMJ-GOSISDBHSA-N 442.991 4.000 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC(=O)Nc2cccc3ccccc23)cc1 1143101149 LKKQZLZTRQEPOR-UHFFFAOYSA-N 439.515 4.357 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H](C)SCc1nc(O)c2ccccc2n1 1155704765 OUCKRQQHTLUBNP-MRXNPFEDSA-N 425.554 4.492 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)c1ccccc1 1269298080 QMSBLQYBUSKBRD-SANMLTNESA-N 436.552 4.155 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)C(C)(C)c1ccccc1 1292724525 JDVOUAONAWVDAX-HNNXBMFYSA-N 444.578 4.351 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H](C)CC3)n2Cc2ccc(N(C)C)c(F)c2)n1 1304756803 UFAMXOLVSFVPRC-KRWDZBQOSA-N 439.583 4.020 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1441909810 DXDISRISIDKEMP-LJQANCHMSA-N 439.547 4.382 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1O 1454803689 FRXKUMCTMDSLAN-FDIDITGRSA-N 430.526 4.000 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc(-c3cccs3)n(-c3ccccc3)n2)cc1 1461343432 GIJBKVNVBMTYGS-UHFFFAOYSA-N 447.564 4.213 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(C(=O)NCC(F)(F)F)cc1 1464060407 ALCNVCOZLNWABI-UHFFFAOYSA-N 443.425 4.451 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc2c(c1)nc(O)n2CC1CC1 1465850175 CLDTUTNVJCCKER-UHFFFAOYSA-N 444.329 4.282 10 10 IICE CC[C@@H](C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)n1nnc(-c2ccc(Cl)cc2)n1 1469106311 KAMUJFTWHMJFSI-KKSFZXQISA-N 440.979 4.066 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2c(O)ccc3ccccc23)[C@@H]1c1ccc(Cl)c(F)c1 1472085256 NVBGCYZAZHWYAI-AOMKIAJQSA-N 426.875 4.174 10 10 IICE O=C(NCc1cccc(Br)c1O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1 1479083169 DLWBNGYRKJAONQ-CYBMUJFWSA-N 442.716 4.025 10 10 IICE CC[C@]1(C)CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1513591024 VOXNNINNTQCGNI-HSZRJFAPSA-N 443.592 4.189 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCc3ccc(SC)cc3)cc2F)CC1 1530377603 WBQZWLMRBMCFNJ-UHFFFAOYSA-N 429.605 4.329 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Br)c(C)s3)cc2F)CC1 1530377647 YCPILVGRUWGZJJ-UHFFFAOYSA-N 440.382 4.030 10 10 IICE CC(C)C(=O)c1ccc([C@@H](C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1535346398 VENRYRBYUULYMX-MRXNPFEDSA-N 430.495 4.060 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2cc(F)ccc2Br)N(C)C)cc1 1537482108 BHUIUVLVFPROLY-HXUWFJFHSA-N 436.369 4.006 10 10 IICE Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1538458282 UWOOVIJRFKCRSM-XMMPIXPASA-N 431.536 4.193 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc3cc(O)c(O)cc3s2)cc1 1544530040 URNBSUGZGMSHRN-SFHVURJKSA-N 426.538 4.200 10 10 IICE Cc1c(C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc(CNC(=O)OC(C)(C)C)n1C 1544884584 LCEMTDUCIWHISD-UHFFFAOYSA-N 442.604 4.475 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc2nc(C(F)F)[nH]c12 1545632053 AAVQMKSTFGYWPB-AWEZNQCLSA-N 434.874 4.254 10 10 IICE Cc1cc(C(=O)NCc2nc(C(C)(C)C)co2)c(C)n1-c1ccc(Br)cn1 1558743127 VLMFXYALAQQDQG-UHFFFAOYSA-N 431.334 4.467 10 10 IICE CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1564587567 JJWMHFXEABFARE-CTNGQTDRSA-N 440.588 4.459 10 10 IICE CCC[C@@H]1CCCC[C@H]1CNC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 1564927235 PJVORPXGTLUWAP-MOPGFXCFSA-N 433.593 4.151 10 10 IICE Cc1ccc(N2CCC[C@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1566112942 SRCOVFPOTUBSPX-DEOSSOPVSA-N 443.547 4.449 10 10 IICE Cc1cc(C(=O)NN2CCc3ccccc3C2=O)c(C)n1-c1ccccc1Br 1566762346 JSSAXYIGYHWTGA-UHFFFAOYSA-N 438.325 4.200 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccc2c(c1)CCO2 1567906192 GPWDNVWSWANBBK-JOCHJYFZSA-N 438.911 4.327 10 10 IICE Cc1nnc(N(C)[C@H]2CCCN(Cc3ccccc3)C2)n1CCCSc1nccs1 1612532527 WTRYFYUQGKFMGT-FQEVSTJZSA-N 442.658 4.326 10 10 IICE Cc1cc(C(=O)N[C@@H](CCC(C)(C)C)C(N)=O)c(C)n1-c1ccccc1Br 1618095467 IRVJHZCJVXPYKP-KRWDZBQOSA-N 434.378 4.267 10 10 IICE Cc1nn(C)c(Sc2ccccc2)c1C(=O)NCc1cccc(Br)c1O 1623363897 MBRSMYKMWHOGLX-UHFFFAOYSA-N 432.343 4.278 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1624819482 OLVNXCCHBSHAPT-CALCHBBNSA-N 448.405 4.086 10 10 IICE Cc1cc(C(=O)NC[C@H](ONC(=O)OC(C)(C)C)C(C)C)c(C)n1-c1ccc(F)cc1 1630330294 SVPWHLHPROTTKU-FQEVSTJZSA-N 433.524 4.444 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1csc(Br)c1 1631425377 DBOSITNLLGRXFH-CQSZACIVSA-N 429.767 4.264 10 10 IICE COc1ccc(N2CCC(NC(=O)C3=Cc4ccccc4O[C@@H]3C(F)(F)F)CC2)cc1 1632045163 YHVGDSGUIQOEBK-NRFANRHFSA-N 432.442 4.187 10 10 IICE O=C(NCc1cccc(Br)c1O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F 1635840814 XNGDLYFAPBNWDS-INIZCTEOSA-N 428.204 4.178 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@]1(C)CCNC(=O)C1 1638240765 GWVYFJNPBHWMCR-PGRDOPGGSA-N 433.474 4.214 10 10 IICE O=C(NCc1c(O)cccc1F)c1nn(-c2ccc(Br)cc2)c2c1CCCC2 1646029391 XGFLPXUPMFZRGE-UHFFFAOYSA-N 444.304 4.288 10 10 IICE CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@H](C)c1ccccc1O 1648889710 INVKSLZVFOCVGU-PXAZEXFGSA-N 441.380 4.428 10 10 IICE CCO[C@@H]1C[C@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1653657506 SYLFOHGMKIUTJO-FCHUYYIVSA-N 448.563 4.316 10 10 IICE O[C@@H](c1ccc(Br)cc1)[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 1653761987 SDLWTFSDMQKGOM-REWPJTCUSA-N 445.401 4.231 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)Nc1ccc(I)cc1 1653811072 XNJBUHYBBKKBOY-UHFFFAOYSA-N 436.293 4.081 10 10 IICE COC(=O)c1ccc2c(c1)OCCN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)C2 1674930428 VBDLGZFMGBQKBY-UHFFFAOYSA-N 447.535 4.027 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)Cc3ccc(N4CCCCC4)cc3)C2)cc1 1683337126 VGCSTBJCRNLBGC-QFIPXVFZSA-N 436.600 4.353 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@@H](C)C3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1692986066 PZFLRKJFHYRTQB-OALUTQOASA-N 448.615 4.360 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CC=C(C(F)(F)F)CC1 1693005356 HDCCHVHVKMELJR-UHFFFAOYSA-N 442.489 4.462 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC[C@@H]1CC 1696248485 MWEMQYRVGKUMGV-FCHUYYIVSA-N 441.620 4.114 10 10 IICE C=C(Cl)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCn1cccn1 1705745674 MMUOLFIRXJWRAI-UHFFFAOYSA-N 435.963 4.438 10 10 IICE CCN(CC)[C@@H](Cn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1O)c1ccco1 1710019835 MMCUYLIXNMIBHM-NRFANRHFSA-N 446.555 4.358 10 10 IICE CN(CC1CCCC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1729463250 CMOKGISSMVEMJB-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743782356 GRAJESYJRVFZLP-SIKLNZKXSA-N 443.661 4.254 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)c(F)c1 1770546609 OEUBOGPFYGLOBB-QGZVFWFLSA-N 442.608 4.095 10 10 IICE CC1CCN(C(=O)CCn2c3c(c4ccccc42)CCn2c-3nc3ccccc3c2=O)CC1 1860345223 VKOKQRCMEOQJLS-UHFFFAOYSA-N 440.547 4.223 10 10 IICE CC[C@](C)(NC(=O)c1cccc2ccccc12)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1862238387 ZYQQZOORLBANQF-MHZLTWQESA-N 445.563 4.096 10 10 IICE O=C(O)[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@H]1c1cccc(O)c1O 1894505211 MREDBZWFRKONFP-LEWJYISDSA-N 445.471 4.147 10 10 IICE COc1cccc([C@@](C)(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c1O 1951737777 IFKXWZWZUNBRGZ-RUZDIDTESA-N 433.460 4.239 10 10 IICE Cc1c(C2CC2)nn(Cc2cccc(Br)c2O)c1I 2079789601 PNBLRBDITYLZOR-UHFFFAOYSA-N 433.087 4.190 10 10 IICE COCCOCCN(Cc1ccccc1)c1ccc(CNC2CC2)c(Br)c1 2152221849 CFQZZANBZNLYSM-UHFFFAOYSA-N 433.390 4.371 10 10 IICE C[C@]1(CCOCc2ccccc2)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2197750973 BBKPWGXWFFOUMB-PZJWPPBQSA-N 431.330 4.010 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C23CCC3)c1O 2236048304 AOPIECZCEANEAA-JKSUJKDBSA-N 441.366 4.089 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2cc(OC)ccc2OC)SC1=S 2314767033 CSOVBEHXOUILPM-LJQANCHMSA-N 443.546 4.209 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc(O)cc2)SC1=S)Nc1cccc(C(F)(F)F)c1 2314828972 XMDCAGROYQJBPX-UHFFFAOYSA-N 438.452 4.251 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)ccc1O[C@@H](C)C(=O)O 2314935053 MTUSOMKVDCPWTD-LBPRGKRZSA-N 447.509 4.482 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)C(=Cc3ccc4c(c3)OCO4)SC2=S)c1 2321683306 OJXJZPUMBUEESO-UHFFFAOYSA-N 433.894 4.261 10 10 IICE O=C1C(=Cc2cc(Br)ccc2O)C(C(F)(F)F)=NN1Cc1ccccc1 2332124869 YYSYKBFZFZSODQ-UHFFFAOYSA-N 425.204 4.499 10 10 IICE Cc1cccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(-c4ccc(C)cc4C)c3O)C2=O)c1 38161191 WLSSEIQDTYONSJ-UNOMPAQXSA-N 430.464 4.318 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)c2C)c1 57496421 PPCVUDLRKDFEMI-VWLOTQADSA-N 447.560 4.466 10 10 IICE COc1ccc(N2CCC(NC(=O)c3nn(-c4ccc(F)cc4)c4c3CCCC4)CC2)cc1 110353206 QBWIPALQFKQVFC-UHFFFAOYSA-N 448.542 4.298 10 10 IICE CC(=O)c1ccc(N2C(=O)/C(=C/c3cccc(OCCC(=O)O)c3)SC2=S)cc1 210420755 JGNXSDKIIOXCMM-PDGQHHTCSA-N 427.503 4.149 10 10 IICE Nc1ccc(CCC(=O)Nc2cc(Br)ccc2I)cc1 383598617 NOGOEBUFHQRNJM-UHFFFAOYSA-N 445.098 4.207 10 10 IICE CCOC(=O)C1=C(C)N(C)C2=S=C(c3ccccc3)C(=O)N2[C@@H]1c1ccc(Cl)cc1 584906368 IMLQLXOAOITFOR-LJQANCHMSA-N 440.952 4.047 10 10 IICE CCOc1c(F)cccc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742749689 KEDYLYSKYSEDQZ-FQEVSTJZSA-N 445.535 4.286 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC3C[C@H]4CC2C[C@@H](C3)C4)c([N+](=O)[O-])c1Br 744171305 IRUUMZGRHDSBMS-ZYANWLCNSA-N 426.267 4.289 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CCCC[C@@H]2c2ccc(F)cc2)c1 751950380 PFUYTYUOWUSNRL-XMMPIXPASA-N 426.532 4.293 10 10 IICE Cc1ccc([C@@H]2CCN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)cc1 753206425 HRJLUUPNQWPGOD-QGZVFWFLSA-N 442.562 4.193 10 10 IICE CC(C)N(Cc1ccccc1F)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769032358 BXLCHQURVCTCPG-UHFFFAOYSA-N 438.591 4.478 10 10 IICE COC(=O)c1ccc([C@@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C(F)(F)F)cc1 776020808 STOONSVEFFWVJU-LJQANCHMSA-N 436.430 4.160 10 10 IICE O=C([C@@H]1CCn2c(cnc2C2CCCCC2)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 777808465 BMXMLTWKWVLRSD-OFNKIYASSA-N 437.584 4.407 10 10 IICE CCN1CC[C@@H](NCc2cccc(Br)c2O)[C@@H]1c1cc(F)c(F)c(F)c1 782391235 JPEAAMSNYSVFQM-AEFFLSMTSA-N 429.280 4.497 10 10 IICE CCOCCCn1c(-c2ccccc2Br)nnc1N(C)Cc1ccccc1O 812191484 GHLPWZVDTSHSHZ-UHFFFAOYSA-N 445.361 4.476 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CCCCC(=O)c3ccccc3)cc2F)C[C@@H](C)O1 918140328 LBGZROZIKXRCMR-RTBURBONSA-N 426.532 4.499 10 10 IICE COC(=O)c1c(CN2CCc3c(ncn3CCc3ccccc3)C2)c2cc(F)ccc2n1C 929067528 DKSPNDJXKMGDFJ-UHFFFAOYSA-N 446.526 4.102 10 10 IICE Cc1cc(CC(=O)N2CCSC[C@@H]2c2cnn(C)c2)c(C)n1-c1ccc(Cl)cc1 1128751509 YPZAFVQAENBKQR-OAQYLSRUSA-N 428.989 4.340 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3sc(C)nc3-c3cccs3)CC2)c(OC)c1 1132031918 BUYZNYIRWUEEGP-UHFFFAOYSA-N 443.594 4.089 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc4[nH]cc(I)c4c3)ccc21 1136436724 HINKRKGNOHXSBR-UHFFFAOYSA-N 445.304 4.085 10 10 IICE Cc1cc(C(=O)NCc2ccccc2CN(C)C)c(C)n1-c1ccc(Br)cn1 1136651564 MISJXIBAJYXHLN-UHFFFAOYSA-N 441.373 4.243 10 10 IICE O=C(NCc1cc(Cl)ccc1O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1 1146232467 LSAOPUXFHSHAQZ-UHFFFAOYSA-N 440.849 4.233 10 10 IICE Cc1ncc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c(Cl)c1Cl 1160600288 UOLQSQCLZJXYQA-VXGBXAGGSA-N 426.319 4.380 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2ocnc2C(=O)NCc2cccc(Cl)c2O)CC1 1180421099 VXAJVJVYOFRYJJ-UHFFFAOYSA-N 435.908 4.078 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3cc(C(F)(F)F)ccc3C2)N(C)C)cc1 1251500036 BMQBVSXCIOYQHZ-NRFANRHFSA-N 434.506 4.142 10 10 IICE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1251980673 CNAHKESUPPDVBW-DENIHFKCSA-N 446.636 4.423 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(CNC(=O)NCc2c(O)ccc3c2CCCC3)cc1 1252157579 LXMYUJVGPHCEAL-UHFFFAOYSA-N 439.556 4.295 10 10 IICE O=C(N(Cc1ccccc1O)C[C@@H]1CCCO1)C(F)(F)c1ccc(Br)cc1 1295406092 OERFBMJSIZSHIQ-KRWDZBQOSA-N 440.284 4.454 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CC(C)C)c1ccc(Cl)cc1 1296055779 WYTNFUOYIONHFR-MOPGFXCFSA-N 433.932 4.172 10 10 IICE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1301350760 YRIWMNNRXFGMID-JQIJEIRASA-N 434.458 4.266 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)CC[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1304750009 OETURABISCCLCB-FUHWJXTLSA-N 439.583 4.018 10 10 IICE CC[C@H](C)N[C@@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccco1 1306840156 PHQBUVRZOQSNIU-UGKGYDQZSA-N 436.600 4.246 10 10 IICE Cc1cc(C(F)(F)F)n2nc(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)cc2n1 1438305101 SNXMLSQRIWIKDH-UHFFFAOYSA-N 427.430 4.394 10 10 IICE Cc1cc(C(=O)N(C)Cc2nccn2C(F)F)c(C)n1-c1ccc(Br)cn1 1440303436 GSZMZYCZMKVWIM-UHFFFAOYSA-N 438.276 4.115 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@H](O)C(F)(F)F 1447072288 MEYYRNZLALZKNV-HOTGVXAUSA-N 433.268 4.288 10 10 IICE Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NCc3cc(Cl)ccc3O)cc2)ccc1F 1452945019 KVIHKFJOFOUNBI-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CCS(=O)(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc1 1453587697 IQHYYHGXTRNCAH-UHFFFAOYSA-N 425.554 4.441 10 10 IICE CC(=O)N1CCN(c2ccc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)cc2)CC1 1455024624 QASGQXIQXIYHCP-UHFFFAOYSA-N 430.552 4.323 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1cc(Br)cnc1OCC1CC1 1456311451 UAJQJSLVABKXOO-UHFFFAOYSA-N 427.298 4.422 10 10 IICE C[C@@H](NC(=O)CCOc1ccccc1I)c1ccc(N(C)C)cc1 1459175870 ABFAKLHJKGTGJB-CQSZACIVSA-N 438.309 4.004 10 10 IICE COc1ccc(N(C)CCN(C)Cc2nc(-c3ccc(Br)s3)no2)cc1 1460335223 NGSIJOOQPGGDIG-UHFFFAOYSA-N 437.363 4.137 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(NC(=O)C(C)(C)C)ccc3F)C2)cc1 1461075277 DILDEYKOHNAKCX-INIZCTEOSA-N 427.520 4.075 10 10 IICE CC(=O)[C@@H]1CC(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)=NN1c1ccccc1 1464534367 AJFFWPICFLYDKJ-VWLOTQADSA-N 432.568 4.296 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@](C)(O)c2cccc(Cl)c2)CCCC1 1466665102 DLAPVAPVRHCZKA-XMMPIXPASA-N 426.944 4.206 10 10 IICE Cc1ccc(CN(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)s1 1510853681 KHLIYLMZVROMKH-UHFFFAOYSA-N 445.643 4.324 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CC(F)(F)Br 1517148489 OHEOKSPPYUWDBU-UHFFFAOYSA-N 443.317 4.260 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)sc2c1CCCCC2 1526801700 ZORDROKHZRQGJW-LBPRGKRZSA-N 448.491 4.073 10 10 IICE CCOC(=O)[C@@](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)(C1CCC1)C(F)(F)F 1531986722 TWMLYUHSHFYPDT-QFIPXVFZSA-N 436.474 4.417 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4cccc(C)c4nc3Cl)cc2F)CC1 1537536010 VLXQGQGYZKDWFY-UHFFFAOYSA-N 440.950 4.408 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncsc1Nc1cccnc1 1545043323 XYYJVIAMZWSJTE-OAHLLOKOSA-N 445.495 4.282 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1ccccn1 1545503515 BYNGMZCXQSTCJX-HXUWFJFHSA-N 434.588 4.155 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc(N(C)C)cc1 1568378291 BMNZLIZYMKYTGF-XZOQPEGZSA-N 437.584 4.245 10 10 IICE CCc1cc2c(CC(=O)NCCN3CCN(c4ccc(OC)cc4)CC3)csc2s1 1583758449 PYBFPDHZILDXFP-UHFFFAOYSA-N 443.638 4.015 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)c2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1 1612211032 BVDBRNOHYVYNNX-LJQANCHMSA-N 442.503 4.232 10 10 IICE CCc1cc(=O)oc2c(CN(CCCOC)C[C@H]3CCCN4CCCC[C@H]34)c(O)ccc12 1614472577 TYHDYQQWUXVKAV-NFBKMPQASA-N 442.600 4.164 10 10 IICE CC(=O)Nc1cccc2c1CCCN2C(=O)/C=C\[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1625273200 FQTCZEWBHXRPOE-MENFKHAKSA-N 427.545 4.128 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCC3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1 1627154514 SDXUOVCJQOZRTB-HXUWFJFHSA-N 445.604 4.065 10 10 IICE COC(=O)CCCc1nnc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)s1 1634293415 WYMVAXHCPDCWSQ-UHFFFAOYSA-N 426.542 4.310 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCC(=O)NCc2cccc(Br)c2O)C1 1634724810 JJOWPLHLZGPZTI-CQSZACIVSA-N 441.366 4.198 10 10 IICE Cc1[nH]nc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1Br 1635126789 OFHPTVNLYJRBAC-NSHDSACASA-N 425.758 4.300 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@]1(C)CCOC2(CCC2)C1 1638543182 USPIFFXSYNFCMA-IBGZPJMESA-N 425.367 4.426 10 10 IICE Cc1cc(C(=O)NCC(C)(C)C2CCOCC2)c(C)n1-c1ccc(Br)cn1 1639625937 UKBQTDNYGVDIGW-UHFFFAOYSA-N 434.378 4.434 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1643394870 ZHGHNPHTGPOLTP-XXBNENTESA-N 443.950 4.305 10 10 IICE Brc1cc(CN2CCN(Cc3cccnc3)CC2)ccc1N1CCCCC1 1652155963 NMZMPYAIGLCDRI-UHFFFAOYSA-N 429.406 4.152 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCC3CCN(CC4CC4)CC3)cc2Cl)C1 1681827715 KWGOMBXULFFZOR-GOSISDBHSA-N 433.040 4.498 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1cc(NC(=O)OC(C)(C)C)ccn1 1682101592 SRVMNBZTVAILFF-KRWDZBQOSA-N 441.576 4.233 10 10 IICE CC(C)(C)O[C@@H]1C[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@H]1n1cccn1 1682610122 ZWIPZLFKUHRBMJ-CEMLEFRQSA-N 438.528 4.091 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1C[C@H](C(=O)OCc2ccccc2)C1 1683584760 FTFXYSSBQGURQI-YHBQERECSA-N 435.568 4.340 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)NC[C@@H]2CCC(C)(C)CN2C(=O)OC(C)(C)C)c1 1684682559 UOYJDMMWDYFJNO-CVEARBPZSA-N 435.565 4.187 10 10 IICE COC(=O)c1ccccc1CCNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1686269661 VQTWFBHLXWKBRO-QGZVFWFLSA-N 443.975 4.405 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCCC[C@@H]3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1694712253 XCXKBLJKYGLODW-FPOVZHCZSA-N 442.627 4.185 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3[C@@H]3CCC[C@@H](C(F)(F)F)C3)CC2)cc1F 1697471465 BURGCRKMOAVWFH-NVXWUHKLSA-N 441.473 4.354 10 10 IICE CC(C)Cc1nnc(N2CCN(C3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1706429915 UOJHSXMXZQFOHX-UHFFFAOYSA-N 442.627 4.185 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N(C)Cc2ccc(Br)o2)cc1 1710025002 MHUBYLPOZXZNSV-UHFFFAOYSA-N 432.366 4.473 10 10 IICE CC1CCN(c2ccc(Cn3c([C@H]4CCCO4)nnc3N(C)CCCCCO)cc2)CC1 1726598202 PZVYTSYEPPFMFF-HSZRJFAPSA-N 441.620 4.013 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)CCC2CCOCC2)cc1F 1729329940 KQOCNRAXMJMHMD-QFIPXVFZSA-N 445.583 4.026 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1CCCOC1CCCCC1 1729420149 IGGRAZFXRVTOGP-FQEVSTJZSA-N 428.577 4.254 10 10 IICE CCC(CC)c1cc(Cn2c(C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)on1 1762176760 GKQYNZCFDNWGLV-UHFFFAOYSA-N 438.576 4.252 10 10 IICE CC[C@]1(C)CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1764339408 GUIBQOSMRLLPIQ-XMMPIXPASA-N 429.584 4.127 10 10 IICE CC(C)(C)OC(=O)N(Cc1cc(Cl)cc(Cl)c1O)c1ccc(S(N)(=O)=O)cc1 1887505970 CBDPJDFOWCDABN-UHFFFAOYSA-N 447.340 4.288 10 10 IICE COc1ccc(Br)c(CN[C@@H](CNC(=O)OC(C)(C)C)C2CCCC2)c1O 2236055033 NLNSYXKPUCLACP-INIZCTEOSA-N 443.382 4.336 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCCC(=O)Nc3ccccc3)C2=O)ccc1O 2314828408 TXRHMLHAZWZPRR-UHFFFAOYSA-N 442.562 4.411 10 10 IICE C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314836469 FPIQREHFMBXADA-NSHDSACASA-N 447.925 4.477 10 10 IICE Cc1ccc(CNC(=O)CCCCCNC(=O)OC(C)(C)C)c(O)c1Br 2352638922 ZFZQSCDZAQGPQX-UHFFFAOYSA-N 429.355 4.164 10 10 IICE Cc1ccc(CN[C@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c(O)c1Br 2352673482 XFFXORAWGBFMTH-PHZGNYQRSA-N 425.367 4.483 10 10 IICE Cc1ccc(CN[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)c(O)c1Br 2352680923 SLTOHMKFPUTWBT-OAHLLOKOSA-N 425.367 4.342 10 10 IICE Cc1ccc(CN[C@H]2CN(C(=O)OC(C)(C)C)C3(CCC3)C2)c(O)c1Br 2352685611 GBZRDGGCJIMECO-OAHLLOKOSA-N 425.367 4.485 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2[C@@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380771946 KUYXCBJPQCQBNV-XJKSGUPXSA-N 441.366 4.067 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCC1 13639856 HCTRFWHLEDSEDK-BSRJHKFKSA-N 426.538 4.099 10 10 IICE O=C1/C(=C\c2ccco2)SC(=S)N1CCC(=O)N1CCCC[C@@H]1c1cccnc1 33537038 PKAJEVRUMGRTJD-CLEQQJOVSA-N 427.551 4.020 10 10 IICE CC(/C=C1\SC(=S)N(CCCCCC(=O)N2CCOCC2)C1=O)=C\c1ccccc1 39793573 OGRWYVPGNJOZLY-MOKUSBMGSA-N 444.622 4.253 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC3CCN(C(=O)C4CCCCC4)CC3)c2C)cc1 108624422 ZTDZOTHZVRJIOM-UHFFFAOYSA-N 437.584 4.404 10 10 IICE CC(C)n1cnc(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)c1 753919077 UJRHGIBZXSIHLX-UHFFFAOYSA-N 433.378 4.212 10 10 IICE C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 754143818 XEQAZGXVKJHOSR-JOQXAKKRSA-N 427.476 4.067 10 10 IICE Cc1sc(NS(=O)(=O)c2cc3c4c(c2)CCC(=O)N4CCC3)nc1-c1ccccc1 758385433 RLFWYINJEBCSRM-UHFFFAOYSA-N 439.562 4.145 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCN(C)[C@H]3c3ccc(Cl)cc3)CC2)cc1 760368197 DJNMHCGILOZRIY-PKTZIBPZSA-N 442.991 4.062 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN(C)Cc3nc(-c4cccnc4)no3)c2C)cc1F 768551853 NSVYOKRWFPVEHV-UHFFFAOYSA-N 433.487 4.301 10 10 IICE O=C(Nc1ccc(N=Nc2ccccc2)cc1)N1CCCN(S(=O)(=O)C2CC2)CC1 801650074 NQNUELYKEIQNBQ-UHFFFAOYSA-N 427.530 4.134 10 10 IICE COc1ccc(-c2nnc(NC(=O)NCc3cc(Br)ccc3O)s2)cc1 806431969 IHOHSGAINXKLGO-UHFFFAOYSA-N 435.303 4.004 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 812307107 BPEMRZVSERASBD-OAQYLSRUSA-N 432.528 4.156 10 10 IICE C[C@@H](N[C@H](C)c1ccc(N2CCOCC2)cc1Cl)c1ncc(Br)cn1 815634383 JTZJHJKWXYWELD-CHWSQXEVSA-N 425.758 4.141 10 10 IICE COc1ccc2c(/C=C3/SC(=S)N(CCc4ccccc4)C3=O)c(C(=O)O)[nH]c2c1 1081155567 ULRBMRHFKZBBPT-LDADJPATSA-N 438.530 4.319 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1oc(C2CC2)nc1C(F)F 1126581836 HFNNXSFVZVINPT-GFCCVEGCSA-N 427.398 4.490 10 10 IICE Cc1cc2c(cc1NC(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)OCO2 1127885678 YULDIGQLVSWZIY-GIJQJNRQSA-N 444.509 4.093 10 10 IICE C[C@H](C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1C(F)(F)F 1129661563 OSGVUGANISUORD-ZDUSSCGKSA-N 428.401 4.240 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)cc1 1130544523 QVTMQVCTQKKVQC-UHFFFAOYSA-N 433.339 4.396 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1OC(F)F 1143013661 RUGPBYIMOOGEGC-UHFFFAOYSA-N 442.462 4.489 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc4c(Br)cnn4c3)cc2)CC1 1144773379 MZALFNVFNHSFDW-UHFFFAOYSA-N 427.346 4.263 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C(=O)OC(C)(C)C)[C@H](C4CC4)C3)ccc21 1154438757 DDFWBGGPWOWJKK-FCHUYYIVSA-N 440.584 4.344 10 10 IICE COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1155017319 YNDKXSNNMRIDCN-ORAYPTAESA-N 433.346 4.270 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N(C)CCCc1ccccc1 1168942710 YPSMDWNYXNFIQP-GOSISDBHSA-N 426.516 4.354 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(O)nc4ccc([N+](=O)[O-])cc34)c2C)c1 1170856615 BHBQBKDJPNMYMR-UHFFFAOYSA-N 430.464 4.495 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H]4[C@H]3CCN4C(=O)OC(C)(C)C)cc2)CC1 1197146300 PXPCKGUPGIURAJ-DHIUTWEWSA-N 429.605 4.276 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2C[C@@H](OCc3ccccc3)C2(C)C)cc1 1226856095 BHRHTUKDLZECQO-XZOQPEGZSA-N 425.573 4.157 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cccc2nccnc12 1288080601 JHCBLCJKLLSJAG-VBKFSLOCSA-N 440.575 4.311 10 10 IICE Cc1cc(C(=O)NCCc2ccc(N(C)C)cc2)c(C)n1-c1ccc(Br)cn1 1292545822 KGLHKXBKVZMVEB-UHFFFAOYSA-N 441.373 4.290 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1F 1293224906 IRGWBVIAFYCNQO-NRFANRHFSA-N 443.563 4.424 10 10 IICE Cc1cc(C(=O)NC[C@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1293622115 ROLLREURKWASLY-QFIPXVFZSA-N 427.342 4.494 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2conc2C2CCCC2)NC(=O)OC(C)(C)C)cc1 1293793077 LCEWIXIMXPBVTJ-FQEVSTJZSA-N 442.560 4.394 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCOC1 1306565553 DSXDHCCTSSCPBA-IQGLISFBSA-N 437.588 4.129 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4ccccc4F)CC3)C2)cc1 1312902499 LYEPMNMWBKZDEX-FQEVSTJZSA-N 425.548 4.325 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccccc2S(=O)(=O)C(C)C)CCCC1 1359856457 JATYFXONMWSINB-UHFFFAOYSA-N 440.565 4.350 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4c(Cl)cccc4nc3C)cc2F)CC1 1360094177 TXZUVMUJHASTTK-UHFFFAOYSA-N 440.950 4.408 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cnn(-c2ccc(F)cc2)c1 1435062677 BPFVRXOXELESNX-UHFFFAOYSA-N 430.430 4.012 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CN(Cc4ccccc4)CCO3)cc2Cl)C1 1436046196 AVUKQKYGVWZOPT-CYFREDJKSA-N 442.003 4.094 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c1 1446563222 DOODXRQKFKGTAA-DEOSSOPVSA-N 432.520 4.434 10 10 IICE CC(C)(C)OC(=O)/C=C/c1cc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)co1 1446571570 YMPGUBGYYXWXNX-CTDFXDFQSA-N 427.497 4.162 10 10 IICE COC(=O)COc1ccc([C@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1447456622 SKNHICFHGFZGHU-SFHVURJKSA-N 448.519 4.258 10 10 IICE CCC[C@H](C)C(=O)NCCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1450025243 SXLLPYWSMAWTTD-AWEZNQCLSA-N 434.378 4.139 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C(F)(F)c3ccccc3OC(C)C)cc2F)CC1 1456124461 CHJGXMWUZDZVNU-UHFFFAOYSA-N 449.517 4.163 10 10 IICE CC(C)CC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1459718783 DZXKOZPMANOSSL-ONTIZHBOSA-N 433.612 4.346 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1459836895 CERPKJHKXYHBDA-HYFFOGBASA-N 447.982 4.450 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)CCCC1 1461738995 WOGWSMJSCOCLGO-RUZDIDTESA-N 441.572 4.044 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1oc2ccccc2c1Br 1469230186 HHAABKNGIDTIIM-UHFFFAOYSA-N 432.270 4.106 10 10 IICE CCc1ccc(CN2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)s1 1470555361 DPXCBKGVWZKONA-IBGZPJMESA-N 428.646 4.143 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCC3(CCOCC3)O2)c(C)n1-c1cccc(Br)c1 1472174566 YKBQROMQMHFQDM-IBGZPJMESA-N 447.373 4.315 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1Cc1cccc(Br)n1 1517146892 HVQIWVALNJHECW-UHFFFAOYSA-N 442.361 4.484 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1nccs1 1517767517 ZCHJTBONFSZGNA-QGZVFWFLSA-N 436.585 4.480 10 10 IICE CCSc1ccc(Cl)cc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261976 RUACHTBDVSGDDU-UHFFFAOYSA-N 426.916 4.497 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3ccc(OC)cc3Br)C2)cc1 1537108575 AGZRWVLPCINPGJ-MRXNPFEDSA-N 447.373 4.042 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@H]2CSc3ccccc3O2)cc1 1544523408 BIKRASULFITZDO-RTWAWAEBSA-N 426.582 4.204 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCN1CCc2sccc2C1 1545337221 QGSUJMRNQKICFV-KRWDZBQOSA-N 425.602 4.253 10 10 IICE CCOc1ccc(C[C@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1545632281 HFVVAXGIJIPZPV-UWJYYQICSA-N 430.976 4.404 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(=O)(=O)CC 1547105176 FPEMHLPODLXDKQ-UHFFFAOYSA-N 443.617 4.024 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3cc(F)c(Br)cc32)c(C)n1-c1ccccn1 1556351328 WALOEPMDCSPGEJ-QGZVFWFLSA-N 430.277 4.254 10 10 IICE CCCN(CC(=O)Nc1ccc(I)cc1C)Cc1ccccc1O 1559570799 CVQVVMJYUSWEHJ-UHFFFAOYSA-N 438.309 4.156 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@@]3(C)c3ccc(C(F)(F)F)cc3)nc12 1560074532 WYHNENOWCBYSBQ-NRFANRHFSA-N 448.445 4.142 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(c2cccc(Cl)c2C)CC1 1564946169 LDVBWGHDJFKDJI-GOSISDBHSA-N 429.008 4.486 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCO[C@H]3c3ccc(Cl)c(F)c3)C2)cc1 1564963485 YASSTSGSPPEOJF-RTOPAQNCSA-N 447.938 4.143 10 10 IICE COc1cc(/C=C/C(=O)Nc2ccc3nc(N(C)C)ccc3c2)cc(Br)c1O 1583555730 JCRZENSEJBJRBB-RUDMXATFSA-N 442.313 4.429 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1 1583569278 GPXIRRWTARQKLF-NRFANRHFSA-N 443.510 4.291 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1ccc(S(=O)(=O)C2CCC2)cc1 1587475624 HAMQPZYBOLMMJC-UHFFFAOYSA-N 426.582 4.275 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(NCCc4ccccn4)cc3)CC2)cc1 1596964983 VMPZBDZTRQLXIS-UHFFFAOYSA-N 430.552 4.097 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(F)c(C(=O)CC)c1 1618427400 MVYCZBYRBPTMAV-UHFFFAOYSA-N 428.504 4.421 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](O)c1ccccc1C(F)(F)F 1626479167 DJYIAWRJCLPSHP-GOSISDBHSA-N 444.400 4.125 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccn(-c2ccc(Cl)cc2)n1 1630257163 PWUZNEHXMXIGRH-SFHVURJKSA-N 445.350 4.279 10 10 IICE COc1ccc(Br)cc1-c1ncc(C(=O)NCc2cccc(OC)c2O)s1 1630366271 NVYSJJGOPPGMLU-UHFFFAOYSA-N 449.326 4.225 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Br)ccc1F 1631425904 RQDBXZHKQACIBB-OAHLLOKOSA-N 441.728 4.342 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](Cn2ccnc2)c2ccccc2)cc1 1633155218 KOJSVUDYSQAXAO-VWLOTQADSA-N 426.520 4.203 10 10 IICE CCCc1c(C(=O)NCc2cccc(Br)c2O)cnn1-c1ccc(F)cc1 1634724842 JUSXJVJCPMBOBL-UHFFFAOYSA-N 432.293 4.362 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccncc3)C(=O)OC(C)(C)C)c2C)cc1 1639111900 ZCEKHXOTYNVLIY-QHCPKHFHSA-N 449.551 4.181 10 10 IICE COC[C@]1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CCCCN1C(=O)OC(C)(C)C 1641997577 RPGPJKIVHNSFSY-FQEVSTJZSA-N 447.359 4.121 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCC3(NC(=O)OC(C)(C)C)CCOCC3)c2C)c1 1645506339 XVWGTUXSFUYCFQ-UHFFFAOYSA-N 441.572 4.206 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC(C)(C)Cc3ccc(C(F)(F)F)cc3)cc2)CC1 1675580623 SJXZCRSQXQNSTL-UHFFFAOYSA-N 448.533 4.278 10 10 IICE COc1cccc(CNC(=O)N[C@@H](Cc2cccc(Br)c2)CC2CC2)c1O 1681709010 XBWLBABYBHEWPD-GOSISDBHSA-N 433.346 4.374 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H](c4ccc(F)c(F)c4)C3)C2)cc1 1683504316 PVGKZVFYHUKPMO-MJGOQNOKSA-N 429.511 4.389 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(Cc3ccccc3)C[C@@H](O)c3ccccc3)C2)cc1 1683782682 SJBMOSLKMUYUKQ-JYFHCDHNSA-N 445.563 4.219 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 1684280557 MSGPKKCZIWUOKL-IBGZPJMESA-N 447.501 4.366 10 10 IICE CC(C)(C)OC(=O)Nc1ccnc(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)c1 1685276549 IRQLQBQBTHIBIL-UHFFFAOYSA-N 441.315 4.440 10 10 IICE COc1ccc(N2C[C@@H](NC(=O)N(Cc3ccccc3O)C3CCCCC3)CC2=O)cc1 1687009916 IRKUZHKTUDLGOY-IBGZPJMESA-N 437.540 4.051 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC[C@@H]1CC 1696322679 VTVSSYCDGXXOIT-LEWJYISDSA-N 441.620 4.366 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(Cl)nc1 1696699428 AWLSUOCGKWQAQM-UHFFFAOYSA-N 441.322 4.432 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)[C@@H](C)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1707275078 WQIWPFKECCZWSD-IBGZPJMESA-N 434.588 4.066 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCc3c(ccnc3N(C)C)C2)cc1 1728378755 OLCSQWBEAAUCAL-UHFFFAOYSA-N 447.631 4.320 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCCO1 1766577058 TZYLGIKHQLWIJK-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCOC(C)(C)C2)cc1 1766615491 YOEZSBJKWKGABI-NRFANRHFSA-N 427.593 4.029 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(OC)CCCC1 1767771303 JXBRNLDLSUGULH-UHFFFAOYSA-N 427.593 4.010 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCO4)n3CCCC(C)C)CC2)cc1F 1770257353 AAYVBBFAVKUIEN-OAQYLSRUSA-N 431.556 4.040 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CC4)n3CC(C)(C)SC)CC2)cc1 1770257668 FEARQRMBHOLJHH-UHFFFAOYSA-N 429.634 4.098 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(F)cc2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2 1859571793 UFPPMNSTSZEPII-UHFFFAOYSA-N 431.514 4.288 10 10 IICE COc1ccc([C@@H](n2nc(C(F)(F)F)c(C(=O)O)c2Br)C2(C)CC2)c(O)c1 2079844037 KBKVOBWLFWYNJU-CYBMUJFWSA-N 449.223 4.466 10 10 IICE CC[C@H](NC[C@@H]1COCCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2158553306 IEVBYRXILFMCBO-YOEHRIQHSA-N 443.382 4.079 10 10 IICE O=C1NC(=O)N(c2ccc(OCc3ccccc3Cl)cc2)C(=O)C1=Cc1cccc(O)c1 2297350234 KQOZIOVKQTYMCX-UHFFFAOYSA-N 448.862 4.291 10 10 IICE O=C1C(=Cc2cccc(Br)c2)SC(=S)N1C(=O)c1cccc([N+](=O)[O-])c1 2297550067 NZQHZFZUEIIWMO-UHFFFAOYSA-N 449.307 4.399 10 10 IICE Cc1cc(-c2ccc(C=C3C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)cc([N+](=O)[O-])c1C 2313560468 ULICKNWEWVYFIT-UHFFFAOYSA-N 445.431 4.480 10 10 IICE O=C(COc1ccccc1C=C1SC(=S)NC1=O)Nc1cccc(C(F)(F)F)c1 2314485825 DHWOBVQKRBLNEB-UHFFFAOYSA-N 438.452 4.212 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3ccccc3OC)SC2=S)N(C)C)cc1 2323879915 QFSPLZGHVWCWBB-SFHVURJKSA-N 428.579 4.208 10 10 IICE CC[C@@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S 6573894 JEMUTZMUJIQXJD-CXDFQFJYSA-N 446.594 4.188 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3cccc(C)c3)C2=O)ccc1O 15045696 CKXWPJZVKJWAGF-VCRXTVNUSA-N 442.562 4.328 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)Nc3ccccc3C)c3ccco3)CC2)cc1 38637874 FQDANXURLIDWAF-HSZRJFAPSA-N 434.540 4.282 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C/NCc2ccccc2)cc1 103764764 HDEPBXLQEAZCMT-CJLVFECKSA-N 428.448 4.028 10 10 IICE COC(=O)Cc1sc(NS(=O)(=O)c2cccc(Cl)c2C)nc1-c1ccccc1 727251148 SKJODRDDZQPXCQ-UHFFFAOYSA-N 436.942 4.288 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N(C)Cc3ccc(F)cc3Cl)cc2F)CC1 730671945 MUQSRAZPAGDDTO-UHFFFAOYSA-N 436.934 4.102 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)Cc1nc(O)c2c(-c3ccco3)csc2n1 741733956 CDWYPVYKPMTTQK-UHFFFAOYSA-N 436.537 4.126 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(N3CCOC3=O)c2)C1 766397820 GYEWTHVXSABXRB-UHFFFAOYSA-N 432.524 4.003 10 10 IICE Cc1cc(Cl)cc(CN2CCC(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)CC2)c1O 775679228 RKDSWMUVUYIAJW-AWEZNQCLSA-N 428.916 4.168 10 10 IICE C[C@H]1CN(Cc2cccc(N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)c2)C[C@@H](C)O1 777226453 FOZVRYKMPIDOOI-HSALFYBXSA-N 427.564 4.445 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3csc(-c4ncccn4)n3)cc2Cl)C1 800048415 ATEWTKRTRQMBRX-CQSZACIVSA-N 427.961 4.420 10 10 IICE CCc1ccc(-c2noc([C@H](C)NC(=O)NCc3cc(Br)ccc3O)n2)cc1 805203913 YUZBAMRNCPHAPM-LBPRGKRZSA-N 445.317 4.328 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(F)cc1OC1CCOCC1 806646777 ZGVJSGDPTVYIDR-UHFFFAOYSA-N 439.281 4.173 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CCCc2occc21 1126246949 XCERBITZQDPACG-IQFISFIMSA-N 430.526 4.204 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccccc3COCc3ccccc3)c2)CC1 1126310647 MYIVDCSUSQDCBM-UHFFFAOYSA-N 443.547 4.357 10 10 IICE CN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C1(C(F)(F)F)CC1 1133977502 WGUMDWFXVZVMES-BENRWUELSA-N 434.530 4.283 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 1136446000 SGDDQTNCIBASFU-GOSISDBHSA-N 437.490 4.441 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC[C@@H]1[C@H](C)Nc2ccnn2[C@@H]1C 1137350545 PNRNADQWAWHAQO-JJRVBVJISA-N 435.366 4.171 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)Cc4ccccc4F)CC3)c2C)c1 1142716572 FDTNETXLGNTAQA-UHFFFAOYSA-N 447.554 4.377 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)[C@@H]1CCCOC1 1178046936 FGSLALPQSCTQIQ-UZLBHIALSA-N 435.362 4.028 10 10 IICE COc1ccc(N(C)C[C@@H](NS(=O)(=O)c2ccc(C)cc2)c2ccccc2)cc1OC 1190673944 NAXRSXVHOJLYDI-JOCHJYFZSA-N 440.565 4.168 10 10 IICE CC(C)CSCCCNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1266261590 RTNCZOPMXVWVPR-SFQUDFHCSA-N 440.631 4.313 10 10 IICE CC[C@H](C)c1nnc(N(C)CCC2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291454621 FKGHPMLCPYCQLE-IBGZPJMESA-N 425.621 4.285 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cnnn1-c1ccccc1Cl 1294685774 TYCRQRXWBSFXED-UHFFFAOYSA-N 435.709 4.051 10 10 IICE Cc1cc(C(=O)NC[C@@]2(C)CCO[C@H]2C2CC2)c(C)n1-c1ccc(Br)cn1 1296126399 QPUVUKRORLWQQD-PZJWPPBQSA-N 432.362 4.187 10 10 IICE CCO[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1296984432 VJLHGPVCFCFQRD-NRFANRHFSA-N 425.621 4.303 10 10 IICE CC(C)(C)OC(=O)N[C@H](Cc1cc2ccccc2o1)C(=O)NCc1c(O)cccc1F 1303875762 OEXFOPXPIYIHJC-GOSISDBHSA-N 428.460 4.030 10 10 IICE C[C@H]1CCCC[C@H]1OCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1305005003 PNXQSZFJSFYCRB-WMZHIEFXSA-N 435.572 4.201 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](c3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1305433249 LQASIIAPDMKQFL-FPOVZHCZSA-N 435.620 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@H]1CCCCCN1C(=O)OC(C)(C)C 1312884389 JFIGZHGXOKITOF-KNQAVFIVSA-N 446.636 4.471 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N(C)C)cc1C 1316169735 IZVWQAAISLGKOU-FQEVSTJZSA-N 443.636 4.297 10 10 IICE Cc1cc(Br)ccc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1355130771 NNHSNTIEOCTZEU-IYBDPMFKSA-N 449.364 4.369 10 10 IICE Cc1c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cccc1N(C)C 1435689418 OGRVFIUARAAHIT-UYRXBGFRSA-N 443.569 4.430 10 10 IICE CCOC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1442447214 KCAHNPCXDIBART-XMMPIXPASA-N 437.584 4.429 10 10 IICE C[C@@H](Cc1cccc(F)c1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1468860547 QNIKIHIDZOBCLE-AWEZNQCLSA-N 448.541 4.097 10 10 IICE CC(C)(C)[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(F)c1 1479343205 CZELWOJFTOOVHT-JOCHJYFZSA-N 440.563 4.114 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(OCCOC)CC1 1500880207 GFSCGAGHTYSOPE-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1514178834 ZBLFXCLFSCRSRQ-RBBKRZOGSA-N 443.661 4.398 10 10 IICE CO[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1)C(C)C 1517818454 XASWDFTUTQINIU-FYYLOGMGSA-N 437.588 4.249 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)N(C)C)cc1 1539705050 FNYUOSCSHRMVOR-DEOSSOPVSA-N 445.567 4.429 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](c2ccsc2)N(C)C)n1 1542564048 PJCKLAMMSSAEQE-OAQYLSRUSA-N 448.596 4.355 10 10 IICE CCc1nnc(N(CC(C)C)C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1546431678 FBPIYFRIGFKITB-UHFFFAOYSA-N 429.584 4.270 10 10 IICE COC[C@H](F)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1555275326 BJOLNPYSPKSNJH-HXUWFJFHSA-N 443.592 4.152 10 10 IICE COC(=O)[C@]12CCC[C@H]1CN(C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)C2 1564649577 GXWSXGGCXACINU-CEXJFXJFSA-N 433.980 4.061 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3CO)c2C)c1 1566448076 PPAIETSSMCIYFG-IGKIAQTJSA-N 445.607 4.324 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)OC3(CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1583634545 ULLSIBBPRPATLE-HNNXBMFYSA-N 432.362 4.425 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCC[C@@H](OC)C2)cc1 1615379285 FNPLEOSMGZKAKV-JOCHJYFZSA-N 434.588 4.158 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cc(Br)cnc1OCC1CC1 1624322562 YZJHQXBOOMUUSU-UHFFFAOYSA-N 430.346 4.163 10 10 IICE COCCN(CCNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)C(=O)OC(C)(C)C 1624508636 ZRPJYJMDRGYBAY-UHFFFAOYSA-N 443.588 4.324 10 10 IICE COc1cc(CNC(=O)c2cc3cc(O)c(O)cc3s2)cc(Br)c1OC 1626475201 IRTGGYDZMCASNB-UHFFFAOYSA-N 438.299 4.022 10 10 IICE Cc1nc(O)c(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1Br 1629723795 YNPKXVIGCPYJLK-UHFFFAOYSA-N 444.329 4.360 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)C2)cc1 1630618670 DFRRQVBIJSFQST-WIYYLYMNSA-N 447.620 4.309 10 10 IICE Cc1nc(O[C@H](C)C(F)(F)F)ccc1C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1631219151 OGKMHCDURPPGCD-NVXWUHKLSA-N 438.446 4.247 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1nccc2cc[nH]c12 1633128627 SPUPSLIGEUOKDU-SDNWHVSQSA-N 428.564 4.245 10 10 IICE COCC[S@@](=O)Cc1cccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1633750980 IWHJWNDJQOFBFX-WJOKGBTCSA-N 438.549 4.054 10 10 IICE COCCN(CCNC(=O)c1cc(C)ccc1-n1c(C)ccc1C)C(=O)OC(C)(C)C 1637840754 JUITVXDXQUIYQE-UHFFFAOYSA-N 429.561 4.016 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)[C@@]12CCCO2 1638249473 DOTNDBXIUZUURE-SJBKTWHCSA-N 447.373 4.313 10 10 IICE CCOc1ccc(CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)C(C)C)cc1 1638918497 WDABXJZQKBLTQS-DEOSSOPVSA-N 426.605 4.374 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-c2cnn(C)c2)cc1 1639827362 QVTISDVMGUTTCG-UHFFFAOYSA-N 434.540 4.089 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](C)c4ccccc43)cc2F)C[C@@H](C)O1 1642168468 XGNOJWVTNQQILB-GBESFXJTSA-N 425.548 4.069 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1c(O)cccc1F)c1ccccc1Br 1652295738 RBPBVHPWRUPDKJ-UHFFFAOYSA-N 443.272 4.476 10 10 IICE Cc1cc(C(=O)COc2ccc(C=O)c(F)c2F)c(C)n1-c1ccc2c(c1)OCCO2 1656864111 SZHWSEKQVISUFN-UHFFFAOYSA-N 427.403 4.218 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1672931748 LGSQDAKRFWMIOA-GOSISDBHSA-N 440.494 4.471 10 10 IICE Cc1cc(CCNC(=O)N2CCn3c(cnc3C(F)(F)F)C2)c(C)n1-c1ccccc1 1674929844 CNELJIBXLQWIJB-UHFFFAOYSA-N 431.462 4.077 10 10 IICE Cc1cc(CCNC(=O)N2CCCSC[C@@H]2c2cnn(C)c2)c(C)n1-c1ccccc1 1674930037 IXKZFZFTCMQWEI-HSZRJFAPSA-N 437.613 4.260 10 10 IICE Cc1ccc([C@H]2C[C@H](C)N(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1681850007 NAUXPENUKVABKF-PXNSSMCTSA-N 429.511 4.197 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(OCc4ccc(F)cc4)CC3)C2)cc1 1682188513 SPNSOIVORHJZKL-HXUWFJFHSA-N 441.547 4.051 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC/C=C\c3ccc(Br)cc3)C2)cc1 1682626893 LDXVBHPYLLPYAB-LHRDXKRPSA-N 430.346 4.049 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3nc(-c4ccc(Cl)cc4)no3)C2)cc1 1682645337 CXXTWSZVKLBJFF-WMLDXEAASA-N 441.919 4.038 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1ccc2ncccc2c1 1685281836 OBFRYRUAOUMYLR-UHFFFAOYSA-N 428.330 4.477 10 10 IICE Cc1cccc(-c2nnc(N3CCO[C@H](C(C)C)C3)n2CCCSc2nccs2)n1 1693199988 HHJJFLKBXVPWIG-SFHVURJKSA-N 444.630 4.149 10 10 IICE CCC[C@](C)(O)Cn1c(Nc2ccn(C)n2)nnc1-c1cc(C)n(-c2ccccc2)c1C 1695047939 IKAITDUHMKICTJ-DEOSSOPVSA-N 433.560 4.381 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1696206658 ONXTVFORBSNSJR-VSKRKVRLSA-N 441.620 4.192 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H](NC(=O)OC(C)(C)C)C(C)C 1723145012 XJFLGGLMHBYEMJ-SFHVURJKSA-N 431.581 4.293 10 10 IICE CCN(CCc1cccs1)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1728488130 MOGHKSJBJPSSKD-HXUWFJFHSA-N 439.629 4.335 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC1(OC)CCC1 1743724599 IRTWLVHAEHENPM-FQEVSTJZSA-N 441.620 4.476 10 10 IICE CC(C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1750630705 WNVZAOWURHIOFU-INIZCTEOSA-N 430.603 4.093 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@H]1C 1768007039 KFNWEUZUSFWGPM-AZUAARDMSA-N 437.588 4.391 10 10 IICE COCCCn1cc(OCCCO)c(=O)cc1CNc1ccc(Nc2ccccc2)cc1 1871264399 WUTDQGWMVBEJQJ-UHFFFAOYSA-N 437.540 4.002 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC(NCc3cccc(Br)c3O)CC2)C1 1923340769 WDGGYNUJKHOWRL-UHFFFAOYSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)C12CC2 1925568747 MBSJUCZTYMLTOE-AWEZNQCLSA-N 431.758 4.440 10 10 IICE COc1cc(Cl)cc(CN[C@H](CNC(=O)OCc2ccccc2)C(F)(F)F)c1O 2090346567 BFFICYFWVHKQQJ-MRXNPFEDSA-N 432.826 4.001 10 10 IICE COc1ccc(Br)c(CN[C@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)c1O 2236054171 FNQDIQGHGUOIIK-JXFKEZNVSA-N 441.366 4.185 10 10 IICE Cc1ccc(NC(=O)CN2C(=O)NC(=Cc3cc(C)n(-c4ccccc4C)c3C)C2=O)cc1 2294516982 XYSPQEWXKRYRJV-UHFFFAOYSA-N 442.519 4.242 10 10 IICE Cc1cccc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccc(Br)cc34)C2=O)c1C 2297312940 HVFDYTKZCWXNTO-UHFFFAOYSA-N 438.281 4.214 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCCOc1ccc(OC)cc1 2297335488 LDMKOPGJLBEHCA-UHFFFAOYSA-N 431.535 4.041 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3Cl)C2=O)ccc1OCC(=O)O 2314931945 JODRSUBFVOJBRP-UHFFFAOYSA-N 435.910 4.218 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccccc3)C2=O)cc1OC)C(=O)O 2314932080 KDXNWMHHDDUEPQ-HNNXBMFYSA-N 429.519 4.343 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2ccc(Br)cc2O)C[C@H]2CCC[C@@H]21 2335106060 QSXSPZMCFWKJFC-COXVUDFISA-N 425.367 4.422 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc(Br)ccc1O)N2 14460953 GVDHMLUQYWVWLX-AUSJPIAWSA-N 449.370 4.232 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccc(Cl)cc1 15037560 QARIXSPXNXDBBU-WJDWOHSUSA-N 447.925 4.478 10 10 IICE COc1ccc(N2CCN(c3ncc4c(n3)CCN(Cc3ccccc3Cl)C4)CC2)cc1 21640159 HJSXSMLXROODTL-UHFFFAOYSA-N 449.986 4.024 10 10 IICE O=C(O)CCCC(=O)Nc1c(Oc2ccccc2)cc(O)c2c1C(=O)c1ccccc1C2=O 39899536 VFYVQWHUEQXGDG-UHFFFAOYSA-N 445.427 4.153 10 10 IICE COc1ccc(N2CCN(c3ncnc(Oc4cccc5ccccc45)c3N)CC2)cc1 40683039 XCKHZTKFRGEMJM-UHFFFAOYSA-N 427.508 4.340 10 10 IICE CCN(CC)c1ccc(CN(C[C@@H](O)COc2ccc(C=O)cc2)c2ccccn2)cc1 54120897 NYNFTDCLEHVAGQ-XMMPIXPASA-N 433.552 4.187 10 10 IICE CCOc1ccccc1/C=C\C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 213809980 JSHGGGSMDVLNJR-NTMALXAHSA-N 434.458 4.270 10 10 IICE Oc1cc2c(cc1CNc1ccc(Br)c(I)c1)OCO2 312548927 IXMNIGYMVGTVMG-UHFFFAOYSA-N 448.054 4.100 10 10 IICE CC[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc(Br)ccc1O 390698148 SEPVNHNTRYGWOQ-PZJWPPBQSA-N 433.390 4.487 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cccc(OC)c3OC)[C@@H]2c2ccc(O)c(O)c2)cc1 526217893 CRDUGXKAYPDSTR-QFIPXVFZSA-N 449.459 4.181 10 10 IICE COC(=O)c1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526354080 WGHIHXXEIKWJKF-NRFANRHFSA-N 435.407 4.081 10 10 IICE C[C@@H]1[C@H](NCc2ccc(Br)cc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709310380 RFHYNZKXUPRKFY-BASLNEPJSA-N 425.367 4.421 10 10 IICE COc1cc(N(C)Cc2ncc(Br)cc2Br)cc(OC)c1OC 753960182 HGLQPJWNDDMGRT-UHFFFAOYSA-N 446.139 4.269 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(CC(=O)c3cc(C)n(-c4ccc(OC(F)F)cc4)c3C)[C@H]2C1 755052248 FABOHIBDEQIPOY-NWSQWKLXSA-N 448.510 4.147 10 10 IICE Cc1nc([C@H]2CCCN2CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cs1 775731903 ZFKDPJMYIVMLGR-HXUWFJFHSA-N 431.517 4.003 10 10 IICE CN(C(=O)NCc1ccc(N(C)C2CCCCC2)cc1)C1CCN(c2cnccn2)CC1 788925745 QHOCFANLFWVJPL-UHFFFAOYSA-N 436.604 4.056 10 10 IICE COc1ccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2Br)c(O)c1 794382543 YKFZNDZHXNLLGU-UHFFFAOYSA-N 447.260 4.420 10 10 IICE O=C(NCCCSc1nccs1)N1CCCC[C@H]1c1nnc(CC(F)(F)F)o1 812154732 VNJARTGWHFRWTR-NSHDSACASA-N 435.497 4.050 10 10 IICE CC(=O)N1c2ccc(S(=O)(=O)Nc3nc(-c4ccc(F)cc4)cs3)cc2C[C@@H]1C 831877310 GHWBXSLMVFEWEQ-LBPRGKRZSA-N 431.514 4.048 10 10 IICE N=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccc(OC(F)(F)F)c1 849083942 QLIJQPFLUUGNLA-UHFFFAOYSA-N 447.505 4.254 10 10 IICE CC(C)Oc1ccc(NC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1Cl 918031441 BJYYJDWJYJPTQM-KRWDZBQOSA-N 444.963 4.151 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cn(-c4ccccc4)nc3C(C)C)cc2F)CC1 1125976176 ONDATBHLKBNJOT-UHFFFAOYSA-N 449.574 4.207 10 10 IICE CCc1cc(N2CCC[C@H](NC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)C2)ncn1 1125982086 DOONETJMGKXYDC-IBGZPJMESA-N 437.975 4.499 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)N(C)C)cc1 1134686582 OZLBNRSDSYYGDK-JOCHJYFZSA-N 440.588 4.157 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccsc2NC(=O)c2ccc(Cl)cc2O)cc1 1135643401 UPFWDTXRHXLPHB-UHFFFAOYSA-N 429.929 4.355 10 10 IICE Cc1c(Br)ccc2[nH]c(C(=O)NCc3ccc(N4CCOCC4)cc3)cc12 1136396586 AKORHFKVTBXLJS-UHFFFAOYSA-N 428.330 4.005 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCOc1ccc(Cl)cc1Cl 1142686286 BFDKLQIMHMOZFX-UHFFFAOYSA-N 440.323 4.450 10 10 IICE Cc1csc([C@@H](C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1147504437 FUGRGKTZRISCQW-YJBOKZPZSA-N 432.590 4.003 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-n2cccc2)ccc1Cl 1152400617 CWWZYJUJYJVWBG-UHFFFAOYSA-N 433.291 4.305 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC(OC(=O)Nc3cccc(F)c3)C2)c1 1154427066 MKBGZTCXTPXWKW-UHFFFAOYSA-N 435.455 4.119 10 10 IICE CC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)NC(C)C)CC1 1290253257 CHHWRISOJWIODS-UHFFFAOYSA-N 446.599 4.424 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1299745466 UHEBYTJFPGKBCP-VWLOTQADSA-N 425.621 4.402 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCCCC[C@@H]2NC(=O)OC(C)(C)C)cc1 1300281490 RZSADVMPWHWNTC-VXKWHMMOSA-N 447.620 4.454 10 10 IICE Cc1ccc(-n2nc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2C)cc1 1354754766 LPVHTRMTDKDGEW-GOSISDBHSA-N 440.494 4.489 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C(=O)c3cc(Cl)cc(Cl)c3)cc2F)C[C@@H](C)O1 1356036768 ONFCSPPHWJXSHV-CHWSQXEVSA-N 439.314 4.245 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Br)cc1Cl 1451921201 TXLMQMFWIHOMAW-UHFFFAOYSA-N 426.694 4.014 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(Cc2c(F)cccc2Cl)CC1 1478840857 JMFSOVGUQAOAHJ-SFHVURJKSA-N 446.998 4.312 10 10 IICE CCc1ccc(-c2nnc(N3CCO[C@H](C)C3)n2CCCSc2nccs2)cc1 1513658295 NDTQYKPEEUJOQX-MRXNPFEDSA-N 429.615 4.372 10 10 IICE CN(CC(C)(C)C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1517093201 YHPAXMKMJMLEFL-FQEVSTJZSA-N 443.661 4.256 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3[C@H]4C[C@H]4CN3C(=O)OC(C)(C)C)cc2Cl)C1 1519549810 FBSFAXZVECZBET-CNTRQJEFSA-N 448.007 4.448 10 10 IICE Cc1ccsc1CCNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1520673813 NIFCWEVHXZGIGO-ATVHPVEESA-N 434.583 4.146 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(-c4cccc(Cl)c4)nc3O)C2)cc1 1529706769 HAUJWOMMKKNEAB-INIZCTEOSA-N 437.927 4.373 10 10 IICE CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1530890265 RNJNZAIUCDAAAJ-VWLOTQADSA-N 431.580 4.280 10 10 IICE O=C(Cc1noc2ccc(Br)cc12)NCc1ccc(N2CCSCC2)cc1 1544409803 SFMCPOIVWPANFN-UHFFFAOYSA-N 446.370 4.002 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(CC(=O)N2CCCCCC2)C(C)C)cc1 1556532847 JTSUBGHFCVIPGM-UHFFFAOYSA-N 437.584 4.089 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)c3ccc(F)cc3OC(F)F)C2)cc1 1564497354 DZVUXKGQBVJCKQ-HUUCEWRRSA-N 437.462 4.322 10 10 IICE COc1ccc(N2CCN(C(=O)C3(CCCOCc4ccccc4)CC3)CC2)cc1F 1566347158 AQLREULLJQDCIV-UHFFFAOYSA-N 426.532 4.260 10 10 IICE Cc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1NC(=O)c1ccccc1 1586054331 FKUDJQCDXWGKGU-RUZDIDTESA-N 444.579 4.346 10 10 IICE COc1ccc(N2CCN(C(=O)CCCc3ccccc3Br)CC2)c(OC)c1 1587487120 SCFGBVUWZRHIIF-UHFFFAOYSA-N 447.373 4.138 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)c1ccccc1C(F)(F)F 1595410892 RBKZXOLDVCEDAN-OAQYLSRUSA-N 430.426 4.389 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N(C)C(=O)C3CC3)cc2)cc1 1596764227 PBDMCOMUZYKTOL-UHFFFAOYSA-N 429.520 4.461 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)Cc1scnc1C 1611964117 MGSWOYLMEMYMLU-UHFFFAOYSA-N 447.612 4.088 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN(CC)C1CC1 1613296039 UVQPJEGGSQTNFM-HXUWFJFHSA-N 440.636 4.001 10 10 IICE CC[C@]1(C)CC[C@@H](Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)O1 1613684101 FLVJRUXHFYRZGH-WMZHIEFXSA-N 441.601 4.324 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cnc3ccccc3c2C(F)(F)F)N(C)C)cc1 1618635198 GWDQBCXRVYJTJK-HXUWFJFHSA-N 430.474 4.352 10 10 IICE COC(=O)[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(C)c(C)c1 1625812007 OUISCALGRXOFGE-RUZDIDTESA-N 432.520 4.096 10 10 IICE COc1ccccc1[C@@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)N1CCCCC1 1626252537 UBADOJYIWSVIGP-QGZVFWFLSA-N 426.538 4.278 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(CCc4ccc(O)cc4)CC3)C2)cc1 1636354302 WQDYOXCXIPWFEP-QFIPXVFZSA-N 437.584 4.282 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCN(c4ccc(F)cc4)C3=O)cc2Cl)C1 1639534565 QYZCNQCHMGOCSK-UZLBHIALSA-N 443.950 4.385 10 10 IICE CC[C@@H](C)n1nc(C)c(-c2cc(C(=O)N(C)CCN(C)c3ccc(OC)cc3)n[nH]2)c1C 1644438106 LRVHEWUSCYIQLF-MRXNPFEDSA-N 438.576 4.078 10 10 IICE Cc1cc(C(=O)N2CC(O)(c3ccc(F)cc3)C2)c(C)n1-c1cccc(Br)c1 1644863757 LRHQGISHPBGFNU-UHFFFAOYSA-N 443.316 4.339 10 10 IICE COc1cc(N2CCN(C(=O)NCC3(C)CCC(C)(C)CC3)CC2)cc(OC)c1OC 1683217388 FYKINJOECYBVCJ-UHFFFAOYSA-N 433.593 4.151 10 10 IICE CCC[C@@](C)(O)Cn1c(Nc2ccn(C)n2)nnc1-c1cc(C)n(-c2ccccc2)c1C 1695047940 IKAITDUHMKICTJ-XMMPIXPASA-N 433.560 4.381 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](C)[C@@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1708566221 QVLJUMZXOYZNJA-OKZBNKHCSA-N 447.624 4.146 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1CCC1CCOCC1 1747750151 MONJECQRWOKTOM-UHFFFAOYSA-N 427.936 4.152 10 10 IICE CC(C)N(C)CCCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750881803 HAWKGFUAUPLBTG-HSZRJFAPSA-N 440.636 4.097 10 10 IICE CCN(c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)c(F)c1)C1CCCC1 1766517792 VKYNEWCEYLDAAC-AVRDEDQJSA-N 445.583 4.024 10 10 IICE COCCN(C)CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=CCC1 1771075272 OHPQCLAGFZXISN-UHFFFAOYSA-N 448.615 4.087 10 10 IICE COC(=O)c1c(NC(=O)CCC(=O)O)sc(C)c1-c1ccc(Br)cc1 1865946480 QUMGNWMFKGCHHU-UHFFFAOYSA-N 426.288 4.076 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)[C@H](N)c1ccc(N2CCCC2)cc1 1999537236 VRUBYAYSIILFOO-DHIUTWEWSA-N 425.573 4.397 10 10 IICE CCOC(=O)c1c(C2CC2)nn([C@@H](C)c2ccc(C)cc2O)c1I 2078991638 CMSDFOAKNUGELY-NSHDSACASA-N 440.281 4.165 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)cc1 2297352668 KPULISZFHKSTMJ-UHFFFAOYSA-N 432.553 4.075 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3ccccc3O[C@H](C)C(=O)O)SC2=S)c1 2314931610 POYUNUZKDYPOMS-CYBMUJFWSA-N 427.503 4.147 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccc(F)cc3)C2=O)cc1OC)C(=O)O 2314932153 LGGQKSMCROMSCL-HNNXBMFYSA-N 447.509 4.482 10 10 IICE CC[C@H](C)[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323827360 YDAVXLYUGDVGAD-SDBXPKJASA-N 432.336 4.289 10 10 IICE CCN1C(=O)/C(=C2/SC(N3CCCCCC3)=NC2=O)c2cc(Br)ccc21 1115913 DBHYGOVRDMRZFJ-FOCLMDBBSA-N 434.359 4.032 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CCNCc1cc(Br)cc(F)c1O 721096811 XTGAWQOYVAHKRR-CHWSQXEVSA-N 431.346 4.277 10 10 IICE C[C@H]1C(=O)N(C2CCN(c3ccc(OC(F)F)cc3)CC2)C(=O)N1Cc1ccccc1 761158431 JTJUUFOYWRNOEC-INIZCTEOSA-N 429.467 4.110 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)c2)c1C 766335836 KGTCQDZUYMEGRZ-UHFFFAOYSA-N 432.568 4.160 10 10 IICE C[C@@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc(Cl)c(Cl)cc1O 774267652 YODDTWVAMXSXGK-CQSZACIVSA-N 443.396 4.475 10 10 IICE Cc1cc(Br)c(O)c(CNCc2ccc(N(C)C(=O)c3ccncc3)cc2)c1 781632346 UINOVATVFSDURE-UHFFFAOYSA-N 440.341 4.425 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)cc1 781957231 HXCNWSRUCZKJIZ-SFHVURJKSA-N 449.454 4.084 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c(C)n1-c1ccc(F)cc1 804204166 QSZNTPQZYLEXTF-INIZCTEOSA-N 439.453 4.154 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(CC(=O)NCc2cc(Br)ccc2O)cc1 804738896 ISXBCCCZGCKICF-UHFFFAOYSA-N 435.318 4.361 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C(=C\c3ccccc3)C(F)(F)F)cc2F)CC1 1125908787 ZCOJAUCQGDAGQC-XMHGGMMESA-N 435.465 4.230 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(-c4ccc(Br)cc4)no3)C2)cc1 1131030566 SQLGINMZSQBNHM-INIZCTEOSA-N 442.313 4.121 10 10 IICE Cc1cc(C(=O)Nc2nnc(C(F)(F)F)s2)c(C)n1-c1ccc(Br)cn1 1136358822 GTHNTZQBWBINEN-UHFFFAOYSA-N 446.252 4.374 10 10 IICE COc1cc(C2(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)CC2)ccc1C 1137438446 LCQFAQJUEIEGAD-HXUWFJFHSA-N 428.960 4.175 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@@H]2C(=O)Nc3ccc(Br)cc32)cc1F 1144985366 LKLUQXNNFDUCSK-INIZCTEOSA-N 448.336 4.177 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c(O)cnc2c(F)cccc12 1148444328 RQVGKZSTDLOHDQ-CYBMUJFWSA-N 431.414 4.080 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC[C@H]([C@H](O)c3ccc(Br)cc3)C2)cc1 1160290189 JRUMDCSSXYDIIW-MAUKXSAKSA-N 445.317 4.197 10 10 IICE Cc1nn(COCC[Si](C)(C)C)c(C)c1CCC(=O)NCc1cc(Cl)ccc1O 1165508870 XJRZDTJYGIRSOM-UHFFFAOYSA-N 438.044 4.420 10 10 IICE CC[C@@H]1c2ccc(OC)c(OC)c2CCN1C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1230859276 VMLXEXHQXCTIQI-VGOFRKELSA-N 439.556 4.010 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)[C@H]1Oc1ccccc1 1234567667 ZJSLWWBLXKQPJL-RBZQAINGSA-N 425.573 4.298 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3C[C@H](OCc4ccccc4)C3(C)C)CC2)cc1F 1235188088 VFWOKTHWHLTOBE-PKTZIBPZSA-N 441.547 4.050 10 10 IICE CN(C)c1ccc(CNC(=O)c2scc(Br)c2Br)cc1F 1264827222 SBPRGVQILRFSAD-UHFFFAOYSA-N 436.144 4.408 10 10 IICE CC(C)N1CCN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)CC1 1288002121 ODFFURCEDWOHJS-UHFFFAOYSA-N 446.621 4.254 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)CC1 1288329661 FMILMWUBKZMPAN-UHFFFAOYSA-N 445.407 4.406 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC[C@@H](c3ccnn3C)C2)cc1 1295420116 MIXOVPQLWZCZBE-JOCHJYFZSA-N 449.647 4.489 10 10 IICE Cn1cc([C@H]2CCCN2c2nnc(C(C)(C)C)n2CCCSc2nccs2)cn1 1298820650 URSMRXBKDHCKMU-MRXNPFEDSA-N 431.635 4.290 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3CCOc4ccc(Br)cc43)CC2)cc1 1352536466 BOOSIEQXXONLDR-IBGZPJMESA-N 445.357 4.109 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(S(C)(=O)=O)c(Cl)cc1Cl 1356266066 IQEQLWYULSJKBF-UHFFFAOYSA-N 441.380 4.269 10 10 IICE CC(C)[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)N1C[C@@H](C)O[C@H](C)C1 1448454955 UFINYULIKBVNHO-ZQAYVECASA-N 436.040 4.326 10 10 IICE Cc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1NC(=O)OC(C)(C)C 1463281134 LIJPINJTHMLQKC-QFIPXVFZSA-N 440.588 4.441 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(-c2ccccc2Cl)c1 1465951097 IUWRTBSRLPMWPB-GOSISDBHSA-N 445.350 4.279 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ncc(Cc2ccccc2)o1 1465951933 SAHAYGWGJXXUFH-LJQANCHMSA-N 425.916 4.019 10 10 IICE CC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1466682041 HEPZMNMHJGZYKT-FQEVSTJZSA-N 440.341 4.182 10 10 IICE CC(C)(CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(Cl)c1F 1469913144 APBPQYDPAIPIPO-UHFFFAOYSA-N 433.955 4.217 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H]3CCCC34CCCCC4)cc2F)C[C@@H](C)O1 1473639904 BNHUJXQEEARZFM-YYDVJCTNSA-N 431.596 4.148 10 10 IICE CC(=O)c1cc(Cl)cc(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C2)c1O 1473801587 GEZRHOHOKPNYQT-HUUCEWRRSA-N 436.858 4.136 10 10 IICE CN(CC1CC(F)(F)C1)c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1503524566 SHUWWQXHRYIDLP-HNNXBMFYSA-N 443.589 4.293 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CC(C)(C)OC(C)(C)C2)cc1F 1517003618 LYGDXBCLTXIFPM-HXUWFJFHSA-N 445.583 4.167 10 10 IICE CSC1(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)CCOCC1 1520000331 MVXACIWSSLGRBB-UHFFFAOYSA-N 444.626 4.185 10 10 IICE CN(C)c1ccc(CNC(=O)CCCCc2ccc(I)cc2)cc1 1531320856 LINVMASEAKESRJ-UHFFFAOYSA-N 436.337 4.386 10 10 IICE CCCc1c(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)cnn1-c1cccc(C)c1 1534518184 FOEDXVZNTQAGDS-UHFFFAOYSA-N 432.568 4.494 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@]1(O)CCC[C@H]1C 1545503944 LHAWXDQNXWQNRJ-WZOHSFFVSA-N 441.620 4.068 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(CC(C)C)n1Cc1ccc(N2CCSCC2)cc1 1547554479 PIEUQKTZLZBIRT-JOCHJYFZSA-N 443.661 4.083 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCCc1ccc(Br)cc1 1557114940 PGSVDHYHFDQWNW-UHFFFAOYSA-N 448.357 4.459 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CSCc3c(F)cccc3F)cc2F)C[C@H](C)O1 1559420805 HLPTUGOLEXQPCV-GJZGRUSLSA-N 438.515 4.267 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cc1ccccc1NS(C)(=O)=O 1566845192 ADJDMIXFNGRDGR-SFHVURJKSA-N 438.549 4.096 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1603393789 SZTJNMORMABPBF-HXUWFJFHSA-N 425.621 4.234 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3C(=O)Nc4ccc(F)cc43)cc2Cl)C1 1617901181 PZNUBVGIXIDCTE-KSSFIOAISA-N 429.923 4.458 10 10 IICE CCCCCCn1nc(C(=O)NCc2c(O)ccc3c2CCCC3)c2ccccc2c1=O 1622664463 VHBIJORYZGBYPS-UHFFFAOYSA-N 433.552 4.491 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(-c4ccccc4)cc3)CC2)c(OC)c1 1623759790 MZXTVOCDGVESLC-UHFFFAOYSA-N 432.520 4.098 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(-c2ccc3ccccc3c2)[nH]n1 1632702092 VZAUAXRRJJVOKR-UHFFFAOYSA-N 449.894 4.404 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1C(C)C 1633793705 IOMMRNJZJHBHPX-UHFFFAOYSA-N 432.568 4.195 10 10 IICE COCCO[C@H]1CCCN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1633839025 TVUFSELJBGVFLK-KRWDZBQOSA-N 435.362 4.124 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)c(C)n1-c1ccccc1Br 1640925395 GYKCCLFEGKAPBQ-MRXNPFEDSA-N 446.389 4.233 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)Oc1ccccc1Cc1ccccc1 1643245677 UXHMAEWKYYASHB-HXUWFJFHSA-N 447.531 4.342 10 10 IICE Cc1cc(C(=O)CSc2nnnn2CC(F)(F)F)c(C)n1-c1ccc2c(c1)CCC2 1643678187 APMTXBKMKFLNLZ-UHFFFAOYSA-N 435.475 4.107 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)C[C@@H](O)COc2cc(Cl)cc(Cl)c2)c1O 1659784906 ARCRCIILCICRIF-MRXNPFEDSA-N 432.731 4.427 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1COc2cccc(Br)c2C1 1675508511 LRGMEDPHXJHNNZ-QGZVFWFLSA-N 446.389 4.439 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(CO)CCc4ccccc43)cc2Cl)C1 1680561283 BBRNLHBMUQIBSB-AVRWGWEMSA-N 442.003 4.252 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@@H](C)Oc3ccc(C(C)C)cc3)C2)cc1 1680998292 VMNSMRMQXBPVTA-UXHICEINSA-N 425.573 4.412 10 10 IICE C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1681161067 PDLJMCDTXNPPTD-HNNXBMFYSA-N 436.383 4.385 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CC2(CCOCC2)Oc2ccccc21 1682101723 VCOIIHLVTZMIKR-WMZHIEFXSA-N 437.584 4.364 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCc3cccc(Oc4ccccc4F)c3)cc2)CC1 1683597417 FKMNQZHYFOEZQW-UHFFFAOYSA-N 448.542 4.369 10 10 IICE Cc1cc(CNC(=O)NCCC2(O)CCN(c3ccccc3)CC2)c(C)n1-c1ccccc1 1684479116 SWTKXVGLSSWMDF-UHFFFAOYSA-N 446.595 4.315 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC3(c4ccc(F)cc4F)CCCC3)C2)cc1 1686182763 DUELGJSOGVPYJU-SFHVURJKSA-N 429.511 4.363 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1693970942 MYLONTYCGMIUCX-AUSIDOKSSA-N 449.603 4.033 10 10 IICE C[C@@H]1CCC[C@@](Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1708027834 RKHYIGYKLHDNFG-FZOAFFARSA-N 441.620 4.025 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccsc1 1729418642 GAZJSDWBAPDEPZ-UHFFFAOYSA-N 444.358 4.488 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCSC1 1761842077 BFWFTHIXBGVRFX-OALUTQOASA-N 429.634 4.270 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1=CCCCC1 1767766383 FQUOZHQSHBWZBW-UHFFFAOYSA-N 446.599 4.425 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCCSC)CC2)cc1 1768705160 YBIHLEFYJWTHQG-UHFFFAOYSA-N 431.650 4.345 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1769713149 HAGIOHDTYCRKLK-SFHVURJKSA-N 425.602 4.331 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1770204565 MVONQCVMDVBOGQ-UNMCSNQZSA-N 441.620 4.051 10 10 IICE O=[N+]([O-])c1cccc(-c2nnc(N3CC=CCC3)n2CCCSc2nccs2)c1 1771580348 PNBKEOAFQXMMTB-UHFFFAOYSA-N 428.543 4.259 10 10 IICE CC[C@H](NC(=O)c1c(C)ccc2ccccc12)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1861906904 ZQHNQOANUZSMGK-DEOSSOPVSA-N 445.563 4.014 10 10 IICE COC(=O)c1c(NC(=O)[C@@H](N)Cc2c[nH]c3ccccc23)sc(C)c1-c1ccccc1 1865951062 ZDGKGTFATTVZBU-SFHVURJKSA-N 433.533 4.500 10 10 IICE CNC(=O)[C@@H]1CCCC[C@H]1C(=O)Nc1sc2c(c1C(=O)OC)CC[C@H](C(C)(C)C)C2 1866192039 FAMLBHZRVKNFDE-RRFJBIMHSA-N 434.602 4.177 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3cccc(C)c3C)nc3ccccn3c2=O)SC1=S 2314506504 DUULDOZWDFVYMB-UHFFFAOYSA-N 437.546 4.325 10 10 IICE COc1cc(C=C2C(=O)N(Cc3cc(C)ccc3C)N=C2C(F)(F)F)cc(OC)c1O 2332147545 JYUDWJWCLKKMHW-UHFFFAOYSA-N 434.414 4.370 10 10 IICE Cc1ccc(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2381132487 BNBXDLZJMRZVMS-AWEZNQCLSA-N 443.382 4.409 10 10 IICE Cc1cc(/C=C2\C(=N)N3N=C(N4CCCCC4)SC3=NC2=O)c(C)n1Cc1ccccc1 20356537 IELAWQUWLWXPHU-BJRGRWSZSA-N 446.580 4.216 10 10 IICE C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S 47152366 XPZYBIXKJMXWAV-OKHBPPCESA-N 447.925 4.477 10 10 IICE CCCN(CC(=O)Nc1ccccc1C(=O)NCc1ccccc1)Cc1ccccc1O 110078163 FZBXJZLKTXGVDK-UHFFFAOYSA-N 431.536 4.173 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(NC(C)=O)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526330976 GEMNVVPLJDPACL-HSZRJFAPSA-N 446.459 4.122 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCCC2)cc1)Cc1ccccc1 743309893 FPDSXRBBOPRPSN-JOCHJYFZSA-N 437.584 4.429 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cnn(Cc2ccccc2)c1 745564727 DVRNYYJBHKMGLF-UHFFFAOYSA-N 443.345 4.131 10 10 IICE Cc1cc(C(=O)[C@@H](C)N2CCN(CC(F)F)CC2)c(C)n1-c1ccc(OC(F)F)cc1 747088574 YFSJLPIRBYTIQX-MRXNPFEDSA-N 441.469 4.149 10 10 IICE COc1cc(N2CCN(C(=O)c3cc(Cl)sc3Cl)CC2)cc(OC)c1OC 759222943 ZITCDERLAMBARG-UHFFFAOYSA-N 431.341 4.043 10 10 IICE Clc1cc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc2c1OCCCO2 768668680 AHNIYOHCUCQPRK-UHFFFAOYSA-N 442.003 4.323 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)c(C)n1-c1ccccn1 769377060 JYDPFYFTCOCKRE-GOSISDBHSA-N 431.458 4.089 10 10 IICE Cc1cc(-c2csc(NC(=O)C3(C(=O)N(C)C)CC3)n2)c(C)n1-c1ccc(F)cc1 806400511 BHQFWMBMLJJGKR-UHFFFAOYSA-N 426.517 4.164 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 812006369 UFONSBZMGMQAGH-FQEVSTJZSA-N 441.601 4.327 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccn(Cc4ccccc4)c3C)cc2F)CC1 1125907530 LQWZATIMCJFEQC-UHFFFAOYSA-N 434.559 4.056 10 10 IICE CC(C)n1ccc(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)n1 1134541946 AWXWGGSFLRUITK-UHFFFAOYSA-N 439.317 4.117 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnn(-c3ccc(F)cc3)n2)cc1 1136698804 XOMJHVNXXVPNRF-UHFFFAOYSA-N 445.498 4.328 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2cccc(Cl)c2)[nH]n1 1137438731 SEDWMLJWMPHRTD-GOSISDBHSA-N 445.350 4.484 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cnc3ccccc3c2)NC(=O)OC(C)(C)C)cc1 1147508149 UQYUOEBKBUIQLA-JOCHJYFZSA-N 434.540 4.297 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(Br)cc([N+](=O)[O-])c3Cl)ccc21 1160639204 HJZRKEPQXGEDTO-UHFFFAOYSA-N 438.709 4.323 10 10 IICE CN(CCC(F)(F)F)[C@H](CNC(=O)c1c(F)ccc(O)c1O)c1ccc(Cl)cc1 1161319747 OVTXFVHDEBORMK-CQSZACIVSA-N 434.817 4.246 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(F)c(F)c1 1168759017 YCTFEDHKNQBXIB-UONOGXRCSA-N 434.442 4.418 10 10 IICE CC1(C)[C@H](C(F)(F)F)CCN1CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1193430827 SHTUUKUKFZNYNJ-GOSISDBHSA-N 430.426 4.063 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1c(F)cccc1F 1197979141 RRNFXGVKKGZOFZ-UONOGXRCSA-N 434.442 4.418 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC[C@@H](Cc2ccccc2)c2ccccn2)cc1 1251639440 BYZSVEZMRKALTQ-JOCHJYFZSA-N 432.568 4.194 10 10 IICE C[C@H]1CC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)CN1C(=O)OC(C)(C)C 1253921159 OMVZBRBXCJGHBY-HKUYNNGSSA-N 443.544 4.485 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC[C@H]1CC1(Cl)Cl 1280372610 DILBBNLLWBBQCY-KWJWQAOWSA-N 449.450 4.430 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C(N)=O)C1 1291349511 QSAYEHOPKFMYES-LJQANCHMSA-N 434.588 4.100 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(S(=O)(=O)c3ccc(C)cc3)CCCC2)cc1F 1293225492 WTQDWTYSOILXNM-UHFFFAOYSA-N 446.588 4.383 10 10 IICE CCOCc1nnc(N2CCSC3(CCCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1297343609 HJFSKXWGKHAUFQ-UHFFFAOYSA-N 443.661 4.493 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCC(F)(F)CC2)cc1F 1298059800 BFRPSXFCEHWDHA-UHFFFAOYSA-N 435.519 4.419 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2ccccn2)n1Cc1ccc2c(c1)CCCN2C 1302727186 ZPDDTSKXEBHAQY-SFHVURJKSA-N 436.629 4.349 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2CCC2(C)CC2)c(C)n1-c1ccccc1 1304191144 XJYPLXWMPPHQTQ-QGZVFWFLSA-N 434.588 4.243 10 10 IICE Cc1ccc(O)c(CNC(=O)C(=O)c2c(C)nn(-c3cccc(C(F)(F)F)c3)c2C)c1 1306877808 JPTNELUCFHSMAA-UHFFFAOYSA-N 431.414 4.021 10 10 IICE CCOC(=O)CN(C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(F)cc1 1356460891 LNVNPPSKVKAGTI-UHFFFAOYSA-N 438.499 4.264 10 10 IICE COc1ccc(COCCCNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1358444904 VQXABFKSZKEFDI-UHFFFAOYSA-N 436.552 4.260 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C\c3ccc(C(=O)OC(C)(C)C)o3)CC2)cc1 1435026267 SRQZDEOVMOIAAP-BENRWUELSA-N 426.513 4.042 10 10 IICE COc1ccc(-c2nc(C)c(C(=O)N(C)CCN(C)c3ccc(OC)cc3)s2)cc1 1437382868 IKHUZNSJHUUHHN-UHFFFAOYSA-N 425.554 4.344 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC([C@](C)(O)C(F)(F)F)CC2)cc1 1466702947 YQGXENSBCSGCNG-QFIPXVFZSA-N 436.474 4.001 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN[C@H](c3ccccc3)C3CCCCC3)CC2)cc1 1473284854 ZYMCQSOPFGNNPX-AHKZPQOWSA-N 437.628 4.089 10 10 IICE Cc1nccn1-c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)cn1 1492704194 UDRHYFQCLIQYOZ-UHFFFAOYSA-N 445.571 4.146 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCC[C@@H]2C)CCOC1 1509796629 OMNQOYQPCBBIEN-XLNZFTOWSA-N 428.577 4.097 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@@H](C(F)F)C2)cc1F 1517000773 XSODSAUEDVNUOJ-MRXNPFEDSA-N 430.478 4.075 10 10 IICE CN(C)CCOc1ccc(/C=C/C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1525593002 DXGYAJGAGTZVAX-NTEUORMPSA-N 440.499 4.054 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccc4)cn3)cc2F)C[C@H](C)O1 1526002567 FJRBCFSHDCFSQN-OALUTQOASA-N 449.526 4.343 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1532104273 ALOBGNMDAMFTLK-GDBMZVCRSA-N 435.337 4.171 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N(C)[C@H]1CCCc2c1cnn2C 1542226703 GLBMDVTYFUAGHP-QFIPXVFZSA-N 435.620 4.147 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c[nH]c4ccc(Br)cc34)C2)cc1 1558998267 RMWHUEBUKNPGFI-AWEZNQCLSA-N 428.330 4.195 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccccc2CCN(C)C(=O)OC(C)(C)C)c1 1566374889 XLYOLAFWTJNKPA-MRXNPFEDSA-N 428.529 4.301 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1 1568378729 MGTRXSOVTLDJIX-INIZCTEOSA-N 432.948 4.496 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnn(-c2ccc(Br)cc2)c1 1570418363 MVWYGWGTNRYQNC-INIZCTEOSA-N 441.373 4.370 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)CC4CCCCC4)CC3)c2C)cc1 1584300603 ISYCBNNJPQQSLQ-UHFFFAOYSA-N 437.584 4.358 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cnn(C(F)F)c1 1585834571 HXRWTTZASZYZHL-UHFFFAOYSA-N 433.216 4.003 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1 1587842032 DRCTYCFSMWYKMC-UHFFFAOYSA-N 429.520 4.324 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1Cl 1611432164 WYISOKKADNUYIO-ZDUSSCGKSA-N 434.920 4.388 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccccc3CN3CCC[C@@H]3CO)c2C)c1 1611496504 NCTFKABFLHZIBW-RUZDIDTESA-N 431.580 4.289 10 10 IICE C[C@H]1CC[C@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1612716617 HQTKTXGMDXMNRF-PMACEKPBSA-N 425.621 4.376 10 10 IICE CN(C[C@@H]1CCOC1)c1nnc(Cc2ccccc2F)n1CCCSc1nccs1 1618135001 UVZQAOFETKIOFW-INIZCTEOSA-N 447.605 4.120 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(SC(F)(F)F)cc3)CC2)c(OC)c1 1623760253 TWZWHKGNCUIBMK-UHFFFAOYSA-N 426.460 4.278 10 10 IICE CCN(Cc1nc(O)c2ccccc2n1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1624589161 BFYJPHDHVAPERP-UHFFFAOYSA-N 428.492 4.218 10 10 IICE CC[C@H]1CCCCN1CCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1627626541 DRFVSGKKMWOWGF-SFHVURJKSA-N 433.394 4.246 10 10 IICE CCc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnn1-c1ccccc1 1631426144 YDMSRTLGBKNIMK-LJQANCHMSA-N 438.959 4.188 10 10 IICE CC(C)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1cccc(F)c1 1633380587 QHIQCHPQMMUWDY-UHFFFAOYSA-N 448.541 4.101 10 10 IICE CCCO[C@@H]1CCCN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1644583058 AHTZPFHPEAGZTK-ZWKOTPCHSA-N 434.536 4.070 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(c3ccccc3)[C@@H](C)c3ccccc3)CC2)cc1 1645224771 ZLOJOPTUTULPLG-HOFKKMOUSA-N 445.607 4.446 10 10 IICE COC(=O)c1sc2nc(C)nc(NC[C@H]3CCN(c4ccc(OC)cc4)C3)c2c1C 1651172009 QZDINFXODWRCIU-OAHLLOKOSA-N 426.542 4.042 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3cccs3)oc2=O)c(C)n1-c1ccc(OC(F)F)cc1 1656154553 NDVJLHRKARJVGY-UHFFFAOYSA-N 445.447 4.457 10 10 IICE Cc1ccnc(-c2noc(CC3CCN(C(=O)N[C@H](C)c4ccc(N(C)C)cc4)CC3)n2)c1 1681553055 USXGJDYRFVLVJW-GOSISDBHSA-N 448.571 4.231 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(C)C[C@H](O)Cc3ccccc3)cc2Cl)C1 1682023104 ALRYTMYCWBEFHR-GHTZIAJQSA-N 429.992 4.321 10 10 IICE COc1cccc2c1OCCC[C@H]2NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1683779252 VQHQORAJROYOKE-AZUAARDMSA-N 426.513 4.005 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3cc(Br)cc(F)c32)N(C)C)cc1 1685608876 IZFSFDRPMORQJL-IBGZPJMESA-N 449.368 4.029 10 10 IICE Cc1ccc(SC[C@H](C)NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1686149651 GNRRSZDNMUXBER-INIZCTEOSA-N 435.540 4.090 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)C2)cc1 1687023852 WOPMOBMVVWWCQQ-PKOBYXMFSA-N 433.474 4.492 10 10 IICE Cc1ccc(-c2nnc(N3CCC(CCCO)CC3)n2CCCSc2nccs2)o1 1693064890 WADZRSSBOBQMPL-UHFFFAOYSA-N 447.630 4.474 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCC3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1724197787 KJXGLGKEAQWBIV-UHFFFAOYSA-N 448.615 4.361 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(F)(F)C1 1730483413 XYGJOSIPOABSNQ-QGZVFWFLSA-N 433.478 4.183 10 10 IICE CC(C)(C)[C@@H]1CCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1741177722 CJWASNJFGSIAQN-OAHLLOKOSA-N 429.619 4.246 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)CC1CC(F)(F)C1 1742142111 SGGINYLQAIZPDO-HXUWFJFHSA-N 433.547 4.424 10 10 IICE CC[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1765272844 OGQNIKZJZBQFAQ-PXNSSMCTSA-N 433.597 4.105 10 10 IICE CCOCCC1(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCC1 1766508346 MVQWDYLAIVRLFY-OAQYLSRUSA-N 428.577 4.459 10 10 IICE COc1ccc(N2CCCCC2)cc1NS(=O)(=O)c1ccc(Br)cc1 1858033198 HTFSZLQYIUOBIF-UHFFFAOYSA-N 425.348 4.249 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)/C2=C/c2ccc3c(c2)OCCO3)cc1 1865671596 KFYYLBLFQSTINM-HYARGMPZSA-N 444.462 4.436 10 10 IICE CCn1cc(OCc2ccc(C)cc2)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870767896 CZMWDEURKUHFEZ-UHFFFAOYSA-N 447.579 4.086 10 10 IICE Cc1nn(C)c2nc(C(C)C)cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c12 1874179191 SLZKCVVGUWXMED-UHFFFAOYSA-N 438.487 4.428 10 10 IICE COc1ccc([C@](C)(NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)c(O)c1 1951738162 XHLVWTVIJNKOQP-VWLOTQADSA-N 433.460 4.239 10 10 IICE CCOC(=O)c1cccc(-n2c(C)cc(C=C3NC(=O)N(Cc4ccccc4)C3=O)c2C)c1 2294049395 CRTKHXFLKOTAHQ-UHFFFAOYSA-N 443.503 4.364 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1cccc2nonc12 2296571282 TXMBCPTUVNTURE-UHFFFAOYSA-N 444.925 4.106 10 10 IICE CCCCCOc1ccc(C=C2SC(=S)N([C@H](C)C(=O)OCC)C2=O)cc1OC 2314740750 MRGGBQIQTQJVAN-CQSZACIVSA-N 437.583 4.417 10 10 IICE CCCC1=NN(Cc2cccc(F)c2)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332141462 XAWRPBOUNZAETG-UHFFFAOYSA-N 425.416 4.087 10 10 IICE COc1ccc(N2N=C(C(F)(F)F)C(=Cc3cc(OC)c(OC)cc3OC)C2=O)cc1 2332141475 ZFAAUOHHSVAXGJ-UHFFFAOYSA-N 436.386 4.070 10 10 IICE CCOc1cc(/C=C2/SC(Nc3cc(C)ccc3O)=NC2=O)ccc1OCCC(=O)O 16920099 OKHMBLJLOLLAOR-XDHOZWIPSA-N 442.493 4.035 10 10 IICE Cc1ccc(-c2noc(-c3cccnc3N3CCN(c4ccc5c(c4)OCO5)CC3)n2)cc1 33004352 OMXTWFSYQZGDGY-UHFFFAOYSA-N 441.491 4.162 10 10 IICE CCN1C(=O)/C(=C\c2cc(Br)ccc2OCc2ccc(C)cc2)NC1=S 33315653 XDZPNIHNAJGCBB-GZTJUZNOSA-N 431.355 4.414 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C/c2cccc(OCCC(=O)O)c2)SC1=S 210419954 GJWXRYXJQBSACZ-AQTBWJFISA-N 429.519 4.345 10 10 IICE COc1ccc(N2CCN(CCNC(=O)Nc3cc(Cl)ccc3SC)CC2)cc1 743313877 GUFSJERSZVKELM-UHFFFAOYSA-N 434.993 4.014 10 10 IICE C[C@@H](NCCc1cnc(C2CC2)nc1)c1cc(Br)cc(Br)c1O 756769770 NGISOTCSQRCKJU-SNVBAGLBSA-N 441.167 4.478 10 10 IICE Cc1ccn(-c2ccccc2NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 759523373 RUKKOLYNQIUBCO-HDICACEKSA-N 437.519 4.255 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@H]2[C@H]2CNC(=O)C2)c(C)n1-c1cccc(C(F)(F)F)c1 764462147 JYVDRRNDXAZNAA-UTKZUKDTSA-N 447.501 4.286 10 10 IICE COc1ccc(N(CC(=O)NCCc2cccc3cccnc23)Cc2ccco2)cc1F 768553670 DWQFFXIJTFYODM-UHFFFAOYSA-N 433.483 4.341 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CC[C@@H](c2ccccc2F)C1 769036369 LDOBYZKLUSUUSP-JOCHJYFZSA-N 436.575 4.057 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CN[C@H](c3ccc(Br)cc3)C3CC3)cc2)C1 774392572 PDUNCIXCGGENJR-UGKGYDQZSA-N 442.401 4.392 10 10 IICE Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 784071318 GQSKVSNPLSOBLQ-ZIAGYGMSSA-N 435.883 4.239 10 10 IICE CCOC(=O)c1cnn(C2CCN(Cc3ccc(N(C)C)cc3C(F)(F)F)CC2)c1C 809687578 KEMFFMTXGHACMF-UHFFFAOYSA-N 438.494 4.290 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1132264000 JNNHRUFTQCVKIL-UHFFFAOYSA-N 439.581 4.055 10 10 IICE COC(=O)c1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1 1137814776 OEDDCLXYLKAHKI-UHFFFAOYSA-N 443.547 4.090 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3cccc(O)c3C2)c(C)n1-c1ccc(Br)cc1 1154261558 BAUCGWZZHZMDFE-QGZVFWFLSA-N 425.326 4.459 10 10 IICE O=C(C[C@H]1C(=O)Nc2c(Br)cccc21)NCc1c(O)ccc2ccccc12 1157050684 HXULOYVEAIJHHU-OAHLLOKOSA-N 425.282 4.050 10 10 IICE COc1cc(Br)ccc1CCCNC(=O)NCc1c(O)ccc2c1CCCC2 1230779817 XEWQWSAKZGHQSC-UHFFFAOYSA-N 447.373 4.474 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1252923713 NJJFDADCUOSWGX-IEBWSBKVSA-N 433.474 4.492 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] 1254730507 OEGDHVQYZQKYEO-UHFFFAOYSA-N 435.322 4.155 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1295414828 LNDRVGLNQYJSCN-PXDATVDWSA-N 441.620 4.072 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H]([C@@H]3CCOC3)C2)cc1 1295420554 SIKRKNITZYSAGU-FCHUYYIVSA-N 425.621 4.234 10 10 IICE Cc1ccc2c(c1)[C@@H](NC(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)CCC2 1298822869 RYLDLBCKGINEPC-IBGZPJMESA-N 442.562 4.370 10 10 IICE Cc1ccc(-n2cnnc2SCC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1C 1299477970 JEIMBOMIGYTPOL-LJQANCHMSA-N 437.613 4.098 10 10 IICE CNC(=O)[C@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)Cc1ccc(F)cc1C 1307151196 RBEUSNXZCQUJSH-IBGZPJMESA-N 449.482 4.290 10 10 IICE CC[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1312994934 PZNUATAPCVFYSI-RTBURBONSA-N 446.389 4.357 10 10 IICE COc1ccc(N2CCCN(C(=O)C[C@@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1355459199 XZAGAQOHASBXNC-LJQANCHMSA-N 433.593 4.063 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2ccc3c(c2)OC(F)(F)O3)c1 1452689604 ZYHLDEBVFQCWLE-UHFFFAOYSA-N 426.419 4.201 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@H]1CCCC1(F)F 1460197403 BLYWYNBXRFPTEP-HLVNSREUSA-N 430.567 4.281 10 10 IICE COC(=O)c1c(F)ccc(F)c1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1462890429 DYSMXONBIAHJCH-UHFFFAOYSA-N 441.478 4.111 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C1=NO[C@@]2(CCCN(C(=O)OC(C)(C)C)C2)C1 1467497586 MAXMRNMHHGGUSD-DEOSSOPVSA-N 445.560 4.067 10 10 IICE Cc1ccc(-n2nc(C(=O)NCc3cccc(Br)c3O)c3c2CCC3)cc1 1467762326 YAGVVSPEHZKQPX-UHFFFAOYSA-N 426.314 4.068 10 10 IICE COc1cc(N2CCc3[nH]c4c(Br)cccc4c3C2)c([N+](=O)[O-])cc1OC 1472668659 UQTUZAMZYFYNOF-UHFFFAOYSA-N 432.274 4.419 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)cc2)CC1 1473558333 QUQKDQRBENSLJK-NZQKXSOJSA-N 429.605 4.133 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](c2cncc(Br)c2)C2CC2)cc1 1478626778 QORGQNQXELHDGL-HXUWFJFHSA-N 447.377 4.082 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@H]2Cc2ccccc2Cl)N(C)C)cc1 1479533651 ICUQKCFBNQQLHN-FYYLOGMGSA-N 429.008 4.425 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c1 1523116907 SQXMAXXPRQFFQP-JOCHJYFZSA-N 437.971 4.378 10 10 IICE Cc1ccc(N=Nc2cc(C)ccc2NC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 1523258623 YSGGMDSYMAFYEJ-UHFFFAOYSA-N 435.509 4.155 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3ccccc3n2CC(F)(F)F)N(C)C)cc1 1539705601 GJDLPYIYWZNOPU-NRFANRHFSA-N 432.490 4.302 10 10 IICE Cc1cc(-c2nnc(N(C)CC(F)(F)F)n2CCN2CCCC2)c(C)n1-c1ccccc1 1542181363 SISCRXBCTMNWPF-UHFFFAOYSA-N 446.521 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)cc1 1545095194 MSPKQUJJNFWXOY-AREMUKBSSA-N 429.564 4.182 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@@H](OC(C)(C)C)C2)cc1F 1552838121 UJTPBKMHRAKSBZ-WIYYLYMNSA-N 445.583 4.167 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)C[C@@H]1C 1564945997 WOEXRKYIOFVHOQ-FHWLQOOXSA-N 432.609 4.031 10 10 IICE Cc1ncsc1/C=C\C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1584901516 OGISXFDIYTWIGN-LZNQSLFOSA-N 431.533 4.334 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 1596359208 RHHCGUXNVWBQLD-UHFFFAOYSA-N 433.961 4.392 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1597572757 SMPZJLLCYVYVLG-UHFFFAOYSA-N 440.927 4.197 10 10 IICE CCN(CC(C)C)c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1615298104 NLPNISDDCWPNLI-UHFFFAOYSA-N 427.637 4.216 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1CCCc1ccnc(C(C)(C)C)n1 1617939713 GGXPNENIVBXAPJ-UHFFFAOYSA-N 445.571 4.336 10 10 IICE Cc1cc(F)ncc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1618368031 BQUFPQSJCAXSKL-UHFFFAOYSA-N 426.249 4.254 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N 1622328075 KWROEZZUCNLXLR-UHFFFAOYSA-N 444.285 4.461 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cccc(O)c1 1625101834 QGEKGVWHECIBMG-NCUBORBFSA-N 430.526 4.000 10 10 IICE Cc1cccc(NC(=O)N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c1 1627428172 ZOJNWXPLLNYONO-UHFFFAOYSA-N 444.535 4.205 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1NCc1ccccc1 1629488303 DRVQIVSLLJDJLC-UHFFFAOYSA-N 437.490 4.344 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1 1631531059 FWFKVNSYTWATGN-QGZVFWFLSA-N 443.463 4.285 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c(C)n1-c1ccc(Br)cc1 1632752526 FPRXPZCPJIAYLQ-ZBFHGGJFSA-N 446.389 4.376 10 10 IICE COc1cc(N(C)C(=O)c2cccc3c2CCN3C(=O)OC(C)(C)C)cc(OC)c1OC 1633580999 AEQXIDPSEVYQJH-UHFFFAOYSA-N 442.512 4.287 10 10 IICE C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1641200315 HIORYVYCVFGBRQ-OAQYLSRUSA-N 444.575 4.322 10 10 IICE CN1C(=O)N(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)S(=O)(=O)c2ccccc21 1643993188 LDRAPLLPMMSYHV-UHFFFAOYSA-N 449.492 4.301 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)Nc3c(C(C)=O)oc4ccccc34)CC2)cc1 1652964488 MESVABROWZAWRU-KRWDZBQOSA-N 435.524 4.183 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCc1ccccc1N1CCOCC1 1655629782 HQOJEXFBQCLSPA-UHFFFAOYSA-N 431.492 4.317 10 10 IICE CC(C)N(CC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1)Cc1ccc(N(C)C)cc1 1657024425 YDFAJMUIMZWCSX-NHCUHLMSSA-N 438.616 4.215 10 10 IICE Brc1cnn(CCNCc2ccc(N3CCCCC3)c(Br)c2)c1 1657939838 IRFOWPBQKMYUCO-UHFFFAOYSA-N 442.199 4.188 10 10 IICE COc1cc(CCCNC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc(OC)c1O 1684233167 XDCDJOHXSWRBGZ-UHFFFAOYSA-N 437.540 4.249 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(C(N)=O)CCCC1 1693994293 BZIBXBGRWFNWCU-LJQANCHMSA-N 438.620 4.074 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)(C)C 1706057318 FIXDRZOBPAXBIU-UHFFFAOYSA-N 436.604 4.361 10 10 IICE C[C@@H](CC#N)N(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1706750093 KKUJUAFGFLBPKW-IBGZPJMESA-N 438.645 4.351 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCOC 1708339075 FNMDNPHNGHKYSF-BVZFJXPGSA-N 439.604 4.232 10 10 IICE CCOCc1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N2CCSCC2)cc1 1710676487 LZKOVBGJRKKTES-UHFFFAOYSA-N 429.634 4.043 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCN(C(C)(C)C)CC1 1724236404 VSPJEGFFRQHKCD-UHFFFAOYSA-N 426.653 4.210 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)CC2CC(F)(F)C2)cc1F 1729329334 XIBKHCDNYYYMEL-UHFFFAOYSA-N 432.494 4.019 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1741442698 GZIGSEPMYNOBTN-RBUKOAKNSA-N 429.584 4.125 10 10 IICE C[C@H]1CCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C[C@H]1C 1752244926 DAGHOAIPARDXJK-DLBZAZTESA-N 428.631 4.385 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)CCOC)C(C)C 1766432687 KLJDMEHLMRSZOQ-RUZDIDTESA-N 439.604 4.375 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1767112047 NWZAKDZLBHFHBY-QGZVFWFLSA-N 445.614 4.153 10 10 IICE Cc1ccc(S(=O)(=O)n2cccc2C(=O)Nc2ccc(Cc3ccc(N)cc3)cc2)cc1 1865961196 WVUKZPLCCSUCMV-UHFFFAOYSA-N 445.544 4.459 10 10 IICE CCN(CC)CCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CC2)C1=O 1873167397 FMKRIYMPWGEMHF-UHFFFAOYSA-N 448.611 4.048 10 10 IICE COc1ccc([C@@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@H]2C(=O)O)c(O)c1 1952762783 MQKDKURUMGSHGH-NVQXNPDNSA-N 445.471 4.239 10 10 IICE CCOC(=O)C1=C(C)N(CCOC)C(=O)C1=Cc1cc(C)n(-c2ccc(C)c(C)c2)c1C 2293654299 LXIVKPPZHDKFDR-UHFFFAOYSA-N 436.552 4.420 10 10 IICE CN1C(=O)C(=Cc2cn(CC(=O)Nc3ccc(F)cc3)c3ccccc23)SC1=S 2297578097 SUEUWRCYRIAAAH-UHFFFAOYSA-N 425.510 4.250 10 10 IICE CCOC(=O)c1ccccc1NCN1C(=O)SC(=Cc2ccc(N(C)C)cc2)C1=O 2313502108 PXNKQVAXQJEAQB-UHFFFAOYSA-N 425.510 4.035 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccc(C(=O)OC)cc3)C2=O)cc1OC 2314732183 LWHZDILDIPPLDD-UHFFFAOYSA-N 429.519 4.286 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccccc3O)SC2=S)cc1 2314837597 UQCZMVXREWAXJQ-ZDUSSCGKSA-N 428.535 4.019 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(Cc3ccccc3)C2=O)cc1 2323710935 FWVWHQSZCHJLBJ-UHFFFAOYSA-N 440.590 4.335 10 10 IICE CC[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NCc1ccc(C)c(Br)c1O 2381134550 DRDSQGZJTHPALH-CQSZACIVSA-N 443.382 4.409 10 10 IICE COc1ccc([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)c1O 2505589 YXPIMPOYNRDLDB-HXUWFJFHSA-N 449.459 4.161 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2)N1CCOCC1 14465009 UVHIHJSTROXJTD-CNNODRBYSA-N 430.957 4.187 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\c3cccc(OCCC(=O)O)c3)SC2=S)cc1 16908119 OGYQTUJXAAUBPN-QGOAFFKASA-N 429.519 4.345 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(-n3cncn3)cc2)cc1 98077834 HFWSEJHRSABODY-UHFFFAOYSA-N 427.508 4.189 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@@H](C)c3cccc(Br)c3)CC2)cc1 110462856 GFDPMWNBGVUCEZ-HNNXBMFYSA-N 432.362 4.487 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OC 206172107 XUSWJQWCQNOJQC-QGOAFFKASA-N 428.535 4.030 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1ccccc1C 206297560 LXUFSNCISQCTNZ-XDHOZWIPSA-N 443.546 4.259 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)c(Br)c1 705850451 WVHSIMNWRXTZQZ-AQCRLBJHSA-N 427.386 4.288 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](NCc1cc(Br)cc(F)c1O)C2 715736008 DGANROPJQOVIIQ-UVBJJODRSA-N 429.330 4.171 10 10 IICE CC1(C)Cc2ccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)c(O)c2O1 728973485 VMEDKVNNHIZKIO-UHFFFAOYSA-N 432.467 4.106 10 10 IICE CC(=O)Nc1ccc(OC[C@H](O)CN2CCCc3cc(OCc4ccccc4)ccc32)cc1 734486412 LNKLCMFOJWLZMK-XMMPIXPASA-N 446.547 4.417 10 10 IICE CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)/C=C\c2ccc(Cl)cc2)cc1 740813246 ZSGYDEFPAIVWGQ-OWBHPGMISA-N 428.963 4.294 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(-c4ccc(F)c(F)c4)s3)CC2)cc1F 779930744 NIMBIVXPIYLPRG-UHFFFAOYSA-N 433.455 4.198 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 784567107 WEGURNVEROYPHH-WOJBJXKFSA-N 430.017 4.353 10 10 IICE O=Cc1ccc(OCc2occc2C(=O)NCc2cc(Br)ccc2O)cc1 804736611 VPNPXYKRCSMDPM-UHFFFAOYSA-N 430.254 4.069 10 10 IICE Cc1nc(NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2c3c(sc2n1)C[C@H](C)CC3 917391486 VYQIJOCPHXOOBA-QAPCUYQASA-N 449.624 4.438 10 10 IICE CC(C)CN1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@@H](C)C3)CC1=O 1128878688 BFBFNPMEVNADKD-HUUCEWRRSA-N 434.602 4.271 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1csc([C@H]2CC[C@H](C)CC2)n1 1135732937 MMQJNTSXQMOFPB-KESTWPANSA-N 427.614 4.475 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)C[C@H]2CCN(Cc3ccccc3)C2)cc1 1137008545 BKCDMFPZMHEWQA-RUZDIDTESA-N 443.591 4.430 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cnc1Br 1142713205 RJBGYGBIMXACBH-LJQANCHMSA-N 432.362 4.040 10 10 IICE COc1ccc(-c2cn(-c3ccccc3)nc2C(=O)NCc2c(O)cccc2F)cc1OC 1178412679 DZKYKZZZBZGJEE-UHFFFAOYSA-N 447.466 4.331 10 10 IICE COC(=O)c1ccc(-c2nc(CN(C)CCN(C)c3ccc(OC)cc3)cs2)cc1 1195790957 WNJKRKJCCQHCFM-UHFFFAOYSA-N 425.554 4.174 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N(C)CC1CC(F)(F)C1 1289423186 HJMKOLJGHBJBLG-UHFFFAOYSA-N 426.515 4.244 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 1295406943 ZXOMRZRMKXRPPL-TUTDDJNXSA-N 444.572 4.103 10 10 IICE COC(=O)[C@@H](NCc1cc(Cl)cc(C(C)=O)c1O)c1ccccc1OC(F)(F)F 1308081861 BEPAYRSVRIUVPW-INIZCTEOSA-N 431.794 4.151 10 10 IICE CSc1ccc([C@@H](CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)N(C)C)cc1 1312757496 ZLVZPEMKPHBXNC-IFMALSPDSA-N 443.613 4.108 10 10 IICE COC[C@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1315897376 CZNQZDCPUUMNMO-NRFANRHFSA-N 425.621 4.296 10 10 IICE CCOC(=O)c1c(NC(=O)/C=C\c2ccc(C(N)=O)o2)sc(C)c1-c1ccc(F)cc1 1351239097 OZLGZLHDRQMOTP-LUAWRHEFSA-N 442.468 4.383 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cc(Br)ccc2Cl)N(C)C)cc1 1439959350 DEQQSEGENDBUOL-IBGZPJMESA-N 438.797 4.130 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(C(F)(F)F)c(F)c1C 1446819322 ZVHWROAAMFFOEJ-UHFFFAOYSA-N 433.785 4.327 10 10 IICE CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1448004844 LPMOLWVXNDAYBN-PKOBYXMFSA-N 427.545 4.090 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1451641712 BAPDFNZHSVCESO-XXBNENTESA-N 439.600 4.244 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)COc3ccc(C4SCCCS4)cc3)C2)cc1 1461491901 DUQTXCXWUBOMQC-GOSISDBHSA-N 444.622 4.338 10 10 IICE C/C(=C\c1cccnc1)C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1462930744 NBMOORKRYYJDSJ-BXBHGGAKSA-N 425.504 4.354 10 10 IICE COC(=O)c1ccc(/C=C\C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)o1 1465006860 PVZIAEMSLIMAOJ-PEZBUJJGSA-N 434.492 4.387 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)NCc2c(O)cccc2O)C1 1472063258 FXLYWHYEQKNJQV-MSOLQXFVSA-N 446.931 4.018 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1478841033 OBDWOFJSKLWFKU-RBUKOAKNSA-N 446.636 4.327 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC[C@@H]1CCCCO1 1495638873 HRFBXWRSYLHRLX-OFNKIYASSA-N 441.620 4.476 10 10 IICE Cc1ccsc1Cn1c(N(C)Cc2ccccc2O)nnc1[C@]1(OC(C)C)CCOC1 1510522908 UFDOPQNHQGSKDE-QHCPKHFHSA-N 442.585 4.079 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H](OC)C1 1516727022 ITFFRVHNRXJHGG-MBSDFSHPSA-N 437.588 4.250 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H]3CN(Cc4ccccc4)CCO3)c2C)c1 1540532540 SNWAUICTCXKMGX-RUZDIDTESA-N 431.580 4.342 10 10 IICE Cc1cc(Br)cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1N 1544529923 PTPIQEMMGCUNHK-IBGZPJMESA-N 446.389 4.227 10 10 IICE CC[C@H](C)c1nnc(N2CCC(c3cnn(C)c3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545415918 SFWWTNFOEODIBD-KRWDZBQOSA-N 439.583 4.163 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2nccs2)cc1 1547447793 GNPJXRHTROZTFB-UHFFFAOYSA-N 447.612 4.251 10 10 IICE CN(C)CC(C)(C)Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1552862027 PQMSTQDKVYVEOW-UHFFFAOYSA-N 426.653 4.400 10 10 IICE CCN1CCN(c2ccc(NC(=O)CN(C)c3ccc(-c4nccs4)cc3)cc2)CC1 1559897090 XPRMOXCXWFBSSW-UHFFFAOYSA-N 435.597 4.027 10 10 IICE CCc1ccc([C@H]2CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1564895734 SLKXARYRKVOELR-FQEVSTJZSA-N 429.511 4.063 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccc(C(F)(F)F)cc3)C3CC3)cc2)CC1 1565271635 VNYFDXXOGOXSSK-UHFFFAOYSA-N 446.517 4.331 10 10 IICE Cc1ccc(C[C@@H](CO)NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)cc1 1567609835 JELDCCVUYDTPQI-FQEVSTJZSA-N 441.369 4.498 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(Cl)c(Br)cc1F 1585536273 XXKHQYJAWWNGPC-UHFFFAOYSA-N 441.728 4.133 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(OCC(F)(F)F)nc1 1595992066 GFJCVILFMWMVML-UHFFFAOYSA-N 431.414 4.173 10 10 IICE Cc1ccc(Br)c2cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)[nH]c12 1603555399 PQNFWUZPXNKVHR-HXUWFJFHSA-N 443.389 4.338 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2cccc(F)c2Br)N(C)C)cc1 1627464612 PAZLASPUOHWODO-IBGZPJMESA-N 436.369 4.006 10 10 IICE CCCS(=O)(=O)Nc1ccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)c(F)c1 1627804145 YOTLEKINNAVMET-UHFFFAOYSA-N 430.505 4.032 10 10 IICE COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1NC(=O)c1cc(O)cs1 1628309531 KHJXZFXNMNQWMS-UHFFFAOYSA-N 438.914 4.169 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CN(Cc1ccccc1)c1ccccc1 1628853822 AXWQRDOWSXFLGK-UHFFFAOYSA-N 429.564 4.188 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)ccc21 1629378529 BWTTWJKOYDJRSW-INIZCTEOSA-N 431.577 4.137 10 10 IICE O=C(CCCc1ccc2c(c1)OCCCO2)N(Cc1ccccc1O)C[C@H]1CCCO1 1636951774 XTWNSVGQSYDJRV-OAQYLSRUSA-N 425.525 4.084 10 10 IICE CC(C)(C)OC(=O)N1CCC=C(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CC1 1638272879 GUPHGDBBXYPYCW-UHFFFAOYSA-N 433.512 4.292 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C[C@H]2C)c1 1639700622 ARLZQGWZWLHOJU-IERDGZPVSA-N 439.556 4.424 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3cccc4cnccc34)C[C@@H]2C)c([N+](=O)[O-])c1 1639858994 ZNKMRFJWJJUEAW-LKUPDRCFSA-N 432.480 4.044 10 10 IICE Cc1ccc(C(=O)Nc2cnn(CC(=O)OC(C)(C)C)c2)cc1-n1c(C)cc(C=O)c1C 1640016704 SZNXKHYSDHWCIK-UHFFFAOYSA-N 436.512 4.006 10 10 IICE C[C@H](NC(=O)Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)c1ccccc1O 1648891980 KLVDEBGMLLLNAX-ZDUSSCGKSA-N 443.297 4.420 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@H]2CCCOc3cc(Cl)ccc32)N(C)C)cc1 1679471155 MNUOMMMPGVKYFH-LEWJYISDSA-N 430.980 4.222 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@@H]3CCCc3ccccc3)cc2)CC1 1685243784 BDBVYWKSJIKMOF-VWLOTQADSA-N 448.611 4.085 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1712726116 KPJOAJZOTLWTOR-PXNSSMCTSA-N 425.602 4.329 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1727664238 OSYHCSCEQGVYHA-XXBNENTESA-N 439.648 4.457 10 10 IICE Cc1cc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)CCCCCO)no1 1742130268 YEJXNLMDLSGFOB-UHFFFAOYSA-N 448.571 4.296 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1 1747451789 RSOOPGRSUVCMTI-WJOKGBTCSA-N 439.629 4.358 10 10 IICE CC(C)N(C)CC1CCN(c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1750877525 RUTNBIWZOSDHMK-UHFFFAOYSA-N 442.627 4.041 10 10 IICE CCOc1ncccc1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1766105951 PWDYYPYIBURGEM-UHFFFAOYSA-N 435.553 4.114 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](SC)C(C)(C)C)CCOC1 1767394837 XBKWPSKKVAEBKX-AUSIDOKSSA-N 448.633 4.050 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](CCOC)C1 1771046718 JTCXHIFGVNWNDR-OAQYLSRUSA-N 437.588 4.252 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(CCc4ccccc4)n(CC(C)C)n3)CC2)cc1 1862311006 PEWWIWZAQYNIHA-UHFFFAOYSA-N 446.595 4.295 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)/C2=C/c2cccc(OC)c2O)cc1 1865658504 JQUILKHSNSHCDD-KGENOOAVSA-N 432.451 4.379 10 10 IICE CCCCOc1c(Br)cc(/C=C2\C(=O)N(C)N=C2C(F)(F)F)cc1OC 1865667726 MUEUNGUUTVKMTK-XFFZJAGNSA-N 435.240 4.410 10 10 IICE COc1ccc(N2CCN(c3nc(Nc4ccc(C)cc4C)ncc3[N+](=O)[O-])CC2)cc1 1871311704 JJCJXMDOEPMZEI-UHFFFAOYSA-N 434.500 4.080 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@@H]2[C@@H](NCc3cc(Br)cc(F)c3O)[C@@H]21 1966019275 MNXMHMLOUJHWMH-FVQBIDKESA-N 429.330 4.171 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@@H]1NCc1c(O)cccc1Br 2144130938 SRSDMIWWBWSAKT-HKUYNNGSSA-N 433.346 4.435 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1C(C)(C)[C@@H]2NCc1cc(Br)cc(F)c1O 2175899881 CQMWMAMDFGECCH-XYPHTWIQSA-N 443.357 4.417 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccc(N4CCCCCC4)cc3)C(=O)NC2=S)cc1 2296179690 RLPCPIWVDCKLKI-UHFFFAOYSA-N 449.576 4.297 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](CC(=O)O)c3ccccc3)C2=O)ccc1O 2296879841 FUYUHFVXJGBQGB-HNNXBMFYSA-N 429.519 4.208 10 10 IICE Cc1cccc(COc2ccc(C=C3C(=O)NC(=O)N(Cc4ccccc4)C3=O)cc2)c1 2297624920 FWCKWHLCCBPVDZ-UHFFFAOYSA-N 426.472 4.236 10 10 IICE CCCCCOc1ccc(C=C2SC(=S)N(CCC(=O)OCC)C2=O)cc1OC 2314740296 GMZFAMXCKHINCS-UHFFFAOYSA-N 437.583 4.419 10 10 IICE Cc1ccccc1NC(=O)[C@@H](C)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314836536 GLXCJURTHRUXAS-CYBMUJFWSA-N 427.507 4.132 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2ccccc2O[C@H](C)C(=O)O)SC1=S 2314932591 WYENURKPOFQNRK-CYBMUJFWSA-N 429.519 4.343 10 10 IICE C[C@@H]1SC(=S)N(CCCC(=O)Nc2ncc(Cc3ccc(Cl)cc3)s2)C1=O 11636142 XETAKLPJHDIIOL-NSHDSACASA-N 440.015 4.355 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 15038222 SNDLCAVJSYAAEB-WJDWOHSUSA-N 447.925 4.478 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)/C(=C\c2ccc(O)c(Br)c2)SC1=S 40940660 TUMOLWLGTYHOHZ-OQLLNIDSSA-N 449.351 4.009 10 10 IICE Cc1cc(C)c([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@@H]3C=CC[C@@H]32)c(C)c1 226684847 UMFXZUOSQDYRFL-TYBLODHISA-N 438.593 4.459 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@H](c3cccc(Br)c3)C2)c([N+](=O)[O-])c1 748793816 NDPVHQBCLPXXOK-FNQPIQQGSA-N 447.285 4.121 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc([N+](=O)[O-])cn2)c(C)n1-c1ccc(F)c(Cl)c1 761985823 DCMHHKBTVAGCGU-UHFFFAOYSA-N 431.807 4.230 10 10 IICE COc1ccc(C(=O)CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c(Cl)c1 780496712 UBDQNKNVBPEYBE-GOSISDBHSA-N 431.916 4.225 10 10 IICE Cc1nc2c(s1)[C@H](NC(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CCC2 780832185 RCSARBKWMRQKSQ-GOSISDBHSA-N 436.528 4.399 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1 801628297 DHWNUWUOEGKYJI-HXUWFJFHSA-N 446.569 4.179 10 10 IICE C[C@@H]1c2ccsc2CCN1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 916631158 DBVAJMNPEVHYHJ-CQSZACIVSA-N 439.503 4.432 10 10 IICE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1125519527 XMWNNLZHHYSYST-CLOONOSVSA-N 447.620 4.278 10 10 IICE Cc1ccc(NS(=O)(=O)c2cc(C(=O)NCc3ccc(N(C)C)cc3)ccc2C)cc1 1135642221 BBPDWTLPQLZBMK-UHFFFAOYSA-N 437.565 4.100 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCN2C[C@H]3CCCCN3C2=O)cc1 1148605736 HXTFURRBNFPUHX-HXUWFJFHSA-N 434.544 4.188 10 10 IICE COC(=O)[C@@](C)(CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1154462241 QQHIYLWKPFDTQS-SANMLTNESA-N 432.520 4.076 10 10 IICE CCC[C@@H]1CN(CC(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OCC)CCO1 1168200179 GHLVIBMYDXALRD-GOSISDBHSA-N 430.570 4.340 10 10 IICE COc1ccc(N2CCN(Cc3nc(-c4c(F)cccc4F)cs3)CC2)c(OC)c1 1175521748 ANWKGTWTLPUPRT-UHFFFAOYSA-N 431.508 4.428 10 10 IICE CCN(CC)CCNC(=O)c1cccc(NC(=O)c2sccc2-n2c(C)ccc2C)c1 1290981997 QJFMAFFWMMYYOZ-UHFFFAOYSA-N 438.597 4.480 10 10 IICE CCOC(=O)c1c(NC(=O)COCc2ccnc(O)c2)sc(C)c1-c1ccc(F)cc1 1352684891 ZLBCPDLGHKAYHE-UHFFFAOYSA-N 444.484 4.295 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Cl)cc(Br)c3F)C2)cc1 1437579715 PERDVBCDXSVUJR-LBPRGKRZSA-N 427.701 4.259 10 10 IICE CCN1C(=O)C[C@H](C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)[C@H]1c1cccnc1 1442453040 UYJMFQTXHOWNPH-UKILVPOCSA-N 434.584 4.076 10 10 IICE Cc1oc(-c2ccccc2)nc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445877885 AUKZDZBMZOCYQR-IBGZPJMESA-N 425.916 4.403 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C\C(=O)N2CCN(C3CC3)c3ccc(F)cc32)C1 1448022765 RCFYIZDIBVPTTB-KOJMWDNASA-N 429.536 4.344 10 10 IICE COC(=O)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1Cl 1456438462 BSIVIARDQQZRPC-UHFFFAOYSA-N 439.943 4.487 10 10 IICE O=C(c1c(F)ccc(O)c1O)N1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 1457717576 ZRCHOSWLIPAHAF-QFIPXVFZSA-N 440.902 4.438 10 10 IICE CC(C)c1nnc(N(C)[C@H](C)c2ccco2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1508892982 ABFCWWNOODYKEL-LJQANCHMSA-N 437.588 4.449 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](c3c(F)cccc3F)N(C)C)c2C)cc1 1543905163 ICVMNMDUXYVFTA-JOCHJYFZSA-N 427.495 4.414 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1c(C)noc1C 1555510923 YPHJELQKTBFYLQ-UHFFFAOYSA-N 448.571 4.283 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]2C2CCC2)n1Cc1ccc(N(C)C)cc1C 1555652651 AGKGKWTYRWPFPV-AUSIDOKSSA-N 441.620 4.194 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)Oc3ccc(C(F)(F)F)cc3)CC2)cc1F 1595483461 VNLNCAKNRNPTNX-UHFFFAOYSA-N 440.437 4.359 10 10 IICE CN(C)c1ccc(Cn2c(N3CCCC4(CCOCC4)C3)nnc2C(C)(C)C)cc1F 1617667385 OPEMMBBDOZEZJH-UHFFFAOYSA-N 429.584 4.226 10 10 IICE CSCCCN(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1620286746 PYLWQCXNHDQEPI-OAQYLSRUSA-N 443.661 4.256 10 10 IICE COc1ccc(C(=O)NCCNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1 1626124841 NTMZWYWSKTWMLA-UHFFFAOYSA-N 433.552 4.386 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cccc3ncccc23)NC(=O)OC(C)(C)C)cc1 1628496419 YGUXYSPEKMNLEW-QHCPKHFHSA-N 448.567 4.226 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2)cc1 1630618785 HLVWQODIHMHAOT-QFIPXVFZSA-N 445.563 4.100 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4cccc(C(F)(F)F)c4nc3O)CC2)cc1 1632157958 KPTYFQBBOAJVNN-UHFFFAOYSA-N 445.441 4.320 10 10 IICE CC1(C)[C@@H](NC(=O)NCc2cccc(Br)c2O)C[C@@H]1OCc1ccccc1 1634535478 ABBBZNUZXJUZIH-ROUUACIJSA-N 433.346 4.338 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cc(Cl)c(C)c(Cl)c3)CC2)cc1 1641947165 XHEBABJBYCVMDX-FPLPWBNLSA-N 448.350 4.154 10 10 IICE COC(=O)CC[C@H](SC1=NC(=O)/C(=C\c2csc3ccccc23)S1)C(=O)OC 1652013952 NXOBHBNFCHUHNX-AHSSXEFNSA-N 435.548 4.100 10 10 IICE CCOc1cc(CN(C)C(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)ccc1OC(F)F 1682645977 LWHDUWQPMSQLNB-KRWDZBQOSA-N 449.498 4.116 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cscn3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1692989534 VWHUXDRUHRWPHD-UHFFFAOYSA-N 436.585 4.216 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1(C)C 1705895630 NCPLHXKPCQVBHE-UHFFFAOYSA-N 432.572 4.034 10 10 IICE CC(C)Cc1nnc(N2CCC([C@@H]3CCCO3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1706396475 CVJPSBPXGOVEHJ-QFIPXVFZSA-N 429.584 4.125 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1708722129 HNKNVBDKZMTWIK-LJQANCHMSA-N 440.636 4.102 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)CCc2cccs2)cc1F 1711004900 CYPYDYNAHFYDNV-UHFFFAOYSA-N 436.560 4.334 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCOC2)nnc1N(C)[C@H](C)c1cccs1 1724235042 LWYMRRVAMVRVJZ-MJGOQNOKSA-N 425.602 4.464 10 10 IICE CN(CCC(F)(F)F)c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1747881675 MWLXLBLEJXRYHA-UHFFFAOYSA-N 442.536 4.291 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(CC2CCCC2)n1Cc1ccc(N(C)C)cc1C 1765173205 LQNVUFIHWKFYLA-HSZRJFAPSA-N 425.621 4.439 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1765523426 MMVPSCZRUVCWNI-KNQAVFIVSA-N 427.593 4.029 10 10 IICE COc1ccccc1-n1nc(C(=O)Nc2ccc(Oc3ccc(N)cc3)cc2)c(=O)cc1C 1866285086 PBGPDRIUACTMKQ-UHFFFAOYSA-N 442.475 4.176 10 10 IICE CC(=O)N1CCCc2cc(S(=O)(=O)Nc3nc(-c4ccc(F)cc4F)cs3)ccc21 1891598646 IYUKOSHSASRXRH-UHFFFAOYSA-N 449.504 4.188 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1C(C)(C)[C@@H]2NCc1ccc(Br)cc1O 2119290656 JGONPDOAOGFAMX-OIISXLGYSA-N 425.367 4.278 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C=C3NC(=O)N(Cc4ccc(C)cc4)C3=O)c2C)cc1 2293769064 SOBMVVXNTCPYJK-UHFFFAOYSA-N 443.503 4.282 10 10 IICE CCc1ccc(C=C2C(=O)N(CCc3ccc(OC)c(OC)c3)C(C)=C2C(=O)OC)cc1 2294037404 BALZTTXHZPEAJW-UHFFFAOYSA-N 435.520 4.182 10 10 IICE O=C1C(=C2SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)c2ccccc2N1CO 2313617639 VEVAPMXYQOWRPK-UHFFFAOYSA-N 437.329 4.066 10 10 IICE CCCC[C@H](NC(=O)C(C)=Cc1ccccc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 2330075976 MOXMCYZDMXYORB-VWLOTQADSA-N 449.595 4.122 10 10 IICE CC[C@@](C)(NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352943965 ARNJDUKTJAVKJV-LJQANCHMSA-N 429.355 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H]2CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380786112 HHAZJVFVCXDWLJ-HNNXBMFYSA-N 441.366 4.211 10 10 IICE CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)/C=C/c1ccc(N2CCCCCC2)cc1 9798719 KCWOWXOFCLPHFT-DTQAZKPQSA-N 430.552 4.365 10 10 IICE Cc1cccn2c(=O)c(/C=C3/SC(=S)N(C(C)C)C3=O)c(NC3CCCCC3)nc12 33489114 NIJNEUGDBQGUKT-SFQUDFHCSA-N 442.610 4.357 10 10 IICE Cc1nnc(-c2cccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)c2)n1C 435913622 JQJCFNLSDWDRAO-UHFFFAOYSA-N 442.567 4.150 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCC(=O)C2CCC(F)(F)CC2)C1 769664172 ZAOCUXHPCSIXOR-UHFFFAOYSA-N 432.511 4.346 10 10 IICE O=C(O)/C=C/c1ccc(N2CCN(Cc3cccc(C(F)(F)F)c3)CC2)c([N+](=O)[O-])c1 920964733 KRFQKRUAIROOOV-FNORWQNLSA-N 435.402 4.034 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc([N+](=O)[O-])c(-n4ccnc4)c3)c2C)c1 1132044688 VTUCHXKAHUDCDK-UHFFFAOYSA-N 429.480 4.426 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CC[C@@H](Nc4ccccn4)CC3)cc2F)C[C@H](C)O1 1141901479 HGUGLRNTXFWQKH-JYAXBFRTSA-N 440.563 4.121 10 10 IICE O=C(c1cc(I)cc(C(F)(F)F)c1)N1Cc2cccc(O)c2C1 1152573625 MVXZMCAVSXRDHL-UHFFFAOYSA-N 433.167 4.172 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1COc2cccc(Br)c2C1 1235735189 KEVSDAXHWHAMBE-MRXNPFEDSA-N 432.362 4.050 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(CC(F)(F)F)C3)cc2Cl)C1 1270439129 JRLMPSHQVMNGJK-RDJZCZTQSA-N 431.930 4.467 10 10 IICE C[C@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)C1(F)F 1302889879 XNRHDNGAVBOKOP-IYBDPMFKSA-N 444.505 4.321 10 10 IICE Cc1cc(OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)c(F)cc1[N+](=O)[O-] 1307332526 BNBOLEUFMDIVHV-UHFFFAOYSA-N 440.427 4.483 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)c2ccc(N3CCNC3=O)cc2)c(C)n1-c1ccccc1 1312906762 QNTOBPRIKLQSDB-IBGZPJMESA-N 445.567 4.227 10 10 IICE Cc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1N1CCOCC1 1353488625 SVRMPZNQZMYTAH-UHFFFAOYSA-N 433.552 4.333 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H](C)COCc2ccccc2)C1 1357122559 HVAGRLMATZODTR-NRFANRHFSA-N 433.596 4.377 10 10 IICE COc1ccc([C@@H](OC)[C@@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1357782152 AGPVSNWDAGPGOH-WINIVTDRSA-N 449.595 4.309 10 10 IICE CSC[C@H](C)C(=O)N1CCC(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1438293892 BLZZGBINGCTDAP-SFHVURJKSA-N 441.641 4.256 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C\C(=O)N2CCN(CC3CC3)c3ccccc32)C1 1445059620 SKRLYJLIQOJJCZ-HSNDNRACSA-N 425.573 4.453 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1 1452013222 WISOZLQDNCCWRB-ILBGXUMGSA-N 436.939 4.437 10 10 IICE Cc1[nH]nc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1Cl 1452605642 IXWFXWQMQSUZIO-DHZHZOJOSA-N 426.976 4.053 10 10 IICE COCCCCN(C(=O)/C=C/c1cnc2ccccc2n1)c1ccc(Br)cn1 1459426312 KLSVTGFAITUFOK-PKNBQFBNSA-N 441.329 4.260 10 10 IICE Cc1cc(C(=O)N[C@@H](c2nc(=O)o[nH]2)C(C)(C)C)c(C)n1-c1ccc(Br)cc1 1469341590 IBCSKPPNMFZHSB-INIZCTEOSA-N 447.333 4.050 10 10 IICE CCCCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1469961888 YFIVCBDLHKCMBR-AZUAARDMSA-N 449.039 4.414 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3nc(-c4ccc(F)cc4)cs3)CC2)cc1 1473295701 HRGPFSWHFRMKJP-UHFFFAOYSA-N 440.544 4.109 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(C(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1502046906 BDAOCJNUOOZEOP-UHFFFAOYSA-N 435.620 4.446 10 10 IICE C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528260907 AKPATOWNBMLXET-MRXNPFEDSA-N 432.511 4.183 10 10 IICE CCn1cc(CN(C)c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)cn1 1547615908 NKVSGWZVIZJRRB-UHFFFAOYSA-N 439.583 4.117 10 10 IICE O=C(NCc1c(O)cccc1F)c1ccccc1SCC(=O)N1CCc2ccccc21 1558455370 NZNHHMLGCOCVOH-UHFFFAOYSA-N 436.508 4.143 10 10 IICE COc1ccc(OCCSCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1559365898 BHLCHNFZSPMOHK-UHFFFAOYSA-N 447.512 4.221 10 10 IICE COc1cc(C(=O)NCc2ccc3cccnc3c2O)cc(OC)c1OCc1ccccc1 1570531774 OAUZZJKYBBXJHI-UHFFFAOYSA-N 444.487 4.467 10 10 IICE C[C@@H](NC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O)c1ccc(N(C)C)cc1 1585424827 SARBOLKNIPKYRF-GOSISDBHSA-N 441.531 4.082 10 10 IICE O=C(/C=C/c1csc(C(F)(F)F)c1)NCc1ccc(N2CCC(O)CC2)c(F)c1 1586864627 NESJWNDCLLFWLM-DUXPYHPUSA-N 428.451 4.197 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(CNC(=O)OC(C)(C)C)s1 1596954403 UPQGTKINBYLTQU-UHFFFAOYSA-N 432.590 4.285 10 10 IICE Cc1cc(-c2nnc(N3CC=CCC3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1611935650 URLPYTSMFOIROU-UHFFFAOYSA-N 427.499 4.401 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2CC(F)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613174856 ITWJXYYHYVSHFW-XTWGIRIWSA-N 443.611 4.233 10 10 IICE CN(CC(F)(F)F)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1617838837 OLNUCORNIAEAJI-UHFFFAOYSA-N 441.567 4.467 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CCCN2c2ncnc3sc(C)cc23)cc1F 1628769837 LNKHDNUIXUUZKP-HXUWFJFHSA-N 441.576 4.270 10 10 IICE C[C@@H](NC(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Cl)c(F)c1 1633358876 NDRPBUGMRKCWDI-GFCCVEGCSA-N 427.854 4.154 10 10 IICE CCOC(=O)C[C@@H]1CCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1634755093 AIZXITKSLUDSRS-INIZCTEOSA-N 433.346 4.414 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2)C1 1638739929 VOUJULSIEPFJFE-OCSRFSMESA-N 430.545 4.139 10 10 IICE CNC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)Cc1ccc(F)cc1C 1638952933 UPZSTFPTEYRQPM-LJQANCHMSA-N 439.506 4.015 10 10 IICE Cc1cc(C(=O)N2C[C@@H]3CCC[C@]3(CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1639940069 GCENJSMAXYFPDK-DFBJGRDBSA-N 438.572 4.256 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](NC(=O)c1cc(C)n(-c3ccc(F)cc3)c1C)CCS2 1640199299 FTGJWQLPLNRWCX-HRZDDSQGSA-N 430.545 4.180 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(Cl)cc3C(C)C)CC2)cc1 1640807468 JTUKQGVEAQBANX-KHPPLWFESA-N 441.959 4.316 10 10 IICE COc1nn(C)cc1C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1641203123 WKEIVWSMZRMTKR-GOSISDBHSA-N 432.446 4.354 10 10 IICE Cc1cc(CN2CCC([C@@H]3OCCC[C@H]3NC(=O)OC(C)(C)C)CC2)ccc1N(C)C 1643326390 UOAJWLHXOGYGBQ-GGAORHGYSA-N 431.621 4.345 10 10 IICE Cc1cc(Br)c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1Cl 1646434841 ICUUBRFUCYKPNI-UHFFFAOYSA-N 437.765 4.302 10 10 IICE Cc1cc(CNC(=O)c2cc(I)ccc2O)c(C)n1-c1ccccc1 1648612026 UVBNINSKQHPVLC-UHFFFAOYSA-N 446.288 4.334 10 10 IICE COc1ccc(N(CC(=O)N=c2cc[nH]n2Cc2cccc(C)c2)Cc2ccco2)cc1F 1653582191 NVFAODTUBVMBEQ-UHFFFAOYSA-N 448.498 4.048 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccccc3Oc3ccccc3)CC2)cc1F 1653749587 TXRHEVMSIJXSNL-UHFFFAOYSA-N 435.499 4.387 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H](c4ccc(F)c(F)c4)C3)C2)cc1 1683504314 PVGKZVFYHUKPMO-HKUYNNGSSA-N 429.511 4.389 10 10 IICE CN(CCOc1ccccc1C(C)(C)C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1685682278 XPVHVCGFWGIMHO-HSZRJFAPSA-N 440.632 4.373 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1694798090 ZEGCKVWWZAAUKF-KNQAVFIVSA-N 438.620 4.033 10 10 IICE CN(C)c1ccc(Cn2c(N3CC[C@@H](CN4CCCCC4)C3)nnc2C(C)(C)C)cc1F 1747577575 RPOMWRWDPVXCSO-FQEVSTJZSA-N 442.627 4.141 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC[C@H]3CCO[C@@H](C)C3)CC2)cc1F 1748849374 NKUHSMLDRZMTLX-OALUTQOASA-N 445.583 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCC[C@H](COC)C2)cc1 1766611636 NCSWYYCLSUUSBJ-QFIPXVFZSA-N 448.615 4.406 10 10 IICE O=C(O)CCc1sc(NS(=O)(=O)c2ccc(Cl)s2)nc1-c1cccs1 1858070071 FBCYPMBJZBDTFP-UHFFFAOYSA-N 434.973 4.405 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CCCN(C(=S)NC)C2)sc(C)c1-c1ccccc1 1860668119 VCSBOOHOIJIJTN-MRXNPFEDSA-N 445.610 4.055 10 10 IICE Cc1ccc(S(=O)(=O)Nc2sc3c(c2C(=O)NCc2ccco2)CCCC3)cc1 1871343292 AZALWZBGCLFMIE-UHFFFAOYSA-N 430.551 4.259 10 10 IICE O=C(Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)Nc1cccc(F)c1 1873860210 VMZHOHWJPXERLD-UHFFFAOYSA-N 438.462 4.352 10 10 IICE O=C(O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cc(O)cc1O 1951662802 JWSZJPKEFICHRP-HXUWFJFHSA-N 449.459 4.248 10 10 IICE CCOC(=O)c1c(CC)nn([C@H](C)c2cc(C)c(C)cc2O)c1I 2079950782 JVYPFEYEHXTGGG-GFCCVEGCSA-N 442.297 4.159 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C3CCC3)c(C(N)=O)c2Br)c(O)c1 2080024838 LESNTUNPROKFDX-GOSISDBHSA-N 434.334 4.116 10 10 IICE CCOc1cc(C=C2SC(NC(C)=O)=NC2=O)cc(Cl)c1OCc1ccccc1 2293465061 QQYOVEDPKONJCI-UHFFFAOYSA-N 430.913 4.424 10 10 IICE COc1ccc(C=CC(=O)Oc2ccc(C=C3SC(=S)N(C)C3=O)cc2OC)cc1 2296538431 PBBJIENWQFPQNY-UHFFFAOYSA-N 441.530 4.154 10 10 IICE Cc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccc4c(c3)OCO4)C2=O)cc1 2296756174 GOABSKCSCXLUFF-UHFFFAOYSA-N 440.546 4.344 10 10 IICE Cc1ccccc1NC(=O)CCCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S 2296880000 PJNFNFARMQAOLX-UHFFFAOYSA-N 440.546 4.344 10 10 IICE CCN(CCO)CCNc1cc(N2CCC[C@H](C)C2)c2noc3c2c1C(=O)c1ccccc1-3 9641212 SZMZKEKREKRMBX-KRWDZBQOSA-N 448.567 4.002 10 10 IICE Cc1cc(C(=O)Nc2ccccc2CN2CCC[C@H](C(N)=O)C2)c(C)n1-c1ccccc1F 109890978 VIKOGPUWHFZNOC-FQEVSTJZSA-N 448.542 4.183 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3C)[C@H]2c2ccc(O)c(O)c2)cc1OC 526494432 CZJBKHWXZHOAOO-QHCPKHFHSA-N 433.460 4.481 10 10 IICE COc1cc(CN(C)C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc(OC)c1 745906024 VCFQKESSIYCUBR-KRWDZBQOSA-N 449.498 4.116 10 10 IICE CC(C)OCc1cccc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768877518 HIBNNGFRIIDYGI-UHFFFAOYSA-N 436.600 4.465 10 10 IICE Cc1ccc(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1C(=O)N1CCOCC1 787645597 RWXYGOIMZBDKDM-UHFFFAOYSA-N 435.499 4.266 10 10 IICE Cc1cc(C(=O)N2CCC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c(C)n1-c1ccccn1 807709937 FDEJZZGOTDYWGQ-RUZDIDTESA-N 438.572 4.352 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CC[C@H](C)C2 1124129668 OIAZEMSWGKSHCN-KBPBESRZSA-N 444.528 4.180 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)cc1 1125692693 RLRLTHKHEFMVRB-FQEVSTJZSA-N 434.559 4.476 10 10 IICE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1135732918 LQQGXTADHLRCDE-RUZDIDTESA-N 447.620 4.059 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ncccc1NCC1CCC1 1141815452 KVTKQEPSAKVWJG-UHFFFAOYSA-N 448.489 4.079 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 1142728135 MOBHPPQTTMWXGT-SFHVURJKSA-N 444.318 4.168 10 10 IICE Cc1csc([C@H](C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1147504436 FUGRGKTZRISCQW-QAPCUYQASA-N 432.590 4.003 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CC[C@@H](C)N(C(=O)OC(C)(C)C)C1 1230200616 LEDAJVFHIXDDGX-NLWGTHIKSA-N 432.609 4.079 10 10 IICE C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1233605141 SGFQVXSAHBBJJI-QGZVFWFLSA-N 449.517 4.439 10 10 IICE CC(=O)c1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1OC(C)C 1264689571 XPZIVWVRBXRBNB-CALCHBBNSA-N 442.531 4.359 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCCc2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1291456136 KKZZJVAAEJXUEA-OAQYLSRUSA-N 448.615 4.141 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](CCOC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291500478 YCNYLDWQDGRCQK-TZIWHRDSSA-N 443.661 4.256 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SC(C)C)CC2)cc1 1295275428 SDFHKPMSIQARIE-UHFFFAOYSA-N 429.542 4.456 10 10 IICE COC1(OC)CC2(CN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)[C@H]2C(C)C)C1 1300067603 XLEXXFAAJXRNCU-QHCPKHFHSA-N 438.568 4.465 10 10 IICE COc1ccc(N(C)C[C@@H](NS(=O)(=O)c2ccc(C)cc2)c2ccccc2)c(OC)c1 1307597423 HCPBHKCTQSJBKR-JOCHJYFZSA-N 440.565 4.168 10 10 IICE COC(=O)[C@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)[C@H]1CCC[C@@H](OC)C1 1307891992 DUKKNMSIBPACRN-AMHTUMDSSA-N 438.528 4.377 10 10 IICE COc1ccc([C@@H]2C[C@H]2CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 1350761069 OBSNJQWRESPFCG-RXVVDRJESA-N 448.485 4.361 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3cc4cc(Cl)ccc4[nH]3)cc2F)C[C@H](C)O1 1357836674 ZVNCCRMNVUXWNQ-GJZGRUSLSA-N 429.923 4.433 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)c(C)n1-c1cccc(Cl)c1 1441066219 KUJIXFDAKLTRFQ-UHFFFAOYSA-N 439.918 4.485 10 10 IICE COc1cc(N(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc(OC)c1OC 1444026773 NCQSOFCSZNAWLR-UHFFFAOYSA-N 436.508 4.138 10 10 IICE CC(=O)N[C@@H](C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)C(C)C 1457572318 FTGUUPJSWHEDTK-TZIWHRDSSA-N 435.490 4.459 10 10 IICE CCn1cc(Cl)c(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 1462853636 MAFURLAFEXHPST-UKTHLTGXSA-N 441.003 4.238 10 10 IICE CCCNC(=O)Nc1ccc(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)cc1 1468658036 HKFPKMRXLAVXGJ-UHFFFAOYSA-N 428.496 4.109 10 10 IICE CCS[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473396390 BEKFZUXAONKKLM-UZQPLGKSSA-N 436.577 4.443 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)N(C)CC)C1 1499568130 IKMPNSDSQFAJLM-HXUWFJFHSA-N 434.588 4.067 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@]2(CCCOC2)C1 1510677042 ZTICGAIGMCKTHF-RUZDIDTESA-N 425.621 4.296 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C1 1512003641 XUZOMCHVZCQRPB-CALCHBBNSA-N 428.631 4.385 10 10 IICE COC(=O)[C@@H](C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1515269009 HCRBLJUCFORHBD-SIBVEZHUSA-N 447.579 4.074 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@H]1CC1(C)C 1517121339 DATDXPCDYJMCTD-HXUWFJFHSA-N 425.621 4.386 10 10 IICE Cc1c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cccc1N1C(=O)N[C@H](C)C1=O 1532720532 DYNULNNWXXHFCH-QGZVFWFLSA-N 430.508 4.028 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccccc2CN2CCCC2=O)cc1 1544735507 CSJJQNNOTJQHFU-UHFFFAOYSA-N 429.520 4.210 10 10 IICE CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)c1cc2cc(O)c(O)cc2s1 1545993849 GURAAGPECHUYRQ-KXBFYZLASA-N 439.581 4.389 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1547443758 HEPCTAXFVOGYCU-IBGZPJMESA-N 434.588 4.238 10 10 IICE COc1cc(OCCN(C)C)ccc1NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1557025262 NIXLUNQVXOXPJP-UHFFFAOYSA-N 435.524 4.108 10 10 IICE Cc1cc(C(=O)N2NC(=O)C[C@H]2c2ccccc2)c(C)n1-c1cccc(Br)c1 1558888877 PMDSKQYZFMSNGY-FQEVSTJZSA-N 438.325 4.475 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CO)c2cccc(Br)c2)c1 1566770111 XGIVNIHPGBVXJA-NRFANRHFSA-N 441.325 4.133 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@H]1CC1(Cl)Cl 1586884498 KKFFWPRXLLHWHN-CJAAZZPWSA-N 447.384 4.117 10 10 IICE Cc1cc(CNC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)c(C)n1-c1ccccc1 1587886002 HJPGTTDDXBIDTC-UHFFFAOYSA-N 432.492 4.162 10 10 IICE Cc1csc(CN(C)c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)c1 1612367958 DCWPJGVRZBYAPR-GOSISDBHSA-N 443.592 4.432 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@H](C1CCCCC1)N(C)C 1617941300 WDIMDKBSFHAVAK-HSZRJFAPSA-N 448.615 4.116 10 10 IICE COC(=O)C[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)cc1 1625531591 PWCGCOPUBKYUNO-QFIPXVFZSA-N 436.483 4.388 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CSC[C@H]1c1ccccc1 1630263249 VCCRDECJXKMKMY-QHAWAJNXSA-N 431.001 4.273 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc3c(c2)NC(=O)C(C)(C)CO3)cc1 1632558265 QIVXXAQFZJOGCO-UHFFFAOYSA-N 445.519 4.445 10 10 IICE Cc1ccc(C(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1633465577 YUZGPGIPVHYUNR-XMMPIXPASA-N 443.547 4.483 10 10 IICE Cc1cc(CCNC(=O)N2CCCC[C@@H]2COC(=O)NC(C)C)c(C)n1-c1ccccc1 1637410880 TWJSABVBLXMEQT-HSZRJFAPSA-N 440.588 4.335 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc4c(c3)nc(C)n4[C@@H](C)CO)ccc21 1640674700 HDMBZRGWSLTVPS-HNNXBMFYSA-N 434.540 4.368 10 10 IICE Cc1cc(CC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)OC(C)C)c(C)n1-c1ccccc1 1641460369 QZYCGKGUJUIXDA-DEOSSOPVSA-N 434.536 4.021 10 10 IICE C[C@H](N[C@@H](C)c1cccc(F)c1F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1642514610 OTRJEWVWJNRSGW-KBPBESRZSA-N 434.442 4.418 10 10 IICE Cc1cc(C(=O)N2CCCC[C@]23CCCOC3)c(C)n1-c1ccc(Br)cn1 1653931722 VBNJAMHWJNJWBG-OAQYLSRUSA-N 432.362 4.427 10 10 IICE CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1F 1654166636 ATXCWSBGGUNRKS-ATLLOTDBSA-N 445.554 4.182 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCc1cc(NC(=O)OC(C)(C)C)ccn1 1682101593 SRVMNBZTVAILFF-QGZVFWFLSA-N 441.576 4.233 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3c(Cl)cccc3OC(F)F)C2)cc1 1687024479 BRKLWXIBGTWLSO-ZDUSSCGKSA-N 425.863 4.028 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc(-c2ccccn2)n1CCCSc1nccs1 1693877654 SHWXNSZQUQQAIG-LSDHHAIUSA-N 432.644 4.309 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@]1(C)CCCS1 1696248653 PJACVGWIWGIXKK-HSZRJFAPSA-N 429.634 4.337 10 10 IICE C=CCN(CC=C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)C(=O)NC 1705869941 JUEADVKGPMNXRV-UHFFFAOYSA-N 446.599 4.303 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1746089791 HLKGEMIWVKJSEX-JOCHJYFZSA-N 434.588 4.096 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1c(C)noc1C 1763712771 XQMNWOFBRFYZJQ-KRWDZBQOSA-N 438.576 4.170 10 10 IICE FC1(F)CCN(c2nnc([C@H]3CCCOC3)n2CCCSc2nccs2)CC1 1770713126 WKHRKNOWUJECLJ-AWEZNQCLSA-N 429.562 4.047 10 10 IICE CCN(CC)C(=O)COc1ccc(/C=C2/SC(=S)N(c3ccccc3O)C2=O)cc1 1860086498 LWAWOMARDSVVHU-CPNJWEJPSA-N 442.562 4.045 10 10 IICE CCCCCCC(=O)Nc1nc(N2CCN(c3ccc(OC)cc3)CC2)nn1C(C)(C)C 1869970945 UMDHESHDOMLJKJ-UHFFFAOYSA-N 442.608 4.277 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C=Cc1cc(Cl)c2c(c1)OCCCO2 2040482474 QXBFJKRAWSSAFA-UHFFFAOYSA-N 442.943 4.010 10 10 IICE O=C(O)CN1C(=O)C(=Cc2cn(Cc3ccc(F)cc3)c3ccccc23)SC1=S 2294522350 AEAWPFYURWZWJT-UHFFFAOYSA-N 426.494 4.115 10 10 IICE O=C(COc1ccc(C=C2SC(=S)N(c3ccccc3)C2=O)cc1)N1CCCCC1 2314488782 YKIYYICREYTOIP-UHFFFAOYSA-N 438.574 4.484 10 10 IICE O=C(O)c1ccc(N2C(=O)C(=Cc3ccc(Br)cc3)SC2=S)cc1O 2314926402 IKKXTXOXYOIZJV-UHFFFAOYSA-N 436.308 4.259 10 10 IICE Cc1ccc(CNCCC23CC(I)(C2)C3)c(O)c1Br 2353152549 ZTXJZCYXHKTMRP-UHFFFAOYSA-N 436.131 4.301 10 10 IICE Nc1ccc(NC(=O)OCc2ccc(I)c(Br)c2)cc1 2377615790 ITWULEJHSQOHMQ-UHFFFAOYSA-N 447.070 4.385 10 10 IICE CCOc1ccc(-c2cc(CCCC(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)cc1 6577315 YKMJHDFOXVJQOG-UHFFFAOYSA-N 449.551 4.420 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)NN(c4ccc(C)c(C)c4)C3=O)o2)cc1 33347504 VYBUDHXLMRRNHR-KGENOOAVSA-N 430.460 4.202 10 10 IICE CCCCN(C)c1c(/C=C2/SC(=S)N(CCC(C)C)C2=O)c(C)c(C#N)c(=O)n1C 33458223 NEPALVPNAKHRPL-LDADJPATSA-N 446.642 4.049 10 10 IICE COc1cc(/C=C2/C(=N)N3N=C(C45CC6CC(CC(C6)C4)C5)SC3=NC2=O)ccc1O 89259516 MPSLUNHOTNFKEK-GHNOHMOLSA-N 436.537 4.236 10 10 IICE CC(C)Oc1ccc(S(=O)(=O)N(C)c2cccc3c2C(=O)c2ccccc2C3=O)cc1 586256061 DKZZXMKRYGQDQA-UHFFFAOYSA-N 435.501 4.074 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(CNCc1cc(Br)ccc1O)C2 720658992 UVPSPDUBKIBKIQ-IRXDYDNUSA-N 425.367 4.422 10 10 IICE CC[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1c(C)noc1C 742749524 HSKMRJMYNCOZMV-UXHICEINSA-N 444.576 4.233 10 10 IICE COc1ccc(SCCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768533470 QQINUZPVABOVTR-UHFFFAOYSA-N 439.625 4.026 10 10 IICE Cc1ccccc1NC(=O)[C@@H](C)OC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 769663699 PLMAGOCPFASYAA-LJQANCHMSA-N 433.552 4.287 10 10 IICE CCN1CC[C@H](NC(=O)N[C@@H](C)c2cc(OC)ccc2O)[C@H]1c1ccc(Cl)c(F)c1 773808785 GQDYPCGOVVGHCT-JBZDTAIVSA-N 435.927 4.389 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(C(=O)NCc3ccc(F)cc3)CC2)c1 781896787 NWPSYZYOTWBEFT-UHFFFAOYSA-N 435.337 4.131 10 10 IICE CCOC(=O)c1c(NC(=O)CCN(C)[C@H]2CC[C@H](O)CC2)sc(C)c1-c1ccccc1 784392846 HJDGYVHLKAOSFJ-WGSAOQKQSA-N 444.597 4.464 10 10 IICE C[C@@H](NC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1)c1ccc(N2CCOCC2)cc1 801001730 PFLPQDMUMIJYGK-APWZRJJASA-N 425.495 4.348 10 10 IICE CCc1ccc(C(=O)CCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 918140386 MJRIYSJYPZLKCX-ROUUACIJSA-N 426.532 4.281 10 10 IICE Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2)n1 919847097 BPLQTBOCUJLVDT-IBGZPJMESA-N 434.515 4.428 10 10 IICE COc1cc(N2CCN(C(=O)c3ccc(Cl)c4occc34)CC2)cc(OC)c1OC 1127933816 VRMSLPZQUJKLPC-UHFFFAOYSA-N 430.888 4.074 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@@H]2O)c(C)n1-c1ccccc1Br 1141668194 AFWSASCIFNTKCA-RXVVDRJESA-N 441.325 4.081 10 10 IICE CCOc1ccc(OCCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1150347941 LYDBIJMISJDEJV-HXUWFJFHSA-N 446.975 4.384 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)Cc2cccnc2)sc(C)c1-c1ccccc1 1176864308 HOMPZWKCRQGMGK-MRXNPFEDSA-N 437.565 4.455 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(F)(c2ccc(Cl)cc2)CC1 1253512061 QQDOYLITVCZHHH-UHFFFAOYSA-N 445.966 4.472 10 10 IICE COC1([C@@H](C)NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCOCC1 1299523855 LDWTUGSEEXDGJN-MRXNPFEDSA-N 435.362 4.171 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1305483912 YLDVNUOZCLHNAD-MJGOQNOKSA-N 439.583 4.163 10 10 IICE CC(C)c1cccc(O[C@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1356422674 UTAQQZZFJNKHFN-OAQYLSRUSA-N 435.612 4.426 10 10 IICE CC(C)Cc1nnc(N(C)[C@@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1359777251 FHSVDDYVAKCUSJ-NFBKMPQASA-N 425.621 4.376 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccnc(SC(C)(C)C)c3)cc2F)CC1 1360091368 OWMFIDASJYTGLQ-UHFFFAOYSA-N 430.593 4.183 10 10 IICE CC(C)NC(=O)c1nnc(N(C)[C@@H](C)c2ccccc2)n1CCCSc1nccs1 1360161879 IBKUDWNLSWIWLY-INIZCTEOSA-N 444.630 4.253 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(NC(=O)NC(C)C)cc1 1441407866 PWVZNBLFHVUQHO-UHFFFAOYSA-N 432.524 4.367 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)N(C)C)cc1 1463279710 JPHHNIIAPUHPAP-QFIPXVFZSA-N 440.588 4.061 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CSCCN3Cc3ccccc3)c2C)cc1 1466850396 DHNIDVAHQSKBDV-HSZRJFAPSA-N 449.620 4.450 10 10 IICE CC[C@@H](Nc1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1472518662 XNQLFJUCZVHRFP-YADHBBJMSA-N 440.588 4.325 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN[C@@H](C)c1ccc(N2CCOCC2)cc1 1473340222 RVRFPXNBKFBSFT-IBGZPJMESA-N 447.583 4.005 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@]4(CCCOC4)C3)nnc2C(C)(C)C)cc1 1501847848 YUTFWAWYLZFRPB-RUZDIDTESA-N 425.621 4.477 10 10 IICE CC(C)c1nnc(N2C[C@H](C)C(F)(F)[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1509017722 XSEUQDSWEXLLMF-HDICACEKSA-N 433.547 4.014 10 10 IICE CCc1nnc(N2CCO[C@@H](c3ccc(F)cc3)C2)n1CCCSc1nccs1 1513936855 FEXUUTHICKFVBF-QGZVFWFLSA-N 433.578 4.196 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1520854178 BVKCCLRSPXJIRL-QHCPKHFHSA-N 433.577 4.485 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cn(-c3ccc(Br)cc3)cn2)cc1 1525918404 KVAFKIAIQURVJZ-UHFFFAOYSA-N 427.346 4.411 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(C)(C)Oc3ccc(Br)cc3)C2)cc1 1526246236 GNCVNSZUPVWMES-INIZCTEOSA-N 447.373 4.258 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C(F)(F)c2ccc(Br)cc2)cc1 1527594340 AAHMJRKEQZLAAB-UHFFFAOYSA-N 427.289 4.144 10 10 IICE COc1cc(N2CCN(C(=O)c3cc(Cl)nc(C(C)(C)C)c3)CC2)cc(OC)c1OC 1528360331 YPFOVZIQTQOAIU-UHFFFAOYSA-N 447.963 4.021 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3c(C)nn(Cc4ccc(C)cc4)c3Cl)C2)cc1 1531730188 SNQDBOUOSKCQCY-LJQANCHMSA-N 438.959 4.219 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 1536924393 HAXXGJMDQOYESY-UHFFFAOYSA-N 436.987 4.429 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(C4CCOCC4)nn3C)cc2Cl)C1 1539911934 FXANFKHSIXETGY-MRXNPFEDSA-N 430.980 4.134 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@]12CC[C@H]1CN(C(=O)OC(C)(C)C)C2 1540464891 XCILSRBXLQVYPY-CPJSRVTESA-N 427.589 4.282 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)cc1 1542490397 MEZAPEZWEWSHQQ-QGZVFWFLSA-N 435.883 4.275 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)c1 1542917242 CLADVOOXWRWBLH-HSZRJFAPSA-N 429.564 4.201 10 10 IICE CC1CCC(N(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)CC1 1543838355 YPZZVESXXKPCKS-UHFFFAOYSA-N 429.619 4.389 10 10 IICE CCCNC(=O)CN(CCC)C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1544861023 PCTQBDGYIDFWJQ-UHFFFAOYSA-N 434.378 4.235 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C)c(NC(=O)OC(C)(C)C)c3)C2)cc1 1557450079 NEAFDSCDELHKJH-GOSISDBHSA-N 425.529 4.359 10 10 IICE COc1ccc(N(C)CC(=O)N(C)[C@]2(c3ccccc3Cl)CCCCC2=O)cc1OC 1559510404 ZHOBNVKSPMVZPA-DEOSSOPVSA-N 444.959 4.290 10 10 IICE CON(C)C(=O)[C@H](CCSC)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1566696509 WUTLKPUJNUOJAB-NRFANRHFSA-N 431.602 4.089 10 10 IICE CCOC(=O)CCN(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CC1 1583183245 LFQHXUUZEWQZAM-UHFFFAOYSA-N 433.346 4.414 10 10 IICE CC(=O)c1cccc(OCc2cc(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)no2)c1 1585264657 VZUIWRNEVTZIRX-QGZVFWFLSA-N 435.524 4.192 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cccc2c1OCC2 1586378999 JMGXOJJXNOBAAP-FOWTUZBSSA-N 430.576 4.303 10 10 IICE CCN1CCN(Cc2ccccc2CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)CC1 1595702234 IWEWCNWKKSGDFP-UHFFFAOYSA-N 444.623 4.470 10 10 IICE CC(C)(COc1ncccc1Br)NC(=O)c1cc2cc(O)c(O)cc2s1 1596946676 BMFMVUTVMNHGQB-UHFFFAOYSA-N 437.315 4.057 10 10 IICE CCc1cc(C(=O)OC)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1598237914 UJBSUYFOXXUWMF-UHFFFAOYSA-N 433.552 4.396 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1CCCSc1nccs1 1613172920 DYJNZAXDJDMDQA-ZDUSSCGKSA-N 440.042 4.454 10 10 IICE CCC[C@@H](C)CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1614363551 FCAXIEVKFPLHJX-NFBKMPQASA-N 441.620 4.277 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1Cc1cc(COC(C)(C)C)on1 1617939835 IJYXDQXVGAIFDK-UHFFFAOYSA-N 425.533 4.239 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC(Cc2ccccc2)C1 1624206076 BBLWFZJAFTVOHT-MOSHPQCFSA-N 440.565 4.118 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(Nc4nccs4)cc3F)CC2)cc1 1632044206 GJLDVKOEGBLJPN-UHFFFAOYSA-N 426.517 4.433 10 10 IICE Cc1cccc(NC(=O)NCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1635125298 COTXVRJWVZHPKP-KRWDZBQOSA-N 428.964 4.323 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@H]2C[C@H](C)O)c(C)n1-c1ccc(Br)cn1 1640432425 DFWHOVHCBRPLIM-YJBOKZPZSA-N 434.378 4.407 10 10 IICE CCC1(CC)C(=O)N(C)C(=O)N(CC(=O)c2cc(C)n(-c3ccc(C)c(C)c3)c2C)C1=O 1641155944 WHZKASPYLAUEQM-UHFFFAOYSA-N 437.540 4.121 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H](c3ccc(Br)cc3)N3CCCC3)ccc21 1641197383 IHFHDQWWTBGKMZ-QFIPXVFZSA-N 442.401 4.285 10 10 IICE Cn1c(-c2ccccc2)cnc1SCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1 1652515804 JHWITFFMNHYPQQ-UHFFFAOYSA-N 441.000 4.177 10 10 IICE CCOC(=O)c1c(C)nc(O)nc1SCC(=O)c1cc(C)n(-c2ccc(C)cc2)c1C 1653059948 ZKTJOJBOHLWGIK-UHFFFAOYSA-N 439.537 4.358 10 10 IICE COC(=O)c1cnc(S[C@@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)s1 1656580717 PBKLSDKTTHHYBL-ZDUSSCGKSA-N 430.551 4.231 10 10 IICE C[C@H](Sc1ncc(Cl)s1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 1656767437 VVROYVRIBGENEC-LBPRGKRZSA-N 446.019 4.090 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC)[C@@H]2CCCOC2)sc(C)c1-c1ccccc1 1659281519 ZKJIAYAJYNMHAN-GOSISDBHSA-N 430.570 4.340 10 10 IICE COC(=O)c1cccc2c1OCCN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)C2 1684322740 UIJAELWNRUAXEU-UHFFFAOYSA-N 447.535 4.027 10 10 IICE C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1684873446 HDZGJXDEODWYEP-MOPGFXCFSA-N 429.008 4.425 10 10 IICE Cc1cc(CCNC(=O)N2CCO[C@H](COc3ccccc3)C2)c(C)n1-c1ccccc1 1687216786 JKHBHYBWWKNSRW-VWLOTQADSA-N 433.552 4.126 10 10 IICE Cc1cc(CCNC(=O)NCC[C@@H]2CCC3(CCOCC3)CO2)c(C)n1-c1ccccc1 1687218933 NXRBCBUAAWHJPV-DEOSSOPVSA-N 439.600 4.302 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(C)[C@@H]2CCC[C@@H](C)C2)cc1 1695623451 DLLWSUSATDVJOQ-QIJUGHKUSA-N 438.620 4.139 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](CC)C1 1696424843 TUXNCEUWRHHKGR-SIKLNZKXSA-N 437.588 4.393 10 10 IICE C=C(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CCOC)[C@H](C)C1 1705721452 AABRQMWCKZWKEI-OAQYLSRUSA-N 448.615 4.086 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1C[C@H]1C[C@@H](OC(C)(C)C)C1(C)C 1729419990 BTDVJFTZQCGRFR-QKNQBKEWSA-N 442.604 4.354 10 10 IICE CCCCN(CC)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1745443617 GNBZQHWDYYAWPM-UHFFFAOYSA-N 434.588 4.160 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CC[C@@H](OC)C2)cc1 1766613841 JHEIFTOGPMSUEJ-OAQYLSRUSA-N 425.602 4.050 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@H]1CCCS1 1767113103 JABAGWMYYCSSTQ-NLWGTHIKSA-N 430.618 4.434 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)Nc2ccccn2)n1CCC1=CCCCC1 1768682197 TWHRXQWWVPSVMP-UHFFFAOYSA-N 432.528 4.158 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1 1769197049 BJOFCZZEKANQOL-PGRDOPGGSA-N 437.588 4.250 10 10 IICE C[C@H]1CN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)C1(F)F 1771501158 TZGWEXSWOKYYBQ-GASCZTMLSA-N 432.494 4.254 10 10 IICE CC(C)c1nc2c(Cl)cc(C(F)(F)F)cn2c1/C=C1/SC(=S)N(CCO)C1=O 1858588316 YQAKWZJTEIWZOM-WUXMJOGZSA-N 449.907 4.323 10 10 IICE CC[C@H](NC[C@@]1(C)CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2143387429 OYWSHBIOAQLZNN-JXFKEZNVSA-N 443.382 4.221 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)C1=Cc1cccn1-c1ccccc1 2293128379 RKORBQYROVHBEA-UHFFFAOYSA-N 426.259 4.451 10 10 IICE Cc1cccn2c(=O)c(C=C3SC(=S)N(C4CCCC4)C3=O)c(NCC(C)C)nc12 2296732177 DSBIQHBFNAOKTR-UHFFFAOYSA-N 442.610 4.215 10 10 IICE CC(C)CN1C(=O)C(=Cc2ccc(OCC(=O)NC3CCCCC3)cc2)SC1=S 2331594869 LLRURTMXRHJEKC-UHFFFAOYSA-N 432.611 4.372 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380722534 QNILOYYDQSXSLN-JLTOFOAXSA-N 441.366 4.163 10 10 IICE Cc1ccccc1/C=C1\SC(=S)N(CCCC(=O)Nc2ccc(C(=O)O)cc2)C1=O 15040004 YCLBBQDITHZBOC-AQTBWJFISA-N 440.546 4.313 10 10 IICE CCOc1ccc(/C=C2\SC(=S)N(c3ccc(CC(=O)O)cc3)C2=O)cc1OC 16930503 MYIKLVLXCOZMHV-WQRHYEAKSA-N 429.519 4.127 10 10 IICE O=C(CCN1CCCCC1)NN1C(=O)/C(=C\c2ccc(-c3ccccc3)o2)SC1=S 35518175 WFQOSRRASKQIMR-XDJHFCHBSA-N 441.578 4.055 10 10 IICE CCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OC(C)C)c(OCC)c2)SC1=S 40938781 DWSTYMCCOJOEEE-AQTBWJFISA-N 437.583 4.417 10 10 IICE CCOc1cc(/C=C2\C(=N)N3C(SCc4ccccc4)=NSC3=NC2=O)ccc1O 96488924 WOHIECLTMZBJRI-BXODQFHZSA-N 438.534 4.301 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccccc2-c2cnn(C)c2)C1 436040548 AGMQOIBJFPGPGA-UHFFFAOYSA-N 441.579 4.125 10 10 IICE CS(=O)(=O)Cc1nc(CN2CCCc3cc(OCc4ccccc4)ccc32)cs1 743850436 WUUQYDWTAOQYMQ-UHFFFAOYSA-N 428.579 4.220 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)c1cn(-c2ccccc2)nn1 761786795 OYZCJRTVEMRNAG-CQSZACIVSA-N 444.333 4.028 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc([C@@H]4CCCOC4)c3)cc2F)C[C@@H](C)O1 766367799 PPPCVAZHGBTQGU-KGVIQGDOSA-N 426.532 4.263 10 10 IICE CCN1CCN(c2ccc(CNC(=O)NCc3cccc(-c4cccnc4)c3)cc2F)CC1 766642624 AAIKYYSCWGMZGM-UHFFFAOYSA-N 447.558 4.029 10 10 IICE CCOc1ccc([C@H](O)C2CCN(c3ccc(/C=C\C(=O)OC)cc3[N+](=O)[O-])CC2)cc1 812482416 WXHWVYXSZUJNQU-PRJVNCNKSA-N 440.496 4.130 10 10 IICE C[C@@H](NC(=O)c1cnnn1-c1cc(C(F)(F)F)ccc1Cl)c1ccc(N(C)C)cc1 1128136407 RDCOONBWYAVERL-GFCCVEGCSA-N 437.853 4.497 10 10 IICE COc1ccc([C@@H](CC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)NC(C)=O)cc1 1132264165 KNOAEAMVUCUQBZ-RUZDIDTESA-N 433.552 4.295 10 10 IICE CC(=O)Nc1cccc(OC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1135963186 ZOPIBGLOWDTXQY-UHFFFAOYSA-N 428.286 4.429 10 10 IICE COc1ccc(N2CCN(C(=O)c3nccc4c(Br)cccc34)CC2)cc1F 1137422573 FGVUJSJTLHYNDW-UHFFFAOYSA-N 444.304 4.107 10 10 IICE CCOC(=O)[C@@]1(F)CN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC12CCC2 1147036123 SNUQIIOSLOQOQI-DEOSSOPVSA-N 428.504 4.000 10 10 IICE C[C@H](N[C@H](C)c1c(F)cccc1F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1176323221 SPBYCXXCASTAJN-KGLIPLIRSA-N 434.442 4.418 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H]4[C@@H]3CCN4C(=O)OC(C)(C)C)cc2)CC1 1197146303 PXPCKGUPGIURAJ-GOTSBHOMSA-N 429.605 4.276 10 10 IICE CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1235243230 LRXILQXCEIKOHS-DNQXCXABSA-N 439.600 4.239 10 10 IICE CC(C)CN(Cc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1246304715 VYJHJNHEGPRQTG-UHFFFAOYSA-N 429.008 4.460 10 10 IICE Cc1cc(C)cc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1280360057 UXUYCMLTOGQQFV-XDHOZWIPSA-N 428.554 4.350 10 10 IICE COc1ccc(N2CCN([C@H](C)c3nc(-c4ccc(C)c(F)c4)no3)CC2)c(OC)c1 1308013829 FNPYWWVZWAHWGT-MRXNPFEDSA-N 426.492 4.085 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CCOCCC(C)C)CC2)cc1F 1315513480 UPOKAAFGGPNKFT-UHFFFAOYSA-N 445.583 4.083 10 10 IICE COc1cc(N2CCN(C(=O)[C@@H](C)c3cccc(CC(C)C)c3)CC2)cc(OC)c1OC 1435841890 PXQHCOALNMTGPY-IBGZPJMESA-N 440.584 4.363 10 10 IICE C[C@H]1CC(F)(F)CCN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1438486007 PIHSLWGZALFUMJ-XBUHWIKASA-N 428.501 4.063 10 10 IICE COc1cc([C@H](C)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc(OC)c1OC 1441506772 DZYGGKKCZXPANV-INIZCTEOSA-N 436.508 4.423 10 10 IICE CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1452084194 CEDFBAOQONYGBM-DEOSSOPVSA-N 441.535 4.481 10 10 IICE COCOc1ccc(CCC(=O)OC)cc1NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1455634802 MYMSFMKWVHTOFS-UHFFFAOYSA-N 436.508 4.435 10 10 IICE CSc1ccccc1CN(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1460045496 FMNZOXPTJZNCMY-UHFFFAOYSA-N 430.529 4.254 10 10 IICE C[C@H](NC(=O)c1cc(OCc2ccccc2)ccc1O)c1ccc(N2CCOCC2)cc1 1464531321 UPCHCDONBZVNTJ-IBGZPJMESA-N 432.520 4.299 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCOc2ccc(C(F)(F)F)cn2)c1 1466021970 IDAANCKUQRRVFD-UHFFFAOYSA-N 431.414 4.129 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 1469104659 QUOJZXCCWWQBRT-XHIHJMKYSA-N 429.605 4.144 10 10 IICE COc1cnc([C@@H]2CCCN2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)nc1O 1472257825 CIOQNXCELZMGDO-IBGZPJMESA-N 440.931 4.158 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCOC2)n1CCC1CC(OC(C)(C)C)C1 1503487875 OVTXDPWMKNEZGD-SKINQDTJSA-N 428.577 4.108 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CCCC4)n3C[C@H](C)SC)CC2)cc1 1518309851 RWKLMZHSKPFCBK-IBGZPJMESA-N 443.661 4.488 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)CCCOCc2ccccc2)C1 1524337342 RAYMDLJPJYGPRU-UHFFFAOYSA-N 433.596 4.473 10 10 IICE O=C(CC[C@@H]1CC1(Cl)Cl)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245410 LVGXPHYLSFYUIA-CYBMUJFWSA-N 425.278 4.132 10 10 IICE CN(C)c1ccc(CNC(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)cc1F 1535620025 SQNGZASHUCCPEI-UHFFFAOYSA-N 430.886 4.289 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)O[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1541437502 LUNVENXHJWSFBF-NHCUHLMSSA-N 425.621 4.375 10 10 IICE C[C@H](Nc1ccccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1ccccc1 1556582131 IERXYYGOQPYYPT-HNNXBMFYSA-N 425.510 4.189 10 10 IICE COc1ccc(N2CCN(C(=O)CC[C@@H](O)c3ccc(C(C)(C)C)cc3)CC2)c(OC)c1 1557825575 ZOTZJZXWVOLHEP-HSZRJFAPSA-N 440.584 4.164 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@](C)(CO)c2ccc(Br)cc2)cc1 1570769940 OOSNEWBMWWMFHK-JOCHJYFZSA-N 427.342 4.494 10 10 IICE CC[C@@](C)(C(=O)OC)N(CC1CC1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1585580395 WPUYAKUHVGBHMD-VWLOTQADSA-N 426.557 4.109 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2nccc(Br)c2O)CCCC1 1586418076 MOSGCDLFTFVSLF-UHFFFAOYSA-N 430.302 4.031 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C)c(Oc4ccncc4)c3)CC2)c(OC)c1 1587486967 NBVQVAFUGKPQCT-UHFFFAOYSA-N 433.508 4.162 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1 1596733606 VMKWCZIRRSSYPF-WOJBJXKFSA-N 434.458 4.436 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CCCO1 1617127509 ZLCWLADPQPJDJP-RUZDIDTESA-N 437.588 4.394 10 10 IICE CN(CCC(F)(F)F)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1618152596 QKGYUZRTQWUXNS-UHFFFAOYSA-N 437.510 4.209 10 10 IICE COc1ccc([C@H](OC)[C@@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1624050449 GSNGPOILLIJVOV-WXTAPIANSA-N 434.536 4.350 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)n1C1CCOCC1 1632040682 XNXKJDVWBFITQP-UHFFFAOYSA-N 447.526 4.457 10 10 IICE Cc1cc(C(=O)NCCCN2CCCO[C@H](C)C2)c(C)n1-c1ccccc1Br 1632818907 GPYYFZNQLWZPHJ-QGZVFWFLSA-N 448.405 4.087 10 10 IICE O=C(Cc1ccc(O)c(O)c1)NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 1634003390 LDYWLFJWGRENDU-UHFFFAOYSA-N 433.504 4.041 10 10 IICE Cc1cc(N2CCC[C@@H](NC(=O)N[C@H](C)c3ccccc3O)C2=O)ccc1Br 1634029522 FEXYMAFLOXVWTA-RDTXWAMCSA-N 446.345 4.019 10 10 IICE O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1634753793 RHGZQZKYTQWBNE-CQSZACIVSA-N 439.846 4.177 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2cccc(Br)c2O)CCCC1 1635840769 WJKXPDPWDRURQT-UHFFFAOYSA-N 443.341 4.313 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cc(Cl)ccc3Br)C2)cc1 1636424426 SROHIBATACKZMD-HNNXBMFYSA-N 438.753 4.189 10 10 IICE CCS(=O)(=O)N(C)c1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1640697360 FNHMZJCIYMLEDL-UHFFFAOYSA-N 425.554 4.441 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CCC(C(F)(F)F)CC1 1641897317 IPTIUQOLYOQMAQ-ZDUSSCGKSA-N 430.426 4.063 10 10 IICE Cc1cc(C(=O)N(C)Cc2noc(C3CC3)n2)c(C)n1-c1ccc(Br)cc1 1642622077 IFQHZRBLCOVYKX-UHFFFAOYSA-N 429.318 4.389 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN(CCOC)c1ccc(OC)c(OC)c1 1644797107 MHKQDAYRUNXXAK-UHFFFAOYSA-N 431.407 4.145 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cc(C(F)(F)F)n(C)n3)cc2Cl)C1 1682024812 VIEAPVXOIQPJCK-CYBMUJFWSA-N 443.901 4.328 10 10 IICE CC1(C)C[C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)CCN(C(=O)OC(C)(C)C)C1 1687264293 SPPPQBSONGUSPC-GOSISDBHSA-N 445.604 4.496 10 10 IICE CCSCCCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1696569407 CRZSQSDYHJLPSA-UHFFFAOYSA-N 431.650 4.444 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(F)(F)C1 1749300511 UNDQQSHVJRUECE-MRXNPFEDSA-N 429.515 4.481 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1750280179 WCKBTBAYGZNBBH-MRXNPFEDSA-N 449.675 4.039 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1CCCOC1CCCCC1 1768682230 UKDRLAACJKXUCE-UHFFFAOYSA-N 435.572 4.345 10 10 IICE Cn1c2c(c3cc(Cl)ccc31)C[C@H](C(=O)N1CCN(c3ccccc3F)CC1)CC2 1858153588 NIVNULFIMJFYQV-MRXNPFEDSA-N 425.935 4.425 10 10 IICE COc1cc(/C=C2/SC(=S)N(C34CC5CC(CC(C5)C3)C4)C2=O)cc([N+](=O)[O-])c1O 1858590670 DECMKZFCFYNSIY-REZTVBANSA-N 446.550 4.479 10 10 IICE COc1ccc2c(c1)/C(=C/C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N1CCCCC1)CC2 1865969709 XUGXGEVOXGVHFU-QPJXPZJXSA-N 433.596 4.434 10 10 IICE CCCNC(=O)COc1cn(CC)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1871133551 LVUMVKWIMRSXNI-UHFFFAOYSA-N 434.540 4.129 10 10 IICE CCCN1C(=O)C(NCCCCN2CCCC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873167402 FWIKHPZSUYYLFH-UHFFFAOYSA-N 448.611 4.050 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Cl)cc(Br)c2O)[C@@H](F)C1 2029903617 KFAMUBKMHVINAJ-UONOGXRCSA-N 437.737 4.245 10 10 IICE CC(=O)N(c1nc(C=C2SC(N3CCCCC3)=NC2=O)cs1)c1ccccc1F 2040454501 VMDOUKODEPHJNV-UHFFFAOYSA-N 430.530 4.423 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C(F)(F)F)c(N)c2I)c(O)c1 2079046679 CVAAQHWYDOWFNZ-LBPRGKRZSA-N 439.219 4.348 10 10 IICE CCOC(=O)c1c(CC)nn([C@@H](c2ccc(OC)cc2O)C(C)C)c1Br 2079982520 WNTSIDRIEUVFDO-QGZVFWFLSA-N 425.323 4.344 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@@H]1NCc1cccc(Br)c1O 2144144702 LKDXLQQDKRJCFM-ZWKOTPCHSA-N 433.346 4.435 10 10 IICE CC[C@@H](NC[C@]1(N(C)Cc2ccccc2)CCOC1)c1cc(Br)ccc1O 2155164638 CJNTUKFXNWUVIT-IFMALSPDSA-N 433.390 4.487 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@H](CN)c1cncc(Br)c1 2194918310 UCNFCPIERGLHFQ-SFHVURJKSA-N 435.366 4.005 10 10 IICE O=C1N=C(N2CCN(c3cccc(C(F)(F)F)c3)CC2)SC1=Cc1ccc(O)cc1 2296929532 FAORAXVXIFVYNL-UHFFFAOYSA-N 433.455 4.204 10 10 IICE CCSC1=NSC2=NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C(=N)N12 2297333724 JNLFBMZVMCNDKX-UHFFFAOYSA-N 427.467 4.185 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3C)C2=O)ccc1OCC(=O)O 2314931505 GLKCANPMKNFNKV-UHFFFAOYSA-N 429.519 4.263 10 10 IICE CCCC[C@@H](C(=O)O)N1C(=O)C(=Cc2c(Cl)nc3scc(C)n23)SC1=S 2323814117 OXWCSOIXGRUGCA-VIFPVBQESA-N 429.976 4.202 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2ccc(OCc3ccc(C)cc3)cc2)SC1=S 206836024 CINCVSYPIUHLFX-CPNJWEJPSA-N 427.547 4.338 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1OC 206923245 JPHFUQZDZDQHMN-CPNJWEJPSA-N 442.562 4.339 10 10 IICE CCCNC(=O)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 435513474 DNPHXJIAMJRHPU-UHFFFAOYSA-N 432.568 4.186 10 10 IICE CN(Cc1cc(Cl)ccc1F)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 765537247 QDHJGKOJPAWCQS-UHFFFAOYSA-N 444.982 4.353 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 768915359 KJVNLAQSYUZLFH-GQWLDOHISA-N 441.959 4.035 10 10 IICE c1ccc(CCN2CCC(NCc3ccc(N4CCN(CC5CC5)CC4)cc3)CC2)cc1 773147412 SLHVQAZOLZSYGY-UHFFFAOYSA-N 432.656 4.015 10 10 IICE C[C@H]1CN(Cc2c(O)ccc3ccc(O)c(CN4C[C@@H](C)O[C@@H](C)[C@@H]4C)c23)[C@@H](C)[C@@H](C)O1 783547465 XFDKZDPKCUJOHY-APNJTCTJSA-N 442.600 4.246 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@H]1CCc2ccc(F)cc21 1125965786 QPVWEYYYLTYNSD-FUDBJYBQSA-N 444.528 4.360 10 10 IICE COC(=O)c1cc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)n(-c2ccccc2)n1 1131781837 QXSOEIQTTHGFKZ-UHFFFAOYSA-N 442.519 4.039 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H](c1ccncc1)C1CC1 1134646885 YJMISSJRBZBBRP-LYDJUCFBSA-N 443.619 4.392 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)COc2ccc(Cl)c3ccccc23)N(C)C)cc1 1134682014 QAUUQAFQIYBTCJ-JOCHJYFZSA-N 425.960 4.357 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1c(C)oc2nc(O)n(-c3ccccc3)c(=O)c12 1139123549 IDZZRZNWJQTMTD-UHFFFAOYSA-N 447.491 4.141 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1 1142887287 XXFPQBISJUMVHS-UHFFFAOYSA-N 443.547 4.002 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)[C@H]1CCN(c2ccccc2Cl)C1=O 1146376785 MLUNPQNHBWTSQE-QHCPKHFHSA-N 449.938 4.438 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(-c4ccccc4F)nc3C)CC2)cc1F 1150241161 TYYPDAZFDLPSGJ-UHFFFAOYSA-N 429.492 4.368 10 10 IICE C[C@H](Cn1ccc2ccccc21)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348080 NEZWJJVWACSESU-UTKZUKDTSA-N 425.960 4.417 10 10 IICE O=C(C[C@@H]1C(=O)Nc2ccc(Br)cc21)NCc1cc(Cl)cc(Cl)c1O 1160599282 HSKJCNNLMTZQNU-LBPRGKRZSA-N 444.112 4.204 10 10 IICE Cc1cc(CC(=O)Nc2ccccc2C(=O)N[C@H]2CC[C@H](O)CC2)c(C)n1-c1ccccc1 1163346540 ZQTFEQAJTMYTTA-AFARHQOCSA-N 445.563 4.309 10 10 IICE CC(C)[C@H]1N(C(=O)OC(C)(C)C)CC12CCN(Cc1ccc(N3CCOCC3)cc1)CC2 1176891996 OTBQDXWXIQPUEP-HSZRJFAPSA-N 443.632 4.381 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@@H]1COc1ccc(Cl)cc1 1233605779 ZVXMOZMVTNYEIS-OAQYLSRUSA-N 443.975 4.054 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(C(N)=O)CCCC1 1294419092 NMHJILZXRKYEQF-UHFFFAOYSA-N 434.588 4.245 10 10 IICE CO[C@@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1Br 1295404820 BZBBCNDTXJQEAG-OXJNMPFZSA-N 434.330 4.050 10 10 IICE Cc1cc(CCNC(=O)c2ccc(NS(C)(=O)=O)cc2Cl)c(C)n1-c1ccccc1 1301990927 ZJDITKDZKFMBOJ-UHFFFAOYSA-N 445.972 4.092 10 10 IICE CN(CC(C)(C)C)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1314716460 XBLDMGPPIQESPN-UHFFFAOYSA-N 425.621 4.285 10 10 IICE COc1ccccc1-c1nnc(N2CCSCC2)n1CCCSc1nccs1 1315606987 DHUNXBDLZIOMGB-UHFFFAOYSA-N 433.628 4.146 10 10 IICE CN(CCc1ccccc1F)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1352769158 VCISXQZGMRBVOZ-XMHGGMMESA-N 446.544 4.257 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)C2CC2)cc1 1354143156 XALVYDQDHWXZBD-CVDCTZTESA-N 443.950 4.256 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1361045700 GHNYKHNGEGRSHD-UHFFFAOYSA-N 436.604 4.313 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCC[C@@H]3N3CCCC3=O)cc2Cl)C1 1436046289 CLUGFSFGRYJSMI-QFUCXCTJSA-N 432.008 4.374 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(O)(Cc3cccc(F)c3)CC2)c1 1448073788 WYHJJPJKBVSLTO-UHFFFAOYSA-N 434.511 4.256 10 10 IICE C[C@H](NC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1)c1ccc(N(C)C)cc1 1459175899 AGIQZNSGCQMRRV-YCRPNKLZSA-N 436.383 4.310 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(Cl)c1 1462803667 GUFGZAOISUUBHT-QFIPXVFZSA-N 427.976 4.242 10 10 IICE COc1cccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1OC 1464054940 NHYZRHMSJIQJTQ-UHFFFAOYSA-N 444.329 4.199 10 10 IICE CC(C)n1ncc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1Cl 1465325671 WRFPMDWPGWUDQV-SFHVURJKSA-N 449.983 4.179 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1465840962 MLDRIOMMZICYAP-HOOSLVGPSA-N 426.513 4.207 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1466290172 SAUBAJLIGKACOI-SXLOBPIMSA-N 434.577 4.229 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@H]1C1CC1 1469653010 ULHOIGZDKYOIEI-ZWKOTPCHSA-N 445.357 4.128 10 10 IICE CC(C)CC(=O)N1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 1469959352 KDCVZKUNNKXDHX-IBGZPJMESA-N 449.039 4.366 10 10 IICE Cc1c(Br)cccc1C[C@@H](CO)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 1478471265 SAIMZIGELKTGCR-IAGOWNOFSA-N 448.405 4.035 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3c(C)noc3C)n2Cc2ccc(N(C)C)c(F)c2)o1 1510762224 HLERDEGJZQNHQM-UHFFFAOYSA-N 438.507 4.341 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccc(OC)cc3)n2CCCSc2nccs2)CCO1 1514143979 YATMDUUWVMLNAB-QGZVFWFLSA-N 445.614 4.208 10 10 IICE CCOCC(C)(C)Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O 1516431716 BSUYZGVBGGRRHR-UHFFFAOYSA-N 429.590 4.039 10 10 IICE CCn1cc(Br)c(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)n1 1519550923 JPLKOOKKPOZRKN-ZDUSSCGKSA-N 439.785 4.485 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1524704391 QHBOORMPUYWKPL-MJGOQNOKSA-N 432.008 4.374 10 10 IICE Cc1cc(Cl)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1[N+](=O)[O-] 1527480808 ARABBZXAYOOITM-OKILXGFUSA-N 435.883 4.239 10 10 IICE Cc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1N1CCOCC1 1530325302 VNNNZZGOJIRXHL-UHFFFAOYSA-N 435.490 4.102 10 10 IICE CCOC(=O)C[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1cccc(OC)c1 1544715661 TUXFIWASRRICFJ-XMMPIXPASA-N 448.519 4.340 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cc3c(s2)CCN(C(=O)OC(C)(C)C)C3)c1 1545684211 NXJGGOJKCUXVSD-CYBMUJFWSA-N 432.542 4.247 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC(OC[C@H]3CCCCO3)CC2)cc1 1547442307 NWVRWNOKNLNZAT-XMMPIXPASA-N 441.620 4.036 10 10 IICE Cc1cc(C(=O)N[C@@H]2Cc3cccc(O)c3C2)c(C)n1-c1ccccc1Br 1556198253 ZTOVYCBBQJJFGU-MRXNPFEDSA-N 425.326 4.459 10 10 IICE Cc1cc(CNC(=O)c2cc3cc(O)c(O)cc3s2)ccc1I 1556425774 MVPQXLOTBBUHGW-UHFFFAOYSA-N 439.274 4.156 10 10 IICE O=C(Nc1ccc(C(=O)NCc2ccc3cccnc3c2O)c(O)c1)c1cc(F)cc(F)c1 1557121901 CIGYUWPZTPIODX-UHFFFAOYSA-N 449.413 4.107 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(N2CCC(N(C)C)CC2)cn1 1566283886 OCMTUZDURGIGQG-UHFFFAOYSA-N 445.567 4.084 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C\c1ccc(I)o1 1584095975 RXQGLDMEFIVJMM-GDAGCXPBSA-N 438.309 4.019 10 10 IICE COc1ccccc1[C@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1595776984 KIGCTXRHJDPCMD-QIQQCEGHSA-N 444.553 4.303 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@H](O)CCO3)c(C)n1-c1ccc(Br)cc1 1597227665 CUDGFNIZQZKDDX-LJQANCHMSA-N 447.373 4.003 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(CC)C[C@@H]2CCCO2)cc1 1615378019 HZVWIJXVIDVNQK-QFIPXVFZSA-N 434.588 4.240 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCCCCC1 1623579531 CNXCQCIRUFIPTO-IBGZPJMESA-N 425.566 4.358 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(CCc2ccccc2)CCN(C)C)cc1 1625019230 VVXGSJQRLDQOHW-UHFFFAOYSA-N 431.580 4.082 10 10 IICE Cc1cc(C(=O)N2CCN(CC(F)(F)F)CC2)c(C)n1-c1cccc(Br)c1 1629115944 RBSVMMXYFOIDKI-UHFFFAOYSA-N 444.295 4.177 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)c2ccccc2)c(C)n1-c1ccccc1Br 1631610255 JEFZZUYILLNADY-GOSISDBHSA-N 427.342 4.363 10 10 IICE Cc1cc(CC(=O)NC2CCN(C3CCOCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1632554756 YBVOSNMSWBJATL-UHFFFAOYSA-N 429.992 4.050 10 10 IICE CCO/C=C\[C@](O)(CNC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1637578320 UUMYGPBSBZAWST-YUQDSPFASA-N 439.478 4.045 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1640260162 SZLLECWKLJFFTH-IAGOWNOFSA-N 425.566 4.167 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@H](CO)C(C)(C)C)sc(C)c1-c1ccccc1 1642319030 DCJDHFFOUQNBFP-KRWDZBQOSA-N 432.586 4.178 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(Cc2nc(C(C)C)n[nH]2)CC1 1644279396 ISDFNIQHFAVMSX-UHFFFAOYSA-N 433.556 4.243 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)ccc1N(C)C 1652165319 QKKXIMWIBOBCSW-JOCHJYFZSA-N 442.512 4.024 10 10 IICE COC(=O)[C@]12C[C@H]1CCCN2C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1652394308 NUIQGZKDVMZEEH-VFNWGFHPSA-N 431.330 4.024 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1COc2cccc(Br)c2C1 1683253606 IYHXYIIPBZZESM-WBVHZDCISA-N 446.389 4.057 10 10 IICE COc1ccc([C@@H]2CN(Cc3ccccc3)C[C@H]2NC(=O)N[C@@H](C)c2ccccc2O)cc1 1683308167 WPZONXOWLPWGBX-PNTFMKQHSA-N 445.563 4.429 10 10 IICE C[C@@H]1CN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CCc2ccc(Cl)cc21 1687807835 WIYMDEPQOCTDHK-UZUQRXQVSA-N 429.008 4.380 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCCc2nccs2)cs1 1693385477 ZOCUUMSMDQHOFJ-UHFFFAOYSA-N 440.598 4.065 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1693965786 NRPDZICTGBCCNY-DENIHFKCSA-N 429.609 4.188 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3C[C@H](OC)C(C)(C)C)CC2)cc1 1748846799 APDNHCOTRMNOEJ-QFIPXVFZSA-N 441.620 4.332 10 10 IICE CC1(C)CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)CCO1 1751299853 SXHZVKGYXHFYEP-UHFFFAOYSA-N 443.642 4.317 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC(CCCO)CC2)cc1 1766612041 ZSNRHIVMDLAWDM-UHFFFAOYSA-N 436.604 4.157 10 10 IICE COCCN(C)c1nnc(-c2ccc(Cl)cc2F)n1CCCSc1nccs1 1771067980 KMKAVQRHMMWSEL-UHFFFAOYSA-N 441.985 4.459 10 10 IICE COc1ccc(OCCCC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1865937185 DVZDIRIUGVRMJI-VWLOTQADSA-N 439.600 4.264 10 10 IICE COCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N([C@@H](C)c2ccccc2)C1=O 1873165423 NTVCTCPFGVSMOY-FQEVSTJZSA-N 443.547 4.171 10 10 IICE COc1ccccc1CN1C(=O)C(NC(C)C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873166985 NKDDJXHWBFBNAV-UHFFFAOYSA-N 443.547 4.381 10 10 IICE O=C(N[C@]1(c2ccc(OCc3ccccc3)cc2O)C[C@@H]1C(=O)O)OCc1ccccc1 1952841120 PRXJYIWOTKZQNI-BWKNWUBXSA-N 433.460 4.197 10 10 IICE C[C@@H]1C[C@H](CNCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2115816130 BCRJUEBPSIERRG-CHWSQXEVSA-N 431.346 4.419 10 10 IICE CN(Cc1cccc(I)c1)c1ccc(CO)cc1Br 2265538793 BZWMCMQBBHAXHR-UHFFFAOYSA-N 432.099 4.182 10 10 IICE Cc1ccc(CNC2([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c(O)c1Br 2352945252 SVLXAEAUXZXGAW-OAHLLOKOSA-N 425.367 4.342 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1cc(Br)cc(F)c1O)[C@@H]2F 2358241764 UOMXYRQLWGYAND-OJLVUWQFSA-N 447.320 4.262 10 10 IICE Cc1ccc(CNC(=O)C2(NC(=O)OC(C)(C)C)CCCCC2)c(O)c1Br 2380744554 DTYXICNXIFBHJB-UHFFFAOYSA-N 441.366 4.307 10 10 IICE Cc1ccc(CN(C)C(=O)O[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380787142 QDGUUUQDQFUPEM-AWEZNQCLSA-N 443.338 4.041 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(O)cc3)SC2=S)cc1 15038086 VNARDLRKLNHCQB-AQTBWJFISA-N 428.535 4.021 10 10 IICE CCOC(=O)c1sc(N2N=C(C)/C(=C/c3cc(C)n(-c4cccnc4)c3C)C2=O)nc1C 33337464 VDZGSHMXBMUTBH-ODLFYWEKSA-N 449.536 4.237 10 10 IICE Cc1ccc([C@@H]2CC(c3cccn3C)=NN2C(=O)CN(C)C(=O)c2ccccc2Cl)cc1 35960335 GGRGKDZLDZSFOV-QHCPKHFHSA-N 448.954 4.437 10 10 IICE Nc1ccc(CCC(=O)Nc2cc(I)ccc2Br)cc1 394463417 TWZAXZGVUZEOBX-UHFFFAOYSA-N 445.098 4.207 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(O)=C(c3cccs3)[C@H]2c2ccc(O)c(O)c2)cc1 526278483 ZOCCZIXSVCBYPX-HXUWFJFHSA-N 437.473 4.393 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1 687744892 MBTYGJLSEYBHAZ-VWLOTQADSA-N 433.460 4.326 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1F 726250461 WZABSCQLOZFBJY-AZUAARDMSA-N 448.583 4.213 10 10 IICE Cc1ccc(-n2nnc(CC(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)c2C)cc1 728838201 CZVPVIZLTOSOBL-UHFFFAOYSA-N 445.489 4.084 10 10 IICE Cc1cc(CCNC(=O)Nc2ccccc2SCCC(N)=O)c(C)n1-c1ccccc1 731755608 DHCYFMDISCKEST-UHFFFAOYSA-N 436.581 4.426 10 10 IICE C[C@@]1(c2ccccc2)CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 755867524 RYXQIJKOFBLMJS-JOCHJYFZSA-N 442.562 4.058 10 10 IICE CN(C)CC(C)(C)CN1C(=O)/C(=C/c2ccc(C(=O)OC(C)(C)C)cc2)SC1=S 764884296 FFMFVDLSYHBDCL-ATVHPVEESA-N 434.627 4.431 10 10 IICE C[C@H](N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1)c1ccc(N2CCOCC2)c(F)c1 773105138 QEAIAUHQZSKMIV-MHALITNNSA-N 449.929 4.077 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F 782080603 BEADJRLPOMUFRK-UHFFFAOYSA-N 434.462 4.224 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cccc(CCCO)c1 782088836 SHAYWBUXRGFJPZ-JXAWBTAJSA-N 446.619 4.293 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(C)s3)cs2)c(C)cc1F 794018514 WWPFRDLDIXTQIN-UHFFFAOYSA-N 426.516 4.215 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 806262152 XQRNBNKPXFSLDW-HNNXBMFYSA-N 439.281 4.173 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC23CCN(C(=O)OC(C)(C)C)CC3)c1 812770300 LHSVWUXAPBSYOQ-UHFFFAOYSA-N 425.367 4.439 10 10 IICE Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(Cl)n1 919253391 YUHRUPGVBYISDO-ZDUSSCGKSA-N 448.862 4.003 10 10 IICE Cc1ccc(-n2nnc(CC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2C)cc1 1132011002 ASBFATYBIXIGSI-UHFFFAOYSA-N 427.552 4.193 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)C(F)(F)c3ccc(C(C)(C)C)cc3)cc2)CC1 1138230554 XHJALGFZFFVYTF-UHFFFAOYSA-N 443.538 4.061 10 10 IICE O=C(C/C=C\c1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)cc1 1148705314 HKEDWPLUTUYNCJ-UPHRSURJSA-N 429.358 4.130 10 10 IICE Cc1cc(C(=O)N2[C@H](C)CN(C(=O)OC(C)(C)C)[C@H](C)[C@H]2C)c(C)n1-c1ccccn1 1162925908 LEMPEQLNYRUVSW-KZNAEPCWSA-N 426.561 4.348 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cc(Br)c([N+](=O)[O-])n3)c2C)cc1C 1188659889 FFBROMCAZOWIMV-UHFFFAOYSA-N 431.290 4.461 10 10 IICE Cc1ccc(C[C@@H]2CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1229772756 ITEQPXWNGZWUQS-FQEVSTJZSA-N 429.511 4.027 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H](c2ccc(F)cc2)CC1 1251751052 SZQDGICMDXDWCP-GOSISDBHSA-N 447.501 4.420 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC=C(c2ccc3c(c2)OCCO3)CC1 1251981303 IJFRNDPXBOBVAM-LJQANCHMSA-N 435.568 4.262 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(OCC(F)(F)F)o1 1265564223 GCMCYTYPHCTVGX-GFCCVEGCSA-N 434.361 4.221 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccccc4)cc3)cc2)CC1 1288913548 XFMCRUXHRVFUGV-UHFFFAOYSA-N 429.520 4.111 10 10 IICE CC[C@H](C)c1nnc(N(C)C2CCC3(CC2)OCCO3)n1Cc1ccc(N(C)C)cc1C 1291432964 PWQQWECDQYYCAN-SFHVURJKSA-N 441.620 4.336 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)c(F)c1 1291516518 FJQNVOVDCBMBRT-IEBWSBKVSA-N 438.551 4.098 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1292235196 GEENKMGFTXCYQH-IBGZPJMESA-N 431.536 4.234 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@H]1C(=O)NCc1c(O)ccc2c1CCCC2 1294869437 MOZDCRLPLONJSQ-NRFANRHFSA-N 426.513 4.015 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1 1296536458 GEYUEGREFUYSIS-OAQYLSRUSA-N 439.556 4.426 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1nc(C(F)(F)F)cs1 1298358376 BUUGWGAGQFDRKZ-UHFFFAOYSA-N 425.480 4.441 10 10 IICE C/C=C\[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1299788559 VCLXXJZWXBMVOT-RSMGVOCJSA-N 427.589 4.352 10 10 IICE CC(C)c1csc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)n1 1302542451 UWUOMQLXDKWJAU-IBGZPJMESA-N 427.574 4.490 10 10 IICE CCn1cc(CC(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nn1 1306450034 ICHXCXLDACRLCE-IBGZPJMESA-N 431.462 4.152 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3cc(F)cc(Br)c3C2)c([N+](=O)[O-])c1 1307178538 AZZHQEJLIARLNV-HYXAFXHYSA-N 435.249 4.245 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CSCN2C(=O)c2ccc(C(C)(C)C)cc2)cc1F 1351738491 ONEGZYPAZSKVGV-NRFANRHFSA-N 443.588 4.021 10 10 IICE CCOc1ccc(C(C)(C)C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1OCC 1436973545 WVCAMKYHLPMOAD-LJQANCHMSA-N 440.584 4.413 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3N(C)c3ccccc3)CC2)c(OC)c1 1461981324 KLLRCHGDAUZHNV-UHFFFAOYSA-N 431.536 4.434 10 10 IICE Cc1nc2ccc(O)cc2cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1465532525 HBKPQCFGEQFURS-MRXNPFEDSA-N 427.451 4.249 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccnc1SC(F)(F)F 1465952290 ZPHMYEQYMDCFOS-AWEZNQCLSA-N 445.894 4.447 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)c(C)c1 1473006845 DCPURSZVWQERED-SANMLTNESA-N 447.510 4.500 10 10 IICE CN(CC1CCCCC1)c1nnc(C(=O)N2CCCC2)n1CCCSc1nccs1 1503539442 LVEHEVNIQMSNNS-UHFFFAOYSA-N 448.662 4.170 10 10 IICE CSCC[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1nnc2ccccn12 1525072249 DLCQZIJDNQJJHY-NRFANRHFSA-N 433.581 4.290 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3cn(-c4ccc(F)c(C)c4)nn3)ccc21 1530829699 HJISWJRJTWIRBF-UHFFFAOYSA-N 436.487 4.290 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N(C)c1c(OC)cccc1C(=O)OC 1537500072 ASDTYFVDGSTVAC-YPKPFQOOSA-N 434.492 4.495 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cc(Cl)c3N)cc2F)C[C@@H](C)O1 1543232986 ACPCXYTYAIMQPT-TXEJJXNPSA-N 426.319 4.258 10 10 IICE Cc1cc(CNC(=O)c2ccc(I)cn2)c(C)n1-c1ccccc1 1544085931 AHHHZCKSKPSAOR-UHFFFAOYSA-N 431.277 4.024 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CC1 1547234930 AHFSQVAHGSLHHL-UHFFFAOYSA-N 434.588 4.115 10 10 IICE Cc1cc(CCNc2nc(N)nc(C(F)(F)C(F)(F)F)n2)c(C)n1-c1ccccc1 1559251060 ZZPXWBZVPQPNBQ-UHFFFAOYSA-N 426.393 4.170 10 10 IICE CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1 1565663344 BCJRDMDQNNOCIF-UHFFFAOYSA-N 428.598 4.427 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(F)c(S(=O)(=O)N(C)C)c3)c2C)c1 1568938645 CORVZJCTOGJABZ-UHFFFAOYSA-N 443.544 4.353 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(Oc2ccccc2)ccc1O 1586864850 UIWVTRPEECXEDF-UHFFFAOYSA-N 436.483 4.215 10 10 IICE Cc1cccc([C@@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)N2CCOCC2)c1 1595719353 GJTGJNQYHVGKQY-RUZDIDTESA-N 435.543 4.345 10 10 IICE CC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCC(C)C)CC1 1596166306 PNVRMYCZCGLWGA-UHFFFAOYSA-N 448.615 4.457 10 10 IICE O=C(NCc1c(O)cccc1F)c1cc(I)cc(C(F)(F)F)c1 1596913148 WLQPYGTWAONYOM-UHFFFAOYSA-N 439.146 4.085 10 10 IICE CCC[C@@](C)(O)Cn1c([C@@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1614323707 HSMSLUVBMLMWQU-YADARESESA-N 429.609 4.068 10 10 IICE C[C@H]1CC(=O)CC[C@H]1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616573196 QVJNDWUQAFISEG-SWLSCSKDSA-N 427.302 4.103 10 10 IICE COc1cccc(C(=O)c2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)cc2)c1 1624892666 NCGNDZFQJHFHSW-UHFFFAOYSA-N 446.572 4.409 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@@H](NC(=O)OC(C)(C)C)C3)cc2Cl)C1 1626169111 NWQHBBZSVZHPDJ-NXHRZFHOSA-N 435.996 4.496 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@H](Oc1ccc(Br)cc1F)c1ccccc1 1626838161 OSVURLKBQDHDAH-HXUWFJFHSA-N 446.272 4.436 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2nc(-c3ccncc3)cs2)cc1 1627488574 IUMWUNMPTYCGNA-UHFFFAOYSA-N 444.560 4.327 10 10 IICE CCN1CC[C@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)[C@H](C)C1 1629674021 MCKAGEHXDMCUDP-KUHUBIRLSA-N 433.394 4.054 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1 1634009524 VADYHWBFDRVZKQ-LJQANCHMSA-N 444.597 4.398 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@H]3CCN(c4ccccc4)C3=O)c2C)c1 1637578493 YWXWPFGTLDINRA-DEOSSOPVSA-N 430.552 4.349 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC(C)(C(=O)OC(C)(C)C)CC2)CCCC1 1639839399 WGCLMCHPLDYMQP-UHFFFAOYSA-N 440.584 4.499 10 10 IICE COC(=O)[C@H]1c2ccccc2OCCN1C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1639895984 FSJJQICOFPIELS-JOCHJYFZSA-N 438.911 4.496 10 10 IICE O=C(CN(C(=O)c1ccccc1)c1ccccc1)NCc1cccc(Br)c1O 1640084506 YRDDQKOHQHKWCW-UHFFFAOYSA-N 439.309 4.118 10 10 IICE CCOC(=O)c1cccc2nc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)[nH]c12 1640313347 ACKLUIAZWPZUCO-UHFFFAOYSA-N 430.464 4.212 10 10 IICE Cc1cc(CCNC(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCC2)c(C)n1-c1ccccc1 1643017825 QCVJUJOVNVURHB-QFIPXVFZSA-N 425.573 4.446 10 10 IICE O=C(Nc1ccsc1C(=O)NCc1ccc(O)cc1O)c1ccc(Br)cc1 1643101025 SJVMCRYURILPSG-UHFFFAOYSA-N 447.310 4.104 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](C(F)(F)F)C[C@H]1C(=O)NCc1c(O)ccc2ccccc12 1647791132 LCEIUESVFYRUSH-YOEHRIQHSA-N 438.446 4.350 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCOc1ccccc1Cl 1680667531 BEBDVKKQYRBTHX-UHFFFAOYSA-N 427.726 4.419 10 10 IICE COc1cc(N2CCN(C(=O)NCC[C@H]3C[C@@H](C)CC(C)(C)C3)CC2)cc(OC)c1OC 1681970761 QDEAYDVLSIDQMI-MOPGFXCFSA-N 447.620 4.397 10 10 IICE CCC[C@@H]1CN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CCN1CCOC 1684599601 FDBRSBITQHNJQL-XMMPIXPASA-N 426.605 4.045 10 10 IICE CC(C)[C@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CCO1 1706346185 WMUVMAPNVYAXHC-GOSISDBHSA-N 429.615 4.445 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2=CCCCC2)CCOC1 1706663545 MSIOGMHCNCVRMI-XMMPIXPASA-N 426.561 4.161 10 10 IICE Cc1nc(C)c(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)s1 1707739634 UASLIXUBZKUEGO-UHFFFAOYSA-N 440.960 4.457 10 10 IICE CC[C@@H](C)[C@H](Cn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1708375367 UGEBHDGVTNCSNB-VGSWGCGISA-N 445.583 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccn2)cc1 1710027683 KPDZDEODTJPGFY-UHFFFAOYSA-N 441.583 4.190 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC(CCCO)CC3)nnc2C(C)(C)C)cc1 1710028164 RBKXSQBWMWKHAQ-UHFFFAOYSA-N 427.637 4.459 10 10 IICE Cc1csc(CN(C)c2nnc(-c3cnn(C)c3)n2Cc2ccc(N(C)C)cc2C)c1 1725074665 QZCMWNAPRCGQNQ-UHFFFAOYSA-N 435.601 4.108 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCC[C@H](OC(C)(C)C)C2)cc1F 1729328983 SZRVCJZXUBRLGS-SFHVURJKSA-N 440.567 4.311 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@H]3CCO[C@H]3C(C)C)CC2)cc1 1730181913 VEAJTAMWYHLINX-REWPJTCUSA-N 441.620 4.188 10 10 IICE CO[C@]1(C)CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1748462714 IZMMGEMAFQUQIH-HSZRJFAPSA-N 429.634 4.008 10 10 IICE Cc1nnc(N(Cc2cccs2)C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1751888622 XBRJDMZWQKAGIX-UHFFFAOYSA-N 429.565 4.087 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1771436483 NAMPXEFRYWYIAR-LEWJYISDSA-N 429.634 4.274 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010406571 WFFNKBFNXXTYDA-RBUKOAKNSA-N 431.537 4.178 10 10 IICE Cc1cccc(CNC2(CNC(=O)OC(C)(C)C)CCN(Cc3ccccc3)CC2)c1O 2067210787 YELRAZATULQMEE-UHFFFAOYSA-N 439.600 4.350 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(C)(C)C)c(C(=O)O)c1I 2079027227 QHBYOUKYCCEVBN-GFCCVEGCSA-N 442.297 4.497 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C(C)C)c(I)c1C=O 2079951890 ZUTMBLOVAOJILV-KRWDZBQOSA-N 426.298 4.430 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2c(O)cccc2Br)[C@H]2CCCC[C@@H]21 2122811904 MBHJJSBQUZVEAQ-COXVUDFISA-N 425.367 4.422 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCCOc4ccccc4)c3)C2=O)cc1 2293476877 FXLDEYDZSMMDMG-UHFFFAOYSA-N 442.471 4.119 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1ccccc1C 2297347498 BGEFEPNUCZFUAP-UHFFFAOYSA-N 447.491 4.302 10 10 IICE COC(=O)COc1ccc(C=C2SC(=S)N(CCC3CCCC3)C2=O)cc1OC 2297559804 KNUWLFARLNJDOM-UHFFFAOYSA-N 435.567 4.029 10 10 IICE COC(=O)CCCCCN1C(=O)C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 2314717776 VNAZIZHJCXZASI-UHFFFAOYSA-N 428.919 4.183 10 10 IICE CCCCCCN1C(=O)C(=C2SC(=S)N(CCCC(=O)OC)C2=O)c2ccccc21 2314759995 HXOUHBMZQWUZQM-UHFFFAOYSA-N 446.594 4.138 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3ccc(OCCC(=O)O)cc3)SC2=S)c1 2314932192 UBUSNYVXKKZLDO-UHFFFAOYSA-N 427.503 4.149 10 10 IICE Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1cccc(O)c1 2438800 FMKPCZOSWZUVEA-RGVLZGJSSA-N 435.867 4.120 10 10 IICE CSc1cccc(NC(=O)CN2C(=O)S/C(=C\c3ccc(N(C)C)cc3)C2=O)c1 35168988 IOUQYPYBMGKZJJ-WQRHYEAKSA-N 427.551 4.150 10 10 IICE O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C(O)=NC(=S)N1c1ccc(Cl)cc1Cl 38170762 FUHDLJPFSULWAL-YHYXMXQVSA-N 438.248 4.279 10 10 IICE CCCCc1ccc(Nc2ncnc(N3CCN(c4ccc(OC)cc4)CC3)c2N)cc1 40679973 FGKNCOMJJZMIOC-UHFFFAOYSA-N 432.572 4.480 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)/C1=C(\C)Nc1cccc(OC(F)(F)F)c1 205949218 RWRRXNDMTCDPTC-CPNJWEJPSA-N 433.386 4.237 10 10 IICE CCn1cc(-c2nn(C)cc2C(=O)N2C[C@H](C)N(Cc3ccccc3)c3ccccc32)cn1 527091407 IRSYEZPMKFKEQY-IBGZPJMESA-N 440.551 4.359 10 10 IICE COc1ccc(N2CCC(NC(=O)NCc3ccc(OCc4ccccn4)cc3)CC2)cc1 726609498 AZOIRYLLHMGPRB-UHFFFAOYSA-N 446.551 4.137 10 10 IICE Cc1cc(C(=O)NCCc2cnc(C3CC3)nc2)c(C)n1-c1ccccc1Br 756088364 UQOQAQIQNQYZGI-UHFFFAOYSA-N 439.357 4.497 10 10 IICE O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)c2ncccc12 766494989 HRJQJEYPFIKVIG-UHFFFAOYSA-N 438.490 4.166 10 10 IICE CC(=O)Nc1sc(NS(=O)(=O)c2ccc3ncsc3c2)nc1-c1ccccc1 775209513 YKTMSDYKJIBHED-UHFFFAOYSA-N 430.536 4.179 10 10 IICE Cc1cc(C(=O)CN2CCC(c3nnc4n3CCCC4)CC2)c(C)n1-c1ccc(F)cc1 775824550 RKJYUTCIMVLSOU-UHFFFAOYSA-N 435.547 4.223 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCc3ccc(F)cc3)C2=O)cc2c1OCCO2 790592036 UBZHOVXXVPOZBW-PDGQHHTCSA-N 431.510 4.049 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CCCC2 1125019283 PRGPSGXLUWEHGI-HNNXBMFYSA-N 426.538 4.184 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3c(C)cc(C)c(Br)c3C)c2)CC1 1128040896 VQFDABFRZDXXJD-UHFFFAOYSA-N 444.373 4.295 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C 1140906102 KBTDSZFXOHDJGO-ZWKOTPCHSA-N 429.520 4.003 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H]3CC[C@@H](Nc4ccccn4)CC3)cc2F)C[C@@H](C)O1 1141901481 HGUGLRNTXFWQKH-UKAVVXHISA-N 440.563 4.121 10 10 IICE CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1142363640 NEXZIPCBAPQIMY-GOSISDBHSA-N 433.508 4.441 10 10 IICE Cc1ccccc1[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOc2cc(N(C)C)ccc21 1147888248 LRKFLRJJDDIXRS-NRFANRHFSA-N 425.529 4.052 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c1 1150241262 VRFATHWLKDNXSJ-UHFFFAOYSA-N 435.883 4.019 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C)CC1CC1 1165313884 NNCMECWWBIRAFU-INIZCTEOSA-N 433.346 4.176 10 10 IICE CC(=O)Nc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1264201365 AYSZSNKBGQKKOH-WQRHYEAKSA-N 443.525 4.014 10 10 IICE CCCCC1CCC(CNC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 1292057861 IJKUJIDVDUGTMM-PFONDFGASA-N 441.616 4.013 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(Cc4cccs4)CCCCC3)CC2)cc1 1292282066 JRDLIFIYNTWEHH-UHFFFAOYSA-N 441.641 4.188 10 10 IICE COC1CCN(C2(CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CCCC2)CC1 1293589869 LXJWPUCFOMSYQB-UHFFFAOYSA-N 437.584 4.060 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccccc1CNC(=O)OC(C)(C)C 1299479580 YHMQCWYULRRCNQ-SFHVURJKSA-N 425.573 4.447 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2C[C@]23CCCN(C(=O)OC(C)(C)C)C3)C2CC2)cc1 1354141213 HHJYCNJRGINSPP-BWKNWUBXSA-N 427.589 4.281 10 10 IICE Cc1nc2ccc(Br)cn2c1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1356267122 MRBFVTPCZJUXSN-UHFFFAOYSA-N 427.346 4.278 10 10 IICE CCc1c(C(=O)NCc2ccc(N(C)C)c(F)c2)cnn1-c1ccc(Br)cc1 1357192453 KCJDMEYPVOYGTP-UHFFFAOYSA-N 445.336 4.332 10 10 IICE Cc1cc(CC(=O)N2CSC[C@@H]2C(=O)NCCC(C)C)c(C)n1-c1ccc(Cl)cc1 1443383672 CVBSOYNHVYANMQ-OAQYLSRUSA-N 448.032 4.354 10 10 IICE O=C(CCC(=O)c1c(F)cccc1F)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444983397 DEQICGRTKSAZNA-AWEZNQCLSA-N 438.421 4.314 10 10 IICE O=C([C@H]1CCc2cc(Br)ccc21)N(Cc1ccccc1O)C[C@H]1CCCO1 1446566424 KUIMKUYVBQJMDJ-QUCCMNQESA-N 430.342 4.392 10 10 IICE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NCc1cccc(Br)c1O 1448964518 RGOSFSNEUBOVQZ-MRXNPFEDSA-N 443.382 4.346 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)cc1 1464548094 JOMITDMYIHTPJU-RUZDIDTESA-N 443.591 4.478 10 10 IICE CC[C@H](C)Oc1ccccc1/C=C/C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1466398938 VAEAPKMKGPBYIP-YHVDPYDOSA-N 431.916 4.438 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)CCCc3cc(-c4ccccc4)no3)C2)cc1 1470773560 QPNKAQHEMAUFRK-HXUWFJFHSA-N 434.540 4.203 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCCC12CCN(C(=O)/C=C\c1ccc(O)c(O)c1)CC2 1472410083 YZFVCVJWTYVKTH-CNRGFGOASA-N 430.545 4.045 10 10 IICE COC1CCN(c2ccc(CN3CCN(c4cc(C(F)(F)F)ccn4)CC3)cc2)CC1 1473409974 JEQLVAQSZCBZEF-UHFFFAOYSA-N 434.506 4.038 10 10 IICE CCc1nnc(N2CCC([C@](C)(O)C(F)(F)F)CC2)n1CCCSc1nccs1 1498899714 CHTMUDUWRLBTSY-KRWDZBQOSA-N 449.568 4.009 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N(C)CCc1nccs1 1510671688 DWPTUEDTZNSFKV-UHFFFAOYSA-N 426.634 4.425 10 10 IICE CCN(CCC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1515703623 QOCZMDWKTVYYGP-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CC[C@H](Oc1ccccc1C(C)C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261470 MIGMFZDBIOJQMO-NRFANRHFSA-N 432.511 4.399 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4ccccc4F)c3C(F)(F)F)C2)cc1 1528318904 ZSBUKQHMOKSBBP-AWEZNQCLSA-N 448.420 4.048 10 10 IICE CCOC(=O)N1[C@@H](C(=O)NCc2ccc(N(CC)CC)cc2)CC[C@@H]1c1ccc(C)o1 1534245583 FSMNQOPNSSGFKZ-NHCUHLMSSA-N 427.545 4.413 10 10 IICE Cc1cc(Cl)cnc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1534519172 WEHBKTMCYDBDFS-DHDCSXOGSA-N 435.933 4.413 10 10 IICE COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1535188704 CCHGAKFDHLXEQT-QHCPKHFHSA-N 444.453 4.427 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(c2cccc(C(F)(F)F)c2)CC1 1535345621 HRFZTXRMJCZAKH-UHFFFAOYSA-N 440.412 4.168 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2nc(-c3ccccc3)n3c2CCCCC3)N(C)C)cc1 1539707172 ONVYIJPOQWPXCD-DEOSSOPVSA-N 445.611 4.375 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H](c3cccc(Br)c3)N3CCCC3)ccc21 1544164262 GHQSBEYCPSPNDN-QFIPXVFZSA-N 442.401 4.285 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCO[C@H](C(F)(F)F)C2)cc1 1547443583 BDEWCWUHKBZHQD-SFHVURJKSA-N 425.499 4.064 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1548052902 CETALLPIBPNTDF-DHIUTWEWSA-N 441.620 4.420 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccnn1C1CCC1 1558704486 UFFCUKZFBIXELT-QINSGFPZSA-N 432.596 4.290 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CC(=O)N(c4ccccc4[C@H](C)CC)C3)CC2)cc1 1566560477 FVFDFABJXWBZLZ-RTWAWAEBSA-N 449.595 4.301 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)COC[C@H]1CCCO1 1610121329 CDYNOSJPWILAME-QUCCMNQESA-N 436.474 4.494 10 10 IICE CN(CC1CCCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1618079270 XDWHZZFFCDLLBI-UHFFFAOYSA-N 429.584 4.226 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1C 1618502177 YOHANQZTKPTHGO-IEBWSBKVSA-N 448.615 4.360 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(=O)c(OCc3ccc(F)cc3)co2)cc1 1623452555 YGOAJQQNENINJB-UHFFFAOYSA-N 438.499 4.476 10 10 IICE COc1ccccc1[C@H](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)N1CCCC1 1623951580 ZFXDJVAQUNGWOB-VWLOTQADSA-N 445.563 4.482 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(C(=O)OC(C)(C)C)CCCCC3)cc2F)C[C@@H](C)O1 1625090664 XEPCEIJKIRZVTQ-HDICACEKSA-N 448.579 4.348 10 10 IICE Cc1cc(C(=O)N[C@H](CCNC(=O)OC(C)(C)C)C(F)(F)F)c(C)n1-c1ccccn1 1626670768 NHBASQDOZINFCH-MRXNPFEDSA-N 440.466 4.065 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@H]2CCC[C@@H](C(F)(F)F)O2)cc1 1627204649 DNIPPQOXPMAREC-AABGKKOBSA-N 428.495 4.150 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@]2(C)CCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1629679324 NTUNOPHCTGBMDG-ATIYNZHBSA-N 437.584 4.339 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1cccc(C)c1 1635891373 WDHHQHPMMLGPIJ-UHFFFAOYSA-N 436.531 4.243 10 10 IICE O=S(=O)(CCN(Cc1ccccc1O)C1CCCC1)c1cccc(Br)c1 1641731016 CYSFCGWYNHZDSK-UHFFFAOYSA-N 438.387 4.373 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](Cc2ccccc2)c2nccn2C)c1 1644347125 ITUJWYINKTUPRU-DEOSSOPVSA-N 426.520 4.354 10 10 IICE Cc1cc(C(=O)NCC2(OCCO)CCCCC2)c(C)n1-c1ccccc1Br 1648288151 FOBDPJGBORHRNM-UHFFFAOYSA-N 449.389 4.298 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3cnnn3)cc2)c(C)n1-c1ccccc1Br 1648433335 XISJZLYKEFKRDZ-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)N2c3ccccc3CCc3ccccc32)cc1 1653259441 UXRAGWQPBCYAFG-UHFFFAOYSA-N 430.504 4.138 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)Nc1ccccc1C(=O)NC1CCCC1 1653602156 HBYRRNXADUZTAN-UHFFFAOYSA-N 443.494 4.352 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C(C)C)C(C)(C)O)sc(C)c1-c1ccccc1 1654398119 LILIFUFDWIHWDH-FQEVSTJZSA-N 432.586 4.224 10 10 IICE COc1cc(N2CCC[C@H]([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1655512815 YVEGKZPWBBOWOQ-DLBZAZTESA-N 449.548 4.476 10 10 IICE COC(=O)c1cc(C(=O)OC)cc(-n2c(C)cc(C(=O)CSc3ccncc3)c2C)c1 1656332281 UZXNAHWZVVQSKQ-UHFFFAOYSA-N 438.505 4.037 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC/C=C\c3ccc(Br)cc3)C2)cc1 1673024855 JEPUUEAIZWKKKL-KVLZDYKBSA-N 444.373 4.297 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3ccc(Br)cc3F)C2)cc1 1673290013 ITRURXDFXPKQSL-UKRRQHHQSA-N 436.325 4.236 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccc(Cn4cncn4)cc3)c2C)c1 1682816363 QWTMZPSIJZFBQL-UHFFFAOYSA-N 428.540 4.042 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(O)(c2ccccc2Cl)CC1 1683421559 RTCBBSQNXNNKPN-SFHVURJKSA-N 429.992 4.339 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709484705 IDDBYOZBBFLXTN-FQEVSTJZSA-N 448.615 4.222 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC=CO1 1743723452 FKQDCXPTGQJGEF-SIKLNZKXSA-N 425.577 4.210 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCN(Cc2ccsc2)CC1 1751432148 ZBQZQFWFRGLTSN-UHFFFAOYSA-N 438.645 4.208 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC3(C)C)n2CCCSc2nccs2)n1 1762450399 MIJKJYVSZGZQPB-UHFFFAOYSA-N 431.635 4.157 10 10 IICE C[C@@H]1SCCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)[C@H]1C 1763290149 JOQPCWTUHMOWMT-HOTGVXAUSA-N 446.671 4.233 10 10 IICE O=C(O)CCC(=Cc1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 2053509071 NXNSXGNQXJUFFN-UHFFFAOYSA-N 439.493 4.447 10 10 IICE Cc1cc(O)c([C@H](C(C)C)n2nc(C(F)F)c(CN)c2I)cc1C 2079856334 SSOOCEAGACLISL-HNNXBMFYSA-N 449.283 4.452 10 10 IICE COc1ccc(Br)c(CNCCC[C@H]2CCCN2C(=O)OC(C)(C)C)c1O 2236048857 JDEBVWIDGSOZFS-AWEZNQCLSA-N 443.382 4.433 10 10 IICE COC(=O)c1ccccc1-n1c(C)cc(C=C2NC(=O)N(Cc3ccccc3F)C2=O)c1C 2293453452 LADTYJOQWHQUMI-UHFFFAOYSA-N 447.466 4.113 10 10 IICE CCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1Cl 2297332979 QZFAHVUDPAIYKF-UHFFFAOYSA-N 449.688 4.168 10 10 IICE CCCN1C(=O)C(=Cc2c(Oc3ccc(F)cc3)nc3ccccn3c2=O)SC1=S 2314508676 PXQRIUQCGSENDY-UHFFFAOYSA-N 441.509 4.237 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(SC)c3)C2=O)cc([N+](=O)[O-])c1O 2321734083 XBQRIGSGLLNTCY-UHFFFAOYSA-N 434.520 4.437 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1cc(Br)ccc1O)[C@H]2F 2333284372 GPUMEUHDJGZBDH-PNBKFKSVSA-N 429.330 4.123 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@]2(C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2381138368 UVMHZOQLHNYODJ-HXUWFJFHSA-N 441.366 4.211 10 10 IICE CCN(C[C@H]1CCCO1)C1CCN(c2cccc(NC(=O)c3ccccc3OC)c2)CC1 12248135 BZSYNZNSNGJSBP-HSZRJFAPSA-N 437.584 4.417 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3ccc(C(C)=O)cc3)C2=O)c(C(=O)O)c1OC 16906182 UZKWNWNWGFPDQD-MHWRWJLKSA-N 443.502 4.010 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@H]32)c1O 20694050 LVGUFMFPNVUCGP-DRSNIGMVSA-N 426.538 4.012 10 10 IICE COc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(Br)cc3)C2=O)cc1 103036004 FSOUXXDXFUISQG-XNTDXEJSSA-N 449.351 4.004 10 10 IICE Cc1[nH]n(-c2ccccc2)c(=O)c1/N=N\c1cc(S(=O)(=O)Nc2ccccc2)ccc1O 111481464 QANZBOURHFMZGS-VHXPQNKSSA-N 449.492 4.396 10 10 IICE C/C(NCCc1ccc(O)cc1)=C1\C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 205954362 MWRFAVYIZCQJDT-HAVVHWLPSA-N 442.475 4.158 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(F)cc3F)[C@H]2c2ccc(O)c(O)c2)c1 526549635 DRIBPWUDHVBPJN-NRFANRHFSA-N 425.387 4.442 10 10 IICE CCCC(=O)Nc1cccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 580871360 WEBLUAKVAMNPFW-UHFFFAOYSA-N 446.595 4.463 10 10 IICE CN(C)c1ccc(CN(C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C2CC2)cc1 730137299 CGMAZTHHTZWJQX-IBGZPJMESA-N 430.593 4.074 10 10 IICE Cc1ncc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c(C(C)C)n1 734201841 OKOLPSWQEACARX-UHFFFAOYSA-N 435.480 4.084 10 10 IICE Cc1cccc2c1OCC[C@H]2NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 749438360 TUALVBWZJCOUGL-LLGFUMIMSA-N 427.520 4.071 10 10 IICE Cn1ccc([C@@H](NCc2ccc(N3CCC(O)CC3)c(F)c2)c2ccc(Cl)cc2)n1 756455751 FAKVCVXGZPSHAG-QHCPKHFHSA-N 428.939 4.053 10 10 IICE COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1nc(-c2cc(C)c(F)cc2F)cs1 795612645 DOJLXZXPKHKNHV-UHFFFAOYSA-N 441.437 4.114 10 10 IICE Cc1cccc(-n2c(C)cc(/C=C3/C(=O)NC(=S)N(c4ccccc4F)C3=O)c2C)c1 1084472122 VGTJXULBSOWIPO-UYRXBGFRSA-N 433.508 4.373 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)COc1ccc(C(=O)c2ccccc2)cc1 1129815370 XAVQIJNCTGRVQL-FQEVSTJZSA-N 430.548 4.418 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)C2)cc1 1131029768 GIJYCAIRJKXIIY-XXBNENTESA-N 448.485 4.058 10 10 IICE Cc1cc(CCNC(=O)[C@]23CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(C)n1-c1ccccc1 1131784909 CKYASFLUDFZZOY-LVXARBLLSA-N 437.584 4.400 10 10 IICE O=C(CCC[C@@H](O)c1ccccc1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1136285112 QCZBAUWWZHTROR-OAQYLSRUSA-N 436.474 4.062 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1ccc(C(F)(F)F)cc1 1137816891 UVRBOVYIHLSCER-LBPRGKRZSA-N 445.821 4.034 10 10 IICE O=C(Nc1cccc2c1CCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1141286905 AUFXVRBUTPJVRE-UHFFFAOYSA-N 428.535 4.386 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2C[C@H]2NC(=O)OC(C)(C)C)cc1 1144704255 BHEYRFMZQJBTIG-FCHUYYIVSA-N 439.556 4.208 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H]3CCCCCC[C@@H]3NC(=O)OC(C)(C)C)C2)cc1 1146949799 HWMIFRLXFCVCBZ-NYVOZVTQSA-N 445.604 4.254 10 10 IICE CC1CCC(OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CC1 1147504001 DYADBFWEYMXZBN-JITJBCMDSA-N 433.593 4.030 10 10 IICE Cc1cc(F)c(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1F 1147507551 SCQLEHCNZDMGFJ-NRFANRHFSA-N 447.526 4.264 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](C)c2ccc(N(C)C)cc2)sc2c1CC[C@@H](C)C2 1193574154 DQJKHNMXPCCMDC-HZPDHXFCSA-N 443.613 4.405 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)[C@H](O)c3c(Cl)cccc3Cl)C2)cc1 1230857415 AMKABXLYAHJALN-CKNLXJGOSA-N 438.355 4.002 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(-c2cc(F)cc(F)c2)n1 1265566328 JAYUIYVJUNBDOT-INIZCTEOSA-N 448.420 4.151 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@](C)(O)c1cccs1 1292832652 GWQJFXRCCLGSRK-HSZRJFAPSA-N 425.602 4.046 10 10 IICE O=C(Nc1ccc(C(=O)NC2CCCCC2)c(O)c1)c1cc2cc(O)c(O)cc2s1 1296501323 YJPKBJCFSLDJAW-UHFFFAOYSA-N 426.494 4.333 10 10 IICE CCn1c(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)nc2cccnc21 1298325304 SZLIGCZNLWTPTO-UHFFFAOYSA-N 439.317 4.269 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4ccn(C)n4)CC3)cc2Cl)C1 1312590227 JFRPNXYKZMCPNM-KRWDZBQOSA-N 429.996 4.399 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)C[C@H]2CC=CCC2)cc1 1313674866 LVOPGHXBFZGCBE-FQEVSTJZSA-N 438.620 4.103 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(Cl)cc3C(F)(F)F)cc2F)C[C@H](C)O1 1350933269 MAQHCGYFUIAMJZ-RYUDHWBXSA-N 445.844 4.437 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC(C(F)(F)F)CC1 1360981397 NELPUQSTQDSSPA-RVDMUPIBSA-N 446.491 4.218 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)cc1 1441096718 HYMNIDFVDYZXOS-XMMPIXPASA-N 445.519 4.205 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(O[C@@H]2CC2(F)F)cc1 1445879884 FFKLCKXKMARQTH-YLJYHZDGSA-N 436.886 4.226 10 10 IICE O=C(CCc1ccc(OC(F)F)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445886162 SAXMTFNHHWNMQY-GOSISDBHSA-N 438.902 4.360 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1(Cc2ccc(OC(F)(F)F)cc2)CC1 1454003536 KKENAIVTXSWUPH-UHFFFAOYSA-N 448.485 4.185 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1C[C@H]1c1cccc(OC)c1 1470518103 DWGDWSLXENCLIO-KXBFYZLASA-N 433.346 4.499 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCCC[C@H]1Cc1ccccc1F 1478786068 IGSLAQPUKIPCRR-IBGZPJMESA-N 447.501 4.247 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCc2ccc(Cl)cc21 1479108714 DWNADJQPHFFHKY-QHCPKHFHSA-N 427.976 4.426 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1503155518 QIXRAWBTNYTABA-MRXNPFEDSA-N 433.603 4.348 10 10 IICE CSCCCN(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1505254045 NUWXFSPTDHBSMU-UHFFFAOYSA-N 431.675 4.336 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(C)CCC2CCOCC2)cc1 1515528872 LKGIYTGTNZETEO-HSZRJFAPSA-N 441.620 4.277 10 10 IICE COc1cc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc(Br)c1OC 1525762134 LFXRVQXOIMKJSF-AWEZNQCLSA-N 435.362 4.202 10 10 IICE C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261431 KUBYWLROFFTNCK-AWEZNQCLSA-N 442.428 4.315 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CN(Cc3ccco3)c3cccc(Cl)c3)C2)cc1 1531729977 NVBISCKSCBDPBP-LJQANCHMSA-N 439.943 4.343 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCOc2ccc(Br)cc21 1536550094 OGVMHBLJPPNOTK-DNVCBOLYSA-N 431.374 4.437 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)N(C)C)no1 1542188864 XUWKGVYKPINFBY-GOSISDBHSA-N 447.587 4.236 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1545623540 CCZMJNBLFPPSAN-IBGZPJMESA-N 436.629 4.424 10 10 IICE CCC(CC)[C@@H](CCn1c(C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1545798865 SNZCTOUDTWKOPB-HSZRJFAPSA-N 429.609 4.153 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)[C@@H]1CC 1546780795 PHZBLMXAXHDYAN-NDEHPHGNSA-N 432.572 4.034 10 10 IICE C[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1560132441 YISHASSTZOWSIH-HUUCEWRRSA-N 443.459 4.048 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@]3(N(C)C)COc4ccccc4C3)cc2Cl)C1 1568142215 PKSHAXZWXKTXKB-AVRWGWEMSA-N 442.003 4.128 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C(C)(C)n1ccc(NC(=O)OC(C)(C)C)n1 1587552777 YNBNAGAXNYESAR-UHFFFAOYSA-N 441.576 4.224 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl 1593872715 BNEJSKPPFDNLFQ-UHFFFAOYSA-N 427.844 4.202 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2cc(Br)ccc2F)cc1 1598292678 TWSOKTIMBKEXBK-FQEVSTJZSA-N 449.364 4.405 10 10 IICE CSc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)ccc1Br 1627463950 HQAAXLYRKKAELX-SFHVURJKSA-N 436.419 4.270 10 10 IICE COc1ccc(CN(CCO)C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1636676884 KOJJXWRCTTVDJD-UHFFFAOYSA-N 426.944 4.320 10 10 IICE COCCN(CCOc1ccc(F)cc1)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1637577606 FFPMXLHSWQDQTN-UHFFFAOYSA-N 439.531 4.470 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)c([N+](=O)[O-])c1 1643550376 NTIVFLZBPLWLCA-UHFFFAOYSA-N 443.843 4.099 10 10 IICE Cc1cc(CC(=O)N(C)Cc2nnc3n2C[C@@H](C(F)(F)F)CC3)c(C)n1-c1ccccc1 1645382319 UHFZVZSGLHRMGX-SFHVURJKSA-N 445.489 4.011 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@@H]3CCNC(=O)CC3)n2)c(C)n1-c1ccc(F)cc1 1648445696 ZMOOMFUAJUOJCH-HNNXBMFYSA-N 426.517 4.212 10 10 IICE Cc1cc(C(=O)N2CCN(CCc3cnccn3)CC2)c(C)n1-c1cccc(C(C)C)c1 1650771014 OGQYOGWNOMCZIK-UHFFFAOYSA-N 431.584 4.008 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@]3(C)CN(C(=O)OC(C)(C)C)CCO3)c2C)c1 1651517135 SJIHRIKVRGDDDT-RUZDIDTESA-N 441.572 4.158 10 10 IICE Cc1cc(NC(=O)c2ccc(N=NC(N)=O)cc2)n([C@@H]2CCN(Cc3ccccc3)C2)n1 1654435960 SPDBTZXCKMNIKK-HXUWFJFHSA-N 431.500 4.053 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCCN(CC4CC4)C3)cc2Cl)C1 1672137467 SIOCSNTWZRCAHS-WIYYLYMNSA-N 433.040 4.498 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCCCC1 1698014680 YPSBKHCRDBPTCY-UHFFFAOYSA-N 437.588 4.130 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@H]3CCSC3(C)C)CC2)cc1F 1711866181 RPPVXNZERNOXLH-QGZVFWFLSA-N 447.624 4.408 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC(CCCO)CC2)cc1 1728381113 SAASBTOKGJWDOH-UHFFFAOYSA-N 448.615 4.224 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1)OC 1744118158 CUOYPMJLLRQVIZ-FGZHOGPDSA-N 437.588 4.393 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CCS1 1745008926 FMFAKHSKVLTUTN-MRXNPFEDSA-N 432.644 4.311 10 10 IICE CO[C@@H](C)c1nc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)cs1 1768002361 NZNBGOBHXXQHPO-HNNXBMFYSA-N 429.590 4.421 10 10 IICE COCCC1(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCC1 1769574118 QDTNLMBMULALBS-UHFFFAOYSA-N 441.620 4.081 10 10 IICE CCn1cc(OCc2cccc(C)c2)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870621314 VPOXPJZAMBWQQO-UHFFFAOYSA-N 447.579 4.086 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@H](CN=[N+]=[N-])C1 2010406500 VJMOMDRUCRPOLA-MOPGFXCFSA-N 431.537 4.036 10 10 IICE O=C(OCc1ccccc1)N1C[C@H](NCc2cc(Br)ccc2O)C2(CCC2)C1 2028690208 RTENXUHGEBSXFD-FQEVSTJZSA-N 445.357 4.436 10 10 IICE COc1ccc(Br)c(CNC2CCC(CNC(=O)OC(C)(C)C)CC2)c1O 2236055042 NMKXJWASGQFHPL-UHFFFAOYSA-N 443.382 4.336 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)C2=Cc2ccc(C(=O)O)cc2)cc1 2332139464 JCFQCDLLWXCOSG-UHFFFAOYSA-N 430.435 4.363 10 10 IICE CCCN1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33459287 NRAXMVGCJXBUNK-SSZFMOIBSA-N 428.583 4.050 10 10 IICE CN(C)c1ccc(CNC(=O)CC[C@H]2CCCN(C(=O)Nc3cccc(F)c3)C2)cc1 65136778 VHRNBFBPQBPRHV-LJQANCHMSA-N 426.536 4.232 10 10 IICE Cc1cccc(N2C(=O)N=C(O)/C(=C/c3cccc(I)c3)C2=O)c1 83327769 ZFJXOXCAVPGANS-GDNBJRDFSA-N 432.217 4.106 10 10 IICE CCN1C(=O)/C(=C\c2ccc(NC(=O)/C=C\c3cccc([N+](=O)[O-])c3)cc2)SC1=S 96835246 KKAQFDMENGTPQN-YGKSWJOESA-N 439.518 4.468 10 10 IICE CCN(CC)c1ccc(CN(C(=O)/C=C\c2ccc(C)cc2)[C@@H]2CCS(=O)(=O)C2)cc1 213218215 XDSDLUFSFZETIT-JBDIQEJZSA-N 440.609 4.070 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cccc(N(C)C)c3)[C@H]2c2ccc(O)c(O)c2)c1 526505775 JOHMXXKUJNDQFD-QHCPKHFHSA-N 432.476 4.230 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COC(=O)c3cnc(-c4cnn(C)c4)s3)c2C)cc1 732687577 DCMHJOYZXFQCRN-UHFFFAOYSA-N 434.521 4.299 10 10 IICE Cc1c(CNC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)oc2ccccc12 734525004 FPVXYMQHEYCDRX-HOTGVXAUSA-N 425.504 4.493 10 10 IICE C[C@@H](NC(=O)c1c[nH]c2cccc(Br)c12)c1ccc(N2CCOCC2)cc1 763997262 KHZTUWWCTQIJGE-CQSZACIVSA-N 428.330 4.258 10 10 IICE CCC1(CC)CN(Cc2cc(Br)cc(Br)c2O)CC[S@]1=O 769557626 QVWQPXWRYBSIFT-OAQYLSRUSA-N 439.213 4.040 10 10 IICE C[C@@H](NC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccc(N2CCOCC2)cc1 788757127 UDJWEOWEMCEEOH-YJYMSZOUSA-N 425.426 4.168 10 10 IICE COc1cc(C(=O)NCc2cc(Br)ccc2O)ccc1OCc1cscn1 804734240 GJWYQFSRALJVQV-UHFFFAOYSA-N 449.326 4.129 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)cc(OC)c1OC(C)=O 915850083 MDZSJEWSMZYWSZ-YVLHZVERSA-N 433.482 4.174 10 10 IICE C[C@@H]1CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c2ccccc2O1 1126262727 UKAOAAJFWRRTRS-ONDHQXCVSA-N 442.537 4.231 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2 1129814995 RCJDXTXGSLDYBI-MRXNPFEDSA-N 438.522 4.375 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H](c1ccccn1)C1CC1 1134170552 NKIMPXXKTDEOQF-MTGKDYNDSA-N 441.553 4.080 10 10 IICE CC1(C)C[C@@H](NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CCS1 1134406228 NWELEKKBVVDKIA-KFXIKWRMSA-N 438.615 4.207 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)C(C)(C)c3cccc4ccccc34)cc2)CC1 1138228490 BILXPFNTAFVGGB-UHFFFAOYSA-N 429.564 4.102 10 10 IICE O=C(NC[C@H]1CCCCN1C(=O)c1cc2cc(O)c(O)cc2s1)Nc1ccccc1 1141436686 ANPVPZQVZVSCEP-MRXNPFEDSA-N 425.510 4.129 10 10 IICE COc1ccc(N(CC(=O)NCc2cccc(OCC(F)(F)F)c2)C(C)C)cc1F 1168095925 FLECESGIRMYOTI-UHFFFAOYSA-N 428.426 4.307 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](C)c3ccc(F)cc3OC(F)F)CC2)cc1 1225571566 RRNZCGRTTYHUBK-OAHLLOKOSA-N 437.462 4.419 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@H](CC(F)(F)F)C3)cc2Cl)C1 1227208268 MZDDEWANPQPMSR-HOCLYGCPSA-N 433.902 4.439 10 10 IICE CC1(C)[C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C[C@H]1OCc1ccccc1 1235188712 XUPDIHHQJCQXLQ-GMKZXUHWSA-N 438.568 4.467 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(F)(c4ccc(Cl)cc4)CC3)cc2)CC1 1254716747 UMMXARHZFQYFHG-UHFFFAOYSA-N 444.982 4.262 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C\c3cc(Cl)cc(Cl)c3)CC2)cc1 1264273700 NXXLILISWTYVAR-BAQGIRSFSA-N 448.394 4.344 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCOc2ccc(F)cc2)NC(=O)OC(C)(C)C)cc1 1293793260 NAQLDCOFGOWBEC-NRFANRHFSA-N 445.535 4.043 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1)OC 1300996861 CICLXEVKTRGFAV-JOCHJYFZSA-N 435.572 4.170 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCCO1 1301581455 CQOJEAVMTVSBSY-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1cc(C)nc(N2CCCC2)c1 1305383720 OOZQCHKTMQOBSX-GOSISDBHSA-N 434.588 4.486 10 10 IICE CN(Cc1ccccc1F)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1314747915 SGPOLZLVOFVDPJ-UHFFFAOYSA-N 443.577 4.093 10 10 IICE Cn1cc(Nc2nnc(-c3ccc(Cl)nc3)n2CCCSc2nccs2)cn1 1314908811 LSENOJDURPPGML-UHFFFAOYSA-N 432.966 4.110 10 10 IICE CCC[C@H](CC(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1351298625 MMGOFGCTRRMDAL-HXUWFJFHSA-N 427.568 4.021 10 10 IICE Cc1cc(CC(=O)N(Cc2ccccc2)[C@@H](C)CN2CCOCC2)c(C)n1-c1ccccc1 1352464081 IGZAIAAJRBVHAB-QHCPKHFHSA-N 445.607 4.386 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccccc1OC(F)(F)F 1354329631 SUXRCRBJQOLTHE-UHFFFAOYSA-N 448.363 4.371 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cc(Br)ccc2Cl)N(C)C)cc1 1439959351 DEQQSEGENDBUOL-LJQANCHMSA-N 438.797 4.130 10 10 IICE Cc1cc(C(=O)NCC(=O)OCc2ccccc2)c(C)n1-c1ccc(Br)cc1 1463674298 JMITXDHAPLTSJR-UHFFFAOYSA-N 441.325 4.330 10 10 IICE CN(c1ccc(CNC(=O)c2cc([N+](=O)[O-])c3nsnc3c2)cc1)C1CCCCC1 1464544508 ZRGAXCSDVJKWOT-UHFFFAOYSA-N 425.514 4.298 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1470189516 SNDPPECFQYQOEL-SFHVURJKSA-N 441.519 4.349 10 10 IICE C[C@H](NC(=O)COc1ccc(CCCNC(=O)OC(C)(C)C)cc1)c1ccccc1O 1471195490 YLQLZVWLICOGFG-KRWDZBQOSA-N 428.529 4.106 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCN([C@H](C)c2ccccc2F)C1=O 1478690519 ICTWOZUQBYZMGC-WZONZLPQSA-N 440.563 4.175 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)[C@@H]2CCOC2)cc1 1515525811 GCOXWXFLUKIQRV-HXUWFJFHSA-N 440.979 4.113 10 10 IICE CC(C)c1cccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 1517140965 PRLRQZUKGXOTND-UHFFFAOYSA-N 428.444 4.424 10 10 IICE Cc1nc(C(C)(C)C)sc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1518323914 AEXTVCMFBPRCNA-UHFFFAOYSA-N 426.630 4.211 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Cl)c(OCC(C)C)c(OC)c3)C2)cc1 1528317224 CILKGDNDYBBVGY-KRWDZBQOSA-N 432.948 4.401 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(C(F)(F)F)ccc3Br)C2)cc1 1532107022 UKEPAGNHFYOQSK-ZDUSSCGKSA-N 443.263 4.485 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccccn4)ccc3Cl)CC2)c(OC)c1 1534277945 HDRGWWPALZZVBG-UHFFFAOYSA-N 437.927 4.382 10 10 IICE COC(=O)COc1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(C)c1 1534558493 WFQREZLKEBBOPQ-UHFFFAOYSA-N 436.508 4.028 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](C[C@H]3COCCO3)C(F)(F)F)cc2Cl)C1 1556369224 JAEIKASHOFFLFV-PVAVHDDUSA-N 448.913 4.177 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNc3nc(-c4cc(Cl)cc(Cl)c4)no3)cc2)C1 1559076600 GUPDLHAEINEJFQ-AWEZNQCLSA-N 446.338 4.357 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Cl)ccc1OCCOC 1566306904 ZEAQZVGJTRSBTE-UHFFFAOYSA-N 442.737 4.496 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(C(F)(F)F)c(O)c1 1566356953 SIRUIASSLQNDMH-OAHLLOKOSA-N 428.838 4.164 10 10 IICE CC[C@@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1cccc(C(F)(F)F)c1 1598028641 MIDJRFVCXRDKSM-JOCHJYFZSA-N 449.517 4.146 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1nc(C)cs1 1613295573 KGWPCXQDBJBLCX-QGZVFWFLSA-N 440.617 4.330 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CC[C@H](C)C(C)(C)C2)cc1 1615379199 CXZJSYPPEKBGMI-IBGZPJMESA-N 435.620 4.446 10 10 IICE CCON(Cc1ccccc1)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1618583060 NHHMISCQUKOASX-QGZVFWFLSA-N 428.488 4.243 10 10 IICE CCO[C@H]1C[C@](O)(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1626720591 VEGXLSVZEIUDGQ-UGKGYDQZSA-N 449.389 4.153 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c(C)n1-c1ccccc1 1626993296 XDUJLSIQSOODBT-LJQANCHMSA-N 435.490 4.086 10 10 IICE CNC(=O)Cn1ccc2ccc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)cc21 1629046578 PXXWFNFTIBPEAI-UHFFFAOYSA-N 442.519 4.168 10 10 IICE C[C@H](CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCc2ccccc21 1629055436 JHOJDPXBBVTBAB-IEBWSBKVSA-N 429.511 4.214 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c1 1629809796 FAAQMKCZMQYGML-AOMKIAJQSA-N 439.556 4.282 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2sc(C)c(Br)c2OC)cc1 1632049542 LUQOMJVMARNFIJ-UHFFFAOYSA-N 427.364 4.045 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@]1(c2ccccc2)CCCO1 1638607479 VXXGFOZWWKYZSE-NRFANRHFSA-N 433.346 4.392 10 10 IICE Cc1cc(C(=O)N2CCc3c(O)cccc3C2)c(C)n1-c1ccc(Br)cn1 1643185774 MSQIJNFETYWYIT-UHFFFAOYSA-N 426.314 4.156 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3ncccn3)C2)c(C)n1-c1ccc(Br)cn1 1652073212 NCKGEGKELWYWGH-INIZCTEOSA-N 440.345 4.061 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](C(C)(C)C)C[C@H]3C)cc2F)C[C@@H](C)O1 1654615479 PGDJBVVVRTVVRG-XCJLJZCSSA-N 433.612 4.202 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C)[C@H](Cc3ccccc3)C2)c(C)n1-c1ccccc1 1683148887 FXUMHXPXLUNLML-AREMUKBSSA-N 430.596 4.205 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1707973666 VTLXIIKMYIDNIG-VIZSFHNOSA-N 441.620 4.230 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1723317651 CTGUNSWSQLPDKZ-OAQYLSRUSA-N 429.584 4.125 10 10 IICE C[C@H]1C[C@H](C)CN(CCCCn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)C1 1726465414 RYRBERFWVYOULM-SXWKCWPCSA-N 441.620 4.230 10 10 IICE COCCN(CC1CC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1749819794 SAERRTTZQXLGMM-UHFFFAOYSA-N 443.661 4.040 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 1765237242 KQPAYSJTUBHPDQ-WMZOPIPTSA-N 427.524 4.104 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1765428997 RNWWKQWDFHGNOG-XMMPIXPASA-N 439.629 4.457 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CCC1CCN(CC(F)(F)F)CC1 1768681191 FVTYZQXYNLHONH-UHFFFAOYSA-N 437.510 4.162 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NCc3cc(Cl)cc(Br)c3O)C[C@H]2C1 1965931893 KNSKGXFSJCCLNL-LNSITVRQSA-N 431.758 4.153 10 10 IICE CN(C[C@H]1CCN1C(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044762932 QPYSHYZVGNYFLJ-MRXNPFEDSA-N 446.592 4.008 10 10 IICE C[C@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1cc(F)ccc1O 2084724211 FLYHLBJUBYBZDW-GHTZIAJQSA-N 443.563 4.303 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(CCCOC)C3=O)o2)cc1 2314433330 MFZIEOOLDTYWRU-UHFFFAOYSA-N 431.535 4.361 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(CC(=O)OCC(C)C)C2=O)cc1OC 2314740968 PSNWMMULVBVLHU-UHFFFAOYSA-N 437.583 4.275 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)C=Cc2cccc(Br)c2)c2nccn2C)cc1 2329588263 FLVKGEXYKGEDHA-OAQYLSRUSA-N 439.357 4.168 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC[C@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380758061 TZKKRYKOMFUVNV-ZFWWWQNUSA-N 441.366 4.115 10 10 IICE Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccc1O 2363622 NPULGNPAIZDACZ-LDADJPATSA-N 435.867 4.120 10 10 IICE COc1ccc(C(=O)Nc2cccc(N3CCN(Cc4ccccc4)CC3)c2)cc1OC 13424196 WKSXMXUUGDAMJK-UHFFFAOYSA-N 431.536 4.278 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(CC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 35270662 BKRRYNQFMLLPRD-OIKHISIKSA-N 439.518 4.381 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)cc1)C1CCCCC1 116040072 PSZHRHWNGDKVQY-QHCPKHFHSA-N 435.568 4.082 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc3c2OCC[C@H]3N(C)C)C1 469352811 XBELEFYJZDHOFB-HSZRJFAPSA-N 446.595 4.432 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)[C@@H]3CCCN3C(=O)C(C)C)c2C)c1 748375374 TUYKJANOPFHVJC-NRFANRHFSA-N 442.581 4.189 10 10 IICE CC(C)C(=O)N1CCC(N[C@@H](C)c2cc(Br)cc(Br)c2O)CC1 756396521 OHSYCEKONRQAIO-NSHDSACASA-N 448.199 4.215 10 10 IICE COC(=O)c1nccc2c(S(=O)(=O)Nc3nc(-c4ccc(F)cc4)cs3)cccc12 766742722 AFRTWSKKSNJSAS-UHFFFAOYSA-N 443.481 4.085 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCC(c3cccnc3)CC2)c([N+](=O)[O-])c1Br 768520592 DGEPIFGALGNIDE-UHFFFAOYSA-N 437.250 4.053 10 10 IICE Cc1ccccc1C1=CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 779685732 JZXVSPUYQFVSNF-UHFFFAOYSA-N 440.546 4.102 10 10 IICE Cc1cc(Br)c(O)c(CN[C@@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 781637504 WRQNMJJABBHEDR-OALUTQOASA-N 439.781 4.278 10 10 IICE Cc1nc(CC2CC2)sc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 788757162 PUIQABWAWUIDLK-UHFFFAOYSA-N 439.503 4.189 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c1 804201894 WZFAIYXNJPHDGO-SFHVURJKSA-N 435.490 4.323 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)s1 810449797 NYRXPMXNPMVTKF-CQSZACIVSA-N 439.528 4.333 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CN3CCOCC3)c3ccc(C)cc3)c2C)cc1 1135768259 FZWBFUQHFWQVBF-SANMLTNESA-N 447.579 4.214 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(C)(C)C)cn2)NC(=O)OC(C)(C)C)cc1 1136903864 NSHVGIDIFDHAFT-NRFANRHFSA-N 440.588 4.441 10 10 IICE Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NCc3cc(Cl)ccc3O)c2)cc1 1146233252 RZTYONWKIHJPAJ-UHFFFAOYSA-N 444.940 4.109 10 10 IICE CCN(CC)C(=O)OC[C@@H]1CCCCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1157025562 PBMAPTJMVRMMKB-QHCPKHFHSA-N 439.556 4.380 10 10 IICE COC(=O)Cc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)[nH]c2ccccc12 1169944357 TZLOMAYHZHEHGD-UHFFFAOYSA-N 429.520 4.263 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1CC(OCc2ccccc2)C1 1265564071 BDDLPZYDPHJNKT-GSVIPDFHSA-N 430.495 4.368 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)N(C)Cc4ccccc4)CC3)c2C)c1 1291658882 NMEQHRIPMMVYQV-UHFFFAOYSA-N 444.579 4.412 10 10 IICE COc1cc(C)c([C@@H](C)NC(=O)CN2CCCc3cc(OC(F)F)ccc32)cc1OC 1307536941 HKNGVDYQFLGTKQ-OAHLLOKOSA-N 434.483 4.244 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)C1(C)C 1445636407 AOYSQEQXXZEVOB-QUCCMNQESA-N 428.529 4.453 10 10 IICE Cc1cc(C(=O)CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)s1 1445889302 YAGQBVHGTGZPBD-GOSISDBHSA-N 434.989 4.468 10 10 IICE CCOC(=O)CCN(C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C(C)C 1469647911 BJTJXDVQKOAWOP-UHFFFAOYSA-N 436.350 4.055 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@@H](c3ccc(F)cc3)C2(C)C)N(C)C)cc1 1471547024 GWDIYSYYHKPRPR-XZOQPEGZSA-N 426.580 4.472 10 10 IICE Cc1cccc([C@@H](NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C(C)C)c1 1473702669 MESKAPPTFRHVDM-UNVFRBQDSA-N 441.591 4.351 10 10 IICE Cc1nnc(N2CCO[C@H](c3cccc(Cl)c3)C2)n1CCCSc1nccs1 1492942616 NULGGDRAKHXORZ-KRWDZBQOSA-N 436.006 4.457 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1510621640 YPTSGOQMWUFIGV-KRWDZBQOSA-N 425.602 4.065 10 10 IICE CCCN(CC)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCSCC2)cc1 1514667731 SQFKQMVAQDNSPR-UHFFFAOYSA-N 436.629 4.102 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(CC)[C@@H](C)C2)cc1 1515533387 VZJFXFNOKOAWJS-FQEVSTJZSA-N 426.653 4.292 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1ccc(C(F)(F)F)cc1 1527735719 YQWXKIAMEIQGHY-KRWDZBQOSA-N 447.501 4.001 10 10 IICE CCOc1ccc([C@@]2(C(=O)N[C@H]3CCN(c4ccc(OC)cc4)C3)CC2(Cl)Cl)cc1 1531740743 JQDBVZIBQMJIQL-HTAPYJJXSA-N 449.378 4.304 10 10 IICE Cc1sc(NC(=O)c2cn3c(n2)COCC3)c(C(=O)OC(C)C)c1-c1ccccc1 1532737028 AHPFDPDCKJZBRL-UHFFFAOYSA-N 425.510 4.268 10 10 IICE CC(C)CCN(c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1)C1CC1 1541510031 HZCSWIQVYQWPSA-UHFFFAOYSA-N 429.584 4.440 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](C)CN2CCCCC2)n1 1542563461 BEGXIGMZFGIKOA-LJQANCHMSA-N 434.588 4.113 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C2=Cc3ccccc3O[C@H]2C(F)F)cc1 1544529206 AXYIVGQTCCHFKX-NFBKMPQASA-N 442.506 4.370 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC(OC(=O)Nc4cccc(F)c4)C3)ccc21 1556223493 OBWMQIUACOSSPE-UHFFFAOYSA-N 439.487 4.117 10 10 IICE C[C@]1(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C[C@]1(F)Cl 1586777705 KWKAAVSHARYUEQ-USPWCZQSSA-N 444.956 4.238 10 10 IICE CCCCN(CC)c1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1596684473 OGJVDZWVBWXFSP-UHFFFAOYSA-N 431.527 4.358 10 10 IICE CC/C(=C\C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(Cl)c1 1598009195 KQXCXZALKDLPEO-OBGWFSINSA-N 425.960 4.152 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)CN1CCCCC1=O 1610123565 RRACMJHKQXIPJN-IBGZPJMESA-N 433.474 4.311 10 10 IICE Cc1cc(CC(=O)N[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(C)n1-c1ccccc1 1611280634 LMTHGHVELZSNFK-GOSISDBHSA-N 439.478 4.208 10 10 IICE Cc1ccc(C(=O)Nc2cc(-c3ccoc3C)nn2CCO)cc1-n1c(C)cc(C=O)c1C 1611459194 XXJYWPQIXYJOOZ-UHFFFAOYSA-N 446.507 4.225 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1613390502 UOHJOGHDLHTQLE-SFHVURJKSA-N 446.603 4.402 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H](O)c1ccccc1C(F)(F)F 1626479168 DJYIAWRJCLPSHP-SFHVURJKSA-N 444.400 4.125 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3sc(SC(F)(F)F)nc3C)C2)cc1 1627154492 RTNUZCXDWVCUPG-CYBMUJFWSA-N 445.532 4.257 10 10 IICE O=C(NCc1ccc(NC(=O)c2cccc(O)c2O)cc1)c1ccc(C(F)(F)F)cc1 1628116230 LNFCULIUWGWQGT-UHFFFAOYSA-N 430.382 4.299 10 10 IICE CCCCN(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H](C)c1ccccc1 1634241991 MHPHTIDNOGYNKU-SFZDQAMXSA-N 449.595 4.290 10 10 IICE CC[C@@H](C)c1nc([C@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n[nH]1 1634754530 IPGIXPRWGHXJFS-YPMHNXCESA-N 445.365 4.374 10 10 IICE O=C(NCc1cc(Cl)ccc1O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O 1635018888 CXIREXJLGIYZTH-OAHLLOKOSA-N 442.730 4.347 10 10 IICE Cc1cc(C(=O)N2CCC3(CCC3)S(=O)(=O)CC2)c(C)n1-c1ccc(C(C)C)cc1 1638138200 GKHRTYWXRSGZGY-UHFFFAOYSA-N 428.598 4.401 10 10 IICE COCc1nn(C)cc1C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1638241602 RNQQSNFEDYFDNF-LJQANCHMSA-N 446.473 4.492 10 10 IICE Cc1cc(C(=O)NCCOc2cncc(Cl)c2)c(C)n1-c1ccc(Br)cn1 1640526999 FBNPGBJSTQMWJH-UHFFFAOYSA-N 449.736 4.109 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@]2(C)C(=O)OC(C)(C)C)CCCC1 1641912807 GPTWYOHMGKPZGE-VWLOTQADSA-N 426.557 4.252 10 10 IICE Cc1cc(C(=O)N2CCN3CC(F)(F)C[C@H]3C2)c(C)n1-c1cccc(Br)c1 1643669517 ZJKVGQOBWYLXOM-KRWDZBQOSA-N 438.316 4.022 10 10 IICE NC(=O)N[C@H](CC(=O)NCc1cccc(Cl)c1O)c1cccc(Oc2ccccc2)c1 1648606362 PHFGMXZLPUYBGK-HXUWFJFHSA-N 439.899 4.254 10 10 IICE CCOC(=O)[C@H]1[C@H]2CN(C(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)CC[C@H]21 1649382046 LKQJGZRDISNGEF-YZGWKJHDSA-N 445.357 4.128 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCOc1cccc([N+](=O)[O-])c1 1653348349 AIOINQSTFWKGEK-UHFFFAOYSA-N 427.501 4.451 10 10 IICE CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NCc2cccc(Cl)c2O)c1 1653563930 SLVKSXPRIJLPAU-UHFFFAOYSA-N 444.940 4.191 10 10 IICE CCc1ccc(C(C)(C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1653940589 GIHHASGICDBDDB-UHFFFAOYSA-N 426.516 4.488 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)CC2 1673743359 CSJZEZMGLVYMSI-CBQOVEMMSA-N 444.620 4.175 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC([C@H]2C(=O)Nc3ccccc32)CC1 1673744584 NVXVJJSTRPQSSV-HOYKHHGWSA-N 434.584 4.150 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@H](Sc2cccc(Cl)c2)C1 1684280852 RDFWRWFJAAVNRH-QFIPXVFZSA-N 446.016 4.377 10 10 IICE C[C@H](c1nc2ccccc2s1)N(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684607441 PXBGSODQYGOISO-OXQOHEQNSA-N 425.602 4.368 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@]3(C)Cc3ccccc3Cl)cc2)CC1 1684878769 ZOEMBYMGBVRENZ-RUZDIDTESA-N 441.019 4.399 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCN1C(=O)OC(C)(C)C 1706280529 FQAZIVQLVMEWCC-SFHVURJKSA-N 429.565 4.143 10 10 IICE C[C@@H]1C[C@@H]1n1c([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nnc1N(C)Cc1ccccc1O 1742977507 SYLMBCLJRPHTIU-NEWSRXKRSA-N 441.576 4.316 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1cccc(C)n1 1743724500 HMSOVEKOLPIODT-HXUWFJFHSA-N 448.615 4.463 10 10 IICE CCC[C@@H]1C[C@H]1n1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(=O)NC 1745856840 DICOAJWBSPIVGO-DENIHFKCSA-N 434.588 4.286 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCc1cnn(C)n1)C(C)C 1745936146 YTKRWBMJGCZWQR-UHFFFAOYSA-N 446.603 4.349 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)cc1C 1749937447 DFHBTZNFJZFKHG-YSIASYRMSA-N 429.609 4.050 10 10 IICE COc1ccccc1Cc1nnc(N2CCSCC2)n1CCCSc1nccs1 1770463855 LKBKPRVNVDTKQM-UHFFFAOYSA-N 447.655 4.070 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](Cc3cccnc3)c3ccc(Cl)cc3)CC2)cc1 1858086340 GTVFNMWXARCPTH-DEOSSOPVSA-N 435.955 4.419 10 10 IICE CCCN[C@H](c1ccccc1O)[C@@H](CN(C)Cc1ccccc1)NC(=O)OC(C)(C)C 1942408362 OMNDHDVBWZQNJI-FYYLOGMGSA-N 427.589 4.458 10 10 IICE CC(C)(C)OC(=O)N[C@H](Cc1cccc(Br)c1)C(=O)NCCCCN=[N+]=[N-] 1963732895 SQDQEMCUPLBBDG-OAHLLOKOSA-N 440.342 4.092 10 10 IICE CSCC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccccc3F)o2)SC1=S 2040480256 LQGYHWGWEKPFSS-CQSZACIVSA-N 437.539 4.493 10 10 IICE [N-]=[N+]=NCCN[C@H](C(N)=O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1 2071354760 LCIAOMDVLMVQRU-QHCPKHFHSA-N 431.496 4.271 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C(C)C)c(C(N)=O)c1I 2079954636 OTNABFQSCARLBN-ZDUSSCGKSA-N 441.313 4.032 10 10 IICE CN[C@@H]1C(=O)Nc2cc(N(CCCCOC)Cc3ccccc3)c(Br)cc21 2152206668 SDRNKMQCDNANMD-FQEVSTJZSA-N 432.362 4.095 10 10 IICE COc1ccc(CCN2C(=O)C(=CC3=Cc4ccccc4OC3)SC2=S)cc1OC 2296702659 CJOHYSIJRUMTIS-UHFFFAOYSA-N 439.558 4.467 10 10 IICE C[C@H](Oc1ccc(C=C2C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1)c1ccccc1 2297358797 HXGJYYUVDGIFGQ-SFHVURJKSA-N 426.472 4.489 10 10 IICE COc1cc(C)c(C=C2C(=O)NC(=S)N(c3cccc(Cl)c3Cl)C2=O)cc1C 2297559189 ZSTINZDMOFUOIV-UHFFFAOYSA-N 435.332 4.450 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(-c4ccc(C)cc4C)c3O)C2=O)cc1 33913065 QBRYKVGRFBVUMP-UNOMPAQXSA-N 430.464 4.318 10 10 IICE CSC1=NSC2=NC(=O)/C(=C/c3ccc(OCc4ccc(F)cc4)cc3)C(=N)N12 104372048 UBPIHLYMOHDHAD-HSJXSQSUSA-N 426.498 4.344 10 10 IICE O=C(CN1C(=O)/C(=C\c2cccc(O)c2)SC1=S)Nc1ccccc1C(F)(F)F 210672659 RPFUIWYLPPIPOZ-OQLLNIDSSA-N 438.452 4.251 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1)N2 226893047 ZMAAHQOQRSBLTG-JBYGMCGMSA-N 428.529 4.110 10 10 IICE CCc1cccc2c(CC(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)c[nH]c12 303325414 ASFKDQBKUBRYBW-UHFFFAOYSA-N 445.485 4.445 10 10 IICE COc1cccc(C[C@@H](C)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743606691 KJJMHBSENRUKEH-SJLPKXTDSA-N 433.499 4.196 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccccc4C)n3C[C@@H]3CCCO3)CC2)cc1 812307710 XRFVFTBQTRPHMA-QHCPKHFHSA-N 447.583 4.158 10 10 IICE C[C@]12CCN(C(=O)CCCN3C(=O)/C(=C\c4cccs4)SC3=S)C[C@@H]1C2(F)F 816786837 OOFQLGVYJJAMEG-JZCOREKGSA-N 442.578 4.233 10 10 IICE O=C(C[C@@H](c1ccc(O)cc1)C1CC1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472226 IXHCWTOJLIZXJZ-IFMALSPDSA-N 428.960 4.416 10 10 IICE COc1ccc([C@H](CC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)NC(C)=O)cc1 914456268 UVXDNBDWXKABQC-VWLOTQADSA-N 449.551 4.151 10 10 IICE Cc1cc(-c2nnc(COC(=O)c3cccc4c3C(=O)c3ccccc3C4=O)o2)c(C)o1 916441345 NQLKUCFQNZOWIO-UHFFFAOYSA-N 428.400 4.079 10 10 IICE Cc1c(C)n(Cc2ccco2)c2ncnc(NCc3ccc(N4CCC(O)CC4)c(F)c3)c12 917086173 IBIADQNJSPJGAW-UHFFFAOYSA-N 449.530 4.402 10 10 IICE COC(=O)c1cc(CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)ccc1OC 1141340111 DQMUTQXCOOERCN-UHFFFAOYSA-N 426.900 4.473 10 10 IICE Cc1cc(C(=O)NCc2cc3n(n2)CCCC3)c(C)n1-c1ccc(Br)cc1 1144035253 LTNLFTVFLGCEOA-UHFFFAOYSA-N 427.346 4.319 10 10 IICE C[C@]1(Cc2cccc(F)c2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751093 VUTRGLNHVASTLL-XMMPIXPASA-N 447.501 4.247 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCC1([C@@H]2CCCCO2)CCC1 1253711402 WXOUPWXHRKPWIA-SFHVURJKSA-N 425.367 4.426 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C(=O)c4cc(C)oc4C)CC3)c2C)c1 1254073241 GFJVVIZBRMHNSZ-UHFFFAOYSA-N 448.567 4.280 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1F 1293225329 QQTRDHRGHPYYJA-BEFAXECRSA-N 437.556 4.049 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@@H]3CCN(c4ccccc4F)C3=O)c2C)cc1 1293281874 FWHVJTLEOOINSB-HSZRJFAPSA-N 435.499 4.119 10 10 IICE C[C@@H](CN(C)C(=O)OC(C)(C)C)Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C 1303674730 PASXFMSYODQHNH-KRWDZBQOSA-N 445.608 4.421 10 10 IICE Cc1cccc(-n2c(S)nc3cc(C(=O)NCc4c(O)cccc4F)ccc3c2=O)c1C 1303878633 QGYMGLVRUKEPGE-UHFFFAOYSA-N 449.507 4.066 10 10 IICE CN1CCN(c2ccc(CNc3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])cc2)CC1 1307198365 KXWQUGYOXBLBPV-UHFFFAOYSA-N 430.508 4.190 10 10 IICE Cc1cc(CC(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)c(C)n1-c1ccccc1 1354445615 VFJIJTLFQBPRDS-UHFFFAOYSA-N 433.527 4.197 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)[C@H](C)c1ccco1 1361098094 NTUILQWZZMWVKE-LJQANCHMSA-N 430.556 4.477 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Cc1ccc(Br)cc1Cl 1440670743 AASMOESQJQLHEG-UHFFFAOYSA-N 437.765 4.140 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](c3cccc(C)c3)C(C)(C)C)CC2)cc1 1442056028 ULFXXFOUGZCPQB-JBXKERDYSA-N 449.595 4.112 10 10 IICE COC(=O)c1nc(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)ccc1Cl 1458476451 SBXBBDDBGZZABJ-UHFFFAOYSA-N 425.828 4.273 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)c2)CC1 1459283340 FMLKRJDVZNDVJE-UHFFFAOYSA-N 434.584 4.299 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(C)(C)N2C[C@H](C)C[C@@H](C)C2)CCCC1 1464462856 GXCITFKKQAKHRR-RTBURBONSA-N 425.617 4.401 10 10 IICE Cc1cc(Cl)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1[N+](=O)[O-] 1465952240 YQFZJYBSEHNHEF-HNNXBMFYSA-N 438.311 4.310 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H](n2cccn2)C(F)(F)F)cc1 1479038593 ROGQETBMAHJRBD-IBGZPJMESA-N 435.450 4.058 10 10 IICE CC[C@H]1C(=O)NCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(C)C 1513970186 IHVBDXZJTMZHDA-QFIPXVFZSA-N 434.588 4.114 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc2cc(Br)cnc2n1C 1525113519 ISNOCSYZZOQUAV-UHFFFAOYSA-N 427.346 4.208 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1526246040 AMPWVIBVDINMDE-DOTOQJQBSA-N 449.364 4.418 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(Cl)cc1NCC(F)(F)F 1539302112 JSHUKLYVZPQDPL-UHFFFAOYSA-N 441.881 4.423 10 10 IICE O=C(Nc1ccc(Cl)cc1)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1540438285 BKGVJVOBIPWSBS-UHFFFAOYSA-N 447.856 4.007 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(Br)c(N)c([N+](=O)[O-])c1 1540464656 MRIZPGUIAVMXDA-UHFFFAOYSA-N 447.333 4.202 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C[C@H](C)n1cc(Br)cn1 1545508624 IKXRIIBFLHVQOE-NSHDSACASA-N 445.155 4.114 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1[C@H]1CCCOC1 1545632312 IBZPYNFKHJPPPQ-RTWAWAEBSA-N 445.991 4.210 10 10 IICE CN(CC(C)(C)C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1554135159 SQFPNMQQFRNUNE-UHFFFAOYSA-N 431.600 4.373 10 10 IICE CN(Cc1cnccn1)c1nnc(-c2ccccc2F)n1CCCSc1nccs1 1554188375 LQGRALBXUMGYCE-UHFFFAOYSA-N 441.561 4.150 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1 1557357651 XDOQDTOCEIOJOF-FQEVSTJZSA-N 435.609 4.165 10 10 IICE O=C(N[C@@H]1C[C@H]1c1ccccc1Cl)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1557520119 VOLCDZNBMKVKTR-WMLDXEAASA-N 448.953 4.194 10 10 IICE O=C(CCCc1ccccc1Br)NCc1ccc(N2CCC(O)CC2)cc1 1557638647 CQGBBAITNFYHIZ-UHFFFAOYSA-N 431.374 4.049 10 10 IICE CC[C@@H](c1ccc(F)cc1)N1CCN(c2ccc(/C=C/C(=O)OC)cc2[N+](=O)[O-])CC1 1559272235 OOXYOSVUCGDASM-KKSMZRNKSA-N 427.476 4.193 10 10 IICE COc1cc(N2CCN(CCc3cccc(Cl)c3Cl)CC2)cc(OC)c1OC 1559732543 LNDPFFYAWOKWHC-UHFFFAOYSA-N 425.356 4.384 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1565169103 GRJYIDQCFXQFRV-HXUWFJFHSA-N 432.609 4.320 10 10 IICE Cc1ccccc1C[C@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1567632359 KHIFHMUPHSQPMR-HXUWFJFHSA-N 441.369 4.498 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4cccc(OC(F)(F)F)c4)CC3)C2)cc1 1584444131 GQWWWXDHPCGCEZ-MRXNPFEDSA-N 434.458 4.268 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1598028335 JLJXIBXDHDKREF-JRGCBEDISA-N 437.559 4.292 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@]1(C)CCCS1 1603303634 SIKGRWJMRXAAIL-DEOSSOPVSA-N 443.661 4.235 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1613998452 RPDQCNYGYRHCHS-OAQYLSRUSA-N 442.627 4.186 10 10 IICE CCOc1ccc(N(CC)CC(=O)Nc2ccc(I)cc2C)cc1 1616179259 DGNXYJIAGLFVCV-UHFFFAOYSA-N 438.309 4.463 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC34CN(C(=O)OC(C)(C)C)C4)cc2Cl)C1 1617901012 OYWNPRAFFRYEDF-AEFFLSMTSA-N 448.007 4.450 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1[nH]c(-c2ccccc2)nc1C 1618427405 NDQXPCMPQANXDE-UHFFFAOYSA-N 434.540 4.387 10 10 IICE COc1ccc2nc(C3CC3)cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2c1 1618642825 JBFUEMRCWLKFOX-VWLOTQADSA-N 432.568 4.220 10 10 IICE CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1c(O)ccc2c1CCCC2)Cc1ccccc1 1622664343 QGMNKOKCHBRTOM-FQEVSTJZSA-N 438.568 4.413 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(OC)ccc(Br)c3[nH]2)cc1 1628469357 XQQWNBALIGZENI-UHFFFAOYSA-N 446.345 4.156 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2c(F)cccc2F)no1 1631425906 RSRKAGWOEKMLKD-HNNXBMFYSA-N 447.869 4.373 10 10 IICE Cc1c(NC(=O)c2ccc(N=NC(N)=O)cc2)nnn1Cc1ccc(C(F)(F)F)cc1 1635104229 JHBBKSLONLESEL-UHFFFAOYSA-N 431.378 4.068 10 10 IICE O=C(C[C@H](c1ccccc1)c1ncc[nH]1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941623 UUADHMNNDBEVMR-LEWJYISDSA-N 438.959 4.072 10 10 IICE Cc1ccc(N2N=C(Br)C[C@@H]2C(=O)NCc2c(O)ccc3ccccc23)cc1 1635964814 AERVFNSPUMLRQT-LJQANCHMSA-N 438.325 4.457 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn(-c2cccc(Br)c2)c1C 1640260295 YYKNUHBIANEBLJ-UHFFFAOYSA-N 435.318 4.065 10 10 IICE Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)N2CCOCC2)o1 1642001735 CHDIWAOBHMEVGL-JOCHJYFZSA-N 435.480 4.213 10 10 IICE COc1ccc(-c2cc3nc(CN[C@@H](C)c4cc(OC)ccc4O)[nH]c(=O)c3s2)cc1 1642504448 LMDALTJXPNLFRW-ZDUSSCGKSA-N 437.521 4.225 10 10 IICE C[C@@H]1NC(=O)N(CCSc2ncc(-c3ccc(Cl)cc3)n2Cc2ccccc2)C1=O 1643465081 WXKGGYLPEAJEKF-HNNXBMFYSA-N 440.956 4.284 10 10 IICE CCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)C1CCN(C(=O)OC(C)(C)C)CC1 1648015411 NXZQAKAAUJZOQX-UHFFFAOYSA-N 426.561 4.351 10 10 IICE Nc1nc(CN2CCCc3cc(OC(F)(F)F)ccc32)nc(Nc2ccc(F)cc2)n1 1653623348 NIOOXGBCTXQUPU-UHFFFAOYSA-N 434.397 4.188 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 1658641038 XAMTZKBAVMGDPQ-CALCHBBNSA-N 447.982 4.234 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)Cc3ccccc3F)cc2Cl)C1 1682024093 OLZLDYQHDWTSEL-APWZRJJASA-N 433.955 4.118 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O 1682824614 PNNWLNWWGPRLAG-WZONZLPQSA-N 440.563 4.175 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(CCc2ccccc2)Cc2ccncc2)N(C)C)cc1 1684606743 IKPDMZMXZYVUOA-AREMUKBSSA-N 445.611 4.205 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CCN2Cc2ccccc2)cc1 1687136834 RGKHRHYLJLBJTN-DEOSSOPVSA-N 432.568 4.332 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1Cc1cc(Br)cs1 1696252460 SXAKBNJGZVOQKS-UHFFFAOYSA-N 437.363 4.029 10 10 IICE CC(C)C(C)(C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1706243323 FBDIKVZBUJVRFP-JOCHJYFZSA-N 441.620 4.285 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H](C)C#N)n2CCCn2cccn2)c(C)n1-c1ccccc1 1707251928 IVDFMPAZUABNII-IBGZPJMESA-N 442.571 4.235 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cscn3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1751409631 FVFPYIOLWNRFME-GOSISDBHSA-N 449.628 4.396 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2C[C@@H]2CC=CCC2)c(C)n1-c1ccccc1 1751414140 DITIDHWSVKNBFL-GHTZIAJQSA-N 446.599 4.409 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1763257150 UTSQVKQZOCNBPN-SBUREZEXSA-N 435.620 4.187 10 10 IICE CCC[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1763973039 WSFXDICYSJMBNM-LJQANCHMSA-N 443.592 4.189 10 10 IICE Cc1cc(I)ccc1/N=N/N1CCN(C(=O)OC(C)(C)C)CC1 1860487083 SVYKCRPRMOZTOJ-VHEBQXMUSA-N 430.290 4.151 10 10 IICE CN1CCc2cc([C@H](NC(=O)OCC3c4ccccc4-c4ccccc43)C(=O)O)ccc21 1951376360 XLJCOCUGCCIRGE-DEOSSOPVSA-N 428.488 4.343 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2060641869 OBWAYDSYHKRMCR-UXHICEINSA-N 445.564 4.426 10 10 IICE COc1ccc(O)c(Cn2nc(C3CCC3)c(C(F)F)c2I)c1 2079745126 RAWZDGPDQNLEEB-UHFFFAOYSA-N 434.224 4.455 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1CC[C@H]2NCc1cc(Br)cc(F)c1O 2088574240 VLVXZYIMYWCEQV-XNRPHZJLSA-N 429.330 4.171 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(F)F)c1O 2236046164 USRUDHRDLYYBBT-DOTOQJQBSA-N 441.316 4.019 10 10 IICE Cc1ccccc1C1=NN2C(=N)C(=Cc3ccc(Br)cc3)C(=O)N=C2S1 2297344258 LHOLAXIUBXKJCT-UHFFFAOYSA-N 425.311 4.425 10 10 IICE COc1ccc(C(=O)NN2C(=O)C(=Cc3cccc(C(F)(F)F)c3)SC2=S)cc1 2297560038 FAUSJEICLMVGGC-UHFFFAOYSA-N 438.452 4.260 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3cc(OC)c(O)c([N+](=O)[O-])c3)SC2=S)cc1 2321593996 CFLRRLVHIKKCKS-UHFFFAOYSA-N 432.479 4.114 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CNC(=O)OC(C)(C)C)C2CCC2)c(O)c1Br 2380723286 UUNMZUHRZUKYMG-HNNXBMFYSA-N 441.366 4.020 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(C)c3)C2)sc2c1CCCC2 11355354 ZXDOMXGRKBHPMW-OAHLLOKOSA-N 426.538 4.104 10 10 IICE Cc1cc(C(=O)COC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)c(C)n1-c1ccc(F)cc1 12656406 XCADRQFULCKUOX-FQEVSTJZSA-N 438.430 4.224 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2 14549957 ZMAAHQOQRSBLTG-GXJJEBCYSA-N 428.529 4.110 10 10 IICE COc1c(I)cc(/C=C2/C=C(c3ccccc3)OC2=O)cc1[N+](=O)[O-] 33924208 SIGDADFEUGXTIS-QPEQYQDCSA-N 449.200 4.189 10 10 IICE COc1ccc(N2CCN(c3ccc(-c4nc(-c5ccc(Cl)cc5)no4)nn3)CC2)cc1 46913718 KOBABJQPSVHFSE-UHFFFAOYSA-N 448.914 4.182 10 10 IICE C[C@@H](NC(=O)c1nn(-c2ccccc2)c2c1CCCCC2)c1ccc(N2CCOCC2)cc1 109179876 GDWBSYQRDUFMPM-HXUWFJFHSA-N 444.579 4.469 10 10 IICE CCCN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1ccc(OCC)cc1 586254127 MUTIJWNVUHFYMH-UHFFFAOYSA-N 449.528 4.466 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(CNC(=O)OC(C)(C)C)CC2)c1O 748792726 RRWCJIDEKMHBGD-UHFFFAOYSA-N 428.529 4.069 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1[C@H]1OCC[C@@H]1C(=O)NCc1ccc2c(c1)CCCN2C 752923566 ADSVPVPNNPYVFH-OZXSUGGESA-N 444.579 4.266 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCCOC3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802682732 OLCZDXBWJNLNCZ-JTHBVZDNSA-N 449.599 4.394 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3CCOc4ccc(Br)cc43)CC2)cc1 1125322723 KJYWVYOZKLODHS-LJQANCHMSA-N 445.357 4.063 10 10 IICE Cc1ccc(CC(=O)N2CCN(C(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)cc1 1136530021 YJRAKEOJZIJCDL-UHFFFAOYSA-N 433.527 4.069 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2([C@H]3CCCCO3)CCC2)NC(=O)OC(C)(C)C)cc1 1136903829 MUDJFBONDKFKNT-NHCUHLMSSA-N 445.604 4.174 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)c(C)n1-c1ccccc1 1226383361 OEHSXAZRLOJZGS-DEOSSOPVSA-N 436.600 4.260 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCc2cc(Cl)cc(Cl)c2C1 1233605774 ZUILOYIIQDRNQI-UHFFFAOYSA-N 434.367 4.222 10 10 IICE Cc1cc(C2CC2)nc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1274888284 BTWWOSGVCBRTCD-GZTJUZNOSA-N 442.541 4.032 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1 1291361777 SKILETHVLABYNU-DEOSSOPVSA-N 434.544 4.138 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1304921668 WVSXYZPSHUSCAJ-HDICACEKSA-N 429.584 4.082 10 10 IICE C[C@@H]1CSCCN1c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1305237574 FCBXLTVUXORQHQ-OAHLLOKOSA-N 431.606 4.126 10 10 IICE CC[C@H](CC(F)(F)F)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1435818642 LIOWHHPBGHMKAQ-CKXDQPNJSA-N 434.480 4.264 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccccc2F)on1 1445884777 QICUPCLOQQQNRM-MRXNPFEDSA-N 429.879 4.234 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](Oc3ccccc3)C(C)(C)O)cc2Cl)C1 1448445374 ANOPKGKFHHZMOD-VGSWGCGISA-N 430.976 4.411 10 10 IICE COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H](C)c2ccccc2O)c1 1454807232 RDSFOIDGHIFEFJ-INIZCTEOSA-N 440.521 4.001 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1cnn(-c2ncccc2Cl)c1C(F)(F)F 1457038245 PTHFPERRRZMMIG-UHFFFAOYSA-N 431.201 4.229 10 10 IICE CN(C)c1ccc(CN(C(=O)CCN2CCN(c3cccc(Cl)c3)CC2)C2CC2)cc1 1464056495 GSMACPJBQXMVAB-UHFFFAOYSA-N 441.019 4.109 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC1=CCN(C(=O)OC(C)(C)C)CC1 1508914865 HQKPIGOYALXDMA-UHFFFAOYSA-N 441.576 4.311 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@H](C)[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1511540786 VGVVOEMBUSKNPZ-HOTGVXAUSA-N 442.608 4.370 10 10 IICE C[C@H]1SCCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)[C@@H]1C 1512599054 WWZUUMDLGGZEIO-HZPDHXFCSA-N 446.671 4.233 10 10 IICE CCO[C@H]1CCCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1516422453 ORHQQZGVOVFIDL-DEOSSOPVSA-N 448.615 4.164 10 10 IICE CCOCc1nnc(N2CCO[C@](C)(C(C)(C)C)C2)n1CCCSc1nccs1 1516612950 PXFUBNUEOXZTND-FQEVSTJZSA-N 439.651 4.095 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Oc2ccc(Cl)cc2S(=O)(=O)N(C)C)cc1 1520533800 ZBWVKYWWGLCWJX-UHFFFAOYSA-N 432.929 4.217 10 10 IICE COC(=O)C[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1cccc(C)c1 1532996944 ZHQGGRDVFUKUEH-JOCHJYFZSA-N 434.536 4.258 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc4ncc(Br)cn4n3)c2C)c1 1535136392 MTSZNUFPAYNMTO-UHFFFAOYSA-N 438.329 4.138 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(F)cc1I 1536549374 FKDUEEMPNUEBBY-CYBMUJFWSA-N 440.300 4.166 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3nccn3)nc2)c(C)n1-c1ccc(Br)cc1 1542106392 AOZUAMMUCPYUMZ-UHFFFAOYSA-N 437.301 4.085 10 10 IICE Cc1ccc(F)c2[nH]c(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cc12 1544434928 NVLHDVXQYSFGEK-UHFFFAOYSA-N 435.421 4.401 10 10 IICE Cc1cccc(-c2nc(C)c(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)[nH]2)c1 1544676443 KDLJYSFDRXFHKP-IAGOWNOFSA-N 436.531 4.376 10 10 IICE CCOc1ccc(C[C@@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1545632280 HFVVAXGIJIPZPV-UTKZUKDTSA-N 430.976 4.404 10 10 IICE CC[C@H](Cn1c(C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)NC(=O)OC(C)(C)C 1545954762 KEECDNQNUGONRR-HXUWFJFHSA-N 442.608 4.126 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1Cc1ccnc(C(F)(F)F)c1 1554175506 ZSKYVJHFDAODDB-UHFFFAOYSA-N 442.445 4.088 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)C(=O)Nc3ccccc3)cc2Cl)C1 1564649433 CNKRYICESYPXKB-IAGOWNOFSA-N 428.964 4.403 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC/C=C/c2ccc(Br)cc2)N(C)C)cc1 1564815097 UUEGAGIEAZHQOQ-YAQIIAKESA-N 445.405 4.130 10 10 IICE COc1cc(CN2CC[C@@H](NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)cc(OC)c1 1566295729 RGAOTDIMGBHOHY-JOCHJYFZSA-N 447.579 4.424 10 10 IICE Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2SCCO)c(C)n1-c1ccccc1 1587027688 WJFRVXUGRVHPCA-UHFFFAOYSA-N 425.510 4.017 10 10 IICE CC(C)NC(=O)c1nnc(N2CC[C@H]3CCCC[C@@H]3C2)n1CCCSc1nccs1 1608469871 RILJLZXWHSSQDF-IAGOWNOFSA-N 448.662 4.072 10 10 IICE CCc1ccc(-c2nc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)cs2)cc1 1622564241 VBRHCIATJBOCLD-UHFFFAOYSA-N 425.529 4.483 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)[C@H](C)c3ccc(S(N)(=O)=O)cc3)c2C)c1 1624475309 BKAWNRKCDXMBKL-GOSISDBHSA-N 439.581 4.192 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccc(-n3ccnc3O)cc2)cc1 1627425707 NCHDUKFYSDFRMT-UHFFFAOYSA-N 442.519 4.500 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc(C(F)(F)F)c2O)c1 1627440696 VMRVALGEYXWZLT-UHFFFAOYSA-N 443.425 4.155 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2nccn2Cc2ccccc2)c1 1634666801 ZXHWQYOALBKLGP-UHFFFAOYSA-N 426.520 4.424 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)N[C@@H](C)c1ccccc1O 1635798864 FVNZALMEIIPBFU-HNNXBMFYSA-N 428.485 4.132 10 10 IICE CCOCCN(C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@@H]1CCc2ccccc21 1636353827 KOWUVCRITWSFKK-NBGIEHNGSA-N 437.584 4.257 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)nc3Cl)cc2F)C[C@H](C)O1 1638197322 YHVKYTWTAJAUJZ-RYUDHWBXSA-N 445.844 4.437 10 10 IICE CC(C)N(CC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1)Cc1ccc(N(C)C)cc1 1641555120 ZYEMVPVLFHAVOA-UHFFFAOYSA-N 433.478 4.497 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NC(=O)c3cc4cc(O)c(O)cc4s3)C(C)(C)[C@@H]21 1642991217 LHNJYZCVAYIFOT-ZNZDAUKMSA-N 446.569 4.466 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H]3COCC[C@@H]32)sc(C)c1-c1ccccc1 1644947169 QLJSVCWTRYMDIH-OALUTQOASA-N 442.581 4.340 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3c(-c4ccc([N+](=O)[O-])cc4)noc3=O)c2C)cc1 1656249313 BDYOPQUEFRJRQL-UHFFFAOYSA-N 432.436 4.010 10 10 IICE COc1ccc(N2CCN(C(=O)NCC(C)(C)c3cccc(Cl)c3F)CC2)c(OC)c1 1681705262 FQFBWAKFHSHTJE-UHFFFAOYSA-N 449.954 4.306 10 10 IICE CCCOC[C@H](Cc1cccc(Br)c1)NC(=O)NCc1cc(C)ccc1O 1681795341 JHKFLCVCSLLWJN-IBGZPJMESA-N 435.362 4.300 10 10 IICE CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)NCc1cc(C)ccc1O 1681795342 JHKFLCVCSLLWJN-LJQANCHMSA-N 435.362 4.300 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCC[C@@H]3CC3(O)CCCCC3)C2)cc1 1683340114 PMGCDNVLGZENLU-RBBKRZOGSA-N 429.605 4.171 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@]2(C)Cc2cccc(F)c2)N(C)C)cc1 1684606237 CURAMECFNLIAJR-ILBGXUMGSA-N 426.580 4.301 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC(=O)N(Cc3ccccc3O)C3CCCCC3)[C@H]2C1 1686625362 RBAQCRQHQHEDBN-KXTWHKPSSA-N 429.561 4.102 10 10 IICE COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCc1cc(C)n(-c3ccccc3)c1C)C2 1687286656 OVAYZMJSCOURGF-UHFFFAOYSA-N 447.535 4.157 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1691667840 BRSHYRWWMVOOJB-SFHVURJKSA-N 443.592 4.391 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1712644458 AVCYVGPSVYHMSH-JZWVFAODSA-N 441.620 4.051 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@@H](C(F)(F)F)C2)cc1 1746086212 JIUBATAFCAXPAG-QFBILLFUSA-N 439.526 4.452 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1C 1748379542 FGGYWCBQCOXADH-SFHVURJKSA-N 447.587 4.066 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC[C@@H]1C 1749214235 CPKICXJFEGYOBJ-RDJZCZTQSA-N 449.671 4.431 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2[C@H]2C[C@@H]2C)c(C)n1-c1ccccc1 1751408816 OISKPMSRVUPFMU-JTSKRJEESA-N 434.588 4.142 10 10 IICE CC[C@@]1(C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1764351528 GQTGQFGAVWOVCN-DEOSSOPVSA-N 443.661 4.182 10 10 IICE COc1ccccc1OCc1nnc(N2CCC[C@H]2C)n1CCCSc1nccs1 1770536478 YASKXBONLCQCGD-MRXNPFEDSA-N 445.614 4.493 10 10 IICE COc1ccc(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCCC(=O)N3)cs1 1859572578 RKBCLRRLZNTKFP-UHFFFAOYSA-N 443.550 4.203 10 10 IICE COc1cc(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])SC2=S)cc(OC)c1OC 1860087621 KIZMBCJBHBCBRG-LZYBPNLTSA-N 432.479 4.026 10 10 IICE CCC(=O)N1CCC[C@@H](C(=O)Nc2sc(C)c(-c3ccc(C)cc3)c2C(=O)OC)C1 1860646871 UHLDJCGEMJONDA-QGZVFWFLSA-N 428.554 4.406 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)N2CCCCC2)cc1 1865990908 VHCBNOOGOQAESN-OAQYLSRUSA-N 430.936 4.271 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Cl)cc(Br)c2O)[C@H]2C[C@H]21 2057596845 YMZBWWSVDWVNGH-VHDGCEQUSA-N 431.758 4.296 10 10 IICE NCc1ccc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc1Br 2153346181 HOEFWEFFJOTRQO-ZRZAMGCNSA-N 426.402 4.400 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1C 2313571328 SODUMINUODOQPL-UHFFFAOYSA-N 431.404 4.138 10 10 IICE CCCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2[N+](=O)[O-])SC1=S 2314769875 WLQHPQYQYIHBGN-GOSISDBHSA-N 442.518 4.491 10 10 IICE C[C@@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S 2314836242 BUEMKPCHLLCCSF-NSHDSACASA-N 446.937 4.267 10 10 IICE COc1cc(C=C2SC(=S)N(Cc3ccco3)C2=O)cc(Br)c1O 2318683501 FGINLFWPNOWYKO-UHFFFAOYSA-N 426.313 4.158 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N([C@@H](C(=O)O)c4ccccc4)C3=O)n12 2323865288 FQVIZWQXRJIUGL-CYBMUJFWSA-N 449.966 4.385 10 10 IICE O=C(O)c1ccccc1C=C1C(=O)N(c2ccc(Br)cc2)N=C1C(F)(F)F 2332131891 RCAUGMFUSFYBNM-UHFFFAOYSA-N 439.187 4.496 10 10 IICE Cc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@H]32)s1 14456803 CCSWNPMIFJLQGP-CTWQGKMFSA-N 430.595 4.340 10 10 IICE CCCCCOc1ccc(/C=C2\SC(=S)N(CCC(=O)OC)C2=O)cc1OCC 40937894 ORQHLHIJZMTXLQ-JXAWBTAJSA-N 437.583 4.419 10 10 IICE Cc1ccccc1C(=O)N1CCN(CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 62694518 OGHACCCINHTNAA-UHFFFAOYSA-N 433.527 4.182 10 10 IICE C[C@@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)c1ccc(N2CCOCC2)cc1 109190157 LFRQIABDDOTOHE-LJQANCHMSA-N 429.520 4.267 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccccc3C)C2=O)ccc1O 210711314 PKYPYJRUQHJZIH-CPNJWEJPSA-N 442.562 4.329 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc3c(cc2F)NC(=O)CC3)C1 436012895 ASTCGCHYMXLZRG-UHFFFAOYSA-N 434.515 4.070 10 10 IICE CC1CCN(c2ccc(CNC(=O)N3CCC(C(=O)NCc4ccccc4)CC3)cc2)CC1 731048725 DGWSSOXFLBCGDC-UHFFFAOYSA-N 448.611 4.161 10 10 IICE COc1ccc(NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1N1CCCC1=O 731107595 DGUPYYSZNFUGMI-UHFFFAOYSA-N 436.556 4.380 10 10 IICE CCN(C(=O)NC1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)Cc1ccc(OC)cc1 731406159 QKRXRWSSGGLHEQ-IBGZPJMESA-N 425.573 4.335 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H](CC3CC3)c3ccccc3)CC2)cc(OC)c1OC 760124901 XKOHDXQNCNNGKS-NRFANRHFSA-N 439.556 4.085 10 10 IICE Cc1ccc(/C=C\C(=O)Nc2cccc3c2OCCN3C(=O)/C=C/c2ccc(C)nc2)cn1 791079044 XVTBKRHQPNBTQX-PJABCKPXSA-N 440.503 4.184 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc(-c2cccn2C)n1C[C@@H]1CCCO1 802693633 ZMKWLGUOGRWJPI-QFIPXVFZSA-N 434.588 4.089 10 10 IICE CN(Cc1ccccc1O)c1nnc(COc2ccc(Cl)cc2)n1C[C@@H]1CCCO1 812295435 YHGNLJSAQHMSSM-IBGZPJMESA-N 428.920 4.032 10 10 IICE Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)N(C)Cc1ccc(N(C)C)cc1 916120670 JCGQOGVJXQVFRC-UHFFFAOYSA-N 445.489 4.170 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@H]3Cc3cccc(F)c3)cc2F)C[C@@H](C)O1 918081251 MSXGVMPUNDLOCA-HMFYCAOWSA-N 443.538 4.495 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)c1cccc(Cl)c1 1125325892 RTUXSHNCIQPFEU-UGKGYDQZSA-N 427.976 4.242 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 1126079696 DYENDXXYXLWGRH-UHFFFAOYSA-N 427.346 4.248 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCCc1nc2ccccc2s1 1142687094 KZHVMFYWVVXSSI-UHFFFAOYSA-N 426.538 4.307 10 10 IICE COc1ccc(CN2CC[C@@H]2CNC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1147930289 IEJBAFNMNAHGNZ-JOCHJYFZSA-N 433.552 4.116 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H](NC(=O)c3cc(O)cs3)c3ccccc3O2)C1 1158594026 NNABKMBNLJYUID-ZHRRBRCNSA-N 430.526 4.087 10 10 IICE Cc1cc(C(=O)N[C@H](C)[C@@](C)(O)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1164486327 SUMVDEVAHVSSEN-OPAMFIHVSA-N 442.357 4.278 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3nnnc3CCc3ccccc3)c2C)c1 1188760380 JDDKZSVFELVNLM-UHFFFAOYSA-N 431.565 4.471 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nn(C)cc3C(F)F)cc2Cl)C1 1227207406 GAXICNYPNBIPCX-CYBMUJFWSA-N 425.911 4.247 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCc1cccc(Cl)c1 1264227805 LYGOIFMUHLWRSJ-QGOAFFKASA-N 448.972 4.429 10 10 IICE Cc1cc(C(=O)NCCCNc2ccccn2)c(C)n1-c1ccc(Br)cc1 1293928540 GVKNSXJOHACQJL-UHFFFAOYSA-N 427.346 4.484 10 10 IICE COc1cccc([C@H]2C[C@H](C)CN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1312833149 FVOITCZUQASGTN-KSFYIVLOSA-N 445.510 4.103 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC3(CCCC3)C2)n1Cc1ccc(N(C)C)cc1C 1316187122 LOLSBPNSOQCRSB-FQEVSTJZSA-N 441.620 4.195 10 10 IICE Cc1nc(Br)sc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1355505613 CDDSPNGPTWWRDW-UHFFFAOYSA-N 427.279 4.242 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)S[C@@H](C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1361049024 PZDYPVYSFRMCNX-ROUUACIJSA-N 439.629 4.454 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C)c(NC(=O)c4ccccc4)c3)C2)cc1 1437573536 CDRFJXMMESRYHY-OAQYLSRUSA-N 429.520 4.265 10 10 IICE Cc1ccc(C(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)cc1-n1c(C)cc(C=O)c1C 1440330726 OUSLIQJOJDNLGV-UHFFFAOYSA-N 429.520 4.119 10 10 IICE CCO[C@@H]1C[C@](CO)(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1447795984 IALPCSXSXNLELT-DENIHFKCSA-N 449.389 4.153 10 10 IICE COc1cccc(NC(=O)CSc2ccccc2C(=O)N2Cc3cccc(O)c3C2)c1 1455035620 AJRCXMWWXIPZRJ-UHFFFAOYSA-N 434.517 4.288 10 10 IICE CC(C)(C)c1ccc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1Cl 1462806261 LHMWXMAKODYBGK-UHFFFAOYSA-N 427.976 4.269 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cccc(Br)c1O)C1CCCCC1 1467761302 OVDIHJUJOSWQOR-MRXNPFEDSA-N 441.366 4.245 10 10 IICE Cc1cc(C(=O)N2CC[C@](C(N)=O)(c3ccccc3)C2)c(C)n1-c1cccc(C(C)C)c1 1469027313 YMJCZIDREWYKHJ-HHHXNRCGSA-N 429.564 4.487 10 10 IICE CCCCOc1ccc(CNC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1Cl 1469811113 ZPAYHTGRKFXVKU-UHFFFAOYSA-N 445.007 4.270 10 10 IICE C[C@@H](CNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)c1ccc(C(F)(F)F)cc1 1469819906 XHTFPCNNCQTZPY-KKSFZXQISA-N 436.522 4.477 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@H]1C[C@H](OCC)C12CCCC2 1471191253 OBMSPZBHXJJSIQ-ZEQRLZLVSA-N 442.648 4.098 10 10 IICE COC(=O)C1(CCCCNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CCC1 1472247006 CWAVEHNRQFXGCB-UHFFFAOYSA-N 439.600 4.038 10 10 IICE Cn1c(-c2ccccc2)cnc1SCCS(=O)(=O)c1cccc(Br)c1 1472953707 WBIVQVKWODCGPH-UHFFFAOYSA-N 437.384 4.416 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC(C)(C)c3ccc(OC(F)(F)F)cc3)C2)cc1 1478958032 VPMMHUQKFIHICH-INIZCTEOSA-N 437.462 4.407 10 10 IICE CC(C)[C@@H](CCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)NC(=O)OC(C)(C)C 1479013804 XVFGRSHERHOCTM-WOJBJXKFSA-N 449.592 4.022 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1501843954 CVXIPTSRTOMPKR-FQEVSTJZSA-N 448.615 4.162 10 10 IICE C[C@@H](CN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1)c1nccs1 1509997155 APFUTOSBQXJXFB-HNNXBMFYSA-N 439.564 4.223 10 10 IICE O=C(Cn1nc(C(F)F)cc1C(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1515927544 RFYRLYXVNYPYTR-UHFFFAOYSA-N 431.345 4.172 10 10 IICE CCCN1C[C@H](C(=O)Nc2sc(C)c(-c3ccc(C)cc3)c2C(=O)OCC)CC1=O 1523247226 QDMBLYLCAYJFKT-QGZVFWFLSA-N 428.554 4.406 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F 1528924073 IKLSGMWSSYAEKR-CQSZACIVSA-N 449.452 4.161 10 10 IICE CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1534242770 WVWNKSRDDZWPBZ-CQTHNFAISA-N 425.598 4.011 10 10 IICE C[C@H](NC(=O)c1cc(Br)cnc1Br)c1ccc(N(C)C)cc1 1537680555 YBKIZRFKOFPXCB-JTQLQIEISA-N 427.140 4.164 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)C3(c4c(Cl)cccc4Cl)CC3)cc2)CC1 1538131633 FSIOKHWOGWTZOM-UHFFFAOYSA-N 446.378 4.043 10 10 IICE CC(C)CN1CCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC1 1541559729 VJCKGAJDJAJIHI-UHFFFAOYSA-N 442.658 4.362 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)[C@@H]1C 1544410406 HZRNANUHOYARKI-ZWKOTPCHSA-N 429.584 4.125 10 10 IICE CCN(CC)C[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1 1547482835 DAUMYKYEQPDBQS-FQEVSTJZSA-N 444.643 4.288 10 10 IICE CN(CCC(F)(F)F)c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1554251583 QBXLUENBDJSPDV-UHFFFAOYSA-N 442.536 4.291 10 10 IICE Cc1cc(C(=O)N2NC(=O)CC23CCCCCC3)c(C)n1-c1ccc(Br)cn1 1557245719 LWKZVUOGNAXQPF-UHFFFAOYSA-N 445.361 4.222 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1CC[C@H](Cc2ccccc2)C1 1564591863 WSOAEIYSOLXBKH-QUCCMNQESA-N 429.511 4.012 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2c(OC)nsc2OC)cc1 1565655978 JUMUFHLRACREEQ-UHFFFAOYSA-N 427.526 4.082 10 10 IICE CNC(=O)c1cc(Oc2cccc(NC(=O)c3cc4cc(O)c(O)cc4s3)c2)ccn1 1569815808 PMIXZXDSQBOOBD-UHFFFAOYSA-N 435.461 4.112 10 10 IICE CC1(C)C[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCO1 1616572895 MOCZSFSMXQOLOB-ZDUSSCGKSA-N 429.318 4.303 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN1CC=CCC1 1619827665 TZLLZSBMAQAUIH-UHFFFAOYSA-N 448.615 4.087 10 10 IICE Cc1ccc([C@@H](CN2CCOCC2)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1624580806 DOYVDOIYAPISMD-AREMUKBSSA-N 445.563 4.018 10 10 IICE COc1ccc(Cn2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)n2)cc1 1625679433 FYNKXTBAFRYAMI-UHFFFAOYSA-N 428.492 4.412 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1 1630824682 GTXFOQFJRCMNIB-KRWDZBQOSA-N 428.492 4.371 10 10 IICE C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)N(C(=O)OC(C)(C)C)C1CC1 1631511675 DNHPHDPXBQNRJD-HNNXBMFYSA-N 443.510 4.432 10 10 IICE COC(=O)[C@H](Cc1cc2ccccc2o1)NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1634282934 GRSMDTDERPDOIH-QFIPXVFZSA-N 434.467 4.494 10 10 IICE O=C(NC[C@](O)(c1ccc(Cl)cc1)C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1635177359 GOMZLNBQHLEWND-KRWDZBQOSA-N 431.819 4.146 10 10 IICE CCOC(=O)N(C)C1CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1637578190 RGWCCFRDHAURQZ-UHFFFAOYSA-N 426.561 4.165 10 10 IICE Cc1ccc(-n2ncc(C(=O)NCc3ccc4cccnc4c3O)c2C(F)(F)F)cc1 1639621797 ULYWNZHKAZTIRS-UHFFFAOYSA-N 426.398 4.383 10 10 IICE COC(=O)c1cccc(OCCN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)c1 1641743922 STJLQZWBJQXABZ-UHFFFAOYSA-N 440.540 4.330 10 10 IICE CN(CCOc1c(Br)cccc1Br)c1ccc2c(c1)OCO2 1642300549 NEVCPPLJQKASDS-UHFFFAOYSA-N 429.108 4.456 10 10 IICE CC(C)(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)NCc2ccc3cccnc3c2O)cc1 1643283107 GKKOXTPICHZNLF-HXUWFJFHSA-N 449.576 4.069 10 10 IICE Cc1cc(C(=O)N2CC[C@H](c3ncccn3)C2)c(C)n1-c1cccc(Br)c1 1645329459 FYERMFNQQYSWET-INIZCTEOSA-N 425.330 4.276 10 10 IICE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1648426485 YPICLTIHMCSRJJ-OAQYLSRUSA-N 434.540 4.466 10 10 IICE CCOCc1nnc(N(C)Cc2nccs2)n1Cc1ccc(N2CCC(C)CC2)cc1 1649659557 RZIQAUJSLRCNHQ-UHFFFAOYSA-N 440.617 4.192 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)[C@@H](CO)Cc3ccccc3)cc2Cl)C1 1680562491 KXUYRMGZTOHVOO-WIYYLYMNSA-N 429.992 4.321 10 10 IICE COc1cccc([C@@H](C)N2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1683253211 DZDGJCLFCIDIJX-LEWJYISDSA-N 438.616 4.089 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](CC(C)(C)C(N)=O)C3)cc2Cl)C1 1686268766 HEGFXPNSQULYAT-HKUYNNGSSA-N 449.039 4.400 10 10 IICE CC[C@@H](C)CN(C)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc2c(c1)CCCN2C 1708585720 HZNWXJWOGONGFT-GOSISDBHSA-N 435.620 4.053 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1709219768 HXWOYKAIMCMBPT-PXNSSMCTSA-N 434.588 4.066 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C 1710908297 RZOCVELQGHTAJM-SSEXGKCCSA-N 427.618 4.213 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@@H](N3CCCCC3)C2)cc1F 1729330003 LXZCCPCQTREAJQ-HXUWFJFHSA-N 442.627 4.185 10 10 IICE Cc1occc1CN(C)c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1761615694 JCFDFGBDHMYOBM-UHFFFAOYSA-N 437.588 4.196 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(=O)(=O)CC 1764041601 COJFKCLCLCFVKT-UHFFFAOYSA-N 443.617 4.024 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CC1([S@](C)=O)CC1 1768651472 OOGLYUIWFLIPRD-HKBQPEDESA-N 443.661 4.014 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(-c4ccc(F)cc4)n4ccccc34)CC2)cc1 1858344376 NILPZSNZAXOHSD-UHFFFAOYSA-N 430.483 4.111 10 10 IICE CCN(CC)c1ccc(CNCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1860717030 PLTMVVKDCWFGIJ-UHFFFAOYSA-N 441.531 4.037 10 10 IICE Cc1cc(OCC(=O)N[C@H](c2ccc(N(C)C)cc2)c2nccn2C)cc(C)c1Cl 1865928753 RXCWSFJBZYMHPZ-JOCHJYFZSA-N 426.948 4.041 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)c(Br)c1 1912064242 GUFTVCVQXIEFBT-RTBURBONSA-N 427.342 4.115 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2cc(Br)ccc2O)C1 1952459878 RRXKASSNZPPKMB-RHSMWYFYSA-N 434.286 4.329 10 10 IICE CC(C)(C)OC(=O)NCC1CC2(C1)CC(NCc1c(O)cccc1Br)C2 2108264577 ABGNBZIZFNILOW-UHFFFAOYSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(CNCc2cc(Br)cc(F)c2O)C1 2136105925 IIOVBIHYIDIIGC-YJYMSZOUSA-N 429.330 4.031 10 10 IICE CC[C@H](N[C@H]1CCO[C@@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2154211690 LLAUWAQHBZMPJF-UXLLHSPISA-N 443.382 4.268 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNCc1cc(Br)cc(F)c1O)C2 2182489346 BALVTBPYGNXBBD-AHIWAGSCSA-N 443.357 4.419 10 10 IICE CC[C@]1(NCc2c(Br)ccc(OC)c2O)CCN(C(=O)OC(C)(C)C)C1 2227749899 HMYVGIVMFMDONP-IBGZPJMESA-N 429.355 4.043 10 10 IICE Cc1ccsc1C=C1SC(=S)N(c2c(C)n(C)n(-c3ccccc3)c2=O)C1=O 2296663462 UEATZPFCOWJWHA-UHFFFAOYSA-N 427.576 4.260 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)NCCc1ccccc1 2297554572 IEMOUWUOGIXQRB-UHFFFAOYSA-N 430.982 4.290 10 10 IICE CC[C@@H]1C[C@@H](C(=O)NCc2ccc(C)c(Br)c2O)N(C(=O)OC(C)(C)C)C1 2380719405 CYGMNTQHDGKONJ-HIFRSBDPSA-N 441.366 4.115 10 10 IICE Cc1ccc(CNC(=O)c2ccc(NC(=O)OC(C)(C)C)nc2)c(O)c1Br 2380725281 JSOVALIATHIVKA-UHFFFAOYSA-N 436.306 4.135 10 10 IICE Cc1ccc(CN(C)C(=O)[C@]2(NC(=O)OC(C)(C)C)CC2(C)C)c(O)c1Br 2381130867 GAAVDVZLJWDLLV-HXUWFJFHSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)C(C)(C)CN(C)C(=O)OC(C)(C)C)c(O)c1Br 2381137868 QQUKDNKWYZNUSL-UHFFFAOYSA-N 443.382 4.315 10 10 IICE O=C(CN1C(=O)/C(=C/c2cccc(O)c2)SC1=S)Nc1cccc(C(F)(F)F)c1 15035792 ZWDXXTRUYZQCOL-NVNXTCNLSA-N 438.452 4.251 10 10 IICE C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 16878175 POEBNCPYPVYAQB-KBMIEXCESA-N 426.605 4.203 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1COc2ccccc21 754880637 MSBAFMVCYDCOFJ-RZQQEMMASA-N 431.483 4.121 10 10 IICE Cc1ccc(NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1S(C)(=O)=O 759997945 KHKKLOLWXFXYDQ-UHFFFAOYSA-N 441.553 4.292 10 10 IICE CC[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cc(Br)ccc1O 775486756 FFJHRCUVBGAWRU-CLCXKQKWSA-N 434.378 4.404 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CCCc2cccnc21 776118226 NSIKVIDLAOFEBT-HSZRJFAPSA-N 440.563 4.181 10 10 IICE COc1cc(C)nc(/C=C2/SC(=S)N(C3CCN(Cc4ccccc4)CC3)C2=O)c1 776726495 KCFMAMTUFTWMPB-KGENOOAVSA-N 439.606 4.264 10 10 IICE Cc1cc(Br)c(O)c(CNCc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1 781629755 ZOBRSGZRGIHEET-HZPDHXFCSA-N 447.373 4.002 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(OC)c(F)c3C)n2)cc1OC 782925349 ICARHTZTJOUDMB-UHFFFAOYSA-N 438.502 4.084 10 10 IICE CC(C)n1ncc2c1C[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)CC2 790583522 IJHXCNJLVJHSPB-NRFANRHFSA-N 435.572 4.392 10 10 IICE CCc1ccc(-c2cc(C(=O)NCc3ccc(N4CCN(CC)CC4)c(F)c3)no2)cc1 1125907089 GTWFVZDNSBUUSU-UHFFFAOYSA-N 436.531 4.115 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2c(F)ccc3ccncc23)c1 1125925024 GDXRVQZIYDQUPI-UHFFFAOYSA-N 428.467 4.118 10 10 IICE Cc1cc(CC(=O)NCc2cc(S(C)(=O)=O)ccc2F)c(C)n1-c1ccc(Cl)cc1 1128430899 RONDGVQAVMTXRR-UHFFFAOYSA-N 448.947 4.149 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2ncc(C(=O)Nc3c(Cl)ccc4nonc34)o2)CC1 1128704611 RNAVJINHIVUVQA-UHFFFAOYSA-N 447.879 4.231 10 10 IICE Cc1nc(COc2cccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2)cs1 1134682059 RQLBJMNZQAPANJ-QHCPKHFHSA-N 438.597 4.129 10 10 IICE Cc1cc(C)c(CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(C)c1Br 1134882235 NFXOIKLVPRSICB-OAQYLSRUSA-N 446.433 4.402 10 10 IICE Cc1cc(C(=O)N[C@@H](CCCO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1137517403 KJTKSTCNRHDMOY-FQEVSTJZSA-N 442.357 4.495 10 10 IICE Cc1ccc2c(c1)C(=O)N(CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1)C2=O 1137816748 QJVFQHBAJARKKV-GOSISDBHSA-N 428.488 4.087 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3C[C@H](OCc4ccccc4)C3(C)C)C2)cc1 1235188392 WYSJGZKRPIGLEI-HUVFLSCGSA-N 437.584 4.205 10 10 IICE Cc1ccc([C@@H]2CCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)C2(C)C)cc1 1251105164 RRGLIXWEBALTEI-DEOSSOPVSA-N 448.611 4.174 10 10 IICE CC1=Nc2ccccc2C12CCN(C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)CC2 1256236714 KIFLIJWYTURLOU-DEOSSOPVSA-N 433.600 4.205 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCCN(c4ccccc4OC)CC3)ccc21 1289727825 LLRBNVFWXTVXAF-UHFFFAOYSA-N 435.568 4.266 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CC(=O)Nc2ccccc2Cl)CCCC1 1290561416 NRRUVDBBNITJLQ-UHFFFAOYSA-N 439.943 4.279 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1291269906 YPOKKIYTQJXBGU-HNNXBMFYSA-N 431.606 4.126 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2CN(c3ccc(F)cc3)C2=O)cc1 1296247822 XXFMVUYBLSEEGH-QFIPXVFZSA-N 431.471 4.452 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CC[C@@H](C)C2 1349304980 OMKJDVKMQUDZGS-HUUCEWRRSA-N 432.586 4.169 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Br)ccc2C2CC2)N(C)C)cc1 1463279399 IAFAXHGPKKLPCN-NRFANRHFSA-N 430.390 4.425 10 10 IICE C=CC(=O)Nc1ccc(O)c(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 1464999511 FPLYJGFUIWQLHS-UHFFFAOYSA-N 445.519 4.438 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1-n1cnnn1 1465541893 XVRKQKMMAKDZDJ-UHFFFAOYSA-N 430.512 4.454 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@](C)(CC)C2)n1Cc1ccc(N(C)C)cc1C 1513345946 MBCGKAQJSGJYRH-RUZDIDTESA-N 440.636 4.246 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N2CCCOCC2)cc1 1515528620 QLHQFNRVWGSXEN-UHFFFAOYSA-N 440.979 4.115 10 10 IICE C[C@H](NC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1)c1ccc(N(C)C)cc1 1517377714 XWIZMDIHNYRLAH-JMMZKRSASA-N 444.564 4.343 10 10 IICE COc1cc(N2CCN(C(=O)CCc3cccc4ccccc34)CC2)cc(OC)c1OC 1521500186 DOKDRQGJBXGWLW-UHFFFAOYSA-N 434.536 4.147 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)N3CCCCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1540670083 VLCANOLYRRLCAA-UHFFFAOYSA-N 442.991 4.040 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H]2CCN(c3ccccc3Cl)C2)cc1 1544529702 JFJJASBAJHGYHW-IRLDBZIGSA-N 442.003 4.440 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN1CCC[C@H]1C 1545504121 PCPJILMQHZSTPZ-NHCUHLMSSA-N 440.636 4.001 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccccn3)CC2)n1CCCSc1nccs1 1545539650 GAWFJPLNLVTSRZ-KRWDZBQOSA-N 443.646 4.152 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1C[C@@H]1CCCC[C@@H]1C(F)(F)F 1554175310 KUYJITZFTXKBPX-RDJZCZTQSA-N 446.477 4.446 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN([C@@H](C)c4nccs4)CC3)c2C)c1 1565193217 RRBDCGJOKOCXTA-FQEVSTJZSA-N 437.613 4.447 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cccc(Cl)c2F)NC(=O)OC(C)(C)C)cc1 1565881665 FKTQAQAECAFVHY-LJQANCHMSA-N 449.954 4.470 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCO[C@H](CNC(=O)OC(C)(C)C)C2)c1 1567734389 QCICREDDXOEOJH-GOSISDBHSA-N 447.963 4.113 10 10 IICE Cc1cc(CC(=O)N[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2(C)C)c(C)n1-c1ccccc1 1570531982 VMDWDRSKKGZDMN-SFTDATJTSA-N 425.573 4.445 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C(C)(C)c3ccc4ccccc4c3)CC2)cc1 1583753296 VETSDHYSVIOCDQ-UHFFFAOYSA-N 431.580 4.064 10 10 IICE CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1584007623 FYHSZLHQHZMZCN-XMSQKQJNSA-N 437.584 4.372 10 10 IICE COc1ccc(CN2C[C@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)cc1 1597950245 LDSSEYNJUKHRRG-JOCHJYFZSA-N 449.595 4.129 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]c3cccc(Br)c23)N(C)C)cc1 1603555071 NQOPLLSCAJZAHQ-LJQANCHMSA-N 429.362 4.029 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC[C@@H](C)C1 1615090280 BFQHIJCQZYQRFI-LJQANCHMSA-N 448.615 4.457 10 10 IICE Cc1cc(CN2CCN(C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)CC2)ccc1N(C)C 1620680943 VJNGGEZXWPYXGP-UHFFFAOYSA-N 448.608 4.266 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(C)n(-c3ccc(Cl)cc3)c1C)C[C@@H]2O 1624208827 WZNWOPPZRCIHGR-FQEVSTJZSA-N 440.927 4.454 10 10 IICE O=C(NCc1cc2ccccc2s1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1624956383 POTBTCGOAUBYCV-UHFFFAOYSA-N 444.559 4.399 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)[C@]12CCCO2 1633710343 JOVWCYHWNFRUEC-KCZVDYSFSA-N 447.373 4.313 10 10 IICE COC[C@]1(CNC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)OCCc2ccccc21 1635796107 DOZJADIRXQKRRT-MHZLTWQESA-N 447.579 4.050 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cccc(-c2cnc3nc(O)n(C)c3c2)c1 1639341398 SFBVIOXCNHOFSN-QGZVFWFLSA-N 443.551 4.076 10 10 IICE CC(C)(C)c1cnc(Sc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)s1 1639614244 DCSGNWOFFLIGCZ-UHFFFAOYSA-N 427.573 4.285 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](N(C)CCc2ccccc2)C1 1644638942 DFGWRRPBYCVKSV-DEOSSOPVSA-N 429.564 4.296 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(c3ccsc3)C3CCCCC3)CC2)cc1 1658488309 MKYPOLWXRVMJPM-QHCPKHFHSA-N 429.630 4.079 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H](O)Cc3ccc(F)cc3)cc2Cl)C1 1681828578 UPBXWSXNKPEJOD-JXFKEZNVSA-N 433.955 4.118 10 10 IICE CC(C)(C)[C@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c2ccccc21 1685244729 VUTVCPHURVHGMP-QFIPXVFZSA-N 434.584 4.248 10 10 IICE CCCCCCNC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 1686826286 FHJDRDFFWIMOEQ-IRLDBZIGSA-N 430.637 4.110 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N(C)C1CCC2(CC1)OCCO2 1707304968 MELOSIMZJBJNEY-UHFFFAOYSA-N 441.620 4.021 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2C[C@H](C)O[C@@H](C)C2)cc1 1710028510 URWIVCCRAXYUSR-OALUTQOASA-N 439.629 4.439 10 10 IICE CCn1cc(CN(C)c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)cn1 1710181310 AYLLYLFEVGQWOW-UHFFFAOYSA-N 435.620 4.150 10 10 IICE C[C@H]1SCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)[C@@H]1C 1726777056 ZOOZDFCAINRSKD-RBSFLKMASA-N 425.649 4.099 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CCO1 1727828325 CWPVWWCUXPEJLX-INIZCTEOSA-N 435.644 4.185 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@](C)=O)CCC1 1728273589 ZZCSDQDDAKZQGI-PMERELPUSA-N 425.602 4.110 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N(C)Cc2ccco2)cc1 1728384647 ZZVLIYNWJOWNIB-UHFFFAOYSA-N 447.587 4.264 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728936672 YKXYPPIZAJKGIP-FCHUYYIVSA-N 425.621 4.293 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)OC(C)(C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1751408348 GDCFNJZDRSZSFJ-SFHVURJKSA-N 437.588 4.127 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1CCC(OC(C)C)CC1 1751432300 DOPMRBCZXVNNGW-UHFFFAOYSA-N 448.615 4.080 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CC[C@@H](C)[C@H]2C)cc1 1764941217 GVOIGQRXCRISRK-URLVKDPJSA-N 441.620 4.131 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1769561519 MWLZLCOCOKAQNL-ROUUACIJSA-N 425.602 4.329 10 10 IICE C[C@H]1N(Cc2ccccc2)CC[C@@]1(CN)N(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 2074363237 CEGCWJOHXOMUQW-IBVKSMDESA-N 438.616 4.139 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2CCC2)c(CO)c1I 2079005869 REDUVYCOLJTOIH-OAHLLOKOSA-N 426.298 4.261 10 10 IICE CCOC(=O)c1c(C(F)F)nn([C@H](CC)c2ccc(OC)cc2O)c1Br 2079879810 JCNBKPRVCVIXSV-LLVKDONJSA-N 433.249 4.474 10 10 IICE C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)C(=Cc2cccs2)SC1=S 2296252569 DOIQIEBTJCEUTF-ZDUSSCGKSA-N 441.603 4.178 10 10 IICE CCCCC1=NN2C(=N)C(=Cc3cccn3-c3cc(OC)ccc3OC)C(=O)N=C2S1 2297499408 BKFMYVFXZGENPS-UHFFFAOYSA-N 437.525 4.304 10 10 IICE Nc1ccc(OCCOCc2cc(I)ccc2Br)cc1 2367527094 PFSQFEUXGXZXFA-UHFFFAOYSA-N 448.098 4.232 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H](C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2381128778 ZPQJRLSFPHFNQD-CYBMUJFWSA-N 443.382 4.363 10 10 IICE CC[C@H](C)N(Cc1ccc(N(CC)CC)cc1OS(=O)(=O)CC)C(=O)CC(C)C 6711007 JDBKKKNGCCTLCH-SFHVURJKSA-N 426.623 4.435 10 10 IICE CCOc1ccc(Nc2nc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)cs2)cc1 9208730 IVZLEPIKCVSJIA-UHFFFAOYSA-N 438.553 4.256 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCC(=O)Nc3ccccc3)C2=O)ccc1O 15037203 NIQGVQMUCLTAGZ-AQTBWJFISA-N 428.535 4.021 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)C(F)(F)F)c(Oc3ccccc3)cc(O)c21 39899546 DWFCREPLMZDQJO-UHFFFAOYSA-N 427.334 4.461 10 10 IICE CN1C(=O)/C(=C/c2cn(CC(=O)Nc3ccc(F)cc3)c3ccccc23)SC1=S 207527432 SUEUWRCYRIAAAH-ZDLGFXPLSA-N 425.510 4.250 10 10 IICE COc1cccc([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1O 309656101 JMERTOAGXLOQGP-NRFANRHFSA-N 433.460 4.455 10 10 IICE CNC(=O)CCOC1CCN(CC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CC1 752339607 ZVRPCMHOIIVOPA-UHFFFAOYSA-N 439.600 4.017 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)c(C)n1-c1cccc(Cl)c1 763772412 GINBAWMQKJVBTM-FPOVZHCZSA-N 428.916 4.305 10 10 IICE COc1ccc(C)cc1-c1csc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)n1 782263293 XSRWINNHGDHDFV-UHFFFAOYSA-N 429.445 4.342 10 10 IICE COc1ccc(CCN2C(=O)/C(=C/c3cc(-n4ccnc4)cs3)SC2=S)cc1 783698685 MZLFRAVNXKQMPM-WQRHYEAKSA-N 427.576 4.386 10 10 IICE COc1ccc(C2(C(=O)NCc3cc(Br)ccc3O)CCCC2)cc1OC 804736105 NTPMUFPLTSOMKY-UHFFFAOYSA-N 434.330 4.300 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3ccc(C)c(Cl)c3)n2)cc1 915290990 HSOSHRVZCBZHCC-UHFFFAOYSA-N 449.985 4.251 10 10 IICE COc1ccc(N2CCN(C(=O)c3sc(-c4ccc(F)cc4)nc3C)CC2)c(OC)c1 1132032143 LRXKDSJHTFCPMK-UHFFFAOYSA-N 441.528 4.237 10 10 IICE CCOC(=O)[C@H](CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)Cc1ccccc1 1136429776 RQOSDNRZCPIBBP-QFIPXVFZSA-N 436.552 4.056 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 1152401683 OHVIJXTWYLEZKI-ZDUSSCGKSA-N 443.849 4.445 10 10 IICE COC(=O)CC[C@H](Cc1ccccc1)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1153373684 JPRVOGKJASDDAB-HXUWFJFHSA-N 448.563 4.209 10 10 IICE CSc1ccc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1155221462 BHMDAUMSKVKAGW-CYBMUJFWSA-N 448.591 4.467 10 10 IICE Cc1cc(C)cc(N2CC[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)C2=O)c1 1163900728 CCIMRLHYVMVCBF-NRFANRHFSA-N 447.501 4.313 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCCCc4ccccc43)cc2F)C[C@@H](C)O1 1191781241 ORKYANSGISWPCH-BGYRXZFFSA-N 439.575 4.289 10 10 IICE C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC(=O)NCc1cccc(Br)c1O 1251843413 JSXGDAOCJJPBRO-LBPRGKRZSA-N 434.309 4.216 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC[C@@H](C(=O)NCc4ccccc4)C3)c2C)c1 1254075133 XDEIOGMBABFQMF-HSZRJFAPSA-N 444.579 4.250 10 10 IICE Cc1ccc(NC(=O)CS[C@@H](C)C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1 1264286663 UKZBQIVEGVDWRD-IBGZPJMESA-N 425.598 4.314 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1Cc1sccc1Br 1298363908 OEFNSMLFPSGSMN-UHFFFAOYSA-N 444.358 4.488 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCc3csc(C)n3)CC2)cc1 1315515078 FXYNQXSILIQUQK-UHFFFAOYSA-N 440.617 4.134 10 10 IICE CC(C)(C)Oc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)nc1 1354784395 LAPAJVFHYZFASI-UHFFFAOYSA-N 437.462 4.044 10 10 IICE Cc1cc(CC(=O)Nc2nc(CN3C[C@@H](C)O[C@H](C)C3)cs2)c(C)n1-c1ccccc1 1357327504 OLOOUYODWBFWDF-QZTJIDSGSA-N 438.597 4.341 10 10 IICE COC(=O)COc1ccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)c2cccnc12 1435523638 PGBDMCXOCMTJTD-UHFFFAOYSA-N 429.476 4.446 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(N)c(OC(F)(F)F)c2)cc1 1442611896 HOGJGSWENVYYHT-GOSISDBHSA-N 437.462 4.055 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@](C)(CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1455935491 XRKWEIBGTUMQHA-RUZDIDTESA-N 447.620 4.357 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCc3cc(Cl)ccc3Br)C2)cc1 1461496096 OEPOOSQNZFJFSO-MRXNPFEDSA-N 437.765 4.439 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccncc3OCC(F)(F)F)c2C)cc1 1467489033 DQZUDHSBNCIOME-UHFFFAOYSA-N 433.430 4.369 10 10 IICE CC[C@@H](C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)n1nnc(-c2ccc(Cl)cc2)n1 1469106307 KAMUJFTWHMJFSI-IERDGZPVSA-N 440.979 4.066 10 10 IICE Cc1cc(CC(=O)N2CCC(O)(Cc3ccccn3)CC2)c(C)n1-c1ccc(Cl)cc1 1470036096 ZXWDMXJLCRWRRM-UHFFFAOYSA-N 437.971 4.281 10 10 IICE CCCN(CCn1c(CC(C)C)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1514774226 PEQLJSOXSQPUHX-UHFFFAOYSA-N 445.608 4.466 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(CC)C[C@@H]2CCCO2)cc1 1515532512 RANXDYWMOACBPU-GMAHTHKFSA-N 441.620 4.072 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@H]32)sc2c1CC[C@H](CC)C2 1523797598 UQDZFMKBHZCSQT-XJNFMUPTSA-N 432.586 4.073 10 10 IICE Cc1cc(O[C@@H](C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1C(C)C 1527858657 XXKYZUUGUNCUTQ-KRWDZBQOSA-N 432.511 4.317 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3cc(Cl)ccc3Br)CC2)cc1 1534017444 KQBICMODKOEEPD-UHFFFAOYSA-N 437.765 4.393 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1CCN(C(=O)OCc2ccccc2)CC1 1536549451 GQIQSJCDFZSKJX-HXUWFJFHSA-N 437.584 4.157 10 10 IICE CO[C@H](C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C1CCCC1 1537251833 UOPWJUSDALDNDY-SFHVURJKSA-N 429.318 4.303 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3CN(C(=O)OC(C)(C)C)Cc4ccccc43)ccc21 1544165110 UVTADZRLYIGNLC-JOCHJYFZSA-N 435.568 4.220 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Cl)ccc2O)NC(=O)OC(C)(C)C)cc1 1544269036 OXAZYKSJZIRLEF-SFHVURJKSA-N 433.936 4.107 10 10 IICE CC[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1546696571 DGAFWTCLWUBPEQ-SFHVURJKSA-N 429.584 4.127 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)=C(C)C1 1547311428 XNDRVYZECKSGND-UHFFFAOYSA-N 446.599 4.377 10 10 IICE Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)NCc3cccc(Cl)c3O)cc2)cc1 1558757131 QGLFLMOQVNMUDS-UHFFFAOYSA-N 429.925 4.258 10 10 IICE CC1CCN(c2ccc(CNC(=O)C3(F)CCN(C(=O)OC(C)(C)C)CC3)cc2)CC1 1585544834 LNFMEHKUQUWXPX-UHFFFAOYSA-N 433.568 4.278 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c(C)n1-c1ccccc1 1586651968 NRAXJPFRSZPCKP-JWQCQUIFSA-N 429.564 4.494 10 10 IICE COc1cc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)ccc1OC(F)F 1587293730 JMDHIMQTKBBMQG-UHFFFAOYSA-N 428.435 4.447 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CC(=O)N(c4c(F)cccc4F)C3)c2C)c1 1596481319 BVUUHSQEOZBBQK-LJQANCHMSA-N 437.490 4.350 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3csc(Cc4ccc(F)cc4)n3)C2)cc1 1598364266 OMHWKXKNZMGZTJ-SFHVURJKSA-N 439.556 4.067 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC[C@@H]3CC[C@@]32CNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1612988708 UACIUWCLKFWKLZ-KYJKDSLESA-N 445.516 4.055 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(-c4ccc(Cl)cc4)on3)cc2F)CC1 1616496189 MRYGYHBZXJZKCS-UHFFFAOYSA-N 442.922 4.206 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CCCc1nccs1 1617941122 OQGTWOCADOLBGG-UHFFFAOYSA-N 425.583 4.362 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC1(C)C 1619521819 GBANNSDIAVXUAA-QGZVFWFLSA-N 444.630 4.149 10 10 IICE COC[C@@H]1[C@H]2CCN(c3nnc(CC(C)(C)C)n3CCCSc3nccs3)C[C@H]21 1620116137 HMAWPJFTBHNTPO-GVDBMIGSSA-N 435.663 4.224 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Cl)cc(Cl)c1O 1622634893 LYUANUXDOLZIPY-AWEZNQCLSA-N 429.731 4.452 10 10 IICE CC(=O)Nc1cccc2c1CCCN2C(=O)/C=C/[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1625273201 FQTCZEWBHXRPOE-QFQMRYFISA-N 427.545 4.128 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc3scnc3c2)NC(=O)OC(C)(C)C)cc1 1634163324 XXBPDDUZEHPTAF-LJQANCHMSA-N 440.569 4.358 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1637436620 UIQDLEIQYLBRLE-HXUWFJFHSA-N 431.305 4.459 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@H](CO)Cc3ccc(F)c(F)c3)c2C)c1 1637578153 QMYKPAVYQCPELW-FQEVSTJZSA-N 441.522 4.331 10 10 IICE CCN(CC(=O)Nc1ncc(Cc2ccc(F)cc2)s1)c1ccc(OC)c(OC)c1 1652870980 WOJBFWHXNZNDRJ-UHFFFAOYSA-N 429.517 4.355 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cc(Br)c([N+](=O)[O-])n3)c2C)cc1F 1656234325 HCOJRUBAKYRFDE-UHFFFAOYSA-N 435.253 4.292 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC[C@]3(C)Cc3ccc(F)c(Cl)c3)nc12 1659815827 VVNBNYPUGUNZCG-JOCHJYFZSA-N 446.910 4.001 10 10 IICE CC[C@H](CN(CC)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccccc1 1685244374 PNEAGBFBWDDDRY-OAQYLSRUSA-N 436.600 4.114 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(Cl)cc2c1OCC2 1685382927 DAPJQHKNZDJQCL-MRXNPFEDSA-N 443.975 4.044 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@@H]2Cc2ccccc2F)N(C)C)cc1 1685610234 WLIRGQCSBXOIDI-VWNXMTODSA-N 426.580 4.301 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)C3)n2CCSCCCO)c(C)n1-c1ccccc1 1692985037 LNWMEQXYFWPRBF-SFHVURJKSA-N 439.629 4.314 10 10 IICE CCNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)C1 1695908441 PHSFNVPCAKAWRR-SFHVURJKSA-N 448.615 4.361 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCC(=O)N2)nnc1N(C)[C@@H](C)C1CCCCC1 1707304984 MNRZYXLYWUQLOZ-AVRDEDQJSA-N 438.620 4.057 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCN(C(C)=O)C1 1728384691 BGYCCBUXFUGCIV-JOCHJYFZSA-N 448.615 4.457 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1741461536 HPWUWOZJXMNWKG-JOCHJYFZSA-N 425.621 4.234 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOCC)CCO1 1745331263 INOURTWDTVNNHG-JOCHJYFZSA-N 437.588 4.394 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCCCCC3)n2Cc2ccc(N(C)C)cc2C)n1 1751851523 UOJARIJAVOENFU-UHFFFAOYSA-N 435.620 4.333 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](C(F)F)C2)n1Cc1ccc(N2CCSCC2)cc1 1760920154 TZCFVQOHXPWXMY-GOSISDBHSA-N 435.588 4.485 10 10 IICE CCOC[C@@H]1CCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1766489216 GMGRGVMGTSSXHE-IAGOWNOFSA-N 437.635 4.021 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3ccc(OC(=O)CC(C)(C)C)cc3)CC2)cc1 1874745013 CYGCJTDRYRTDHF-UHFFFAOYSA-N 438.568 4.432 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2cc(I)cc(CN=[N+]=[N-])c2)CC1 1887515493 BQVGQLNXDPQEEY-UHFFFAOYSA-N 443.289 4.159 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010404980 WFFNKBFNXXTYDA-MOPGFXCFSA-N 431.537 4.178 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@]1(C)CNCc1ccc(Br)cc1O 2102784895 FTWMGHBDNXZNRP-QGZVFWFLSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)N1CC(COCc2ccccc2)(C(=O)N2CCC[C@@H](N=[N+]=[N-])CC2)C1 2256735572 NTAXHEZLCXUVJK-LJQANCHMSA-N 443.548 4.132 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2ccc(OCc3cccc(F)c3)c(Br)c2)S1 2293215432 YQZTUCIHFJDMJJ-UHFFFAOYSA-N 449.301 4.274 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cc(Cl)ccc2O)SC1=S)Nc1nccs1 2314831495 MIKFTJXAMPUBCA-UHFFFAOYSA-N 439.971 4.122 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380794305 ZFMJLHYYNNKIBM-OAHLLOKOSA-N 441.366 4.115 10 10 IICE O=C(O)/C=C/c1ccc(N2CCCN(Cc3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1 13272672 QBKLSXKTUJOTHF-WEVVVXLNSA-N 449.429 4.424 10 10 IICE C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CN(C)Cc1ccc(N3CCCCC3)cc1)C2=O 16878176 POEBNCPYPVYAQB-UQBPGWFLSA-N 426.605 4.203 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(CC(C)C)C2=O)c(C)n1-c1ccc(OC(F)F)cc1 57496665 JFPFZQGARSUUQX-HSZRJFAPSA-N 447.482 4.235 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)NCc4cccc(Cl)c4)cs3)CC2)cc1 65211529 RIIUZCCLHQSYPP-UHFFFAOYSA-N 442.972 4.062 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccccc1OC 100275442 AYEIATJMMLLNPG-GZTJUZNOSA-N 428.282 4.335 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 705620102 NRPWCQFWSGDKJW-BGYRXZFFSA-N 426.402 4.269 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1ccc(N3CCCC3)cc1)O[C@H](C)C2 730823757 OVMWXJHUOWXADB-FHZYATBESA-N 435.568 4.364 10 10 IICE CCOC(=O)c1sc([C@H](C)NC(=O)N(Cc2ccco2)Cc2ccccc2O)nc1C 757274345 VNGKPMCUQFMVQI-HNNXBMFYSA-N 443.525 4.400 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@H]2[C@@H]2CNC(=O)C2)c(C)n1-c1cccc(C(F)(F)F)c1 764462149 JYVDRRNDXAZNAA-UWJYYQICSA-N 447.501 4.286 10 10 IICE Cc1cc(C(=O)CN2CCCC[C@@H]2[C@@H]2CNC(=O)C2)c(C)n1-c1ccc(F)c(Cl)c1 764465943 NELXJHDNGDUPMS-HRAATJIYSA-N 431.939 4.060 10 10 IICE CC[C@@H](C)n1ncc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C1CC1 768914947 KYXVCLWZRZWTGT-LJQANCHMSA-N 435.616 4.194 10 10 IICE Cc1cc(Cl)cc(CN2CCC(C(=O)Nc3ccc(Br)cn3)CC2)c1O 775653807 BWEAJGSWGBOLML-UHFFFAOYSA-N 438.753 4.362 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(OC)c(C(C)C)c(OC)c3)CC2)cc1F 779141513 KARZCPOFEOMDEA-UHFFFAOYSA-N 431.508 4.329 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1 789918320 ZPTOQECNBLLRFX-SFHVURJKSA-N 439.581 4.101 10 10 IICE COc1ccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(Br)c1 796343361 AQNNRBFMTOOOEK-UHFFFAOYSA-N 444.417 4.280 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1coc(-c2ccc(Br)cc2F)n1 808094795 DTAPYAUNCWDFMV-UHFFFAOYSA-N 440.265 4.365 10 10 IICE C[C@H]1CN(c2ccc(CNc3ccc(/C=C/C(=O)O)cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 917087268 VQFJIPVFOLUFRX-CZXPBSPDSA-N 429.448 4.057 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(-c4ccccc4)c3C(F)(F)F)C2)cc1 1130185595 MLZHXSFVMNOARY-MRXNPFEDSA-N 444.457 4.156 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl 1149879931 BIIPSCMXBNDUCJ-UHFFFAOYSA-N 438.977 4.129 10 10 IICE Cc1cc(C(=O)Nc2cc([C@H]3CCCO3)nn2C)c(C)n1-c1ccc(Br)cn1 1156880388 IUSRERFNVATZKM-QGZVFWFLSA-N 444.333 4.089 10 10 IICE O=C(NCc1c(O)cccc1O)[C@@H](Oc1ccc(Br)cc1)c1ccccc1 1156881151 RJVGNBMIBRZJLT-FQEVSTJZSA-N 428.282 4.297 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCCC1(O)CCN(Cc2ccccc2)CC1 1246474938 IMPCFCRXAXCYGX-UHFFFAOYSA-N 439.600 4.121 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(c3cccc(F)c3F)CC2)N(C)C)cc1 1251500102 CJRGBVJVNPYCOS-QFIPXVFZSA-N 430.543 4.223 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc(-c3ccc(F)cc3)n(C)n2)cc1 1265002071 RZBWEBQETZHKJX-UHFFFAOYSA-N 434.437 4.497 10 10 IICE Cc1cc(CNC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)c(C)n1-c1ccccc1 1287661989 VZJPORGPKAWPPZ-UHFFFAOYSA-N 439.581 4.053 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2ncc(Br)cc2O)cc1 1290758338 YYZVLMCNZDETAL-UHFFFAOYSA-N 430.302 4.051 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)NCc3ccc(N4CCCC4)cc3)CCCC[C@H]12 1290777420 HQAWMSHSBKGLKM-SQJMNOBHSA-N 427.589 4.473 10 10 IICE Cc1cc(C)n(-c2ccc(CNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cn2)n1 1291658725 KUMMAWCXQPORQP-UHFFFAOYSA-N 427.508 4.034 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)c1 1292216315 GJTAWFCTKZONFE-UHFFFAOYSA-N 432.520 4.385 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cnn(-c2ccc(Br)cc2)c1 1294869881 PARRIUWSEMQAAR-UHFFFAOYSA-N 426.314 4.149 10 10 IICE CC(C)(C)c1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1302050364 FLCPSTHZPGXOHE-FQEVSTJZSA-N 425.621 4.333 10 10 IICE CC1(C)CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1303976882 SKIPMKZOXAEELA-HNNXBMFYSA-N 439.676 4.490 10 10 IICE Cc1ccccc1C(F)(F)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1354330223 ZYMWVIRIHKKSLK-UHFFFAOYSA-N 428.401 4.259 10 10 IICE CSc1cc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)ccc1Br 1356167017 XZXAFGWIPUFMOB-CQSZACIVSA-N 435.387 4.499 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(Oc4ccccc4OC)cn3)CC2)cc1 1358141210 UFUVGVSAOBJRGX-UHFFFAOYSA-N 433.508 4.244 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccccc4)cn3)cc2F)CC1 1359920292 PCLAAJLAXDPYLF-UHFFFAOYSA-N 434.515 4.085 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1442247082 JBMVLLRAPHFFPB-QHCPKHFHSA-N 432.520 4.119 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3csc(Br)c3C)cc2F)CC1 1456126764 GFZOXKSDJNVOQV-UHFFFAOYSA-N 440.382 4.030 10 10 IICE CN1CCCc2cc(CNC(=O)C[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1464522234 UPSPWWQVWFLVSA-JOCHJYFZSA-N 437.584 4.211 10 10 IICE Cc1cc(C(=O)NCCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccc(Cl)cc1 1467838173 BBODBVYJMJZOLF-UHFFFAOYSA-N 435.911 4.164 10 10 IICE COc1cc(C(N)=O)ccc1NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1468950537 MQGDJLJOYZQEKF-UHFFFAOYSA-N 442.313 4.216 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CN(c2ccc(Cl)cc2)CCO1 1470810543 PALQMXJRMMZHMJ-QHCPKHFHSA-N 445.007 4.231 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](CC)OC)CCO1 1497190263 GDYANROOUZSDIN-YADHBBJMSA-N 437.588 4.393 10 10 IICE CO[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CC[C@@H]1C 1504516095 JVUSXABLCNMXNI-MBSDFSHPSA-N 425.621 4.295 10 10 IICE Cc1csc([C@@H](C)Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)n1 1511449033 RZDREABGJFVFCL-KXBFYZLASA-N 427.574 4.430 10 10 IICE Cc1csc([C@H](C)CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1521500935 IUENIMNCCSGLMQ-GFQQVXNGSA-N 449.598 4.102 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F 1525762881 UXEZBRBUWDMJTF-CQSZACIVSA-N 449.452 4.161 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 1528924704 QNFSTZUMWJWMDH-XXBNENTESA-N 439.600 4.417 10 10 IICE Cc1ccc(N2C[C@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1F 1530890558 WOQOSDLLDQSGKZ-OAQYLSRUSA-N 433.527 4.253 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2)cc1 1538159691 CBAIZZQSNHPJQA-UHFFFAOYSA-N 445.563 4.142 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)c1 1540326542 PINLKFHBZZRPOW-UHFFFAOYSA-N 448.498 4.036 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1c2ccccc2C(=O)OC1(C)C 1545509055 XYDVKELRRXXUTI-GOSISDBHSA-N 432.314 4.236 10 10 IICE Cc1cc(C(=O)N[C@@H](CCO)c2cccs2)c(C)n1-c1ccc(Br)cn1 1545748224 WQKSHHQMOGKREU-INIZCTEOSA-N 434.359 4.167 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCO[C@@H](CNC(=O)OC(C)(C)C)C2)c1 1567734390 QCICREDDXOEOJH-SFHVURJKSA-N 447.963 4.113 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)c1 1583893558 JOSNVZMIEGWPSX-UHFFFAOYSA-N 432.524 4.124 10 10 IICE CC(C)c1nnc(N2CCS[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1602926579 JFDQANLMZDXDNJ-OAQYLSRUSA-N 447.624 4.003 10 10 IICE C/C=C\C[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C(=O)OCC 1611354224 RTJIPZDOJRHWGJ-YEODSOHDSA-N 433.346 4.484 10 10 IICE CCC1(CC)CN(c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1613726992 KWZPMRQXKRWOPZ-UHFFFAOYSA-N 443.661 4.398 10 10 IICE CC[C@@H]1CCN(c2nnc(Cc3csc(C)n3)n2Cc2ccc(N(C)C)c(F)c2)C1 1614190899 CPTPCISBZWAGHO-MRXNPFEDSA-N 428.581 4.124 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2nc3cc(Cl)ccc3s2)N(C)C)cc1 1618635987 RCUHVTBAFARATO-IBGZPJMESA-N 431.005 4.367 10 10 IICE CCN(CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1)Cc1ccccc1Cl 1626107604 ZNHXBZURHTXRBL-HSZRJFAPSA-N 444.019 4.436 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)cc4c3OCCO4)cc2)CC1 1627467407 HIKFJCNFSGLIIA-UHFFFAOYSA-N 445.357 4.387 10 10 IICE O=C(c1cc(Br)cc2c1OCCO2)N(Cc1ccco1)Cc1ccccc1O 1629943822 QKOZZLMXIOPHRE-UHFFFAOYSA-N 444.281 4.362 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)cc1 1630324331 UIDVYMHZRFJCAJ-HXUWFJFHSA-N 448.542 4.018 10 10 IICE Cc1cc(I)cc(C(=O)NCc2c(O)ccc3c2CCCC3)c1C 1631438329 BXUHEEVPIHVUBH-UHFFFAOYSA-N 435.305 4.422 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(-c2ccc(Br)cc2)[nH]n1 1631439199 YCVOHJQQHUPOFG-UHFFFAOYSA-N 426.314 4.354 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](C)N3CCC(Cc4ccccc4)CC3)CC2)cc1 1632154447 UZDOMEAULYJDJB-JOCHJYFZSA-N 435.612 4.077 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3CCN([C@@H]4CCSC4)CC3)cc2Cl)C1 1634023199 WWPITSXIQQNQBT-FXAWDEMLSA-N 436.065 4.410 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C\C=C(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1634161694 BYOCUCPTWOQZGU-QKIRZYONSA-N 428.360 4.310 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CC1 1638273344 WFKWVJRKCFTLJI-KRWDZBQOSA-N 435.528 4.372 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC[C@@]2(C)C(=O)OC(C)(C)C)C1 1640978969 OHZSFKAVUBHXAH-SANMLTNESA-N 439.600 4.131 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cccc4c3CCN4C(=O)OC(C)(C)C)C2)cc1 1645242929 VUVYVJREDIAFEP-QGZVFWFLSA-N 437.540 4.002 10 10 IICE COC[C@@H]1CC[C@@H]([C@@H]2COCCN2C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)O1 1646250557 JEYOHJCFTQHILQ-HVCNVCAESA-N 440.584 4.253 10 10 IICE COc1ccccc1Nc1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1646431225 JKSLBVQNXAKHNK-UHFFFAOYSA-N 431.536 4.330 10 10 IICE CC(C)N(CCc1ccccc1)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1653228515 IKDHNUIJVYOBKV-UHFFFAOYSA-N 426.516 4.354 10 10 IICE Brc1cc(CNC2(c3ncccn3)CCOCC2)ccc1N1CCCCC1 1658657939 ICPSSDBOKGIEJZ-UHFFFAOYSA-N 431.378 4.025 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3c(F)cccc3F)cc2Cl)C1 1686268964 JBEYGSJAFUSBGE-IFXJQAMLSA-N 437.918 4.387 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1692278321 VDKKKMNLIQTTCL-MRXNPFEDSA-N 431.635 4.190 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1695093708 USJMDHXOACSIAW-SIKLNZKXSA-N 438.620 4.139 10 10 IICE Cc1ncc(CN(C)c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)s1 1725565392 HVQCPPGAACYCFU-UHFFFAOYSA-N 433.585 4.164 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](Cc3cnn(C)c3)C2)n1CCCSc1nccs1 1726933162 SUBJWLRMCGDJFL-IRXDYDNUSA-N 445.662 4.233 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1Cc1ccc(OCC(F)(F)F)nc1 1729420056 FJDMNPJOINKXCX-UHFFFAOYSA-N 447.461 4.272 10 10 IICE Cc1cc(-c2nnc(N(CC(C)C)C(C)C)n2Cc2nncn2C)c(C)n1-c1ccccc1 1751408660 MCTWSWIFYMFGEE-UHFFFAOYSA-N 446.603 4.400 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C[C@@H](C)S1 1752359709 MUDPJOZFERYJAQ-RTBURBONSA-N 443.661 4.082 10 10 IICE CC[C@@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)C1 1762447723 KPNXUEPBPNTIDY-SANMLTNESA-N 448.615 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC(c3nc(C)no3)CC2)cc1 1764931436 SDZBRNZSGUIKRN-UHFFFAOYSA-N 437.592 4.371 10 10 IICE CN(C)c1ccc(-c2nc3cc(C(=O)N4CCN(c5ccccc5)CC4)ccc3[nH]2)cc1 1873506013 QNYMOKJSAYOSRH-UHFFFAOYSA-N 425.536 4.258 10 10 IICE Cc1c(C(C)C)nn(Cc2c(O)cccc2Br)c1I 2079775458 AXGWZUBRDSJSQX-UHFFFAOYSA-N 435.103 4.436 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CNCc2cccc(Br)c2O)CC12CCC2 2116697737 DKWMFZGBSMRIQG-CQSZACIVSA-N 425.367 4.424 10 10 IICE CCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1Br 2294095121 KGRAYCXMFLDDKM-UHFFFAOYSA-N 449.688 4.168 10 10 IICE O=C(CN1C(=O)C(=Cc2cccc(Br)c2)SC1=S)Nc1ccccc1 2295914104 SBNABCSNAPGHAH-UHFFFAOYSA-N 433.352 4.289 10 10 IICE Cc1ccc(CNC(=O)C[C@H](C)C(C)(C)NC(=O)OC(C)(C)C)c(O)c1Br 2381138634 XELMBPFLFDGQIN-ZDUSSCGKSA-N 443.382 4.409 10 10 IICE COc1ccc(CCN2C(=O)c3ccccc3[C@H](C(=O)O)[C@@H]2c2ccccc2O)cc1OC 20583470 FJWBMPGQFPUEPT-ZEQRLZLVSA-N 447.487 4.017 10 10 IICE CC(C)CNc1nc2ccccn2c(=O)c1/C=C1/SC(=S)N(C2CCCCC2)C1=O 33351657 YOXVMOHBPFFLIB-SFQUDFHCSA-N 442.610 4.296 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C/c1ccccc1OCc1ccccc1 33923069 GHEWFEXLRFYMMF-ODAUKNCYSA-N 433.504 4.117 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 226802573 WQXCMCBHUSCVAL-XQBPLPMBSA-N 427.526 4.452 10 10 IICE O=C([C@H]1CCn2c(cnc2C2CCCCC2)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 777808467 BMXMLTWKWVLRSD-REWPJTCUSA-N 437.584 4.407 10 10 IICE Cc1cc(Br)c(O)c(CN[C@](C)(CO)c2ccc(Br)cc2)c1 796471418 QCUQLHFVZQMJPE-QGZVFWFLSA-N 429.152 4.223 10 10 IICE C[C@@H]1CN(c2ccc(NC(=O)NCc3cc(Br)ccc3O)cc2)C[C@@H](C)O1 806246207 SZDQDYLNMFANKD-ZIAGYGMSSA-N 434.334 4.090 10 10 IICE Cc1cc(C)n([C@@H](C)CC(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)n1 919312507 ZCJCEKPRGZHVSS-KRWDZBQOSA-N 437.496 4.013 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC([C@@H]3C(=O)Nc4ccccc43)CC2)c1O 1115955736 LJGGRAJQSBZNSU-QHCPKHFHSA-N 430.504 4.280 10 10 IICE CC1(C)OC(=O)c2ccccc2[C@H]1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1125877276 DHUPGCDWLYUYIZ-FQEVSTJZSA-N 444.478 4.106 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C 1129820247 SEUCWJZAZJRXSP-XXBNENTESA-N 439.600 4.449 10 10 IICE CC(C)C[C@H](CNC(=O)OC(C)(C)C)CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1135733100 UFFSLEGYXVXQCH-NRFANRHFSA-N 447.620 4.059 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1294457529 NGEDNRLDWXPLPZ-TZIWHRDSSA-N 426.653 4.382 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1 1296626675 XVPJTGRWMYRGMB-SFTDATJTSA-N 439.556 4.472 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)[C@@H](C)C1)OC 1315795320 JVXPZIYXMWKMDO-SPEDKVCISA-N 437.588 4.106 10 10 IICE CC(C)(C)c1cc(CNCc2cccc([C@@]3(C)NC(=O)NC3=O)c2)c(O)c(C(C)(C)C)c1 1318366573 BHVJIUQQDNGYNW-AREMUKBSSA-N 437.584 4.332 10 10 IICE CC1CCN([C@@H](CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)C(C)C)CC1 1350326743 JUXYHGCYRKVCAE-SANMLTNESA-N 438.660 4.281 10 10 IICE Cc1sc(NC(=O)c2nnn(C(C)(C)C)n2)c(C(=O)OC(C)C)c1-c1ccccc1 1358008595 CYOGUDQKXVTELK-UHFFFAOYSA-N 427.530 4.283 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](O)c1cc(Cl)cc(Cl)c1 1445879116 DBMJNLBUKQYHSD-PKOBYXMFSA-N 443.758 4.167 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](N(C)CCc4ccccc4)C3)ccc21 1452973778 PASYBSCXULNSHJ-XMMPIXPASA-N 433.596 4.294 10 10 IICE COC(=O)c1cc(OCCOc2ccc(Cl)cc2Br)ccc1N(C)C 1459244786 ZFZNCNRYSYQOGH-UHFFFAOYSA-N 428.710 4.413 10 10 IICE Cc1ccc(C(=O)N2CCN([C@H](C)c3cccnc3)CC2)cc1-n1c(C)cc(C=O)c1C 1465311081 FSFXOVOHKGBOSC-HXUWFJFHSA-N 430.552 4.129 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COc3cc4c(cc3[N+](=O)[O-])OCCO4)c2C)cc1F 1473097518 HZKMIGAFIXGYHK-UHFFFAOYSA-N 440.427 4.483 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(Cc1ccccc1Cl)CC1CC1 1479030572 LKUHJUBGUBEHRK-UHFFFAOYSA-N 427.976 4.423 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCNC(=O)NCc1cccc(Cl)c1O)Cc1ccccc1 1479119588 GKARCMZNIFICKL-GOSISDBHSA-N 447.963 4.371 10 10 IICE Cn1cc(Nc2nnc([C@@H]3CCO[C@H]3C(C)(C)C)n2CCCSc2nccs2)cn1 1517386125 HMANVQSIOBVMAJ-HZPDHXFCSA-N 447.634 4.313 10 10 IICE CS[C@H]1CCCCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1519292106 PALUHHQUOGJFMD-WLSWZUKCSA-N 438.615 4.161 10 10 IICE CC(C)n1nc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)c2ccccc2c1=O 1520970098 RTDVOGZMINIXCD-UHFFFAOYSA-N 446.473 4.248 10 10 IICE CC(=O)[C@H]1CC(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)=NN1c1ccccc1 1526364356 XQEFJXTWHSVJKE-RUZDIDTESA-N 444.535 4.098 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1(c2cccc(F)c2)CC1 1538706065 YGCUDOLHLQLZQF-PDGQHHTCSA-N 444.528 4.362 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CC[C@H]1c1ccccc1 1540812607 NOWWZBVWZGFMPV-OGBKAESYSA-N 426.538 4.391 10 10 IICE CC(C)CCSc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-] 1543809209 GXJRTMSDCDHRQR-UHFFFAOYSA-N 443.569 4.500 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1545642530 OROQSXXPDDOLIV-SFHVURJKSA-N 446.603 4.402 10 10 IICE Cc1cc(C(=O)N2C[C@H](O)Cc3ccccc32)c(C)n1-c1cccc(Br)c1 1556414310 LVKJLBMOCULPOK-LJQANCHMSA-N 425.326 4.420 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc([C@]3(C)NC(=O)N(C)C3=O)cc2)c1 1557234241 HBEDLODDEBHMHC-VWLOTQADSA-N 430.508 4.052 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](O)c2cccc(Br)c2)c1 1568059961 ZUTWOLNNXDTVCP-NRFANRHFSA-N 441.325 4.133 10 10 IICE Cc1ccc(C(=O)N(C)[C@@H](c2ccccc2)c2nc[nH]n2)cc1-n1c(C)cc(C=O)c1C 1570180553 PCBNBYQBNSWKSQ-QHCPKHFHSA-N 427.508 4.195 10 10 IICE Cc1nc(-c2cccs2)ccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1583379528 VOTDWFINBAFJBX-UHFFFAOYSA-N 429.492 4.163 10 10 IICE CC[C@H](C)[C@@H](C(=O)NCc1cc(C)n(-c2ccccc2)c1C)N1C(=O)c2ccccc2C1=O 1587885926 GQNFDEUFCOOZNZ-XDHUDOTRSA-N 443.547 4.421 10 10 IICE CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1598277623 UFZGYNHLCDDRLH-HXUWFJFHSA-N 433.518 4.342 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1611933564 IEYZOZVHQMTJNM-UHFFFAOYSA-N 436.604 4.360 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccc(OC)c(O)c1 1616862184 XBLWJQCNWOHQJH-NRFANRHFSA-N 442.899 4.106 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCc2ccc(Br)cc2)N(C)C)cc1 1618643942 QIWLMMNHJUGBOS-NRFANRHFSA-N 432.406 4.257 10 10 IICE CCOc1ccc(N(Cc2cc(OCC)n3nc(C(F)(F)F)nc3n2)CC2CC2)cc1 1620499012 AXGFYJORQPFRSQ-UHFFFAOYSA-N 435.450 4.357 10 10 IICE Cc1nc2ccc(O)cc2cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634630 DNLRBEHWTBPFLQ-SFHVURJKSA-N 425.916 4.002 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc2c(n1)CCCC2 1625502956 MBQALOVDDUAZKP-AQTBWJFISA-N 441.553 4.330 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccnn2CCc2ccccc2)cc1 1627204898 HZFLCEODCZBYQY-DEOSSOPVSA-N 432.568 4.013 10 10 IICE CCC(CC)(CC(=O)OC)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1628952302 TZVJFTWRUOEUCO-UHFFFAOYSA-N 436.350 4.103 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(OC)cc1 1636364254 KMDHIFHEONUWLZ-NRFANRHFSA-N 426.900 4.400 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCOc2ccc(F)c(Cl)c2)cc1 1637031872 XIVUVUUARJBDMM-UHFFFAOYSA-N 428.891 4.437 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccccc1O 1643741791 AHWOLHJUAUVNJE-LLGFUMIMSA-N 428.529 4.068 10 10 IICE Cc1cc(CN2CCC[C@@H](S(=O)(=O)Nc3ccccc3)C2)ccc1N1CCCCC1 1647757206 JHZWZDFIFQPHMU-HSZRJFAPSA-N 427.614 4.392 10 10 IICE COc1ccc(N2CCN(CCCNc3nc4cc(Br)ccc4o3)CC2)cc1 1651323818 OGHHIPIXLMETTG-UHFFFAOYSA-N 445.361 4.223 10 10 IICE COCc1cccc(OCC2(CN3CCN(c4ccc(OC)c(F)c4)CC3)CCC2)c1 1657763923 XIEUHQFMULHYDK-UHFFFAOYSA-N 428.548 4.352 10 10 IICE Brc1cc(CNc2ccc(CN3CCOCC3)cn2)ccc1N1CCCCC1 1662102674 VOENSPJYEFBVCB-UHFFFAOYSA-N 445.405 4.279 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCO[C@H](c2ccc(OC(F)F)cc2)C1 1673744943 PXLMMLUAIKODQS-VGSWGCGISA-N 447.526 4.377 10 10 IICE O=C(NCc1cc(F)c(F)cc1Br)NCc1c(O)ccc2c1CCCC2 1682173043 BFOCHOKFVOQMOL-UHFFFAOYSA-N 425.273 4.311 10 10 IICE CC(C)CN1CCN(c2nnc(CC(C)(C)C)n2CCCSc2nccs2)CC1 1692430308 KISPKNAGNLVSJR-UHFFFAOYSA-N 436.695 4.284 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CC(C)(C)OC(C)(C)C2)cc1 1710026545 KRIJUPCJIXEGGT-HXUWFJFHSA-N 441.620 4.070 10 10 IICE COCCCCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1712364109 ZFIRSGMFZBPCDU-TZIWHRDSSA-N 430.593 4.355 10 10 IICE C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]1C 1726599880 YSSAYVDGYXYCLY-RBUKOAKNSA-N 425.621 4.067 10 10 IICE CCc1nnc(N2CCC[C@H](n3nc(C)cc3C)C2)n1Cc1ccc(N(CC)CC)cc1 1727582983 IVEYNZFSRNJEOR-QHCPKHFHSA-N 435.620 4.390 10 10 IICE Cc1cccc(CN(C)c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)c1 1742124429 BPHWFDKOZFQREZ-GOSISDBHSA-N 429.615 4.366 10 10 IICE Cc1noc(C)c1CN(C)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1751954769 VJRKUCFCNZUBHV-UHFFFAOYSA-N 441.586 4.220 10 10 IICE CC[C@@H](C)c1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763821489 PMXRJSLFIACFOZ-QGZVFWFLSA-N 447.624 4.147 10 10 IICE CCC[C@@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1763972820 ULZSCZOAXJOOAJ-XMMPIXPASA-N 448.615 4.164 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC([C@@](C)(O)C(F)(F)F)CC2)cc1 1766609241 XKDLLKNXQFAVFI-OAQYLSRUSA-N 439.526 4.011 10 10 IICE CCOC[C@@H]1CCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768037471 HETLWRUCRGLDDN-LJQANCHMSA-N 443.592 4.047 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1C[C@@H]1N(C)CCCC1(C)C 1768684662 XDWDMYWBRDZTAH-QFIPXVFZSA-N 425.621 4.473 10 10 IICE COCCN(c1nnc(C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@H](C)C1 1769799916 FYSXKXOIXPIPBC-HKUYNNGSSA-N 431.600 4.470 10 10 IICE Cc1ccc2c(=O)c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c2c1C 1866076197 PWNMDFRPERAVEG-DEOSSOPVSA-N 446.595 4.168 10 10 IICE CCCc1cc(-c2nc(C)c(C(=O)N3CCN(c4ccc(OC)cc4)CC3)s2)ccn1 1873831735 GEZPQPIKIAQFCK-UHFFFAOYSA-N 436.581 4.437 10 10 IICE CCCCN1C(=O)C(=C2SC(=S)N(CC)C2=O)c2cc(Br)ccc21 2296713479 DOJUGMZFPZXFGT-UHFFFAOYSA-N 425.373 4.187 10 10 IICE CCCCN1CCc2cc(C=C3C(=O)NC(=S)N(CCC4=CCCCC4)C3=O)ccc21 2296930527 OKXKFIJTXJFYCR-UHFFFAOYSA-N 437.609 4.366 10 10 IICE CCOC(=O)COc1ccccc1C=C1SC(=S)N(CCCc2ccccc2)C1=O 2297361884 DNBRADFYALKYBG-UHFFFAOYSA-N 441.574 4.463 10 10 IICE COc1cc(C=C2SC(=S)N(C[C@H](c3ccccc3)N3CCCC3)C2=O)ccc1O 2323882335 PTYNZGFWFKDUFX-GOSISDBHSA-N 440.590 4.439 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cccc(Br)c2O)C[C@H]2CCC[C@@H]21 2335123905 BPLXWEGFQABZPZ-KMFMINBZSA-N 425.367 4.422 10 10 IICE Cc1ccc(CN[C@@]23CCC[C@@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352690515 BVMQWDWMOGZUGG-FOIQADDNSA-N 425.367 4.342 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)c(F)c4)c3C)C2=O)cc1 8644078 IADIMHFTTVRDFI-AREMUKBSSA-N 447.510 4.500 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC=C[C@@H]21 20704703 AVPLTBQWZCPHJR-QEEYODRMSA-N 427.888 4.451 10 10 IICE COC(=O)c1ccccc1N1C(=O)/C(=C/C=C/c2ccccc2[N+](=O)[O-])SC1=S 39861681 NFDLTKWKBVXEFR-LSLGJYKGSA-N 426.475 4.343 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2ccc(Cl)cc2)cs1 727246659 NYUSDCTVFYSNLQ-UHFFFAOYSA-N 426.903 4.261 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 743675480 UWEIGORTNCGULY-OAQYLSRUSA-N 426.561 4.126 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ncccn1 753779524 LHMJGJMKXOWSGA-QTJGBDASSA-N 433.600 4.263 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC(CC(F)(F)F)C1 760070545 GFIRTQBGASQZJK-NTUHNPAUSA-N 434.530 4.140 10 10 IICE CCOC(=O)c1csc([C@@H]2CCCN2Cc2cc(C)cc(Br)c2O)n1 792195663 DFKGCFKVJKJEOY-HNNXBMFYSA-N 425.348 4.433 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 804734516 OYIXOCGBEGEHEY-ZIAGYGMSSA-N 430.220 4.473 10 10 IICE COc1ccccc1[C@H](CNC(=O)NCc1cc(Br)ccc1O)OC(C)C 805298957 WZWFBNUMUGMQCZ-IBGZPJMESA-N 437.334 4.129 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1c(F)ccc(S(=O)(=O)CC2CC2)c1F 1124623315 RHLBAGBOOFIQDR-UHFFFAOYSA-N 448.535 4.021 10 10 IICE COc1ccc(/C(C)=C/C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 1136284972 KUZWSMNXJSTBDE-DTQAZKPQSA-N 434.458 4.270 10 10 IICE COCCOc1ccccc1N1CCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1137274679 CFUBOZOIMATDQT-UHFFFAOYSA-N 447.579 4.011 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)cc1 1195791184 YOWKVAARBMIDOW-HSZRJFAPSA-N 429.580 4.496 10 10 IICE COc1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)c2ccccc2O)cc1 1197004888 WFZLKVZRNOEHTK-MHECFPHRSA-N 429.520 4.429 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H]2CC(c3ccc(OC)c(C)c3)=NO2)cc1 1227024540 CFFJUBTXNFHLSX-QFIPXVFZSA-N 438.572 4.184 10 10 IICE Cc1ccccc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCC[C@H](C)C1 1293237404 XJYMBZXNQPJHCV-GIMINZRKSA-N 430.570 4.370 10 10 IICE Cc1cc(C(=O)N2CC3(CCCC3)OC[C@@H]2CN(C)C)c(C)n1-c1cccc(Cl)c1 1301430837 GAZVPUYABSJRHJ-NRFANRHFSA-N 429.992 4.463 10 10 IICE CC(C)c1nnc(N2CCC(OC(C)(C)C)CC2)n1Cc1ccc(N2CCOCC2)cc1 1302638343 DLTGKSGJAWTWEF-UHFFFAOYSA-N 441.620 4.070 10 10 IICE CN1C(=O)CC[C@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(C(F)(F)F)cc1 1305085103 QOHPMZSNDLVJGU-MAUKXSAKSA-N 440.849 4.290 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1ccc(OCC(F)(F)F)nc1 1314750932 NXUOKGXIVRJNAX-UHFFFAOYSA-N 449.477 4.302 10 10 IICE CC(C)Oc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1[N+](=O)[O-] 1350934112 YHZUMKRBDCAMGF-HOTGVXAUSA-N 445.491 4.065 10 10 IICE COc1cc(OC)cc(N2CC[C@H](NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)c1 1354976997 HKPGMYNMWKRATG-NRFANRHFSA-N 433.552 4.049 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)Cc3csc4cc(C)sc34)CC2)cc1 1356063792 CSGPYSJWRXPJSJ-UHFFFAOYSA-N 443.638 4.151 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1359830030 CDNXSEOIBFJAAE-LJQANCHMSA-N 429.584 4.127 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](c2c(C)nn(C)c2C)C(F)(F)F)CCCC1 1435380463 JXAZVTLHECVLNG-QFIPXVFZSA-N 448.489 4.299 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@H](c2ccccc2Br)C1 1442669781 SFRJQXJVYVRHIE-MRXNPFEDSA-N 434.311 4.289 10 10 IICE CC(C)(C)c1ccc(C[C@@]2(C)CCCN2C(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 1469900439 JZNXUOVXYFDICQ-XMMPIXPASA-N 444.597 4.299 10 10 IICE CCOC(=O)[C@H](C[C@H]1CCCO1)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1471779849 AGSSVVASAWFBDB-GGAORHGYSA-N 426.557 4.448 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)CC(F)(F)F)cc1 1501841189 ZOBHGSZAJQFOSA-KRWDZBQOSA-N 425.499 4.065 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@H]1CC[C@@H](F)C1 1503474032 VJUAVGHNVHNXCX-NHCUHLMSSA-N 443.611 4.478 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1509160084 LWEMCVZLJFFUHB-FQEVSTJZSA-N 443.611 4.373 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)cc1C 1519257871 YHSYCVRVJYYMSF-IBGZPJMESA-N 429.609 4.194 10 10 IICE COCc1cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc(C(=O)OC)c1 1523454739 XDQFMQCKPIFYMZ-UHFFFAOYSA-N 436.508 4.100 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)CC(=O)N(C)[C@H](C)c2ccccc2)CCCC1 1523800498 SKXGAPKAGBNBOG-LJQANCHMSA-N 447.579 4.207 10 10 IICE CC(C)(C)OC(=O)[C@@]1(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC1(C)C 1524065976 BEYQQQDSLCVPLV-WNSKOXEYSA-N 438.515 4.131 10 10 IICE C[C@@H](C1CC1)n1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1524167096 FBVABDMZVVKNQE-VQIMKDEXSA-N 444.557 4.223 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1OC1CCCCC1 1527864662 TZDGGEUHWMGCMN-UHFFFAOYSA-N 430.495 4.443 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(C(F)(F)F)c(F)c1 1535561985 WJUANTVGPMWASD-UHFFFAOYSA-N 435.465 4.307 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)N(C)C)cc1 1537483861 RHOAMBHIAPULKL-OAQYLSRUSA-N 426.948 4.023 10 10 IICE CCN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)[C@H](C)C(F)(F)F 1538872023 IXQKIBFSYVYYSV-UXEDPAHQSA-N 434.480 4.216 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1542490029 AVLQDIKLGKQFNU-VQTJNVASSA-N 430.980 4.199 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C[C@@H]2CCc3sccc3C2=O)cc1 1583919322 NXBKDPXDKGEUKR-AZUAARDMSA-N 426.582 4.157 10 10 IICE Cc1nc2ccc(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)cc2[nH]1 1595320916 IAUJIEAYDUXRMS-ZDLGFXPLSA-N 440.525 4.240 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)[C@H](C)c2ccco2)cc1 1615376087 QCRIMTFOQUWBGO-GOSISDBHSA-N 438.576 4.101 10 10 IICE Cc1ccc(C(=O)NC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)cc1-n1c(C)cc(C=O)c1C 1616470641 HECNHPHMBCVYIN-DENIHFKCSA-N 436.474 4.428 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(CCN3[C@H](C)CC[C@H]3C)CC2)c1 1627721676 HTQGSHZNCQCPLL-RTBURBONSA-N 443.035 4.378 10 10 IICE Cc1cc(CC(=O)NCCCc2cc(N)n(-c3ccccc3)n2)c(C)n1-c1ccccc1 1628429501 NDTZHPZFXGQXRF-UHFFFAOYSA-N 427.552 4.154 10 10 IICE CCc1ccccc1[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1629144376 DURJRSHIEGZYBL-BPOBUFBUSA-N 426.513 4.056 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1633079746 NEKUPXOESPZIFI-UHFFFAOYSA-N 447.516 4.057 10 10 IICE Cc1cc(CC(=O)NC[C@H](CO)Cc2ccncc2Cl)c(C)n1-c1ccc(Cl)cc1 1635602719 XMTJHGUBLJBMST-QGZVFWFLSA-N 446.378 4.306 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCOc1ccc(Cl)c(Cl)c1 1643242347 LNFRZACLNUQNNZ-UHFFFAOYSA-N 426.296 4.060 10 10 IICE COc1ccc(C)cc1[C@@]1(C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1=O 1652723650 NLBXKAIHIAQXIP-AREMUKBSSA-N 445.519 4.061 10 10 IICE Cc1cc(C(=O)NCc2ccc(CCO)cc2)c(C)n1-c1cccc(Br)c1 1653427991 OSBWMHSNFRWOGS-UHFFFAOYSA-N 427.342 4.321 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2C2(O)CC2)sc(C)c1-c1ccccc1 1653822814 IIMHHXVGJKUJFB-GOSISDBHSA-N 442.581 4.218 10 10 IICE C[C@@H](S[C@H](C)C(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1656495335 HJHOWUZCHUWIOH-ZIAGYGMSSA-N 439.533 4.252 10 10 IICE COC(=O)c1cnc(SC[C@H](CNC(=O)OC(C)(C)C)c2ccc(F)cc2)s1 1656580922 QUBDICTUPCTTSC-ZDUSSCGKSA-N 426.535 4.469 10 10 IICE CC(C)NC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1682023219 BYPCYEIIIPLXTF-MJGOQNOKSA-N 435.012 4.023 10 10 IICE C[C@@H]1CCCC[C@H]1OCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1708047930 WEODXQZEFQAFLY-QIJUGHKUSA-N 428.577 4.457 10 10 IICE CC[C@@H](C)CN(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1708579605 DIMWLJKVELHMFN-LJQANCHMSA-N 425.621 4.285 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)C[C@H]2CC=CCC2)cc1 1710025864 PVVASLNQBSJCSP-FQEVSTJZSA-N 431.588 4.422 10 10 IICE CCOCc1nnc(N2CCOC(C)(C)[C@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1710745969 MSJLDBDSWFLQOD-HXUWFJFHSA-N 441.620 4.103 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3cccs3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1724198858 RTFPOCAJHSCHGC-UHFFFAOYSA-N 448.596 4.139 10 10 IICE CCCN(CC)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1745592083 HECHCMBFAWDDAQ-UHFFFAOYSA-N 427.524 4.107 10 10 IICE CC(C)c1nc(CCn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)cs1 1750600694 JENAYPGAFPHXLH-GOSISDBHSA-N 441.601 4.337 10 10 IICE CN(CCCn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1767326574 DKFHHZXUHUYRQP-UHFFFAOYSA-N 429.565 4.145 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1769399475 IAICWCLFSHYVKI-LJQANCHMSA-N 441.551 4.353 10 10 IICE CCCOc1cccc(/C=C2/SC(=S)N([C@@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 1858592663 UDGAVSGMHHUXHT-DYGKOUCMSA-N 443.546 4.078 10 10 IICE CCN(CC)CCCCN1C(=O)/C(=C\c2cc(OC)c(OC)c(OC)c2)SC1=S 1858595773 HXZUYDUHWCIFOT-NBVRZTHBSA-N 438.615 4.036 10 10 IICE COC(=O)c1c(NC(=O)CCc2cnc(N(C)C)nc2)sc(C)c1-c1ccc(C)cc1 1866154415 XPIYNHDWDPSTSR-UHFFFAOYSA-N 438.553 4.246 10 10 IICE Oc1c(Br)cc(Cl)cc1CN[C@@H]1CCOC[C@@H]1OCc1ccccc1 1965931096 CMQXWHNMUDLALF-MSOLQXFVSA-N 426.738 4.272 10 10 IICE COC(=O)c1c(C(C)C)nn([C@H](C)c2ccc(C)cc2O)c1I 2078980149 ARRCMVHVBJJAFE-LLVKDONJSA-N 428.270 4.021 10 10 IICE CC[C@@H](c1cc(C)c(C)cc1O)n1nc(C2CC2)c(CN)c1I 2079978507 BGQHWWCJSWNDLM-HNNXBMFYSA-N 425.314 4.146 10 10 IICE CC(C)(C)OC(=O)NCCC(CCNC(=O)OC(C)(C)C)N[C@@H]1CCc2cccc(O)c21 2084886537 SHVFXNQJNJBMMU-GOSISDBHSA-N 449.592 4.167 10 10 IICE C[C@H](NCc1c(O)cccc1Br)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116239057 PHQCMFTYDMQSAA-SJCJKPOMSA-N 425.323 4.492 10 10 IICE O=C1C(=Cc2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1ccccc1Cl 2332144727 IYSLJURLHIFIKF-UHFFFAOYSA-N 425.750 4.298 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]3CC[C@@H]32)c(O)c1Br 2352675943 LDKJXXRSNRLQQI-OAGGEKHMSA-N 425.367 4.341 10 10 IICE Nc1ccc(OCCCOc2cc(Br)cc(I)c2)cc1 2364011553 ASEHTSXGSWKWEN-UHFFFAOYSA-N 448.098 4.484 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@H](C)C(=O)Nc3ccc(F)cc3)C2=O)cc1OC 15046236 VKGVLGSPKWUAHA-OTWJJXBCSA-N 446.525 4.071 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1cccc(C)c1 20236363 LWSDVBWAXUTWSB-YUIYYNKLSA-N 447.491 4.302 10 10 IICE CN(C)c1ccc(/C=C\[C@]23NC(=O)CN2c2ccc(Br)cc2C3(C)C)cc1 34388900 KGZUVUNFFZRBDN-GJCOWUBNSA-N 426.358 4.152 10 10 IICE CCOc1ccc(-n2c(C)cc(/C=C3\SC(=O)N([C@@H](C)C(=O)OC)C3=O)c2C)cc1 38200007 MGARAMHNXJNNDO-CCRNYGKSSA-N 428.510 4.091 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccccc3SC[C@H]3CCCO3)CC2)cc1 110362685 REWMTTGHZHQCHV-OAQYLSRUSA-N 426.582 4.365 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C\c3c(C)nn(-c4ccc(F)cc4)c3C)CC2)cc1 207253752 XYSZRMDJBHCEFC-SEYXRHQNSA-N 448.542 4.435 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCCC1 226642109 JKOMCCPTKZDSGT-IMWIBFENSA-N 440.565 4.489 10 10 IICE O=C(c1cnc(N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)c(Cl)c1)N1CCOCC1 301168046 IPTBYRAXIYPFNU-UHFFFAOYSA-N 440.906 4.122 10 10 IICE Cc1cccc(CN(Cc2cccc(C)n2)C(=O)NCc2ccc3c(c2)CCCN3C)n1 751790133 MJPZTLBIAOUYBG-UHFFFAOYSA-N 429.568 4.388 10 10 IICE CCOC(=O)c1sc([C@H](C)NC(=O)NCc2ccc(N3CCC(C)CC3)cc2)nc1C 756935669 YQPAOTSNZZQCEA-KRWDZBQOSA-N 444.601 4.425 10 10 IICE CN1CC[C@@H](NC(=O)NCc2cccc(Br)c2O)[C@@H]1c1ccc(Cl)cc1 764798175 ASYOLIFHAKSING-SJORKVTESA-N 438.753 4.053 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)c1O 769498465 JAVSRDLPLILERI-AHRSYUTCSA-N 442.943 4.144 10 10 IICE Cc1cccc2c(O)nc(COC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)nc12 769664211 ATHJRZJYBXNOMI-UHFFFAOYSA-N 444.535 4.108 10 10 IICE O=C(Cn1cc(NCc2ccc3c(c2)CCN3Cc2ccccc2)cn1)NC1CCCC1 796277396 HMIIGUBBWFUILV-UHFFFAOYSA-N 429.568 4.117 10 10 IICE O=C1COc2cc([N+](=O)[O-])c(N3CCC(c4cccc(Br)c4)CC3)cc2N1 798420246 MVXHHEPHCZNUCU-UHFFFAOYSA-N 432.274 4.072 10 10 IICE COc1cc2c(cc1F)CC[C@@H]2NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 802092057 AIUQBANGQBBQLX-FQEVSTJZSA-N 449.473 4.391 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(N2CCCC2=O)c(Cl)c1 806182422 YLKWSELWIFRKPE-UHFFFAOYSA-N 438.709 4.257 10 10 IICE CCOc1cc(N(CC)CC)ccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O 1084444600 PBFGQZMFKHODPI-XDHOZWIPSA-N 441.915 4.251 10 10 IICE Cc1cc(C(=O)Nc2ccc(-c3nn[nH]n3)cc2)c(C)n1-c1cccc(Br)c1 1142791515 ZIODYPSCWDKVED-UHFFFAOYSA-N 437.301 4.289 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OC(F)(F)F)cc1 1150346771 ADSHASLXPWIQBX-INIZCTEOSA-N 428.838 4.339 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3ccc(Br)c(F)c3C2)c([N+](=O)[O-])c1 1187647868 RFQKKTCOLWYPLL-CLTKARDFSA-N 435.249 4.245 10 10 IICE CCOC(C)(C)Cn1c([C@H](C)CC)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1296436980 JXYRJBLCMNGXCP-LJQANCHMSA-N 429.609 4.080 10 10 IICE COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1308061126 FCFIASSNHVYSFG-DLBZAZTESA-N 442.515 4.457 10 10 IICE Cc1nn(-c2ccccn2)c(C)c1CC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1355696426 KXAJHGDOUQCQDQ-UHFFFAOYSA-N 443.551 4.315 10 10 IICE Cc1cnc(CCNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c(C)c1 1437186886 SYFFKXCCQHMVMG-PDGQHHTCSA-N 445.635 4.100 10 10 IICE Cc1ccc(C(=O)NCCc2cnn(-c3ccccc3)c2)cc1-n1c(C)cc(C=O)c1C 1440829639 SUEFYWHUBUQFBV-UHFFFAOYSA-N 426.520 4.373 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H](O)c1cc(Cl)cc(Cl)c1 1465532373 AVNIUEBGUWFDDC-YJBOKZPZSA-N 445.293 4.413 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)C1(c2ccc(I)cc2)CC1 1465955032 VSGOKSVTFKYONS-UHFFFAOYSA-N 447.316 4.224 10 10 IICE COc1ccc(Cl)cc1[C@H](O)CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1468017159 KEJVWQCMHRNPHQ-OAQYLSRUSA-N 426.900 4.032 10 10 IICE CCCN(Cc1nc(O)c2sccc2n1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1470555616 HHBRJKCKLFVABO-INIZCTEOSA-N 441.601 4.324 10 10 IICE CC[C@H](NC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)[C@@H](c1ccc(C)cc1)n1cncn1 1470556588 XZKNAHNHVWUTQD-DCEDVJGZSA-N 448.615 4.259 10 10 IICE CCOC(=O)c1c(NC(=O)CSc2nc3cc(F)c(F)cc3[nH]2)sc2c1CCC2 1472973938 XPENJQSXDQWNIW-UHFFFAOYSA-N 437.493 4.299 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCN(Cc4cscn4)CC3)c2C)c1 1479100458 UHHYNMKDITUDKL-UHFFFAOYSA-N 437.613 4.277 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccc[nH]4)n3CC(C)(C)C(C)C)CC2)cc1F 1504296298 OQFVEDPVBXMEIE-UHFFFAOYSA-N 440.567 4.430 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(CC(C)C)C(C)C)n1Cc1ccc(N(C)C)c(F)c1 1505064168 QAOFWEGLYQPDNB-UGKGYDQZSA-N 447.599 4.126 10 10 IICE CC(C)(C)Cc1nnc(N2CC[C@H]([C@H]3CCOC3)C2)n1CCCSc1nccs1 1508556104 BWPQWBCHSANIAU-IRXDYDNUSA-N 435.663 4.368 10 10 IICE Cc1cc(-c2nnc(N3CCCC3)n2CCSCCCO)c(C)n1-c1ccccc1 1510620746 SRGSAHRPLWCLGY-UHFFFAOYSA-N 425.602 4.068 10 10 IICE COc1ccc(-c2cncc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)c2)c(C)c1 1519155484 GLSUEOUOSRHSCE-IBGZPJMESA-N 431.536 4.393 10 10 IICE CC(C)Cc1nnc(N(C)C[C@@H]2CC=CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1541430249 NBWNRGSLZLSJOR-HXUWFJFHSA-N 441.595 4.293 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1c(F)c(F)c(Br)c(F)c1F 1544930473 ZTVVIXZFIFWENG-UHFFFAOYSA-N 433.199 4.094 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CCC[C@H]3C)CC2)cc1F 1554960220 CMWTWAHBRWCGBU-RTBURBONSA-N 429.584 4.387 10 10 IICE Cc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1NC(=O)NC(C)(C)C 1558722801 CPBKTLXOXMZERC-QFIPXVFZSA-N 439.604 4.014 10 10 IICE COC1CCN(c2ccc(CN[C@](C)(CO)c3ccc(Br)cc3)cc2)CC1 1559828956 HQEKOTIDHREAQB-JOCHJYFZSA-N 433.390 4.062 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCOc3ncccc3C(F)(F)F)c2C)cc1 1566516918 FYOACDMYBGGHDX-UHFFFAOYSA-N 433.430 4.325 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2cccc(F)c2)c(C)n1-c1ccc(Br)cc1 1566784224 DDAZVMYWEFTTAP-FQEVSTJZSA-N 431.305 4.459 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H](OC1CCCC1)c1ccccc1 1583379532 VUTTXERRIRIDGI-HSZRJFAPSA-N 430.495 4.118 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccnn2Cc2ccc(Br)cc2)cc1 1584819797 CCDXOIHKZVVAFZ-UHFFFAOYSA-N 427.262 4.109 10 10 IICE Cc1cnc(F)cc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1618368959 ONNAPEWMTIGYEL-UHFFFAOYSA-N 426.249 4.254 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2ccc3c(c2)OC(F)(F)O3)cc1 1626107300 XILLORKGUMOJAT-HXUWFJFHSA-N 446.494 4.215 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2ccccc2F)c2nccn2C)c1 1629295002 LNWVUVOSFWHEAH-QHCPKHFHSA-N 430.483 4.299 10 10 IICE C[C@@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630263257 VIIYWVCXAAQMKN-YWZLYKJASA-N 432.923 4.174 10 10 IICE C[C@@H](NC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCC3)c1ccccc1O 1632247193 UTWXPAGHQFSKNN-GFCCVEGCSA-N 429.567 4.092 10 10 IICE Cc1nc(CN2CCC(CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)oc1C 1632610928 KVZGPPOHOQBQRE-UHFFFAOYSA-N 448.567 4.153 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Cl)cc2O)NC(=O)OC(C)(C)C)cc1 1634162022 GWYOWUNVOUUHGB-SFHVURJKSA-N 433.936 4.107 10 10 IICE C[C@H](NC(=O)N1CCC[C@@H](CC(=O)NCc2ccc(F)cc2)C1)c1ccc(N(C)C)cc1 1634434974 JTDZTRLPQDUIOB-ICSRJNTNSA-N 440.563 4.081 10 10 IICE O=C(Nc1ccc(C(=O)NCc2cc(O)ccc2O)c(O)c1)c1ccc(Cl)c(Cl)c1 1637126233 PIMJZYWXJMDMLX-UHFFFAOYSA-N 447.274 4.293 10 10 IICE Cc1cc(C(=O)N2CCN(C)[C@@H](C(C)(C)C)C2)c(C)n1-c1ccc(Br)cn1 1639428523 SAUUAWUYMNZAMV-GOSISDBHSA-N 433.394 4.054 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c1 1639618532 ZNADPWWBXLKDNG-LEWJYISDSA-N 439.556 4.328 10 10 IICE C[C@H](NC(=O)N[C@H]1CCN(c2cccc(Br)c2)C1)c1ccc(N(C)C)cc1 1671851655 HSWVVQPAAXVEKD-YJBOKZPZSA-N 431.378 4.154 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H]3CCN(c4ccc(F)cc4)C3=O)c2C)c1 1673676103 AVFKTHSQZKPQOA-QHCPKHFHSA-N 434.515 4.146 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3cc(Cl)cc(Cl)c3F)CC2)c(OC)c1 1683433195 WUJXVCJZILNZLG-UHFFFAOYSA-N 442.318 4.182 10 10 IICE Cc1ccccc1Cc1nnc(N(C)C[C@H](C)C#N)n1CCCSc1nccs1 1707657736 CSDAAFVFSQPBLK-MRXNPFEDSA-N 426.615 4.412 10 10 IICE CCN(CC)c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc2c(c1)CCCN2C 1710030380 VHMJLLXFSMABDX-UHFFFAOYSA-N 443.393 4.313 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3OCCC3(C)C)CC2)cc1 1711865318 QPWHMZFJGNGEOB-QFIPXVFZSA-N 441.620 4.017 10 10 IICE CC(C)[C@@H](Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1723124173 TUOKDODVQVFQCI-GOSISDBHSA-N 429.565 4.047 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)CC2CCOCC2)cc1F 1729328862 CMXKHJWYZOMSTC-UHFFFAOYSA-N 429.584 4.127 10 10 IICE Cc1ccc(-c2nnc(N(C)CCC(F)(F)F)n2Cc2ccc(N3CCOCC3)cc2)o1 1742182806 LDFIGFFBWHFNJH-UHFFFAOYSA-N 449.477 4.120 10 10 IICE CCc1nnc(N(C)[C@H](C)c2ccc([S@](C)=O)cc2)n1CCCSc1nccs1 1744523810 VNMRAHMIMBWYOU-HOLBHBGLSA-N 449.671 4.414 10 10 IICE CN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1)[C@@H]1CCSC1 1747612431 WMFPHZCFTFKMAZ-LJQANCHMSA-N 431.675 4.119 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCN(CC(F)(F)F)C2)o1 1761737572 KCCPUMJCEMQAMP-MRXNPFEDSA-N 449.477 4.073 10 10 IICE Cc1cccc(-c2nnc(N3CC(C)(C)OC[C@@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1761930380 BKNDLDYRFJRPDD-IBGZPJMESA-N 434.588 4.075 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)sc(C)c1-c1ccc(C)cc1 1865923192 QSCNJIBSUJEWFC-MRXNPFEDSA-N 428.554 4.404 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)[C@@H]1C1CC1 1886006833 OOVGPRASMTVRJA-HOTGVXAUSA-N 429.330 4.171 10 10 IICE CCN1CCc2cc([C@H](O)[C@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044721162 ZPOYPJSTSPWEKD-UPVQGACJSA-N 439.600 4.128 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)c1O 2227750655 KULRGOUGKURWSB-GFCCVEGCSA-N 429.355 4.041 10 10 IICE COC(=O)C1=C(C)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(C(=O)O)cc1 2294037416 CCGINJVLLRWTPH-UHFFFAOYSA-N 442.265 4.025 10 10 IICE COc1ccc(C=C2C(=O)N(c3ccc(I)cc3)N=C2C)cc1OC 2297458352 WZZHSOYVPKRTPQ-UHFFFAOYSA-N 448.260 4.115 10 10 IICE O=C1N=C(O)/C(=C/c2cnc(-c3ccccc3)nc2)C(=O)N1c1ccc(Br)cc1 1181121 BWXTXLMNNFHELO-YVLHZVERSA-N 449.264 4.413 10 10 IICE COc1cc(/C=C2\SC(Nc3cc(C)ccc3C)=NC2=O)cc(OC)c1OC(C)=O 13041969 PYYHRYAURMHVKT-ODLFYWEKSA-N 426.494 4.328 10 10 IICE CCCOc1ccc(/C=C2\SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)cc1 16926756 BTJRHFFXLRHKSG-IUXPMGMMSA-N 443.502 4.278 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C\c2ccc(O)c(Br)c2)SC1=S 40938908 GEZDZQFZZXYVGD-GXDHUFHOSA-N 444.372 4.089 10 10 IICE CCC1=NN2C(=N)/C(=C/c3cccn3-c3ccc(Br)cc3)C(=O)N=C2S1 96462485 NVCWFUUSHBNFKG-MKGVMWAWSA-N 428.315 4.269 10 10 IICE COC(=O)CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(\C)NC1CCCCCC1 205942733 TUHINCUQQKDYHR-XSFVSMFZSA-N 426.542 4.148 10 10 IICE O=C(O)/C=C\c1ccc(N2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c(Br)c1 687214780 PQKZBZCJRNUYDE-DVYMXEPTSA-N 427.342 4.400 10 10 IICE COc1ccc(-c2cnc(CCC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)o2)cc1 735518319 STBZFCGMFASQKX-OAQYLSRUSA-N 436.508 4.196 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c1O 740857473 PBSZRTMDRIFXGF-YWZLYKJASA-N 428.529 4.067 10 10 IICE COc1ccc(N2CCC(NC(=O)NCc3ccc(C(=O)OC(C)(C)C)cc3)CC2)cc1 743694137 LEPNYHOHXXDOMS-UHFFFAOYSA-N 439.556 4.119 10 10 IICE Cc1cc(C(=O)COC(=O)c2csc(Cl)n2)c(C)n1-c1ccc2c(c1)OCCO2 781220430 HEJVXPDTDDFIMA-UHFFFAOYSA-N 432.885 4.015 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCO[C@@H]1c1c(C)nn(-c2ccccc2)c1C 808095260 WZERGDJZBOVOIJ-DVECYGJZSA-N 440.540 4.074 10 10 IICE CCN1C(=O)/C(=C\c2cn(CCCOc3ccc(C)cc3)c3ccccc23)C(=O)NC1=S 1084478548 LCIUAAOEBRVRJW-QNGOZBTKSA-N 447.560 4.065 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1 1125251095 LNFKDJCLUJTXCH-GGAORHGYSA-N 443.385 4.474 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(-c4ccccc4C(F)(F)F)on3)C2)cc1 1130826696 HHUMSZOGYIYIFQ-AWEZNQCLSA-N 431.414 4.378 10 10 IICE CCOC(=O)[C@H](C[C@@H]1CCCO1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1133413105 RVTWIUCOSVZBJW-UGKGYDQZSA-N 438.528 4.399 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O 1142419106 NPTHEPPUKAQBRX-DNVCBOLYSA-N 448.394 4.468 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1157103230 XRICQLZIGWFTTJ-SFHVURJKSA-N 441.471 4.038 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CO)c2ccc(Br)cc2)c1 1160059191 IFPSMKGFWHGTRW-NRFANRHFSA-N 441.325 4.133 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@H](NC(N)=O)C(C)(C)C)n2)c(C)n1-c1ccc(F)cc1 1160529498 BPJHZQRHGNPHDT-SFHVURJKSA-N 443.548 4.378 10 10 IICE Cc1cccc([C@H]2CCCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1C 1251105120 REOWKBISCHBCFC-RUZDIDTESA-N 448.611 4.442 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H]3C[C@]3(C)c3cccc(Br)c3)C2)cc1 1278861334 IHDWUXZUUFJZPT-UCNVEGJOSA-N 429.358 4.130 10 10 IICE Cc1cc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)c(C)n1-c1ccc(Br)cn1 1295169180 QUZBPQDXUDXOPK-OAHLLOKOSA-N 433.394 4.054 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)CC[C@@H]3C)n2CCCSc2nccs2)n1 1304751467 LSSIPDHPPHBVLP-RDJZCZTQSA-N 445.662 4.403 10 10 IICE CCC1(CC)CN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCS1 1307662245 QXXCFFHSKXTOCG-MRXNPFEDSA-N 436.577 4.397 10 10 IICE CCOc1ccc(C2=CCN(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)CC2)cc1 1312901748 HHPLHOBHMGXQSY-HXUWFJFHSA-N 435.568 4.419 10 10 IICE CCO[C@H]1C[C@@](NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)(C(=O)OC)C1(C)C 1326016305 NUWRGOVXNPDFOH-WMZHIEFXSA-N 432.948 4.224 10 10 IICE CCOCCCNC(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1355719994 FGZMWBCLSNOJOH-UHFFFAOYSA-N 433.552 4.432 10 10 IICE O=C(Cc1ccc(Br)c([N+](=O)[O-])c1)N(Cc1ccco1)Cc1ccccc1O 1445636872 DSNFHSMYDKAGLG-UHFFFAOYSA-N 445.269 4.427 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@@H]21 1446660182 SNEQBICBCIULJQ-AEGPPILISA-N 432.542 4.078 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(COc2ccccc2)cc1 1446809188 ZTXNROCMJFMUGV-UHFFFAOYSA-N 439.895 4.440 10 10 IICE Cc1cc(C(=O)NC[C@@H]2COC3(CCCC3)O2)c(C)n1-c1cccc(Br)c1 1446850563 XLAJUAQUEFDVOS-GOSISDBHSA-N 433.346 4.272 10 10 IICE CCCNC(=O)OC[C@H]1CCCCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1449101295 QRKLMGDVJTWCOO-JOCHJYFZSA-N 439.556 4.346 10 10 IICE CO[C@H]1C[C@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C12CCC2 1449632420 QIHHACXFTRTBAR-ROUUACIJSA-N 432.362 4.281 10 10 IICE CCN(CC)C(=O)[C@@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1455977060 IFJDATRECJAKQK-FQEVSTJZSA-N 434.005 4.060 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCC(=O)Nc1c(F)cccc1F 1465850176 CLEQNGKYVFQIMY-UHFFFAOYSA-N 441.272 4.200 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](CCNC(=O)OC(C)(C)C)C1 1470556560 XILSXNPMRMMVCV-VQTJNVASSA-N 446.636 4.328 10 10 IICE Cc1cccc(O[C@@H](C)C(=O)N2CCN(Cc3ccc(N4CCCCC4)c(C)c3)CC2)c1 1473162901 IJCFPCAXLMCMAU-QHCPKHFHSA-N 435.612 4.405 10 10 IICE Cc1c([C@@H](C)NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)oc2ccccc12 1477576183 XNGYJXABGPMXFK-QGZVFWFLSA-N 434.540 4.003 10 10 IICE COC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)OC)C1 1518868973 MMTQMKWTMIUOSV-FQEVSTJZSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CCCc3ccc4ccccc4c3)CC2)cc1 1523442538 GXJCCSCLFYWOEJ-UHFFFAOYSA-N 445.607 4.500 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCN(C)C)Cc2cccs2)CCCC1 1534098922 SCRHCTJKSLETML-UHFFFAOYSA-N 425.598 4.181 10 10 IICE C[C@H](NC(=O)CC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1535557633 CJXINIFYDYMJBP-PMACEKPBSA-N 445.604 4.128 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1542704065 NZNBVDVLMLPVHX-OAQYLSRUSA-N 447.620 4.452 10 10 IICE Cc1cc(Br)cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1N 1544529924 PTPIQEMMGCUNHK-LJQANCHMSA-N 446.389 4.227 10 10 IICE CNC(=O)OC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1556879719 WUZFTCNCPUJJBQ-MRXNPFEDSA-N 448.361 4.207 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2ccccc2)C2(CO)CCOCC2)c1 1557223348 CGVRYDIBBUVIFQ-RUZDIDTESA-N 446.547 4.167 10 10 IICE CN1CC[C@H](C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)[C@@H]1c1ccccc1 1558924352 OLAFSBKCICKCFE-VXKWHMMOSA-N 429.511 4.066 10 10 IICE C[C@H](N[C@H](C)c1ccc(F)cc1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559704060 CGXYISIVVYKEJS-KGLIPLIRSA-N 434.442 4.418 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CO)c2cccc(Br)c2)c1 1566770112 XGIVNIHPGBVXJA-OAQYLSRUSA-N 441.325 4.133 10 10 IICE Cc1ccc(O)c(CNC(=O)c2c[nH]cc2-c2cc(Br)c3c(c2)OCCO3)c1 1584983862 TXVBNIMLZKVUEI-UHFFFAOYSA-N 443.297 4.159 10 10 IICE CCC(CC)[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)N1CCOCC1 1587767511 OIFFNZPUGNEXDH-VWLOTQADSA-N 439.600 4.082 10 10 IICE COc1ccc(N2CCN(C(=O)C(F)(F)c3cccc(Cl)c3Cl)CC2)c(OC)c1 1595996973 OHUVDXZPSGVDDQ-UHFFFAOYSA-N 445.293 4.451 10 10 IICE CC(C)(C)OC(=O)NC1(C(=O)NCc2ccc(N3CCSCC3)cc2)CC2(CCC2)C1 1596358571 GEASDKCHTVHGAJ-UHFFFAOYSA-N 445.629 4.084 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCOC[C@H]1C 1613295985 TWCILCXKWXNUKH-PWRODBHTSA-N 441.620 4.190 10 10 IICE CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623549702 ISTIDESXLJBWPH-QHCPKHFHSA-N 440.563 4.052 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]2C)c(C)n1-c1ccccc1 1624064402 FMVJPEJGOYMKBW-RBUKOAKNSA-N 425.573 4.493 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1625622783 QGANAGJPVHEIGO-JOCHJYFZSA-N 432.542 4.176 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C=C\c2ccc(C)nc2)cc1 1627165715 NWDMNLMUCMXSQB-QINSGFPZSA-N 429.520 4.047 10 10 IICE Cc1sc2ncc(C(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)c(=O)n2c1C 1631531652 XSSJNGMGDUOSPI-INIZCTEOSA-N 433.533 4.482 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1 1632158202 VFYRSUYJTDIXFU-GMAHTHKFSA-N 443.385 4.474 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(Cl)c(Cl)cc2N)c1 1633080204 ZFIUOZOBTMWGRU-UHFFFAOYSA-N 443.334 4.320 10 10 IICE CCOC(=O)[C@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)[C@H](O)c1ccc(Cl)cc1 1641948695 QMAXGJACVQHQNN-FGZHOGPDSA-N 440.927 4.143 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccc(Cl)c(S(=O)(=O)Nc3ccccc3C)c2)c1 1645805164 VAMGANWCZBRQTI-UHFFFAOYSA-N 444.940 4.393 10 10 IICE Cc1ccccc1[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 1653026501 DDUDTBPHMMFQKO-ANSQWYIGSA-N 439.575 4.105 10 10 IICE C[C@H](S[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(=O)OC(C)(C)C 1656495333 HJHOWUZCHUWIOH-KGLIPLIRSA-N 439.533 4.252 10 10 IICE Cc1cccc([C@@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccn2)c1 1679703669 UFAVQRSAJKJVJK-JWQCQUIFSA-N 431.584 4.148 10 10 IICE C[C@@H](CCc1ccc(I)cc1)NC(=O)N1Cc2cccc(O)c2C1 1680785567 NDJQSAXJXZAGPL-ZDUSSCGKSA-N 436.293 4.043 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H]3CC(=O)N(c4ccccc4F)C3)c2C)c1 1682713505 XAQLGDKNLVQRMX-FQEVSTJZSA-N 434.515 4.146 10 10 IICE C[C@@H]1CCCC[C@H]1OCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1693651612 SRACJSPJJPVWEB-AUSIDOKSSA-N 435.572 4.201 10 10 IICE CC[C@@H](C)[C@@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1708380292 ACADNIFFBHSIFR-UEVCKROQSA-N 441.620 4.427 10 10 IICE CCOC1CC(CCn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)C1 1746914136 MYHQIPJZHTWCMB-UHFFFAOYSA-N 445.583 4.081 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](c3ccnn3C)C2)n1CCCSc1nccs1 1750740050 ZPKIHJUKDZWASJ-KRWDZBQOSA-N 445.662 4.233 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCc2nc(C)c(C)s2)n1 1761917211 WJUBJSBETPZXCR-UHFFFAOYSA-N 434.569 4.307 10 10 IICE CCc1cnc(CN(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)s1 1762699388 YHSDRHJIOPTTQD-HXUWFJFHSA-N 440.617 4.208 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCSC[C@H]2C)cc1 1766614054 JTRBIXCBNLELNN-LJQANCHMSA-N 436.629 4.100 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1767112046 NWZAKDZLBHFHBY-KRWDZBQOSA-N 445.614 4.153 10 10 IICE CCOCCN(C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1772885595 QDFOJAHARNCOKO-UHFFFAOYSA-N 436.604 4.041 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1-c1ccccc1F 1868176076 BQAGGJKGAGQAJG-UHFFFAOYSA-N 425.419 4.348 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2010402519 RJXKHQGNMQJKPG-RTBURBONSA-N 431.537 4.036 10 10 IICE O=[N+]([O-])c1c(Br)nn(Cc2cccc(C(F)(F)F)c2O)c1C(F)(F)F 2079162139 CEDYKLQVIHHUEA-UHFFFAOYSA-N 434.090 4.345 10 10 IICE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cc(Br)cc(F)c1O 2093491194 ABLBESCHLJYUHJ-MLGOLLRUSA-N 431.346 4.419 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 2193233496 KTROGDVRQUTJNG-DOTOQJQBSA-N 447.270 4.446 10 10 IICE CN1CCc2cc([C@H](N)c3ccc(Br)cc3I)ccc21 2207265258 OZBVVPKUHFGVLW-INIZCTEOSA-N 443.126 4.094 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)c1O 2236035861 HYFFHXIDVXDTAC-MRXNPFEDSA-N 441.366 4.043 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)C(C)(C)C2)c1O 2236055086 OCYSSLKYGRMLPO-ZDUSSCGKSA-N 443.382 4.431 10 10 IICE CC[C@H](C)NCc1ccc(N(C)C[C@@H](O)COCc2ccccc2)cc1Br 2240022788 ALIKBXHPJJGQMU-LAUBAEHRSA-N 435.406 4.351 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)cc1 2296397858 CBXHVXCYMKUYLC-UHFFFAOYSA-N 431.467 4.462 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)Nc1ccccc1Cl 33932684 PLRPMSASYKDRMR-LICLKQGHSA-N 446.937 4.299 10 10 IICE Cc1cc(Oc2nc3ccccn3c(=O)c2/C=C2/SC(=S)N(C)C2=O)ccc1Cl 39835707 XNACBUKVECHZNU-XNTDXEJSSA-N 443.937 4.280 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC2(c3ccccc3)CCOCC2)C1 435565906 HUTKOSJQBSRACZ-UHFFFAOYSA-N 445.607 4.272 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cc(C)ccc3OC)[C@H]2c2ccc(O)c(O)c2)c1 526445926 ITRKXNDCRRGEII-QHCPKHFHSA-N 433.460 4.481 10 10 IICE Cc1nn2c(CNCc3ccc(N4CCN(CC5CC5)CC4)cc3)c(C(C)C)nc2s1 768669997 KPQAPUJZWIXJGG-UHFFFAOYSA-N 438.645 4.044 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnc(-c2ccc(F)c(F)c2)s1 780390466 YIOHKYCFQNALHJ-UHFFFAOYSA-N 447.482 4.119 10 10 IICE Cc1cccc2c1OCC[C@H]2NC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 788744483 TUALVBWZJCOUGL-CBGDNZLLSA-N 427.520 4.071 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1 797635442 PUFRXFCDRMEBLF-KRWDZBQOSA-N 443.507 4.157 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1 801548549 XCPJPDAOHNCXPB-UHFFFAOYSA-N 445.516 4.103 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)c(C)n1-c1ccccc1 919840444 VVWBGXXAZOIBTC-HSZRJFAPSA-N 435.593 4.048 10 10 IICE CCN1CCN(C(=O)c2ccc(NC(=O)c3sccc3-n3c(C)ccc3C)cc2)CC1 1136483472 OSEZYVQAPNSKPW-UHFFFAOYSA-N 436.581 4.186 10 10 IICE CC[C@@H](CO)NC(=O)Cc1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1137440567 YGFNCNKSFDLJED-NRFANRHFSA-N 433.552 4.084 10 10 IICE Cc1cc(C(=O)NCCOc2ncccc2F)c(C)n1-c1cccc(Br)c1 1137638543 JPKNJWJBYPWHIW-UHFFFAOYSA-N 432.293 4.200 10 10 IICE CN(CCCOc1ccc(Cl)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1251501092 NJUPJRGEKZMOKH-QFIPXVFZSA-N 432.996 4.119 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(OC)cc1I 1297004914 CXBDKDAEJMEOLW-UHFFFAOYSA-N 439.293 4.448 10 10 IICE COC(=O)c1cn(-c2cccc(NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)c2)nn1 1297774003 XGNQWCBCXAMZCZ-UHFFFAOYSA-N 449.898 4.367 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](O)[C@H](C3CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1299225290 HTTLCPBBQAVCNW-VQTJNVASSA-N 446.389 4.265 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccccc1O 1302530211 FVNZALMEIIPBFU-OAHLLOKOSA-N 428.485 4.132 10 10 IICE C[C@@H](NC(=O)c1c[nH]cc1-c1cc(Br)c2c(c1)OCCO2)c1ccccc1O 1302532439 CEGHMNLFZYJIFZ-GFCCVEGCSA-N 443.297 4.412 10 10 IICE Cc1nc(Cc2nnc(N3CCC(C)CC3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1304662528 JDODYCRXYSSTEG-UHFFFAOYSA-N 428.581 4.124 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(=O)NC(C)C)C1 1306361713 LEMXMABNCPCGAS-FQEVSTJZSA-N 434.588 4.114 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(C)(C)Oc4ccccc43)cc2F)C[C@@H](C)O1 1355131206 ULEBRRAOKZUIDU-FUHIMQAGSA-N 426.532 4.400 10 10 IICE Cc1ccccc1C(=O)NC1CCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1356377686 HBDPADIQOOENHZ-UHFFFAOYSA-N 429.564 4.366 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CC[C@H]3CCCC[C@H]3N2C(=O)OC(C)(C)C)cc1F 1357200107 IMNRXCSXKDVDFZ-QFUCXCTJSA-N 433.568 4.466 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)N2CC3(CCCC3)c3cc(Br)ccc32)c1 1435512510 DNCUUBRZPWMKID-QPJJXVBHSA-N 440.341 4.076 10 10 IICE Cc1ccc(C)c(C2=NO[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)C2)c1 1456089893 VCQKMWJCPBXVCD-OAQYLSRUSA-N 433.474 4.454 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)[C@@H]1CCC[C@H](OC)C1 1461289788 XZJRLGZJLSRAOP-PLMTUMEDSA-N 432.948 4.224 10 10 IICE CCOC(=O)c1cn(CC)nc1NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1463369587 XSDCZPFAIDSABQ-UHFFFAOYSA-N 428.920 4.322 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 1464077579 ZTDIDUBAROQGBX-HSZRJFAPSA-N 435.568 4.438 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(c4ccccc4)C[C@H](O)C3)cc2Cl)C1 1469959998 MTSSONNLIKCASE-IOZGHAEBSA-N 442.003 4.468 10 10 IICE CNC(=O)[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC1(C)C 1503701957 BEDGZCASQRGTCR-YLJYHZDGSA-N 448.615 4.217 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@@H]1CC1(C)C 1517121338 DATDXPCDYJMCTD-FQEVSTJZSA-N 425.621 4.386 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)CC(C)(C)C1 1517583799 IKLVGSOCMFUKPX-GOSISDBHSA-N 448.615 4.361 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(OC)c(-c4ccccc4)c3)CC2)c(OC)c1 1534278110 OBRYACVIPKORNN-UHFFFAOYSA-N 432.520 4.342 10 10 IICE C=CC(=O)N1CCC(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)(c2ccccc2)CC1 1540543388 LISOJXTXEYMBGU-UHFFFAOYSA-N 445.607 4.382 10 10 IICE Cc1cc(C)c(NC(=O)CN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(C)c1 1540722313 MFNSIJKYNKURLV-UHFFFAOYSA-N 445.563 4.472 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N1C[C@H](C)S[C@@H](C)C1 1542227023 QISJRCFLHVBRCB-OALUTQOASA-N 436.629 4.017 10 10 IICE COc1ccc(N2CCN(C(=O)C/C=C\c3ccc(Br)cc3)CC2)cc1F 1545608431 SPQVRBXYJZTYCH-IHWYPQMZSA-N 433.321 4.349 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cn(-c2ccc(Br)cc2)cn1 1545639155 DNDDEXGAPXWPAX-UHFFFAOYSA-N 426.314 4.149 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2cnnn2-c2cc(C(F)(F)F)ccc2Cl)c1 1545684514 ZOSVCOOADVDHQN-SNVBAGLBSA-N 440.809 4.145 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(C)c(S(=O)(=O)N2CCCCC2)c1 1556367253 YZPNORQWKYQDCM-UHFFFAOYSA-N 444.597 4.318 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cc(C(=O)OCc3ccccc3)[nH]n2)c1 1558687744 KRVPZTUOHHWQPY-UHFFFAOYSA-N 442.475 4.239 10 10 IICE O=[N+]([O-])c1ccc(N(Cc2ccccc2O)C[C@@H]2CCCO2)nc1OCc1ccccc1 1559143189 OBHXZVQTKOEAJG-FQEVSTJZSA-N 435.480 4.460 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NCc1nc(C(F)(F)F)n2c1CCCC2 1565229943 VLIMFGKWGNBVJW-UHFFFAOYSA-N 437.249 4.250 10 10 IICE Cc1ccc(NC(=O)c2ccc(C)c(O)c2O)cc1S(=O)(=O)Nc1ccc(Cl)cc1 1586856733 YVHMOXNRQCWHJZ-UHFFFAOYSA-N 446.912 4.421 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@H](C)O[C@@H](COC)C2)cc1 1615381556 YMOWOYJVBLJNLO-SIKLNZKXSA-N 443.636 4.001 10 10 IICE CCN(CC(=O)NCCc1c(C)cc(C)cc1C)Cc1cc(Br)ccc1O 1615674121 DYUKZVDEWYGSRT-UHFFFAOYSA-N 433.390 4.261 10 10 IICE CCOCc1nnc(N2CCC(C(F)(F)F)CC2)n1Cc1ccc(N(CC)CC)cc1 1616759601 XVSJOTRETQYHGY-UHFFFAOYSA-N 439.526 4.488 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(C)c(S(=O)(=O)N(CC)CC)c1 1617879820 OKQMINKBVNIHKA-UHFFFAOYSA-N 432.586 4.174 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)[C@H](OC)c3ccccc3Cl)CC2)cc1F 1634425037 KZMBTZDACSHXSN-VFNWGFHPSA-N 435.927 4.096 10 10 IICE Cc1ccc(C(=O)CC(C)(C)CC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1638488685 MMRAJIUTQFRHEJ-UHFFFAOYSA-N 449.595 4.002 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCN(CC(F)F)C2)c(C)n1-c1cccc(Br)c1 1650898922 UVQFRHXTUURDFQ-OAHLLOKOSA-N 440.332 4.173 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCN1CCN(c2ccc(F)cc2)CC1 1651362926 SMLPKCLOJBZFJF-UHFFFAOYSA-N 448.498 4.199 10 10 IICE CCOc1ccccc1[C@@](N)(C(=O)NCc1ccc(N(CC)CC)c(F)c1)C(F)(F)F 1654311888 COBABCHRJPFZPG-OAQYLSRUSA-N 441.469 4.103 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCO[C@@H](c2ccccn2)C1 1682356046 VECZXXUNMIPVFX-VQIMIIECSA-N 434.334 4.002 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NCc2cccc(Cl)c2O)Cc2ccccc21 1683757717 VDNIFIZGMSQCEF-INIZCTEOSA-N 431.920 4.211 10 10 IICE C=C(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CCOC)[C@@H](C)C1 1705721451 AABRQMWCKZWKEI-NRFANRHFSA-N 448.615 4.086 10 10 IICE C=CCN(CC=C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCOCC1 1705870245 PRZLBJFQHNSACZ-UHFFFAOYSA-N 447.583 4.073 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CC[C@H](C)C(C)(C)C1 1707305381 YHEZPEFXQJBFCS-PZJWPPBQSA-N 425.621 4.467 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCCC2)nnc1N(C)Cc1c(C)nn(C)c1C 1742141665 KYKJYYZOMBHTSZ-UHFFFAOYSA-N 435.620 4.345 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC[C@@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1742706026 RSRVXASPILIGBU-GOSISDBHSA-N 435.620 4.189 10 10 IICE CN(CC1CC(F)C1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1768752956 HZHUEAWHMGHWHV-GPANFISMSA-N 425.599 4.343 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3)C(=O)/C2=C/c2cc(OC)c(O)c(OC)c2)cc1 1865679731 DABJNIOVURUNTD-FYJGNVAPSA-N 444.487 4.248 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2Cl)N2CCCCC2)cc1 1866140575 LMEJCVMTQVUFMT-HXUWFJFHSA-N 430.936 4.271 10 10 IICE CCCCCn1cc(OCC(C)C)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870437569 ZUZIHCFTKJXPTA-UHFFFAOYSA-N 441.616 4.404 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccc([N+](=O)[O-])c1Br 1891416466 XFSHTSINGUXBHT-HOCLYGCPSA-N 430.302 4.276 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2ccc(Br)cc2O)C1 1952455918 IRYQXXLMEHQQAL-RHSMWYFYSA-N 434.286 4.329 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@H]2C[C@@H](C1)N(Cc1ccccc1)C2 2187750023 FSYQWQPPJNJOQO-FPOVZHCZSA-N 426.402 4.412 10 10 IICE CCN(CC)c1ccc(C=Cc2nc(O)c([N+](=O)[O-])c(O)n2)c(OCc2ccccc2)c1 2296566817 MJRIRXUNOLFJDQ-UHFFFAOYSA-N 436.468 4.392 10 10 IICE CN(C)c1ccc(C=C(NC(=O)c2ccccc2F)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 2297298929 RAHPIYJLXKDPTG-UHFFFAOYSA-N 448.454 4.210 10 10 IICE CSC1=NSC2=NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C(=N)N12 2297333803 UBPIHLYMOHDHAD-UHFFFAOYSA-N 426.498 4.344 10 10 IICE O=C1NN(c2ccc(F)c(Cl)c2)C(=O)C1=Cc1cccc(OC(=O)c2cccs2)c1 2297349292 JNUIQGKVFFMDLX-UHFFFAOYSA-N 442.855 4.221 10 10 IICE CCOc1cc([N+](=O)[O-])cc(C=C2SC(=S)N(CCc3ccccc3)C2=O)c1O 2297349791 DGRJKAWNZDOSQR-UHFFFAOYSA-N 430.507 4.143 10 10 IICE COc1ccc(-c2csc(N3N=C(C)[C@@H](N=Nc4ccc(C(=O)O)cc4)C3=O)n2)cc1 2297734715 FIUUXVWPOYFVBS-GOSISDBHSA-N 435.465 4.392 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C3(CCC3)C2)c(O)c1Br 2352685607 GBZRDGGCJIMECO-HNNXBMFYSA-N 425.367 4.485 10 10 IICE Cc1ccc(CN[C@@]23CC[C@@H](CN(C(=O)OC(C)(C)C)C2)C3)c(O)c1Br 2352940314 DBBYSTZWMFCTAZ-JLTOFOAXSA-N 425.367 4.342 10 10 IICE Cc1ccc(CN2CCN(Cc3ccccc3)CC(F)(F)C2)c(O)c1Br 2352944811 MSVPSXBDMPDICB-UHFFFAOYSA-N 425.317 4.416 10 10 IICE Cc1cc(C(=O)Nc2ccc(CCN3CCC(C(N)=O)CC3)cc2)c(C)n1-c1ccccc1 110195539 NODFVYLQRNYIRV-UHFFFAOYSA-N 444.579 4.086 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)ccc1OCC(=O)O 210456680 GLKCANPMKNFNKV-WQRHYEAKSA-N 429.519 4.263 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2nc3c(s2)CSCC3)C1 557519989 VYJQALRULIFORV-UHFFFAOYSA-N 426.611 4.292 10 10 IICE Cc1cc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc(N2CCCC2)n1 569631597 FZPWMXRFHNCUNU-UHFFFAOYSA-N 445.611 4.028 10 10 IICE C[C@H]1[C@H](NCc2ccc(Br)cc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709310389 RFHYNZKXUPRKFY-WBQNTZJQSA-N 425.367 4.421 10 10 IICE CC(C)(C)OC(=O)N1CCC(CCNCc2cc(Br)cc(F)c2O)CC1 715737432 NCEKBGKTAYQLPE-UHFFFAOYSA-N 431.346 4.421 10 10 IICE Cc1cc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c(C)n1-c1ccc(F)cc1 732779354 JRRXHZLZSLKYAP-UHFFFAOYSA-N 448.542 4.311 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCCc1csc(N2CCCC2)n1 745839786 ZJMWUJLHARUHHR-UHFFFAOYSA-N 427.618 4.118 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccc(OC(F)F)c1 768873490 UYABYIVKJGRXNW-UHFFFAOYSA-N 430.499 4.142 10 10 IICE Cc1nn(C)c(C)c1[C@H]1COCCN1CC(=O)Nc1ccc(N=Nc2ccccc2)cc1 772380800 FDYOCUUEUITNLZ-JOCHJYFZSA-N 432.528 4.464 10 10 IICE O=C(N[C@H](c1cc(F)ccc1F)C(F)F)N(Cc1ccccc1O)C[C@H]1CCCO1 788755214 DMNAOLYYDOBTSS-DNVCBOLYSA-N 426.410 4.367 10 10 IICE Cc1ncc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c(C2CC2)n1 798513673 IMSGYPQFVJBYSA-YBEGLDIGSA-N 444.607 4.344 10 10 IICE O=C(NCc1ccc(Oc2ccccc2)nc1)NCc1cc(Br)ccc1O 805032467 MGFZHQQYVOIACX-UHFFFAOYSA-N 428.286 4.341 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1sc([C@@H]2CCCOC2)nc1C 815797223 HDAWHVSPPKMKSZ-CYBMUJFWSA-N 439.375 4.476 10 10 IICE COCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)sc2cccc(F)c12 1134681769 HDAQRYOICUDHTN-IBGZPJMESA-N 429.561 4.286 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)c1 1136689221 ANRRAKYDFMXROD-HSZRJFAPSA-N 449.938 4.438 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Oc2ccccc2)ccn1 1137816018 BHFGZEDVBIKZJZ-UHFFFAOYSA-N 426.856 4.048 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2c(Br)cccc2cn1 1139974890 PBPATKQBQJTXFS-UHFFFAOYSA-N 436.103 4.395 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)c(C)n1-c1ccc(Br)cn1 1141695483 ZFFVUDVQPMERLK-HOCLYGCPSA-N 433.394 4.244 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCCN(c4ccc(C)cc4)C3=O)c2C)cc1 1148223946 HOQMJEAXZPTJCW-XMMPIXPASA-N 431.536 4.337 10 10 IICE Cc1cc(C(=O)CSc2ncc([N+](=O)[O-])c(N)n2)c(C)n1-c1ccc(C(C)C)cc1 1166211845 NCIWCYVNCIFITG-UHFFFAOYSA-N 425.514 4.473 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](C)c2ccc(N(C)C)cc2)sc2c1CC[C@@H](C)C2 1193574149 DQJKHNMXPCCMDC-CVEARBPZSA-N 443.613 4.405 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@H](c2ccc(F)cc2)CC1 1233605744 YOPRIVDBNVBCJK-FQEVSTJZSA-N 425.548 4.266 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H]3[C@@H](O)C(F)(F)F)cc2Cl)C1 1235834053 NAZQKHOBUSHRSG-FSPWUOQZSA-N 433.902 4.174 10 10 IICE COCCNC(=O)c1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1Cl 1264676886 LUQOAHGLQZGQDU-UHFFFAOYSA-N 439.943 4.305 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccnc(Oc4ccc(F)cc4F)c3)C2)cc1 1276832100 NHBQKNWFOHXWBS-MRXNPFEDSA-N 439.462 4.417 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@H](N(C)C(=O)OC(C)(C)C)C3)c2C)cc1 1294115492 UZIQMWCENHERBA-IBGZPJMESA-N 427.545 4.184 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CCCC1 1295283358 IIWDBRXSTNZNNX-QHCPKHFHSA-N 434.580 4.447 10 10 IICE COC1CCN(c2ccc(CN3C[C@@H]4CCC[C@]4(NC(=O)OC(C)(C)C)C3)cc2)CC1 1307960380 LFJBPZIVVKEGLE-CPJSRVTESA-N 429.605 4.181 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](C)c3ccc(-n4cccn4)c(F)c3)CC2)cc1 1312743268 XYADEDCQOOXXOU-GOSISDBHSA-N 437.519 4.003 10 10 IICE Cc1cc(CCNC(=O)N2C[C@@H]3C[C@H]2CN3C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1313101169 RUCOYKPKAKAEEC-VXKWHMMOSA-N 438.572 4.040 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cncc(-c4ccc(N(C)C)cc4)c3)C2)cc1 1436970150 HWEOFUOMSOMKBH-IBGZPJMESA-N 430.552 4.080 10 10 IICE CNc1cc(I)ccc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1440710920 GVOOXAGHJDJTEO-UHFFFAOYSA-N 449.336 4.205 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2CCCC[C@H]2[C@@H]1C(=O)NCc1ccc2cccnc2c1O 1451957565 KCQLMQGTKPZJOT-LDQXTDLNSA-N 439.556 4.372 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(OCC(F)(F)F)o2)cc1 1464594098 GERINETUDZTILZ-KRWDZBQOSA-N 426.435 4.108 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(F)c(C(F)(F)F)cc1F 1466398101 HXJMWORUDUXWHK-UHFFFAOYSA-N 437.748 4.158 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1 1469107295 YHYVYWXAXZGXTF-HXUWFJFHSA-N 429.564 4.205 10 10 IICE CC(C)C(=O)Nc1cc2ccccc2cc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1471565663 UONZKORVFCAFIL-UHFFFAOYSA-N 444.579 4.116 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccc(Cl)cc4C[C@@H]3C)cc2F)C[C@@H](C)O1 1473901914 NRIURCJSIZISIW-YESZJQIVSA-N 445.966 4.160 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC[C@@H]1CCC[C@@H]1c1ccccc1 1478714100 ZARGAURIXATQGH-VQTJNVASSA-N 429.511 4.185 10 10 IICE CCCCCn1nc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c2ccccc2c1=O 1529276818 AJAILQZCXWCPOD-IBGZPJMESA-N 434.584 4.322 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cc(C(C)C)ccc3C)CC2)c(OC)c1 1534586286 BGAUZUCESUDIMV-LJQANCHMSA-N 426.557 4.252 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4ccc(F)cc4F)CC3)ccc21 1535160640 BXEGWJBTGQHNGG-UHFFFAOYSA-N 427.495 4.145 10 10 IICE CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1544402308 QZKHHSOBLHKWBW-OAQYLSRUSA-N 436.512 4.438 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)cc2F)C[C@H](C)O1 1544675934 FMPYYVAOHGCVGC-RYUDHWBXSA-N 439.846 4.070 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCN(C(=O)OC(C)(C)C)CC2)n1CC1CC1 1554175837 XTMNFZWOOPOMMJ-UHFFFAOYSA-N 441.576 4.145 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NCc1cc(Cl)ccc1O 1557386381 SMJDWWGEQMDLKK-UIAACRFSSA-N 426.944 4.446 10 10 IICE COc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1C 1586309550 DDDOMKWLZVLREN-PDGQHHTCSA-N 430.526 4.373 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3cnc4cc(C(C)(C)C)nn4c3=O)c2C)c1 1614989702 IEAOBSQPWHARPC-UHFFFAOYSA-N 431.540 4.096 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)CC2CC(F)C2)cc1 1615382033 KOUIDEXBKHDNOC-UHFFFAOYSA-N 436.579 4.343 10 10 IICE CC(C)[C@H](NC(=O)NC(C)(C)C)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1617900754 LTDWAEFXFZZCOQ-JXFKEZNVSA-N 437.028 4.315 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c1C 1618295494 QEZHHIGWHVOXPJ-GOSISDBHSA-N 430.470 4.401 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(Oc2nccs2)c1 1637247271 LCSVXOQFYCYWGZ-UHFFFAOYSA-N 432.885 4.110 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N(CCCCc2ccccc2)c2ccccc2)c1 1637697016 LLXIMMUWRFABSP-UHFFFAOYSA-N 438.549 4.433 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1nc(O)c2c(C)c(C)sc2n1 1638243548 HNKWXVUNPJRQTC-AWEZNQCLSA-N 426.586 4.068 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3CCC3CCCC3)cc2F)C[C@@H](C)O1 1644947625 XSSUUGQFKZBHPZ-VIZSFHNOSA-N 445.623 4.490 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)Nc1cccc(I)c1 1653810556 GVPSCCGYDHTPBZ-UHFFFAOYSA-N 436.293 4.081 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H]2CC[C@]21CNC(=O)OC(C)(C)C 1673744435 LUWYGNRSXVLXQL-NNPDTBDGSA-N 444.620 4.081 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)c(C)n1-c1ccccc1 1681187671 DUJOGWWRAXYCPP-TZRRMPRUSA-N 449.599 4.330 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccccc3)cc2Cl)C1 1686268824 IEFXYTJALBHBRW-GHTZIAJQSA-N 429.992 4.227 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)S[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708430561 OOFAFOZFBQHDOX-FHWLQOOXSA-N 429.634 4.007 10 10 IICE CC[C@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1744970272 ZZHVXIXEOVUJEZ-FQEVSTJZSA-N 431.675 4.335 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3nccs3)n2Cc2ccc(N(C)C)c(F)c2)o1 1751474965 QGIWRCMXEWFDHO-UHFFFAOYSA-N 426.521 4.193 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(C3CCCC3)CC2)cc1F 1768496366 IQNLELTZZXYRQG-UHFFFAOYSA-N 442.627 4.185 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cccc(C(=O)OC(C)C)c3)C2=O)ccc1O 1860086915 OVHICNKKALHASP-VCHYOVAHSA-N 429.519 4.372 10 10 IICE CCCCCn1cc(OCCC)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870657593 MZDWOVSTETWAIJ-UHFFFAOYSA-N 427.589 4.158 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3cc(Br)ccc3O)CCC[C@H]12 2087290594 WRHGHJHGIXZORY-PXNSSMCTSA-N 425.367 4.424 10 10 IICE CN[C@H]1C(=O)Nc2cc(N(CCCCOC)Cc3ccccc3)c(Br)cc21 2152206669 SDRNKMQCDNANMD-HXUWFJFHSA-N 432.362 4.095 10 10 IICE COc1ccc(Br)c(CNC[C@](C)(NC(=O)OC(C)(C)C)C2CCC2)c1O 2236045041 PZEPUFJHHJUCNE-FQEVSTJZSA-N 443.382 4.336 10 10 IICE Cc1ccc(OCCOCCOc2ccc(C=C3SC(=S)NC3=O)cc2)cc1C 2293544017 OZWNNQHGNFIWBJ-UHFFFAOYSA-N 429.563 4.267 10 10 IICE CCN1N=C(C(F)(F)F)C(=Cc2cc(Br)cc(Br)c2O)C1=O 2332131459 VKJGQUZBAWUGJC-UHFFFAOYSA-N 442.029 4.081 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@H](NCc1cccc(Br)c1O)C2 2333632607 WLDXECUAWLHECW-FRFSOERESA-N 425.367 4.280 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)Nc1ccccc1OC 24874599 HDDOLQPVJUMXGJ-UHFFFAOYSA-N 425.510 4.081 10 10 IICE O=C(NN1C(=O)/C(=C/c2ccc(Br)o2)SC1=S)c1ccccc1Cl 40846768 MGCNUUSURQTEHQ-XFFZJAGNSA-N 443.731 4.242 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)C1 435561439 UQRWHLWZRAEMNP-GOSISDBHSA-N 444.579 4.170 10 10 IICE CCn1cnnc1-c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435612768 HIWIIGVUMYDPLF-UHFFFAOYSA-N 442.567 4.325 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1 437018365 KZJJEZSQFMICTK-UHFFFAOYSA-N 431.521 4.101 10 10 IICE COc1cccc(N2C(=O)C(O)=C(c3ccc(OC)c(OC)c3)[C@H]2c2ccc(O)c(O)c2)c1 526145291 PEJJIKBRJGBIEV-HSZRJFAPSA-N 449.459 4.181 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 743718649 IMRYTWYBWYNRLI-INIZCTEOSA-N 433.474 4.218 10 10 IICE COCCN(Cc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccc(OC)c(OC)c1 746474177 CORQYJQDDUQWOD-UHFFFAOYSA-N 437.418 4.426 10 10 IICE CO[C@H](C)c1noc(CN(C)CC(=O)c2cc(C)n(-c3cccc(SC)c3)c2C)n1 747965525 AKXDSIAZEDFULM-MRXNPFEDSA-N 428.558 4.221 10 10 IICE C[C@@H](NC(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1)c1ccc(N2CCOCC2)cc1 750625085 NKDJUGHNTKZWGJ-WYIRRWHOSA-N 441.475 4.033 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2ccncn2)c(C)n1-c1ccc(Br)cc1 754940377 JITIBJPHCHBJQE-VMPITWQZSA-N 440.297 4.086 10 10 IICE CN1CC[C@H](NC(=O)NCCCSc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 755083244 JEQBQSLZLHBSEF-JKSUJKDBSA-N 428.986 4.162 10 10 IICE CCOC(=O)c1sc([C@H](C)NC(=O)N(C)Cc2ccc(N(CC)CC)cc2)nc1C 756979169 VKIBOCZUIQZOCE-INIZCTEOSA-N 432.590 4.377 10 10 IICE C[C@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@H](C[C@H]2CCCc3ccccc32)C1=O 761160109 OTGSPODCEMIDCY-MEKIYTOJSA-N 433.552 4.015 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc([N+](=O)[O-])cn2)c(C)n1-c1ccc(OC(F)F)cc1 761982478 VMAJPQJOADTZCC-UHFFFAOYSA-N 445.378 4.038 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)N(C)Cc2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1 783320173 LZICWBOSIRTONL-RXVVDRJESA-N 433.911 4.077 10 10 IICE CCOC(=O)c1csc([C@H]2CCCN2Cc2c(O)c(C(=O)OC)cc3ccccc23)n1 790484002 RYCSSTXFQYHXEM-LJQANCHMSA-N 440.521 4.302 10 10 IICE CC(C)n1ncc2c1C[C@@H](NCc1cc(Br)cc(Br)c1O)CC2 792183449 NRJGNQQLWRSVFI-AWEZNQCLSA-N 443.183 4.342 10 10 IICE Cc1cc(I)cc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c1 1129973586 JXLGMWFCYDTSPY-OAHLLOKOSA-N 436.337 4.335 10 10 IICE Cc1cc(CCNC(=O)c2ccc(S(=O)(=O)C3CCC3)cc2)c(C)n1-c1ccccc1 1132014872 GNBKXQAZQMXTPM-UHFFFAOYSA-N 436.577 4.393 10 10 IICE Cc1cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)c(N)cc1F 1137815063 WTCPTFAKCCSOAR-UHFFFAOYSA-N 432.543 4.333 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(N=S(C)(C)=O)c1 1139590575 XAFMYLKTIZYZNT-UHFFFAOYSA-N 445.585 4.048 10 10 IICE Cc1ccc([C@@H](CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)N2CCCC2)o1 1143106268 JJGBILYHKQCWKL-XMMPIXPASA-N 433.552 4.304 10 10 IICE COc1cc(/C=C\C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc(Br)c1O 1299479047 SPNGLCTXDNTJAT-AJHXJQRKSA-N 447.373 4.298 10 10 IICE Cc1ccc(C(=O)N[C@H](CO)c2csc(C(C)C)n2)cc1-n1c(C)cc(C=O)c1C 1300081764 CDQADROCTJMXOO-LJQANCHMSA-N 425.554 4.258 10 10 IICE CC(C)CCOC1CCN([C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1307443952 IQGYYHDWAZETCT-GOSISDBHSA-N 448.563 4.316 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@@H](CCc3ccccc3)C(F)F)C2)cc1 1312901398 GGCVWJUHXNQKBK-KNQAVFIVSA-N 431.527 4.429 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1313247341 LXZQELJZKKRFIB-IHPCNDPISA-N 431.577 4.492 10 10 IICE Cc1nc([C@H]2CCOC2)sc1C(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F 1360068777 MLDWVVIHJIQZER-HNNXBMFYSA-N 427.492 4.226 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3nn(-c4ccccc4)cc3OCC(C)C)C2)cc1 1436971403 NTJAGCIBSXIIIV-FQEVSTJZSA-N 448.567 4.172 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CC[C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1436972476 QVMZPWOJEWJPBI-WOJBJXKFSA-N 445.604 4.065 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C[C@H]2CCCC[C@H]2O)sc(C)c1-c1ccccc1 1459840668 PBJBIRYNUOBMNB-RTBURBONSA-N 444.597 4.322 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc2n[nH]cc12 1466558346 OKCWZGYHVISNRD-NVMNQCDNSA-N 440.525 4.240 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2c(C)n(C)n(C3CCCCC3)c2=O)cc1 1469726468 NZHANZFSYZMRTH-UHFFFAOYSA-N 448.567 4.402 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)[C@@H](C)C1 1470556134 MZUDIPWDBOWCHE-FHWLQOOXSA-N 432.609 4.031 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CC[C@H](C)C(C)(C)C2)cc1 1501830018 FQANHISRBICVKY-IBGZPJMESA-N 440.636 4.183 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(Cc2ccccc2)CCOCC1 1514714825 GBGJGLNUEYFGLA-FQEVSTJZSA-N 444.522 4.413 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(C)C[C@@H]3CCCCO3)ccc21 1517410459 FHLNNLFKDLDWRR-NRFANRHFSA-N 425.621 4.303 10 10 IICE CO[C@@H](Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1517838124 JOKVTUWQHXSENM-PKTZIBPZSA-N 441.620 4.427 10 10 IICE Cc1ccc(Br)cc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1518326361 SACSXJOFGWGSKM-UHFFFAOYSA-N 442.401 4.220 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1C(C)C 1537483143 MIUJTWGJMPWQNG-XMMPIXPASA-N 433.600 4.403 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC[C@@H](C[C@@H]4CCOC4)C3)nnc2C(C)(C)C)cc1F 1552836758 JLLFSGRDDNSDGN-ICSRJNTNSA-N 443.611 4.472 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(N2CCc3cc(F)ccc32)CC1 1564946563 RVFGHIOSWLNLBU-LJQANCHMSA-N 438.591 4.368 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC([C@@H](F)c2ccccc2F)CC1 1565127011 HWOMEKIFQMCXNH-XMMPIXPASA-N 443.538 4.419 10 10 IICE Nc1c(Br)cccc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1584356883 SPRGXCCHZQKHTR-UHFFFAOYSA-N 440.288 4.032 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(NC(=O)NC(C)C)cc2)c1 1595955216 GVZDUHBZYBNAEN-UHFFFAOYSA-N 432.524 4.367 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1597774727 OKAHTBOZIQBMTK-BVAGGSTKSA-N 435.568 4.150 10 10 IICE COc1cccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 1618253699 QASBYCWMTMXDNJ-FQEVSTJZSA-N 427.545 4.065 10 10 IICE COCCN(CC(C)C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)cc1C 1619896350 DMKQZRNSMOBOLW-QFIPXVFZSA-N 429.609 4.051 10 10 IICE Cc1ccc(NC(=O)CSCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1623733464 JGVPTALEWWMTJU-UHFFFAOYSA-N 435.593 4.433 10 10 IICE Cc1ccc(C(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)cc1-n1c(C)cc(C=O)c1C 1624459570 NLVTWEPKSYUKCQ-GOSISDBHSA-N 449.595 4.326 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(NC(=O)NC(C)C)cc2)CCCC1 1625672624 PTZPFEHAVWKNDJ-UHFFFAOYSA-N 448.567 4.375 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)COc1cc(Cl)ccc1C 1626516976 WFSHBKBMZPAADP-UHFFFAOYSA-N 432.948 4.416 10 10 IICE CCc1ccc(N2C[C@H](C(=O)N(CC)Cc3cc(Br)ccc3O)CC2=O)cc1 1631167300 PAKNPISQTQSOES-QGZVFWFLSA-N 445.357 4.119 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCO[C@@H](C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1637018439 VAEBHYDFBCEELH-VQIMIIECSA-N 434.378 4.433 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)CC[C@@H]1C1CC1 1643394560 LGAGWJHQEKOXMN-YADHBBJMSA-N 427.589 4.471 10 10 IICE CCN(C)c1ccc(CN2CCC([C@@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)CC2)cc1 1646179093 TWAVKVFKBQKFHI-GGAORHGYSA-N 431.621 4.427 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC)cc2OC)sc2c1CC[C@@H](C)C2 1652958584 YICLWEPPCXXYOT-CQSZACIVSA-N 446.569 4.142 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CC2(O)CCCC2)sc(C)c1-c1ccccc1 1653846989 SDMHPXOSBVSGOK-UHFFFAOYSA-N 430.570 4.076 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1654404230 DQAQGALGHWMRNZ-BGYRXZFFSA-N 427.564 4.218 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccccn3)noc2=O)c(C)n1-c1cc(Cl)cc(Cl)c1 1656259553 JKXHEAYHLOWKIU-UHFFFAOYSA-N 443.290 4.496 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCC1(c2cccc(Cl)c2)CCC1 1673472469 MMHXBTABMISDSM-UHFFFAOYSA-N 449.929 4.376 10 10 IICE CC(C)CCN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1692322196 SMHBQMAQDJOORG-UHFFFAOYSA-N 448.615 4.079 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708430563 OOFAFOZFBQHDOX-IPMKNSEASA-N 429.634 4.007 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H](C)C1 1709839285 BERIFMFOQKBBDK-RTBURBONSA-N 448.615 4.361 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1730853574 BYILYPALTIPHDR-NHCUHLMSSA-N 441.620 4.275 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC[C@H]1C 1749214234 CPKICXJFEGYOBJ-NVXWUHKLSA-N 449.671 4.431 10 10 IICE Cc1nc(CCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)cs1 1751791312 NWUBSXSUXVLJCC-UHFFFAOYSA-N 425.583 4.280 10 10 IICE CCC1=NN(Cc2ccccc2Cl)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679316 GZROPWDRAUGCDJ-OQLLNIDSSA-N 427.844 4.211 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](C2(NCc3cc(Br)cc(F)c3O)CC2)C1 2090168175 FQORIJRUZOAUJU-CYBMUJFWSA-N 429.330 4.173 10 10 IICE NCc1ccc(N2C[C@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)cc1Br 2153346179 HOEFWEFFJOTRQO-DHIUTWEWSA-N 426.402 4.400 10 10 IICE O=C1C(=Cc2cc3cc4c(cc3nc2O)OCO4)SC(=S)N1c1cccc(F)c1 2296603287 VENMWPDFRBKWJT-UHFFFAOYSA-N 426.450 4.214 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3cccc(OCCC(=O)O)c3)SC2=S)cc1 2314931442 OGYQTUJXAAUBPN-UHFFFAOYSA-N 429.519 4.345 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3ccc([N+](=O)[O-])s3)SC2=S)N(C)C)cc1 2323880182 ZWVFVHDTJLBIGE-OAHLLOKOSA-N 449.579 4.169 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3)C(=O)C2=Cc2cc(OC)c(O)c(OC)c2)cc1 2332147431 DABJNIOVURUNTD-UHFFFAOYSA-N 444.487 4.248 10 10 IICE CN(Cc1ccc(N)cc1)Cc1ccc(I)c(Br)c1 2349854228 KKPBGZVMIBUFRJ-UHFFFAOYSA-N 431.115 4.268 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCCC4)cc3[C@H]3C=CC[C@H]32)cc1O 14457115 BYWVLKLBRPAYHT-GLDPYIMESA-N 440.565 4.402 10 10 IICE COc1ccc(/C=C2\C(=O)N(c3cccc(Br)c3)C(=S)N=C2O)c(OC)c1 20229003 JCEPBYXKBLOXQO-NVNXTCNLSA-N 447.310 4.138 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1/C=C1\SC(=S)N(CC(C)C)C1=O 33490816 AEHZAVKUOHXIDE-ATVHPVEESA-N 444.626 4.462 10 10 IICE CCOc1cc(N(CC)CC)ccc1/C=C1\C(=O)N(c2ccc(OC)cc2)C(=O)N=C1O 59860068 QSRRTJXRZLBZCZ-ZHZULCJRSA-N 437.496 4.447 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(OC)c(O)c1)N2 226643987 DCTOPAUENYQMDX-UMEGOILYSA-N 435.568 4.299 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CC(c3noc(COc4ccc(F)cc4)n3)C2)cc1 581787213 DYWSEAMCEGSEIJ-UHFFFAOYSA-N 446.482 4.435 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2cc3ccccc3o2)cs1 727245535 BYXWKEIQPKHYNM-UHFFFAOYSA-N 432.479 4.354 10 10 IICE CCn1nc(C(=O)OCC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)c(=O)c2ccccc21 735726005 BQMNZPZFVMNHMM-UHFFFAOYSA-N 443.503 4.172 10 10 IICE COC(=O)c1cccc(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1C 743099511 YDLPIYXVSFXCCQ-HNNXBMFYSA-N 433.455 4.174 10 10 IICE COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)c1 756648681 YDPCFTNNDAUYMX-RISCZKNCSA-N 443.853 4.176 10 10 IICE CC(C)(CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CCCCO1 758743386 YTJBRJKQLQOAPD-LJQANCHMSA-N 425.520 4.151 10 10 IICE C[C@@H](CCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NC(=O)OC(C)(C)C 764989456 YSPPEHCPSVKDFE-JKSUJKDBSA-N 441.519 4.066 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)[C@H]2CCOC[C@H]2C)sc(C)c1-c1ccccc1 769253757 CEMDXFYLAYWZNR-PBHICJAKSA-N 445.537 4.055 10 10 IICE CN1CCN(c2ccc(CN3CCC[C@H](c4nc(-c5cccc(F)c5)no4)C3)cc2)CC1 775670182 VQUOYPYZPLFDBH-NRFANRHFSA-N 435.547 4.007 10 10 IICE Cc1cc(Br)cc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c1O 779001798 BSRWSKRBQSCZBJ-JYJNAYRXSA-N 434.378 4.323 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)c1 781897261 QPJRXVNIESMCKL-UHFFFAOYSA-N 438.753 4.362 10 10 IICE COc1cc(Cl)c(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)cc1OC 790479345 VPUJITPTQGMGID-UHFFFAOYSA-N 436.942 4.380 10 10 IICE CCCN(CCC)c1ccc(CNc2cccc(S(=O)(=O)NC3=NCCC3)c2)cc1 796387666 FDULBJRWOOUPEF-UHFFFAOYSA-N 428.602 4.396 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](c3cnn(C)c3)C(F)(F)F)cc2Cl)C1 800565220 IMYMCOPJOHLGNE-SCLBCKFNSA-N 443.901 4.413 10 10 IICE Cc1cc(C(=O)N2CCC(n3cc(N(C)C)cn3)CC2)c(C)n1-c1ccc(Cl)cc1 820510541 PSSIQAULLKZZPV-UHFFFAOYSA-N 425.964 4.487 10 10 IICE COc1ccc2c(c1)c1c(n2Cc2nc([C@H]3CCC(=O)N(CC4CCC4)C3)no2)CCCC1 856538246 QSUMGUPAVUXASH-SFHVURJKSA-N 448.567 4.466 10 10 IICE CCc1nc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cs1 1126259799 HDXSNQWTHNPFGM-YUSFRKCESA-N 449.598 4.313 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@@H]2CCCC[C@H]12 1146320249 PKMUOBRDZSZAPI-WXFUMESZSA-N 436.552 4.029 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1CCCCN1Cc1ccccc1 1148444218 PSFRLMLGBFLLDD-NFBKMPQASA-N 443.538 4.428 10 10 IICE Cc1cc(C(=O)N[C@H](C2CCC2)[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1149525907 ZTTAZSIGHDFMFA-AZUAARDMSA-N 432.362 4.329 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)CCC[C@H]12 1151903581 ORDYTUQZNLBVHL-FZOAFFARSA-N 444.572 4.080 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CO[C@H](CN(Cc3ccco3)Cc3ccccc3O)C2)C1 1167982634 FMXGMRVQNWBNTF-SQJMNOBHSA-N 442.556 4.404 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2CC[C@@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1230693954 NLMXTYIDAJXVGM-RTWAWAEBSA-N 425.573 4.446 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)c1 1272211054 KOUXUNHSHXFABK-SFHVURJKSA-N 428.964 4.158 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1 1278288592 MFTFUKDXYWNDHF-UHFFFAOYSA-N 432.446 4.108 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2Cc2cscc2C)cs1 1290392103 JKFKJMGOONZQCB-UHFFFAOYSA-N 425.583 4.394 10 10 IICE O=C(CCC(=O)c1c(F)cccc1F)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1292594731 YGQZVFXNWGHSQJ-UHFFFAOYSA-N 438.421 4.314 10 10 IICE COC(=O)[C@H](C)[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1294481962 PVPRDEZMBJGHCR-HOYKHHGWSA-N 432.520 4.495 10 10 IICE CN(C)c1ccc(Cn2c(C3CCC3)nnc2N2CCO[C@@](C)(C(C)(C)C)C2)cc1F 1298056986 ZUGAOTBIROYJAK-XMMPIXPASA-N 429.584 4.440 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1C[C@@H]1CCCO[C@H]1C(C)(C)C 1298363918 OLNNWVBGUXWMDL-SIKLNZKXSA-N 437.588 4.467 10 10 IICE Cc1cc(C(=O)N2NC(=O)C[C@H]2c2ccccc2)c(C)n1-c1ccccc1Br 1306124906 XZDZKGLTGWERJA-FQEVSTJZSA-N 438.325 4.475 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3cc(C(C)C)ccc3C)cc2F)CC1 1352959979 JPYAQPALXAGSFD-HXUWFJFHSA-N 441.591 4.483 10 10 IICE CC(C)COc1cccc(OCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1355131198 UESBDFFKALKGHX-RTBURBONSA-N 444.547 4.169 10 10 IICE CCOC(=O)CN(CC(F)(F)F)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1355984254 OOPWYESLZGUBRM-UHFFFAOYSA-N 430.854 4.244 10 10 IICE CC(C)Cc1nnc(N(C)Cc2nccs2)n1Cc1ccc(N2CCSCC2)cc1 1359782270 NOBDAZCVFGLIFY-UHFFFAOYSA-N 442.658 4.171 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4cccc(F)c4)c3C(F)(F)F)C2)cc1 1437580105 QMNHJMXFWCTQSL-HNNXBMFYSA-N 448.420 4.048 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@@H]3CCCC[C@@H]32)c(C)n1-c1ccc(C(C)C)cc1 1445952387 BKDUSOJJLVSHLY-XZOQPEGZSA-N 428.598 4.399 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc(I)c(Cl)c2)cc1 1456619375 QQKOGZVUWVJWPT-UHFFFAOYSA-N 428.617 4.359 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ccc(F)cc32)c(C)n1-c1ccc(Br)cn1 1465512202 UWGIKILQXMKEKE-UHFFFAOYSA-N 443.320 4.487 10 10 IICE COC(=O)/C=C\c1ccc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c([N+](=O)[O-])c1 1472687109 SDZQKGFNFUQJMF-ZETNRXDVSA-N 445.903 4.217 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)cc1OC 1473028173 OYCFIBOHEFPGKN-UHFFFAOYSA-N 428.872 4.199 10 10 IICE Cc1csc([C@@H](C)Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)n1 1492637930 AYGACBXCHIOPPR-INIZCTEOSA-N 434.569 4.175 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4ccc(Br)cc4)CC3)C2)cc1 1529705883 BGKQSTAVZZBYIG-MRXNPFEDSA-N 429.358 4.132 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc(-n4nccc4C(F)(F)F)c3)C2)cc1 1537109728 QZWSIQWDANONBT-INIZCTEOSA-N 444.457 4.156 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CO[C@@H]3C[C@H](C)CC[C@@H]3C(C)C)cc2F)CC1 1537534680 FYGUUJCYTXWEFJ-ZILOHOTNSA-N 433.612 4.061 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCCN(C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1544304379 WJOBZODSZJIKFX-QGZVFWFLSA-N 433.394 4.102 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(OCc2ccccc2)ccc1O 1544538499 QMVUZBXRLNTIIX-UHFFFAOYSA-N 446.547 4.110 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@H](C1CCCCC1)N(C)C 1554174899 DLFZNXLVXOMNNA-HSZRJFAPSA-N 448.615 4.116 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H](OCC1CCCC1)c1ccccc1 1565985347 BXDCCEVWPLAVMA-SANMLTNESA-N 436.596 4.460 10 10 IICE C[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1c(Cl)cccc1Cl 1584506640 DZEZFWVYWWFOTL-AWEZNQCLSA-N 434.367 4.115 10 10 IICE COCCN(CC(=O)NCc1ccc(N(C)C)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 1615323905 XQNZEXYUEXKSTO-KRWDZBQOSA-N 437.506 4.097 10 10 IICE Cc1cc(Nc2ccc3c(c2)CCCC3)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(O)n1 1624955344 XQJFCPJRZDGADT-OAHLLOKOSA-N 447.535 4.490 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccc(I)c(F)c1 1625684012 IKJAHJPRCJMSSN-UHFFFAOYSA-N 440.039 4.373 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccc(N3CCOCC3)cc2)c1 1626693209 JUZXYFDXTBCBLK-UHFFFAOYSA-N 445.947 4.454 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 1628667391 UYKPOMGIXFPZMH-UHFFFAOYSA-N 436.821 4.453 10 10 IICE COc1cc2c(cc1CNC(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)O[C@@H](C)C2 1630920517 OAQQRNFEVVAKNA-KRWDZBQOSA-N 432.520 4.477 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1csc(-c2ccc(Cl)s2)n1 1638529136 FYCHPHHLRCVXST-UHFFFAOYSA-N 436.942 4.436 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1CN(Cc2ccccc2)CC12CCC2 1640087914 MYMSVBJEDNJSPZ-SFHVURJKSA-N 429.358 4.073 10 10 IICE CCC[C@@H](O)CCCS[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1644147593 PZOPFADIRLSRJZ-DOTOQJQBSA-N 425.550 4.463 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H](C(C)(C)O)C2)sc(C)c1-c1ccccc1 1644427693 DUSWUMLPLUIPQZ-SFHVURJKSA-N 444.597 4.322 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCOC23CCCCC3)c(C)n1-c1ccc(Br)cn1 1646162730 IEYJWSCMKNJFER-GOSISDBHSA-N 432.362 4.473 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3F)c3ccc(F)cc3)nc12 1653668821 ZYBWRIIYNJTFHA-UHFFFAOYSA-N 438.434 4.097 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]1CN(C)C(=O)OC(C)(C)C 1683253279 GQGKLHIQVQWYMM-RXVVDRJESA-N 432.609 4.033 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC(C)(C)c3ccc(Br)cc3)C2)cc1 1683782618 REQGNPTZBVMGGX-QGZVFWFLSA-N 432.362 4.271 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2ccc(F)cc2F)CCCC1 1684281285 WXXFTFDIGJRJMN-UHFFFAOYSA-N 429.511 4.195 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCS[C@H](C(C)C)C1 1693005777 LOUQUJXORPGVRG-QFIPXVFZSA-N 436.629 4.341 10 10 IICE CCCCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1709623472 HHVXOZGNPNAVOO-UHFFFAOYSA-N 440.979 4.267 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1 1712363610 KZZKJOYLCFHVRK-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)OC 1728448491 SVDWMSQNGHLNRU-IBGZPJMESA-N 447.587 4.148 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(Cc3cccc(C(=O)O)c3)C2=O)ccc1OC 1860825226 UJMYNSFOBJTMMC-WOJGMQOQSA-N 429.519 4.194 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)c2c3c(nc4ccc(F)cc24)CCC3)c2nccn2C)cc1 1866273221 YFYUNZBESBUSGL-XMMPIXPASA-N 443.526 4.182 10 10 IICE CCc1cccc(C)c1N1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC)CCCC3)CC1=O 1873427549 YOOGPJIYDSDZTK-INIZCTEOSA-N 440.565 4.276 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@@H]1CNCc1ccc(Br)cc1O 1967785857 AGYHIBQUWYTFTD-MRXNPFEDSA-N 425.367 4.424 10 10 IICE Cc1cccc(COc2ccccc2C=C2C(=O)NC(=O)N(c3ccccc3F)C2=O)c1 2297340982 VEAXILWIRYAAOF-UHFFFAOYSA-N 430.435 4.380 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3)C2=O)cc1 2313548476 VXJUHCHFKQKWSO-UHFFFAOYSA-N 442.471 4.331 10 10 IICE Cc1ccc(CNCC[C@H](NC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2352941264 OTCUUNRIERZDRI-LBPRGKRZSA-N 441.288 4.398 10 10 IICE Cc1cccc(COc2ccc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)cc2)c1 20356298 KBDYBBHKGNERQU-BJRGRWSZSA-N 445.548 4.246 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@@H](c2cccnc2)c2ccc3cccnc3c2O)c1 54620936 NCINUFKDONDFPN-NRFANRHFSA-N 443.459 4.110 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)C1 436021651 JJIXFMNIWHSARW-RLWLMLJZSA-N 431.580 4.444 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@H]3C[C@H]3c3cccc4ccccc34)CC2)cc1 730769391 FDPAVVJIXDFGML-SVBPBHIXSA-N 443.591 4.280 10 10 IICE Cc1cc(C(=O)OCC(=O)Nc2ccnn2CC2CCCCC2)c(C)n1-c1ccccn1 744691742 LBSQDGZJOHUCAC-UHFFFAOYSA-N 435.528 4.061 10 10 IICE CSCC[C@H](NC(=O)c1ccccc1)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 746429596 OBCLJUYQGYPUCW-DEOSSOPVSA-N 449.620 4.305 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](CN[C@@H](C)c3ccc(Br)cc3O)C2)c1 756648936 BIDWIVUGLFOHRW-GJZGRUSLSA-N 435.362 4.349 10 10 IICE C[C@H](NCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccc(N2CCOCC2)cc1 775256509 YTAFNZGOXHPLHV-HNNXBMFYSA-N 432.446 4.443 10 10 IICE C[C@H](NCc1cc(Br)cc(Br)c1O)c1nnc2n1CCCCC2 775935053 AAYISJVAOONFMT-JTQLQIEISA-N 444.171 4.086 10 10 IICE O=[N+]([O-])c1cc(CNCc2cc(Cl)ccc2N2CCOCC2)ccc1N1CCCCC1 798499120 MURGZRHUCSNQNG-UHFFFAOYSA-N 444.963 4.365 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccccc3C)C2=O)cc(OC)c1OC(C)=O 814275774 KFDGCFLBLAOJQX-WOJGMQOQSA-N 429.519 4.343 10 10 IICE Cc1ccc(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)cc1-n1c(C)cc(C=O)c1C 1136272395 GMHACQAXXIVESB-UHFFFAOYSA-N 439.556 4.344 10 10 IICE COc1cc(F)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(F)c1 1147503591 BFQYYZOMJOPSCR-IBGZPJMESA-N 449.498 4.035 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CC[C@@H](C(=O)OC(C)(C)C)c3ccccc32)C1 1168421844 QIOIQAMSLRTKEQ-PKOBYXMFSA-N 442.556 4.462 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cccc2ocnc12 1269441429 HRMNOGLCRJQMSI-YBEGLDIGSA-N 427.482 4.197 10 10 IICE CC(C)Cc1nnc(N(C)CC2CC(F)C2)n1Cc1ccc(N2CCSCC2)cc1 1287369627 YHMCEDLDFPBCHP-UHFFFAOYSA-N 431.625 4.262 10 10 IICE Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)n1 1291766432 LZDZHAFFXIVBNS-OAQYLSRUSA-N 430.552 4.217 10 10 IICE COc1ccc(N2CCN(C(=O)Cn3c(C)c(Br)c4ccccc43)CC2)cc1 1294755166 CQWJXRHRTOQGMH-UHFFFAOYSA-N 442.357 4.070 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C[C@@H](c2nccn2C)C(F)(F)F)cc1 1300091522 GIBQTCRIZTTXIB-HNNXBMFYSA-N 436.400 4.113 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3(OC)CCCCC3)CC2)cc1 1300246517 CBEVQKOBYWDIOI-UHFFFAOYSA-N 441.620 4.476 10 10 IICE COCCC(C)(C)Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1301419014 YRKFSPHKUJCOLN-UHFFFAOYSA-N 429.609 4.190 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)[C@@H]1C 1301628651 UXYOFCIMORROMW-FQEVSTJZSA-N 437.588 4.393 10 10 IICE CC[C@@H](C)N[C@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccco1 1306840153 PHQBUVRZOQSNIU-DENIHFKCSA-N 436.600 4.246 10 10 IICE Cc1cc(-c2nnc(N(C)CCOC(C)(C)C)n2CC2(O)CC2)c(C)n1-c1ccccc1 1361049064 RIUCPSHLXWWQKK-UHFFFAOYSA-N 437.588 4.129 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cn(-c4ccccc4)nc3C(C)(C)C)C2)cc1 1436971668 OLCRJMIEAMUVCS-LJQANCHMSA-N 432.568 4.435 10 10 IICE COc1ccc(/C=C(/C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1F 1445887974 WKIBBNHKHSYGLU-XZGNNNQISA-N 432.923 4.377 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4c(Br)cccc4[nH]3)C2)cc1 1452035283 ZDFCFIGJRZEJOT-CQSZACIVSA-N 428.330 4.195 10 10 IICE O=C(NCc1cc(O)ccc1O)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1 1455356623 JTLYVXYWCTWNAS-UHFFFAOYSA-N 433.504 4.041 10 10 IICE Cc1ncccc1[C@H](C)OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1461686728 CMZKRKPOBPCBCU-HIXWQLQUSA-N 430.526 4.425 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc3nc(C(F)F)[nH]c23)cc1 1464601406 DRUSDRIEEYKNOM-KRWDZBQOSA-N 428.483 4.388 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(CO)(Cc2ccccc2)CC1 1467569259 OYXCBSWZJNBKTL-UHFFFAOYSA-N 430.548 4.364 10 10 IICE Oc1ccc2c(c1CNc1ncnc3cc(I)sc13)CCCC2 1472707314 ADGDYBSVRAFIHM-UHFFFAOYSA-N 437.306 4.492 10 10 IICE COc1ccc([C@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)C2CCC2)cc1 1479473215 XXDJPTAQEFWVEO-HSZRJFAPSA-N 427.520 4.216 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1512865449 QNJJMAINBIZOLL-MOPGFXCFSA-N 443.661 4.397 10 10 IICE CCCN(CC(F)(F)F)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1514953329 KDFJJBSRAONUSJ-GXDHUFHOSA-N 434.480 4.218 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(OCC(F)(F)F)cn1 1515924923 JAGONDVHNDDWCQ-UHFFFAOYSA-N 426.350 4.050 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC(C)C)C1 1519477276 OSBGHIUJHLNRND-JOCHJYFZSA-N 437.588 4.393 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(SC(F)(F)F)cc1 1528262011 SWLAFJHVORNRNM-UHFFFAOYSA-N 432.414 4.343 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ncc(F)cc1Cl 1530163864 WCDVZVGVPWGTQH-VGOFMYFVSA-N 439.896 4.243 10 10 IICE COc1ccc(N2CCN(C(=O)C/C=C\c3ccc(Br)cc3)CC2)c(OC)c1 1530968791 YXNBSEHRJJAQJY-ARJAWSKDSA-N 445.357 4.218 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)Cc3cc(Cl)cc4ccccc34)cc2)CC1 1535157647 XGSCIBTYQVYAPX-UHFFFAOYSA-N 435.955 4.054 10 10 IICE COc1cc(N2CCN(C(=O)c3ccccc3CC(C)(C)C)CC2)cc(OC)c1OC 1536633039 FNWVOKWOGSVMBE-UHFFFAOYSA-N 426.557 4.263 10 10 IICE Cc1cc(C)n(-c2ccc(CNC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)cn2)n1 1541626200 CBBLNHVAJRBDTR-UHFFFAOYSA-N 441.535 4.343 10 10 IICE COc1ccc(-c2nnc(Nc3ccn(C)n3)n2CCCSc2nccs2)cc1 1554876960 KGCQODIUEJHQSE-UHFFFAOYSA-N 427.559 4.070 10 10 IICE CN(C)c1ccc(CN(C[C@H]2C[C@]3(CCN(C(=O)OC(C)(C)C)C3)CO2)C2CC2)cc1 1559492460 QFQKEJODABXVOO-RDGATRHJSA-N 429.605 4.133 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCCCC[C@H]1C(=O)NCc1ccc2cccnc2c1O 1570533775 QAIBEOYDPTYRLG-MOPGFXCFSA-N 427.545 4.420 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(C)c(S(=O)(=O)N(C)C)c3)c2C)c1 1586856500 OZUCCIXFBNGOBH-UHFFFAOYSA-N 425.554 4.214 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)/C(F)=C/c1ccc(C(F)(F)F)cc1 1596695027 MAKVVEVCPKRGBB-WQRHYEAKSA-N 426.385 4.308 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1614103447 QOGIHMWQCBIGIJ-CTNGQTDRSA-N 438.620 4.033 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1 1616532471 CBDVRMKKFPMZQR-UHFFFAOYSA-N 440.544 4.048 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)cc1 1622527034 ULRQRYGFTFZIID-JOCHJYFZSA-N 444.453 4.318 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3nc(-c4ccccc4)cs3)cc2F)C[C@H](C)O1 1626159476 YHYXTPAZMUXANF-IRXDYDNUSA-N 439.556 4.422 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 1626885491 ABEVNANZOWLDIU-QFIPXVFZSA-N 425.573 4.410 10 10 IICE Cc1cc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1628218585 GLSKIUWIWIVXLO-OAHLLOKOSA-N 445.405 4.198 10 10 IICE Cc1cc(CCNC(=O)[C@]23C[C@H](NC(=O)OC(C)(C)C)C[C@H]2C3)c(C)n1-c1ccccc1 1631356394 IGHUREAQBMKGFB-LZCXECNNSA-N 437.584 4.446 10 10 IICE CCNC(=O)c1cc(Cl)ccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1632583873 WDJBBHSTHUYHEC-UHFFFAOYSA-N 437.927 4.491 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C(F)(F)F)c(C)n1-c1ccccc1Br 1634080867 CMKSWCFGVZGTTB-MRXNPFEDSA-N 431.252 4.260 10 10 IICE CN(c1ccccc1)c1nc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)cs1 1634348243 VWBYLPIJNQYWKA-UHFFFAOYSA-N 436.581 4.050 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@@H]3CCC4(CCOCC4)CO3)c2C)c1 1637577605 FESMYBYKNXNLGE-QHCPKHFHSA-N 425.573 4.178 10 10 IICE CC1(C)C[C@@H](NC(=O)NCc2cccc(Cl)c2O)CCN(C(=O)OC(C)(C)C)C1 1675056725 XTWCMJWHAWMJGT-HNNXBMFYSA-N 425.957 4.271 10 10 IICE CCN(c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1)[C@H](C)C1CCC1 1695524716 CLISYYKYMBITBC-GOSISDBHSA-N 429.584 4.440 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@]1(C)CCCS1 1696248656 PJACVGWIWGIXKK-QHCPKHFHSA-N 429.634 4.337 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](C)C(F)(F)[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1708570087 SJVGXBYGSXVFTR-QRVBRYPASA-N 447.574 4.404 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CCO1 1727326033 CFXDXVWNRROMPW-RUZDIDTESA-N 434.588 4.077 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCCN(C(C)=O)C1 1728270624 GXDKHMGTLPXELP-OAQYLSRUSA-N 434.588 4.067 10 10 IICE CC(C)CCN(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1750786726 RYONETJONSFZJL-UHFFFAOYSA-N 425.621 4.285 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC[C@H]3CCCCO3)CC2)cc1 1770258570 QASZLTGSLOCBGV-JOCHJYFZSA-N 427.593 4.086 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1C1CC(C(C)(C)C)C1 1771283831 ZAUIQXIOQASTNU-OXKPJDFFSA-N 428.577 4.341 10 10 IICE CSCCCn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1771483030 AKIBGDZAMOGHRI-UHFFFAOYSA-N 436.629 4.254 10 10 IICE COc1ccc(N2CCCCC2)cc1NC(=O)[C@@H](CC(C)C)N1C(=O)c2ccccc2C1=O 1858033547 RBAYXUHWMOPPHQ-JOCHJYFZSA-N 449.551 4.335 10 10 IICE Cc1nc2scc(C)n2c1/C=C1/SC(=S)N(Cc2ccc(C(=O)O)cc2)C1=O 1858590673 DJCWEUJTJXFGQS-VIZOYTHASA-N 429.548 4.112 10 10 IICE COc1ccc(N2CCN(C(=O)CCn3ccc4cc(Br)ccc43)CC2)cc1 1860228360 HDJZEQZCZIQSMY-UHFFFAOYSA-N 442.357 4.151 10 10 IICE COC(=O)Nc1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3F)cs2)cc1 1891615112 VMERJOGHBBXFET-UHFFFAOYSA-N 425.438 4.067 10 10 IICE O=C(OCC1c2ccccc2-c2ccccc21)N1CC[C@@](C(=O)O)(c2cccc(O)c2O)C1 1951727009 YLGRMNIFAYMSPH-SANMLTNESA-N 445.471 4.075 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]21CNCc1cc(Br)ccc1O 2089360470 XPTPOBMWCWDEEY-QRWLVFNGSA-N 425.367 4.424 10 10 IICE CCOC(=O)c1cccc(-n2c(C)cc(C=C3NC(=O)N(c4ccccc4)C3=O)c2C)c1 2293556300 PEYUYMUUTNCNAG-UHFFFAOYSA-N 429.476 4.368 10 10 IICE Cc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccc(C(=O)O)cc3)C2=O)cc1 2295927447 LKTJNBQCLIXHPG-UHFFFAOYSA-N 440.546 4.313 10 10 IICE CCn1cc(C=C2C(=O)NC(=O)N(c3cccc(C(F)(F)F)c3)C2=O)c2ccccc21 2296944795 LKQPOOQJXKIRHG-UHFFFAOYSA-N 427.382 4.346 10 10 IICE Cc1ccc(CN(C)[C@@H]2CC[C@H]2NC(=O)OCc2ccccc2)c(O)c1Br 2307568093 AERHTNWOLNVEEH-QZTJIDSGSA-N 433.346 4.352 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccccc1OCc1ccccc1F 2313559244 UTTFTBRDIOLRRQ-UHFFFAOYSA-N 434.398 4.210 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(O)c3)C2=O)ccc1OCCC(=O)O 2314935058 MXYRLWIFQORQQQ-UHFFFAOYSA-N 445.518 4.050 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C/c1c(C)nn(-c2ccc(Br)cc2)c1O 1190737 GCSPYXIFPSQZEA-LDADJPATSA-N 437.297 4.455 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457140 HMRJNLLOXFBFOO-PNCHPQGNSA-N 428.554 4.258 10 10 IICE CCCNS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(OC)c(OC)c1)N2 14479434 GTEMQVYYVWFXHU-PNCHPQGNSA-N 428.554 4.219 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/Nc1nc2ccc(Cl)cc2s1 101350030 YXUYUTGUGRNQOY-XYOKQWHBSA-N 433.276 4.182 10 10 IICE COc1ccc(O)c(CNc2ccc(I)c(Br)c2)c1 311732333 OUBSEFVGVAPGQL-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2noc(-c3ccccc3)n2)C1 435819008 RDXIBGJXTRHAMG-GOSISDBHSA-N 443.551 4.335 10 10 IICE CCn1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)c(=O)c2ccccc21 735728591 VDCIXDRGJQVQFH-UHFFFAOYSA-N 447.466 4.003 10 10 IICE COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)cs2)c1 743045484 MFEJDKKXYUAAAP-UHFFFAOYSA-N 438.914 4.060 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCC[C@H]1CCCCO1 754774023 DIGNBMCPGSSMBT-UMWKZLPKSA-N 425.597 4.232 10 10 IICE C[C@H](N[C@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(N2CCOCC2)c(F)c1 776931974 OROWHLNAWLTKPR-AVRDEDQJSA-N 432.543 4.327 10 10 IICE Cc1cc(Br)c(O)c(CNC2CCN(C(=O)CCc3ccccc3)CC2)c1 781626744 LUALYMDYNRXQLJ-UHFFFAOYSA-N 431.374 4.177 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc(Cl)ccc3OC(C)C)CC2)cc1 1124514399 OEFJNNFUBCXRBB-UHFFFAOYSA-N 445.991 4.078 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccc(Cl)cn1 1134542201 LYVKFUUIASLKNU-UHFFFAOYSA-N 428.677 4.460 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 1135745939 IBWLBWXYUYKLMK-SQJMNOBHSA-N 445.604 4.050 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(I)c1O 1136335314 VTIOBHSLPSXICF-UHFFFAOYSA-N 438.309 4.114 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)c2)n1 1137727362 HLJDTYZXUJSWOT-FQEVSTJZSA-N 448.523 4.070 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)s1 1140172732 ZKPCSNNGOPIZNO-CVEARBPZSA-N 439.585 4.210 10 10 IICE C[C@H](NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]([C@@H]2CCCO2)C1)c1ccc(N(C)C)cc1 1154667996 BBJRLHMNPOCSGJ-TZEULACYSA-N 445.604 4.125 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3ccccc3OC2)c(C)n1-c1ccc(Br)cn1 1155585008 QIPZBJKITFATHQ-SFHVURJKSA-N 440.341 4.375 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCCO[C@H](CNC(=O)OC(C)(C)C)C2)c1 1161110181 QRLFRGWFBGPGHH-HXUWFJFHSA-N 441.572 4.158 10 10 IICE COc1ccc(C)cc1[C@H](C)N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1170967359 RVIZLUQDXUDGRU-IRXDYDNUSA-N 442.515 4.457 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c(OC)n1 1298837395 DAWVFLXPSNISSD-UHFFFAOYSA-N 444.329 4.199 10 10 IICE Cc1ccc(C(=O)N[C@@H](CO)c2csc(C(C)C)n2)cc1-n1c(C)cc(C=O)c1C 1300081763 CDQADROCTJMXOO-IBGZPJMESA-N 425.554 4.258 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@](C)(O)CCC(C)C)CC2)cc1 1300246403 AEFVRGFOPNRADR-RUZDIDTESA-N 443.636 4.314 10 10 IICE CO[C@H](Cn1c(-c2cnccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)(C)C 1315202609 CHBBLVDSEIUIFC-JOCHJYFZSA-N 449.603 4.033 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 1352893332 ZCMZKAFFIWCLNY-UXHICEINSA-N 431.439 4.085 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1CC[C@@H]1c1ccc(F)cc1 1354326863 DJYFKJNWDXQVGB-UXHICEINSA-N 436.449 4.491 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(-n4nc(C)c(Cl)c4C)cc3)C2)cc1 1436972508 RIPPPRPXIWRHTH-SFHVURJKSA-N 438.959 4.407 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@@H]1OCc2ccccc21 1440132755 DPVADRRLWXKEKJ-PBXDPIQXSA-N 444.603 4.117 10 10 IICE Cc1cc(C)cc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1448338222 MKYOGIJUPYAMGA-FQEVSTJZSA-N 442.357 4.332 10 10 IICE O=C(CSc1ccc([N+](=O)[O-])cc1F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1459033578 RDFSBXYTSWGMAH-UHFFFAOYSA-N 436.420 4.240 10 10 IICE Cc1cc(CC(=O)N2CCN(c3cccc(F)n3)CC2)c(C)n1-c1ccc(Cl)cc1 1460241107 MTSHUQVDVOFKDI-UHFFFAOYSA-N 426.923 4.173 10 10 IICE CN(c1ccc(CNC(=O)c2cc(F)cc(N3CCOCC3)c2)cc1)C1CCCCC1 1464544389 YKXSZSLMHOFKLR-UHFFFAOYSA-N 425.548 4.361 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)/C=C\CN(C)CC(F)(F)F)cc1 1464956770 MOMCLIOJHGSHGA-WAYWQWQTSA-N 435.490 4.345 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCc2c(Cl)cccc2OC(F)F)N(C)C)cc1 1471091894 QQDIPTQZXHQOBX-GOSISDBHSA-N 440.922 4.110 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@@H](C)c3ccc4ccccc4c3)CC2)c(OC)c1 1473732277 FOLSOUBZXLJKNB-VQTJNVASSA-N 447.579 4.245 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1478375940 FGCCUSFIBMPFRW-LJQANCHMSA-N 433.911 4.302 10 10 IICE CN(C)c1ccc(CN(C(=O)NCCC2CCN(C(=O)OC(C)(C)C)CC2)C2CC2)cc1 1478903515 ZZTFBTAKCRYEFQ-UHFFFAOYSA-N 444.620 4.464 10 10 IICE CN(Cc1ccc(Br)s1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1479535949 ZEYBKXUIPNLLQV-QGZVFWFLSA-N 439.423 4.021 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1500010005 WWQAWLQSMRLEPY-GOSISDBHSA-N 446.603 4.402 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@H]1CC[C@@H](F)C1 1503474030 VJUAVGHNVHNXCX-LEWJYISDSA-N 443.611 4.478 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1 1515929562 XFMCSWGLPRWOEN-OAHLLOKOSA-N 432.476 4.014 10 10 IICE COc1cc(F)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(Cl)c1 1524066981 JNAPOGHRJYGWQL-GFCCVEGCSA-N 428.838 4.488 10 10 IICE C[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528262106 VGNHFJCOJFRXTE-INIZCTEOSA-N 426.463 4.038 10 10 IICE COC[C@]1(C(=O)OC)CCCCN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1533734390 JDRGZRSEKKQGIR-DEOSSOPVSA-N 438.528 4.352 10 10 IICE Cc1cccc(CNC(=O)c2ccc(C(=O)Nc3cccc(N4CCOCC4)c3)cc2)c1 1537157635 SOOKRMRGEMVHED-UHFFFAOYSA-N 429.520 4.014 10 10 IICE CC(C)c1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1543756496 CBMOZTWKGZYZGF-WOJBJXKFSA-N 425.621 4.283 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(N(CC)CC)nc1 1546418513 BZRYYGWLIZTLDY-UHFFFAOYSA-N 447.631 4.367 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CCC[C@@H]3C)CC2)cc1F 1554960218 CMWTWAHBRWCGBU-OALUTQOASA-N 429.584 4.387 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H]3CCCN(C(=O)C(F)(F)F)C3)c2C)c1 1557249638 MODSSAZABYCSQR-SFHVURJKSA-N 435.490 4.242 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1C 1565905856 CPEVCFRELOKVSK-QFQXNSOFSA-N 431.580 4.422 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F 1568737949 UMXIIOJHHPJNOX-UHFFFAOYSA-N 428.382 4.152 10 10 IICE Cc1ccc(C(=O)NCc2ccccc2OCCN(C)C)cc1-n1c(C)cc(C=O)c1C 1583604650 DYZIFLDSMUWCRA-UHFFFAOYSA-N 433.552 4.085 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)cc1 1585933096 TUQHYTOTEBKXDP-VWLOTQADSA-N 443.547 4.103 10 10 IICE Cc1ccccc1OCCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1586620546 ZAPZEQQZFWZFRC-OAQYLSRUSA-N 441.572 4.212 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3CC(c4ccc(Cl)cc4Cl)=NO3)CC2)cc1 1596965226 WYOVIQJYPKXGSA-NRFANRHFSA-N 448.350 4.234 10 10 IICE C[C@H](NC(=O)c1cc2c(F)c(Br)ccc2[nH]1)c1ccc(N2CCOCC2)cc1 1597914371 CIHWDHLPSKCBQH-ZDUSSCGKSA-N 446.320 4.397 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1)OC 1613613044 FSOORUCGQSBPSE-SIKLNZKXSA-N 437.588 4.393 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O 1614540873 YGHUHEZEMVBGDQ-IFMALSPDSA-N 427.593 4.126 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)cc1 1624286105 HIQBKRJTSNQLSE-QGZVFWFLSA-N 432.520 4.315 10 10 IICE Cc1cc(C(=O)NCc2nc(C(F)F)no2)c(C)n1-c1ccccc1Br 1627090761 BISNEXDEVYDQAV-UHFFFAOYSA-N 425.233 4.107 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c1 1628735338 AMHFMUZDQWZXBU-UHFFFAOYSA-N 443.547 4.075 10 10 IICE CC[C@@H](Nc1cccnc1Cl)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630262665 OHKCFRINCXJTOG-IAGOWNOFSA-N 437.371 4.065 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cccc(NCc4nc(C)cs4)c3)CC2)cc1 1630718109 MBUKYKAUQMTOMG-UHFFFAOYSA-N 436.581 4.425 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@@H]2C[C@H](C)O)c(C)n1-c1ccc(Br)cn1 1640432423 DFWHOVHCBRPLIM-MAUKXSAKSA-N 434.378 4.407 10 10 IICE Cc1cccc(N2CCN(CCC(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1642459754 WJYRDZRYPZRUFE-UHFFFAOYSA-N 430.596 4.231 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C)c(OCc2cccnc2)c(C)c1 1643245353 NPLCYQVXPQAOOT-UHFFFAOYSA-N 448.519 4.189 10 10 IICE Cc1cnn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1C(=O)NCc1cccc(Cl)c1O 1648609227 UUYCZOCPSDEIAW-INIZCTEOSA-N 448.951 4.053 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](CC3CCCC3)c3ccccc3)CC2)cc1 1653967384 GOZAVBRAQHOTKD-VPUSJEBWSA-N 437.628 4.089 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](CC3CC3)c3ccccc3)cc2F)C[C@@H](C)O1 1658037659 HBQNEIXHPDBWRI-KHCICDEESA-N 439.575 4.187 10 10 IICE C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1)c1ccccc1O 1671808472 KHNLSQCCDXDXNH-CQSZACIVSA-N 435.446 4.076 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCc3ccc(OCc4ccccc4)cc3)cc2)CC1 1674825841 JAIIUKXRELGWCH-UHFFFAOYSA-N 444.579 4.017 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(OCC4CCCCC4)CC3)C2)cc1 1683336804 LTLXYARASNDIIQ-OAQYLSRUSA-N 429.605 4.292 10 10 IICE CCN(Cc1ccccc1Br)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684606480 GHCJJFFKWSOBNR-NRFANRHFSA-N 447.421 4.350 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N(C)Cc2ncc(Cl)n2C)cc1 1710023801 DHEWZCHDAUMSDF-UHFFFAOYSA-N 430.000 4.319 10 10 IICE CCO[C@@H]1CCCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C1 1710614518 RHYHSMAOGKYWJL-JOCHJYFZSA-N 436.604 4.183 10 10 IICE C[C@H]1CCC[C@H](N(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1726519844 AHTFNOKOCKQGRY-HOTGVXAUSA-N 429.619 4.389 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1nnc(C)s1 1743564792 WOOUKTOAZMZJJV-KRWDZBQOSA-N 439.633 4.431 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2cccnc2Cl)sc(C)c1-c1ccc(C)cc1 1860750534 PPJHTEFMQWDGPA-UHFFFAOYSA-N 443.912 4.444 10 10 IICE CCNC(=O)COc1cn(CC(C)C)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1870969814 AEAWXZYZYUHBAJ-UHFFFAOYSA-N 448.567 4.375 10 10 IICE CN1CCc2cc([C@H](O)C[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999508878 LXLXWIFYTYJDIG-JTHBVZDNSA-N 426.557 4.213 10 10 IICE C[C@@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccccc1O 2025252381 SQEQCJIEUYFVEA-CTNGQTDRSA-N 425.573 4.164 10 10 IICE COc1ccc(O)c(Cn2nc(C(C)C)c(C(F)(F)F)c2I)c1 2079827914 YVDOPAFHVGRJQW-UHFFFAOYSA-N 440.203 4.392 10 10 IICE Cc1cccc(Cn2cc(C=C3C(=O)NC(=O)N(Cc4ccco4)C3=O)c3ccccc32)c1 2296398111 UINRCLRCWIBRRC-UHFFFAOYSA-N 439.471 4.253 10 10 IICE CCOC(=O)[C@@H](C)N1C(=O)C(=Cc2ccccc2OCc2ccccc2)SC1=S 2314741394 YOPBWTIOOBQSRC-OAHLLOKOSA-N 427.547 4.418 10 10 IICE CCCOC(=O)CCN1C(=O)C(=Cc2cc(Br)ccc2OC)SC1=S 2314761323 SICFIWKELDBMDB-UHFFFAOYSA-N 444.372 4.002 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(C)c3)C2=O)ccc1OCC(=O)O 2314932098 KKMWPSVPRNFSQW-UHFFFAOYSA-N 429.519 4.263 10 10 IICE COc1cccc2c1O[C@@H](C)C(/C=C1/SC(=S)N(CCCCCC(=O)O)C1=O)=C2 33514466 MQRASQFHYMPBRK-VLURKWGBSA-N 433.551 4.249 10 10 IICE CC[C@H](C)Oc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 33546610 QODOHLZCALGJDV-QIQQCEGHSA-N 442.562 4.419 10 10 IICE CCCCOC(=O)c1ccc(-n2c(C)cc(/C=C3/C(=O)N(C)C(=S)N=C3O)c2C)cc1 59182186 NIEHHHBYQNPMDY-CPNJWEJPSA-N 439.537 4.148 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1C[C@H]1c1cc(F)ccc1F 741542521 RJCDKNDQHAPSQY-FUHWJXTLSA-N 440.412 4.240 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCCCSc1nccs1)O[C@@H](C)C2 759581292 SMFHKEKCGWMFBE-QRTARXTBSA-N 433.599 4.203 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNc3nnc(-c4ccccc4Cl)s3)cc2)C1 760493134 YGTDLOPBVKEPNF-OAHLLOKOSA-N 427.961 4.172 10 10 IICE Cc1ccnc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(OC(F)(F)F)cc3)c2C)n1 795793143 CKZXNPFCCALXEK-UHFFFAOYSA-N 433.386 4.131 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1C[C@H]1c1ccc(Br)cc1 804739798 UDWFHDMOHNBXIE-GJZGRUSLSA-N 425.120 4.337 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1[N+](=O)[O-] 1124340762 KVWBKAFQUCLXMH-YVLHZVERSA-N 445.497 4.272 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(C)(C)n1cc(NC(=O)OC(C)(C)C)cn1 1129973185 DBCXCSHIFODUMM-KRWDZBQOSA-N 443.592 4.087 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4ccccc4Br)CC3)C2)cc1 1129993231 LTEWSMHPVSEVBV-MRXNPFEDSA-N 429.358 4.132 10 10 IICE CC1CCN(c2ccc(CNC(=O)Cn3nc(C(F)(F)F)c4c3CCCC4)cc2)CC1 1136705494 OVFQBTVAUNAJCV-UHFFFAOYSA-N 434.506 4.333 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@H](CO)C2CC2)c(C)n1-c1ccc(Br)cc1 1141274297 MWHUIDAMSZVQQV-NHCUHLMSSA-N 431.374 4.384 10 10 IICE COc1cccc(C(=O)CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1152994174 LABAECBWMJBYMW-UHFFFAOYSA-N 441.325 4.478 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1cccc(OCc2ccccc2C)c1 1162539831 MXKPODPGHORHLJ-UHFFFAOYSA-N 447.531 4.414 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCC(=O)NCc3ccccc3)cc2Cl)C1 1227207238 FOGJKOLCYAGLMA-GOSISDBHSA-N 442.991 4.082 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(F)c(Br)c(Cl)c2)N(C)C)cc1 1289601938 HCKJUMPUFJIEOS-KRWDZBQOSA-N 442.760 4.340 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1291269907 YPOKKIYTQJXBGU-OAHLLOKOSA-N 431.606 4.126 10 10 IICE CC[C@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1293403448 MTDBBEXUMFJADF-NRFANRHFSA-N 439.648 4.360 10 10 IICE CCN(CC)[C@H](C)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1295554133 RCSWWOJTFRCUJR-MRXNPFEDSA-N 428.968 4.066 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)cc1 1297281814 UEUIXCXZIHIRKZ-DEOSSOPVSA-N 429.564 4.087 10 10 IICE CC(C)(C)C(=O)NCc1ccc(Cl)c(C(=O)NCc2ccc3cccnc3c2O)c1 1299727210 ZRRNGJAAILDRDT-UHFFFAOYSA-N 425.916 4.186 10 10 IICE CC(C)c1nnc(N(C)C[C@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1302584924 MPWOZQNOFCOJGM-OAQYLSRUSA-N 429.634 4.008 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F 1351162544 HJETXIHWCAKTEL-UHFFFAOYSA-N 447.436 4.298 10 10 IICE CCN1CC[C@@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C[C@H]1C 1444620146 VWJISIWPEVWEIO-RDTXWAMCSA-N 433.394 4.196 10 10 IICE O=C(NC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1c(F)ccc(O)c1O 1457550454 BTALPZTYJINDKU-QGZVFWFLSA-N 446.931 4.481 10 10 IICE CC[C@@]1(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)CCNC1=O 1457573932 INPXRWGGUHVIGS-PGRDOPGGSA-N 433.474 4.214 10 10 IICE CCN(Cc1nc2c(s1)C[C@@H](C)CC2)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1471546482 CENPLUVERVVQBZ-LAUBAEHRSA-N 443.661 4.168 10 10 IICE COC(=O)/C=C\c1ccc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c([N+](=O)[O-])c1 1472687106 SDZQKGFNFUQJMF-JIGZGPPQSA-N 445.903 4.217 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cc(C)on1 1494772697 MTEWCPSQYYEXMI-VWLOTQADSA-N 448.571 4.446 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCCCSC)CC2)cc1 1504292517 LXWUSDCCLGHONB-UHFFFAOYSA-N 431.650 4.345 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCC(C)CC3)C2)n1CCCSc1nccs1 1513903128 UXLAKJCEHCULHK-IBGZPJMESA-N 448.706 4.428 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2C[C@H](C)O[C@@H](C)C2)cc1 1515527013 OJYKDJQPRXSJDJ-PMACEKPBSA-N 434.588 4.157 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C)C1 1516676948 HQAKKTUGDICTFA-HXUWFJFHSA-N 437.588 4.394 10 10 IICE COC(=O)[C@@]1(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCCC(C)(C)C1 1532623367 WFORIPRYZJGIBH-RUZDIDTESA-N 426.557 4.157 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCc3nnc(-c4cccc(C)c4)n3C2)cc1F 1585698641 UEDPUAXMFFPUQZ-HXUWFJFHSA-N 435.547 4.118 10 10 IICE Cc1cc(CC(=O)NC[C@H]2CCC3(CCOCC3)CO2)c(C)n1-c1ccc(Cl)cc1 1610914995 VLMWHSIRKJSSLU-JOCHJYFZSA-N 430.976 4.382 10 10 IICE Cc1nn(C)c(Oc2cccnc2)c1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1611463146 DYXDIUUDSYZDGW-UHFFFAOYSA-N 429.480 4.388 10 10 IICE COC(=O)CN(Cc1cc(OC)cc(OC)c1)Cc1ccc(N2CCCCC2)c(C)c1 1615285328 CVXUFRBKNTYWPC-UHFFFAOYSA-N 426.557 4.178 10 10 IICE CC1(C)CCC[C@H](CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)O1 1618441749 JNHAGZLVLTWESE-RGHBXIHOSA-N 438.640 4.193 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC[C@H]3CCCCO3)CC2)cc1 1619301242 COQMDRRMACIUSY-JOCHJYFZSA-N 441.620 4.260 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](O)c3ccccc3Br)ccc21 1626430917 KVSBXRCYEKWLIP-NRFANRHFSA-N 445.357 4.130 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2coc(-c3ccccc3)n2)cc1 1626628211 ZNERFSTXSIQFPV-UHFFFAOYSA-N 427.504 4.463 10 10 IICE CCCc1cc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)no1 1627271784 GPANNCIWEPDMOS-UHFFFAOYSA-N 426.274 4.352 10 10 IICE CCc1nc(CCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cs1 1627669764 CSQOJOOXTPASPP-UHFFFAOYSA-N 433.375 4.243 10 10 IICE CCOc1cc(C(=O)N(C)C)ccc1NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1630842848 PSJSWBOHSUFANS-UHFFFAOYSA-N 433.508 4.259 10 10 IICE Cc1cc(C(=O)N2CCOCC3(CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1638913313 XEIRYCIYLYEDLM-UHFFFAOYSA-N 432.362 4.284 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)[C@H]2C1 1652207367 MHMNGRXJPCFSGS-WOJBJXKFSA-N 437.496 4.351 10 10 IICE CC(C)(C)OC(=O)N1CCN(Cc2ccc(N3CCOCC3)cc2)[C@H](c2ccccc2)C1 1653819272 GFBVWUXIHLXOFJ-DEOSSOPVSA-N 437.584 4.317 10 10 IICE C[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)(C)c1ccccc1 1653998293 UDVMIWSNGQETIX-KRWDZBQOSA-N 426.516 4.356 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC3(CCc4ccccc4C3)CC2)N(C)C)cc1 1684607507 QZMBRUNBRUNVAU-RUZDIDTESA-N 434.628 4.336 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(CCN4CCOCC4)CC3)c2C)c1 1687286564 LMYXYWDUJMCZMK-UHFFFAOYSA-N 438.616 4.046 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)CCCCCO)nnc3C(C)(C)C)cc2)CC1 1708104809 QYCRZHFSPYANCP-UHFFFAOYSA-N 427.637 4.459 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1708445086 DGTYYQKZJGPADD-OTWHNJEPSA-N 429.584 4.298 10 10 IICE CC[C@H](C)c1nnc(N2CCC(O)(C(F)(F)F)CC2)n1CCCSc1nccs1 1708468658 IMOAGGJKISEYRG-ZDUSSCGKSA-N 449.568 4.324 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](C)[C@H]2C)n1Cc1ccc(N2CCOCC2)c(F)c1 1708566222 QVLJUMZXOYZNJA-RCCFBDPRSA-N 447.624 4.146 10 10 IICE CN(Cc1cccc(F)c1)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1747741036 FRRQJNZJNIEXQU-MRXNPFEDSA-N 433.578 4.196 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1[C@@H](C)CCN1C(=O)OC(C)(C)C 1750611049 JUUDFDOKXFWUGI-HKUYNNGSSA-N 443.592 4.389 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765063937 MIZWCHRYOFRMCQ-OFNKIYASSA-N 439.648 4.358 10 10 IICE COc1ccc(Br)c(CNC[C@]2(C)CCCN2C(=O)OC(C)(C)C)c1O 2227752759 XMKHKGYEIGUCNM-IBGZPJMESA-N 429.355 4.043 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)[C@H](Cc1ccc(Br)cc1)NC(=O)OC(C)(C)C 2237412179 LMNOILMVBKNCNV-HNNXBMFYSA-N 440.342 4.044 10 10 IICE O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(Cl)c(Cl)c1 2296390049 AHTWDEQYVCMCAK-UHFFFAOYSA-N 440.080 4.422 10 10 IICE COC(=O)CC1=NN(c2ccccc2)C(=O)C1=C(C)NCCSc1ccc(Cl)cc1 2313681433 DSLTWGYRSDURBK-UHFFFAOYSA-N 443.956 4.262 10 10 IICE COc1cc(C=C2C(=O)N(CC(C)C)N=C2c2ccccc2)cc(Br)c1O 2332107094 NFCYBQXFMATNSV-UHFFFAOYSA-N 429.314 4.449 10 10 IICE Cc1cccc(-n2c(SCC(=O)c3ccc(O)c(O)c3)nc3ccccc3c2=O)c1C 10211577 YJHFJWZOIPSLKX-UHFFFAOYSA-N 432.501 4.389 10 10 IICE CCN(CC)c1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 27499341 NIPRUXCQLDKAPV-RGEXLXHISA-N 441.578 4.088 10 10 IICE CC(C)[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1nnc2ccccn12 726283402 YVVSRGSYRGWFMO-QHCPKHFHSA-N 446.555 4.497 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccc(OCc4cccnc4)cc3)CC2)cc1 728693375 YALOWPNRZRQSGC-UHFFFAOYSA-N 432.524 4.413 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](c3c(C)nn(C)c3C)C(F)(F)F)c2C)cc1 746447372 YQESCOYSYVRFAB-HXUWFJFHSA-N 434.462 4.486 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@@H](c3cccc(Br)c3)C2)c([N+](=O)[O-])c1 748793817 NDPVHQBCLPXXOK-MONCILHSSA-N 447.285 4.121 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 759658116 DMZACCPKZFKGLB-UYAOXDASSA-N 432.362 4.132 10 10 IICE C[C@@H]1C[C@H](c2noc(CCCN3C(=O)/C(=C/c4cccs4)SC3=S)n2)CCO1 762289108 NGHKFVIYOJYLFZ-VVKGIKJRSA-N 435.596 4.248 10 10 IICE O=C(NCc1ccc(Oc2ccc(F)cc2)nc1)NCc1cccc(Br)c1O 764762599 IQAHQJHKLRYXNV-UHFFFAOYSA-N 446.276 4.481 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccccc2Nc2c(F)cccc2F)c1 779071485 MFEPQRWVKKQRQE-UHFFFAOYSA-N 433.436 4.038 10 10 IICE Cc1cc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CN(C)C(=O)N4)cs2)c(C)s1 799187635 XSLHYUOAEBERHG-UHFFFAOYSA-N 434.568 4.267 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCc3cnc(C4CC4)nc3)cc2Cl)C1 799961759 ASYMEQKLKZTGRW-INIZCTEOSA-N 427.980 4.286 10 10 IICE Cc1ccc2nc(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)[nH]c2c1 1129274489 LCYMLDVDYAZUPU-BOPFTXTBSA-N 440.525 4.240 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C3(NC(=O)OCc4ccccc4)CC3)c2C)c1 1132264516 UUOUCVVLOJSLCS-UHFFFAOYSA-N 431.536 4.478 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(C(F)(F)F)cc1 1133626589 QLSIIYASVVWXKE-MRXNPFEDSA-N 447.501 4.217 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(Br)cc1O 1137082130 PQTLDBNZLPNNFU-ZDUSSCGKSA-N 441.272 4.155 10 10 IICE Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1185555849 XWHMWINVLJIYGO-JTQLQIEISA-N 435.353 4.029 10 10 IICE CCC[C@]1(CO)CCCN1CC(=O)Nc1sc(C)c(-c2ccccc2)c1C(=O)OCC 1193962641 HAPPLCCCINWTFT-XMMPIXPASA-N 444.597 4.466 10 10 IICE COC(=O)c1nc(CNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)ccc1Cl 1230804631 NTJOLWOEFLZOIH-UHFFFAOYSA-N 440.931 4.237 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@@](C)(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1233974043 KPONFIJXOQETDJ-RUZDIDTESA-N 425.573 4.400 10 10 IICE CN(Cc1ccccc1O)C(=O)N[C@H]1C[C@@](CNC(=O)OC(C)(C)C)(c2ccccc2)C1 1255762154 KNBFVMHEYBRAQD-IHRKKFBRSA-N 439.556 4.159 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cc3ccc(Br)cc3c(=O)o2)C2CC2)cc1 1264413863 GAJIYFIFISZKCO-UHFFFAOYSA-N 441.325 4.426 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccn(-c4ccc(Cl)c(Cl)c4)n3)C2)cc1 1278861977 STVJZSIRMHDKQK-CQSZACIVSA-N 431.323 4.196 10 10 IICE CC(C)(C)c1nnc(N2CCC([C@H]3CCOC3)CC2)n1CCCSc1nccs1 1286996695 FQLHTVUCZWMEKT-KRWDZBQOSA-N 435.663 4.467 10 10 IICE Cc1cc(C(=O)NCCCN2CCCCCC2=O)c(C)n1-c1ccc(Br)cc1 1290304756 JDHIOXRPEUXXIY-UHFFFAOYSA-N 446.389 4.379 10 10 IICE CCc1nnc(N2CCC(c3ncc(C)s3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1292943416 GPCNFEMVYALAAC-UHFFFAOYSA-N 428.581 4.243 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC([C@@](C)(O)C(F)(F)F)CC2)CCCC1 1296107415 QZONHMGSSDZNSO-JOCHJYFZSA-N 438.490 4.081 10 10 IICE Cc1ccc(N2N=C(Br)C[C@H]2C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1296647816 DGINQBROHPEPPX-BEFAXECRSA-N 429.362 4.226 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2CCCC(C)(C)C)CCOC1 1303480248 BBTIQOLGBGCEKJ-XMMPIXPASA-N 430.593 4.487 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CCCn2ccnn2)c(C)n1-c1ccccc1 1304189916 PAYWITMOWHSEJJ-UHFFFAOYSA-N 432.576 4.127 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CC[C@@H](C)C2)CCOC1 1304971748 IWOIDYMHNCWSOI-YDIMBITNSA-N 428.577 4.097 10 10 IICE C[C@@H](C[C@@H](C)NC(=O)OC(C)(C)C)NC(=O)N(Cc1ccco1)Cc1ccccc1O 1312914409 OUSJYFXEEYCBNJ-DLBZAZTESA-N 431.533 4.389 10 10 IICE CCO[C@]1(c2nnc(N3CCC[C@@H]3CC)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1314128321 JPNHUQYCKFVBQT-SQJMNOBHSA-N 441.620 4.204 10 10 IICE CC[C@@H](c1ccncc1)N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1360528929 SLBHCGZYYDLZGT-OGBKAESYSA-N 443.569 4.422 10 10 IICE CC[C@H]1CCc2nc(O)c(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2C1 1444983373 DAUFXWMOKZIFDV-DOTOQJQBSA-N 445.510 4.302 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2c(C(C)C)noc2n1 1445889522 YTAUWQRIJNFJJX-KRWDZBQOSA-N 442.947 4.408 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCOCCCNC(=O)OC(C)(C)C)c2C)c1 1454558655 AICAJNLBMZRPMF-UHFFFAOYSA-N 429.561 4.064 10 10 IICE CC[C@@](CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)(C(=O)OC)c1ccccc1 1468942119 AECISZWEFKEHOH-SANMLTNESA-N 434.536 4.354 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@]1(Cc2ccc(Cl)cc2)CCOC1 1478841593 ZLZKCVXOYCEAFG-UUOWRZLLSA-N 429.992 4.346 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCOC3)n2CCOC(C)(C)C)c(C)n1-c1ccccc1 1510607399 UNXKQOVYDHNBOD-OAQYLSRUSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(CC)C[C@H]2CCCO2)cc1 1515532514 RANXDYWMOACBPU-JTHBVZDNSA-N 441.620 4.072 10 10 IICE Cc1cc(CC(=O)N2CCOc3ncc(Br)cc32)c(C)n1-c1ccccc1 1521558217 GVVDAWSVPQVACR-UHFFFAOYSA-N 426.314 4.220 10 10 IICE CCCOc1ccc(OCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1524065959 BAFIUJMFURTZMP-KRWDZBQOSA-N 434.483 4.241 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cnc(Cc4ccccc4)s3)cc2F)C[C@@H](C)O1 1526003687 RORGVUINPQTTCY-IAGOWNOFSA-N 439.556 4.417 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](Cc3ccccc3)c3nccn3C)ccc21 1531178695 XBKVPMIFULRACI-HSZRJFAPSA-N 430.552 4.352 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2O)cc1 1540800683 ZGAZUZZJTSYSSU-UHFFFAOYSA-N 429.860 4.455 10 10 IICE O=C(Cc1c[nH]c2ccc(Br)cc12)NCc1ccc(N2CCSCC2)cc1 1543098731 IJGSGXITLPTGQI-UHFFFAOYSA-N 444.398 4.343 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@H](O)C2CCCCCCC2)NC(=O)OC(C)(C)C)cc1 1544269060 PCPPYNKNJFUALL-FGZHOGPDSA-N 447.620 4.156 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](CN1CCCC1)c1ccccc1 1545632926 YYAMDLZTPODUTD-DHIUTWEWSA-N 442.003 4.006 10 10 IICE CCS[C@@H]1CC[C@H](N(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1552511248 AEZVNOHCTRXOSB-CEXWTWQISA-N 447.624 4.146 10 10 IICE COC[C@@H]1CCCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1555332692 RGZNATWBQQTIQV-OAQYLSRUSA-N 443.661 4.256 10 10 IICE CC(=O)c1cc(F)cc(CN[C@@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1O 1559751103 YMZONURECFLPME-TZIWHRDSSA-N 436.886 4.367 10 10 IICE Cc1nc(-c2ccc(C)c(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)c2)n[nH]1 1566219816 PKENGERCWJURNY-UHFFFAOYSA-N 427.508 4.490 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](O)c3cc(Cl)ccc3OC)c2C)cc1 1569027236 XMUOTECNQDKCFP-OAQYLSRUSA-N 428.916 4.228 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4cccc(F)c4F)CC3)ccc21 1586561105 ZQUNUBOUJKYWOV-UHFFFAOYSA-N 427.495 4.145 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CC(=O)N(c4c(F)cccc4F)C3)c2C)c1 1596481318 BVUUHSQEOZBBQK-IBGZPJMESA-N 437.490 4.350 10 10 IICE C[C@H]1CCCN(CCCCn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)C1 1612800732 HFDNOSSNAGNPSB-FQEVSTJZSA-N 436.604 4.138 10 10 IICE COc1cc(N2CCN(CCCc3ccc(C(F)(F)F)cc3)CC2)cc(OC)c1OC 1617063525 HIFQOHFTAZJHID-UHFFFAOYSA-N 438.490 4.486 10 10 IICE Cc1cc(C)cc(C[C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1620500915 QNWSZHUSXHFQDH-MRXNPFEDSA-N 444.578 4.232 10 10 IICE CCN(CC)C(=O)Cn1ccc2cc(NC(=O)c3cc4cc(O)c(O)cc4s3)ccc21 1626007664 VCADRKJKOKCYII-UHFFFAOYSA-N 437.521 4.388 10 10 IICE Cc1cc(C(=O)N2CCC(CN(CCO)C(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1627213450 KYJCIHNYZBVQCF-UHFFFAOYSA-N 432.008 4.302 10 10 IICE Cc1cc(C(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1629689800 HXRNCTWXWLMIST-IBGZPJMESA-N 434.559 4.174 10 10 IICE Cc1oc(-c2cccs2)nc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257188 QKBLVBIFZBUWHQ-INIZCTEOSA-N 431.945 4.465 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1C(=O)c1ccc(Cl)cc1 1630283217 OVGQGLYQXVBNSZ-UHFFFAOYSA-N 448.950 4.462 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCSC[C@@H]2c2nccs2)cc1 1633348242 KCKOBERUJBLWNB-HXUWFJFHSA-N 425.579 4.222 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)N(CC)C(=O)OC(C)(C)C 1635489353 UQZPXPPHHDVMDP-KRWDZBQOSA-N 449.592 4.021 10 10 IICE COCCN(C)CCCC1CCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)CC1 1636616469 FSTUMHHENRQYRN-UHFFFAOYSA-N 425.617 4.234 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4cscn4)[C@@H](C)C3)c2C)c1 1638510565 IBIZGXUPMXOPTC-SFHVURJKSA-N 436.581 4.154 10 10 IICE CCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)nnc1-c1ccccn1 1640977750 OVUGADMTYAALKX-UHFFFAOYSA-N 436.516 4.277 10 10 IICE CCN(C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)[C@@H]1CCN(CC(F)(F)F)C1 1641507738 QKKRLIVWTNEPCX-HXUWFJFHSA-N 435.490 4.314 10 10 IICE COc1ccc(C(C)(C)NCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1F 1643882601 OSZAFBNOKJOYKP-UHFFFAOYSA-N 446.478 4.073 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3C3CCCCC3)cc2F)C[C@@H](C)O1 1653176137 ZANJSRBFOJIQPB-DNVFCKCGSA-N 431.596 4.100 10 10 IICE COc1cccc2c1CC[C@]2(CO)NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1654642038 XGCIVGZRKCBUJF-RUZDIDTESA-N 430.508 4.473 10 10 IICE CC(C)N(CC(=O)NCc1ccc(N(C)C)cc1)Cc1cc(Br)ccc1F 1657104105 VDELZBXHHZHIRG-UHFFFAOYSA-N 436.369 4.181 10 10 IICE CCOC(=O)CC[C@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1674924269 NRVSSHWSFVOMEI-OAQYLSRUSA-N 425.573 4.402 10 10 IICE C[C@@H](NC(=O)NCc1noc(-c2cccc(Br)c2)n1)c1ccc(N(C)C)cc1 1681779088 JUQFZUYMCSWJSM-CYBMUJFWSA-N 444.333 4.126 10 10 IICE CC(C)(NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1Br 1682986816 PIYARSHDQSHIFQ-UHFFFAOYSA-N 446.389 4.145 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1 1683254665 RTAVGDPWASOABJ-WUMKDDEVSA-N 436.600 4.032 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H](N(C)C(=O)OC(C)(C)C)C1 1683421086 DOLWEPJENVTEDZ-WIYYLYMNSA-N 432.609 4.033 10 10 IICE C[C@@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)CCCO1 1693824795 JPJUHOMTBWZJJI-GOSISDBHSA-N 443.642 4.317 10 10 IICE CC(C)Cc1nnc(N2C[C@H](C)C(F)(F)[C@H](C)C2)n1Cc1ccc(N2CCOCC2)cc1 1723349107 IXQUPNAESVKWFZ-KDURUIRLSA-N 447.574 4.089 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCC1CC1)C(C)C 1728288536 BCRIQSZCMGPXJW-UHFFFAOYSA-N 434.588 4.114 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1 1747325663 FCIJSODNTFMBNP-QFIPXVFZSA-N 437.588 4.394 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC[C@H](C)C3)n2CCCSc2nccs2)n1 1762449098 VGHFQMJWRPBLFY-INIZCTEOSA-N 445.662 4.405 10 10 IICE CC[C@H](C)c1nnc(N2CCCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763706255 HPPLFUSOLHHEHW-FQEVSTJZSA-N 425.621 4.429 10 10 IICE COCc1nc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)OC)cs1 1770870049 XNNKKZORUFDTPA-UHFFFAOYSA-N 438.557 4.001 10 10 IICE CC(C)N(C(=O)Cc1ccccc1[N+](=O)[O-])c1cccc2c1C(=O)c1ccccc1C2=O 1859889634 SKHFRVLJRDJCLW-UHFFFAOYSA-N 428.444 4.354 10 10 IICE COc1ccc(OC)c(/C=C/C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)c1 1865996242 IBQBFIVBRPVEPL-RLMNYEENSA-N 437.584 4.126 10 10 IICE COc1ccc(OC)c(/C=C/C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)c1 1865996243 IBQBFIVBRPVEPL-USXRGHEGSA-N 437.584 4.126 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC(C)C)C(=O)N(CCc3ccccc3)C2=O)cc1 1873166695 FFWVNKHTXUTRHL-UHFFFAOYSA-N 427.548 4.415 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3ccccc3O[C@@H](C)C(=O)O)SC2=S)c1 2314931611 POYUNUZKDYPOMS-ZDUSSCGKSA-N 427.503 4.147 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCC2)c(O)c1Br 2381130292 WQEHQINWJWECAA-INIZCTEOSA-N 441.366 4.115 10 10 IICE CCN1C(=O)/C(=C/c2ccc(OC)c(COc3ccc([N+](=O)[O-])cc3)c2)SC1=S 1015986 RGADJPKPXRAZEK-WQRHYEAKSA-N 430.507 4.404 10 10 IICE O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)Nc3cccc(C(F)(F)F)c3)ccc21 6089029 JOJLMWOYOCSIND-UHFFFAOYSA-N 431.391 4.282 10 10 IICE CCCCOC(=O)c1ccc(NC(=O)CCCCCN2C(=O)[C@@H](C)SC2=S)cc1 11636602 BGEHUJQMEQQTEF-OAHLLOKOSA-N 436.599 4.391 10 10 IICE CCCN1C(=O)/C(=C\c2c(N(CCC)CCC)nc3ccc(C)cn3c2=O)SC1=S 33780554 WDFOUBMKJKWYLT-GHRIWEEISA-N 444.626 4.241 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2cccc(O)c2)SC1=S)NCc1ccccc1 210759766 KXVBVKISIBYQGC-HMMYKYKNSA-N 440.590 4.470 10 10 IICE COc1cccc(O)c1[C@@H](CC(=O)O)NC(=O)OCC1c2ccccc2-c2ccccc21 687755231 SEESGWGUPNABJP-HXUWFJFHSA-N 433.460 4.455 10 10 IICE COc1cc(C)c(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1OC 743070398 JVLPHTHLFFIEME-HNNXBMFYSA-N 435.471 4.404 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc([C@@H]2CCCOC2)cc1 779948918 WHDBAGRQEPKZDV-RUZDIDTESA-N 433.596 4.043 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1cccc(Br)c1Cl 811823420 ROZCEGZXERUYER-UHFFFAOYSA-N 430.736 4.422 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)c3ncc(Br)cn3)c2C)cc1 817273503 UVNBQXZJSYJLKP-CYBMUJFWSA-N 429.318 4.146 10 10 IICE COc1ccc(N2CCC(NC(=O)c3nccc4c(Br)cccc34)CC2)cc1 1125816444 LISQRLDOHOBKHS-UHFFFAOYSA-N 440.341 4.405 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCC(=O)Nc2ccc(Cl)cc2)C1 1130657164 DMRQJASREOPIAY-UHFFFAOYSA-N 439.943 4.243 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCCn2cc(C(F)(F)F)nc21 1149901501 ZIXCBOGAEOEYKD-CYBMUJFWSA-N 446.267 4.296 10 10 IICE COC(=O)CC[C@@H](Cc1ccccc1)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1153373681 JPRVOGKJASDDAB-FQEVSTJZSA-N 448.563 4.209 10 10 IICE COC(=O)[C@@H]1C[C@@H]2C[C@H](NC(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)[C@@H]2C1 1157645162 IMRLSEAOTMAZQP-IONDEXAJSA-N 445.357 4.174 10 10 IICE COC1CCN(c2ccc(CN3CCCN(C(=O)c4ccc(Cl)cc4)CC3)cc2)CC1 1167171711 OZASLZUGJKFYSM-UHFFFAOYSA-N 442.003 4.303 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)OC(C)(C)C)c1 1179978777 ROLMAEXBBFBOBK-VSKRKVRLSA-N 437.540 4.177 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](c3cccc(C)c3)c3ccccn3)C2)cc1 1225430776 QOIGTKJSILDXHJ-NLFFAJNJSA-N 430.552 4.314 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@@](CO)(c4ccccc4)C3)cc2Cl)C1 1235832704 GFDMJDXVDVNNPG-JYMRHQFYSA-N 442.003 4.468 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)c1cnn(CC2CCC2)c1 1256298730 PLKHBFVZXCEFOE-CQSZACIVSA-N 435.366 4.444 10 10 IICE CC[C@H](C)c1nnc(N2CCC(N3CCCC3=O)CC2)n1CCCSc1nccs1 1291509137 YISRWSPLDRDXOR-INIZCTEOSA-N 448.662 4.022 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C[C@H](c2nccn2C)C(F)(F)F)cc1 1300091523 GIBQTCRIZTTXIB-OAHLLOKOSA-N 436.400 4.113 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCCC[C@@H]1c1ncc(Br)cn1 1303806903 RZFLQORUSCTVEW-GFCCVEGCSA-N 434.315 4.232 10 10 IICE C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307695745 PAXSMBQMPAFLSB-SJORKVTESA-N 441.531 4.206 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 1312527441 FRZHYBPCJRSEFJ-IHPCNDPISA-N 432.609 4.127 10 10 IICE CC1(C)OC(=O)c2c(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cccc21 1360045453 HNQGLXHWXUSQLQ-UHFFFAOYSA-N 430.451 4.092 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1ccnc(Cl)c1I 1456307894 FJQPNYWYHWUISD-UHFFFAOYSA-N 438.652 4.128 10 10 IICE COC(=O)[C@]1(NCc2ccc(N(C)C)c(C)c2)CCc2cc(Br)ccc2C1 1460452786 VFMRKPMAVUGVDG-QFIPXVFZSA-N 431.374 4.014 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(CNC(=O)c2cccs2)cc1 1460987584 ZZPXQROTPYWARB-SFHVURJKSA-N 435.593 4.414 10 10 IICE CCN(C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@H](Cc1ccc(F)cc1)C(C)C 1471192390 YAZMBZBPNPJLLQ-RUZDIDTESA-N 440.607 4.376 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)c(C)n1-c1ccccc1 1478654617 ZCRZERJJGKSCLM-ZLNRFVROSA-N 435.572 4.287 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCCN([C@H](C)c2ccccc2F)C1=O 1478690517 ICTWOZUQBYZMGC-JPYJTQIMSA-N 440.563 4.175 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](C)C1 1503904579 NFCDENIHCMJIEQ-OALUTQOASA-N 437.588 4.391 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1C[C@@H](C)S[C@H](C)C1 1510675577 SPSOKKGNEYCQQX-RTBURBONSA-N 436.629 4.017 10 10 IICE CCOC(C)(C)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1516093034 LJTOFRAPOZJHNM-UHFFFAOYSA-N 448.615 4.316 10 10 IICE O=C(Cn1nc(C(F)F)cc1C1CC1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1531502342 GLBYKHRUKWKVRF-AWEZNQCLSA-N 440.441 4.085 10 10 IICE CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1534242772 WVWNKSRDDZWPBZ-GQNCVOLQSA-N 425.598 4.011 10 10 IICE CN(C)c1ccc(CNC(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)cc1F 1535620097 VOLUWVXCNFXFKA-UHFFFAOYSA-N 427.520 4.115 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 1536550258 OIOYLAQETOIXKW-AWEZNQCLSA-N 432.446 4.491 10 10 IICE CC(C)c1nsc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1537168273 CCARRJCNBVWJNI-UKTHLTGXSA-N 436.559 4.031 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCN(Cc2ccc(-c3ccccc3F)s2)CC1 1539368762 ARSHABWHQKJNJS-UXBLZVDNSA-N 438.524 4.323 10 10 IICE O=C(/C=C/c1cnc2ccccc2n1)N1CCOc2cc(Br)c(Cl)cc21 1539901304 QTHGFYIGLKJFJL-AATRIKPKSA-N 430.689 4.485 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2nc(C)c3cccnc32)cc1 1543115881 XYINKXGEHKGYBF-UHFFFAOYSA-N 429.524 4.048 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1Br 1544630040 IIBJHTYBCOKQFK-UHFFFAOYSA-N 435.337 4.096 10 10 IICE CO[C@@H](Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1554662770 QQGRCVJJYSXXRI-DEOSSOPVSA-N 448.615 4.172 10 10 IICE COC(=O)Cc1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1564649801 NQVSNZWDMWJOSM-QGZVFWFLSA-N 443.975 4.291 10 10 IICE CCN(CC)c1ccc(CNC(=O)CSc2nccn2-c2cccc(OC)c2)cc1F 1565688494 ZFAFRDGWWYTXLF-UHFFFAOYSA-N 442.560 4.275 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@](C)(CC)CNC(=O)OC(C)(C)C 1566306817 WFJYTLREEVPYMX-HXUWFJFHSA-N 443.382 4.444 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2[C@@H]3Cc4ccccc4[C@H]32)NC(=O)OC(C)(C)C)cc1 1586620240 UUBYHFOZARKVCR-KAOXLYBCSA-N 435.568 4.021 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C3CCCCC3)CC2)cc1 1623430345 YTEMLFLQXQAQTI-QFIPXVFZSA-N 445.604 4.208 10 10 IICE Cc1ccccc1C[C@H](CO)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1625275477 UFCCCSMMUNJAGT-HXUWFJFHSA-N 441.369 4.498 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccn(-c2ccc(Br)cc2)n1 1625794007 ARYFFGMPPRUFAL-UHFFFAOYSA-N 427.346 4.363 10 10 IICE COc1ccc(CNC(=O)c2ccc3c(c2)[C@H](CNC(=O)OC(C)(C)C)CCC3)c(O)c1 1626079830 MPJGXPOEZLJZMB-SFHVURJKSA-N 440.540 4.275 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(CCC(C)C)cc3)CC2)cc1 1631586748 IPXIDYHYQNURHL-CCEZHUSRSA-N 435.568 4.127 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1c(O)cccc1F)c1cccc(C(F)(F)F)c1 1635367000 VCQHXCFGFYDLHK-KRWDZBQOSA-N 442.409 4.432 10 10 IICE CCc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnn1CCC(C)C 1635940251 ACKDMZLEHRMCGO-LJQANCHMSA-N 432.996 4.245 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCC(C)(C)NC(=O)OC(C)(C)C)cc1 1636887683 OHXBPLQWEQRFIR-UHFFFAOYSA-N 441.572 4.259 10 10 IICE Nc1c(Br)cc(F)cc1C(=O)Nc1c(-c2ccccn2)nc2ccccn12 1637108422 QRGJGWCOISONOJ-UHFFFAOYSA-N 426.249 4.132 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(Cc4ccccc4)C(=O)C3(C)C)c2C)cc1 1641554978 BXHMWNXIJDNMNR-UHFFFAOYSA-N 445.563 4.366 10 10 IICE C[C@@H]1CN(C(=O)CN(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)CC(C)(C)O1 1642029368 JYEUTCJGDZAIHI-JRMCHAMMSA-N 436.552 4.004 10 10 IICE C[C@H](Sc1ncc(Cl)s1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 1644118850 NUMPUAXPIBSMEZ-LBPRGKRZSA-N 446.019 4.090 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCCCN(Cc3ccc(N4CCOCC4)cc3)C2)C1 1655587070 NVBLYIWNSYXUQB-RUZDIDTESA-N 429.605 4.136 10 10 IICE CCc1ccc([C@@H](CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)N(CC)CC)cc1 1673207232 BWPNMOXGVFCRRZ-WIOPSUGQSA-N 438.616 4.219 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC(=O)NCc3c(O)ccc4c3CCCC4)CC[C@H]2C1 1673507666 CTWRNXUEHDBFKV-OTWHNJEPSA-N 443.588 4.106 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCn3ccc4cc(Cl)ccc43)C2)cc1 1682166602 VQQOMTASWZKHLQ-QGZVFWFLSA-N 426.948 4.129 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@H](CNc4ccc(Cl)cc4)C3)C2)cc1 1683787771 QDUMHRAUTDJTHV-NQIIRXRSSA-N 442.991 4.461 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCCCc3cc(OC)c(OC)cc32)cc1 1684966211 DEJLXRLFFUOIAH-QFIPXVFZSA-N 441.572 4.258 10 10 IICE C[C@H](c1cccs1)N(C)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)c(F)c1 1706739560 PWKDTYMXFVKLOY-OAHLLOKOSA-N 437.548 4.247 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1709218853 WESGHVLGOVGGIC-SIKLNZKXSA-N 439.648 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1728383829 FUMFSTYWLSVCHV-QHCPKHFHSA-N 448.615 4.021 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@@H]1CCC[C@@H](O)C1 1747720683 PMJHVKKILPWKNZ-IFMALSPDSA-N 425.621 4.363 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1 1770152757 IQFMSAQHCSJBGF-UHFFFAOYSA-N 437.588 4.252 10 10 IICE CCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1-c1ccc(Cl)cc1 1862307847 XJBZUDHVLJJEOD-UHFFFAOYSA-N 438.959 4.449 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(F)(F)F)c(C=O)c1I 2079036650 ZREIOBXSNSTYNP-LLVKDONJSA-N 438.187 4.332 10 10 IICE CCc1nn([C@H](c2ccc(OC)cc2O)C(C)(C)C)c(Br)c1C(=O)OC 2079977560 NXYKKHDLDWFIEE-MRXNPFEDSA-N 425.323 4.344 10 10 IICE CC[C@H](NC[C@]12C[C@H]1CN(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2092532395 SLQYMFKAPQZWLO-RISOHXOYSA-N 425.367 4.452 10 10 IICE CN(Cc1csc(=NCc2cc(Br)cc(F)c2O)[nH]1)C(=O)OC(C)(C)C 2224600564 LMRABONWFYPCCX-UHFFFAOYSA-N 446.342 4.151 10 10 IICE CC1=NN(c2cccc(C(=O)O)c2)C(=O)C1=Cc1ccc(N(C)C)c(Br)c1 2297504586 YJMSUGYSQYAZJK-UHFFFAOYSA-N 428.286 4.019 10 10 IICE O=C(CCN1CCCCC1)NN1C(=O)C(=Cc2ccc(-c3ccccc3)o2)SC1=S 2314489905 WFQOSRRASKQIMR-UHFFFAOYSA-N 441.578 4.055 10 10 IICE COC(=O)c1cccc(-c2ccc(/C=C3\C(=O)NN(c4ccc(C)c(Cl)c4)C3=O)o2)c1 33333412 JQBXCDKXOMOIJS-LDADJPATSA-N 436.851 4.156 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc(OC)c1O 59396963 MEFOIUOTWIYHOH-PXNMLYILSA-N 432.479 4.032 10 10 IICE O=C(C1=CN(c2cccc(C(F)(F)F)c2)c2ccccc2S1(=O)=O)N1CCCCC1 65096226 HAFBCZADXCIYOG-UHFFFAOYSA-N 436.455 4.485 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1 687755126 MBTYGJLSEYBHAZ-RUZDIDTESA-N 433.460 4.326 10 10 IICE C[C@@H]1CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)C[C@@H](c2ccccc2)O1 726720661 ZAABRHCFAIRIPT-VGSWGCGISA-N 445.510 4.428 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741180872 DNUMCNFAAPYGAC-WOJBJXKFSA-N 434.458 4.436 10 10 IICE Cc1ncsc1-c1nc2ccccc2n1CC(=O)NCc1ccc(N2CCCC2)cc1 742536178 FWVGIIIPYDDISL-UHFFFAOYSA-N 431.565 4.385 10 10 IICE C[C@H](NC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2c(c1)OCO2 743521039 OJIKMEPYPJTZLU-HOCLYGCPSA-N 433.455 4.046 10 10 IICE CCOc1ccc(-c2nc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3OC)sc2C)cc1 748672184 DPMLSIJFBDXDLR-UHFFFAOYSA-N 449.510 4.235 10 10 IICE COc1cc(C)cc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c1 752205944 HPWMGHMDABBXDY-PDGQHHTCSA-N 446.619 4.363 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCO[C@@H]1c1cnn(Cc2ccccc2)c1 752922854 SFIAFXNTWQEGCA-LOSJGSFVSA-N 432.568 4.124 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(CC(=O)c3cc(C)n(-c4cccc(SC)c4)c3C)[C@H]2C1 755053501 KNCVVRKXWGDWFE-UCFCWBNQSA-N 428.598 4.267 10 10 IICE Cc1cc(C(=O)CCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)s1 768532967 SMKJHFTWDILDEG-UHFFFAOYSA-N 439.625 4.176 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CCCCC[C@H]1c1ccncc1 769041265 HJFCCKXFIZCUGL-SANMLTNESA-N 447.627 4.441 10 10 IICE Cc1cc(NCc2cc(Br)cc(Br)c2O)cc(OCCO)c1 775207694 WOKRXRVMNHZYEB-UHFFFAOYSA-N 431.124 4.209 10 10 IICE Cn1ccnc1CN1CCC[C@@H](NCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1=O 782978004 IKNJMMVTSLYXQD-HXUWFJFHSA-N 426.605 4.002 10 10 IICE O=C1/C(=C/c2ccnn2-c2ccccc2)SC(=S)N1CCc1ccc2c(c1)OCCO2 790628404 WZEDBAFMXYFIPT-QNGOZBTKSA-N 449.557 4.087 10 10 IICE Cn1nccc1[C@H]1CCCCN1Cc1cc(Br)cc(Br)c1O 798961435 WVEMFZMWRFANGP-OAHLLOKOSA-N 429.156 4.378 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Nc3ncc(C(F)(F)F)s3)cc2F)C[C@@H](C)O1 801751344 OWUSEMGMBVQKGE-GHMZBOCLSA-N 432.443 4.236 10 10 IICE COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1Cc1ccccc1 1084329169 OVFBFKYEKQAQKN-QNGOZBTKSA-N 430.435 4.092 10 10 IICE COc1ccc(N2CCC(NC(=O)C3(C(=O)OC(C)(C)C)C(C)(C)C3(C)C)CC2)cc1 1143190808 IMPQPXOAJZAXNR-UHFFFAOYSA-N 430.589 4.174 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc([N+](=O)[O-])c1Cl 1148444175 OPLRISIUPYBJPG-LBPRGKRZSA-N 425.819 4.248 10 10 IICE COc1ccc(C)cc1[C@H](C)N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1170967358 RVIZLUQDXUDGRU-DLBZAZTESA-N 442.515 4.457 10 10 IICE COc1ccc(N(CCC(C)C)CC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)cc1 1194074085 PISRHANZTKRNQG-UHFFFAOYSA-N 425.573 4.228 10 10 IICE C[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1229369938 CRRAIOQMVLEPHG-UYAOXDASSA-N 449.592 4.166 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCc3ccc(Br)cc3)C2)cc1 1230301100 QAALWXNHMKPDLS-SFHVURJKSA-N 446.389 4.168 10 10 IICE C[C@H](NC(=O)NCC[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 1254215057 GTHKKRUNNRFASH-HKUYNNGSSA-N 427.545 4.279 10 10 IICE CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1255508842 GKTQWEGPGZUVOH-RPBOFIJWSA-N 448.611 4.256 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)nc2)c(C)n1-c1cccc(Br)c1 1290831426 YMHMSHVVSYRQRS-UHFFFAOYSA-N 427.346 4.248 10 10 IICE COCCCOC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)cc2C)CC1 1301671564 CZAFHKINFSOWTN-UHFFFAOYSA-N 443.636 4.020 10 10 IICE CC(C)c1nnc(N(C)C[C@@H]2CCCCO2)n1Cc1ccc(N2CCSCC2)cc1 1302584923 MPWOZQNOFCOJGM-NRFANRHFSA-N 429.634 4.008 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](CC)c2noc(C)n2)sc(C)c1-c1ccccc1 1307668960 JMPRAMTUSXEGLV-MRXNPFEDSA-N 442.541 4.271 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](C)c3ccc(OC)cc3Br)C2)cc1 1312368407 PHHWXIDCDVHXMX-HUUCEWRRSA-N 448.361 4.105 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@H](C)Cc3cccs3)CC2)cc1 1315515888 UNBPXZVTJYOGKU-GOSISDBHSA-N 425.602 4.252 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(=O)c(OCc2ccc(F)cc2)co1 1349120469 XQEPALPOABVTHA-UHFFFAOYSA-N 436.483 4.230 10 10 IICE COc1cc(F)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1349945611 SLEUBSPRYZVURE-YVLHZVERSA-N 434.489 4.203 10 10 IICE CC(C)(C)N1CCCN(c2nnc(C3CCC3)n2CCCSc2nccs2)CC1 1359547902 GLEFHDSSLNJYRN-UHFFFAOYSA-N 434.679 4.495 10 10 IICE O=C(CO[C@@H]1CCCc2ccccc21)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333543 RRDCQIXEDFSUFW-PGRDOPGGSA-N 430.495 4.467 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\c3ccsc3C(F)(F)F)CC2)c(OC)c1 1438184962 IVQCQEKVZZQWPL-UTCJRWHESA-N 426.460 4.146 10 10 IICE CCS(=O)(=O)Nc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1C 1441885256 MRMOVIUJAPETIY-UHFFFAOYSA-N 425.554 4.345 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)[C@@H]3CCCC[C@H]32)c(C)n1-c1ccc(C(C)C)cc1 1445952384 BKDUSOJJLVSHLY-DHIUTWEWSA-N 428.598 4.399 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@](C)(O)c2cccc(Cl)c2)C1 1447336784 AZWNGGZDMVIRBL-VWLOTQADSA-N 439.987 4.085 10 10 IICE Cc1cc(C(=O)NCCC2(O)CCN(c3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1454635055 SVURYGALNVWBRA-UHFFFAOYSA-N 435.543 4.385 10 10 IICE Cc1cc(C(=O)NCc2cccc3c2OCC3)c(C)n1-c1ccc(Br)cn1 1456170857 ZTJDFHJMGMZFFQ-UHFFFAOYSA-N 426.314 4.117 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1 1465236928 FISWSQHIUDUVGX-SANMLTNESA-N 429.564 4.230 10 10 IICE COc1ccc(C(=O)C2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1470556399 UEVTVAMYUSQSEZ-LJQANCHMSA-N 437.584 4.305 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)C[C@H]3CCCO[C@@H]3c3ccccc3)C2)cc1 1478860718 RAUYOQXATQSEBR-QFZWGZQFSA-N 437.584 4.331 10 10 IICE CCC1(CC)CCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1497688684 BZTXMDPYRIMGPU-UHFFFAOYSA-N 431.635 4.334 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](NC(=O)CC)C1 1514790329 QYQJLWXXUPTTQH-HXUWFJFHSA-N 434.588 4.258 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CCCCC2 1515519669 LDKODCYAYKRMLU-AWEZNQCLSA-N 444.528 4.324 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@@H](C)C1 1519135709 NIUVQOFPVNCKGU-IEBWSBKVSA-N 440.567 4.168 10 10 IICE CC[C@H](Cc1cccc(Br)c1)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1531730121 QNQHCROLGATZGC-MJGOQNOKSA-N 431.374 4.422 10 10 IICE Cc1cn(C(C)(C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)nc1C(F)(F)F 1534007836 AZWZBGOROWIXHT-UHFFFAOYSA-N 441.409 4.360 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1541441952 GBQZPSLNYSCOHW-OAQYLSRUSA-N 425.621 4.234 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)C1CCOCC1 1546312713 HMZYSPQUZXKFPC-QHCPKHFHSA-N 426.557 4.306 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)n1 1559097519 BJUAGGPSQSVICC-QGZVFWFLSA-N 432.952 4.212 10 10 IICE CC(C)CCC1CCN(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1 1559601615 HZFOXGUIBRHOKA-WOJBJXKFSA-N 433.612 4.204 10 10 IICE CC(=O)c1cc(F)cc(CN[C@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1O 1559751102 YMZONURECFLPME-PZJWPPBQSA-N 436.886 4.367 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H](O)C23CCCC3)sc(C)c1-c1ccccc1 1559875519 YPUDPTZILOXEBK-GOSISDBHSA-N 442.581 4.218 10 10 IICE Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)nc1 1565193096 OGXVGHNXPIGWRV-NRFANRHFSA-N 445.567 4.358 10 10 IICE O=C(C[C@@H](c1ccccc1)C(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1584515348 PFLFDTWXAJLJOL-INIZCTEOSA-N 428.401 4.154 10 10 IICE CC[C@H](C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccc(Br)cc1 1587490695 NZPRBCMJMFFNBZ-IBGZPJMESA-N 447.373 4.309 10 10 IICE CCCOc1ccccc1C(=O)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1587530273 FDOPMCIJOLNJGN-UHFFFAOYSA-N 447.579 4.196 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCn1c(=O)n(C)c2ccccc21 1597567398 MSPHKUTXFITBNY-IBGZPJMESA-N 429.520 4.226 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2CCCSc2nccs2)C[C@@H]1C 1615768118 IXLJBLWJEHZTOJ-IRXDYDNUSA-N 436.695 4.425 10 10 IICE CC(=O)N/C(=C\c1cccs1)C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1617900710 LIUPHPCFYUTDQR-DKNZLLBESA-N 431.989 4.431 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)(C)CC1 1618786474 RLZCHNZGOCWADZ-UHFFFAOYSA-N 434.588 4.115 10 10 IICE Cc1c(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)nnn1Cc1ccccc1F 1626151098 JBZCBVHXHYMWLI-UHFFFAOYSA-N 431.471 4.246 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC3(CCOCC3)CO2)c(C)n1-c1cccc(Br)c1 1632325168 XPFIXZZXMXEHEN-IBGZPJMESA-N 447.373 4.172 10 10 IICE CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1ccc(N=NC(N)=O)cc1 1632952662 PYGCJPOIUCQJMK-UHFFFAOYSA-N 435.406 4.357 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)(F)F)CC2)c(C)n1-c1ccccc1Br 1636177964 QPHOLRKAMHWCLX-UHFFFAOYSA-N 440.332 4.270 10 10 IICE CC(=O)c1cc(Br)ccc1OCC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1642997833 OVJFYPQHDVGYED-OAHLLOKOSA-N 447.373 4.152 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N(CC1CC1)c1cccc(F)c1 1643693375 FFOPDUQDZYHMNU-UHFFFAOYSA-N 446.525 4.450 10 10 IICE CN1CCN(Cc2cccc(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)c2)CC1 1650722854 GBQWHJXAEKEKOI-UHFFFAOYSA-N 444.535 4.185 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@]3(C)c3ccccc3)cc2F)C[C@@H](C)O1 1654648213 YCGFDNLXASHZIY-XMERXJNXSA-N 439.575 4.067 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@@H](c2ccc(F)c(F)c2)C1 1684280345 JJMMUARGPWRNHH-LJQANCHMSA-N 429.511 4.015 10 10 IICE COc1ccc(CNC(=O)NCc2c(Cl)cc(Br)cc2Cl)c(O)c1 1687705252 YMIYXDFVMKHZNL-UHFFFAOYSA-N 434.117 4.470 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)(C)C 1695437382 VQGBPBZSYXLHHB-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CNC(=O)[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1[C@@H]1C[C@H]1C(C)C 1696901635 HBVXEOLAQQRFHR-JWNTYJGQSA-N 448.615 4.388 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CC[C@@H](CC(C)C)C2)cc1 1746090220 QYNHNLJOKIHJPX-NRFANRHFSA-N 435.620 4.446 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1764935882 CKNKGUMRHCLFLX-HXUWFJFHSA-N 448.615 4.162 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N([C@@H]2CC(=O)N(c3cccc(C)c3)C2=O)C1=O 1772759327 VQIDPVVZENGYDS-MYJZHROTSA-N 448.569 4.475 10 10 IICE CC(=O)N1CCc2cc(-c3csc(SCC(=O)c4ccc(O)c(O)c4)n3)ccc21 1860805279 ANZFNNFJOFFTBS-UHFFFAOYSA-N 426.519 4.105 10 10 IICE C[C@@](NC(=O)OCc1ccccc1)(C(=O)O)c1cc(Cl)cc(Br)c1O 1951857185 BLNVOBCWFPMMEB-KRWDZBQOSA-N 428.666 4.034 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)Nc1ccc(C(=O)O)cc1 2293039574 OOWPMRNPEHSELQ-UHFFFAOYSA-N 446.937 4.268 10 10 IICE COc1ccc(C(=O)Oc2ccc(C=C3C(=N)N4OC(C)=CC4=NC3=O)cc2Cl)cc1 2297347697 UMLJWKJCDKMDAE-UHFFFAOYSA-N 437.839 4.018 10 10 IICE CCOc1cc(C=C2C(=O)N(Cc3cccc(F)c3)N=C2C)cc(Br)c1O 2332110939 RWAPUSYYBTVFET-UHFFFAOYSA-N 433.277 4.494 10 10 IICE COc1ccc(N2CCN(C(=O)Cn3c(-c4ccccc4)cc(C(C)=O)c3C)CC2)cc1 9502144 SDWUNPOYUXWVTI-UHFFFAOYSA-N 431.536 4.024 10 10 IICE O=C(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14476238 HJGRQAURCQFWEW-DDOIHHOZSA-N 435.480 4.036 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccccc3C)C2=O)cc1OC 15045498 KRZDGMJBFBBGLN-YQNUULROSA-N 442.562 4.241 10 10 IICE NS(=O)(=O)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N3C[C@H]1CC=C[C@H]21 35337452 FUJFNZKSUFSRDU-DJIOSBNXSA-N 449.532 4.137 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3CCN(Cc4ccc5c(c4)OCO5)CC3)c2C)cc1 62659019 GJBNQRWSYSZCRV-UHFFFAOYSA-N 445.563 4.132 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2ccccc2NS(C)(=O)=O)c(C)n1-c1ccccc1F 108601168 CMUDPJMYZWGDEZ-HNNXBMFYSA-N 429.517 4.096 10 10 IICE COc1cc(NC(=O)C(=O)N(c2ccccc2)c2ccc(N)cc2)c(OC)cc1Cl 170389045 QRORNNSDWTYLMD-UHFFFAOYSA-N 425.872 4.243 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccc(C)cc3C)C2=O)ccc1OCC(=O)O 210451352 PLSUCPCEUBWEPB-ZDLGFXPLSA-N 429.519 4.181 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccnc(N3CCCCC3)c2)C1 435547133 BMECXZAKDBWYAR-UHFFFAOYSA-N 445.611 4.110 10 10 IICE Cc1cc(CCNC(=O)N[C@H](c2nnc3ccccn23)C(C)C)c(C)n1-c1ccccc1 726191527 DDTMKKGHYRDCGZ-QHCPKHFHSA-N 430.556 4.376 10 10 IICE Cc1cc(CCNC(=O)C[C@H](c2ccccc2)N2CCOC2=O)c(C)n1-c1ccccc1 728265329 KEIBIJAANIRLLZ-XMMPIXPASA-N 431.536 4.336 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCCN(C(=O)Oc3ccccc3)CC2)c1O 738143898 JLKLAMHGJWPKGW-UHFFFAOYSA-N 434.492 4.039 10 10 IICE Cc1cc(C(=O)CSc2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccc2c(c1)OCO2 749752348 OFUCFWMMRYNOJV-UHFFFAOYSA-N 443.546 4.201 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Nc3nn(C4CCCCC4)cc3C)cc2F)CC1 752904026 KRXDXDOVJGJEOQ-UHFFFAOYSA-N 442.583 4.299 10 10 IICE Cc1noc(C)c1CO[C@@H]1CCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1 762631608 DOJXLLGNEKDWJJ-OAQYLSRUSA-N 425.504 4.312 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2c(F)cccc2-n2cccn2)C1 766611463 KWRHBEDTTZQZBD-UHFFFAOYSA-N 431.515 4.371 10 10 IICE O=C(NCC[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 766615737 PWHTYBKSHJKDEE-HXUWFJFHSA-N 430.464 4.387 10 10 IICE Cc1ccc2c(CCC(=O)NCc3ccc(N4CCN(CC5CC5)CC4)cc3)c[nH]c2c1 768533468 QPVBJGGFTWJKGM-UHFFFAOYSA-N 430.596 4.257 10 10 IICE COc1ccccc1CN(C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C1CC1 769047752 HGOYOGLBIZEMJF-UHFFFAOYSA-N 448.611 4.101 10 10 IICE COCc1nc(C(=O)OCC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)co1 775090220 SIOPZXANJUPPTD-UHFFFAOYSA-N 447.285 4.031 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc3ncsc3c2)nc1-c1cccc([N+](=O)[O-])c1 775149718 UHKCXYBRLGHHAS-UHFFFAOYSA-N 432.508 4.437 10 10 IICE C[C@@H]1CN(c2ccc(CN[C@@H](c3ccc(F)cc3)c3ccn(C)n3)cc2F)C[C@@H](C)O1 775621509 KTPQDGFOACZJIE-OJLQRUNKSA-N 426.511 4.191 10 10 IICE Cc1c(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cccc1N(C)C 776033308 GIDIVNAODWTSRI-UHFFFAOYSA-N 436.478 4.238 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1nnc(SCc2ccc(F)cc2)s1 797607960 VPQSFKPBBNZWIR-NSHDSACASA-N 434.518 4.133 10 10 IICE Cn1nccc1[C@@H]1CCCCN1Cc1cc(Br)cc(Br)c1O 798961433 WVEMFZMWRFANGP-HNNXBMFYSA-N 429.156 4.378 10 10 IICE Cc1nn(-c2ccccc2)cc1CCCNC(=O)NCc1cc(Br)ccc1O 804968693 IRRMQSCAVNJUCX-UHFFFAOYSA-N 443.345 4.081 10 10 IICE CC[C@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1cc(Cl)cc(Cl)c1O 806142827 GEKOUZQZKZIROM-WFXMLNOXSA-N 448.394 4.339 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2C[C@@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1C 807705487 JKWFUPOHBSYIDL-RTWAWAEBSA-N 443.547 4.052 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)cc1 1125766196 LTDVYPQGICVAJI-UHFFFAOYSA-N 439.918 4.485 10 10 IICE Cc1cc(CC(=O)N2CCC(C(=O)NCc3ccccc3)CC2)c(C)n1-c1ccccc1 1135654339 KACWZTNVSVBNJJ-UHFFFAOYSA-N 429.564 4.192 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H]2C(=O)N(Cc1ccco1)Cc1ccccc1O 1149856672 BGCZNHIINNGVLA-HOJAQTOUSA-N 426.513 4.302 10 10 IICE Cc1cc(C(=O)N2CCN(C3CCCC3)[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1177712628 HWRNZDRSYMZIJZ-MRXNPFEDSA-N 445.405 4.341 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCCCOC(=O)[C@H](C)O 1188366561 ZEOLWICERXDLEE-AWEZNQCLSA-N 441.391 4.375 10 10 IICE CC(C)C[C@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(=O)OC(C)(C)C 1230278441 NJINQMMIVUFHKF-WOJBJXKFSA-N 434.577 4.087 10 10 IICE CCN(C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)[C@H](C)Cc1ccc(OC)cc1 1251501083 NHUASMCHSBEYSR-NTKDMRAZSA-N 426.605 4.027 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@H](CC(=O)OC(C)C)C2)c(C)n1-c1ccccc1 1253808401 RONLTLZZSSQRCV-OAQYLSRUSA-N 425.573 4.400 10 10 IICE COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1272047740 MDJSYWXFBZIGGU-FQEVSTJZSA-N 442.865 4.244 10 10 IICE C[C@@H](Oc1cccc2ccccc12)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1275224581 OOPOXMRIXDPAQX-MRXNPFEDSA-N 426.463 4.038 10 10 IICE Cc1cc(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)c(C)n1-c1ccc(Br)cn1 1294209783 BZTVNTVEUITSHV-UHFFFAOYSA-N 441.285 4.316 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)Cc2ccccc2)c(C)n1-c1ccc(Br)cn1 1295272208 WNOFKDVJGIPBOK-OAHLLOKOSA-N 440.341 4.182 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1296922882 MDLPIAZTWISZGT-WOJBJXKFSA-N 431.600 4.469 10 10 IICE COCCCN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1301597967 BXSLIZXUOGZRQF-UHFFFAOYSA-N 429.634 4.010 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cnc3ccnn3c2C(F)F)cc1 1353013207 KAPAJQDAEXRSMK-UHFFFAOYSA-N 425.439 4.169 10 10 IICE COc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OC(C)C 1445879177 DITPNNGAOKNRRW-IBGZPJMESA-N 432.948 4.236 10 10 IICE CCOC(=O)c1ccccc1N(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1456029831 HQGMFVPGWCYQEV-UHFFFAOYSA-N 433.552 4.248 10 10 IICE Cc1cc(C(=O)NCCN(C)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1464498453 JKCCGUGCJPSWIT-UHFFFAOYSA-N 433.394 4.246 10 10 IICE CCOC(=O)[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)Cc1ccccc1 1464523346 UMSWHIGFLSPSQL-QHCPKHFHSA-N 446.547 4.367 10 10 IICE CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc(C)n(-c2ccccn2)c1C 1466158951 AUQLRTCOYGMGOL-JOCHJYFZSA-N 432.568 4.321 10 10 IICE COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)NCc2c(O)ccc3ccccc23)cc1OC 1472086150 NYMVDSPTXFHGRJ-PBHICJAKSA-N 434.492 4.087 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@@H](c3ccccc3)C3CCCC3)CC2)cc1F 1473270204 PZRDXNFDNRANGW-VWLOTQADSA-N 425.548 4.004 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2C[C@@H](C)[C@@H](C)C2)cc1 1501844315 OMEXGZTXFYJLIC-KDURUIRLSA-N 435.620 4.126 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1520277072 XYUVCEBOPWPXJH-KRWDZBQOSA-N 449.640 4.177 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CC[C@H](C3CC3)N2C(=O)OC(C)(C)C)C2CC2)cc1 1524793230 CPDUEDSSVDCWGI-FGZHOGPDSA-N 427.589 4.422 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1531694884 WTPHJNMGGCIRCX-QGZVFWFLSA-N 429.923 4.091 10 10 IICE CC(C)(C)CNC(=O)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1534011255 XJAWYHYPXPWOEV-UHFFFAOYSA-N 440.499 4.490 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3cc(Cl)ccc3Cl)CC2)c(OC)c1 1534587013 LXNCHRRFSQPHGP-UHFFFAOYSA-N 441.380 4.452 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@@H]21 1536551132 XCCYTRGBURDDQE-LBPSXOOBSA-N 427.386 4.457 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(CCC(=O)OC(C)(C)C)C2CCOCC2)cc1 1537568213 ZQASRCGPVOJSIC-UHFFFAOYSA-N 426.557 4.447 10 10 IICE Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1538157922 QTJAZPUWMXLNMI-DEOSSOPVSA-N 435.955 4.298 10 10 IICE Cc1c(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)nnn1Cc1ccc(F)cc1 1544251938 BOEWZFKBCJALAB-UHFFFAOYSA-N 435.547 4.473 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC(C)(C)C1 1544616948 UCTWFBBMOHTZBP-SFHVURJKSA-N 443.611 4.472 10 10 IICE Cc1ccc(-c2cc(C(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)n[nH]2)cc1C 1544677539 URIGKOCGDKOUSM-HDICACEKSA-N 436.531 4.376 10 10 IICE COc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OCC(C)C)c1 1545632637 REHKPEWPNAEIOG-LJQANCHMSA-N 446.975 4.483 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCO[C@@H](C(F)(F)F)C3)nnc2C(C)(C)C)cc1 1547448346 KWMFKLXWHYUZSE-GOSISDBHSA-N 439.526 4.238 10 10 IICE CN(C)c1ccc(Cn2c(C3CCC3)nnc2N2CCN(CCC(C)(C)C)CC2)cc1F 1552824567 ZXJITQAVUBVYFN-UHFFFAOYSA-N 442.627 4.357 10 10 IICE COCCCN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1555479964 HNRRWLYYRHRZRE-HSZRJFAPSA-N 441.620 4.277 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCc4cc(Br)ccc43)C2)cc1 1584444734 YZJQUKONGMJPAH-QVKFZJNVSA-N 429.358 4.130 10 10 IICE Cc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1N1C(=O)CCC1=O 1586204547 CXCWCIAQGLYRKC-UHFFFAOYSA-N 443.503 4.050 10 10 IICE Cc1cc(C(=O)Nc2cc(Cl)c(=O)n(C)c2)c(C)n1-c1cccc(Br)c1 1611000310 SMUAOMGZRRTCLG-UHFFFAOYSA-N 434.721 4.461 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCC[C@H]3CCC3CCCCC3)CC2)cc1 1616347334 PSVZFLYQWCLGSW-ZCYQVOJMSA-N 429.649 4.003 10 10 IICE COc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(OC)c(C)c1OC 1617811599 GMMAPWBPKXSBKE-UHFFFAOYSA-N 436.508 4.422 10 10 IICE COC(=O)[C@@H]1c2ccccc2CCN1C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1620465652 BKFVCGQHYZGUPQ-DEOSSOPVSA-N 430.504 4.128 10 10 IICE COc1cnc([C@@H]2CCCN2CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)nc1O 1620648096 LORYYCPBHSLEKO-IBGZPJMESA-N 432.484 4.382 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](C)N(CC)C(=O)OC(C)(C)C 1622327835 BVGSRHCPHKEKAE-ZDUSSCGKSA-N 429.355 4.149 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)c1 1627321786 RNJWPTYTPYUMIZ-UHFFFAOYSA-N 444.623 4.292 10 10 IICE Cc1csc(CCCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1634163240 WFDQIQLNNKLHMF-IBGZPJMESA-N 446.617 4.222 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@]2(C)C(=O)OC(C)(C)C)CCCC1 1641912805 GPTWYOHMGKPZGE-RUZDIDTESA-N 426.557 4.252 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)c2cccc(Br)c2)c(C)n1-c1ccccn1 1642634683 NKBMTHUSSCMQNU-IBGZPJMESA-N 428.330 4.057 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](C(=O)NCc2c(O)ccc3ccccc23)(C(F)(F)F)C1 1645441182 VSLMMDPJOKUJHF-OAQYLSRUSA-N 438.446 4.351 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](C)c3cccc(OC(F)(F)F)c3)C2)cc1 1673823629 XHXDPTKCFPMIPM-HOTGVXAUSA-N 437.462 4.481 10 10 IICE Cc1cc(CCNC(=O)NCCCNC(=O)/C=C/c2ccccc2)c(C)n1-c1ccccc1 1680541205 IVEQEWWUZOOATM-CCEZHUSRSA-N 444.579 4.156 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCc3cnc4c(Cl)cnn4c3)c2C)c1 1682619536 MGMSNSUIQNWEAD-UHFFFAOYSA-N 436.947 4.141 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](Oc4ccccc4Cl)C3)C2)cc1 1683337004 ROHCHQZCEVNPRE-XLIONFOSSA-N 429.948 4.038 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CC[C@@H]1c1ccc(Br)cc1 1684279952 DFUQANQCGYXXEP-OAQYLSRUSA-N 444.373 4.067 10 10 IICE CO[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)CC[C@H]1C 1712070151 BWKBOQYSHLEXKM-RHSMWYFYSA-N 433.603 4.347 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1728381603 UXGPKNDWHJTBJV-HSZRJFAPSA-N 434.588 4.096 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCSCC(F)(F)F)n1 1742313938 CVHLEHCOZMESIX-UHFFFAOYSA-N 437.491 4.286 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1769561520 MWLZLCOCOKAQNL-ZWKOTPCHSA-N 425.602 4.329 10 10 IICE CSCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnn(C)c1 1771471317 JTTNODMQUHCYHG-UHFFFAOYSA-N 449.628 4.324 10 10 IICE CCOc1ccccc1NC(=O)[C@@H](C)Oc1cccnc1NC(=O)Oc1ccc(N)cc1 1858686779 DHKPALHMHZOFGY-OAHLLOKOSA-N 436.468 4.079 10 10 IICE O=C(NC[C@@H](NCc1c(O)cccc1Br)C(F)(F)F)OCc1ccccc1 1942700607 FKJCWTMFEOXFDP-MRXNPFEDSA-N 447.251 4.102 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NCc2ccc(Br)cc2O)C1 2092950235 QYXIMHWHQDXCDM-USXIJHARSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC(NCc3cc(Br)cc(F)c3O)C[C@H]2C1 2102638196 QLRJXCFEZWVGPU-STQMWFEESA-N 429.330 4.029 10 10 IICE CN(C)C(=O)CN(Cc1ccccc1)c1ccc(CNC2CCC2)c(Br)c1 2239982910 GIJOFSSKYDQSSP-UHFFFAOYSA-N 430.390 4.186 10 10 IICE CC[C@H](Nc1cnn(C)c1I)c1cc(Br)ccc1O 2265294188 CEZMXAUKEQXZEA-JTQLQIEISA-N 436.091 4.056 10 10 IICE Cc1c(N2C(=O)C(=Cc3ccccc3F)SC2=S)c(=O)n(-c2ccccc2)n1C 2296537318 CKIFOCHSZSDWLM-UHFFFAOYSA-N 425.510 4.029 10 10 IICE Cc1ccc(OCCOCCOc2cccc(C=C3SC(=S)NC3=O)c2)cc1C 2297306597 WZUNRUFAJZFWDV-UHFFFAOYSA-N 429.563 4.267 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc(Br)o2)SC1=S)OC1CCCCC1 2314739769 NJXHFMYHCSBZJF-UHFFFAOYSA-N 430.345 4.119 10 10 IICE COc1ccc(/C=C2\SC(=S)N(NC(=O)c3csc4c3CCCC4)C2=O)cc1 1405199 HUBOXCPFYXWBJS-YVLHZVERSA-N 430.576 4.182 10 10 IICE N=C1/C(=C\c2ccc(OCc3ccccc3)cc2)C(=O)N=C2SC(c3cccnc3)=NN12 2422100 NUUOSYNZTUZQHK-NHOPXOSBSA-N 439.500 4.328 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3cc(-c4csc(C)n4)sc3C)CC2)cc1 33308412 GEZYMAIEOFNSSF-UHFFFAOYSA-N 449.623 4.008 10 10 IICE C[C@H](NC(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O)c1ccccc1 33579022 STNWZCBMXLTUKG-AWEZNQCLSA-N 447.874 4.150 10 10 IICE CCCCc1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n[nH]1 224385436 APRBMRSWZRFTFG-NTCAYCPXSA-N 434.612 4.434 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3F)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526203118 JYVKCOZYOBLKMN-JOCHJYFZSA-N 437.423 4.311 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@](C)(CNCc2cc(Br)cc(F)c2O)C1 715813276 NNHTWLSZDYIITF-IBGZPJMESA-N 431.346 4.421 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1 739064243 PHZCEWLNRDCMRD-UHFFFAOYSA-N 448.611 4.371 10 10 IICE C[C@@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@H](c2ccc(F)cc2)O1 743554343 BJFZJEFKHPBMCJ-VGOFRKELSA-N 429.561 4.051 10 10 IICE Cc1nn(C)c(C)c1[C@H](NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(F)(F)F 757888653 XEEJFNMGRQUYJT-FQEVSTJZSA-N 437.510 4.472 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1)C(F)(F)F 758164181 VEIGYOHLUWWMNV-UHFFFAOYSA-N 429.203 4.001 10 10 IICE COc1cc(N2CCN(C(=O)NCC(C)(C)C3=CCCCC3)CC2)cc(OC)c1OC 773471431 FTTPUNGJBPEROH-UHFFFAOYSA-N 431.577 4.071 10 10 IICE CCCN(CCC)c1ccc(CNc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)cc1 785554007 BDRLIEQVRZUSDF-UHFFFAOYSA-N 445.629 4.071 10 10 IICE C[C@H](Cn1ncc2ccccc21)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 790574258 KFZSIRKHZGNDND-AEFFLSMTSA-N 428.483 4.059 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)c2cnc(C(=O)OC(C)(C)C)cn2)c1C 801890325 HSYDJUYUGGXOIQ-UHFFFAOYSA-N 449.507 4.188 10 10 IICE CCN(Cc1ccccc1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1124445285 UUKCTCNHHXIWQB-XMHGGMMESA-N 428.554 4.466 10 10 IICE COc1ccc(Cl)cc1NC(=O)CCNC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1126933733 XWHUIIHHTZWXSU-UHFFFAOYSA-N 439.943 4.444 10 10 IICE CCOC(=O)[C@@](C)(NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)c1cccnc1 1128828015 CBRVZMHZSOCTSH-QHCPKHFHSA-N 425.916 4.351 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H]1Cc2cc(Br)ccc2O1 1135964768 NHEZYNLKEYUDCS-NRFANRHFSA-N 429.358 4.402 10 10 IICE CCOC(=O)[C@@H](Cc1ccccc1)N(C)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1138558132 ZFHUAAIAYVVPIX-XMMPIXPASA-N 432.520 4.153 10 10 IICE COC(=O)[C@H]1CN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)Cc2ccccc21 1233974266 MULYPMMLKGWJAR-DEOSSOPVSA-N 431.536 4.119 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1ccccc1C(=O)OC(C)(C)C 1251989782 QOIRWSAOKKTNFO-SFHVURJKSA-N 425.573 4.447 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(C)c3C)C2)sc2c1CCCCC2 1264552677 GWUFRRWYVQFBBY-INIZCTEOSA-N 440.565 4.412 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccc4nc(O)n(CC(C)(C)C)c34)C2)cc1 1276831817 FRHKVAQVYDHQGH-KRWDZBQOSA-N 436.556 4.053 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(F)(F)c3ccc(Br)cc3)C2)cc1 1276832016 LHRHOHGMBSYNHT-AWEZNQCLSA-N 439.300 4.192 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1292179585 WBKRTQBKLOATCM-INIZCTEOSA-N 434.367 4.461 10 10 IICE COc1ccc(-c2nnc(N3CC=CCC3)n2CCCSc2nccs2)cc1OC 1300029939 YZGIHYIPGOCPME-UHFFFAOYSA-N 443.598 4.368 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCCCC1)OC 1300998567 KOCGLTAVIABYCR-QFIPXVFZSA-N 437.588 4.394 10 10 IICE C[C@@H](NC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)c1ccccc1O 1302530388 NSVJDDOBHKXUGT-CQSZACIVSA-N 430.913 4.337 10 10 IICE CC(C)N1CCN(CCCSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)CC1 1307286634 NHSNALUEXNPOJV-QFIPXVFZSA-N 428.646 4.237 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N(C)CC(C)(C)C)cc1 1313674668 VMUAWCZYDVMQIA-UHFFFAOYSA-N 449.603 4.302 10 10 IICE COc1cccc(-c2nnc(Nc3ccn(C)n3)n2CCCSc2nccs2)c1 1315573691 ZCWGSBSCGVAFDC-UHFFFAOYSA-N 427.559 4.070 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2cc(F)ccc2Br)cc1 1442599560 HAIUMTJPFNQROM-FQEVSTJZSA-N 449.364 4.405 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@H]1C[C@@H]1c1ccccc1 1461158635 PMPOCPPBGMAVIQ-MVBZRGLFSA-N 440.565 4.337 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(Cl)ccc3OC3CCCC3)cc2)CC1 1462467189 MDMRWAZMJVJMGK-UHFFFAOYSA-N 427.976 4.343 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc2n1CCN(C(=O)OC(C)(C)C)[C@@H]2C 1465028174 FMIGGHSQGPWLRR-QGZVFWFLSA-N 426.561 4.104 10 10 IICE CCOC(=O)c1c(NC(=O)CN2Cc3c[nH]nc3[C@@H](C)C2)sc(C)c1-c1ccccc1 1473703260 GLQBPFWTJAGZKF-AWEZNQCLSA-N 438.553 4.181 10 10 IICE COc1ccc(C2(NC(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CCCC2)cc1 1478786214 KUFAEHIHOUTMGA-UHFFFAOYSA-N 445.510 4.079 10 10 IICE C[C@H]1CCCN(CCCCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1493794694 XJFBOKJTFIHQLS-REWPJTCUSA-N 441.620 4.374 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccn2ccnc2c1 1527606346 LPJXZOKUJHCDAK-QINSGFPZSA-N 428.564 4.016 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3cc(C)ccc3C(C)C)cc2F)CC1 1530377431 SLMIBUMSCVIYRI-HXUWFJFHSA-N 441.591 4.483 10 10 IICE Cc1ccc(N2C[C@@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1F 1530890557 WOQOSDLLDQSGKZ-NRFANRHFSA-N 433.527 4.253 10 10 IICE O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1c(Cl)ccc2nonc12 1531534418 ZOQDTIXLKZEQSP-UHFFFAOYSA-N 429.742 4.244 10 10 IICE COC(=O)CNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)C[C@H](C)C2 1540610199 LZFVIBWSBTYXAH-STZPCZCHSA-N 443.547 4.327 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCCCC1CCOCC1 1544528699 FWWWGUXILDSWTI-SAPNQHFASA-N 438.640 4.053 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)CCCC1 1557536774 CGHXHLXTJNKZJR-HKUYNNGSSA-N 440.584 4.355 10 10 IICE CCCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1cccc(C)c1 1586061287 OUBNOJUKUMJFMI-RUZDIDTESA-N 433.600 4.232 10 10 IICE CCCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(F)cc1 1586061950 YMMAIBFLRKWOGI-DEOSSOPVSA-N 437.563 4.063 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1C[C@H]1c1ccsc1 1588136426 JJZUSCCOZLZZOB-XXZXCBLQSA-N 434.633 4.463 10 10 IICE C[C@@H](CC(=O)NCc1ccc2c(c1)CCCN2C)C1CCN(C(=O)OC(C)(C)C)CC1 1597849873 XZSMPTRRNMBHQN-SFHVURJKSA-N 429.605 4.359 10 10 IICE CCc1nnc(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1613902523 OJEUXAMNEAZYLQ-UHFFFAOYSA-N 425.606 4.100 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1615377876 CEBOLWPSBDWASL-LJQANCHMSA-N 434.588 4.238 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)cc1 1616534583 PMDFIAKJMMPIQO-UHFFFAOYSA-N 439.947 4.015 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](CC)[C@H]2CCCO2)sc(C)c1-c1ccccc1 1617103421 LSQUBPFJUMLSLQ-ZWKOTPCHSA-N 430.570 4.386 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1 1623460510 IRFDDDDGCDICJO-UHFFFAOYSA-N 431.536 4.497 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1C 1624339712 JIWUFMIDDLIHLP-UHFFFAOYSA-N 434.559 4.094 10 10 IICE Cc1nnc(COc2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc2)o1 1627283932 QQNHFJGIHORVTK-UHFFFAOYSA-N 444.491 4.358 10 10 IICE CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)NCc1ccc(N2CCC(C)CC2)cc1 1627467309 DRIWRMAETLYHBU-UHFFFAOYSA-N 444.919 4.373 10 10 IICE Cc1cccc(CN2CCN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)CC2)c1 1628456263 FKPBEWSGRGFNOZ-UHFFFAOYSA-N 429.564 4.102 10 10 IICE CCN(C[C@@H]1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)C1)CC(F)(F)F 1629505854 BVNSBSZEZCGKOW-SFHVURJKSA-N 435.490 4.253 10 10 IICE Cc1cc(C(=O)N2CCN(c3ccc(C(N)=O)cc3)CC2)c(C)n1-c1ccc(C(C)C)cc1 1629584501 GVAGNYOBIRNBBJ-UHFFFAOYSA-N 444.579 4.279 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N(CCO)CCOCC(F)(F)F)cc1 1630929714 FEHITOMMENYYPX-UHFFFAOYSA-N 438.450 4.181 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3cccc(O)c3O)[C@H]2c2cccs2)cc1 1633507381 HGAWLHSIBCPUFF-AVRDEDQJSA-N 436.533 4.268 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C(F)(F)F)c(C)n1-c1ccccc1Br 1634080866 CMKSWCFGVZGTTB-INIZCTEOSA-N 431.252 4.260 10 10 IICE CCOC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1640798412 CAIDIWCQBZGHTP-QAPCUYQASA-N 433.346 4.318 10 10 IICE C[C@@H]1CC[C@@H](C(F)(F)F)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1645250609 CWZDCGOFOCVFLV-ZIAGYGMSSA-N 430.426 4.063 10 10 IICE CCCCC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1647827415 BWSMVALBNIMFIK-JAXLGGSGSA-N 433.612 4.490 10 10 IICE Cc1cc(C(=O)N[C@H](C2CCC2)[C@H]2CCOC2)c(C)n1-c1ccc(Br)cn1 1648998447 GTQVTDBNGVLCJH-OXJNMPFZSA-N 432.362 4.187 10 10 IICE COc1ccc2cc(CN(C)C(=O)[C@@H](C)N3CCOc4cc(N(C)C)ccc43)ccc2c1 1658081424 CBWQCARZYCJGEA-GOSISDBHSA-N 433.552 4.160 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCC3(O)CCC(F)(F)CC3)cc2Cl)C1 1681828105 PQOQTCSWQRFNBY-OAHLLOKOSA-N 429.939 4.316 10 10 IICE Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1681899071 FACGQRALQYSVDS-NRFANRHFSA-N 435.490 4.449 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCOc4cc(O)ccc4C3)cc2Cl)C1 1682024355 RAEFPUVKTKOVAU-INIZCTEOSA-N 429.948 4.386 10 10 IICE Cc1ccc(C[C@@]2(C)CCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1683018008 BLZQKCRSGTWIBK-RUZDIDTESA-N 443.538 4.417 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1CC2(C1)CC(NC(=O)OC(C)(C)C)C2 1683425451 PSMFQFHYLSWJIJ-RQILOKFUSA-N 444.620 4.127 10 10 IICE CC1(C)C[C@H](c2ccccc2)CN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725516 MRPQYALGXVZCST-IBGZPJMESA-N 429.511 4.279 10 10 IICE COCC1CCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC1 1697871641 VLSJHCPWGDCYTQ-UHFFFAOYSA-N 444.630 4.150 10 10 IICE CCc1nnc(N(C)CCC2CCOCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1709045277 KZHXIZVSNGAVSJ-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCC(C)C 1729705559 SNDOPBPKZGKNRZ-UHFFFAOYSA-N 436.604 4.361 10 10 IICE COCC1(C)CCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1730500855 KXXJJSKAKJQAEH-JOCHJYFZSA-N 441.620 4.195 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)[C@@H]1C 1752492679 NWTYKIXENSABSQ-FQEVSTJZSA-N 448.615 4.456 10 10 IICE CC(C)c1nnc(N2C[C@H](C)O[C@H](C(F)(F)F)C2)n1CCCSc1nccs1 1763061328 ZCWZWMHYMPPASZ-STQMWFEESA-N 435.541 4.196 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)OC2CCCC2)cc1 1766614074 KGXKWMAEYCKSEF-UHFFFAOYSA-N 434.588 4.469 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1772851089 CGJBKBRNZIWKJS-GOSISDBHSA-N 447.574 4.284 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCc2ccco2)sc(C)c1-c1ccc(Cl)cc1 1860758350 DYXUMDBIKDUCSW-UHFFFAOYSA-N 446.912 4.402 10 10 IICE Oc1ccc(Br)cc1Cn1ncc(C2CCC2)c1I 2070241103 PKGWRDJWGDYABD-UHFFFAOYSA-N 433.087 4.272 10 10 IICE N=C1C(=Cc2ccc(Br)cc2)C(=O)N=C2SC(Cc3ccccc3)=NN12 2297344256 JHULHRVOZFFGEG-UHFFFAOYSA-N 425.311 4.311 10 10 IICE CCN1C(=O)/C(=C\c2cc(OC)ccc2OCCOc2ccc(OC)cc2)SC1=S 33447360 UFEIYXJNWDYDFG-XSFVSMFZSA-N 445.562 4.383 10 10 IICE COc1ccc(CCN/C=C2\C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)cc1 100357701 YKUKYEJQNCGHDQ-QJOMJCCJSA-N 442.475 4.071 10 10 IICE Nc1cc(F)cc([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1O 687740736 GGNRLSWQFQZGTH-NRFANRHFSA-N 436.439 4.168 10 10 IICE CCN(CC)c1ccc(CNC(=O)N[C@H](C)c2ccc(N3CCCC3=O)cc2)cc1F 731402961 AGAHBAPTVDJBGQ-QGZVFWFLSA-N 426.536 4.359 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C[C@H](C)c3ccc(C(F)(F)F)cc3)CC2)cc1 742916431 HZNNUCURVAQGFA-SFHVURJKSA-N 449.517 4.146 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1cc(F)c(Br)cc1F 759480181 YHWSAJQYPSCGHV-UHFFFAOYSA-N 432.271 4.047 10 10 IICE COc1ccccc1C/C(C)=C\C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768913657 NNIGNMWGHJJJNZ-UZYVYHOESA-N 433.596 4.032 10 10 IICE Cc1nc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cc(C2CC2)n1 769745715 ZOVNNYLVPVYGBD-MHWRWJLKSA-N 444.607 4.344 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](c3cccc(F)c3F)C(F)(F)F)CC2)cc1 776015470 VCPDOJPCSXHGLV-LJQANCHMSA-N 443.416 4.499 10 10 IICE CNC(=O)CC(=O)Nc1nc(-c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)cs1 789909526 YDKBTXQJEMCMCV-UHFFFAOYSA-N 436.459 4.311 10 10 IICE CCOC(=O)C1(COC)CCN(Cc2c(O)ccc3cc(Br)ccc23)CC1 794706477 YJBYGLBUBXBEPL-UHFFFAOYSA-N 436.346 4.100 10 10 IICE COc1ccccc1CN(CCO)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 800718716 CVOOKISJTWOLIW-GOSISDBHSA-N 445.991 4.289 10 10 IICE COc1cc(OC)c(C2CCN(c3ccc(/C=C/C(=O)O)cc3[N+](=O)[O-])CC2)c(OC)c1 915213746 LTHJTEARSFFRPM-FNORWQNLSA-N 442.468 4.102 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCCSCc3ccccc3)cc2F)C[C@H](C)O1 918187043 QHKNAXRWCRDYAL-ROUUACIJSA-N 431.577 4.172 10 10 IICE COc1ccc(C)cc1CN1CCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)CC1 1135666185 WMWYLPPCWHUZAN-UHFFFAOYSA-N 445.563 4.182 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@@H](F)CN2C(=O)OCc2ccccc2)cc1F 1136730393 NKSTXYOKJRRDDZ-DENIHFKCSA-N 445.510 4.037 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C2CN(C(=O)C3CCCCC3)C2)cc1 1144710494 FJIRAJJZXMXVDF-UHFFFAOYSA-N 449.595 4.333 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3F)C2=O)c(C)n1-c1ccccc1 1188635753 RTDMLSQIGCHDBU-XMMPIXPASA-N 437.446 4.022 10 10 IICE COc1ccc(N2CCCN(C(=O)NCCCCCCNC(=O)OC(C)(C)C)CC2)cc1 1252146228 BPVFUTJTOODJLX-UHFFFAOYSA-N 448.608 4.002 10 10 IICE CN(C)[C@@H]1CCc2cc(Br)ccc2N(C(=O)/C=C\c2ccc(Cl)nc2)C1 1280507423 KEGFEVQSUVOAKE-BOHLGEJMSA-N 434.765 4.420 10 10 IICE CCOCc1nnc(N(C)Cc2cccs2)n1Cc1ccc(N2CCSCC2)cc1 1297063468 QUBRHNCRNFBPGE-UHFFFAOYSA-N 443.642 4.114 10 10 IICE CCOCCC1(Cn2c(C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CCCC1 1297425578 RQBGLSDQNUETST-UHFFFAOYSA-N 445.583 4.048 10 10 IICE Cc1cc(C(=O)NC[C@H](N2CCOCC2)C(F)(F)F)c(C)n1-c1cccc(C(C)C)c1 1297536662 BNBQUOQWMNVKAO-NRFANRHFSA-N 437.506 4.210 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Cc2ccc(Cl)cc2)CC1 1313065013 OWVXRROBWIPIGD-UHFFFAOYSA-N 442.003 4.465 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)OCC(=O)c2cccc(S(C)(=O)=O)c2)c1 1321910699 AJFIDWMBSCMOSU-UHFFFAOYSA-N 445.924 4.191 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CN(Cc3ccccc3)C[C@]2(C)c2ccccc2)cc1 1348909450 IGTARMHCOVNFSO-IXCJQBJRSA-N 427.592 4.459 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1c(O)cnc2c(Br)cccc12 1445901342 MJPSZLKKMWELBB-UHFFFAOYSA-N 427.298 4.217 10 10 IICE CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1446419028 ZHGNAVHNOMFDIF-UHFFFAOYSA-N 429.542 4.458 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C3CC3)O[C@H](C)C2)sc(C)c1-c1ccccc1 1460038597 LOUFKRMHRNWFGO-DNVCBOLYSA-N 442.581 4.338 10 10 IICE CC[C@H](C)CCNC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 1461441630 XDLKZMKDBJZKCN-GQVHDAKQSA-N 441.416 4.203 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 1465969348 LOWIIHHZGOWDBL-AREMUKBSSA-N 429.564 4.182 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC(C)(C)c2nc3ccccc3n2C)cc1 1467297940 CBDVXKOBYSZGPL-UHFFFAOYSA-N 428.536 4.387 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](c3ccccc3)C3CCCCC3)CC2)cc1 1473284856 ZYMCQSOPFGNNPX-VPUSJEBWSA-N 437.628 4.089 10 10 IICE CCc1ccc(C(C)(C)NCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 1473326108 BWWUYZFCSWOGFT-OALUTQOASA-N 441.591 4.143 10 10 IICE CCCC1(Cn2c(COCC)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CC1 1500202615 RAQRDMLWSMHNSL-UHFFFAOYSA-N 427.593 4.120 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C[C@H]1C 1502257548 MBZSSKVSGXQFCK-UXHICEINSA-N 426.653 4.208 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2CC(F)(F)C2)n1Cc1ccc(N2CCOCC2)cc1 1512813886 IUGVJPCXXQOOKM-QGZVFWFLSA-N 433.547 4.158 10 10 IICE Cc1nsc(C)c1COC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1526736279 HZIBMSCHDGONBE-SXGWCWSVSA-N 436.555 4.234 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N2CCOc3cc(F)c(F)cc32)C1 1530995785 KCRPLRGXCCUQCI-UHFFFAOYSA-N 430.451 4.297 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCCC[C@@H]2C(=O)OC(C)(C)C)CCCC1 1532947675 SVADGRLDPHGXSK-JOCHJYFZSA-N 426.557 4.252 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCc1cccc(C)n1 1545333399 ZRGDBSQNGPMUED-HXUWFJFHSA-N 448.615 4.211 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1[C@@H]1CCCOC1 1545632311 IBZPYNFKHJPPPQ-NHCUHLMSSA-N 445.991 4.210 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](NC(=O)c1ccccc1)c1ccccc1 1557063224 ISRPPOJIZQKVRF-NBGIEHNGSA-N 429.564 4.280 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2ncc(C(=O)NCc3cc(Cl)ccc3O)o2)CC1 1557386825 LTJFWOXZYYZUBA-UHFFFAOYSA-N 435.908 4.078 10 10 IICE COC(=O)[C@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccc(OC)c(Cl)c1 1585300934 GXSJELHAWXXOBE-OAQYLSRUSA-N 426.900 4.400 10 10 IICE Cc1cc(CNC(=O)CCC(=O)N2CCC(c3ccccc3)=N2)c(C)n1-c1ccccc1 1587886972 YZKAHDVFJPIBCK-UHFFFAOYSA-N 428.536 4.127 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1Cc2cc(F)c(F)cc2C1 1611210737 OBOSRDXDYQBAJZ-CNHKJKLMSA-N 448.491 4.238 10 10 IICE CC[C@@H]1CCCN1c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1614159864 XZGOOWDIOHUMKK-PXDATVDWSA-N 441.620 4.120 10 10 IICE CCCCN(CC)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc2c(c1)CCCN2C 1614512903 VRSQFZOGOZPAFV-GMAHTHKFSA-N 441.620 4.059 10 10 IICE COCCO[C@@H]1CCCN(C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1 1634971232 XAIZVPTYRNYJBS-LJQANCHMSA-N 435.362 4.124 10 10 IICE CC(C)(C)OC(=O)N1CCCc2cc(CNC(=O)NCc3c(O)cccc3F)ccc21 1635310687 HBLUJPLBBLGWCL-UHFFFAOYSA-N 429.492 4.218 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@]1(C)c1cccc(Br)c1 1638529334 MDOUNEARQBISGH-AVRDEDQJSA-N 446.341 4.024 10 10 IICE Cc1cc(C(=O)N[C@](C)(CO)c2ccccc2)c(C)n1-c1ccc(Br)cc1 1639453235 HSPLEUCQSJBOSW-JOCHJYFZSA-N 427.342 4.494 10 10 IICE Cc1cc(C(=O)NCc2ccc(-c3nncnn3)cc2)c(C)n1-c1ccc(C(C)C)cc1 1644323101 HXZUBWYDYCYRQI-UHFFFAOYSA-N 426.524 4.395 10 10 IICE COC1CCN(c2ccc(CN3CCN([C@H](C)c4ccc(F)cc4F)CC3)cc2)CC1 1652472720 BPUJZJWAZIBZJN-LJQANCHMSA-N 429.555 4.459 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@@H]1CCN([C@@H](C)c2ccc(F)cc2)C1=O 1657431352 LCRSHRSOJOEICE-IFXJQAMLSA-N 435.337 4.478 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC/C=C/c2ccc(Br)cc2)cc1 1673025247 QVHSWCRKEFHZOH-SNAWJCMRSA-N 432.362 4.249 10 10 IICE Cc1cc(CCNC(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccccc1 1684444458 NELISMPJWWIYFT-UHFFFAOYSA-N 440.588 4.289 10 10 IICE COc1ccc(N2CCN(c3nnc(CC4CCCC4)n3C[C@H](C)SC)CC2)cc1F 1711866030 NWVQGOUILQMPJR-KRWDZBQOSA-N 447.624 4.237 10 10 IICE Cc1cc(-c2nnc(N(C)C3CCC3)n2CCSCCCO)c(C)n1-c1ccccc1 1742117053 FVEQGTDNWSESIA-UHFFFAOYSA-N 439.629 4.457 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(OC)CCOC1 1745591141 LXGFFPVPWNEBSL-RUZDIDTESA-N 437.588 4.394 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCS1 1752609997 SHJXZDNACSPXEM-WIYYLYMNSA-N 429.634 4.160 10 10 IICE CC1=CCCN(c2nnc([C@]3(OC(C)C)CCOC3)n2CCCSc2nccs2)C1 1762156587 HMLACTGAXUPFNW-NRFANRHFSA-N 449.646 4.114 10 10 IICE CC[C@@H](C)[C@H](C(=O)O)N1C(=O)/C(=C\c2ccc(Br)cc2F)SC1=S 1858596723 ZFVZIFLKSHBZAD-SURQKKHASA-N 432.336 4.289 10 10 IICE CC(C)N(C(=O)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)C(=O)c1ccccc1C2=O 1859891841 OOZYAJZDHZDYRT-UHFFFAOYSA-N 428.444 4.354 10 10 IICE CCN[C@@H](c1ccccc1O)[C@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 1942402000 YSGMQWZNIFCWJE-DHLKQENFSA-N 425.573 4.212 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(F)(F)F)c(N)c1I 2079047206 JPRMCALORYCHGC-VIFPVBQESA-N 425.192 4.102 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3[C@H](CCN3Cc3ccccc3)C2)c(Br)c1 2188889453 YGDNJHYRSSEKAP-WIYYLYMNSA-N 427.342 4.258 10 10 IICE CC(C)[C@@H](C(=O)NCCc1ccc(O)cc1)N1C(=O)C(=Cc2cccs2)SC1=S 2296566776 DJNVJABGFYWXHZ-SFHVURJKSA-N 446.619 4.038 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 2297561605 OAHKYJHFXCNIMK-UHFFFAOYSA-N 442.562 4.420 10 10 IICE CC1=NN(c2cccc(C(=O)O)c2)C(=O)C1=Cc1ccc(OC(=O)c2cccs2)cc1 2297617361 SWTMHFOJGODJSH-UHFFFAOYSA-N 432.457 4.472 10 10 IICE COC(=O)CC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)Nc1cccc(Br)c1 2313683027 PUVQWXNYELPHKF-UHFFFAOYSA-N 446.276 4.240 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(CCC(=O)OCCC)C2=O)cc1OC 2314740972 PYAUOUGDDKZSOR-UHFFFAOYSA-N 437.583 4.419 10 10 IICE COc1ccc(C2=NN(c3ccc(C)cc3)C(=O)C2=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 2332144847 SMYPPUVIMXYTHZ-UHFFFAOYSA-N 429.432 4.452 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c(O)c1Br 2352947364 HVJYGLWSTYQGHD-ARFHVFGLSA-N 425.367 4.341 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)ccc1OCC(=O)O 16915624 HQYXXNONGDVOIC-WOJGMQOQSA-N 429.519 4.263 10 10 IICE COc1ccc(O)c(C2=NN3[C@H](C2)c2cccc(OC)c2O[C@@H]3c2ccc(OC)c(O)c2)c1 20071383 ORUDZAJOEHNUPV-KBMIEXCESA-N 448.475 4.366 10 10 IICE O=C1/C(=C\c2ccc(O)c(Cl)c2)C(O)=NC(=S)N1c1ccc(Br)cc1 34138064 ANUKKSKAGYSWHO-GHXNOFRVSA-N 437.702 4.480 10 10 IICE CCOC(=O)c1sc(N2N=C(C)/C(=C/c3ccc(OCC)cc3OCC)C2=O)nc1C 103676215 GQRQSLYKDXHWPP-BOPFTXTBSA-N 443.525 4.232 10 10 IICE COc1ccc(O)c(C2=NN3[C@H](c4ccc(O)c(OC)c4)Oc4c(OC)cccc4[C@H]3C2)c1 245297715 WPFQZSRAWPPQMV-CLOONOSVSA-N 448.475 4.366 10 10 IICE CSc1nnc(-c2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)s1 519789797 SZNRUKXFPPCJHC-UHFFFAOYSA-N 426.571 4.080 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)c(F)c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526540275 HDTHQBAIRXFMBU-OAQYLSRUSA-N 425.387 4.442 10 10 IICE C[C@H](NCc1cc(Br)cc(F)c1O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 715828250 OAAFXEQZTWGUSA-QWHCGFSZSA-N 431.346 4.419 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCOc2ccc(F)cc2F)cc1 730127753 LJCQYCVYXDOKJU-UHFFFAOYSA-N 429.467 4.415 10 10 IICE C[C@@H](NC(=O)CN(Cc1ccccc1)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 746169290 YCDFBDBHVBTMGF-HSZRJFAPSA-N 443.591 4.403 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccc([S@](=O)C(F)(F)F)cc3)CC2)cc1 750625465 NVGAOVDYQYGPFV-PMERELPUSA-N 441.475 4.067 10 10 IICE O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(Br)c(Cl)c2Cl)ccc1O 780401793 KZAKXMZXABEXBO-UHFFFAOYSA-N 442.074 4.171 10 10 IICE CCn1c(CNC(=O)N[C@@H](C)c2cc(OC)ccc2O)nc2cc(Br)ccc21 790760387 VXHHCSQZHCVGQV-LBPRGKRZSA-N 447.333 4.093 10 10 IICE Cc1noc(C)c1CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)C1 800742223 AAGSFPAGTZHHRD-OAQYLSRUSA-N 446.555 4.290 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)NCc1ccccc1CN1CCCCC1 916221496 MRBCPVLQOAUNEC-UHFFFAOYSA-N 438.641 4.225 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)N1CCCCC[C@H]1C(F)(F)F)c2[N+](=O)[O-] 1133873628 GAVPZZFWZASMCM-INIZCTEOSA-N 446.381 4.317 10 10 IICE O=C(Nc1nc(-c2c[nH]c3ncc(Br)cc23)cs1)c1cccc(O)c1O 1147408164 VTTCFNCPNFGFKC-UHFFFAOYSA-N 431.271 4.112 10 10 IICE CC(C)(C)OC(=O)N1CC(NC(=O)c2cc3cc(O)c(O)cc3s2)(c2ccccc2)C1 1153042322 HCJYJZURUMABKB-UHFFFAOYSA-N 440.521 4.189 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)c([N+](=O)[O-])c1 1162949343 NBMJOESYGQDQLM-KSEUIEODSA-N 439.516 4.331 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H](NC(=O)c4ccc(Cl)cc4)C3)cc2)CC1 1198229738 LYOSQPAZGKAWMD-QFIPXVFZSA-N 442.003 4.350 10 10 IICE C[C@@H]1C[C@@H]1c1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n[nH]1 1299911228 RKQFNXAJROYEQT-JXIANXGOSA-N 432.596 4.215 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(C)c1Br 1301350609 RFBQYINZVPUCEC-UHFFFAOYSA-N 431.374 4.265 10 10 IICE COC(=O)/C=C\c1ccc(N(C)C[C@@H]2CCN(Cc3ccc(C)s3)C2)c([N+](=O)[O-])c1 1307156047 DRUZUVJMEMSZHN-KKMIYCERSA-N 429.542 4.109 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1312741809 UOHJWEGGSWNYTA-QZTJIDSGSA-N 428.577 4.238 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@@H](C)C2 1354327556 YCBIJIHIKGVGHA-HUUCEWRRSA-N 432.586 4.168 10 10 IICE CCOC(=O)CN(C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(F)cn1 1360619938 HGADIBWZWVXMFD-UHFFFAOYSA-N 443.906 4.420 10 10 IICE Cc1cc(C(=O)NCC(=O)OCc2ccccc2)c(C)n1-c1ccccc1Br 1440578914 SZULQQIJIWKFPY-UHFFFAOYSA-N 441.325 4.330 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Cc1ccc(O)cc1 1443460255 LVLZFXKQLKDWHH-OAQYLSRUSA-N 434.536 4.178 10 10 IICE O=C(NCc1c(O)cccc1F)c1cccc(NC(=O)c2cccc(Br)c2)c1 1456086692 GWVJBFGRUCTUGW-UHFFFAOYSA-N 443.272 4.476 10 10 IICE C[C@H](Cc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1458018766 LGRJJISKHJKYFK-LJQANCHMSA-N 426.004 4.367 10 10 IICE COC(=O)/C=C\c1ccc(N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)c([N+](=O)[O-])c1 1458118994 GGOAXVZDZSUUAZ-LUAWRHEFSA-N 438.459 4.379 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](Cn2ccccc2=O)c2ccccc2)c1 1467462836 DEUUFFWTSPJUIJ-VWLOTQADSA-N 439.515 4.240 10 10 IICE CN(C[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc(OCc2ccccc2)cc1 1473389185 KOLCNNKEMCQNIC-JOCHJYFZSA-N 432.520 4.026 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC[C@H]1CCCCO1 1495638871 HRFBXWRSYLHRLX-NFBKMPQASA-N 441.620 4.476 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CC[C@H](C)[C@@H]2C)cc1 1515520958 BDPWPSLTUIUUFB-OALUTQOASA-N 447.587 4.055 10 10 IICE CN(C)c1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1523516995 VHSNRVSKBBPIBL-QGOAFFKASA-N 429.542 4.122 10 10 IICE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1525761707 GCSURYGLQSHLBD-JVFUWBCBSA-N 435.612 4.108 10 10 IICE COCCOCc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)ccc1F 1528641551 AKEBBCRPJFEYOE-UHFFFAOYSA-N 442.453 4.259 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(OCCCC(=O)OC)cc3)ccc21 1528959039 FHYCIWSYXMUTSV-UHFFFAOYSA-N 438.524 4.489 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3nccc4c(Br)cccc34)C2)cc1 1532106012 PNDJHIBOTCGXTE-AWEZNQCLSA-N 426.314 4.015 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)/C=C/c3ccc4c(c3)NC(=O)CO4)cc2Cl)C1 1538422510 XKPPQNKOFSWZKO-YXMGTMDOSA-N 439.943 4.237 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C[C@H]2C(=O)Nc3ccc(Br)cc32)cc1 1539307010 GHZPURMACBQTIG-LJQANCHMSA-N 444.373 4.380 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1-n1cccn1 1539582053 NUBASHUYTVFPIT-SFHVURJKSA-N 426.467 4.181 10 10 IICE CC(C)CCC[C@@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1540616335 KPDMBECYIVXFKY-OAHLLOKOSA-N 449.529 4.046 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)C[C@@H]1CC=CCC1 1542227298 YJOIQKAKXIDSNQ-JOCHJYFZSA-N 430.600 4.479 10 10 IICE COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)ccc1Br 1544529984 ROKYTEIQXNQPNU-IBGZPJMESA-N 447.373 4.345 10 10 IICE COCCOc1ccccc1N1CCN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)CC1 1545380293 LYFKECXUWUIJAG-UHFFFAOYSA-N 447.579 4.390 10 10 IICE CCN(CC)C1CCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC1 1547470719 KCSJPIMNGPRIRF-UHFFFAOYSA-N 445.662 4.223 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCC4)n3CCCOCC(C)C)CC2)cc1F 1554960855 QXASYFBHQPDOSE-UHFFFAOYSA-N 445.583 4.083 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CCCC[C@@]3(C)NC(=O)OC(C)(C)C)C2)cc1 1557133381 JXBYQCKOKQVRRM-IOZGHAEBSA-N 445.604 4.111 10 10 IICE CCOC(=O)C1(C(=O)c2ccccc2)CCN(Cc2cc(Cl)cc(C(C)=O)c2O)CC1 1559851363 IOXHGBDJXWCKDC-UHFFFAOYSA-N 443.927 4.276 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(C)n1-c1ccc(Cl)cc1 1568502064 NVVVDCCTXUGJMR-UHFFFAOYSA-N 435.955 4.275 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CCc3cc(Br)cc(F)c32)C1 1584836097 WTNANQWXFPGFPG-AWEZNQCLSA-N 425.298 4.091 10 10 IICE Cc1cc(CC(=O)N2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1585885416 HONUZGVHMWIFFH-VWLOTQADSA-N 425.573 4.400 10 10 IICE C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1623550327 YKKYCXOCZTZPRI-HNNXBMFYSA-N 434.367 4.371 10 10 IICE Nc1c(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)sc2ncccc12 1624458977 RUVKYTBHVSQTIP-UHFFFAOYSA-N 434.433 4.258 10 10 IICE CCCOc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(OCCC)c1 1624537890 VJAPDIAUHDNHJT-UHFFFAOYSA-N 426.557 4.373 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3C(=O)c3ccc(C)cc3)CC2)cc1F 1630202132 NCOPJZDVEXPEAW-UHFFFAOYSA-N 432.495 4.336 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1 1633243534 JMNHAPKRUSWKMW-OAQYLSRUSA-N 430.426 4.389 10 10 IICE C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1633746753 KREXBAOETVBCSL-GOSISDBHSA-N 444.576 4.361 10 10 IICE CCOC(=O)[C@@]1(NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CCc2ccccc21 1633894361 RJZKVWQQNLNTHX-AREMUKBSSA-N 432.520 4.237 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSc1ccccc1OC 1634381541 QGJIXLXKOVSIEW-UHFFFAOYSA-N 430.570 4.176 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)c1 1634484288 SIPDTTDVSSXAKV-XMMPIXPASA-N 430.483 4.299 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1cccc(Br)c1O)C(C)(C)C 1635840007 PWKDXBPRAHCZEY-AWEZNQCLSA-N 429.355 4.100 10 10 IICE CCc1ccc(Br)cc1C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 1637247234 JUBYSPKQHKFNBT-UHFFFAOYSA-N 440.721 4.186 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@H]1CC(=O)N(Cc2ccccc2)C1 1639741759 MTEUCBRYSUVGQW-LJQANCHMSA-N 429.476 4.286 10 10 IICE CCO[C@@H]1C[C@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1642127762 ZOQRFQKAUADLQB-XZOQPEGZSA-N 448.563 4.316 10 10 IICE O[C@@H](COc1cc(F)cc(Br)c1)CN1CCCc2cc(OC(F)F)ccc21 1644807029 ZHYXUASUPICWBL-OAHLLOKOSA-N 446.263 4.382 10 10 IICE CSc1ccc(C(=O)c2ccccc2C(=O)NCc2c(O)cccc2F)cc1[N+](=O)[O-] 1645048465 XCHBFBMCLRVMRB-UHFFFAOYSA-N 440.452 4.322 10 10 IICE CCCN(CC(F)(F)F)C(=O)CSc1ncc(-c2ccc3c(c2)OCCO3)n1CC 1651683178 ODRVTAJASFLEAA-UHFFFAOYSA-N 443.491 4.234 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)Cn3cccc([N+](=O)[O-])c3=O)c2C)ccc1Br 1652640637 FUCHJSVINHQZDJ-UHFFFAOYSA-N 444.285 4.118 10 10 IICE COC1CCN(c2ccc(CN[C@@](C)(CO)c3cccc(Br)c3)cc2)CC1 1656418110 LOWZMGDBUZOFFS-QFIPXVFZSA-N 433.390 4.062 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)cc1 1673892677 ULGTWERHYIIUHU-RBUKOAKNSA-N 435.572 4.376 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)Cc3cccc(F)c3)cc2Cl)C1 1680561728 FLWZLFSZPOXNKX-OXJNMPFZSA-N 433.955 4.118 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC(NC(C)C)CC2)cc1 1710025536 DFKJTIXZHMMGGQ-UHFFFAOYSA-N 447.631 4.201 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](O)CC3(CCCC3)C2)n1CCCSc1nccs1 1723288981 MZZCBQCUIZIEIO-KRWDZBQOSA-N 435.663 4.247 10 10 IICE C[C@H]1CN2CCC[C@H]2CN1c1nnc(CC(C)(C)C)n1CCCSc1nccs1 1726739573 CZWJBNQGGUMMAO-IRXDYDNUSA-N 434.679 4.179 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(CC)(CC)SC 1727503486 GWRVKDKIUHGBSI-UHFFFAOYSA-N 431.650 4.235 10 10 IICE CC[C@@H](C)c1nnc(N2CCC([C@@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)cc1C 1743642803 YPHSGCUTBQODJQ-XMSQKQJNSA-N 425.621 4.467 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CC[C@@H](C(C)(C)C)C2)cc1F 1768496226 CVYXVDHLABOAAL-LJQANCHMSA-N 436.579 4.390 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(N3CCN(C(=O)Nc4ccccc4)CC3)cc2)c1 1860884391 XXGXPJHIARSOMU-UHFFFAOYSA-N 443.551 4.359 10 10 IICE Cc1c(C2(C)CC2)nn(Cc2c(O)cccc2Br)c1I 2079798452 DFBLOEHPTZUYMS-UHFFFAOYSA-N 447.114 4.364 10 10 IICE CC(NCCSCc1[nH]cnc1C)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 2296472993 IGZPPYRJOGIPII-UHFFFAOYSA-N 431.565 4.266 10 10 IICE COc1ccc(C=C2C(=O)NC(=O)N(c3ccc(OCc4ccc(C)cc4)cc3)C2=O)cc1 2297335733 QWWQGDIZEOPDSR-UHFFFAOYSA-N 442.471 4.249 10 10 IICE COC(=O)CCCN1C(=O)C(=Cc2ccc(OCc3ccccc3)cc2)SC1=S 2314740260 DXILOCWHFQAJSN-UHFFFAOYSA-N 427.547 4.420 10 10 IICE Cc1oc2c(CN(C)CC(=O)NC(C)(C)C)c(O)ccc2c(=O)c1-c1ccccc1Cl 21995795 RTCOSZKATVUFDT-UHFFFAOYSA-N 442.943 4.474 10 10 IICE C[C@H](NC(=O)c1nn(-c2ccccc2)c2c1CCCCC2)c1ccc(N2CCOCC2)cc1 109179873 GDWBSYQRDUFMPM-FQEVSTJZSA-N 444.579 4.469 10 10 IICE O=C1/C(=C/c2cnn3ccccc23)SC(=S)N1Cc1ccc(Br)cc1 746814642 ARAAYFWLHRROMT-SXGWCWSVSA-N 430.352 4.498 10 10 IICE CCO[C@@H]1C[C@](NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)(C(=O)OC)C1(C)C 781997823 PBPMPPLWLVNFAT-YKSBVNFPSA-N 438.528 4.377 10 10 IICE CC[C@@H](C)n1ncc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 790676573 KONFNNCYYIDJON-IERDGZPVSA-N 443.592 4.224 10 10 IICE CC(C)(C)OC(=O)NC[C@H](C(=O)NCc1cc(Br)ccc1O)c1ccccc1 804732775 AZSFAWLGQJUATO-KRWDZBQOSA-N 449.345 4.079 10 10 IICE CC(C)[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc2c(c1)OCCO2 804884925 IBQIJHYJWNCODT-IBGZPJMESA-N 435.318 4.122 10 10 IICE Cc1cc(C(=O)COC(=O)c2ncsc2Br)c(C)n1-c1cccc(F)c1 805707202 SGLKTORJEMFFTM-UHFFFAOYSA-N 437.290 4.492 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)CC2 807836680 KAXPWIQNIZRESY-SECBINFHSA-N 434.245 4.238 10 10 IICE COc1ccc(COCCCNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1125726595 CKUCHYZOQSLZJM-UHFFFAOYSA-N 449.595 4.140 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1 1125893257 HNIQFPVNRWRKOO-UHFFFAOYSA-N 425.838 4.105 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)nn1C(C)C 1129836667 AGTMYQXNYIJOLD-LFIBNONCSA-N 432.546 4.142 10 10 IICE Cc1cc(CNC(=O)[C@@H](C(C)C)S(=O)(=O)C2CCCCC2)c(C)n1-c1ccccc1 1132048261 OLHHLUCXEGVFIW-HSZRJFAPSA-N 430.614 4.482 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(Br)ccc3C3CC3)cc2)CC1 1133126906 FFGHFBBMFIAQRP-UHFFFAOYSA-N 428.374 4.008 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)OC(C)(C)C 1136025443 KRALQHSHLZLBCW-MPJJRAAHSA-N 427.589 4.185 10 10 IICE O=C(c1ccc(NCCc2ccccn2)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1137727566 MMGCYKNCTYXUMQ-DEOSSOPVSA-N 431.536 4.263 10 10 IICE COc1cccc([C@@H](CNC(=O)Cc2ccc(O)c(O)c2)c2c[nH]c3ccccc23)c1OC 1141329005 ZWROKQGDRJQDIE-HXUWFJFHSA-N 446.503 4.087 10 10 IICE COc1ccc(N2CCN(C(=O)/C(C)=C/c3ccc(OC(F)(F)F)cc3)CC2)cc1F 1150240393 PTACQTAUHRGKPV-FYWRMAATSA-N 438.421 4.485 10 10 IICE COC(=O)c1cc(OCC(=O)N(Cc2ccc(F)cc2)C2CCCCC2)ccc1N(C)C 1166713459 HGMPBQJBAJBRML-UHFFFAOYSA-N 442.531 4.419 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C[C@@H]2CCCCO2)sc(C)c1-c1ccccc1 1167137779 GEOVFXNQGSRESU-SFHVURJKSA-N 430.570 4.340 10 10 IICE COc1ccc(N(C)Cc2csc(CN3C(=O)c4ccccc4C3=O)n2)cc1Cl 1167882240 XQYVRCOPTAKOKG-UHFFFAOYSA-N 427.913 4.238 10 10 IICE CC(C)Oc1ccc(N(C)C[C@H](O)c2ccc3c(c2)CN(C(=O)C(F)(F)F)CC3)cc1 1169252913 NWMBYMMEALJPMV-NRFANRHFSA-N 436.474 4.091 10 10 IICE Cc1cc(C(=O)NCc2cccc(N(C)S(C)(=O)=O)c2)c(C)n1-c1cccc(Cl)c1 1180266419 RSBAQJVJECSTIZ-UHFFFAOYSA-N 445.972 4.073 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@](C)(O)c3cccc(F)c3)cc2Cl)C1 1227207084 CAPHXNXNRKSKTQ-WAIKUNEKSA-N 433.955 4.422 10 10 IICE CN(Cc1ccccc1O)C(=O)NCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1234533394 KBNPMEAZTNLNHS-HXUWFJFHSA-N 427.545 4.060 10 10 IICE CC(C)[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)[C@H](O)c1ccc(Cl)cc1 1251501032 MOEYGNUKAHNBAW-RJGXRXQPSA-N 447.023 4.066 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC=C(c2ccc3c(c2)OCCO3)CC1 1251981302 IJFRNDPXBOBVAM-IBGZPJMESA-N 435.568 4.262 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1313681647 UXBLVXSCKRRORH-FCHUYYIVSA-N 441.620 4.275 10 10 IICE CCCCn1nccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1358503570 GIKQFSGKVCCRTR-DTQAZKPQSA-N 432.546 4.052 10 10 IICE O=C(c1cc(Br)cc2nc(O)[nH]c12)N(Cc1ccco1)Cc1ccccc1O 1445639120 PUWGQLLTQAZDNO-UHFFFAOYSA-N 442.269 4.172 10 10 IICE Cc1cc(C(=O)NCCC[C@H]2CCCN2C(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1449742493 LBPMOZWTJVRRIT-IBGZPJMESA-N 426.561 4.399 10 10 IICE CC(C)(C)OC(=O)NCCOCCN(Cc1cccs1)c1ccc2c(c1)OCCO2 1459661827 IIZWVASFXFFKIN-UHFFFAOYSA-N 434.558 4.067 10 10 IICE C[C@H]1[C@H](c2ccccc2)c2ccccc2CCN1CC(=O)NCc1ccc(N(C)C)cc1 1459786603 MHNYRIZIFMZDGK-RBTNQOKQSA-N 427.592 4.448 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1ccc(I)cc1Cl 1469251006 VZUBMAPSZSUOMT-UHFFFAOYSA-N 438.652 4.128 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC[C@@H]3CN3C[C@H](C)O[C@H](C)C3)c2C)c1 1471036781 ZKKGWRAUHJUIML-TYBLODHISA-N 438.616 4.186 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N(Cc3ccccc3)C[C@@H](C)C(=O)OC)ccc21 1524992336 TUIAGSRNICLGOF-GOSISDBHSA-N 436.552 4.356 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3ccc(Cl)cc3-n3cncn3)ccc21 1531174526 DYDWSLOJHYXFDZ-UHFFFAOYSA-N 438.915 4.496 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2nc3n(c2C(=O)OC(C)(C)C)CCOC3)cc1 1537422839 LYYLXXHGCXEBDG-UHFFFAOYSA-N 436.512 4.028 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1546880099 UACWKTQNYWLLLX-HOYKHHGWSA-N 447.599 4.197 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CCC[C@@H](C(F)F)C2)cc1 1547443952 IBLIVFVHXPVKRX-GOSISDBHSA-N 443.546 4.055 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C[C@H](O)C(Cl)(Cl)Cl)cc1 1585493608 WICXHWHDFXTYGO-SFHVURJKSA-N 445.774 4.416 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)COc2ccc(F)c(F)c2)c(C)n1-c1ccc(Cl)cc1 1588202331 DCKGNLSDANEYSL-QGZVFWFLSA-N 434.870 4.195 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1)C1CCCC1 1594973804 KWLZOOLAXIZOAE-LPHOPBHVSA-N 432.561 4.424 10 10 IICE CC[C@H](C)c1nnc(N(CC)CC2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1613191635 UMELGDMURFZXLU-SFHVURJKSA-N 429.584 4.442 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2CN2CCC(=O)Nc3cc(F)ccc32)C1 1616156150 ZOQFKYDGFLEHID-UHFFFAOYSA-N 425.504 4.468 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@@]2(CO)CC[C@H](C)C2)sc(C)c1-c1ccccc1 1617443846 POVYYLAWORCRAY-FYSMJZIKSA-N 444.597 4.322 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(OC(F)(F)F)cc1Br 1623581128 NOEZVKVCLZYUMS-UHFFFAOYSA-N 439.224 4.469 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1nccs1 1626886011 VZAXTVRGAMICLA-DNQXCXABSA-N 448.636 4.473 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c(C)n1-c1ccc(Br)cc1 1631252492 NCIJTUAULGLMRJ-UTKZUKDTSA-N 430.390 4.413 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)Oc1ccc(F)cc1 1633173430 XJIQPCWNFHDEQX-OAQYLSRUSA-N 444.890 4.237 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(Cl)c(F)cc1Br 1633793783 JYCZOEFQDDYDRG-UHFFFAOYSA-N 441.728 4.133 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)COCc1nccn1C 1638240721 FWDXUDHKEZDLRM-LJQANCHMSA-N 446.473 4.248 10 10 IICE Cc1cc(C(=O)N(Cc2ccccc2)[C@H](C)CO)c(C)n1-c1ccc(Br)cn1 1640166074 HQCIVDUMCQKKIC-MRXNPFEDSA-N 442.357 4.275 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(Br)cc1Br 1640259734 BUMOHEDJQDAPQJ-UHFFFAOYSA-N 434.124 4.333 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3cccc(Cl)c3Cl)CC2)c(OC)c1 1644225658 UHKYJCABXIXTMQ-AWEZNQCLSA-N 438.355 4.160 10 10 IICE CC[C@@](O)(CCC(F)(F)F)CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1684444974 VWWVNSVMIMDVCJ-OAQYLSRUSA-N 425.495 4.419 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1696373927 WRVFEHADSMBQMR-IAGOWNOFSA-N 437.635 4.021 10 10 IICE CO[C@@H](C)Cn1c(-c2ccc(Br)s2)nnc1N(C)Cc1ccccc1O 1748380758 RIBLSXPHDPPNIM-LBPRGKRZSA-N 437.363 4.146 10 10 IICE CC[C@@H](C)[C@@H](C(=O)O)N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S 1858596649 YDAVXLYUGDVGAD-YWSVIBCRSA-N 432.336 4.289 10 10 IICE O=C(OCc1ccccc1)N1C[C@@H](NCc2c(O)cccc2Br)C2(CCC2)C1 2028689926 PAHXSTJPROKXPW-HXUWFJFHSA-N 445.357 4.436 10 10 IICE CN(Cc1ccccc1)[C@H]1CCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2034739812 QJDQSYBNQXCCDN-FQEVSTJZSA-N 436.600 4.273 10 10 IICE C[C@@H](O)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)c(Br)c1 2144883996 FMZXQAVBUGEMFE-GOSISDBHSA-N 433.390 4.231 10 10 IICE Nc1ccc(CN(c2ncc(I)cc2Br)C2CC2)cc1 2189909239 RXQPJKGBMJEKFE-UHFFFAOYSA-N 444.114 4.200 10 10 IICE Cc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccc4c(c3)OCO4)SC2=S)cc1 2296880231 XICGRPCMEFKSKV-UHFFFAOYSA-N 440.546 4.344 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1ccc(C)cc1 2297347510 CSBRSVSXGRKZRO-UHFFFAOYSA-N 447.491 4.302 10 10 IICE CC(C)COc1ccc(C=C2C(=O)NC(=O)N(c3cccc(Br)c3)C2=O)cc1 2313560989 OMOCQZSSKAWKOU-UHFFFAOYSA-N 443.297 4.150 10 10 IICE COc1cc(OC)cc(N2C(=O)C(=Cc3cc(OC)c(OC)c(OC)c3)SC2=S)c1 2321740017 AYKGDTGXHKDPBO-UHFFFAOYSA-N 447.534 4.135 10 10 IICE Cc1ccc(CN(C)C(=O)CCC2CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380772606 NHCFQYNLSIODSR-UHFFFAOYSA-N 441.366 4.069 10 10 IICE CC[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)NCc1ccc(C)c(Br)c1O 2381147459 RKHAAOMCUZKPEP-BBRMVZONSA-N 441.366 4.115 10 10 IICE CCCCCCOc1ccc(/C=C2\SC(=S)N(CCC(=O)OC)C2=O)cc1OC 40853754 UWJCGYYOBSHXIC-JXAWBTAJSA-N 437.583 4.419 10 10 IICE Nc1ccc(N(C(=S)N2CCN(Cc3ccc4c(c3)OCO4)CC2)c2ccccc2)cc1 244076505 UCMSWBAYCMLESL-UHFFFAOYSA-N 446.576 4.238 10 10 IICE Cc1cnn(-c2ccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2)c1 726567226 NKLGBZJAOIZYOI-UHFFFAOYSA-N 426.467 4.181 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2Cc3ccccc3CN2C(=O)CC(C)C)cc1 727861227 CSUAHENBTGMOAZ-RUZDIDTESA-N 435.612 4.491 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCc1ccc(N2CCCC2)cc1)c1ccccc1 743551991 KYJHVFWZASOSAX-QFIPXVFZSA-N 438.572 4.352 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC(C2CCOCC2)CC1 752663730 HCTPBUVXUYUPJD-UHFFFAOYSA-N 437.531 4.105 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1CC[C@H](c2ccccc2F)C1 769036372 LDOBYZKLUSUUSP-QFIPXVFZSA-N 436.575 4.057 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)C2)c([N+](=O)[O-])c1 773247867 NNEDZETYCOGQJN-SOFGYWHQSA-N 445.516 4.008 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c1 775182433 FGHJRHQFPLYTBF-GASCZTMLSA-N 433.346 4.325 10 10 IICE CCCCCCNC(=O)Cc1noc(Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n1 809467276 MIMWNTAENXNXFR-UHFFFAOYSA-N 437.588 4.078 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(c2c(Cl)cccc2Cl)CC1 1129661095 FPTDDKDNNAWAQG-UHFFFAOYSA-N 441.305 4.456 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(-n4ccc(C(F)(F)F)n4)c3)CC2)cc1 1137658565 NDBFGVBAANKQAV-UHFFFAOYSA-N 444.457 4.252 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](CCNC(=O)OC(C)(C)C)C(F)F 1159012101 LYGUVTUDSMALOM-SFHVURJKSA-N 449.498 4.185 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@@H](C)c1cccc(O)c1 1191297499 KXOIJDFJBYEROL-INIZCTEOSA-N 428.488 4.189 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CC3)nnc2N2C[C@H](C)O[C@H](C(F)(F)F)C2)cc1 1295414383 GSEKPXYYJIIVFM-KXBFYZLASA-N 437.510 4.206 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cccc(OC(F)(F)F)c4)CCC3)CC2)cc1 1356445709 LEQUDPJRGRCQOM-UHFFFAOYSA-N 434.458 4.364 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CSc2ccc(Br)cc2)N(C)C)cc1 1439958668 KOACPLNNKFZJFT-LJQANCHMSA-N 436.419 4.026 10 10 IICE Cc1ccc(C(=O)N2CCN(Cc3cccc(F)c3)CC2)cc1-n1c(C)cc(C=O)c1C 1447178876 BAPLTDOEUUPYFH-UHFFFAOYSA-N 433.527 4.312 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c1 1448628846 IEEFJMYYUJAFIL-SFHVURJKSA-N 430.470 4.401 10 10 IICE CC/C(=C\C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(OC)cc1 1456126843 GQYMIDXURCRJAH-LVZFUZTISA-N 425.548 4.086 10 10 IICE COCCN(CCC(=O)OC(C)(C)C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1456951653 CRJGEIQXZZEJIU-UHFFFAOYSA-N 448.991 4.497 10 10 IICE CON(CCNC(=O)OC(C)(C)C)C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1457248534 NYLUTUMKFZEDKZ-UHFFFAOYSA-N 435.952 4.205 10 10 IICE CCN(CCOc1ccccc1OC)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1461841661 HJBBALMAFUORFW-UHFFFAOYSA-N 449.595 4.344 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](c1ccc(F)cc1)c1cccs1 1470905930 YRTNTJSQSGZBLX-HSZRJFAPSA-N 439.556 4.437 10 10 IICE COC1CCN(c2ccc(CN[C@H](C)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1473367136 ODVZJXKKMNTHQF-CTNGQTDRSA-N 431.621 4.427 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCO[C@H]1C 1500735330 WQGINVVKYVNNSF-CPJSRVTESA-N 437.588 4.129 10 10 IICE CN(Cc1nccs1)c1nnc(-c2cccnc2)n1CCCSc1nccs1 1517187316 RORHIUJCLJVAMN-UHFFFAOYSA-N 429.600 4.072 10 10 IICE CO[C@H](Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1517828235 JYMVKKDXOUARGX-GOSISDBHSA-N 429.952 4.397 10 10 IICE CCO[C@@H]1C[C@](NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1522685945 GXNLMAQVNGILEL-YKSBVNFPSA-N 446.975 4.153 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1=Cc2cc(Br)ccc2OC1 1528924615 PVOHIXUSIJFNCJ-HNNXBMFYSA-N 429.358 4.347 10 10 IICE Cc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)oc(=O)c2ccccc12 1531504285 QQKKAXOKZQPQLN-OAHLLOKOSA-N 428.435 4.102 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(Br)cn2ccnc12 1539336945 VSDXNNGKDOLMKU-UHFFFAOYSA-N 427.346 4.359 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)C1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CCOCC1 1556884648 GWGXHOLHMZAAPQ-LBPRGKRZSA-N 447.359 4.025 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4ccc(F)cc4)CC3)C2)cc1 1564962511 LYSLOOWASPXPSG-OAQYLSRUSA-N 425.548 4.325 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Cc3ccc(Br)cc3)CC2)cc1F 1566347097 XUJCXMZPQKYHEP-OAHLLOKOSA-N 435.337 4.124 10 10 IICE CC(C)(C)OC(=O)N[C@H](C[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1)C1CCCC1 1594973806 KWLZOOLAXIZOAE-VQIMIIECSA-N 432.561 4.424 10 10 IICE CC[C@@H]1CCC[C@@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@@]1(OC(C)C)CCOC1 1614134704 BDXRHQBCGWSQKG-UMEGOILYSA-N 442.604 4.487 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)C1 1617002190 UNLTZAKEKUGMFX-FQEVSTJZSA-N 434.588 4.016 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)[C@H]3CN(Cc4ccccc4)CCO3)c2C)cc1 1618337394 ZBVJZATZJCZZQB-FQRUVTKNSA-N 447.579 4.122 10 10 IICE CO[C@@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCO)C1 1619494117 CEQITGOGFOOMSS-JOCHJYFZSA-N 437.588 4.130 10 10 IICE Brc1cc(CN2CCC(OC[C@H]3CCOC3)CC2)ccc1N1CCCCC1 1621196747 MBJCJKXPEUXFQC-IBGZPJMESA-N 437.422 4.457 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(Cl)c(Br)c(OC)c1N 1622319707 WFHGTWZPDRHGDD-UHFFFAOYSA-N 427.726 4.451 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1623477422 ZDHMGXPJDRJOSM-FPOVZHCZSA-N 433.568 4.230 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)Cc1csc(CNC(=O)OC(C)(C)C)n1 1626160386 LNQFMWCHDRZCDT-UHFFFAOYSA-N 433.574 4.245 10 10 IICE COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 1626654690 UTZGLOQUOVMPAC-UHFFFAOYSA-N 449.473 4.378 10 10 IICE COc1ccc(CNC(=O)CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)cc1 1626781126 KREDDECVBJJFFB-UHFFFAOYSA-N 433.552 4.272 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3nccnc3SCc3ccccc3)C2)cc1 1627158894 IPMMTCALFAUUGO-IBGZPJMESA-N 434.565 4.034 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(C2SCCCS2)cc1 1630282739 IDXJJEDAQDBKGP-UHFFFAOYSA-N 428.623 4.446 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)c1 1640585025 INFYOIMSCOBQFL-HXUWFJFHSA-N 441.572 4.158 10 10 IICE Cc1cc(C(=O)COc2ccc(Br)nc2)c(C)n1-c1ccc2c(c1)OCCO2 1641047210 RUBBFWJWEGFYSV-UHFFFAOYSA-N 443.297 4.285 10 10 IICE COc1ccc(N(C)CCN(C)Cc2csc(CC(=O)Nc3ccccc3C)n2)cc1 1643684891 OAOPLCVCVRCAPM-UHFFFAOYSA-N 438.597 4.210 10 10 IICE COC(=O)CC[C@@H](SC1=NC(=O)/C(=C/c2csc3ccccc23)S1)C(=O)OC 1652013955 NXOBHBNFCHUHNX-WJQTUHTMSA-N 435.548 4.100 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CC3(CCC3)c3cc(Br)ccc32)cc1 1654359283 NWYRGUSOOAWWAY-UHFFFAOYSA-N 428.374 4.073 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H](CCc1ccccc1)C(F)F 1682987029 VHOXPXWBHIOKFS-JOCHJYFZSA-N 431.527 4.056 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@H]3C[C@@H](O)c3ccco3)c2C)c1 1683302823 BXOKALVVUDPAFK-DHIUTWEWSA-N 437.540 4.030 10 10 IICE CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684606634 HWYLBNDOEORHGW-RUZDIDTESA-N 448.615 4.020 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC(C)(C)c3ccc(Cl)c(Cl)c3)cc2)CC1 1684874777 VHJCZEMCGGILCG-UHFFFAOYSA-N 435.399 4.480 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(F)F 1696509776 SJHYUNXPWVZQJM-WJOKGBTCSA-N 449.571 4.213 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C[C@H](C)S1 1708241953 SWWFEUVFZKEQCB-SOUVJXGZSA-N 425.649 4.099 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1sccc1C 1764888988 GKDZSENJNKQNQP-UHFFFAOYSA-N 425.602 4.178 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1765427017 CQZAEWDTVDAEKX-OFVILXPXSA-N 437.588 4.129 10 10 IICE Cc1nc2scc(C)n2c1/C=C1/SC(=S)N([C@H](C(=O)O)c2ccccc2)C1=O 1858591615 ULBHJBNOFRUUBG-NHXNDTTKSA-N 429.548 4.040 10 10 IICE O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1cccc(Cl)c1 1865677772 BVYLTSQHVXXPLO-QPEQYQDCSA-N 425.750 4.298 10 10 IICE Cc1cccc2c(C(=O)N[C@H](c3ccc(N(C)C)cc3)c3nccn3C)c3c(nc12)CCC3 1866269573 RNCUGGKBGFENLD-RUZDIDTESA-N 439.563 4.351 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@@H](CO)C(C)C)c(Br)c1 1915264229 KFJBSKQZFUZYOV-QFIPXVFZSA-N 435.406 4.209 10 10 IICE O=C(O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cc(O)cc1O 1951662801 JWSZJPKEFICHRP-FQEVSTJZSA-N 449.459 4.248 10 10 IICE O=C(O)c1ccc2c(=O)n3c(nc2c1)C(=Cc1c(-c2ccccc2)nc2ccccn12)CC3 2040481009 FRLMUFRGTAXXIB-UHFFFAOYSA-N 434.455 4.354 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C2CC2)c1O 2236051519 UKUBKTXSCPSUGM-WBVHZDCISA-N 441.366 4.041 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1OC 2314717091 LZFJQZMPPCMGBP-UHFFFAOYSA-N 442.562 4.339 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380747676 WOJBKFKEANDRKV-XOBRGWDASA-N 441.366 4.163 10 10 IICE Cc1ccc(CNC(=O)[C@]2(NC(=O)OC(C)(C)C)C[C@@H]2C(C)C)c(O)c1Br 2380753152 CMZXUJIXLISUGZ-VLIAUNLRSA-N 441.366 4.019 10 10 IICE CCOc1ncnc2sc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c(C)c12 71565448 VSHAIQWKSXRIBW-UHFFFAOYSA-N 443.484 4.426 10 10 IICE Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 726245173 HGVBMIBAWPNNLK-KRWDZBQOSA-N 446.389 4.463 10 10 IICE C[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cc(Br)cc(Cl)c1O 756561561 DXYDNCVVLHAATO-YVEFUNNKSA-N 425.754 4.158 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NCc2ccc(N(C)C)c(F)c2)cc1 763634763 GSUMUZIYQMIATD-INIZCTEOSA-N 444.551 4.477 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCCc4cn(C5CCCC5)nc43)CC2)cc1 764764638 ZXMOQRMIMWORSX-HSZRJFAPSA-N 437.588 4.306 10 10 IICE Cc1n[nH]cc1-c1nnc(NC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)s1 782094486 ISCFWASPQGSCHB-UHFFFAOYSA-N 425.562 4.327 10 10 IICE CC(=O)Nc1cccc(N2C(=O)/C(=C\c3cc(-n4ccnc4)cs3)SC2=S)c1 783699604 WWVHNDUKROLXDK-RQZCQDPDSA-N 426.548 4.298 10 10 IICE CCOC(=O)c1csc(CCNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)n1 787462300 OXKIJXVLZWSCAZ-UHFFFAOYSA-N 431.945 4.353 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CCc3nc4ccccc4oc3=O)cc2Cl)C1 800050025 LZLRJNQXRUSZRT-INIZCTEOSA-N 439.943 4.327 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(OCc2ccncc2)cc1 806258685 ZALFGHSYAGMWCB-UHFFFAOYSA-N 428.286 4.450 10 10 IICE Cc1cc(C(=O)N(CCO)C2CCSCC2)c(C)n1-c1ccccc1Br 819604754 BEHJOFJVEPOSSW-UHFFFAOYSA-N 437.403 4.187 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H]3Cc3cccc(F)c3)cc2F)C[C@@H](C)O1 918081253 MSXGVMPUNDLOCA-JBYIUTFZSA-N 443.538 4.495 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCc2ccccc2CC1 1126231282 NTIBMCSKKWNUHQ-HMMYKYKNSA-N 440.565 4.044 10 10 IICE CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549746 TXKNENGBBGIDOT-OAQYLSRUSA-N 438.902 4.175 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CCN(c3ccc(F)cc3)C2=O)c1 1129885704 JURFCHWZRYDESX-NRFANRHFSA-N 425.891 4.422 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1136388746 BIAYTDSKCBKJHE-HXUWFJFHSA-N 425.573 4.400 10 10 IICE CCc1nc2ccc(Cl)cn2c1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1142712544 CPCPONGTOSUMQN-FQEVSTJZSA-N 440.975 4.438 10 10 IICE COc1ccc(N(Cc2ccccc2)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1OC 1177022620 RKPPWZJAMGYWOQ-NRFANRHFSA-N 442.556 4.346 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)C2CC2)cc1 1225076989 VQQKYMMUZRCDDB-QGZVFWFLSA-N 430.955 4.498 10 10 IICE COC(=O)[C@@]12CCCC[C@@H]1CN(C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)C2 1227207426 GQLPFAIIRRIDPH-RGZWJVDOSA-N 448.007 4.451 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1287467166 QUAOSJDJYJRZEV-UHFFFAOYSA-N 440.547 4.438 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CCS[C@H](C)[C@@H]1C 1289424543 XTCICKBOWRXDRW-UEXGIBASSA-N 429.634 4.273 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCNc3ncccc3C(F)(F)F)c2C)cc1 1291686448 ZVVSQSJKUCJEGW-UHFFFAOYSA-N 432.446 4.358 10 10 IICE CSC[C@@H]1CCCN1c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1302706358 JCRUZVFDVYREFT-KRWDZBQOSA-N 446.671 4.235 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CCCCC3)C3CC3)cc2F)C[C@@H](C)O1 1307423034 WTXKJQKIWYOZLJ-KDURUIRLSA-N 431.596 4.100 10 10 IICE CCCn1nccc1NC(=O)CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2 1307530502 XTVPIYCSVXYVMV-TWGQIWQCSA-N 432.524 4.223 10 10 IICE C[C@@H](NC(=O)NCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 1313151046 GTHKKRUNNRFASH-IEBWSBKVSA-N 427.545 4.279 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CC(C)(C)SC)CC2)cc1 1315515943 XDKUEIPBJSJTBI-UHFFFAOYSA-N 431.650 4.443 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Br)cc2)n1C[C@H]1CCCO1 1324675981 DUNNYEUYBNSVQM-GOSISDBHSA-N 443.345 4.229 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cnnn2-c2cc(Cl)ccc2Cl)C2CC2)cc1 1349948559 FTSIYTWOZGMKPH-UHFFFAOYSA-N 430.339 4.445 10 10 IICE CC1(C)CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)CCS1 1360827143 XHNJIDTTXSHHRS-UHFFFAOYSA-N 446.671 4.235 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCN(C)C(C)C)o1 1361178104 FIQGHDZQMQLQEL-UHFFFAOYSA-N 436.604 4.423 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Oc1ccccc1 1435184224 JOWINGGAMKGVCH-CCNLRRDASA-N 444.553 4.001 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)c1cccnc1 1440302591 VHOYUGKHLWAPPE-QHCPKHFHSA-N 425.916 4.351 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(Br)c1N 1445650948 GXPGYCZSOKRMCN-UHFFFAOYSA-N 428.124 4.162 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c1 1467823771 PMXJIKMMRNZURP-GOSISDBHSA-N 435.490 4.466 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cccnc3Nc3ccccc3OC)C2)cc1 1469279992 IWRFPTJKIGAFJJ-SFHVURJKSA-N 432.524 4.099 10 10 IICE CCOC(=O)CS[C@H](CNC(=O)c1cc(C)n(-c2ccccc2C)c1C)C(F)(F)F 1471402741 OMFXBWUJSQAUKS-GOSISDBHSA-N 442.503 4.360 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC2CC2)cc1 1473791902 KHYSNRHLGNLJKI-BGYRXZFFSA-N 439.575 4.281 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)O 1515681822 QPNPKCICGFUNCF-NRFANRHFSA-N 437.588 4.129 10 10 IICE CCOC(=O)CN(CCc1ccccc1)C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC 1520770474 DQEPKYIGPSDQJR-UHFFFAOYSA-N 436.552 4.153 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-n2cccc2)ccc1Cl 1524851428 RCQHMYYCDUXQRG-UHFFFAOYSA-N 431.870 4.176 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 1528923875 FHLBBNLIGHIFCY-NQIIRXRSSA-N 442.003 4.314 10 10 IICE CN(C)[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(Cl)cc1 1533327061 ASSHHLOKHSVAMZ-PXNSSMCTSA-N 437.918 4.329 10 10 IICE CCCCN1C(=O)C[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@@H]1c1ccc(OC)cc1 1540518305 JNPLLFNFUWERHM-NOZRDPDXSA-N 437.584 4.110 10 10 IICE Cc1cc(CCNC(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1543592926 BGWLQVDERLSSQV-RBBKRZOGSA-N 443.563 4.348 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(c2ccc(C(C)C)cc2)CCCC1 1556101903 IXDVEIFEGFNFSA-NRFANRHFSA-N 439.552 4.324 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1N(C(=O)OCc2ccccc2)CC1(C)C 1557063275 JPYUZWVYTQYFBI-XXBNENTESA-N 437.584 4.155 10 10 IICE Cc1cc(CCNC(=O)Cc2csc(SCCN(C)C)n2)c(C)n1-c1ccccc1 1557818452 BYDOODKLQXLVMY-UHFFFAOYSA-N 442.654 4.106 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C(F)(F)c2ncccc2Br)cc1 1587460064 NWKGKEVNDSDOJE-UHFFFAOYSA-N 426.305 4.441 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccc4c(Br)cccc34)cc2)CC1 1596532366 GMBPCKFVDXZZSY-UHFFFAOYSA-N 438.369 4.284 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)CC2)cc1 1596964936 SLBYFMMXDKTEOB-AREMUKBSSA-N 438.568 4.149 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)N(C)C)cc1 1627463745 DWRZFYVZBKZYHE-NRFANRHFSA-N 446.382 4.278 10 10 IICE CCc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)ccc1Br 1628686684 BCWHWIQAYMTOLV-UHFFFAOYSA-N 431.374 4.150 10 10 IICE O=C(Cc1cccc(C(F)(F)F)n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1629055180 CUVLATJQACWRGR-AWEZNQCLSA-N 429.389 4.030 10 10 IICE CC(C)CCc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n[nH]1 1631145020 NPQZPKUNHWRFKU-BOPFTXTBSA-N 446.573 4.367 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2ccncc2Br)cc1 1633853579 DQNKLEBPFVDDOP-HNNXBMFYSA-N 440.341 4.484 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1635801033 AWJPWOIENHUAQL-RXVVDRJESA-N 444.620 4.081 10 10 IICE COC(=O)C[C@@H]1CC[C@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1636954407 TVOWXICODVGRJH-CVEARBPZSA-N 433.346 4.318 10 10 IICE CC1(C)[C@H](c2ccc(F)c(F)c2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1637228874 PXRBURVFKJQQPQ-NRFANRHFSA-N 443.538 4.404 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@H](c2ccccc2)[C@@H](O)c2ccccc2)N(C)C)cc1 1638916936 BCDJRHJZYNODRR-CYXNTTPDSA-N 446.595 4.129 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnn2c1N[C@@H](C1CC1)C[C@H]2C(F)F 1642997576 HHYSQAACIDFCCH-KPOBHBOGSA-N 431.531 4.019 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C3)ccc21 1643590036 PDMGPXBGQBIZDD-KKSFZXQISA-N 428.573 4.344 10 10 IICE Cc1cc(CN2CCC(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)CC2)ccc1N(C)C 1654801372 LMMXVNJFZSAYSP-GOTSBHOMSA-N 442.648 4.109 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCc3cn(C)c4cc(Cl)ccc34)C2)cc1 1671688182 QFDYXQRLUXGYGM-QGZVFWFLSA-N 440.975 4.209 10 10 IICE Cc1cc(CCNC(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)c(C)n1-c1ccccc1 1674924262 NNIMZJGLGGYLTM-IZZNHLLZSA-N 447.579 4.171 10 10 IICE CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1682986876 QTSSFIAFHOROPR-UHFFFAOYSA-N 449.517 4.441 10 10 IICE COc1ccc(OC)c([C@H](O)[C@@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1683307481 HTZLFUSUGUBTFT-MZNJEOGPSA-N 437.540 4.033 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(Cc4ccc(Cl)cc4)CCC3)cc2)CC1 1684973316 OROWEWHZINHCBN-UHFFFAOYSA-N 426.992 4.056 10 10 IICE COc1cc(CCCNC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)cc(OC)c1O 1687181693 QHMXKJKHIZCXKS-UHFFFAOYSA-N 429.561 4.028 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1)OC 1695114731 OMXYDILBWHDLFU-FGZHOGPDSA-N 437.588 4.393 10 10 IICE CCN(CC(C)C)c1nnc(-c2noc3c2COCC3)n1CCCSc1nccs1 1709982191 VLBOIDXVCITIEY-UHFFFAOYSA-N 448.618 4.127 10 10 IICE C[C@@H]1CN2CCC[C@H]2CN1c1nnc(CC(C)(C)C)n1CCCSc1nccs1 1726739575 CZWJBNQGGUMMAO-SJORKVTESA-N 434.679 4.179 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(CNC(C)=O)CC2)n1Cc1ccc(N(CC)CC)cc1 1726934497 BHAGKSAZXUZIEL-LJQANCHMSA-N 440.636 4.039 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728920005 BIXKBCDPKFSEHN-FGZHOGPDSA-N 436.604 4.336 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1746090453 ZAQWUIJIOWCHTJ-YADARESESA-N 448.615 4.404 10 10 IICE CC[C@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1763383340 PKROOVYWQUNDIX-IBGZPJMESA-N 429.584 4.270 10 10 IICE CSc1ccc(CNCCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1860711966 YGLKPDXNSHXJNK-UHFFFAOYSA-N 430.529 4.302 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2nc(C)c(C)s2)sc(C)c1-c1ccc(C)cc1 1860768275 ZAGWFJVAXVNJIG-UHFFFAOYSA-N 443.550 4.469 10 10 IICE CCOc1c(Br)cc(/C=C2/C(=O)N(C)N=C2c2ccc(OC)cc2)cc1OC 1865671129 LPYDWGXGHPZASR-MHWRWJLKSA-N 445.313 4.125 10 10 IICE O=C(CCN1C(=O)CSC1=S)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 1865767987 KDPCPXQTUIHYPK-UHFFFAOYSA-N 432.379 4.306 10 10 IICE CN(C)c1ccc([C@H](NC(=O)CCc2cccc(Br)c2)c2nccn2C)cc1 1866123925 JORZADBTHMUNKM-NRFANRHFSA-N 441.373 4.087 10 10 IICE CN(C)c1ccc([C@H](N)C2(COCc3ccccc3)CN(C(=O)OC(C)(C)C)C2)cc1 2248453992 NVFDITUTUBZMPY-QFIPXVFZSA-N 425.573 4.206 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)SC1=S 2297302714 FHQMQAPSRMUBLR-UHFFFAOYSA-N 443.546 4.039 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(CCc2ccccc2)C1=O)C(=O)O 2314932104 KMFSWERPYREJSK-QGZVFWFLSA-N 427.547 4.373 10 10 IICE Cc1ccsc1[C@@H]1Nc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2[C@H]2C=CC[C@@H]21 14456148 TVZJABPZMJNSFD-QUJKESNLSA-N 430.595 4.340 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C(C)(C)C)cc(OC)c1OC 35225470 YRGMJAJXLWWQGE-GZTJUZNOSA-N 439.468 4.453 10 10 IICE CCOC(=O)c1ccc(N2N=C(C)/C(=C/c3cc(Cl)c(O)c(OCC)c3)C2=O)cc1 96893019 NYFQJEQXDRZTKH-YVLHZVERSA-N 428.872 4.427 10 10 IICE CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/c1cc(OC)c(OC)c(OC)c1 100163348 BMZVJULHHKHPPE-GZTJUZNOSA-N 425.441 4.207 10 10 IICE CC(C)c1nnc2ccc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)cn12 435995670 NNNFCZOYABHAOZ-UHFFFAOYSA-N 430.556 4.213 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2CCN(CC3CCCC3)CC2)C1 444048439 IWOVYQLNNIHTHU-UHFFFAOYSA-N 436.644 4.179 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NCc1cc(Br)cc(F)c1O 715812496 KQMAACBNJIRVBR-WBMJQRKESA-N 431.346 4.467 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)Nc3cccc(C(F)F)c3Cl)cc2)C1 758246958 DGNUNNHTTVXMEX-AWEZNQCLSA-N 436.890 4.301 10 10 IICE COc1ccc([C@@H](C)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1NC(C)=O 765128641 WXTWTIZXSBCMOE-IXDOHACOSA-N 429.536 4.257 10 10 IICE CN1CCC[C@@H](CNC(=O)NCc2cccc(Br)c2O)[C@H]1c1cccs1 765510828 CSCAHYLHMVMUNM-GUYCJALGSA-N 438.391 4.099 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](c3cccc(F)c3F)C(F)(F)F)CC2)cc1 776020152 NHPMFESWZXPWNW-GOSISDBHSA-N 429.389 4.109 10 10 IICE C[C@@H]1[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)CCCN1C(=O)OC(C)(C)C 779682966 GUQDZOXPKMJIQI-YLJYHZDGSA-N 443.544 4.485 10 10 IICE CN(C)c1ccc(CNC(=O)C(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)cc1 785429015 VLWWFYFHVIAAAJ-AREMUKBSSA-N 437.543 4.428 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 792273983 CUCFLDLFDYPKPM-UHFFFAOYSA-N 426.527 4.089 10 10 IICE COCCSc1ccc([C@H](C)NC(=O)NCc2cc(Br)ccc2O)cc1 805069901 SAGKTZQYKYVBDJ-ZDUSSCGKSA-N 439.375 4.454 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCn4c(cc5ccccc54)C3)cc2F)C[C@H](C)O1 812876485 FGPIDIKBNYYKLH-ROUUACIJSA-N 436.531 4.119 10 10 IICE Cc1ccc([C@H]2CCCN2C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1C 920812506 PJCPGEVLCXYCLI-LADGPHEKSA-N 434.584 4.052 10 10 IICE COc1ccc2cc(/C=C/C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)ccc2c1 1129549027 AWDOJHRKSRLRSW-XVNBXDOJSA-N 438.474 4.293 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCCN(C(=O)c3ccccc3F)CC2)c1 1136410970 UVASTUKDXURKPK-UHFFFAOYSA-N 447.510 4.034 10 10 IICE COc1cccc([C@H](CNC(=O)Cc2ccc(O)c(O)c2)c2c[nH]c3ccccc23)c1OC 1141329004 ZWROKQGDRJQDIE-FQEVSTJZSA-N 446.503 4.087 10 10 IICE COc1ccc(N2CCN(CCNC(=O)Cc3csc4ccc(Cl)cc34)CC2)cc1 1142565954 QUDRNFUXJFWWJD-UHFFFAOYSA-N 444.000 4.044 10 10 IICE Cc1cc([N+](=O)[O-])c(F)c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1F 1148444484 SLGVTFLZIWVEDO-GFCCVEGCSA-N 441.381 4.182 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc2ccc(O)cc2c1O 1150355635 ZSCNVRHBPDDAJD-KRWDZBQOSA-N 426.900 4.004 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)C1 1230196292 XUKWGHMLIRARSE-LMNJBCLMSA-N 446.636 4.184 10 10 IICE CCc1ncsc1C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1289510526 GOWKZGTXSPACHI-UHFFFAOYSA-N 428.315 4.430 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N(C)Cc2c(C)nn(C)c2C)cc1 1295419216 HAPAPMQYIHNZOG-UHFFFAOYSA-N 437.636 4.358 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccc(Cl)cc2NS(=O)(=O)c2ccccc2)c1 1301046492 CRCSYVUAAVACDI-UHFFFAOYSA-N 430.913 4.085 10 10 IICE CC(C)(C)c1nnc(N2CCN(C3CCCC3)CC2)n1CCCSc1nccs1 1302088592 FLTPTAHRKMHLIJ-UHFFFAOYSA-N 434.679 4.279 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC/C=C/CNC(=O)OC(C)(C)C)cc1 1312794536 GGTIGOYBWWNXMG-VOTSOKGWSA-N 442.560 4.138 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(Oc4ccccc4)o3)CC2)cc1 1351457105 NTOFHNIDUVFXIF-UHFFFAOYSA-N 435.524 4.023 10 10 IICE COC(=O)C[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccc(F)cc1 1355977055 AWRWNSVJPYTFKQ-NRFANRHFSA-N 438.499 4.088 10 10 IICE CCCC[C@H](C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)C 1358428074 ILGDHXWYDKHDQW-FQEVSTJZSA-N 427.568 4.021 10 10 IICE COc1cc(OC)cc(C2(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CCCC2)c1 1434909135 HLXYZBGKGAZCOF-LJQANCHMSA-N 438.568 4.230 10 10 IICE CC1CCN(c2ccc(CNC(=O)C34CCC(CC3)N4C(=O)OC(C)(C)C)cc2)CC1 1464963695 YEDPWOSYXMTGJY-UHFFFAOYSA-N 427.589 4.471 10 10 IICE CCN(CCC1CCN(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1)CC(C)C 1470773897 RNNGBNHTKPRGIS-JOCHJYFZSA-N 430.637 4.064 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1Cc1ccnc(C(F)(F)F)c1 1517142301 FVOGIFDZZQBQOP-UHFFFAOYSA-N 440.429 4.144 10 10 IICE COc1ccccc1C[C@@H](C)CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1519556125 MERXLYKIWBBTLW-OAQYLSRUSA-N 435.612 4.112 10 10 IICE CCc1sc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1Br 1524851154 FTPHXNWVPGPNGM-UHFFFAOYSA-N 445.329 4.118 10 10 IICE CCN(CC)[C@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)c1cccc(C(F)(F)F)c1 1531729988 OIFXTTYAHNIHNP-KNQAVFIVSA-N 449.517 4.492 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1(C(F)(F)F)CCC1 1532982053 PJNICBGLUWTEDZ-JLHYYAGUSA-N 432.464 4.018 10 10 IICE CCOc1ccc(N2C[C@@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1534761008 YDQSHWJGQVBZGM-NRFANRHFSA-N 431.536 4.162 10 10 IICE CN1CCCc2cc(CNC(=O)c3coc([C@@H]4CCCN4C(=O)OC(C)(C)C)n3)ccc21 1542389969 UJGIJNLAPZKVMH-FQEVSTJZSA-N 440.544 4.059 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)cc2Cl)C1 1556369455 NWQHBBZSVZHPDJ-KBAYOESNSA-N 435.996 4.496 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@H](C)N(C(=O)c1cc(C)n(-c3cc(C)cc(C)c3)c1C)C2 1558416539 SIHLUHFTMAIYEC-SFHVURJKSA-N 434.540 4.129 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)n[nH]2)c(OC)c1 1565662957 FHRRCMBPNLLBQA-UHFFFAOYSA-N 434.540 4.260 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CC[C@H](C)[C@H]2C)cc1 1615381988 JLITZYGKKACQTK-GHTZIAJQSA-N 435.620 4.269 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cnc3ccccc3c2C(F)(F)F)N(C)C)cc1 1618635196 GWDQBCXRVYJTJK-FQEVSTJZSA-N 430.474 4.352 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)CC[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C 1626885595 DTHRSNCERHYZMG-HXUWFJFHSA-N 433.593 4.253 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cncc2nc(C(F)(F)F)[nH]c12 1629971750 GWEKINFMSRPVSC-UHFFFAOYSA-N 443.223 4.107 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3cccc(OC)c3)CC(C)C)C2)cc1 1636353981 NMVVTHSTTBZDDE-OAQYLSRUSA-N 425.573 4.398 10 10 IICE CC(C)N(C)c1ccc(NC(=O)CCN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1F 1642199394 DYOMICXUUCLICY-NRFANRHFSA-N 443.563 4.386 10 10 IICE COC(=O)/C=C\c1ccc(N(C)Cc2cc(Br)ccc2OC)c([N+](=O)[O-])c1 1642472349 YFOIQDVOMSDKBI-UITAMQMPSA-N 435.274 4.189 10 10 IICE COC(=O)/C=C\c1ccc(N2Cc3cc(Br)ccc3C[C@@H]2C)c([N+](=O)[O-])c1 1642548718 WRTPUJCCOONCPB-UKOWJOKBSA-N 431.286 4.495 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4ccncn4)CC3)cc2Cl)C1 1680563304 SXXGJCCMJLSHJA-KRWDZBQOSA-N 427.980 4.456 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCSC[C@H]2c2ccccc2)N(C)C)cc1 1685686378 MCLBECJNIHVFQW-GOTSBHOMSA-N 426.630 4.245 10 10 IICE C#CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@H]1C 1705605377 JAYXKQLRZXVZSZ-DENIHFKCSA-N 431.584 4.485 10 10 IICE CC(C)OCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706706433 SSXYTXATZAMDMW-QFIPXVFZSA-N 427.593 4.181 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(CC)(CC)OC 1708526698 CPDJAECRFKZVNI-GOSISDBHSA-N 447.599 4.471 10 10 IICE CC1CCN(c2ccc(Cn3c(-c4ccc[nH]4)nnc3N(C)CCCCCO)cc2)CC1 1752209566 ZIZMRUWAMWNFSR-UHFFFAOYSA-N 436.604 4.157 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)CCCO1 1752375991 WNKRPYXOUDUZHC-INIZCTEOSA-N 447.605 4.262 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](N3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1752710174 YKSXSBBTDUFMCO-UYAOXDASSA-N 428.600 4.110 10 10 IICE CCc1nnc(N(CC)Cc2ccc3c(c2)OCO3)n1CCCSc1nccs1 1762903381 ICEMKVMASRJHPS-UHFFFAOYSA-N 431.587 4.235 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N(C)CCn2cccn2)cc1 1766609779 BJNKQDOYCYEXAH-UHFFFAOYSA-N 433.560 4.074 10 10 IICE COC(=O)c1c(NC(=O)c2c[nH]c3cc(O)ccc3c2=O)sc(C)c1-c1ccccc1 1866407585 BJRIXAZMHKHVES-UHFFFAOYSA-N 434.473 4.310 10 10 IICE CC(C)(C)OC(=O)N1C[C@]2(F)CCC[C@@]2(NCc2cc(Br)cc(F)c2O)C1 2182446913 DBUQZYXXHHWKSD-RTBURBONSA-N 447.320 4.265 10 10 IICE [N-]=[N+]=N[C@H]1CCC[C@H]1NC(=O)c1cc(I)ccc1Br 2225798353 GEEQCNNXUVBYMY-MNOVXSKESA-N 435.063 4.015 10 10 IICE COc1ccc(N2C(=O)C(=Cc3ccc4c(c3)Cc3ccccc3-4)C(=O)NC2=S)cc1 2296930417 WXAAHKFWUKVUFH-UHFFFAOYSA-N 426.497 4.098 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2352639266 WGSHWVUHGUEZGH-CQSZACIVSA-N 429.355 4.019 10 10 IICE Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2=O)cc1C 6858420 YAAXUHJNAMBOHV-UNOMPAQXSA-N 431.404 4.138 10 10 IICE CCCN1C(=O)/C(=C\c2c(NC3CCCCC3)nc3c(C)cccn3c2=O)SC1=S 33459290 XDZUJPMYPDMPFA-GHRIWEEISA-N 442.610 4.359 10 10 IICE CCCCn1c(N2CCCC2)c(/C=C2\SC(=S)N(CCC)C2=O)c(C)c(C#N)c1=O 39990349 AALGSAARGWZMGW-AQTBWJFISA-N 444.626 4.040 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCCC1 249901321 JKOMCCPTKZDSGT-YDIMBITNSA-N 440.565 4.489 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cc(F)ccc3F)[C@@H]2c2ccc(O)c(O)c2)c1 526559398 AZDMSWXOFCELPT-OAQYLSRUSA-N 425.387 4.442 10 10 IICE C[C@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccc(N2CCOCC2)cc1 727031488 CZBMFBJEICVXJT-AWEZNQCLSA-N 443.454 4.394 10 10 IICE COc1cccc(CNC(=O)c2ccc(COc3ccc4c(C)cc(=O)oc4c3)cc2)c1O 729861201 GETHTWUKTCCEBT-UHFFFAOYSA-N 445.471 4.325 10 10 IICE O=C(/C=C/c1ccc(Br)o1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742807306 ZKYRHGMIFTVICS-FROQITRMSA-N 441.272 4.442 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCCC[C@H]1c1ccc(F)cc1 752897083 ZFYNCUNCJUNSJD-QFIPXVFZSA-N 429.511 4.363 10 10 IICE COCC[C@@H]1CCCCN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C1 768386343 ZNTVFGGVTLMLJB-ROUUACIJSA-N 425.520 4.105 10 10 IICE CN(Cc1ccc(F)cc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769035178 GHVOWMREZMBVLT-UHFFFAOYSA-N 444.982 4.353 10 10 IICE CCc1c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cnn1C1CCCC1 789661036 JNOVEZKAIHJEOS-UHFFFAOYSA-N 435.616 4.023 10 10 IICE CCC1(CC)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C)CC[S@@]1=O 800727775 OILNEGFPZLMJNU-PMERELPUSA-N 425.602 4.017 10 10 IICE Cc1ccc(C(=O)NCc2cc(Br)ccc2O)cc1NC(=O)NC(C)(C)C 804737696 NZKKQWWZCWRBDB-UHFFFAOYSA-N 434.334 4.313 10 10 IICE O=C(NCCc1csc(-c2ccccc2)n1)NCc1cc(Br)ccc1O 805216949 FGWOLMCCDQQZON-UHFFFAOYSA-N 432.343 4.320 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)c2nnc3n2CCCCC3)c(C)n1-c1ccc(Cl)cc1 914605201 AWTGXLUNHGLUKH-INIZCTEOSA-N 425.964 4.485 10 10 IICE CCN(CC)c1ccc(CNC(=O)NC2CCN(c3ccc(C(F)(F)F)cn3)CC2)cc1 918205179 IPTOBVAVHKNVFX-UHFFFAOYSA-N 449.521 4.415 10 10 IICE Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4ccccc4c3)C2=O)c(C)n1C[C@@H]1CCCO1 1084343186 UADVIOGNABQCIR-DHNIJCFSSA-N 443.503 4.104 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCC[C@@H]1c1ccccn1 1142285728 JENIAZUMOAMMRR-GXYBQNOFSA-N 441.553 4.176 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@](C)(CO)c2cccc(Br)c2)cc1 1180167106 UUCZGBKQDNCJAC-QFIPXVFZSA-N 427.342 4.494 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1cccc(=O)n1C 1182482583 RJECJBHAZYBBOY-GOSISDBHSA-N 429.442 4.311 10 10 IICE CN=[S@](C)(=O)c1cccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1272547305 ICHWALKFMAVVCX-SSEXGKCCSA-N 425.554 4.254 10 10 IICE COC1(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCC(C)CC1 1299809278 NPHYCEKBUCPKFP-WLBKGHODSA-N 428.577 4.109 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)cc1F 1307575232 UPEOEKIGQWBVJZ-AWEZNQCLSA-N 425.426 4.002 10 10 IICE C[C@@H]1[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 1352925814 HDWJTRABWBNAFE-QAPCUYQASA-N 443.510 4.289 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 1357723388 UJQZJKJALBVWTK-BXUJETTOSA-N 446.544 4.476 10 10 IICE CN(C)c1ccc(CNC(=O)Cc2ccc3c(c2)N(C(=O)OC(C)(C)C)CC3)cc1F 1442473396 LDWVGPLNKYMVQZ-UHFFFAOYSA-N 427.520 4.048 10 10 IICE Cc1nc(Cl)c(Cl)cc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445887985 WNYVVIJPYQFLDR-CQSZACIVSA-N 428.747 4.450 10 10 IICE COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc(C)n(-c2ccccc2C)c1C 1464934867 NDNAVZDORPFOER-UHFFFAOYSA-N 447.535 4.278 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CNC(=O)Nc2cccc(Cl)c2)cc1 1469612367 JUTPXJNTOBHQCK-UHFFFAOYSA-N 442.869 4.119 10 10 IICE CC[C@@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1cccc(OC)c1OC 1471136730 YKERISUVUSMXSV-AZUAARDMSA-N 428.529 4.251 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3ccc(Cl)c(Cl)c3C2)N(C)C)cc1 1471547482 MCHSWNYACHJXFP-FQEVSTJZSA-N 435.399 4.430 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C[C@@H]1C 1502257547 MBZSSKVSGXQFCK-PMACEKPBSA-N 426.653 4.208 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1[C@@H]1CCC[C@@H](C(F)(F)F)C1 1517143214 YHKUUVOTEVRQQN-IAGOWNOFSA-N 434.466 4.314 10 10 IICE CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)C1 1524246241 XMZZVMPCEWYQIU-AZUAARDMSA-N 449.039 4.270 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3sc4cccc(F)c4c3Cl)cc2)C1 1527735472 UAHROAPJADPNHV-CQSZACIVSA-N 445.947 4.326 10 10 IICE CC[C@H](C)c1nnc(N2CCC([C@@H]3CCCO3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1545416097 WDBVRFBFMUZRJL-JTSKRJEESA-N 429.584 4.440 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC2(C)C)n1Cc1ccc(N(CC)CC)cc1 1545902439 OHPROCYWQOCQCL-UHFFFAOYSA-N 440.636 4.470 10 10 IICE CCC[C@@H](C)N(C)c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1546876146 DDQOVLIBKIOJTC-LJQANCHMSA-N 426.609 4.033 10 10 IICE O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)NCc1ccc2cccnc2c1O 1570533505 FJUAMEYIIXATQI-QHCPKHFHSA-N 428.488 4.259 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1ccn(-c2ccc(F)cc2)n1 1586914437 MPNFIIBRYKBUSH-UHFFFAOYSA-N 430.483 4.204 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)/C(F)=C\c1ccc(F)c(C(F)(F)F)c1 1596695374 RQGFVHHWYGYBQK-VCHYOVAHSA-N 444.375 4.447 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)Nc1ccc(F)c(F)c1 1615477234 ISZJTBORDNIBNN-UHFFFAOYSA-N 431.483 4.381 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2nc3cc(Br)cnc3[nH]2)c1 1627925822 OYIBSESAVREGAW-UHFFFAOYSA-N 438.329 4.366 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCC(=O)c2cccc(F)c2Cl)cc1 1631517246 DZAIKAZILHWQOF-UHFFFAOYSA-N 426.875 4.241 10 10 IICE COC(=O)[C@H](C)N(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CCC1 1634013683 KYXGIGUDXVKLDX-HNNXBMFYSA-N 433.346 4.413 10 10 IICE COc1cccc(-c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)n[nH]2)c1 1634753454 LTDGYZBBDMDDLT-MRXNPFEDSA-N 442.466 4.086 10 10 IICE CCn1cc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 1635942016 ZJJASIVPWMPLFU-HXUWFJFHSA-N 425.960 4.344 10 10 IICE Cc1ccc(-c2nnn(CC(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)n2)cc1 1637244001 QAGHYRNNCMGHOI-IBGZPJMESA-N 427.508 4.144 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCOc1ccccc1[N+](=O)[O-] 1641744083 VLEGPKBKEJUGLL-UHFFFAOYSA-N 427.501 4.451 10 10 IICE Cc1cc(C(=O)NCCc2ncn(C)c2Br)c(C)n1-c1cccc(Cl)c1 1645592870 RJAIOZLLPTZVFI-UHFFFAOYSA-N 435.753 4.216 10 10 IICE O=C(NC/C=C\c1ccc(Br)cc1)NCc1cccc(Br)c1O 1649418800 MQWROQKSLWSOJH-IHWYPQMZSA-N 440.135 4.430 10 10 IICE COCCN(CC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(OC)c(OC)c1 1653590537 XEIAVVZDPBISAO-AWEZNQCLSA-N 441.355 4.341 10 10 IICE Brc1cccc(CN2CCC(NCc3ccc(N4CCOCC4)cc3)CC2)c1 1658120044 VVQRNVMXSPWUOM-UHFFFAOYSA-N 444.417 4.040 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NC/C=C/c1ccc(Br)cc1 1682622692 JRIQVDNGGPRATO-NSCUHMNNSA-N 444.373 4.141 10 10 IICE Cc1ccc(-c2nnc(N(C)CCc3nccs3)n2Cc2ccc(N(C)C)cc2C)o1 1693048146 AXKKSZLBWZNLCL-UHFFFAOYSA-N 436.585 4.405 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1693572886 QUIXZLADTBCNBV-BGYRXZFFSA-N 434.588 4.050 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@](C)(O)c1ccco1 1696685135 WHTATOYXAQBKFN-VWLOTQADSA-N 437.588 4.313 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)CNC(=O)OC(C)(C)C 1708398696 AVKHFRWPCRFGCS-IRXDYDNUSA-N 431.581 4.294 10 10 IICE C[C@H](c1ccccc1)N(C)c1nnc([C@H]2CCC(=O)N2)n1CCCSc1nccs1 1723754595 KIKDIHATMGVIPC-NVXWUHKLSA-N 442.614 4.066 10 10 IICE CCNC(=O)C(C)(C)Cn1c([C@@H](C)CC)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1728641093 JDTSWIREYYFEFZ-IBGZPJMESA-N 440.636 4.191 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@@H]3C)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1742118882 ARXLVXBIZCYGSL-OALUTQOASA-N 438.645 4.244 10 10 IICE C[C@@H]1CC[C@@H](C)N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1742981107 NOPISLQTJDUBCQ-WOJBJXKFSA-N 439.648 4.457 10 10 IICE CCCN1CCC(N(C)c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1 1745702397 SCJWQDFIWSRSBB-UHFFFAOYSA-N 438.664 4.218 10 10 IICE CC(C)N1CCCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1750902179 ILOXMKXXKYIAKT-UHFFFAOYSA-N 428.600 4.110 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1CCCN(C)C1CCCCC1 1768681866 OTQDTZPUESEWOF-UHFFFAOYSA-N 434.588 4.337 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3cccc(F)c3)[nH]n2)N2CCCCC2)cc1 1866138171 SWBWPSMFIAMUNP-XMMPIXPASA-N 435.547 4.239 10 10 IICE COc1ccc(CNC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(C3CC3)C2=O)cc1 1873166486 QTYFAKWCAVIIRB-UHFFFAOYSA-N 441.531 4.135 10 10 IICE Cc1nn(Cc2c(O)cccc2Br)c(I)c1C1(C)CC1 2079598942 MNMOSPUVCTXPQF-UHFFFAOYSA-N 447.114 4.364 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3cc(Br)cc(F)c3O)C[C@H]2C1 2102638195 QLRJXCFEZWVGPU-NHAGDIPZSA-N 429.330 4.029 10 10 IICE CC(NCCc1ccccc1)=C1C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 2313682463 CVWASZPPDWZGMD-UHFFFAOYSA-N 426.476 4.452 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3cccc(O[C@@H](C)C(=O)O)c3)SC2=S)cc1 2314931408 NWHLTPPKICAYRW-ZDUSSCGKSA-N 429.519 4.343 10 10 IICE CCCN(CC(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2352674045 TYXSUGPCKFYDJI-UHFFFAOYSA-N 429.355 4.069 10 10 IICE COc1ccc([C@H]2Nc3ccc(C(=O)NC[C@@H]4CCCO4)cc3[C@H]3C=CC[C@H]32)cc1OC 14479712 WZSJEHQOMYRBNY-UVPKRVSESA-N 434.536 4.439 10 10 IICE Cc1ccccc1N1C(=O)/C(=C\c2cccc(I)c2)C(O)=NC1=S 35227736 LAYFANNADWWPPT-UVTDQMKNSA-N 448.285 4.271 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)c4ccccc4C)c(C(=O)O)c3)CC2)cc1 64589580 UBZMIRWREMHASG-UHFFFAOYSA-N 445.519 4.281 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)[C@H]2CCCN(C3CCC3)C2)C1 436026701 KBYRJOHCBPFQTA-RTWAWAEBSA-N 436.644 4.177 10 10 IICE C[C@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc2c(c1)OCO2 726611264 SSRBTRGKRMIFKW-AWEZNQCLSA-N 433.455 4.046 10 10 IICE CCCn1c(/C(Cl)=C\c2cnn3ccccc23)nc2cc(S(=O)(=O)N(C)C)ccc21 729643788 IBDCXTMVZUPTEZ-SFQUDFHCSA-N 443.960 4.081 10 10 IICE COc1ccccc1[C@H](O)CN[C@H](C)c1cc(Br)cc(Br)c1O 756458170 KCMGNMUANOVCPY-MEBBXXQBSA-N 445.151 4.310 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C/c2ccnc(Cl)c2)NC(=O)OC(C)(C)C)cc1 761776677 SZAOLEJDFYVQQH-NJGYHNCTSA-N 444.963 4.196 10 10 IICE Cc1ccc(/C=C\C(=O)NCc2ccc(N(C)C(=O)/C=C\c3ccc(C)nc3)cc2)cn1 765480558 MSSJRWKFIQVYOL-HYQBVQLESA-N 426.520 4.099 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2sccc2C(=O)NC2CC2)C1 766486275 ZHFNDYSGQIZEMG-UHFFFAOYSA-N 436.581 4.000 10 10 IICE CCN1CC[C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@H]1c1cc(F)c(F)c(F)c1 782498817 FQPLHHJDKNCXGD-JTHBVZDNSA-N 446.517 4.339 10 10 IICE Cc1cc(Br)c(O)c(CNc2cccc(S(=O)(=O)NC(C)(C)C)c2)c1 796404432 PWUZSBLYTSYWOF-UHFFFAOYSA-N 427.364 4.152 10 10 IICE COCCNC(=O)c1cccc(N[C@H](C)c2cc(Br)cc(Cl)c2O)c1 797035877 APCYTMSULDYZLI-LLVKDONJSA-N 427.726 4.357 10 10 IICE C[C@H]1CN(c2ccc(CNC[C@@]3(C)CCN(C(=O)OC(C)(C)C)C3)cc2F)C[C@@H](C)O1 798947673 KHVGFPZKZXLACG-NXMSCROESA-N 435.584 4.176 10 10 IICE Oc1ccc(Br)cc1CNCc1cn(-c2ccc(Cl)cc2Cl)nn1 809713374 NNHYDGPZSCFZBK-UHFFFAOYSA-N 428.117 4.332 10 10 IICE Cc1cc(C(=O)N2CC[C@H](N3CCC3)[C@@H](F)C2)c(C)n1-c1ccccc1Br 819532145 UHVLMRGKBIYHQU-ICSRJNTNSA-N 434.353 4.115 10 10 IICE COc1ccc(N(CC(=O)N2[C@@H](C)CCC[C@H]2C)CC(=O)N2[C@H](C)CCC[C@H]2C)cc1 914866980 CNMYTDJSDXBLNF-NCYKPQTJSA-N 429.605 4.081 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCC[C@@H]1c1ccccc1 920052130 ZKBHVJDVKGVKOC-FYYLOGMGSA-N 425.548 4.312 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccc(N2CCCCC2)o1 1084200657 NQLZVYQEOFNFGB-KAMYIIQDSA-N 434.279 4.243 10 10 IICE CCOC(=O)c1ccc(N(CC2CC2)C(=O)C2=CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 1125412483 IYGFRBYVHHMYKC-IBGZPJMESA-N 428.529 4.220 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@](C)(CNC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1130185442 HXXASIJHWAEVCW-CLOONOSVSA-N 447.620 4.215 10 10 IICE Cc1csc(CNc2cccc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)c2)n1 1136881457 PNPNZBWVUNBSJM-UHFFFAOYSA-N 449.580 4.018 10 10 IICE Cc1cc(CC(=O)N2CCN(C3CCOCC3)C[C@H]2C)c(C)n1-c1ccc(Cl)cc1 1139340589 XRXXTFSIVFCSOE-GOSISDBHSA-N 429.992 4.002 10 10 IICE O=C(CN1CCC(O)(CN2CCCCC2)CC1)Nc1ccc(N=Nc2ccccc2)cc1 1176879324 ILVMCBBORYVYEK-UHFFFAOYSA-N 435.572 4.353 10 10 IICE COC(=O)c1cc2n(n1)CCC[C@H]2NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1180100006 RQNPBMGGUXYGQQ-OAQYLSRUSA-N 434.540 4.466 10 10 IICE Cc1nnc(N2CCC(C(=O)c3ccccc3)CC2)n1CCCSc1nccs1 1290759639 KAVHDLHQWWKKCF-UHFFFAOYSA-N 427.599 4.325 10 10 IICE Cc1ccccc1[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)[C@H]1CCC[C@@H](C)C1 1293237406 XJYMBZXNQPJHCV-ULYRPOKDSA-N 430.570 4.370 10 10 IICE CO[C@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccccc1Br 1295404817 BZBBCNDTXJQEAG-JXFKEZNVSA-N 434.330 4.050 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1cccs1 1304237923 HEJSXHOZOQBIPC-IBGZPJMESA-N 425.602 4.293 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCC3(OC)CCC3)CC2)cc1 1315515263 IYCWTRVPQWSLIR-UHFFFAOYSA-N 441.620 4.260 10 10 IICE CCOC(=O)c1c(NC(=O)COCc2ccnc(O)c2)sc(C)c1-c1ccc(C)cc1 1353529028 YZNZXAARFODXJV-UHFFFAOYSA-N 440.521 4.465 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1ccc(F)cc1 1436067554 BNUSWJVJPDEGQI-BKMDOPFGSA-N 444.528 4.228 10 10 IICE CCN(C(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1439253134 VAQUXHCCTRXTHR-FQEVSTJZSA-N 443.588 4.376 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C(C)(C)n2ccc(NC(=O)OC(C)(C)C)n2)cc1 1440671164 CLZCSBGPNCNNRA-UHFFFAOYSA-N 443.592 4.470 10 10 IICE Cc1ccc(C(=O)N(C)Cc2nc(O)c3sccc3n2)cc1-n1c(C)cc(C=O)c1C 1440872910 BTUGEHOOBRCILA-UHFFFAOYSA-N 434.521 4.198 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)O[C@@H]([C@@H]2CCCOC2)C(F)(F)F)CCCC1 1459759451 PZDLNXJKGGFAAP-SZNDQCEHSA-N 425.447 4.429 10 10 IICE Cc1nc2ccc(O)cc2cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1465532524 HBKPQCFGEQFURS-INIZCTEOSA-N 427.451 4.249 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@@H](c3ccc(F)cc3)C2(C)C)N(C)C)cc1 1471547022 GWDIYSYYHKPRPR-GOTSBHOMSA-N 426.580 4.472 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC(=O)NCc2cccc(Cl)c2O)CC1 1478760935 VKCHWQBOYCMECQ-SHTZXODSSA-N 425.957 4.176 10 10 IICE CC1(C)CCN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C[C@@H]1c1ccccc1 1479343396 HFTDVQWIYQFPTI-XMMPIXPASA-N 448.611 4.114 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](COC)OC)C1 1514090972 RSLVUZLHYCZBCV-IFMALSPDSA-N 437.588 4.250 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CC(C)C 1515278057 ISTCNRAICRDGMV-UHFFFAOYSA-N 436.604 4.313 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC(COC)CC2)cc1 1515525541 KIDUMSVYQIMSJB-UHFFFAOYSA-N 434.588 4.097 10 10 IICE CCSC1(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 1533715271 QZFILOWBTHEZEV-SDNWHVSQSA-N 426.654 4.131 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F 1544578214 YNPFBKQHMKPJCV-FQEVSTJZSA-N 447.482 4.022 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(COC)CCC1 1545504252 RQMXYAMIHQNOHE-FQEVSTJZSA-N 441.620 4.334 10 10 IICE CCC(O)(CC)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1546031368 FEEOTYQWQQTFNG-UHFFFAOYSA-N 448.615 4.436 10 10 IICE O=C(NCCc1cccc2c1OC(F)(F)O2)N(Cc1ccco1)Cc1ccccc1O 1565094988 SUGKVHNZEJMFQP-UHFFFAOYSA-N 430.407 4.261 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1(c2cccc(Cl)c2)CC(=O)C1 1566306229 DNLGTZRCPMEANL-UHFFFAOYSA-N 436.733 4.458 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2c[nH]cc2-c2cc(Cl)c3c(c2)OCCO3)c1 1566374414 IIARSUVWEOERAH-LBPRGKRZSA-N 428.872 4.312 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1c(F)ccc(C(F)(F)F)c1Br 1567467737 QIMDLGGEKYBTHB-QMMMGPOBSA-N 436.199 4.379 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCCCC[C@H]1NC(=O)OC(C)(C)C 1568737663 IAISXSKUCDUYOY-IAGOWNOFSA-N 425.566 4.358 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1nc2ccc(Br)cn2c1F 1570027673 SJMPQTHYXRCNRP-UHFFFAOYSA-N 433.064 4.178 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CC[C@@H](CNC(=O)OC(C)(C)C)C3)ccc21 1570390797 YEVPTMWCIXWKJH-QUCCMNQESA-N 443.588 4.328 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc2ccc(Br)cc2c(=O)o1 1585264602 UYCOMQCOURFDPP-AWEZNQCLSA-N 443.341 4.291 10 10 IICE CSc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)nc1 1585911516 UQJNSMBPQIQXRZ-GDNBJRDFSA-N 433.555 4.173 10 10 IICE Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CCCN3C)C2)c(C)n1-c1ccccc1Br 1587989982 JPKOGANRWOXUCS-FXAWDEMLSA-N 430.390 4.413 10 10 IICE C=CC(=O)Nc1ccc(O)c(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1617901956 VQJVTCIGOSDTCV-HNNXBMFYSA-N 427.932 4.336 10 10 IICE COc1ccc(CCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1 1618253505 OKMKXTYOANNKBE-JOCHJYFZSA-N 441.572 4.076 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@](C)(OC)C3CC3)CC2)cc1 1619301700 VIEOVAGQKVEILY-RUZDIDTESA-N 441.620 4.116 10 10 IICE CO[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC[C@H]1C 1619525961 OBNDJECUIVQPCJ-XMSQKQJNSA-N 425.621 4.159 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)c2ccc(O)cc2)CC1 1629955178 WFCFDODOICEKHL-UHFFFAOYSA-N 430.504 4.347 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@H](C)C3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1 1632612022 QXSPTOZDAYMJOD-ICSRJNTNSA-N 445.604 4.063 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cnc(-c2cccc(Cl)c2)s1 1634423696 JJHRBQPBUFQBBG-UHFFFAOYSA-N 445.947 4.494 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1c(F)ccc(I)c1Cl 1647830153 LGNBDVPKPDPZNK-UHFFFAOYSA-N 440.039 4.373 10 10 IICE Oc1cc(Br)ccc1CN[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1665663329 XVONLBODLYHWEK-IAGOWNOFSA-N 429.280 4.307 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(c4ccc(Cl)c(Cl)c4)CC3)cc2)CC1 1675580386 MBVRTBVRSUXXPA-UHFFFAOYSA-N 433.383 4.234 10 10 IICE Cc1ccnc(N2CCN(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)CC2)c1 1681827849 LRNBXZBAPLLRPX-IBGZPJMESA-N 442.007 4.312 10 10 IICE Cn1ccnc1[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)c1ccc(F)c(F)c1 1685617035 ZHFRRWXQTDDKKW-MRXNPFEDSA-N 441.265 4.300 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC2CCN(c3ccncc3)CC2)cc1 1687835622 UNKBACAXPMENFJ-UHFFFAOYSA-N 433.556 4.121 10 10 IICE Cc1ccc(N(C)c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)cc1 1693105876 YSMUMZRKHKLDGP-UHFFFAOYSA-N 425.587 4.394 10 10 IICE CCCN(CC)c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1695300089 FDIUCPATMWTECN-UHFFFAOYSA-N 438.620 4.035 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccn2)cc1 1710026034 VHDTWVMXAMXOSJ-UHFFFAOYSA-N 427.556 4.266 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010404983 WFFNKBFNXXTYDA-RTBURBONSA-N 431.537 4.178 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@H](NCc3ccc(Br)cc3O)[C@H]2C1 2092950236 QYXIMHWHQDXCDM-XIRDDKMYSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)C2(CC2)C1 2129398745 XHHXZSZDUWGOCD-HNNXBMFYSA-N 429.330 4.173 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](CNCc1cc(Br)cc(F)c1O)C2 2182489347 BALVTBPYGNXBBD-DCGLDWPTSA-N 443.357 4.419 10 10 IICE CCCN1C(=O)C(=Cc2c(N(CCC)CCC)nc3c(C)cccn3c2=O)SC1=S 2296547580 DXHZYFKQDDWUJN-UHFFFAOYSA-N 444.626 4.241 10 10 IICE CCOC(=O)c1ccc(NC(=O)CN2C(=O)C(=Cc3ccccc3C)SC2=S)cc1 2314827898 OTPXAIXFBJYIEO-UHFFFAOYSA-N 440.546 4.012 10 10 IICE COc1ccc(OCCN2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)cc1 2323719190 VNMRMNVCRVUDQE-UHFFFAOYSA-N 445.591 4.301 10 10 IICE CCOc1cccc(C=C2SC(=S)N(CCc3ccc(OC)c(OC)c3)C2=O)c1O 2323790346 SIFAJFBSRRRCDN-UHFFFAOYSA-N 445.562 4.252 10 10 IICE CCCN1C(=O)/C(=C/c2cc(I)c(O)c(OCC)c2)SC1=S 33681504 LTMYJJZIMMQTNU-WQLSENKSSA-N 449.335 4.007 10 10 IICE Cc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 47152311 IJOZVZUTRBGXRC-MFVBVHDHSA-N 427.507 4.132 10 10 IICE COc1ccc(N(C)CN2C(=O)/C(=C/c3cc(OC)ccc3OC)SC2=S)cc1 59377823 PKGVJHYSCULHDQ-UNOMPAQXSA-N 430.551 4.008 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 226834433 OSCRUMCLLZLPJU-ZOCZFRKYSA-N 427.526 4.498 10 10 IICE COc1ccc(O)c(C2=NN3[C@@H](C2)c2cccc(OC)c2O[C@H]3c2ccc(OC)c(O)c2)c1 245296689 ORUDZAJOEHNUPV-DFBJGRDBSA-N 448.475 4.366 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2ccc(=O)c3ccccc32)cc1 303456806 GGOHETRQCJOHDZ-UHFFFAOYSA-N 441.531 4.310 10 10 IICE COc1c(C)cc(CN(C)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1C 725863793 ILGHSMSBNKYOCJ-OALUTQOASA-N 443.563 4.406 10 10 IICE CS(=O)(=O)c1ccc(-c2csc(NS(=O)(=O)c3cccc4ccccc34)n2)cc1 752192321 VWNKHIYADAYOFS-UHFFFAOYSA-N 444.559 4.168 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)OCC[C@@H]1CCCCO1 754774014 DIGNBMCPGSSMBT-BXWAGETQSA-N 425.597 4.232 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCC[C@H]2COc3ccccc3O2)cc1 767186405 ZVQIQOYBFSFEMQ-QFIPXVFZSA-N 435.524 4.288 10 10 IICE Cc1ccc(NC(=O)COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)c1 769663168 KAROXAUAMFIGFO-UHFFFAOYSA-N 433.552 4.207 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@H]1CCCOc2c(Cl)cccc21 775777210 MVYJNOPJXZMNQY-FQEVSTJZSA-N 447.938 4.153 10 10 IICE CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cn1 1126581431 FEDWZWCHTYRVPD-INIZCTEOSA-N 446.498 4.066 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3cc4c(cc3OC(F)F)OCO4)ccc21 1127193588 CLYSKGGUVIRURU-UHFFFAOYSA-N 446.450 4.165 10 10 IICE O=C(/C=C/c1cnc2ccccc2n1)N(C[C@@H]1CCCO1)c1ccc(Br)cn1 1130008426 KHHAWNFNPSKAKE-VMSUTVGLSA-N 439.313 4.013 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccc(S(=O)(=O)NC(C)C)cc3)c2C)c1 1132043343 DVZSXIHGGCDGOE-UHFFFAOYSA-N 439.581 4.019 10 10 IICE COc1nc(C)cc(C)c1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1136600192 IHQZREYKWKZHRA-UHFFFAOYSA-N 443.345 4.202 10 10 IICE CC(C)[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)[C@@H](C)NC(=O)OC(C)(C)C 1141803455 JFQFMLYTMALZFE-YLJYHZDGSA-N 435.634 4.041 10 10 IICE COC1(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCCCC1 1147504789 HDDGDWOFJRJORD-HXUWFJFHSA-N 433.593 4.174 10 10 IICE COC(=O)c1ccoc1CSc1ccccc1C(=O)N1CCS[C@H](C(F)(F)F)C1 1155467976 VNDQWTIILLYJAT-INIZCTEOSA-N 445.484 4.478 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)Cc1cc(Br)ccc1OC(F)F 1171390601 OCWJGLYWUCWDPV-UHFFFAOYSA-N 444.272 4.321 10 10 IICE Cc1cc(CN2CCC[C@H](NS(=O)(=O)c3cccc(F)c3)C2)ccc1N1CCCCC1 1191985683 FSDGRFWJVUVJSB-QFIPXVFZSA-N 445.604 4.067 10 10 IICE Cc1cc(CCNC(=O)NC[C@](C)(O)c2ccc(F)cc2F)c(C)n1-c1ccccc1 1253807825 IOZPROKTQNROOI-DEOSSOPVSA-N 427.495 4.122 10 10 IICE COC(=O)c1c(NC(=O)C[C@H]2CCNC2=O)sc(C)c1-c1ccc(Cl)cc1Cl 1264453626 DPSZXHDTBFAVQO-SNVBAGLBSA-N 441.336 4.282 10 10 IICE COc1cccc(C[C@@H](C)CC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 1266258948 LVWVDQWEQMTGMU-OAQYLSRUSA-N 435.612 4.112 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl 1297438406 BLUPQXZAYJVGOY-UHFFFAOYSA-N 438.036 4.439 10 10 IICE CCOc1ccc(N2CCN(CC[S@](=O)c3cc(Cl)ccc3Cl)CC2)cc1 1307599488 KNEMSVACVVUBLZ-MHZLTWQESA-N 427.397 4.322 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCN(c4ccc(C)c(C)c4)C[C@H]3C)C2)cc1 1312902844 QIQYBVFURRQCAZ-FGZHOGPDSA-N 436.600 4.059 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1314418445 JPDQIFRWQDUBOY-QFIPXVFZSA-N 448.615 4.488 10 10 IICE COc1cccc(-c2nnc(Nc3cnn(C)c3)n2CCCSc2nccs2)c1 1315571602 PWRIWCWYIAOEEU-UHFFFAOYSA-N 427.559 4.070 10 10 IICE C[C@@H](NC(=O)[C@H]1CCCCC[C@H]1NC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1357928355 NLGVVIXVJJTUPY-BVYCBKJFSA-N 445.604 4.174 10 10 IICE CCc1cnc(CN(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1361168868 NLPNNWNOECBDMS-MHWRWJLKSA-N 449.598 4.095 10 10 IICE CCOc1ccccc1-c1cccc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 1438886747 MQELFCHVVNRAKE-UHFFFAOYSA-N 429.564 4.434 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(Br)c(C)c([N+](=O)[O-])c3)CC2)cc1 1446414519 HUCOBAHZERIWQZ-UHFFFAOYSA-N 448.317 4.027 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@H](O)C(F)(F)F 1447085146 WMYCVCDQYKUMHL-HOTGVXAUSA-N 433.268 4.288 10 10 IICE CCO[C@@H]1C[C@@](CO)(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1(C)C 1447795985 IALPCSXSXNLELT-KNQAVFIVSA-N 449.389 4.153 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCC3(O)CCN(Cc4ccccc4)CC3)c2C)c1 1451568860 KTUJGBRMMWWNFN-UHFFFAOYSA-N 431.580 4.159 10 10 IICE COC(=O)Nc1ccc(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c(Cl)c1 1466650313 QHXWAHHGKSRBMG-UHFFFAOYSA-N 430.936 4.301 10 10 IICE COC(=O)/C=C\c1ccc(N2CC[C@@H]3[C@H](CCCN3Cc3ccccc3)C2)c([N+](=O)[O-])c1 1472722444 SCMGBCGZJMBAAS-GEKSQCCNSA-N 435.524 4.272 10 10 IICE Cc1cc(C(=O)Cn2c(Br)cccc2=O)c(C)n1-c1ccc2c(c1)CCC2 1473039841 ZVSYDIDZFVWNCN-UHFFFAOYSA-N 425.326 4.390 10 10 IICE Cc1c(Br)cccc1C[C@@H](CO)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1478471264 SAIMZIGELKTGCR-DLBZAZTESA-N 448.405 4.035 10 10 IICE CC[C@@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1514050349 NULOFVNQBPDDRU-HXUWFJFHSA-N 425.621 4.285 10 10 IICE COc1cccc([C@@H](C)N2CCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)CC2)c1 1543216221 ZQVOKXCWQZZLJP-HXUWFJFHSA-N 445.563 4.434 10 10 IICE CCO[C@H](CCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1547850447 YPTNWNGOCOQCTF-FGZHOGPDSA-N 428.577 4.457 10 10 IICE Cc1cc(C(=O)N2CC[S@@](=O)C(C)(C)CC2)c(C)n1-c1ccccc1Br 1556621591 RPZFLMOPKZFHPH-AREMUKBSSA-N 437.403 4.230 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)cc1 1557355095 BXUVGYWBUDIZSV-SFHVURJKSA-N 441.572 4.489 10 10 IICE Cc1cc(C(=O)N[C@@H]2C[C@@H](N(C)C)C23CCC3)c(C)n1-c1ccc(Br)cc1 1557697613 WJDKWAJJVYOBTF-WOJBJXKFSA-N 430.390 4.459 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Nc2nccs2)cc1F 1570168263 XYESKVNRALJJDQ-UHFFFAOYSA-N 448.470 4.071 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](Cc1ccccc1)N1Cc2ccccc2C1=O 1597782100 XRFRSDKPMJYADQ-AREMUKBSSA-N 441.575 4.368 10 10 IICE CC[C@H](C)CN(CC)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1613397326 TYLRXSFMOGBSCI-FPOVZHCZSA-N 443.661 4.256 10 10 IICE Cc1nc(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)sc1C 1616567801 WLYBTBPBDJATNK-UHFFFAOYSA-N 442.342 4.413 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(NC(=O)CC(C)C)ccc3Cl)C2)cc1 1617263372 VVGBMYPARCWRCE-KRWDZBQOSA-N 429.948 4.342 10 10 IICE Cc1cc(C(=O)NCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1ccc(C(C)C)cc1 1625681864 RAMJMPXUQTUNQP-UHFFFAOYSA-N 429.520 4.244 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2ccc3c(c2)OC(F)(F)O3)cc1 1626107299 XILLORKGUMOJAT-FQEVSTJZSA-N 446.494 4.215 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1627390527 FSADHNIALRDAKF-HOYKHHGWSA-N 432.520 4.057 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1csc(N(C)c2ccccc2)n1 1631534205 UBNPRVDYZKKZNH-UHFFFAOYSA-N 445.928 4.085 10 10 IICE COCCNC(=O)[C@H](CC(C)C)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1631783926 LFJWDRKHKZSZBE-QHCPKHFHSA-N 427.589 4.125 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(Br)c(F)cc3F)CC2)cc1 1632158060 OMDKJFKDTDTBOF-UHFFFAOYSA-N 425.273 4.088 10 10 IICE CCN(C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)[C@H]1CCN(CC(F)(F)F)C1 1641507737 QKKRLIVWTNEPCX-FQEVSTJZSA-N 435.490 4.314 10 10 IICE CCN(C)c1ccc(CN(Cc2ccccc2)[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)cc1 1643356236 UJDNRKVZAZKPJL-DNQXCXABSA-N 439.600 4.125 10 10 IICE CC(C)N1C(=O)C[C@@H](NCc2ccc(N3CCOCC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1654145493 BMXMHIKDHRCTQK-VWNXMTODSA-N 445.966 4.156 10 10 IICE Cc1cc(CNC(=O)NCC2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]23)c(C)n1-c1ccccc1 1684483071 FHIDPUCCIWUPRA-FGZHOGPDSA-N 438.572 4.006 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(OC4CCC(C)CC4)CC3)C2)cc1 1686855232 ZAUVETGDNUTWEC-LRZVDXDASA-N 429.605 4.291 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@@H]3c3ccc(Br)cc3)C2)cc1 1687022755 GUHMMCJBPPEDBK-YLJYHZDGSA-N 430.346 4.193 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC[C@]1(Cc2ccccc2)C=CCCC1 1687155129 GITOAFMFFDHNNQ-HHHXNRCGSA-N 433.596 4.416 10 10 IICE COCCN(c1nnc(CC(C)C)n1Cc1ccc(N(C)C)c(F)c1)[C@H]1CC[C@H](C)C1 1730742076 NEEKCYROZNKLKV-ICSRJNTNSA-N 431.600 4.371 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCC3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1742117904 WHEWQDUQNKFUPE-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC1 1748469087 OANCWIFHOMIAAY-HXUWFJFHSA-N 432.619 4.308 10 10 IICE C[C@H]1CC[C@H](Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)C1 1752074578 NVBPGTLWJCXIGL-FPOVZHCZSA-N 425.621 4.485 10 10 IICE CC(C)c1nnc(N(C)[C@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752089943 FGKZPLIGXINOKF-ICSRJNTNSA-N 429.584 4.440 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H](Oc2ccccn2)C1 1761698720 VKWPLECQWCSSMD-QFIPXVFZSA-N 448.615 4.342 10 10 IICE CN(C)c1ccc([C@H](NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)c2nccn2C)cc1 1866230657 OXNNWWBQEGFHPS-NRFANRHFSA-N 449.555 4.353 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCC[C@H](C)C4)nc(-c4cccnc4)n3)CC2)cc1 1868003688 SFPJDPQAMVFEFQ-FQEVSTJZSA-N 444.583 4.110 10 10 IICE Cc1nn(Cc2cc(Br)ccc2O)c(I)c1C(F)F 2079596285 YOVDORUWLOYFND-UHFFFAOYSA-N 443.029 4.250 10 10 IICE CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1OC)c1cc(Br)ccc1O 2146729555 XMPFRXZKUKWLNR-XYJFISCASA-N 443.382 4.220 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccc(O)cc3)C2=O)cc1 2293035078 OERXBCCROVVZJG-UHFFFAOYSA-N 428.535 4.021 10 10 IICE COc1ccc(C=C2C(=O)NC(=S)N(c3cccc(Cl)c3Cl)C2=O)cc1Cl 2294259111 JPNBPPSIIRVDRV-UHFFFAOYSA-N 441.723 4.487 10 10 IICE O=C1NC(=S)SC1=Cc1cccc(OS(=O)(=O)c2ccc3ccccc3c2)c1 2295172650 RDNLDEBUUPFGFH-UHFFFAOYSA-N 427.528 4.096 10 10 IICE Cc1ccc(N2C(=O)C(=C3C(=O)Nc4ccc(Br)cc43)SC2=S)cc1 2296680779 YRNPSHRXTHDICY-UHFFFAOYSA-N 431.336 4.486 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)NC(=S)N(c3ccccc3)C2=O)o1 2313553199 RFOJQYVZPWVSQA-UHFFFAOYSA-N 447.472 4.249 10 10 IICE COc1ccc(C=C2SC(=S)N(c3cccc(C(C)=O)c3)C2=O)c(C(=O)O)c1OC 2314929747 RDAJJAVFMCNRNU-UHFFFAOYSA-N 443.502 4.010 10 10 IICE CCN(CC)CCNC(=O)c1ccc(N=NN2CCN(c3cccc(Cl)c3)CC2)cc1 2330149452 GYRDPDJHLUCLEA-UHFFFAOYSA-N 442.995 4.233 10 10 IICE Cc1ccc(CNCc2csc(CNC(=O)OC(C)(C)C)n2)c(O)c1Br 2352944506 IYRGPKFHPYKSBL-UHFFFAOYSA-N 442.379 4.234 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14460015 ZDWGRAJKBSZWAF-RPWDQDSNSA-N 428.554 4.304 10 10 IICE CCSc1nnc2c(n1)O[C@@H](c1ccc(N(C)C)cc1)N(C(C)=O)c1ccc(C)cc1-2 32997503 XXNBTSPIHTVSAM-QFIPXVFZSA-N 435.553 4.469 10 10 IICE CCCn1c(N2CCCC2)c(/C=C2\SC(=S)N([C@H](C)CC)C2=O)c(C)c(C#N)c1=O 39990009 JERMEKGZYCIIJK-IIMQCXAKSA-N 444.626 4.038 10 10 IICE CCCCN(C(=O)/C=C\c1cc(C)n(-c2ccc(C)cc2)c1C)[C@H]1CCS(=O)(=O)C1 206439123 IGQZNETXBWSOEE-AGUXYKHFSA-N 428.598 4.232 10 10 IICE Oc1ccc(Br)cc1[C@H](c1ccc(OC(F)(F)F)cc1)N1CCOCC1 575276613 DOROLYNZAMIWJQ-KRWDZBQOSA-N 432.236 4.475 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 741392439 FRSUFHXIUXTEHE-UHFFFAOYSA-N 445.445 4.049 10 10 IICE COC(=O)c1cc2ccccc2c(CN(C)Cc2nc([C@@H](C)OCC(C)C)no2)c1O 744439524 DDUILWSZBWNZLD-OAHLLOKOSA-N 427.501 4.081 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(C)cc3-c3nc(C4CC4)no3)CC2)cc1 746744155 DPCFVDLCXXMLEL-UHFFFAOYSA-N 433.512 4.285 10 10 IICE O=C(Nc1ccc([S@](=O)C(F)(F)F)cc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 750615417 CHNGWEGEKWOZLM-DFYVNMARSA-N 442.459 4.233 10 10 IICE CCOC(=O)c1sc([C@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)nc1C 757269702 BYIKGTVAPIEKLK-HNNXBMFYSA-N 430.574 4.129 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@H]3C)ccc21 762600665 ZTIGQYXIFSFFLC-IIBYNOLFSA-N 443.588 4.280 10 10 IICE Cc1cncc(/C=C/C(=O)NCc2ccc(N(C)C(=O)/C=C/c3cncc(C)c3)cc2)c1 765480216 LKRGSXYRJAVNLC-JMQWPVDRSA-N 426.520 4.099 10 10 IICE Cc1cc(Br)c(O)c(CNc2cc(Cl)ccc2OCCS(C)(=O)=O)c1 781636514 RNIJHVAQGYHGTA-UHFFFAOYSA-N 448.766 4.152 10 10 IICE COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1nc(-c2c(C)cc(C)cc2C)cs1 795609015 DBVBTYDBVAOYFN-UHFFFAOYSA-N 433.511 4.453 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](C(=O)N4CCCC4)C3)cc2Cl)C1 800719792 NPLAQKJGAXHRFP-QUCCMNQESA-N 447.023 4.120 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1c1ccccc1F 916662858 RTSBHJWEAWFZBM-XFFZJAGNSA-N 431.251 4.429 10 10 IICE COc1cc(OC)cc(N(C)C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1 1128117968 ZRJMCQYUNZCKAV-UHFFFAOYSA-N 426.513 4.274 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc4cc(C(C)(C)C)ccc4[nH]3)CC2)cc1 1135722654 OAQZERHSKYVJCD-UHFFFAOYSA-N 448.611 4.416 10 10 IICE CCN(C)C(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C(C)C 1141199801 KWSZYZDOYQPARI-IBGZPJMESA-N 434.378 4.089 10 10 IICE Cc1cc(CC(=O)N2CCC(CN(CCO)C(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1142850494 GVYDPQKVINULPY-UHFFFAOYSA-N 446.035 4.231 10 10 IICE CC(C)(C)[C@H]1Cc2ccccc2N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1175333154 RNLSIYUCVRJSPD-NRFANRHFSA-N 439.575 4.004 10 10 IICE COc1cc(N2CCN(CCCOc3ccc4ccccc4c3)CC2)cc(OC)c1OC 1193188012 IVGKYRORWXHIHV-UHFFFAOYSA-N 436.552 4.457 10 10 IICE COc1ccc(CN(CCO)C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1227208189 LRYBQYBDWOEDDA-SFHVURJKSA-N 445.991 4.289 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@@H](Cc3ccccc3)C(C)C)CC2)c(OC)c1 1234520200 FQESODLFAOJRFM-OAQYLSRUSA-N 425.573 4.050 10 10 IICE Cc1ccc(C(=O)Nc2cccc(CS(C)(=O)=O)c2C)cc1-n1c(C)cc(C=O)c1C 1293524251 BCUXCYHNKJZOCY-UHFFFAOYSA-N 438.549 4.320 10 10 IICE Cc1ccc(C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)cc1-n1c(C)cc(C=O)c1C 1298023459 BDPJZAYHNLOVCD-GMKZXUHWSA-N 448.567 4.339 10 10 IICE CC[C@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1306388335 VNOJKUYODIJGPJ-NQIIRXRSSA-N 429.634 4.007 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3=Cc4ccccc4O[C@@H]3C(F)F)cc2F)C[C@@H](C)O1 1357836129 NXXFIHSQVMGEOU-HLFMIMNKSA-N 446.469 4.165 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccccc3C(C)(C)C)cc2F)C[C@@H](C)O1 1357836319 TUIRDRZHKYOEQF-HDICACEKSA-N 428.548 4.432 10 10 IICE CC(C)N(Cc1ccco1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1360120197 YHGLALGCXVDORD-UHFFFAOYSA-N 441.586 4.382 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CCCN(CC(F)(F)F)C1=O 1446807484 UWJPGLIBFLOSSS-QFBILLFUSA-N 434.458 4.283 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC(c2ncco2)CC1 1452138828 RRYXMIHVWTULNB-DTQAZKPQSA-N 447.607 4.124 10 10 IICE Cc1cc([C@H]2CCCN2CC(=O)NCc2ccc(N(C)C)cc2)ccc1Br 1460025423 UZHMMBXKHIFVNE-OAQYLSRUSA-N 430.390 4.277 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1CC(O)(c2cccc(Cl)c2)C1 1465950879 FGFXRWPOOGRJBL-VRVFXRSRSA-N 449.378 4.077 10 10 IICE COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1C 1473843154 QQUMGIVKJOCUBU-IAGOWNOFSA-N 442.515 4.457 10 10 IICE CCOCc1nnc(N2CCC[C@H]2CSC)n1Cc1ccc(N2CCC(C)CC2)cc1 1503091772 QUBWAFKUABOMSD-QFIPXVFZSA-N 443.661 4.431 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ccsc1 1512804371 KRPFWTLWVCZNEO-GOSISDBHSA-N 425.602 4.374 10 10 IICE CCN1C[C@H](CN(C)C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)Oc2ccccc21 1525085023 WEMKYOFNZBDRFI-NRFANRHFSA-N 435.568 4.264 10 10 IICE COc1ccccc1O[C@H](C)CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1533141876 JZTVVQIYUCQNOU-LJQANCHMSA-N 435.568 4.000 10 10 IICE CCSc1cc(Cl)ccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1535345756 NFGOPFLVECMXKT-UHFFFAOYSA-N 426.916 4.497 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(OC(F)(F)F)c(Cl)c3)c2)CC1 1585113601 GECJKHFBFRGPKW-UHFFFAOYSA-N 441.837 4.159 10 10 IICE Cc1cc(C(=O)NCC2(O)CCC(C)(C)CC2)c(C)n1-c1ccc(Br)cn1 1585526434 ZESTVKDIDNVHOR-UHFFFAOYSA-N 434.378 4.313 10 10 IICE CC(C)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1586060255 DQNPGASAWOBSSP-LEWJYISDSA-N 448.652 4.047 10 10 IICE CC[C@H](C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Br)cc1 1586800956 ZSWAYNFRVUDCTQ-QFIPXVFZSA-N 445.401 4.468 10 10 IICE COCCCN(Cc1cc2c(C)cc(=O)oc2c(C)c1O)C[C@H]1CCCN2CCCC[C@H]12 1614472673 BHCZOCAGPZUNOC-NFBKMPQASA-N 442.600 4.218 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(CC)CC1CC1 1615090711 FTVQQXNSXSSWFY-UHFFFAOYSA-N 434.588 4.067 10 10 IICE COc1ccc(N2CCCN(CC(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CC2)cc1 1615219420 JMGLUJOTPCAFKY-MRXNPFEDSA-N 436.383 4.392 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc(OCCCN(C)C)c2)cc1 1628086994 ZYEFCUIKEWHOTA-UHFFFAOYSA-N 433.552 4.418 10 10 IICE COc1ccccc1O[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)C1 1636262467 HIQKFSLFNJOKBV-KNQAVFIVSA-N 425.573 4.254 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)c2ccccc2)c(C)n1-c1cccc(Br)c1 1639453259 IHXLKKJVQCITLG-QFIPXVFZSA-N 427.342 4.494 10 10 IICE O=C(Cc1csc(COc2ccc(Cl)cc2)n1)NCc1ccc2cccnc2c1O 1639621660 OEPRZFLTCAQVIJ-UHFFFAOYSA-N 439.924 4.488 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@H](CO)Cc2ccncc2Cl)c1 1639912764 FJVXPOGKKJNZCN-MRXNPFEDSA-N 432.351 4.377 10 10 IICE CO[C@H](C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)[C@H]1CCOC1 1641202975 PVAJTXXSPZVLRR-ZRCAFCQKSA-N 436.474 4.350 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC(C2CCCCC2)C1 1641599657 AORJCAVAWDRIGL-XDHOZWIPSA-N 432.586 4.456 10 10 IICE Cc1cc(-c2csc(NC(=O)/C=C3\SCC(=O)N3C)n2)c(C)n1-c1ccc(F)cc1 1654198262 WWKPUWTWHHWRAN-UKWGHVSLSA-N 442.541 4.342 10 10 IICE CC(C)(COCc1ccccc1)NC(=O)NCCN1CCCc2cc(OC(F)F)ccc21 1657590055 PGFZNQTUHFXKJW-UHFFFAOYSA-N 447.526 4.335 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C(=O)OC(C)(C)C)cc1 1685631514 ZCYZPZWCBFEZCY-NJYVYQBISA-N 430.593 4.215 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1CC 1705895793 SEQHYAZJYHYKFP-WZONZLPQSA-N 446.599 4.280 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(SC)CC1 1708396838 OPMPSPLOTAFYKT-GOSISDBHSA-N 429.634 4.160 10 10 IICE CCN1CCC(CCn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CC1 1710224935 IKLPGNYXYRCIEH-UHFFFAOYSA-N 425.621 4.475 10 10 IICE CC(C)Cc1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1723318091 TZLALODSJUBYNN-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CN1CCCc2cc(Cn3c(-c4ccccn4)nnc3N(C)CCC(F)(F)F)ccc21 1729596243 BFKFQJAIBLKUSL-UHFFFAOYSA-N 430.478 4.159 10 10 IICE CC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)[C@H](C)C1 1749846288 KHKDMMHHIGSTDD-HXUWFJFHSA-N 448.615 4.456 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)C[C@@H]1CCCCO1 1761698401 NIQONHUPBIJDCE-QFIPXVFZSA-N 439.629 4.358 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H](SC)C(C)(C)C)CCOC1 1767394841 XBKWPSKKVAEBKX-WMZHIEFXSA-N 448.633 4.050 10 10 IICE CC(=O)Nc1ccc(S(=O)(=O)N(CCc2c[nH]c3ccccc23)c2ccc(N)cc2)cc1 1857992381 QFNMIWOKGLXNAO-UHFFFAOYSA-N 448.548 4.147 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Cc3ccccc3)c3cccc(OC)c3)CC2)cc1 1858087343 SYNCCBFGJALBQY-AREMUKBSSA-N 430.548 4.379 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010390313 BPELSOIYJUJUEI-LPHOPBHVSA-N 431.537 4.034 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC[C@@H]2NCc2cccc(Br)c2O)CC1 2132804935 PUDZWNHHQFHPDT-INIZCTEOSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NCc3cc(Br)cc(F)c3O)C(C)(C)[C@@H]21 2175899879 CQMWMAMDFGECCH-KBRIMQKVSA-N 443.357 4.417 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2[C@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380771940 KUYXCBJPQCQBNV-CJNGLKHVSA-N 441.366 4.067 10 10 IICE O=C(O)CCOc1cccc(/C=C2/SC(Nc3ccc(Br)cc3)=NC2=O)c1 16908352 LCKSTQFKHFUUPM-LFIBNONCSA-N 447.310 4.385 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(/C=C3\NC(=O)N(Cc4ccc(C)cc4)C3=O)c2C)cc1 96469688 SOBMVVXNTCPYJK-UCQKPKSFSA-N 443.503 4.282 10 10 IICE CCOC(=O)c1ccc(N2C(=O)/C(=C/c3cccc(Cl)c3)C(C(=O)OC)=C2C)cc1 103756397 NGJOCCQONMMTEK-CPNJWEJPSA-N 425.868 4.394 10 10 IICE Cc1cc2c(n1-c1cc(Br)ccc1I)CCC[C@@H]2N 311559706 NZTBAAXDVFAMJT-ZDUSSCGKSA-N 431.115 4.489 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CNCc1cc(Cl)cc(Br)c1O 723835780 DFASBHUPOPSYJJ-YPMHNXCESA-N 433.774 4.401 10 10 IICE Cc1cc(C(=O)COC(=O)C2C[C@H]3COC[C@@H](C2)C3=O)c(C)n1-c1ccc(C(C)C)cc1 740399866 VURCPTWGFWAOEN-SEJPIABJSA-N 437.536 4.185 10 10 IICE O=C(Cc1c(F)ccc(Br)c1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 800522699 MFEZEPMFHIOKJS-AWEZNQCLSA-N 440.284 4.183 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2nc(-c3ccccc3)no2)c(C)n1-c1ccc(Cl)cc1 804122284 BJJMLNCAONIAGZ-FQEVSTJZSA-N 436.899 4.261 10 10 IICE COc1ccc([C@@H](CC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)NC(C)=O)cc1 822093806 OVJFXALWCALSSV-RUZDIDTESA-N 433.552 4.029 10 10 IICE C[C@@H](NC(=O)c1cc(Br)ncc1Br)c1ccc(N(C)C)cc1 1128135526 FNXCOPTVFHCSDL-SNVBAGLBSA-N 427.140 4.164 10 10 IICE CC(C)O[C@H]1CCCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1130762858 DJOYWNWNQJKCDL-ZKMNFCBKSA-N 438.640 4.146 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1131031313 ZEHHZGUUWDGBSC-LUTRRODMSA-N 431.536 4.441 10 10 IICE CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1141382670 GCXQJGRSDLJSSM-UHFFFAOYSA-N 439.462 4.286 10 10 IICE CC(C)c1ncc(OCc2ccccc2)c(C(=O)NCc2ccc3c(c2)CCCN3C)n1 1142465817 SATDCCHNDQHUEI-UHFFFAOYSA-N 430.552 4.491 10 10 IICE Cc1cc(C(=O)N[C@H](C2CCOCC2)C2(CO)CCC2)c(C)n1-c1cccc(Cl)c1 1143573472 MRTVRTIRQIXLPY-JOCHJYFZSA-N 430.976 4.435 10 10 IICE COc1cc(N[C@@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)cc(OC)c1 1149999890 GIYXUTXLOMVJTG-CQSZACIVSA-N 428.510 4.046 10 10 IICE CC(C)(C)c1ccc2cc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)[nH]c2c1 1155604132 NBTAYTOMGASMKK-UHFFFAOYSA-N 432.568 4.097 10 10 IICE Cc1ccc(C[C@H](C)N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1167453904 OLUGAWCKVHHFRP-SFHVURJKSA-N 426.516 4.272 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@H](C)c1nc(N)nc(Nc2ccccc2)n1 1167512624 OUZWGBGWUFNXBM-CYBMUJFWSA-N 443.349 4.249 10 10 IICE O=C(CN1CCC[C@@H]1CCC1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 1168174973 KOTJCFIEGPEDTP-JOCHJYFZSA-N 431.596 4.103 10 10 IICE COc1ccc(C2CC2)c(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1175300659 UYACLIZUJRBKDC-UHFFFAOYSA-N 444.534 4.393 10 10 IICE Cc1cc(C(=O)Cn2c(-c3cccs3)noc2=O)c(C)n1-c1ccc(OC(F)F)cc1 1188678346 VEDYOMQTDUQDMB-UHFFFAOYSA-N 445.447 4.457 10 10 IICE Cc1nnc(N(CC(C)C)C2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1290740124 JLFYNDDSQGQTFM-UHFFFAOYSA-N 425.621 4.249 10 10 IICE COc1cccc(CNC(=O)Cc2csc(-c3sccc3Br)n2)c1O 1294938243 YSSMWHLSEJECCJ-UHFFFAOYSA-N 439.356 4.207 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(C)n(C)c1=O 1295429645 YTKCDPQBNYUDLQ-UHFFFAOYSA-N 444.583 4.254 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1F 1298056529 QYPATNKCCRPQOJ-SFTDATJTSA-N 445.583 4.024 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccsc1 1299205095 UIDZOHKBHYNHBU-UHFFFAOYSA-N 448.596 4.035 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@H]1CCCO[C@H]1C(C)(C)C 1314753221 MTNLFPNAAHEYDB-ZJSXRUAMSA-N 449.599 4.447 10 10 IICE Cc1cc(CCNC(=O)NCCc2nc(Cc3ccccc3)no2)c(C)n1-c1ccccc1 1353028825 TYXLFIVSCGQFJH-UHFFFAOYSA-N 443.551 4.152 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)cc2)c1C 1436846558 IUSCEGBNWGQDKH-SFHVURJKSA-N 448.567 4.093 10 10 IICE COC(=O)c1cc(-c2csc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)n2)c[nH]1 1443505445 PXJZBBKZRDQUMK-UHFFFAOYSA-N 448.504 4.397 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1c1ccc(Cl)c(F)c1 1450723072 UZEBLIBLPKVEPU-PXAZEXFGSA-N 445.705 4.327 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cc(C)cc(Br)c4o3)CC2)cc1 1458048290 ZEKQWQNFPXGNMA-UHFFFAOYSA-N 429.314 4.475 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](NC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2)c1 1465609457 UKQLGWKGVJJYLQ-HXUWFJFHSA-N 433.552 4.428 10 10 IICE COC1CCN(c2ccc(CN[C@@H](CCO)c3ccccc3Br)cc2)CC1 1473375589 SUOHZDHELRQVOZ-QFIPXVFZSA-N 433.390 4.278 10 10 IICE CN(CC1CC(F)C1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1503524877 BZMVDCLZIDEITE-UHFFFAOYSA-N 431.625 4.361 10 10 IICE CCN(CC(C)C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1515459748 OREQISKFFMXCAH-DEOSSOPVSA-N 447.599 4.054 10 10 IICE CS(C)(=O)=Nc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 1530288286 WJISBYCZHLVMEY-UHFFFAOYSA-N 437.512 4.046 10 10 IICE Cc1cc(-c2csc(NC(=O)CSc3nncn3C)n2)c(C)n1-c1ccc(F)cc1 1532706056 HEUCIKMMYFPBCA-UHFFFAOYSA-N 442.545 4.216 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCCC1SCCS1 1533948058 IMPAAJYOYYKGEN-QBFSEMIESA-N 444.694 4.042 10 10 IICE COc1ccc([C@H]2[C@@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC(=O)N2C)cc1 1535136457 OTDYWCATMGKRFM-AHWVRZQESA-N 445.563 4.247 10 10 IICE CC[C@@H](C(=O)N(CC)Cc1ccc(N(C)C)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1544094399 SRLICLARUPCVOE-FQEVSTJZSA-N 426.952 4.059 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCOC3(CCCC3)C2)NC(=O)OC(C)(C)C)cc1 1544267793 IIDINVWWJRTRAO-FPOVZHCZSA-N 445.604 4.174 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCc1ccccn1 1545503514 BYNGMZCXQSTCJX-FQEVSTJZSA-N 434.588 4.155 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1sc(CC2CC2)nc1C 1556426336 IMACKYRUCTUASJ-UHFFFAOYSA-N 429.586 4.406 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3c(F)cc(Br)cc3C2)c([N+](=O)[O-])c1 1559136852 FQSMQTQMWIBSLL-HWKANZROSA-N 435.249 4.245 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O 1564555644 WZKANWHFGCUGBF-VFHOHQAYSA-N 441.591 4.204 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H]2CCCN(C(C)(C)C)C2=O)cc1 1565656187 RWDZEPOFAKNEPY-HSZRJFAPSA-N 437.584 4.332 10 10 IICE COc1cc(CN2CC[C@H](NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)cc(OC)c1 1566295730 RGAOTDIMGBHOHY-QFIPXVFZSA-N 447.579 4.424 10 10 IICE Cc1ccc(-n2nc(C(=O)NCc3cccc(Br)c3O)c3c2CCCC3)cc1 1568606017 WBAGITJLLXGGFW-UHFFFAOYSA-N 440.341 4.458 10 10 IICE COC(=O)[C@@H](C)Oc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1F 1584788918 YJPYYGWXVIDDML-MRXNPFEDSA-N 438.455 4.238 10 10 IICE CC(C)(CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)CC(F)(F)F 1586903382 GQIRRTHAEXJIOB-UHFFFAOYSA-N 434.370 4.079 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)c1C 1618183027 LRISRLVHZPAVLN-XMMPIXPASA-N 431.580 4.076 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2ccccc2C(F)(F)F)cc1 1622527035 ULRQRYGFTFZIID-QFIPXVFZSA-N 444.453 4.318 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1 1624305874 YYIALQAJHBSLKW-UHFFFAOYSA-N 437.927 4.443 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1C[C@@H](NC(=O)OCc2ccccc2)C1 1624554210 RIJULYRWXZJTFC-ZRZAMGCNSA-N 435.568 4.340 10 10 IICE C[C@H](NC(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1625882024 ADDXCZIESMGFPD-GHTZIAJQSA-N 447.620 4.372 10 10 IICE O=C(NCc1ccc(O)cc1O)c1c(C(F)(F)F)nn(-c2ccccc2)c1C(F)(F)F 1630301497 CMODKFNPLMGQLT-UHFFFAOYSA-N 445.319 4.251 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2csc(I)c2)cc1F 1633259029 HQSQCAXJZGFZTC-UHFFFAOYSA-N 432.302 4.268 10 10 IICE O=C(CCCCCc1ccc(I)cc1)NCc1cc(O)ccc1O 1633595303 QTMXFJQYOMYZGC-UHFFFAOYSA-N 439.293 4.122 10 10 IICE C[C@H](NC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCCC3)c1ccccc1O 1642828081 YXOSDESSWYVIFE-ZDUSSCGKSA-N 443.594 4.482 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@@H]3CN(C)CCN3Cc3ccccc3)c2C)c1 1647781792 SONQYZJJWZHSRV-AREMUKBSSA-N 444.623 4.257 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CC[C@]3(C)C3CCCCC3)cc2F)C[C@@H](C)O1 1659918957 UDCFRSPRVNIMBM-MPCDZSKCSA-N 431.596 4.100 10 10 IICE C[C@@H](NC(=O)N[C@@H]1Cc2ccccc2N(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671851993 OBHZNELRDCWWKX-YLJYHZDGSA-N 438.572 4.479 10 10 IICE CC[C@H](C)c1nnc(N2CC=C(COC)CC2)n1Cc1ccc(N2CCSCC2)cc1 1708434401 GAEHADDAEHWLFO-IBGZPJMESA-N 441.645 4.176 10 10 IICE CCC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@@]2(OC(C)C)CCOC2)CCC1 1708890700 HGPJWMUUJOAYAM-XMMPIXPASA-N 428.577 4.241 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1712177031 VOTHNEGHJNKTHK-MJGOQNOKSA-N 443.592 4.279 10 10 IICE CC(C)[C@@H]1OCCC[C@@H]1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1723250836 XLZNLCXSZPRHRJ-FCEUIQTBSA-N 428.577 4.313 10 10 IICE CC(C)CN(c1nnc(C(=O)N2CCCC2)n1CCCSc1nccs1)C(C)C 1723431121 KBJVEABWVHMZHR-UHFFFAOYSA-N 436.651 4.024 10 10 IICE C[C@@H](CN(C)C(=O)OC(C)(C)C)Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1723810150 LRYCHJDTNQAYQB-INIZCTEOSA-N 429.565 4.001 10 10 IICE CC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOCCOC)C1 1727756943 PGNNFUJGNUZLNU-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CO[C@H](CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)OC)C(F)(F)F 1748400799 FTFRESICEOPHIU-GOSISDBHSA-N 437.466 4.318 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(N(C)C)nc1 1750609610 AOLAXONCZSJACT-UHFFFAOYSA-N 433.604 4.147 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCc1cnn(C)n1 1765710190 UCAKJBOETMKULX-UHFFFAOYSA-N 446.603 4.350 10 10 IICE CN(C)c1ccc(Cn2c(N3CCOC4(CCCCC4)C3)nnc2C(C)(C)C)cc1F 1768499178 UXGJSJQNMTVJKH-UHFFFAOYSA-N 429.584 4.369 10 10 IICE COc1cc(N2CCC(NC(=O)c3ccc(C(F)(F)F)cc3)CC2)cc(OC)c1OC 1858044316 NCNXJALKCNBBNG-UHFFFAOYSA-N 438.446 4.130 10 10 IICE CCCC1=NN(Cc2cccc(F)c2)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679626 XAWRPBOUNZAETG-LICLKQGHSA-N 425.416 4.087 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)F 1878709862 JUIBLRAMYVIULV-NVXWUHKLSA-N 429.280 4.149 10 10 IICE O=C(O)C[C@@H](NC(=O)OCc1ccccc1)c1cc(Cl)cc(Br)c1O 1951383708 QMXHWFZFLKWUGV-CQSZACIVSA-N 428.666 4.250 10 10 IICE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCc1c(Br)ccc(OC)c1O 2236054296 HBODBDNQYUFMFK-BBRMVZONSA-N 443.382 4.289 10 10 IICE COc1cc(C=C2C(=O)N(c3ccc(Cl)c(C(=O)O)c3)N=C2C)cc2sc(=O)oc12 2296648909 CWDOAYXEHRQADW-UHFFFAOYSA-N 444.852 4.021 10 10 IICE COc1ccc(-n2c(C)cc(C=C3C(=O)N(C)C(=O)N(c4ccccc4)C3=O)c2C)cc1 2313559874 ACBKTMJHLFFZLM-UHFFFAOYSA-N 429.476 4.111 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)C23CCCC3)c(O)c1Br 2352690672 GZJYXXZHXKCNSM-OAHLLOKOSA-N 425.367 4.485 10 10 IICE CC(=O)N(C(=O)CCCOc1ccc(Br)cc1Cl)c1ccc(N)cc1 243499359 NUNRIVQOQYNSKW-UHFFFAOYSA-N 425.710 4.423 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N2 251331135 IPQSQFWUYLXWDV-AUZXGJTBSA-N 427.526 4.498 10 10 IICE CC[C@H](NCCOCCCNC(=O)OC(C)(C)C)c1cc(Br)ccc1O 698772035 ASYFVXRBRNXQRQ-INIZCTEOSA-N 431.371 4.127 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726567840 QRZKLIBPSLTKTQ-VFNWGFHPSA-N 443.494 4.281 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)c3cnn4ccc(C)nc34)c2C)c1 727929686 BJOZGHJYGGHXMH-UHFFFAOYSA-N 434.521 4.207 10 10 IICE CC(C)(C)OC(=O)N1CCc2cccc(/C=C3\SC(=S)N(CCCC(=O)O)C3=O)c21 757527031 OLPXTYVYEGJUQY-QINSGFPZSA-N 448.566 4.050 10 10 IICE C[C@@H](CCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)NC(=O)OC(C)(C)C 764989454 YSPPEHCPSVKDFE-HOTGVXAUSA-N 441.519 4.066 10 10 IICE O=C(Cc1ccc(C(F)(F)F)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768543372 IJNOPLDPHJWWAL-UHFFFAOYSA-N 431.502 4.096 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H]1c1ccc(I)cc1 779525626 MJUMVVBSWTYHLF-FIRRRZPPSA-N 435.261 4.079 10 10 IICE Cc1nc([C@@H]2CCCOC2)sc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 794238825 NJEACDLODXEQQK-IIDMSEBBSA-N 447.576 4.028 10 10 IICE Cc1cc(C(=O)COC(=O)CCc2nc(-c3ccco3)no2)c(C)n1-c1ccc(F)cc1 900570957 GHZLGKXAUZRRPC-UHFFFAOYSA-N 437.427 4.235 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3ccc(Cn4ccccc4=O)cc3)c2C)cc1 919869275 WIZPXLCBZWUZSW-UHFFFAOYSA-N 441.531 4.243 10 10 IICE CN(C)c1ccc(CNC(=O)c2nn(-c3ccc(Cl)cc3F)c3c2CCC3)cc1F 1125469660 XMCSDXJEKJSNIF-UHFFFAOYSA-N 430.886 4.289 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H]1COc2ccc(Cl)cc2C1 1126582296 LAJRYRNFKJVWSP-WBVHZDCISA-N 436.886 4.278 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H]2CCN(c3ccc(F)cc3)C2=O)c1 1129885705 JURFCHWZRYDESX-OAQYLSRUSA-N 425.891 4.422 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(-c4noc(CC(C)(C)C)n4)cc3)cc2)CC1 1133123839 YTANPHGOWACPAF-UHFFFAOYSA-N 447.583 4.007 10 10 IICE CC[C@H](C(=O)NCc1ccc(N(CC)CC)c(F)c1)n1nnc(-c2ccc(Cl)cc2)n1 1136729779 PPMVVKAPBYLHEI-LJQANCHMSA-N 444.942 4.246 10 10 IICE Cc1cc(CC(=O)NC[C@@H](O)COc2cccc(C(F)(F)F)c2)c(C)n1-c1ccccc1 1137399579 BHQYYQAAWJTRAX-OAQYLSRUSA-N 446.469 4.212 10 10 IICE COc1ccc(-c2n[nH]c(CNC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)n2)cc1 1144800724 IEHVLGNMUIXNHT-UHFFFAOYSA-N 429.524 4.435 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1251430927 VONHMWLDIULEQF-VSKRKVRLSA-N 442.604 4.359 10 10 IICE COc1cccc(CNC(=O)NCC[C@@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)c1O 1254192610 ABFSVGUZQNFXBL-QGZVFWFLSA-N 441.528 4.129 10 10 IICE CCn1c([C@@H]2CCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)nc2ccccc21 1256231657 AJCIXVMDDAGZTP-BJKOFHAPSA-N 448.615 4.272 10 10 IICE Cc1ccsc1Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1289252966 JERBPVBFUKLFFV-UHFFFAOYSA-N 439.629 4.368 10 10 IICE COc1ccc(N2CCCN(C(=O)CCCCCCNC(=O)OC(C)(C)C)CC2)cc1 1291856275 OCPDJOYTXGJREF-UHFFFAOYSA-N 433.593 4.209 10 10 IICE OC1(C(F)(F)F)CCN(c2nnc(C3CCC3)n2CCCSc2nccs2)CC1 1303135780 LUTKPEBDMQMJOD-UHFFFAOYSA-N 447.552 4.078 10 10 IICE COc1cnc([C@H]2CCCN2C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)nc1O 1304660200 JLYPOSDGJTYOTR-GOSISDBHSA-N 426.904 4.229 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C)C(=O)C1 1305276256 DRLQNFXKGZEZFU-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](c3cnn(C)c3)C2)n1Cc1ccc(N(CC)CC)cc1 1305433254 LQASIIAPDMKQFL-TZIWHRDSSA-N 435.620 4.414 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@H]3CCN(c4ccccc4Cl)C3)CC2)cc1 1312993119 SMDQMCLQADVBJA-LJQANCHMSA-N 442.991 4.097 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1C(=O)Nc2ccc(Br)cc21 1350044294 HDUDFCCPELLXJH-LJQANCHMSA-N 444.373 4.378 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccnn1C1CCCC1 1352278648 NHSXRWXAPYZXEO-GHRIWEEISA-N 444.557 4.367 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)c1 1354977000 HKPGMYNMWKRATG-OAQYLSRUSA-N 433.552 4.049 10 10 IICE CCCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1360091082 DGHRAPXDFACNQT-UHFFFAOYSA-N 443.563 4.085 10 10 IICE COc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OCC2CC2)c1 1445889707 ZJMDRHHWVMZBRG-IBGZPJMESA-N 444.959 4.237 10 10 IICE CCOC(=O)Nc1ccc(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)c(Cl)c1 1446417724 HKMSGJQDMDWBCF-UHFFFAOYSA-N 431.920 4.270 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)CCCC1 1456493416 PTWQHQQOPNFVCV-KRWDZBQOSA-N 441.572 4.044 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCN3CCN(c4ccccc4)CC3)c2C)c1 1464043174 QZNPLZGINHPVOC-UHFFFAOYSA-N 430.596 4.263 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@H](c2ccc(Br)cc2)C1 1464419476 NLZJYNMWGRDUKT-INIZCTEOSA-N 434.311 4.289 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@@H]1CSc2ccccc2O1 1467632179 RXBBJXZCUQQSRC-LJQANCHMSA-N 442.581 4.318 10 10 IICE CCN(Cc1nc2c(s1)C[C@H](C)CC2)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1470772339 JRMSQPLPQWZWNR-SJORKVTESA-N 428.602 4.087 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CCCN2CC(F)(F)F)cc1 1471281904 MUHIHTKNDWTJIL-LJQANCHMSA-N 438.494 4.084 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)cc2F)C[C@@H](C)O1 1516816972 OXCOSWDCJXKDOC-GASCZTMLSA-N 449.910 4.250 10 10 IICE Cn1cc(-c2ccc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cc2)cn1 1520922044 DCEDEUIBNCSGGL-UHFFFAOYSA-N 426.467 4.087 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(C(=O)NC4CC4)cc3)cc2Cl)C1 1524703605 MOWPNVJATYJJJH-MRXNPFEDSA-N 425.960 4.399 10 10 IICE COC(=O)[C@H](Cc1ccccc1)[C@H](C)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1525821832 JSGLKJDHFMTROB-PGRDOPGGSA-N 448.563 4.065 10 10 IICE CC1(C)Cc2cccc(OCC(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)c2O1 1533327604 CVBJKPWMIWQQNA-QGZVFWFLSA-N 446.494 4.166 10 10 IICE Cc1ccc(C(C)C)c(OCCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1535345560 DEXOSEILSBBOIA-UHFFFAOYSA-N 432.511 4.319 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(OC(F)F)cc2F)c1 1537587979 RPDDMXVUZBZRHC-UHFFFAOYSA-N 443.425 4.171 10 10 IICE COc1cc(C(=O)N2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)ccc1C 1542066571 FDICVYFVBPUQJM-UHFFFAOYSA-N 445.563 4.318 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1 1542885738 HEPHCCMSXNLCKO-XMMPIXPASA-N 430.504 4.255 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc2ccc(C(F)(F)F)cc2nc1O 1543099367 YNXBRXQUGGNPIA-UHFFFAOYSA-N 447.482 4.442 10 10 IICE Cc1ccc(N2CCC[C@@H](NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2=O)cc1 1544851008 JRSZLEYKPSAIOP-XMMPIXPASA-N 429.520 4.140 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3ccn(C)n3)C2)c(C)n1-c1ccc(Br)cn1 1558411731 JEKSYSFDJXINSE-INIZCTEOSA-N 442.361 4.005 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCc1cccc(OCC(F)(F)F)c1 1564629209 VUCULFUDZLZJNE-QGZVFWFLSA-N 437.506 4.475 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCN(Cc2ccc(F)cc2)CC1 1564944988 CUIRJQZZYFZRIU-HXUWFJFHSA-N 426.580 4.049 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CN(C)C[C@H]1c1ccccc1 1565429604 XRHINNMEXBXQBO-QUCCMNQESA-N 446.389 4.032 10 10 IICE Cc1c(N[C@H](C)C(C)C)cccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1570168012 DYZIYKGJSCFYBG-QGZVFWFLSA-N 431.527 4.496 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1CC[C@@H](Nc2ccccn2)CC1 1584357057 WFCODAGZDBHYKC-HDICACEKSA-N 444.526 4.439 10 10 IICE CN(c1ccc(CNC(=O)C(C)(C)N2C(=O)c3ccccc3C2=O)cc1)C1CCCCC1 1597950077 HTWBFPNHBUTTNE-UHFFFAOYSA-N 433.552 4.147 10 10 IICE CC(C)c1nnc(N2CCC(Cn3cccn3)CC2)n1CCCSc1nccs1 1598581101 HXIFWJBKKRTPLQ-UHFFFAOYSA-N 431.635 4.154 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1613663649 IHFRAJMKNGYCAG-OAQYLSRUSA-N 437.588 4.129 10 10 IICE CCc1nnc(N2CCC(C(=O)C(F)(F)F)CC2)n1Cc1ccc(N(CC)CC)cc1 1613954914 ULZVGCCEVMGAMC-UHFFFAOYSA-N 437.510 4.083 10 10 IICE CCS[C@@H]1CCCCN(c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)C1 1617500110 MGWMDCYGCVZVHY-OAQYLSRUSA-N 431.675 4.300 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1nn(C)c(C(F)(F)F)c1Br 1617879933 PZWDBCXEYRJKDL-UHFFFAOYSA-N 434.256 4.350 10 10 IICE CNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H]1C 1618500423 NXLMTYVVWKXALC-KRWDZBQOSA-N 434.588 4.114 10 10 IICE CN(C)[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(Cl)c1 1630257157 PWFQJBBTYLXZPB-FPOVZHCZSA-N 436.383 4.083 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H]1CSCCN1Cc1ccccc1 1633975584 ISGXGEOMNAESKZ-HSZRJFAPSA-N 447.604 4.254 10 10 IICE COc1ccccc1[C@](N)(C(=O)NCc1cc(C)n(-c2ccccc2)c1C)C(F)(F)F 1638983030 CBZMHQKXNCBUDC-QFIPXVFZSA-N 431.458 4.135 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3cc(Br)cc(F)c3C2)c([N+](=O)[O-])c1 1642505806 KGHIHZZFRLYCKM-HYXAFXHYSA-N 435.249 4.245 10 10 IICE CCCCN(Cc1csc(CN2C(=O)c3ccccc3C2=O)n1)Cc1ccccc1O 1642886742 NXNWCMDDUMNROK-UHFFFAOYSA-N 435.549 4.447 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3nnc4c(Cl)cccc4c3=O)c2C)c1 1644025969 UUIBINZTDXNMES-UHFFFAOYSA-N 438.940 4.457 10 10 IICE Cc1cc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)ccc1N1CCCCC1 1644876141 HZMQCOVZVVRURX-OAQYLSRUSA-N 438.591 4.269 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1ccc(C(N)=O)nc1 1648493223 AYUASLMBAVJDFD-SFHVURJKSA-N 442.441 4.106 10 10 IICE C[C@@]1(C2CCCCC2)CCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1650836854 XZMHKBJBPUZDGI-NRFANRHFSA-N 434.583 4.439 10 10 IICE Brc1cc(CN2CCN(Cc3cscn3)CC2)ccc1N1CCCCC1 1658452821 KHKABWOOXGXLKR-UHFFFAOYSA-N 435.435 4.214 10 10 IICE C[C@H](NC(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)c1ccccc1)c1ccc(N(C)C)cc1 1671845299 YNAZTTKIPNMOJO-CPJSRVTESA-N 444.579 4.387 10 10 IICE COc1cccc([C@H](C)N2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1683253213 DZDGJCLFCIDIJX-RTWAWAEBSA-N 438.616 4.089 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Cc2cccc(F)c2F)CC1 1687155265 JENHZSRZOVTSJG-UHFFFAOYSA-N 443.538 4.090 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1707973667 VTLXIIKMYIDNIG-ZRCGQRJVSA-N 441.620 4.230 10 10 IICE COCC1(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCCCC1 1712202911 XPNPOPYPOCYJNT-HXUWFJFHSA-N 428.577 4.111 10 10 IICE CCN(Cc1cccs1)c1nnc(-c2cnccn2)n1Cc1ccc(N(C)C)cc1C 1765093335 CEORCOVKBVVHBY-UHFFFAOYSA-N 433.585 4.246 10 10 IICE O=C(Nc1ccc(Cl)cc1C(=O)O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O 1857608294 NJLJERSUNSGYJE-UHFFFAOYSA-N 448.862 4.129 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(C)n4cc(-c5ccccc5)ccc34)CC2)cc1 1858205267 RQHJKBMDGYADKT-UHFFFAOYSA-N 426.520 4.281 10 10 IICE CC[C@H](C)NC(=O)CCn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@@H]21 1860344777 FRQWZLINBHMOCN-SSOJOUAXSA-N 430.552 4.093 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCN(c2ccc(N)c3c2CCN(C(=O)OC(C)(C)C)C3)C1 2044630308 DLHJEWXAGQLILY-MRXNPFEDSA-N 446.592 4.056 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3cccc(Br)c3O)CCC[C@@H]12 2087283119 VBQQKEBABXIVNR-UZLBHIALSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@]21CNCc1ccc(Br)cc1O 2089363626 VRUXHRNBFICGKS-QRWLVFNGSA-N 425.367 4.424 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CCC(=O)Nc3cccc(OC)c3)C2=O)cc1 2296882421 UMSRRDXDACYOMJ-UHFFFAOYSA-N 442.562 4.324 10 10 IICE Cc1ccc(NC(=O)CCN2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)cc1 2314827566 HQXRYXWUUWRLBH-UHFFFAOYSA-N 427.507 4.133 10 10 IICE CC[C@@H](NC[C@H]1[C@@H]2C[C@@H]2CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2332566808 DUSZTTAQKKNCFD-WNOSKKOXSA-N 425.367 4.451 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2C[C@@H](C)N(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380756403 KVXGVNREBFIGCR-KGLIPLIRSA-N 441.366 4.115 10 10 IICE CCOc1ccc(-n2cccc2/C=C2\C(=N)N3N=C(c4ccco4)SC3=NC2=O)cc1 20210691 UWHALSUGFQSROZ-SLWLXCFBSA-N 431.477 4.136 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)COC(c1ccccc1)c1ccccc1 24192826 GZYTZTLWXUNWNZ-UHFFFAOYSA-N 430.548 4.288 10 10 IICE Cc1cccn2c(=O)c(/C=C3/SC(=S)N(CCc4ccccc4)C3=O)c(Cl)nc12 33932250 IEAZILZEGJBHQJ-FOWTUZBSSA-N 441.965 4.100 10 10 IICE COc1ccc(N2CCN(c3cc(C(F)(F)F)nc(-c4ccccn4)n3)CC2)cc1F 301590812 XWOYLLMHQVTKTI-UHFFFAOYSA-N 433.409 4.032 10 10 IICE C[C@H](NCc1cccc(COC2CCOCC2)c1)c1ccc(N2CCOCC2)c(F)c1 765932095 RIWMJUKIBLCDDU-IBGZPJMESA-N 428.548 4.209 10 10 IICE CCN(Cc1cc(OC)c(OC)cc1O)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 768444561 AJTLVAQLXCNVRT-UHFFFAOYSA-N 428.577 4.122 10 10 IICE COc1cnccc1[C@H](C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 783867520 JGMYRQDJQYNTSK-HNEYUBDGSA-N 447.607 4.011 10 10 IICE COc1cc(C)cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1C 787660686 IDISQBDYVZUFJN-UHFFFAOYSA-N 432.523 4.132 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@@H]([C@@H]2CCCOC2)C(F)(F)F)C1 789646433 OVJQMBIBBLHRRY-ZHRRBRCNSA-N 438.490 4.309 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)CCO1 802691249 DEWVGWYGDLZUAD-YADHBBJMSA-N 435.572 4.147 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCCC[C@H]2c2nnc([C@H]3CCCO3)o2)c1O 808239783 MRAIFXUBPODVSA-VQTJNVASSA-N 437.496 4.294 10 10 IICE CCc1ccc([C@@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 822074031 RZQHQQGRCWRVOY-CQSZACIVSA-N 428.444 4.424 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C(\C)c3cccc(Cl)c3)CC2)cc1 1124515823 HGKNMKFGGFGPJF-HTXNQAPBSA-N 427.976 4.080 10 10 IICE Cc1cc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1cccc(Cl)c1 1135718036 JDZSTXULAKWFHV-QHCPKHFHSA-N 437.971 4.378 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Cl)cc2ccc(C)nc12 1152401075 JVUNDEIMDXQDOP-UHFFFAOYSA-N 433.291 4.371 10 10 IICE Cc1cc(C(=O)NC2CCC(C)(N3CCC3)CC2)c(C)n1-c1ccc(Br)cn1 1158107927 BNVAPMWCRCUBRN-UHFFFAOYSA-N 445.405 4.388 10 10 IICE C[C@@H](NC(=O)[C@@H]1CCc2cc(Br)ccc21)c1ccc(N2CCOCC2)cc1 1264822417 QEDYRHODKRNNFX-QVKFZJNVSA-N 429.358 4.193 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccccc3CNC(=O)OC(C)(C)C)CC2)cc1 1264934008 UGNDSUWKRNXMNA-UHFFFAOYSA-N 439.556 4.119 10 10 IICE C[C@@H]1COCC[C@@H]1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1291300016 HPSCJGBMWJBSCX-TZIWHRDSSA-N 425.621 4.485 10 10 IICE CC[C@@H](C)c1nnc(N2CCSC[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1291682214 PCKHPMLVWHVDPK-QZTJIDSGSA-N 431.675 4.335 10 10 IICE COC(=O)c1ccc(C)c(NC(=O)CN(CCc2ccccc2)c2ccc(OC)cc2)c1 1307555564 MTEIXPYSDJUQME-UHFFFAOYSA-N 432.520 4.478 10 10 IICE CCN(CC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)c1ccc(OC)c(OC)c1 1307575029 UJJYDDFPZFQSDG-OAQYLSRUSA-N 445.991 4.137 10 10 IICE CCSCCCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1314616330 AZHJXFPRVCBXRV-UHFFFAOYSA-N 445.677 4.483 10 10 IICE Cc1cccc([C@@H](CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)N2CCOCC2)c1 1350300779 AYKNZLWPASSZEO-AREMUKBSSA-N 431.580 4.135 10 10 IICE COCCSc1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1353912450 ZWCDFQPIMLGLAD-UHFFFAOYSA-N 429.542 4.206 10 10 IICE C[C@H](NC(=O)[C@H]1C[C@@]1(C)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 1357927979 LEKJCIBGABGOQZ-YTJPUZGESA-N 443.385 4.441 10 10 IICE Cc1cccc(CCNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1434983102 GWNZKTLFUIJDCE-RGEXLXHISA-N 428.554 4.084 10 10 IICE Nc1c(I)cccc1C(=O)N(Cc1ccco1)Cc1ccccc1O 1445639414 WAUNFRZBIKVLRE-UHFFFAOYSA-N 448.260 4.015 10 10 IICE COC(=O)C(C)(C)c1csc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)n1 1450105877 CVDLMSFVXFDEAH-UHFFFAOYSA-N 425.510 4.066 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(N2C(=O)CCCC2=O)cc1 1464162387 ISWOYQZHONPCSB-UHFFFAOYSA-N 429.476 4.202 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(Cl)cc4Cl)c3)CC2)cc1F 1465930628 ZADKJDYYMDXNCZ-UHFFFAOYSA-N 449.313 4.289 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@@H](O)C(F)(F)F 1466536735 OUCLQDCRPVOXJS-GOEBONIOSA-N 433.268 4.288 10 10 IICE O=C(COc1ccccc1F)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1538918914 IJFOPFFCJMFKGP-UHFFFAOYSA-N 441.260 4.315 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1 1544094201 OTPIHYLBBNGVPU-QJOMJCCJSA-N 442.523 4.046 10 10 IICE CC[C@H](C)c1nnc(N(C)CC(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1545321715 SXKYHTLAGURVGQ-FQEVSTJZSA-N 440.636 4.037 10 10 IICE CC(C)(C)OC(=O)NCc1cc(NC(=O)c2cccc(O)c2O)cc(C(F)(F)F)c1 1556394702 ZGCSIIWGKHKJIW-UHFFFAOYSA-N 426.391 4.394 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(C(F)(F)F)cc1O 1595582937 HGDHKSRWYGRFHM-HNNXBMFYSA-N 428.838 4.164 10 10 IICE C[C@]1(C(F)(F)F)CCN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)C1 1597098519 CIONALUZSQGPTF-BLSFAOBESA-N 446.491 4.218 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2[nH]c3c(c2c1)CCCC3 1597567278 IGCWUEFPOUPFEM-UHFFFAOYSA-N 426.900 4.221 10 10 IICE CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c1 1598277031 JOWAGFXJDLGSBT-UHFFFAOYSA-N 442.991 4.006 10 10 IICE CC[C@H](Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1613636902 OBWQDDJKDOKBNJ-FGZHOGPDSA-N 427.593 4.181 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)N(C)Cc3ccc(N(CC)CC)cc3)cc2)c1C 1623452180 UNBYTUQYEQJPFY-UHFFFAOYSA-N 448.567 4.476 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)[C@@H](C)c3ccc(S(N)(=O)=O)cc3)c2C)c1 1624475310 BKAWNRKCDXMBKL-SFHVURJKSA-N 439.581 4.192 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C(=O)/C=C/c2ccc(Cl)nc2)C1 1624671163 SYOJLLIKTFIXOL-QXLXQBSBSA-N 427.932 4.478 10 10 IICE CC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(C)cc1 1627559585 ZAYSMAGCDAEYAG-SFHVURJKSA-N 430.551 4.444 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(Cc2ccc(O)c(Cl)c2)CC1 1631315273 KVVVBQRYSURYGE-UHFFFAOYSA-N 429.973 4.473 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3CCCN(C(=O)Cc4ccccc4)C3)c2C)cc1 1634855536 UQQMBTHALFMVOL-JOCHJYFZSA-N 445.563 4.066 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 1636240000 VUGBAZANRYIYNW-VQTJNVASSA-N 432.609 4.366 10 10 IICE CCOC(=O)CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)Cc1ccccc1O 1643519475 UUTUJRLETOFYDB-UHFFFAOYSA-N 444.837 4.068 10 10 IICE COCCN(Cc1cc([N+](=O)[O-])ccc1Br)c1ccc(OC)c(OC)c1 1652711011 AWVMLNSCCNCKDR-UHFFFAOYSA-N 425.279 4.028 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)COc1c(F)cccc1F 1682621360 OVFMWPKCXMFRNF-GFCCVEGCSA-N 443.288 4.432 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H](CNC(=O)OC(C)(C)C)[C@@H](C)C1 1683426073 UUAPJDVMVRLXIJ-IRFCIJBXSA-N 446.636 4.184 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NC[C@@H]2CCC(C)(C)CN2C(=O)OC(C)(C)C)c1 1684682560 UOYJDMMWDYFJNO-HOTGVXAUSA-N 435.565 4.187 10 10 IICE CCc1nnc(N2CCC[C@@H](CN3CCCC[C@H]3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1694712248 XCXKBLJKYGLODW-CTNGQTDRSA-N 442.627 4.185 10 10 IICE CCN1CCCC[C@@H]1Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695846313 AZMYJCXJVXCEFZ-JOCHJYFZSA-N 440.636 4.001 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCO[C@](C)(CC)C2)cc1 1710027942 MRQDVFMAGVYHNR-ZJSXRUAMSA-N 427.593 4.029 10 10 IICE C[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1726566056 ICAWZFLQOIDXPV-HXUWFJFHSA-N 439.648 4.360 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C[C@@H](C)S1 1726706815 LHUWSENFSNPDGV-IYBDPMFKSA-N 446.671 4.233 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1763606594 JTZBDXAPGKXAQZ-FXAWDEMLSA-N 429.584 4.298 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NC(C)C 1766776910 MGPFETYANSZRJT-UHFFFAOYSA-N 434.588 4.114 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CCC(C)(F)F)CC2)cc1F 1768704795 OFHAKWZMDCHNFP-UHFFFAOYSA-N 439.526 4.386 10 10 IICE Cc1c(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c(=O)oc2ccc(F)cc12 1859707255 MPJFXMAHNVJXCY-UHFFFAOYSA-N 427.387 4.268 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ccc(OC)cc2)sc(C)c1-c1ccccc1 1860747829 XIQSGHIJCKHXRR-UHFFFAOYSA-N 438.505 4.486 10 10 IICE CC(C)(C)OC(=O)N1C[C@]2(F)CCC[C@@]2(NCc2c(O)cccc2Br)C1 2126044965 BGBLFFDCARFZKL-RTBURBONSA-N 429.330 4.126 10 10 IICE Cc1cc(O)cc(C)c1NS(=O)(=O)c1cc(Br)sc1Br 2239723935 DVMCKQWJUAHSEC-UHFFFAOYSA-N 441.166 4.396 10 10 IICE Cc1cc(N2CCOCC2)ccc1C=C1NC(=O)N(Cc2ccc(Cl)c(Cl)c2)C1=O 2297365104 PUHWKVXKOKFASV-UHFFFAOYSA-N 446.334 4.231 10 10 IICE COc1ccc2[nH]c(=NC=C3C(=O)N(c4ccc(Br)cc4)N=C3C)sc2c1 2297708940 HRFGKOOQOAUPRX-UHFFFAOYSA-N 443.326 4.208 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3F)C2=O)ccc1OCC(=O)O 2314932544 NQXWGYPMAVKYRE-UHFFFAOYSA-N 433.482 4.094 10 10 IICE CC(C)C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(Br)cc2F)SC1=S 2323812991 MSUMLZKUNSXYGU-GFCCVEGCSA-N 432.336 4.289 10 10 IICE CCCC[C@H](C(=O)O)N1C(=O)C(=Cc2c(Cl)nc3scc(C)n23)SC1=S 2323814116 OXWCSOIXGRUGCA-SECBINFHSA-N 429.976 4.202 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CNCc2cc(Br)cc(F)c2O)C2(CC2)C1 2336286869 HDYDNNMNELKMTO-ZDUSSCGKSA-N 429.330 4.031 10 10 IICE COCCNC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1Cl 108732251 DRWJUIRQAOXWFI-UHFFFAOYSA-N 425.916 4.376 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)c2ccc([S@](C)=O)cc2)C1 435917197 LOAZIMGHPQRXHJ-OKXSDPAFSA-N 437.609 4.023 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](CNCc2ccc(Br)cc2O)C1 717068759 SBBJBZASGOKTKI-ZDUSSCGKSA-N 435.309 4.137 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@@H](c1ccccc1)[C@H]1CCOC1 772458957 GNINDRHMZQLQOL-AVRDEDQJSA-N 445.510 4.334 10 10 IICE CCOC(=O)c1csc(CCN[C@@H](C)c2cc(Br)cc(Cl)c2O)n1 786950332 NYDOIMMTBWXRLW-VIFPVBQESA-N 433.755 4.335 10 10 IICE Cc1ccc(N2CCOCC2)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 797599062 FNKDZXSJYVEKQR-UHFFFAOYSA-N 446.595 4.192 10 10 IICE C[C@@H]1COCC[C@H]1c1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 799672409 YIIAVJBRGKYUPE-XBGOXGAMSA-N 435.596 4.105 10 10 IICE Cc1cc(-c2nnc(N(CCCCO)C3CC3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 812273616 FNBCXEUFISLDPW-HSZRJFAPSA-N 449.599 4.273 10 10 IICE Cc1cc(C(=O)COC(=O)c2csc(-c3ncccn3)n2)c(C)n1-c1ccc(F)cc1 920530442 URKWTJSUDMZPQO-UHFFFAOYSA-N 436.468 4.186 10 10 IICE C=Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1129246114 LDZQGTFRXLEWMW-HMMYKYKNSA-N 440.565 4.419 10 10 IICE O=C(CCNC(=O)c1cc2cc(O)c(O)cc2s1)Nc1cc(Cl)cc(Cl)c1 1141537575 ACXSSQXHLCJGIL-UHFFFAOYSA-N 425.293 4.378 10 10 IICE CCN(CC)c1ccc(CNC(=O)C[C@H]2C(=O)Nc3ccc(Br)cc32)cc1F 1144985369 LKLUQXNNFDUCSK-MRXNPFEDSA-N 448.336 4.177 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1cccc(OC)c1 1147443562 TYUHGDKNEBNOHA-NRFANRHFSA-N 426.900 4.400 10 10 IICE Cc1nc(C2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)NCc1ccccc1O 1150536657 QTRORLRVMKKUMY-UHFFFAOYSA-N 431.558 4.202 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)CC(C)C 1156427888 ITLTWIPKLQOZIH-SANMLTNESA-N 441.616 4.140 10 10 IICE CN1CCC[C@@H](c2cccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)c2)C1 1182262156 SAJNCAXWZNYBBO-RSXGOPAZSA-N 435.612 4.383 10 10 IICE CN(C)c1ccc([C@@H](CNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)N(C)C)cc1 1187832690 KZWCVKWCBXPEOU-GOSISDBHSA-N 430.478 4.338 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)CCCCc3ccc(Cl)cc3)cc2)C1 1264736976 JSJZYOXGHOLKFE-FQEVSTJZSA-N 427.976 4.071 10 10 IICE Cc1c(C(=O)NCc2ccc(N(C)C)c(F)c2)nnn1-c1ccc(-c2ccccc2)cc1 1264827080 NVAVFCQYXBRIEJ-UHFFFAOYSA-N 429.499 4.378 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N(C)c1ccc(OCC(=O)OC)cc1 1268949335 ZLCMXEMUXJGUTP-NTEUORMPSA-N 434.492 4.252 10 10 IICE O=C(CN(C(=O)c1ccccc1)c1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1295404984 CWHILWLPXSVIHO-DEOSSOPVSA-N 444.531 4.247 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CC4)n3CCSC(F)(F)F)CC2)cc1 1300247276 KNBAKLDNQSOBCS-UHFFFAOYSA-N 441.523 4.134 10 10 IICE CCn1c(-c2ccc(Br)cc2)cnc1SCC(=O)C(C)(C)C(=O)OC 1307274528 PKCRWXBSDCMXAU-UHFFFAOYSA-N 425.348 4.193 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CC[C@H](C(F)(F)F)[C@H]1C 1307734524 PISDBCBECIXGJO-XNJGSVPQSA-N 430.426 4.062 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccccc3NC(=O)c3ccccc3)CC2)cc1 1319615310 PVFKGDHUVXEZLV-UHFFFAOYSA-N 429.520 4.300 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)COc1ccc2ccccc2c1Br 1361101876 FRUZMYGPCXUEFZ-UHFFFAOYSA-N 441.325 4.473 10 10 IICE CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1459990490 RFPZPOXXMFDPBT-NPFVIJTESA-N 448.563 4.362 10 10 IICE Cc1cc(F)c2c(c1)N(C(=O)OC(C)(C)C)[C@@H](C(=O)NCc1ccc(N(C)C)cc1C)C2 1465029378 KGMNWRUBGGBYGA-JOCHJYFZSA-N 441.547 4.491 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc2Cl)C1 1469960022 NBPYBAVKHDXUGA-INIZCTEOSA-N 445.951 4.396 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCC3(CCOCC3)O2)c(C)n1-c1ccc(Br)cc1 1472174524 XKKPMYOXBAJNJZ-IBGZPJMESA-N 447.373 4.315 10 10 IICE CCCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1514838859 KNBOPCVAGAOPHN-WIYYLYMNSA-N 445.583 4.081 10 10 IICE O=C(CCCc1cc(F)ccc1F)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015132 FPTPTKOUVQTKKY-UHFFFAOYSA-N 427.539 4.136 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(Cc2ccccc2)[C@H](C)CN2CCOCC2)cc1 1528022203 XCOIJKGKNLRBKX-HSZRJFAPSA-N 431.580 4.457 10 10 IICE COc1ccc2c(c1)OC[C@@H](C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)C2 1530426866 WQHXDXXGTIBGRP-APWZRJJASA-N 428.960 4.452 10 10 IICE CC[C@@](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)(C(=O)OC)c1ccccc1 1532316413 RIEJKGYOUFVTJK-MHZLTWQESA-N 447.579 4.003 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccn(-c2c(F)cccc2F)n1 1533328784 KXQUWCDXSLHCEE-AWEZNQCLSA-N 448.420 4.151 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2csc(-c3c(F)cccc3F)n2)N(C)C)cc1 1537482539 GKTZCRJPZHJZLH-LJQANCHMSA-N 430.524 4.187 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1544633489 VNGILJKVYJMYHF-GOSISDBHSA-N 429.634 4.007 10 10 IICE CCN(CCCN1CCN(c2ccccc2)CC1)Cc1cc(Br)ccc1O 1559568915 JMOWPTFYAOXGNQ-UHFFFAOYSA-N 432.406 4.189 10 10 IICE Cc1ccc(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1566174920 SIHTWPRZGGQGJY-UHFFFAOYSA-N 427.545 4.248 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1CC(OCc2ccccc2)C1 1566356273 ARHGBEZRNSOVQO-QUENFVSXSA-N 428.960 4.122 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2c2cc[nH]n2)c(C)n1-c1ccc(Br)cn1 1568900441 CNIKCUJUHKQCSF-GOSISDBHSA-N 428.334 4.342 10 10 IICE Cc1cccc2c1C[C@@H](C(=O)NCc1ccc3c(c1)CCCN3C)N2C(=O)OC(C)(C)C 1583628584 ZGQWSFAQECTCOB-QHCPKHFHSA-N 435.568 4.360 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3[C@H](C(=O)OC)CC[C@H]3c3ccccc3)ccc21 1586306422 JEIMYIOLAJHROM-UPVQGACJSA-N 434.536 4.423 10 10 IICE Cc1cc(C(=O)N[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c(C)n1-c1ccc(F)cc1 1587064148 RNAKAWXANMHZPN-QFIPXVFZSA-N 447.432 4.383 10 10 IICE CC(C)=CCCn1c(C(=O)N2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1597846813 FXAUGCQDLMCRER-UHFFFAOYSA-N 436.604 4.107 10 10 IICE COc1cc(N2CCC(C(=O)N(Cc3ccccc3)C3CC3)CC2)c([N+](=O)[O-])cc1OC 1612020880 XNUOUIQQTGFKHY-UHFFFAOYSA-N 439.512 4.020 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](C)N3CCN(c4ccccc4)CC3)c2C)c1 1624671901 FYNRQZXUKORBRO-QFIPXVFZSA-N 430.596 4.343 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(NCc2ccsc2)cc1 1625090490 SMDHMWIGZPXASI-UHFFFAOYSA-N 425.529 4.266 10 10 IICE Cc1cnc(F)c(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1627271808 HZWKKGCGHBPPOJ-UHFFFAOYSA-N 426.249 4.254 10 10 IICE Cc1cc(CC(=O)Nc2ccc(N3CCN(C)CC3)nc2)c(C)n1-c1ccc(Cl)cc1 1629233638 NDCVCJFIMOVZEN-UHFFFAOYSA-N 437.975 4.076 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(F)c(Cl)c2)NC(=O)OC(C)(C)C)cc1 1634161648 AXPPKKHZHAROBQ-HXUWFJFHSA-N 449.954 4.470 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccc(O)c4)CC3)cc2Cl)C1 1634719623 AYZMEBZORKCACW-SFHVURJKSA-N 442.991 4.314 10 10 IICE C[C@H](Cc1ccccc1)n1cccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1637549582 HBZRXJBLGWCJEI-GOSISDBHSA-N 439.506 4.337 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N(CC(=O)OCC)Cc1ccccc1O 1639584982 JHFAWDFJIZXVJT-BUHFOSPRSA-N 448.519 4.334 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3ccc([N+](=O)[O-])cc3OC)c2C)cc1 1640895055 PNFMAJAHXIOLNO-UHFFFAOYSA-N 438.436 4.059 10 10 IICE Cc1nc(CCC(=O)NCc2cc(O)ccc2O)oc1-c1ccc(Br)cc1 1651222771 PCCNFTPOMXTULL-UHFFFAOYSA-N 431.286 4.073 10 10 IICE Cc1cc(C(=O)Cn2nnc(-c3ccsc3)n2)c(C)n1-c1cccc(Br)c1 1651708677 MDZLKVUAGSHETA-UHFFFAOYSA-N 442.342 4.455 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(CCc1ccccc1)C1CCCC1 1681849824 KKEZAUGZDSCAMK-UHFFFAOYSA-N 443.538 4.498 10 10 IICE Cc1cc(CNC(=O)N(C)C[C@H]2CN(c3ccccc3)C(=O)O2)c(C)n1-c1ccccc1 1683307619 LXEZRVNFBYVQDS-QHCPKHFHSA-N 432.524 4.261 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC[C@H](OCC3CC3)c3ccc(Cl)cc3)C2)cc1 1686425917 LZICIAZMSPFSMV-OFNKIYASSA-N 443.975 4.394 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1749981397 GWEWDUCSLSSHPN-UGKGYDQZSA-N 429.609 4.050 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(C(C)C)n2Cc2ccc(N(C)C)c(F)c2)C12CCC2 1767670333 MUNRDGNLBOGGNH-RTWAWAEBSA-N 429.584 4.439 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1CCc1csc(C(C)(C)C)n1 1768681838 OGGKWEQZPWNREK-KRWDZBQOSA-N 441.601 4.121 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3ccccc3F)N=C2c2ccccc2)cc(OC)c1O 1865680140 ZMSMWDOCWLUWDM-UNOMPAQXSA-N 432.451 4.379 10 10 IICE CC(C)(c1ccc(O)c(O)c1)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1952542444 DAJZBIUNHKXVDM-HSZRJFAPSA-N 447.487 4.367 10 10 IICE COCCNCc1ccc(N(C)[C@@H]2CC[C@H]2OCc2ccccc2)c(Br)c1 2156439602 XNIGBJLNVXXOKK-FGZHOGPDSA-N 433.390 4.369 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](CC(=O)O)c3ccccc3)C2=O)ccc1O 2296879842 FUYUHFVXJGBQGB-OAHLLOKOSA-N 429.519 4.208 10 10 IICE COc1cc(C=C2C(=N)N3N=C(C45CC6CC(CC(C6)C4)C5)SC3=NC2=O)ccc1O 2297555703 MPSLUNHOTNFKEK-UHFFFAOYSA-N 436.537 4.236 10 10 IICE CCOC(=O)[C@H](C)N1C(=O)C(=Cc2ccccc2OCc2ccccc2)SC1=S 2314741393 YOPBWTIOOBQSRC-HNNXBMFYSA-N 427.547 4.418 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccccc3)C2=O)cc1OC)C(=O)O 2314932081 KDXNWMHHDDUEPQ-OAHLLOKOSA-N 429.519 4.343 10 10 IICE Cc1ccc(CN[C@H]2CSC3(C2)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352687604 PWVGHFBYIZAFMW-CQSZACIVSA-N 443.407 4.048 10 10 IICE COC(=O)c1ccc(N2NC(=O)/C(=C\c3ccc(-c4ccc(C)c(Cl)c4)o3)C2=O)cc1 666828 RIBMFHVFWMGODT-LDADJPATSA-N 436.851 4.156 10 10 IICE C[C@@H]1CCc2c(sc(NC(=O)c3ccc(C(=O)C(=O)c4ccccc4)cc3)c2C(N)=O)C1 1940147 IDRHGVPRECCIKI-CQSZACIVSA-N 446.528 4.290 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S)N1CCCC1 33413982 UUBGRMFJYFMBEH-NTCAYCPXSA-N 439.400 4.053 10 10 IICE COc1ccccc1OCCn1cccc1/C=C1\C(=O)N(c2ccc(F)cc2)C(=O)N=C1O 33829162 AAGLWBDOJYRFCH-CYVLTUHYSA-N 449.438 4.222 10 10 IICE COCCOC(=O)c1ccc(N[C@@H](c2cccnc2)c2ccc3cccnc3c2O)cc1 54620236 ZSQDCTLGYARMOY-QFIPXVFZSA-N 429.476 4.340 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4noc(-c5ccccc5)n4)s3)CC2)cc1 65063014 OCJJOVZAKHWLMS-UHFFFAOYSA-N 446.532 4.436 10 10 IICE Cc1cc(C(=O)N2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c(C)n1-c1ccccc1F 106281533 XMOXEAYDWNIART-QGZVFWFLSA-N 425.548 4.344 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)Nc2cc(C(=O)N3CCCCCC3)ccc2OC)c1 729039626 OGAIYFZQGWATDM-INIZCTEOSA-N 441.528 4.308 10 10 IICE CS(=O)(=O)c1ccc([C@H](O)CN2CCCc3cc(OCc4ccccc4)ccc32)cc1 734485527 LTXQIVZZLZPJGK-RUZDIDTESA-N 437.561 4.155 10 10 IICE COc1ccc(Nc2ccccc2C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1 739767149 WCTISECLEFJPPB-UHFFFAOYSA-N 444.535 4.393 10 10 IICE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 761860768 KDKRTILDOFXHSE-UHFFFAOYSA-N 445.567 4.061 10 10 IICE COc1ccc(N2CCC(NC(=O)Nc3nnc(/C=C/c4ccco4)s3)CC2)cc1 763999015 CQMQCBVZNSBJKF-CMDGGOBGSA-N 425.514 4.101 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cccc(COC4CCOCC4)c3)c2)CC1 767384059 YECCDEFNGWQYTD-UHFFFAOYSA-N 437.584 4.165 10 10 IICE C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1Cl 773062216 BMPLWXNWISTZOW-VLIAUNLRSA-N 439.781 4.323 10 10 IICE CC1(C)CN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC2(CCCC2)O1 785871031 GDRQPSIDRXRPHY-UHFFFAOYSA-N 437.531 4.390 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C(/C)c3ccccc3C(F)(F)F)cc2)CC1 786258930 INZQKVPJZQDOFJ-ICFOKQHNSA-N 445.485 4.094 10 10 IICE C[C@H]1CN(c2ccc(CN3C(=O)[C@@H]4CC[C@@H](c5ccccc5)N4C3=O)cc2F)C[C@H](C)O1 797133615 BRSZCHGJSMRVJJ-PUEVPBCXSA-N 437.515 4.107 10 10 IICE O=C(NCc1nc(-c2ccccc2F)cs1)NCc1cc(Br)ccc1O 805386948 OYHIGGDFMHEDTH-UHFFFAOYSA-N 436.306 4.417 10 10 IICE O=C(NCc1cc(Br)ccc1O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F 805429486 FLMAYPSFKKDLEY-KGLIPLIRSA-N 427.245 4.111 10 10 IICE CC1CCN(C(=O)c2ccc(NC(=O)NCc3cc(Br)ccc3O)cc2)CC1 806224264 BTEMLWVLCOVHJD-UHFFFAOYSA-N 446.345 4.349 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@@H](C(=O)Nc4cccc(C)n4)C3)c2C)cc1 919848669 WAURJHMXBCEYDB-HXUWFJFHSA-N 446.551 4.297 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C\Sc3cc(F)ccc3F)cc2F)CC1 1125907923 PGQCEGXQYPLLEU-GHXNOFRVSA-N 435.515 4.168 10 10 IICE COC(=O)c1ccc(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1OC 1127164969 HFDXCVQLGLHEPZ-UHFFFAOYSA-N 440.927 4.402 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 1127189066 FHARTIVCVYQYDA-MDWZMJQESA-N 431.536 4.394 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccccc3S(=O)(=O)C(F)(F)F)cc2)CC1 1136705585 SKGJPSIRDDNQBI-UHFFFAOYSA-N 440.487 4.146 10 10 IICE COC(=O)c1n[nH]c2ccc(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)cc12 1141452578 RBJBEQPZNAGVPU-UHFFFAOYSA-N 430.464 4.130 10 10 IICE C[C@@H](CC(=O)NCc1ccc2cccnc2c1O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1142728664 ZKMQTKBABFAHCX-LPHOPBHVSA-N 427.545 4.230 10 10 IICE C[C@@]1(Cc2ccc(I)cc2)CCCN1C(=O)c1cc(O)cs1 1157749474 CIKFNWHSDQAJOP-KRWDZBQOSA-N 427.307 4.296 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCC(=O)Nc3nnc(C(C)C)s3)c2C)c1 1170857030 FKKFSTHSABHZLL-UHFFFAOYSA-N 439.585 4.413 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(c4cccc(F)c4F)CC3)C2)cc1 1230301226 UPDOPMQHGGNCFR-KRWDZBQOSA-N 429.511 4.389 10 10 IICE O=C(Cc1cccc(Br)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860670 WOJFJUKRPCSTQX-GOSISDBHSA-N 437.765 4.131 10 10 IICE COC(=O)[C@@H](c1cccc(Br)c1)N(C)Cc1cc(Cl)cc(C(C)=O)c1O 1307585138 IVHSOPCSHPALPY-QGZVFWFLSA-N 440.721 4.357 10 10 IICE NC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)Cc3ccccc3-4)cs2)c1 1318241514 RIHLCWSWDWFEDY-UHFFFAOYSA-N 447.541 4.281 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H](c3ccc(Cl)cc3)N(C)C)cc2F)C[C@@H](C)O1 1441786039 POZUSQLFMOWCNG-ZMPRRUGASA-N 433.955 4.012 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)cc1-n1c(C)cc(C=O)c1C 1446179019 XWIPNXCCIBJDMZ-SFHVURJKSA-N 432.520 4.467 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@]3(Cc4ccc(C(F)(F)F)cc4)CCOC3)CC2)cc1 1458044567 PVMRANXWNUDAQE-HSZRJFAPSA-N 448.485 4.012 10 10 IICE Cc1cc(C(=O)N(CCO)Cc2ccccc2)c(C)n1-c1ccc(Br)cc1 1464037235 PXPBUABKPKDBQA-UHFFFAOYSA-N 427.342 4.491 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1500831372 ORZBDWDULQDSIB-AREMUKBSSA-N 448.615 4.457 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H](Cc3cnn(C)c3)C2)cc1 1501840781 PILMDIGKTSQPBJ-JOCHJYFZSA-N 449.647 4.174 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@H](O)c2ccc(C(F)(F)F)cc2)cc1 1542490755 XRUYKFAKUXYRMR-LEWJYISDSA-N 436.474 4.013 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3ccn(C)n3)C2)c(C)n1-c1ccc(Br)cn1 1558411734 JEKSYSFDJXINSE-MRXNPFEDSA-N 442.361 4.005 10 10 IICE CC[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)[C@@H](O)c1c(F)cccc1F 1566341269 CWVUJAPNPFWVAI-FYYLOGMGSA-N 426.463 4.427 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1 1566408447 YHTZTDZIXICKFM-HSZRJFAPSA-N 429.564 4.366 10 10 IICE COC(=O)C[C@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 1585761237 OWLIMCMNQBRPAO-DEOSSOPVSA-N 439.943 4.280 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(C3CC3)[C@@H]2c2cccc(OC)c2)cc1 1623451936 ORVDVLDYLDONOI-AZGAKELHSA-N 449.595 4.252 10 10 IICE CCOC(=O)[C@H]1[C@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)[C@@H](C)C[C@H]1C 1623486207 AWKHUFKGPBUVIP-HCSKMRSTSA-N 440.584 4.353 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1625794704 OAVJVMCUFHROGP-SFHVURJKSA-N 434.367 4.461 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C(C)(C)C2)c1 1626606062 CWZVXJHNUNXVSG-UHFFFAOYSA-N 439.556 4.378 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1628954609 NKESCSFCGFIHOM-IBGZPJMESA-N 437.531 4.138 10 10 IICE CCCCC[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C(=O)OC 1629606885 MHECFQRGDGCDSF-QGZVFWFLSA-N 436.350 4.103 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(SC(F)(F)F)o1 1630718683 JJJFJRWELNFBLK-UHFFFAOYSA-N 439.503 4.354 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(OC(F)(F)F)cc3)CC2)cc1 1632157936 JMWJIYUANUGSGM-LEWJYISDSA-N 434.458 4.436 10 10 IICE C[C@@H](NC(=O)N1C[C@@H](CCNC(=O)C(F)(F)F)c2ccccc21)c1ccc(N(C)C)cc1 1634434368 BJDSLGDIBUZSHO-NVXWUHKLSA-N 448.489 4.196 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(O[C@H](C)c4ccccc4)nc3)C2)cc1 1643351367 SEINMPSYGVSLHY-UXHICEINSA-N 431.536 4.487 10 10 IICE C[C@H](c1cc(F)ccc1F)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1657000682 FEOZTHYRGFJBHZ-CQSZACIVSA-N 434.442 4.372 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc1C 1680465758 DAFURCHABRQGLJ-QHCPKHFHSA-N 446.551 4.404 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)Cc3ccccc3F)cc2Cl)C1 1682024096 OLZLDYQHDWTSEL-VQIMIIECSA-N 433.955 4.118 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCSC[C@H]1c1ccc(Cl)cc1 1682987183 ZLCQROHLMHCXTD-QFIPXVFZSA-N 446.016 4.301 10 10 IICE C[C@@H](NC(=O)NCc1cccc(Br)c1O)c1cc(Cl)cc2c1OCC2 1685387849 LBQFYUAAZBHXES-SNVBAGLBSA-N 425.710 4.303 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)[C@H](C)c3ccco3)n2Cc2ccc(N(C)C)cc2C)n1 1693410241 PBJIHGUKTCVLSI-HXUWFJFHSA-N 447.587 4.353 10 10 IICE CC[C@@H](C)N(C)CCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1694198685 AHMOSMWJCBCVSQ-HXUWFJFHSA-N 442.652 4.031 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)OC(C)(C)C1 1697995070 JDECVEWCFZZZJM-IBGZPJMESA-N 437.588 4.393 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(=O)(=O)CC)C(C)C 1709932950 CODNXKUYFLDTDZ-UHFFFAOYSA-N 443.617 4.022 10 10 IICE CCCN1CCCC[C@H]1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1728141919 FVSXXPSSBYZAFT-UNMCSNQZSA-N 427.593 4.126 10 10 IICE CON(C)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1730962646 CTRQUDYHKJWMGH-UHFFFAOYSA-N 426.952 4.276 10 10 IICE CCOCC(C)(C)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1746997936 ICSQPFIODJTIGC-UHFFFAOYSA-N 441.620 4.334 10 10 IICE CCCCC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1860547355 JONQATMKUNCKSP-UHFFFAOYSA-N 427.460 4.238 10 10 IICE CCOC(=O)c1c(C2CC2)nn([C@@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080003821 RNMWMBXGATWISM-GOSISDBHSA-N 435.318 4.413 10 10 IICE COc1ccc(Br)c(CNC2CCN(C(=O)OCc3ccccc3)CC2)c1O 2220462490 MKBOROUXPJRGOP-UHFFFAOYSA-N 449.345 4.054 10 10 IICE COC(=O)CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1ccc(Cl)c(F)c1 2313682987 PCXALFMBXQNRIZ-UHFFFAOYSA-N 446.822 4.039 10 10 IICE COC(=O)c1ccc(C=C2C(=O)N(Cc3ccccc3F)N=C2c2ccc(OC)cc2)cc1 2332139186 FIEQGXCSEGUTNF-UHFFFAOYSA-N 444.462 4.451 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478058 AQVIQLTVKYNCGI-GSHUGGBRSA-N 427.526 4.452 10 10 IICE CCOC(=O)COc1ccccc1/C=C1\SC(N(C)c2ccc(Cl)cc2)=NC1=O 15016292 GIEBYSCSWKTSCI-PDGQHHTCSA-N 430.913 4.389 10 10 IICE O=C(CN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1nc2ccc(F)cc2s1 39874943 RVCNXBJEOCXVPF-QPEQYQDCSA-N 435.552 4.337 10 10 IICE COc1cc(/C=C2/SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)ccc1OC(C)C 206923617 HXIIBTLMQUTBRT-XDHOZWIPSA-N 442.562 4.337 10 10 IICE C[C@H](NC(=O)NCc1ccc(C(=O)OC(C)(C)C)cc1)c1ccc(N2CCOCC2)cc1 743564066 COGZZMONWURYAQ-SFHVURJKSA-N 439.556 4.039 10 10 IICE COc1ccc(OC)c([C@H](C)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743565228 UXDXGUQZDDXFBY-JKSUJKDBSA-N 449.498 4.334 10 10 IICE Fc1ccc([C@H](NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c2cnccn2)cc1 753620394 ZULJNIWHGQLLIO-QFIPXVFZSA-N 446.448 4.350 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)c2)c1C 766403582 AGPYVDXQNJIFMR-SFHVURJKSA-N 432.568 4.379 10 10 IICE C[C@H](N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(F)c1)c1ccc(N2CCOCC2)c(F)c1 773105126 QEAIAUHQZSKMIV-JOGUKUGOSA-N 449.929 4.077 10 10 IICE COc1cc(Br)ccc1CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 779662134 ZUFYYFHOYLEASW-GOSISDBHSA-N 449.345 4.054 10 10 IICE O=C(NCc1ncn(Cc2cccc(F)c2)n1)N(Cc1ccccc1O)C1CCCCC1 780850983 GFWSAJPETAJLRI-UHFFFAOYSA-N 437.519 4.216 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnccn1 802631511 KURYDEYVKNJOLO-UHFFFAOYSA-N 445.571 4.206 10 10 IICE O=C1N=C(SCC(=O)N2CCOC[C@@H]2C2CC2)S/C1=C\c1csc2ccccc12 814772886 HTLVYLVTSRWXQP-BZMUBCNJSA-N 444.603 4.242 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 919895899 YXPXFTIOOLAMAH-KOSHJBKYSA-N 432.568 4.065 10 10 IICE CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1136138307 IHJCCDGLKFKSBX-UHFFFAOYSA-N 449.526 4.133 10 10 IICE Cc1ccc(CNC(=O)c2cccc(CNC(=O)c3cc4cc(O)c(O)cc4s3)c2)cc1 1136260783 ZCCMEBPCAODKAX-UHFFFAOYSA-N 446.528 4.481 10 10 IICE Cc1ccc(C(=O)NCC(=O)Nc2cccc3cccnc23)cc1-n1c(C)cc(C=O)c1C 1136539449 ZSYKTGVMCXNFTJ-UHFFFAOYSA-N 440.503 4.132 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2CN2CCCCC2)c(C)n1-c1ccc(Br)cn1 1143500773 ZDAVKVMBGPFMHB-IBGZPJMESA-N 445.405 4.342 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(OC(C)C)c1 1167762765 RMVBPRXORIOLRF-UHFFFAOYSA-N 426.557 4.154 10 10 IICE CN1CCC[C@H](c2cccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)c2)C1 1182262151 SAJNCAXWZNYBBO-AHWVRZQESA-N 435.612 4.383 10 10 IICE C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1228460209 RREPUIUVENQOMP-VQTJNVASSA-N 434.584 4.185 10 10 IICE Cc1ccc(CNC(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)c(-n2cc(Cl)cn2)n1 1234385802 BIHICAKCWFQANT-KRWDZBQOSA-N 440.979 4.034 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[C@@H](c4ccccc4)CC3)cc2)CC1 1251104644 PCRNNTBLRANOKJ-ISKFKSNPSA-N 448.611 4.304 10 10 IICE C[C@@H]1CN(c2nnc(CCCc3ccccc3)n2CCCSc2nccs2)CCO1 1291275681 WVKDODWDKARNHS-GOSISDBHSA-N 443.642 4.317 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1 1297004855 AXIOJLOUSHYTCI-UHFFFAOYSA-N 444.597 4.399 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C[C@H]1c1ccc(O)cc1 1298362756 JASVMKKSTLJQAQ-LOSJGSFVSA-N 446.547 4.445 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 1313123864 JCPLEPKSGKAEHF-KZULUSFZSA-N 426.344 4.371 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(C(F)(F)C(F)(F)F)cc3)c2)CC1 1360877580 HMQAJCCGOXPFIZ-UHFFFAOYSA-N 441.400 4.295 10 10 IICE C[C@@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Cc1cccs1 1435332615 MCNPOKQVWOHRHB-IIMQCXAKSA-N 448.610 4.474 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cnc(-c4ccccc4Cl)s3)cc2)CC1 1438888260 TUCSTHVIWLHGDW-UHFFFAOYSA-N 426.973 4.145 10 10 IICE Cc1nc(-c2ccccn2)sc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1465951996 SIGFGGIDNACZKW-QGZVFWFLSA-N 442.972 4.267 10 10 IICE CN(CCOc1ccccc1C(C)(C)C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1470905809 WSDPPPAJEUQVLU-UHFFFAOYSA-N 439.600 4.166 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)c2ccc(Br)cn2)CCCC1 1516183274 CMXRXZAIVJCYFW-UHFFFAOYSA-N 428.330 4.349 10 10 IICE CO[C@@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C1CCCC1 1530035427 FVCDHGJPRDTSAX-BQGMYUGNSA-N 438.640 4.051 10 10 IICE Cc1ncc([C@@H](C)NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)s1 1534717848 JYVILIXHTKEPSD-RLIURORJSA-N 437.637 4.372 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)N(C)C)cc1 1539234008 AMIKULOVQMSONY-OAQYLSRUSA-N 444.551 4.271 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2Cc2cccs2)c(C)n1-c1ccccc1 1542179297 AWRHDSVKFTWPCU-MRXNPFEDSA-N 448.596 4.163 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc4c(Br)c(F)ccc4[nH]3)CC2)cc1 1543359043 SMJVFYFOMBBISY-UHFFFAOYSA-N 446.320 4.431 10 10 IICE Cc1cc(Br)c(=O)n(CC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)c1 1559403771 ZGOKHSNCAIEHHA-UHFFFAOYSA-N 434.721 4.258 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H](C)N(C)C(=O)OC(C)(C)C 1612536438 AYGCMQPEWWZNFC-SFHVURJKSA-N 442.608 4.079 10 10 IICE CC(=O)N1CCN(Cc2cccc(NC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)c2)CC1 1625379297 DDWFHHUDOPYZRM-UHFFFAOYSA-N 444.579 4.319 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c1C 1627220063 MZRJPJYTXSVGHZ-UHFFFAOYSA-N 448.567 4.182 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(-c4cc(OC)ccc4Cl)no3)CC2)cc1 1630992704 SLRQNLJEIUJYMM-UHFFFAOYSA-N 441.915 4.365 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(C(=O)OC(C)(C)C)nc1 1631166123 ARDSGCGIEJJPSZ-UHFFFAOYSA-N 435.318 4.167 10 10 IICE Cc1cc(C(=O)NC[C@H](O)COc2ccccc2)c(C)n1-c1ccccc1Br 1631311425 QLUIAIGEFQNGIR-KRWDZBQOSA-N 443.341 4.026 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CN(Cc4ccccc4)CC[C@@H]3CO)c2C)c1 1631430509 VBTAYWFAEMYNTC-SQHAQQRYSA-N 445.607 4.324 10 10 IICE COCCN(C[C@@H](O)C(F)(F)F)C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1631628117 HNMUMKJRMVDPLM-LJQANCHMSA-N 438.450 4.180 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@]1(C)CC(c2cccc(Cl)c2F)=NO1 1639341182 OYEXSLRPTIWMJT-IQMFZBJNSA-N 431.939 4.484 10 10 IICE Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)CSc1ncc(Cl)s1 1641311117 GERBPJZDCAJZEP-UHFFFAOYSA-N 446.019 4.010 10 10 IICE CCN(Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)Cc1cc(Br)ccc1O 1644711463 WNHBQXJCGHKVCQ-UHFFFAOYSA-N 433.262 4.135 10 10 IICE COC(=O)[C@H]1c2ccccc2OCCN1C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1653130156 HSSHEDMRBLQQOV-JOCHJYFZSA-N 438.911 4.496 10 10 IICE CC(C)(C)c1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n[nH]1 1653842523 BRTXEBJYJLTXAN-GXDHUFHOSA-N 432.546 4.076 10 10 IICE CN(CC(=O)NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(OCc2ccccc2)cc1 1654173077 VPUJJWSAKKQARA-QHCPKHFHSA-N 429.564 4.345 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@@H]2C(=O)Nc3ccccc32)CC1 1673744615 NVXVJJSTRPQSSV-UUOWRZLLSA-N 434.584 4.150 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H](c4cncn4C(C)(C)C)C3)C2)cc1 1683339759 FTMKSMWOQUXKPI-PMACEKPBSA-N 439.604 4.062 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1C[C@@H]1C 1694301943 BMZXZGFJDONDCW-AZUAARDMSA-N 438.620 4.089 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C[C@@H](C)O1 1694950780 QEMXIBISYOEBGW-ZACQAIPSSA-N 437.635 4.162 10 10 IICE CCSCC[C@H](C)N(C)c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)cc1C 1696555910 FQWMKFXQHPZTTO-SFHVURJKSA-N 441.649 4.069 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](CCOC)C1 1710822644 HXPCQDBVAWGOCJ-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CC(C)Cc1nnc(N(C)C[C@@H]2CCOC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1723272423 BPXQUZXUNLTCNV-QFIPXVFZSA-N 425.621 4.234 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)[C@@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1724196538 RZLNVYVZXCKSMC-MJGOQNOKSA-N 434.588 4.066 10 10 IICE CCc1nnc(N2CCO[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1727617552 FKMXAJJFUYQYCG-QFIPXVFZSA-N 425.621 4.376 10 10 IICE Cc1cc(C)n(Cc2nnc(N(CC(C)C)C(C)C)n2Cc2ccc(N(C)C)c(F)c2)n1 1762427415 RIALGJLFRPZRDW-UHFFFAOYSA-N 441.599 4.264 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCc1nccc(C(F)(F)F)n1 1768682077 RYQJOXRERCEJJF-UHFFFAOYSA-N 448.493 4.260 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1\C(=O)N(Cc2ccc(F)cc2)N=C1C(F)(F)F 1865678465 NGUHMXDEQQTNDK-NVNXTCNLSA-N 438.377 4.196 10 10 IICE COc1ccc(/C=C/C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCCCC2)c(OC)c1 1865908940 WHISOGCCDYLSID-MXWQMBOOSA-N 437.584 4.126 10 10 IICE CCN1C(=O)C(NCCc2ccc(F)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873162006 BCQSHIWJUXSCEX-UHFFFAOYSA-N 431.511 4.165 10 10 IICE O=C(OCC1c2ccccc2-c2ccccc21)N1CC[C@@](C(=O)O)(c2ccc(O)c(O)c2)C1 1951734377 MPHSNDHAVKTKTF-SANMLTNESA-N 445.471 4.075 10 10 IICE COC(=O)c1c(C2(C)CC2)nn([C@@H](c2ccc(OC)cc2O)C(C)C)c1Br 2080041684 CYDBLQMRPLVAFL-MRXNPFEDSA-N 437.334 4.443 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)c1cc(I)ccc1Br 2163081356 ZBQVIWHDHTUXRG-MRXNPFEDSA-N 445.142 4.429 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@H](CN)c1cncc(Br)c1 2194918309 UCNFCPIERGLHFQ-GOSISDBHSA-N 435.366 4.005 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@H]3C[C@H]2CN3C(=O)OC(C)(C)C)c1O 2236053985 CTQOXWYHNRVLET-HEHGZKQESA-N 441.366 4.041 10 10 IICE Cc1cccc(Cn2cccc2C=C2C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c1 2296928120 ROARASISQAGPPM-UHFFFAOYSA-N 433.895 4.473 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)C2=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 2332144803 OQMPDUVWHKUCDL-UHFFFAOYSA-N 447.422 4.278 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380788167 ZFMJLHYYNNKIBM-OAHLLOKOSA-N 441.366 4.115 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475854 ZWDZWAUVKNZVHK-DRSNIGMVSA-N 443.525 4.157 10 10 IICE Cc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC[C@@H]4CCCO4)cc3[C@@H]3C=CC[C@@H]32)s1 226671892 CCSWNPMIFJLQGP-KANGHSEISA-N 430.595 4.340 10 10 IICE CC1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@@H](c2ccc(O)cc2O)N3)CC1 226779030 HAEWHHKKTAJPCU-IECBHUPTSA-N 440.565 4.345 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 726087779 SLSAHANMVVIGIW-FQEVSTJZSA-N 440.588 4.193 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCc3ccccc3OC3CCC3)cc2F)C[C@H](C)O1 735680834 IVHMSNPOXKHZFB-ROUUACIJSA-N 441.547 4.370 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC(c2ccccn2)CC1 754641739 LKDBOKCSRNARQH-UHFFFAOYSA-N 430.499 4.241 10 10 IICE Cc1ccnc(C2CCN(Cc3cc(Br)cc(Br)c3O)CC2)n1 757928697 WFBUTAPRWOEZOZ-UHFFFAOYSA-N 441.167 4.395 10 10 IICE O=C(N[C@H]1C[C@@H]1C1CCN(Cc2c(O)ccc3ccncc23)CC1)OCc1ccccc1 793667475 JBTZTANDCKPZLW-QPPBQGQZSA-N 431.536 4.467 10 10 IICE O=C(NCc1cc(Br)ccc1O)C1(c2cccc(Br)c2)CC1 804733524 ROIYJMQYHAHWHO-UHFFFAOYSA-N 425.120 4.265 10 10 IICE Cc1ccnc(Oc2ccc(NC(=O)NCc3cc(Br)ccc3O)cc2)n1 806342599 LTXNLHDIVQZWMZ-UHFFFAOYSA-N 429.274 4.367 10 10 IICE O=C(CCc1ccc2ccccc2n1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 813505060 MDCIRMCPWYNDGP-UHFFFAOYSA-N 428.580 4.016 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N3CCC[C@@H]3Cc3cccc(F)c3)cc2F)C[C@@H](C)O1 918081256 MSXGVMPUNDLOCA-KGVIQGDOSA-N 443.538 4.495 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C\c1ccc(N2CCCCC2)o1 1084378568 LJJCEMXCUAZFBU-KAMYIIQDSA-N 434.279 4.243 10 10 IICE CCOc1ccc(-n2c(C)cc(/C=C3/C(=O)NC(=O)N(Cc4ccccc4)C3=O)c2C)cc1 1084452937 NQGZTUYYOZLMIK-HAHDFKILSA-N 443.503 4.155 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc2c1OC(F)(F)O2 1126656913 AQVLIWFBYPZFBR-LBPRGKRZSA-N 426.366 4.008 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(C(=O)c3cccc(OC)c3)cc2)cc1 1130544796 URXPRXYILOWMEL-UHFFFAOYSA-N 432.520 4.143 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(CNC(=O)C(C)(C)C)ccc3Cl)C2)cc1 1131030526 RREMXGMLSSBQMX-KRWDZBQOSA-N 443.975 4.020 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(C(C)C)c1 1137228719 XHHIKEGRJXXKQS-JOCHJYFZSA-N 426.557 4.400 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)CC(C)C 1156427887 ITLTWIPKLQOZIH-AREMUKBSSA-N 441.616 4.140 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N(C)CCc1ccccc1F 1167331878 BYMGKTUKGJMKER-MRXNPFEDSA-N 430.479 4.103 10 10 IICE CCOc1ccc(N(CC(=O)Nc2ccc(N3CCN(CC)CC3)cc2)CC2CC2)cc1 1175371992 PZKZRUWHWLFKHX-UHFFFAOYSA-N 436.600 4.082 10 10 IICE COC(=O)[C@]12CCC[C@H]1CN(C(=O)c1cc(C)n(-c3ccc(Br)cc3)c1C)C2 1176312274 HRXKAWOOOGBNCZ-AOMKIAJQSA-N 445.357 4.272 10 10 IICE Cc1cc(C[C@@H](C)NC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)n(-c2ccccc2)n1 1224439393 CIMUESGRVJFDOS-WOJBJXKFSA-N 433.600 4.417 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2cccc(Br)c2O)c2ccco2)cc1 1251936158 MCPSCCUHKWCQQA-GOSISDBHSA-N 431.286 4.345 10 10 IICE COc1ccc([C@@H](NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccc2)cc1 1256237095 QRNPUFLHZNFHQU-UIOOFZCWSA-N 446.595 4.453 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CCS[C@@H](C(C)C)C1 1289423456 LNHQFUWFEUZBIJ-RBBKRZOGSA-N 443.661 4.173 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C1 1294455727 ZPMFHWOMXSVHNM-FQEVSTJZSA-N 426.653 4.166 10 10 IICE Cc1cc(C(=O)N2CCCN(CC(F)F)CC2)c(C)n1-c1ccccc1Br 1295165560 JSKANPRAXVTGOV-UHFFFAOYSA-N 440.332 4.270 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NCc2ccc3cccnc3c2O)c1 1299725961 OXDYUFLMCYWTAO-UHFFFAOYSA-N 438.377 4.158 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)CC2CCOCC2)cc1 1313681707 WRWDBWNXUJMURL-QHCPKHFHSA-N 441.620 4.277 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1)C(C)C 1315188704 LBSRGTDCCVRZIZ-CVDCTZTESA-N 437.588 4.249 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1CCN(C(=O)N(C)Cc2ccccc2)CC1 1349106955 UDMDUWVFUSBMFR-UHFFFAOYSA-N 448.611 4.209 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(OC(F)F)c(Cl)c3)cc2F)CC1 1352970034 QIUFGLKRASFLDU-UHFFFAOYSA-N 441.881 4.152 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](NC(=O)OC(C)(C)C)C1CCCCCC1 1354371541 OJRFJSSFPDZJJG-OAQYLSRUSA-N 431.577 4.342 10 10 IICE Cc1cc(CNC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1438301140 ITLZUGFLZZDCMM-SANMLTNESA-N 449.526 4.461 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C/C(=O)N2CCN(CC3CC3)c3ccccc32)C1 1445059621 SKRLYJLIQOJJCZ-HYSAVQALSA-N 425.573 4.453 10 10 IICE COc1ccc(C[C@@H](CO)CNC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1O 1445684875 FHWJUSHLNSCALB-OAQYLSRUSA-N 436.552 4.006 10 10 IICE CSc1ccc(/C=C/C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1458016783 HJEMTGYJDQIJDI-CSKARUKUSA-N 427.639 4.332 10 10 IICE CCN(CC(=O)N(C)[C@@H](C)c1ccccc1OC)Cc1cc(Br)ccc1O 1459576661 PTIIROCYZWIEDD-HNNXBMFYSA-N 435.362 4.205 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCO[C@H]1c1cncc(Br)c1 1460980969 FQGGWNJMHGSVTB-LPTQZCDUSA-N 446.389 4.044 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F 1463814645 QTCIZXOIEILSGW-QHCPKHFHSA-N 427.539 4.403 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc(Br)cc(N)c2N)cc1 1464075600 TYTQTOOYIGYGFV-UHFFFAOYSA-N 443.345 4.115 10 10 IICE Cc1nc(COc2ccc(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)cc2)no1 1465018633 AWLHFCCSKSOHSR-UHFFFAOYSA-N 430.464 4.429 10 10 IICE Cc1ccc(C(=O)NCCOc2c(Cl)cc(Br)cc2Cl)c(O)c1O 1466562014 DNBWRSLLSWABNM-UHFFFAOYSA-N 435.101 4.284 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1 1478840536 DHPLCUYXHGDLSC-XXBNENTESA-N 425.573 4.374 10 10 IICE CCOCc1nnc(N2CCc3cc(F)ccc3C2)n1CCCSc1nccs1 1503072106 KUODJTTYPSMTCQ-UHFFFAOYSA-N 433.578 4.155 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccccc3C(=O)c3ccc(F)c(F)c3)C2)cc1 1531729621 JHHHHLPKYPPFIJ-KRWDZBQOSA-N 436.458 4.213 10 10 IICE COC(=O)[C@@H](C)[C@@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1534151040 LORZEDUEEAKKEO-SSOJOUAXSA-N 434.536 4.195 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3csc(COc4ccc(F)cc4)n3)C2)cc1 1537110654 ZZHYKJSQOFTVNG-INIZCTEOSA-N 441.528 4.126 10 10 IICE CN(C)c1ccc(CN(C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)C2CC2)cc1 1540709095 BGFCDCQSRFJASG-UHFFFAOYSA-N 436.556 4.250 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 1540729262 PLKISMKZPATOIB-OAQYLSRUSA-N 427.589 4.330 10 10 IICE CNC(=O)C[C@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 1543571762 KHHSTICTDFNHOS-DOMQTXCISA-N 442.563 4.042 10 10 IICE CCCN1CCCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)CC1=O 1547203451 SDAXJPBMYVLJEZ-UHFFFAOYSA-N 448.662 4.023 10 10 IICE COc1ccc(CNC(=O)c2nn(-c3ccc(Cl)cc3Cl)c3c2CCC3)c(O)c1 1556353996 UCAVXVKQJOFYPO-UHFFFAOYSA-N 432.307 4.312 10 10 IICE CC(C)c1nnc(NC(=O)CCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)s1 1597950903 QOUFRDYQISAANJ-UHFFFAOYSA-N 443.617 4.466 10 10 IICE CC(C)[C@H]1OCCC[C@H]1Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1603172449 WBDWWNGZAZJDIF-GBXCKJPGSA-N 435.572 4.057 10 10 IICE CCOCc1nnc(N2CCCC[C@H](SC)C2)n1Cc1ccc(N(CC)CC)cc1 1616880932 UUPUSBOEIGIMPS-NRFANRHFSA-N 431.650 4.431 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CNCc2cc(Br)cc(F)c2O)CC1 1621105703 XZVIIVVJSAGGRG-CYBMUJFWSA-N 431.346 4.421 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)ccc3C3CC3)CC2)cc1F 1622578849 JBFXHWIMEDVYTB-UHFFFAOYSA-N 433.321 4.437 10 10 IICE O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)c1cccc(OCC(F)(F)F)c1 1625567932 QAZHTRMSNJHVMM-UHFFFAOYSA-N 433.474 4.412 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](C)[C@H](C)C(=O)Nc2ncccc2O)c1 1627090253 IMBSUMHIYCNECZ-JKSUJKDBSA-N 440.931 4.241 10 10 IICE Cc1ccc(C)c(OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1629679124 LJPFLCMHHWCHEU-OAQYLSRUSA-N 441.572 4.130 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(c4ccccc4Br)CC3)CC2)cc1 1632158247 WXOVODRFHOXSOX-UHFFFAOYSA-N 429.358 4.228 10 10 IICE Cc1cc(C(=O)N[C@@H](c2ccccc2)C2(CO)CCOCC2)c(C)n1-c1ccc(F)cc1 1639175862 AMOYZPHIPBTHJC-DEOSSOPVSA-N 436.527 4.493 10 10 IICE Cc1cc(CN2CC[C@@H](c3cccc(F)c3)[C@@H](NC(=O)C(F)(F)F)C2)ccc1N(C)C 1647300228 YEDBDJQWJUZLHE-PMACEKPBSA-N 437.481 4.237 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC3(CCC3)OC[C@@H]2C)sc(C)c1-c1ccccc1 1659326287 QRZBJTREMUILGK-INIZCTEOSA-N 442.581 4.482 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3nc(COc4ccccc4)n[nH]3)c2C)c1 1680290716 VREAOLWAXLYUMA-UHFFFAOYSA-N 444.539 4.099 10 10 IICE C[C@H](c1ccccc1Br)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1684280706 OJRGDOPKGNLMSJ-MRXNPFEDSA-N 446.389 4.313 10 10 IICE Cc1ccc(N(C)c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)cc1 1693104976 VXWLCDORZHMPSH-UHFFFAOYSA-N 442.614 4.229 10 10 IICE C[C@H]1CCC[C@@]1(O)Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1693645266 BITJTBOBGBUDAX-UQBPGWFLSA-N 425.621 4.363 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1CC1(O)CCCCCC1 1696701030 UXYPRQMDGILHDB-UHFFFAOYSA-N 426.586 4.358 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)Cc4cnn(C)c4)nnc3C(C)(C)C)cc2)CC1 1708105390 XLQROGAFHHZYRF-UHFFFAOYSA-N 435.620 4.230 10 10 IICE CO[C@@H](Cn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)C 1748434315 ARRSDSVEXGKGQT-QHCPKHFHSA-N 441.620 4.080 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccoc1 1750031404 YJBJEHPWHZFNDB-UHFFFAOYSA-N 446.555 4.108 10 10 IICE CC(C)Cc1nnc(N2CCc3ccc(Cl)nc3C2)n1Cc1ccc(N(C)C)c(F)c1 1750735431 PJNOPBDWFCHLNX-UHFFFAOYSA-N 442.970 4.341 10 10 IICE C[C@@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccccc1O 2025252384 SQEQCJIEUYFVEA-TZIWHRDSSA-N 425.573 4.164 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@H](CN)c1cnn(Cc2ccccc2)c1 2074363734 GSNCULBBYDNSRX-QHCPKHFHSA-N 435.572 4.092 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3cc(Br)ccc3O)CCC[C@@H]12 2087290595 WRHGHJHGIXZORY-XLIONFOSSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@]1(C)CNCc1cccc(Br)c1O 2102785231 IHRGSKSEYTZVFA-QGZVFWFLSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](NCc3ccc(Br)cc3O)C(C)(C)[C@@H]21 2119290654 JGONPDOAOGFAMX-DJIMGWMZSA-N 425.367 4.278 10 10 IICE COCCOCCN(Cc1ccccc1)c1ccc(CNC2CC2)cc1Br 2152215737 WYNNTZLXKKPSQZ-UHFFFAOYSA-N 433.390 4.371 10 10 IICE Brc1cc(N2CC3(CN(Cc4ccccc4)C3)C2)ccc1CNC1CCC1 2240039917 KTULDSPUOAYVDX-UHFFFAOYSA-N 426.402 4.413 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1C=C1SC(=S)N(C(C)C)C1=O 2314414541 BYNMFNGUMIVZJM-UHFFFAOYSA-N 430.599 4.215 10 10 IICE Cc1ccc(CN(C)C(=O)CC2(C)CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381137901 QXKWTIRUXYWSGI-UHFFFAOYSA-N 441.366 4.069 10 10 IICE Cc1ccc(CNC(=O)C[C@H](CNC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2381139922 CNLHBSOQEJCCHX-OAHLLOKOSA-N 443.382 4.266 10 10 IICE COc1ccc(N2CCN(c3nccc4ccc(C(=O)NCCC(C)C)cc34)CC2)cc1 65002003 GUFILXDAERLICQ-UHFFFAOYSA-N 432.568 4.346 10 10 IICE CC(/C=C1\SC(=S)N([C@H]2CC(=O)N(c3ccccc3)C2=O)C1=O)=C\c1ccccc1 101154663 ZVXPEIXTKZGELO-IBOJSVHSSA-N 434.542 4.166 10 10 IICE CCOC(=O)CCCCCN1C(=O)/C(=C\c2ccc(OCC)c(OC)c2)SC1=S 206717636 BFIYEYDUZTYRNM-NBVRZTHBSA-N 437.583 4.419 10 10 IICE COCCOc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)c1 435519634 MZTCXRDQDROSHZ-UHFFFAOYSA-N 435.568 4.380 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3cccs3)[C@@H]2c2ccc(O)c(O)c2)c1 526226769 KXARFPPZOPVYQC-FQEVSTJZSA-N 425.462 4.234 10 10 IICE COC(=O)c1ccccc1N1C(=O)C(O)=C(c2ccc(C)cc2)[C@@H]1c1ccc(O)c(O)c1 526481586 IFNQSYSLDVUJNT-QFIPXVFZSA-N 431.444 4.250 10 10 IICE COc1ccc(Nc2nc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)cs2)cc1 743323086 RYUDRJRMLYSFDN-INIZCTEOSA-N 438.553 4.223 10 10 IICE Cc1ccc(C(=O)CCCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 766136864 NXVMPXQZCBMKBF-RTBURBONSA-N 426.532 4.417 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(Oc3cccc(C(N)=O)c3)nc2)c1 781559819 KGDGVLIJKDTIQO-UHFFFAOYSA-N 428.286 4.361 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1ccc(F)cc1 792056084 BLFVIRJUNOHWEJ-JOCHJYFZSA-N 441.547 4.351 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 804734515 OYIXOCGBEGEHEY-UONOGXRCSA-N 430.220 4.473 10 10 IICE CCOc1cccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1125052515 FUUIRPKUHKEJKK-UYRXBGFRSA-N 444.553 4.132 10 10 IICE Cc1onc(-c2cccc(F)c2)c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1125187434 FVUFGJXFGPJIPT-HUUCEWRRSA-N 441.478 4.472 10 10 IICE CC(=O)N1CCN(c2ccc(CNc3ccnc(CSc4ccccc4)n3)cc2)CC1 1163241744 HUFDXIPDCQMYOA-UHFFFAOYSA-N 433.581 4.050 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@H]3c3cccc(C)c3C)CC2)cc1 1191212600 BWJHMZQXRVUYDK-IGKIAQTJSA-N 437.628 4.022 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCCC[C@@H]2CCO)sc(C)c1-c1ccccc1 1194306598 LBMNSFOQOCQGGY-LJQANCHMSA-N 444.597 4.466 10 10 IICE CCOc1ccc(N(CC(=O)Nc2cccc(CN3CCSCC3)c2)CC2CC2)cc1 1196952737 MTWDBBQWNGIOHP-UHFFFAOYSA-N 439.625 4.489 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@H](N(C)C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1233973044 HWKSMHGCCYRJTE-QFIPXVFZSA-N 440.588 4.287 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cnc(O)c2ccccc12 1251127807 KGOQKBPBOYPCGL-UHFFFAOYSA-N 430.302 4.140 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2nc(C(F)(F)F)n3c2CCCC3)C2CC2)cc1 1254362114 GZTRYXQLYVWEMQ-UHFFFAOYSA-N 435.494 4.178 10 10 IICE Cc1cc(C(=O)NCC(C)(C)C2(O)CCOCC2)c(C)n1-c1ccccc1Br 1299607496 FDMQLUIMGIFARB-UHFFFAOYSA-N 449.389 4.154 10 10 IICE COCCN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCC(C)CC2)cc1 1301698665 RTGWPWZRXXTLKZ-UHFFFAOYSA-N 434.588 4.016 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1OCCC1(C)C 1305379987 BZMBIJHVJPDLLC-SIKLNZKXSA-N 441.620 4.080 10 10 IICE C[C@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)C1(F)F 1316493445 RMERAZWUUYJIAX-IYBDPMFKSA-N 444.505 4.321 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)CCC(=O)NC(c1ccccc1)c1ccccc1 1353244882 CTBDVCHBINGYNB-UHFFFAOYSA-N 429.564 4.363 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccn(-c4ccc(Cl)cc4)n3)cc2F)C[C@@H](C)O1 1355131736 YNMJQZCTQZPUJG-IYBDPMFKSA-N 442.922 4.208 10 10 IICE CC(C)CCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1359907260 BDARFUOJHFHRIP-QFIPXVFZSA-N 441.620 4.081 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@H](C(N)=O)c2cccc(Br)c2)cc1 1458346062 DOEIESBIIBRRLY-FQEVSTJZSA-N 440.341 4.155 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@H](C)c3cccc4ccccc34)CC2)c(OC)c1 1460653451 XQSBNCBPOVBTSZ-WOJBJXKFSA-N 447.579 4.245 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)c(C)ccc4[nH]3)CC2)cc1F 1465931676 LVMFBAQLVLJOLI-UHFFFAOYSA-N 446.320 4.349 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](CCC(=O)OC)Cc3ccccc3)ccc21 1466610999 LMJMFGMOXOEQGQ-JOCHJYFZSA-N 436.552 4.199 10 10 IICE CC(C)Cc1cc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n[nH]1 1469557049 QGAOBIJGAKCFQH-RVDMUPIBSA-N 434.612 4.290 10 10 IICE Cc1ccc(C[C@@H](CO)CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1Br 1469854484 RPXSPNRBTJWDMM-SJLPKXTDSA-N 448.405 4.035 10 10 IICE CCCCO[C@@H]1C[C@H](N(C)CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(C)C 1473259616 KJFGIIJVJOQHLT-XZOQPEGZSA-N 448.563 4.316 10 10 IICE Cc1nnc(N2CCC(CN(C)C(C)C)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1492803544 DUNRKXBOKJXVPT-UHFFFAOYSA-N 438.664 4.428 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1504963866 ODXLOQKEQBIJFC-ZWKOTPCHSA-N 447.599 4.128 10 10 IICE COc1cccc(Cl)c1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1515966811 YOKJWJUXJMONJK-UHFFFAOYSA-N 425.960 4.386 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccc(I)cc1 1524895000 REHNDMROXBDSDF-UHFFFAOYSA-N 436.337 4.337 10 10 IICE COc1cc(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)c([N+](=O)[O-])cc1OC(F)F 1525106720 LYABGGPJBOIHRG-UHFFFAOYSA-N 435.427 4.077 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@]1(C)CC1(Br)Br 1525113580 KPOFSJBSMYMPME-MRXNPFEDSA-N 430.184 4.141 10 10 IICE CC[C@H]1[C@@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1525593830 MYNSMEMDIMMRGC-FPOVZHCZSA-N 448.519 4.436 10 10 IICE CN(C)c1ccc(CN(C(=O)C2(NC(=O)OC(C)(C)C)CC3(CCC3)C2)C2CC2)cc1 1526186430 SLEQOBMCQXSAGO-UHFFFAOYSA-N 427.589 4.471 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3cc4c(Cl)cccc4s3)cc2)CC1 1537839974 SUZWGMBNMLJEHT-UHFFFAOYSA-N 427.957 4.186 10 10 IICE Cc1ccc(N2N=C(Br)C[C@H]2C(=O)N(C)Cc2ccc(N(C)C)cc2)cc1 1540440433 HWOHWFVTBYQDQS-IBGZPJMESA-N 429.362 4.007 10 10 IICE CCCCN1C(=O)C[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)[C@H]1c1ccc(OC)cc1 1544165009 SRZQVWMNJYGTJP-ZEQKJWHPSA-N 449.595 4.084 10 10 IICE COc1ccc([C@H]2[C@@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC(=O)N2C)cc1 1544246074 HJEHZQBWCANWIC-AHWVRZQESA-N 449.595 4.300 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](CN1CCCC1)c1ccccc1 1545632929 YYAMDLZTPODUTD-XZOQPEGZSA-N 442.003 4.006 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CC(=O)c2ccccc21 1546230045 HPHJIXDGXLMJQR-YCPFAOKUSA-N 442.587 4.173 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCc2ncc(Br)n2C1 1559300774 CYEBJXRZXCHBON-CQSZACIVSA-N 441.285 4.212 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccc(F)cc2F)c1 1566374761 SRWQYMKACIDWMC-BUXKBTBVSA-N 436.455 4.122 10 10 IICE C/C(=C/C(=O)N1C[C@@H]2CCCCN2c2cc(Br)c(F)cc21)c1cnccn1 1583070301 HUBLYVFJZMHUCH-MQJVFOOVSA-N 431.309 4.187 10 10 IICE Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595583451 JBGFBDGMRSDFFC-GOSISDBHSA-N 431.920 4.273 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](O)CCO3)c(C)n1-c1ccc(Br)cc1 1597227654 CUDGFNIZQZKDDX-IBGZPJMESA-N 447.373 4.003 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2cnn(C)c2)cc1 1615382351 UPPUDFRAAKLWJF-UHFFFAOYSA-N 449.628 4.195 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c1 1618315147 NCBTYLSFOUPEAA-OAQYLSRUSA-N 429.520 4.032 10 10 IICE COC(=O)CC1(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CCCCC1 1625728985 QTLGKHCCLLEDTM-UHFFFAOYSA-N 439.600 4.038 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)c1ccccc1Br 1626429759 ABGVXUJTHNDXAL-NRFANRHFSA-N 441.325 4.133 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2C[C@H]3COC[C@@]3(C(=O)OC(C)(C)C)C2)c1 1628934322 QFBSGWLJQQZLTI-XDHUDOTRSA-N 444.959 4.178 10 10 IICE CCOc1ccccc1OCCCC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257502 YNFYYLNCIGGZAG-HXUWFJFHSA-N 446.975 4.384 10 10 IICE CCN(CC)C(=O)N1CCN(C(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CC1 1633874350 ZCIVEZAITPMQOX-UHFFFAOYSA-N 436.560 4.388 10 10 IICE C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635992302 CALBDSWDEDRZPO-CRAIPNDOSA-N 433.474 4.028 10 10 IICE Cc1cc(C(=O)Nc2cncnc2-n2cccn2)c(C)n1-c1cccc(Br)c1 1640297411 GDLXBOOCLJIDQQ-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COc1ccc(C2(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CCOCC2)cc1 1646591182 LMHXEQXJIYQSJV-UHFFFAOYSA-N 432.520 4.351 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@H](c1ccc(Br)cc1)N1CCCC1 1654366068 MZXLALKSEMQEQW-QFIPXVFZSA-N 443.385 4.487 10 10 IICE CCOC(=O)CN(Cc1nnc(-c2c(Cl)cccc2Cl)o1)Cc1ccccc1O 1659100658 OJFARDFUFUBITR-UHFFFAOYSA-N 436.295 4.314 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC2(c3cccc(Cl)c3)CCC2)N(C)C)cc1 1684768396 AGBJUBWSRILTPZ-JOCHJYFZSA-N 429.008 4.430 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C12CCC2 1686826455 IRFJBBQYGIJSOY-RXVVDRJESA-N 444.620 4.223 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1ccon1 1697969105 LDJSJSKRSDGFNR-UHFFFAOYSA-N 434.544 4.404 10 10 IICE C[C@@H](C#N)CN(C)c1nnc(Cc2c(F)cccc2F)n1CCCSc1nccs1 1706078706 ZQNVEHYFWNADCX-AWEZNQCLSA-N 448.568 4.382 10 10 IICE CC(C)CCN(CCC#N)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)cc1 1706462466 XOOZYQUARCNNTO-UHFFFAOYSA-N 436.604 4.197 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN2CCC(C)CC2)n1 1751603787 DTFPCPFPBNQVLC-UHFFFAOYSA-N 434.588 4.113 10 10 IICE CC[C@H](C)c1nnc(N2CC=C(C(F)(F)F)CC2)n1Cc1ccc(N2CCOCC2)cc1 1763572153 RXMVAYVBOLCYLE-KRWDZBQOSA-N 449.521 4.375 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc2c(c1)CCCN2C 1763837583 RSDHIZZUFLMARP-JZWVFAODSA-N 441.620 4.058 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)CC1 1768167968 WUJSCIPQPJGYGZ-RUZDIDTESA-N 434.588 4.158 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)ccc1OC 1860084579 VCYQXJFQSAQUHE-VCHYOVAHSA-N 446.506 4.417 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccccc2OC(F)F)SC1=S)Nc1cccnc1 2042453595 SIDJXJGZXANCIW-UHFFFAOYSA-N 449.504 4.303 10 10 IICE CC1=NN(c2ccc(C(=O)O)cc2)C(=O)C1=Cc1ccc(OC(=O)c2cccs2)cc1 2293020968 XLEMZFNFVOYJAC-UHFFFAOYSA-N 432.457 4.472 10 10 IICE Cc1ccccc1Cn1cc(C=C2C(=O)NC(=O)N(Cc3ccco3)C2=O)c2ccccc21 2293245301 ZFAKSKBOQOQFJD-UHFFFAOYSA-N 439.471 4.253 10 10 IICE COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)cc1 2293264686 BBRHFXGOVSVYHD-UHFFFAOYSA-N 446.434 4.080 10 10 IICE CCOC(=O)c1ccc(N2N=C(C)C(=Cc3cc(Cl)c(O)c(OCC)c3)C2=O)cc1 2294400590 NYFQJEQXDRZTKH-UHFFFAOYSA-N 428.872 4.427 10 10 IICE O=C(NN1C(=O)C(=CC=Cc2ccco2)SC1=S)c1ccccc1Br 2296883347 UEPZMBBJZKZQCH-UHFFFAOYSA-N 435.324 4.145 10 10 IICE COc1cccc(C=C2SC(=S)N(CCCC(=O)Nc3ccccc3O)C2=O)c1 2296885209 JDXTWRUONYLZEP-UHFFFAOYSA-N 428.535 4.021 10 10 IICE CN1C(=O)C(=Cc2ccc(OCC(=O)Nc3nc4ccccc4s3)cc2)SC1=S 2314488204 KGVNTVUOWBEPMD-UHFFFAOYSA-N 441.559 4.145 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(c4cccc(C(=O)O)c4)C3=O)n12 2321629405 WPXJPIPDADWIKC-UHFFFAOYSA-N 435.939 4.462 10 10 IICE CCOc1ccc(N2C(=O)[C@@H]3ON(c4ccccc4)[C@@H](c4ccccc4O)[C@@]3(C)C2=O)cc1 20069318 NKXRAMBQNGIYDP-JCYRPKCISA-N 444.487 4.232 10 10 IICE COc1ccc(N2CCN(c3cc(C(=O)N4CCCCC4)c4ccccc4n3)CC2)cc1 23334564 NFCWWOWERYXLPZ-UHFFFAOYSA-N 430.552 4.196 10 10 IICE COCCN1C(=O)/C(=C/c2cc3ccccc3nc2N2CCC(C)CC2)SC1=S 38732371 XXDUAOCTNALGMO-RGEXLXHISA-N 427.595 4.319 10 10 IICE CCOc1cccn2c(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c(C)nc12 71457888 QVCFHPDIGMRCEL-UHFFFAOYSA-N 425.444 4.069 10 10 IICE COC(=O)c1ccccc1-c1ccc(/C=C2\C(=N)N3N=C(CC(C)C)SC3=NC2=O)o1 103564238 DDHWCUMSZNCEME-GESHDMKESA-N 436.493 4.398 10 10 IICE CN(C)c1ccc(C2N(c3ccc4c(c3)OCO4)CCN2c2ccc3c(c2)OCO3)cc1 248072271 SQJUQYYZBTXKHB-UHFFFAOYSA-N 431.492 4.235 10 10 IICE COC1CCC(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 750083517 NMGYFKBVXSCQAQ-ATVHPVEESA-N 438.640 4.051 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1F 753737695 CAFJSPHQJDOKRO-DLBZAZTESA-N 438.421 4.185 10 10 IICE Fc1cc(CN[C@@H]2CCCOc3ccc(Br)cc32)ccc1N1CCOCC1 765117127 AYWYJDHUFZCXJX-LJQANCHMSA-N 435.337 4.428 10 10 IICE COc1ccc(Cn2nc(C)c(CN3CCN(c4ccc(OC)c(F)c4)CC3)c2C)cc1 768509665 QAANUMAJDBEHNN-UHFFFAOYSA-N 438.547 4.027 10 10 IICE O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 769306633 BBTZPCFKWOWVJA-QHCPKHFHSA-N 425.960 4.125 10 10 IICE COc1ccc(C)cc1C1(CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CCOCC1 773246246 MMBHHNFEJXEUNX-IBGZPJMESA-N 425.573 4.178 10 10 IICE Cc1cc(Br)c(O)c(CN[C@H](c2ccc(Cl)cc2)[C@@H]2CN(C)CCO2)c1 781637505 WRQNMJJABBHEDR-RBUKOAKNSA-N 439.781 4.278 10 10 IICE CCN1CC[C@@H](NCc2ccc(N3CCOCC3)c(F)c2)[C@H]1c1cc(F)c(F)c(F)c1 782391246 JYBHWYWWQCAPDL-NFBKMPQASA-N 437.481 4.005 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccccc1OC[C@@H]1CCCCO1 806229538 HLIQIFLJYZDHAC-INIZCTEOSA-N 435.318 4.424 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC2CCN(c3ccccn3)CC2)cc1 919654823 OAZKCIFDBFJZSU-UHFFFAOYSA-N 433.556 4.121 10 10 IICE CC[C@@H](C)Oc1ccccc1/C=C/C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549036 BBRCMLHDIOIPMF-KBOKABMXSA-N 430.495 4.308 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(Br)c(N)c([N+](=O)[O-])c2)cc1 1135735442 OMOQVBWLJBSMLM-UHFFFAOYSA-N 435.322 4.058 10 10 IICE O=C(N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1)c1cc2cc(O)c(O)cc2s1 1136634921 VIAVXZMZOGQMDY-GOSISDBHSA-N 432.501 4.292 10 10 IICE COc1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCSCC4)cc3)nc2)cc1 1141803161 FUNUEHFIEMSJRA-UHFFFAOYSA-N 435.549 4.366 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Oc1ccc(F)cc1 1153156289 HFUIKYVEUCYPCT-HSZRJFAPSA-N 438.499 4.200 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)c2cccnc2)c(C)n1-c1cccc(Br)c1 1180217903 ZHPILVXVEQOOAK-HXUWFJFHSA-N 428.330 4.057 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CC(C)(C)Oc4ccc(F)cc43)C2)cc1 1252114235 BGALYQLJSYTHBD-HRAATJIYSA-N 427.520 4.262 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1252923715 NJJFDADCUOSWGX-MJGOQNOKSA-N 433.474 4.492 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)COc3ccccc3Cc3ccccc3)C2)cc1 1276831986 KDJXMQOCBSWTFY-JOCHJYFZSA-N 430.548 4.308 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Br)ccc3OC(F)F)C2)cc1 1278860705 ADZHWAJYYKXXMP-ZDUSSCGKSA-N 441.272 4.068 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)C3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1289359308 MNIFSRZSJUVPCU-GOSISDBHSA-N 434.588 4.067 10 10 IICE CCC(CC)(Cn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1291925918 ORZVKHLABRAXST-UHFFFAOYSA-N 445.583 4.225 10 10 IICE COc1ccncc1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1315672406 LLOVZNSMIBTKRG-UHFFFAOYSA-N 434.588 4.264 10 10 IICE COCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H]1C 1315963131 DHPYBOGWYGSKJM-IQGLISFBSA-N 437.588 4.129 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)C[C@H]3C)n2CCC(C)C)c(C)n1-c1ccccc1 1361048939 NQDFEDGMQZTGRK-LJQANCHMSA-N 434.588 4.066 10 10 IICE CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)C2 1441273983 ULLYBJCYCIQGNX-GTXQTCRKSA-N 434.583 4.199 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3[C@H](C)OC(C)(C)N3C(=O)OC(C)(C)C)cc2)CC1 1443669925 ZONFIYDEQDSDAA-GHTZIAJQSA-N 445.604 4.300 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1[C@@H]2CCCC[C@H]2CCN1C(=O)OC(C)(C)C 1449119929 LJTXSGUXZYAEMN-QKLQHJQFSA-N 437.577 4.310 10 10 IICE CC(C)C(=O)Nc1cc2ccccc2cc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1454006499 QLMAJDMIHSXZMU-UHFFFAOYSA-N 445.563 4.325 10 10 IICE CC[C@@H]1COC(C)(C)CN1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1461378132 POQZJKKPVUROAC-DSQDWWTGSA-N 438.640 4.146 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(F)c(Br)c(Cl)c3)C2)cc1 1461491917 DVKMRZFGVYINJR-GFCCVEGCSA-N 427.701 4.259 10 10 IICE Cc1ccc2c(n1)N(C(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)CCC2 1462593320 KFUDNOZQVZUEGD-QGOAFFKASA-N 441.553 4.100 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cnn2cccc(Br)c12 1463786768 VOZHTFVUXVWHEU-UHFFFAOYSA-N 427.346 4.359 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](CO)c3ccc(Br)cc3)c2C)cc1 1468538657 ISRWRLZPTLSIFT-NRFANRHFSA-N 443.341 4.329 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3cc(F)ccc3F)CC2)c(C)n1-c1ccccc1 1470968820 JCNVVYDAMAAYME-UHFFFAOYSA-N 438.522 4.447 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3CCCOC(C)C)CC2)cc1F 1504295922 KKKQRPUDUJBXRC-UHFFFAOYSA-N 445.583 4.225 10 10 IICE COC(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)c1 1528583044 JXJJHTCJWJVANS-UHFFFAOYSA-N 433.455 4.174 10 10 IICE C[C@H]1COc2ccccc2N1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1532846780 FBWDGAQICDZNJU-YQNUULROSA-N 442.537 4.231 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1544267139 CMMGXPZWFNGGRE-QZTJIDSGSA-N 425.520 4.260 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](CN3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1545424638 FAXSMHXWLPIRJA-PZJWPPBQSA-N 442.627 4.357 10 10 IICE O=C(c1ccccc1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1 1559243815 LMFVOGFNGSMTEH-UHFFFAOYSA-N 431.492 4.399 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2nc(-c3c[nH]c4ccccc34)cs2)cc1 1559966840 MLJWZQSDFSHHMR-UHFFFAOYSA-N 449.580 4.307 10 10 IICE COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1565453007 PZXFSKCZAAMDON-YADHBBJMSA-N 432.996 4.038 10 10 IICE CN1CCCc2cc(CNC(=O)C[C@H](Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1583628348 UPSPWWQVWFLVSA-QFIPXVFZSA-N 437.584 4.211 10 10 IICE CCCNC(=O)CCn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1614962540 YXQZMKOHXFJWKZ-UHFFFAOYSA-N 438.620 4.089 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3cccc(Br)c3)no2)cc1 1616532483 CCNOXVPNQUXBFP-UHFFFAOYSA-N 444.329 4.321 10 10 IICE CC(C)[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1617538605 GMENFQGBXICUEY-ATLLOTDBSA-N 445.554 4.182 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@](O)(c3ccccc3)C(F)(F)F)c2C)cc1 1628763066 CLHVOZVVPVJGEF-QFIPXVFZSA-N 432.442 4.283 10 10 IICE CCOC(=O)C1=CC[C@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)C1 1632879193 NTNDPIYLMVKMFL-INIZCTEOSA-N 431.330 4.238 10 10 IICE CN(C)c1ccc(CNC(=O)COc2ccc(Br)cc2C(F)(F)F)cc1 1641170662 WQHLOAOKBUITAP-UHFFFAOYSA-N 431.252 4.229 10 10 IICE O=[N+]([O-])c1cnc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(Br)c1 1650729027 YYYUCLWYEJMTDY-CYBMUJFWSA-N 441.713 4.188 10 10 IICE COC(=O)c1c(NC(=O)CN(C)c2ccc(OC)c(Cl)c2)sc2c1CC[C@@H](C)C2 1653680064 KEGSZQLMIDWWSI-GFCCVEGCSA-N 436.961 4.396 10 10 IICE COC1CCN(c2ccc(CN3CCN(Cc4csc(C(C)(C)C)n4)CC3)cc2)CC1 1657088643 GWWYSMVJZVAWFJ-UHFFFAOYSA-N 442.673 4.374 10 10 IICE O=C(NCc1cc(Cl)ccc1O)N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1 1682724530 AESQCTUBRBWVKH-OAHLLOKOSA-N 432.858 4.002 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCCC[C@H](NC(=O)OC(C)(C)C)C1 1683425252 NEZPSZIUSQNJHK-CTNGQTDRSA-N 446.636 4.471 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1 1683875411 XJPPXUCARGSFQY-MRXNPFEDSA-N 444.746 4.057 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1Cc1ccc(N(C)C)c(F)c1 1693998434 MQGYFKSRAHVMBW-AWEZNQCLSA-N 433.963 4.068 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)cc2C)CCS1 1709365670 JQFHYODRSAXVPU-JOCHJYFZSA-N 436.629 4.018 10 10 IICE Cc1noc(CCCn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)n1 1726437803 UEKNPAFVFBFPCM-UHFFFAOYSA-N 437.592 4.037 10 10 IICE CC(C)c1nnc(N(Cc2ccco2)C[C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1750617107 RABIVDCHZWPASN-HXUWFJFHSA-N 441.551 4.434 10 10 IICE CCc1ccc(-c2nnc(N3CCC(CO)CC3)n2CCCSc2nccs2)cc1 1764468028 XRDNLHOEDZZPPQ-UHFFFAOYSA-N 443.642 4.355 10 10 IICE CCC(=O)NCc1ccc(OC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1858893512 WRNXICBZNJTKGC-UHFFFAOYSA-N 428.444 4.099 10 10 IICE CCCCC(=O)Nc1cc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)ccn1 1860501377 CSAIDMBEBXCAKU-UHFFFAOYSA-N 427.460 4.238 10 10 IICE CCN(C(=O)C(C)(C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccccc1 1866213200 SVNQBSGWMUDMSE-UHFFFAOYSA-N 440.499 4.480 10 10 IICE COc1ccc(O)c([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1 1951376069 KCYFMCMZOVLWNU-QFIPXVFZSA-N 433.460 4.455 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)[C@@H](O)c1ccc(N2CCCC2)cc1 1999522244 XHPZGOQCIPCANG-PKTZIBPZSA-N 426.557 4.430 10 10 IICE C[C@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccc(F)cc1O 2084723939 CEEYLFWRDCOPOF-GHTZIAJQSA-N 443.563 4.303 10 10 IICE COCCOCCN(Cc1ccccc1)c1ccc(C=CC(=O)O)c(Br)c1 2152223241 LPYUHUORBMPZKC-UHFFFAOYSA-N 434.330 4.217 10 10 IICE COc1ccccc1OCCNC(C)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 2313682625 HNNQTXHRJPFLIA-UHFFFAOYSA-N 427.504 4.389 10 10 IICE O=C(COc1ccc(C=C2SC(=S)NC2=O)cc1)Nc1cccc(C(F)(F)F)c1 2314487732 RKMLUZZOENPHGQ-UHFFFAOYSA-N 438.452 4.212 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2314827680 KDSBYGXAMWLLPJ-UHFFFAOYSA-N 433.898 4.088 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N([C@@H]2CC(=O)N(c3ccccc3)C2=O)C1=O 2314834171 ZVXPEIXTKZGELO-GOSISDBHSA-N 434.542 4.166 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccc(C)cc3)C2=O)ccc1O 2314837805 WWQGSXDXEFRNCE-CQSZACIVSA-N 442.562 4.328 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)cc1OC)C(=O)O 2314931271 DGBVLVPROAWWQG-OAHLLOKOSA-N 447.509 4.482 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3cccc(F)c3)C2=O)ccc1O[C@H](C)C(=O)O 2314935052 MTUSOMKVDCPWTD-GFCCVEGCSA-N 447.509 4.482 10 10 IICE CC[C@@H](CCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2352932806 RGQKDEDNLPCMOO-ZDUSSCGKSA-N 429.355 4.020 10 10 IICE Cc1ccc(OCCn2cc(/C=C3\C(=O)N(C)C(=S)N=C3O)c3ccccc32)cc1C 33457429 UVOOXMLVNZFQJY-MOSHPQCFSA-N 433.533 4.434 10 10 IICE CC(C)c1ccc(/C=C2/SC(=S)N(CCC(=O)N3CCCC[C@@H]3CCO)C2=O)cc1 33583219 QEUNXIXALCYEBK-NGYXKBBWSA-N 446.638 4.165 10 10 IICE CCOC(=O)Cc1sc(NS(=O)(=O)c2ccc(Cl)cc2)nc1-c1ccccc1 71556437 HMQVECDYSRRNRW-UHFFFAOYSA-N 436.942 4.370 10 10 IICE CCN(CC)c1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1 103314832 OHYBOMZCZSGJCB-XMHGGMMESA-N 425.579 4.387 10 10 IICE CCN1C(=O)/C(=C/c2c(Oc3cc(C)cc(C)c3)nc3ccccn3c2=O)SC1=S 213162402 FDIFBIFZWPEYRF-ATVHPVEESA-N 437.546 4.325 10 10 IICE CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 303683525 NEEKCRVXEGQVRR-SFHVURJKSA-N 431.374 4.375 10 10 IICE CC(=O)Nc1nc(C)c(S(=O)(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)s1 727244060 REYONSQXODHOJS-UHFFFAOYSA-N 444.563 4.487 10 10 IICE CC1CCN(c2ccc(CNC(=O)N(C)[C@H]3CCN(c4ccccc4F)C3=O)cc2)CC1 732890388 GKVQKSFCFXILPV-QHCPKHFHSA-N 438.547 4.009 10 10 IICE C/C=C/c1ccc(OCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 742805567 LRBLALASPCGZPH-YZTRRJNXSA-N 446.494 4.494 10 10 IICE Cc1cc(C(=O)COC(=O)C2CCC(=O)CC2)c(C)n1-c1cccc(Br)c1 751677346 ZIHFBHBJCYYUQN-UHFFFAOYSA-N 432.314 4.342 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3cc(C)n(-c4ccccc4Br)c3C)[C@@H]2C1 755203423 PEHUOXSUEVCMPZ-HBGVWJBISA-N 447.373 4.265 10 10 IICE C[C@H](NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccc(N(C)C)cc1 776110814 HZALYRRWZPHUQG-HNNXBMFYSA-N 435.494 4.196 10 10 IICE COc1cc(Cl)cc(CN2CCN(C(=O)OC(C)(C)C)C[C@H]2c2cccnc2)c1O 800531498 CEGHRTKEMWMUNQ-SFHVURJKSA-N 433.936 4.243 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1cccnc1Oc1cccc(F)c1 806384903 QALJKTUXDVPJOW-UHFFFAOYSA-N 446.276 4.481 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1C[C@@H]1c1ccccc1 920226898 RRVGPNDSIOBSGK-NVZRXXAXSA-N 428.604 4.402 10 10 IICE COC(=O)[C@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c2ccccc2O1 1124798548 CDASCBSNCJJRCO-JOCHJYFZSA-N 438.911 4.257 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150347052 DLHHSZQTWVVEMU-KRWDZBQOSA-N 438.902 4.317 10 10 IICE CCO/C=C/[C@@](O)(CNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)C(F)(F)F 1159754010 VYLWGMOWYONVMH-JBVUFVISSA-N 430.854 4.321 10 10 IICE COc1ccc(N2CCN(CCNc3ccnc(CSc4ccccc4)n3)CC2)cc1 1185088395 DXTIWFAYJWCDAN-UHFFFAOYSA-N 435.597 4.012 10 10 IICE CCOC(=O)N1CCC([C@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1 1226945343 DLYQSXCXEORMBG-SFHVURJKSA-N 426.561 4.150 10 10 IICE CC1(C)[C@H](c2ccccc2F)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751262 YBLCDKAZXYKQKW-SFHVURJKSA-N 447.501 4.418 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)cc1 1293125572 MXIONQOYTCAELV-OAQYLSRUSA-N 449.595 4.476 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1COCCO1 1293898808 IIGFIXFHALQRNF-XMSQKQJNSA-N 437.588 4.393 10 10 IICE COc1ccc(-c2nnc(N3C[C@@H](C)[C@@H](F)C3)n2CCCSc2nccs2)cc1 1300089194 PMVJVNOUOBPESH-PBHICJAKSA-N 433.578 4.387 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C[C@H](C)O1 1306397387 MLWFEHFXJZMOFP-GHTZIAJQSA-N 437.588 4.127 10 10 IICE COC(=O)c1ccccc1NC(=O)CN(Cc1ccccc1)c1ccc(OC)c(OC)c1 1308173295 MHQRRULSCXJCNB-UHFFFAOYSA-N 434.492 4.136 10 10 IICE CCOc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1349609129 GFZNADLNJRKWNW-AQTBWJFISA-N 430.526 4.454 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1355878933 OSTOHBLIDKTZMH-GCJKJVERSA-N 431.939 4.160 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCOc3ccc(C(F)(F)F)cn3)ccc21 1435533624 NMLUHRJULLMACZ-UHFFFAOYSA-N 435.446 4.127 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2cc(F)ccc2Br)cc1 1442599563 HAIUMTJPFNQROM-HXUWFJFHSA-N 449.364 4.405 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@H]3CN(Cc4ccccc4C)CCO3)c2C)c1 1454918274 FIMNLOQUOQLFCH-VWLOTQADSA-N 431.580 4.342 10 10 IICE CCOC(=O)CC(=O)CSCC(=O)c1cc(C)n(-c2ccc(F)c(Cl)c2)c1C 1458982866 UYMAUOGRSTZKAW-UHFFFAOYSA-N 425.909 4.325 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CNC(C3CCCCC3)C3CCCCC3)CC2)cc1 1460688055 IPSCLKHSDZJLAS-RUZDIDTESA-N 443.676 4.297 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ccc(OC(F)F)cc2)cc1 1463716187 CYDKZICVATYXEH-UHFFFAOYSA-N 426.463 4.409 10 10 IICE CCCN(Cc1ccccc1O)C(=O)CSc1nc2ccccc2nc1N1CCCC1 1465845986 LDISLMLPFLMPMH-UHFFFAOYSA-N 436.581 4.467 10 10 IICE CCOCc1nnc(N2CCC[C@H]2c2cccs2)n1Cc1ccc(N(C)C)c(F)c1 1503090872 DLCLHUCBLODIJC-IBGZPJMESA-N 429.565 4.471 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c1 1524949218 BSWMJENTUAQXGM-UHFFFAOYSA-N 435.955 4.275 10 10 IICE O=C(COc1ccc(C(F)(F)F)cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1527058247 UNUCGLYQUWCYCR-UHFFFAOYSA-N 425.362 4.498 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)CN2CCOCC2)cc1 1528022204 XCOIJKGKNLRBKX-QHCPKHFHSA-N 431.580 4.457 10 10 IICE CCC1(CC)CN(C(=O)/C=C\c2cncc(C(=O)NC)c2)c2ccc(Br)cc21 1532619576 LXJPMSDDVDCQOH-TWGQIWQCSA-N 442.357 4.322 10 10 IICE COc1cc(C)cc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1534464046 AMFNZQBHOCSWFY-UNOMPAQXSA-N 444.553 4.050 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3ccc(Br)cc3F)CC2)cc1 1545929559 AVHDDXHXAWXDSP-UHFFFAOYSA-N 435.337 4.268 10 10 IICE CN1CCCc2cc(Cn3c(Cc4ccccn4)nnc3N(C)CCC(F)(F)F)ccc21 1554360350 VWLLOBIHCPTARM-UHFFFAOYSA-N 444.505 4.083 10 10 IICE Cc1ccc(Oc2cccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)c2)c(C)c1 1587630502 LMASPZZAJBTTJO-UHFFFAOYSA-N 426.494 4.425 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCO[C@](C)(C(C)(C)C)C1 1611964261 QPWRCNASOWATPU-BWKNWUBXSA-N 441.620 4.194 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@H]1CCCC2(CCC2)O1 1616245299 LLGGKRBZTWPABX-GFWHJHDHSA-N 448.585 4.025 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(C)c1 1622250966 GFHJGVJCEKDISW-UHFFFAOYSA-N 428.330 4.499 10 10 IICE Cc1cccc(C[C@@H](CO)NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1625246951 HGDXVAKICUEFJK-IBGZPJMESA-N 441.369 4.498 10 10 IICE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1626822512 POSXBANYZZSLNE-HXUWFJFHSA-N 443.382 4.348 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 1626885532 BRYZVPMAKMVBFZ-IBGZPJMESA-N 447.501 4.169 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](C)[C@H]2C(=O)OC(C)(C)C)cc1 1626995294 OBZGMVFIVSWTPC-OSPHWJPCSA-N 438.568 4.418 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C3CCCCC3)C2)cc1 1627153947 CZPHVGCZGUPPOZ-AVRDEDQJSA-N 445.604 4.111 10 10 IICE Cc1ccc(C(=O)NCc2cc(OCC(F)F)ccn2)cc1-n1c(C)cc(C=O)c1C 1632876760 HKBKLUKJCKGPGJ-UHFFFAOYSA-N 427.451 4.184 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2nc3cc(Br)cnc3[nH]2)c1 1641292574 UJKBBGOKAWMFQM-UHFFFAOYSA-N 438.285 4.193 10 10 IICE CCOC(=O)C1=C(CSc2ncc(C(C)(C)C)s2)NC(=O)N[C@H]1c1ccccc1 1643770518 GMWDMAUOPPHFMO-KRWDZBQOSA-N 431.583 4.404 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SC[C@H](C)S(C)(=O)=O 1651677135 NTPPBVPFBPMMKB-ZDUSSCGKSA-N 431.421 4.494 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)c1cnn(C)n1 1651677233 RZSLQIZOOIACFB-UHFFFAOYSA-N 434.363 4.072 10 10 IICE COc1cc(C(C)=O)c(OC)cc1OCC(=O)c1cc(C)n(-c2ccc(F)cn2)c1C 1656347104 GQFSOTIIXHHFQV-UHFFFAOYSA-N 426.444 4.110 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3Cc4cc(Br)ccc4C[C@@H]3C)C2)cc1 1682646603 UQWUJVYWOOKYRZ-HNAYVOBHSA-N 444.373 4.193 10 10 IICE CN1CC[C@H](CNC(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccc(Cl)c(F)c1 1685956535 ZRINDWOVWHMQIJ-BFUOFWGJSA-N 426.319 4.330 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1696364450 LRPAPBKLGQQWBK-NRFANRHFSA-N 448.615 4.324 10 10 IICE COc1ccccc1OCc1nnc(N2CC[C@H](C)C2)n1CCCSc1nccs1 1697613136 PRKPUDCJTCODQQ-INIZCTEOSA-N 445.614 4.351 10 10 IICE CC[C@@H](C)CN(C)c1nnc(C(=O)NC(C)C)n1Cc1ccc(N2CCC(C)CC2)cc1 1708572041 MAROZQCTWPQEBD-LJQANCHMSA-N 440.636 4.183 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)C1 1741382630 BJFOKTPAFUSAIP-MRXNPFEDSA-N 431.635 4.190 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)CCc2cnccn2)cc1 1764939672 VKFMLWYUMOKFGN-UHFFFAOYSA-N 435.620 4.230 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCC[C@@H]4C)nc(-c4cccnc4)n3)CC2)cc1 1868003032 VHGKGRCEFBOJEA-FQEVSTJZSA-N 444.583 4.253 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1ccc(O)c(O)c1 1952824463 BNFPPMNSVJBPMO-YKSBVNFPSA-N 445.471 4.495 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](CNCc1cccc(Br)c1O)C2 2103450757 IAXVOPZOAQDPKL-MKZZRHPPSA-N 425.367 4.422 10 10 IICE Cc1ccc(NC(=O)CN2C(=O)NC(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)cc1 2297313851 WGVMIZPFGGJCKW-UHFFFAOYSA-N 446.482 4.073 10 10 IICE COC(=O)c1ccc(N2C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)cc1 2297456761 MJFAILXRFZNXAG-UHFFFAOYSA-N 434.882 4.441 10 10 IICE CCCC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323815942 DSTCUZHLVUIQRI-LBPRGKRZSA-N 432.336 4.433 10 10 IICE COC(=O)Cc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526625606 UFPKBYWBIDYHAP-HSZRJFAPSA-N 449.434 4.010 10 10 IICE C[C@H](NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(N2CCOCC2)cc1 732456356 OQTRGFNTAOPJOK-ZZMXOZIFSA-N 448.611 4.079 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3cc4ccccc4o3)cs2)cc1 733730656 BZYRXBGSPCGNRT-UHFFFAOYSA-N 428.491 4.073 10 10 IICE CCCCS(=O)(=O)Nc1ccc(NS(=O)(=O)/C=C/c2ccc(Cl)cc2)cc1 740813247 ZSGYDEFPAIVWGQ-WYMLVPIESA-N 428.963 4.294 10 10 IICE Cc1ccc(CC[C@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 743554348 BPPKENUSUYBJFU-HNNXBMFYSA-N 439.478 4.264 10 10 IICE CCN(CC1CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1)C(=O)OC(C)(C)C 745974291 UOYPYEXXZUNGRD-NTMALXAHSA-N 447.532 4.254 10 10 IICE C[C@@H](NCc1ccc(OCc2ccccc2)cc1O)c1cccc(NS(C)(=O)=O)c1 753551448 LWSGZMZFAMPDNU-QGZVFWFLSA-N 426.538 4.194 10 10 IICE CCc1ccc(CC)c(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)c1 759988231 QRQSQZZQFPNRLS-UHFFFAOYSA-N 427.545 4.191 10 10 IICE Cc1ccc([C@@H](NCc2cc(C)cc(Br)c2O)[C@@H](C)S(C)(=O)=O)cc1 798088164 IJVSRBDXBAPIPB-KDOFPFPSSA-N 426.376 4.036 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccc(C(F)(F)F)c2)n1C[C@@H]1CCOC1 812409329 YBTZQOYTYWYOHU-HNNXBMFYSA-N 432.446 4.342 10 10 IICE COc1ccc(N(CC(=O)N2[C@@H](C)CCC[C@H]2C)CC(=O)N2[C@@H](C)CCC[C@H]2C)cc1 914866977 CNMYTDJSDXBLNF-FXELSEDVSA-N 429.605 4.081 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 1125162358 QXQFXEOZVBHSRN-UHFFFAOYSA-N 443.459 4.456 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(NC(=O)C4CC4)c3)cc2Cl)C1 1128490613 WUOFCPJXCIWROG-OAHLLOKOSA-N 426.948 4.250 10 10 IICE COC(=O)c1cn(CC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c2ccccc12 1132264659 ZIDIQMHBBPBZPW-UHFFFAOYSA-N 429.520 4.460 10 10 IICE C[C@H](NC(=O)C1CC2(C1)C[C@H](NC(=O)OC(C)(C)C)CCS2)c1ccc(N(C)C)cc1 1138363830 RFHKQXQNLAGRDX-WZISEMEKSA-N 447.645 4.499 10 10 IICE Nc1ccc(C(F)(F)F)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150352851 AVUIDGRRQIDUNP-HNNXBMFYSA-N 427.854 4.041 10 10 IICE Cc1cc(CC(=O)NCc2nnc3ccc(Cl)cn23)c(C)n1-c1ccc(Cl)cc1 1167481435 NSESUWCTERRJBN-UHFFFAOYSA-N 428.323 4.303 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CCC(=O)OC)C(C)C)sc(C)c1-c1ccccc1 1190953468 DJYCYGFUKGSTHB-UHFFFAOYSA-N 446.569 4.112 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)Cc3cccc(Cl)c3)[C@@H](C)C2)c1O 1191279120 WAZYJPAEHURZGJ-AWEZNQCLSA-N 435.351 4.177 10 10 IICE CCOc1ncc(C)cc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1274119800 WYUYMVZDKVVVQK-LFIBNONCSA-N 447.607 4.470 10 10 IICE CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1287659686 APEWPNNAVXAWIS-MDACWZTJSA-N 425.598 4.277 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@]2(C)c2cccc(Br)c2)N(C)C)cc1 1289602915 YBJYAPYNACKKHO-QNWVGRARSA-N 444.417 4.212 10 10 IICE CC[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1nnc2n1CCCCC2 1292525481 BKPUDWDONWGAQZ-QFIPXVFZSA-N 433.556 4.035 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]nc1-c1c(F)cccc1F 1294162121 XPFRSVIBAWTKBY-CYBMUJFWSA-N 448.420 4.355 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C3)c2C)cc1 1447015595 XWWNPRQMNXZRKM-MJGOQNOKSA-N 441.572 4.478 10 10 IICE CCN1CCC(N2CCCN(C(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2)CC1 1469129814 NCERZUMCQQTKPI-UHFFFAOYSA-N 436.644 4.343 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1c(O)cccc1O)c1ccccc1Br 1472063492 LFXZUENREAYHIU-UHFFFAOYSA-N 441.281 4.043 10 10 IICE C[C@H](NC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1ccc(N(C)C)cc1 1478325273 WNLPNGOMHZVGLC-DJJJIMSYSA-N 435.355 4.225 10 10 IICE CO[C@@H](Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1517860281 MGAHGBCYULDAHJ-YADHBBJMSA-N 427.593 4.037 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 1528923877 FHLBBNLIGHIFCY-WIYYLYMNSA-N 442.003 4.314 10 10 IICE CCc1ccc(Br)cc1C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1530375687 ALIOABQETQDWFA-UHFFFAOYSA-N 448.380 4.223 10 10 IICE COC(=O)COc1c(C)cc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1C 1534542887 MPYQCBICVMYHGE-UHFFFAOYSA-N 434.536 4.235 10 10 IICE CCOc1ccc(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)c(C(=O)OC)c1F 1537634590 ZPOSNPGBZFWBML-UHFFFAOYSA-N 442.487 4.481 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccc(N4CCO[C@H](C)C4)nc3)c2C)c1 1540791413 CLSACILWRXSMNF-HXUWFJFHSA-N 432.568 4.261 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3occc3NC(=O)OC(C)(C)C)cc2F)C[C@@H](C)O1 1542113194 QWDXICFONXGHFR-GASCZTMLSA-N 447.507 4.309 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)[C@H]1c1ccc(OC)cc1 1544165007 SRZQVWMNJYGTJP-JYFHCDHNSA-N 449.595 4.084 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc3n(n2)CCC[C@@H]3NC(=O)OC(C)(C)C)cc1 1544580089 DUYVFZUMDAPECU-IBGZPJMESA-N 441.576 4.019 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1ccnc1C 1555475132 ODASCGMKYKZMEZ-UHFFFAOYSA-N 447.587 4.030 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](c3ccc(F)cc3)c3cnn(C)c3)c2C)cc1 1556265857 ONEDWLVCWLXFKH-XMMPIXPASA-N 432.499 4.495 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3Cc4cc(F)ccc4NC3=O)cc2Cl)C1 1556369234 JILCPMPVLCKFCO-KDOFPFPSSA-N 429.923 4.143 10 10 IICE Cc1cc(C(=O)NC[C@H](O)c2ccccc2Br)c(C)n1-c1ccc(F)cc1 1557011655 NQXPDKAFVOROAP-FQEVSTJZSA-N 431.305 4.459 10 10 IICE COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559698133 QKALLVIGFUUMLS-JKSUJKDBSA-N 428.488 4.148 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)Cc2ccns2)sc(C)c1-c1ccccc1 1559985720 ZMFQGFYEYKORSZ-UHFFFAOYSA-N 429.567 4.427 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1c(Cl)cccc1Br 1596684565 SHDAPVPXHXARAV-UHFFFAOYSA-N 445.691 4.147 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCCOc3cccc(Br)c3)CC2)cc1 1623429684 LVXBHFWRMDESHZ-UHFFFAOYSA-N 447.373 4.356 10 10 IICE Cc1ccc(C(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)cc1-n1c(C)cc(C=O)c1C 1626774479 NPXHWSWBFPHNMO-UHFFFAOYSA-N 439.556 4.344 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccc(-c2ccccc2)o1 1631531640 XHDRFYNCJSPNJN-UHFFFAOYSA-N 427.884 4.440 10 10 IICE COCCNC(=O)[C@H](CC(C)C)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1631784920 YUOLMCNLZSWLOS-QHCPKHFHSA-N 427.589 4.125 10 10 IICE C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)[C@@H](OC1CCOCC1)c1ccccc1 1632094470 WWTJWYDCDXJRNY-JLCFBVMHSA-N 427.522 4.368 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1 1632701571 IQEFERDCMJKWMK-HNNXBMFYSA-N 433.932 4.312 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)CN(C(=O)c1ccc(N=NC(N)=O)cc1)CCO2 1633379207 HRJKBMLNSWTJJB-UHFFFAOYSA-N 439.472 4.231 10 10 IICE CCCc1c(C(=O)NCc2cccc(Br)c2O)nnn1-c1cccc(Cl)c1 1640084332 RYFFHGQZMMDMKO-UHFFFAOYSA-N 449.736 4.271 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CC(=O)Nc1ccc(Cl)cn1 1641744234 WNIVKKJEKSWHRQ-UHFFFAOYSA-N 430.936 4.151 10 10 IICE CC(C)C[C@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1641822576 LMERFTOOMNSTKF-RZUBCFFCSA-N 433.612 4.346 10 10 IICE CNS(=O)(=O)c1ccc2c(c1)N(CC(=O)Nc1ccc(N=Nc3ccccc3)cc1)CC2 1653587102 IYSGRFDYVUEDHY-UHFFFAOYSA-N 449.536 4.011 10 10 IICE COc1ccc(CNC(=O)c2nn(-c3c(Cl)cc(Cl)cc3Cl)cc2O)c(O)c1 1654516022 FAHAXGSZZMJPQL-UHFFFAOYSA-N 442.686 4.182 10 10 IICE CCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 1683944871 LORKDODGZUSYPA-KIFXHHALSA-N 436.600 4.141 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCO[C@@H](C)C1 1693995499 HSHKWJXQQCIZRC-JAXLGGSGSA-N 441.620 4.080 10 10 IICE C#CCN(CC#C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCN(C)C(C)C 1705574433 DIDLKLOCXQWKHT-UHFFFAOYSA-N 442.611 4.156 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCS[C@@H](C)[C@H]2C)cc1 1710027016 VPIYFYSNNGZOHT-WSTZPKSXSA-N 429.634 4.007 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N2CC[C@H](COC)C2)cc1 1710028614 ZBJSSUMFKZHOBL-QFIPXVFZSA-N 425.621 4.378 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3ccccc3C)n2CCCSc2nccs2)C1 1712263992 KVWZHXDVGSBZAV-QGZVFWFLSA-N 429.615 4.365 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)CC(N)=O 1760822506 AHIYLSPJBNAIQZ-SFHVURJKSA-N 434.588 4.409 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1nccs1 1761844279 WCDBUVDPOHQUCK-QGZVFWFLSA-N 426.590 4.022 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1C[C@H](SC)C(C)(C)C 1770179045 CWXWNGAOPAPDFA-IHPCNDPISA-N 448.633 4.122 10 10 IICE CCCc1nc(N2CCN(c3ccc(OC)cc3)CC2)cc(N2CC[C@H](c3ccco3)C2)n1 1869224512 NXSSEVWJFKMJQV-FQEVSTJZSA-N 447.583 4.351 10 10 IICE CC(=O)Nc1ccc(Br)c(C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c1 1890922386 WMMJKTBGXZQNML-LPHOPBHVSA-N 442.357 4.326 10 10 IICE Cc1cc(O)c([C@H](C2CCC2)n2nc(C(F)(F)F)c(C(N)=O)c2Br)cc1C 2080033158 JCGYOJYMQSAOIW-AWEZNQCLSA-N 446.267 4.475 10 10 IICE CCOc1cc(C=C2SC(=S)N(C3CCCCC3)C2=O)ccc1O[C@H](C)C(=O)O 2314936098 VAPFAUQTCLUYAW-CYBMUJFWSA-N 435.567 4.471 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 2323866158 XBVMIXWHHXLJKN-OAHLLOKOSA-N 448.909 4.145 10 10 IICE Cc1ccc(CNC(=O)[C@H](CNC(=O)OC(C)(C)C)CC2CC2)c(O)c1Br 2381137407 NRBWBOZXGFQXPL-HNNXBMFYSA-N 441.366 4.020 10 10 IICE CCOc1cc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3cccc(C)c3)C2=O)ccc1O 15045693 CKXWPJZVKJWAGF-YQNUULROSA-N 442.562 4.328 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(F)cc2)N2CCc3ccccc3C2)cc1 16914136 FTCFXIJHWYZGIV-SANMLTNESA-N 431.555 4.350 10 10 IICE C[C@H](OC(=O)c1cc2ccccc2[nH]1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 22099060 VHTUBTSOEBRQQR-AWEZNQCLSA-N 438.439 4.127 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4nc5ccc(C)cc5s4)c3N)CC2)cc1 40727801 KPEFSGMUYYTWIH-UHFFFAOYSA-N 447.568 4.056 10 10 IICE COCCOc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1F 435519334 YHTFLCRCCLPLEO-UHFFFAOYSA-N 439.531 4.211 10 10 IICE CCOc1ccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@H]2c2ccc(O)c(O)c2)cc1 526278783 DTNLAGCTLFZLSP-QHCPKHFHSA-N 443.459 4.430 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)c1O 769498473 JAVSRDLPLILERI-VDGAXYAQSA-N 442.943 4.144 10 10 IICE O=S(=O)(Cc1ccc(Cl)cc1Cl)N(Cc1ccccc1O)C[C@H]1CCCO1 779624041 KBOCUBUBWDNHMX-QGZVFWFLSA-N 430.353 4.210 10 10 IICE CCCc1ccc(-c2nc(NS(=O)(=O)c3ccc(C(=O)NC)cc3)sc2C)cc1 784107959 GZPIVTBFVWHYNQ-UHFFFAOYSA-N 429.567 4.231 10 10 IICE Cc1c(NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cccc1N1CCNC1=O 786310889 CGGCJVHAQDZDKH-UHFFFAOYSA-N 431.540 4.296 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[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)cc1 787682365 FUSBWYKLCYWCQP-RIRWTTTLSA-N 442.563 4.407 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ncc(Cc4ccccc4F)s3)CC2)cc1 806787339 GAXNVQQILGZWOP-UHFFFAOYSA-N 426.517 4.236 10 10 IICE O=C1/C(=C\c2ccc(F)c(-c3cccs3)c2)SC(=S)N1CCN1CCOCC1 917642811 RPKGWDDRPLMIFV-QGOAFFKASA-N 434.583 4.088 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1 1124549650 NXZHFYIJTOACOK-GMAHTHKFSA-N 425.960 4.118 10 10 IICE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1125519529 XMWNNLZHHYSYST-KBMIEXCESA-N 447.620 4.278 10 10 IICE COC[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(F)c(F)c1 1127667715 YAQXFLGOUWOYCS-QFIPXVFZSA-N 441.522 4.190 10 10 IICE Cc1cc(CC(=O)N2CCCNC(=O)[C@@H]2Cc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1129295678 UAXCLJFKCSREPA-DEOSSOPVSA-N 449.982 4.250 10 10 IICE COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCSc1nccs1 1136661670 MNWNYGJUVZUPQR-MRXNPFEDSA-N 437.587 4.016 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCOc4c3ccc(Cl)c4Cl)C2)cc1 1248489891 IICQKEIUQGHMEV-FZKQIMNGSA-N 436.339 4.404 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](CC(N)=O)c3ccccc3Cl)c2C)c1 1254072997 DXBJAXBSBVJFSY-JOCHJYFZSA-N 438.959 4.472 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)CC(F)(F)F 1276234990 IWSKJGZJMFPHPM-KYJZABPNSA-N 434.480 4.122 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C)[C@H]3C)n2CCCSc2nccs2)n1 1304752543 XMWCTNRGAGTNTO-WMLDXEAASA-N 431.635 4.013 10 10 IICE COCC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)C1 1315991861 LSORNCZHBDTDGD-TZIWHRDSSA-N 437.588 4.250 10 10 IICE Cc1sc(NC(=O)Cc2nc(C3CC3)nn2C)c(C(=O)OC(C)C)c1-c1ccccc1 1349836829 VNBMEYVGGYDHMR-UHFFFAOYSA-N 438.553 4.476 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccc(-c4ccc(F)cc4)cc3F)cc2)CC1 1439334073 WZIYPFCGWVTKBR-UHFFFAOYSA-N 449.501 4.264 10 10 IICE CCN(CC)C(=O)COc1ccc(NC(=O)c2ccc(N=NC(N)=O)cc2)cc1Cl 1464121813 OIYLROGHGMSEFD-UHFFFAOYSA-N 431.880 4.002 10 10 IICE Cc1cccc(CN2CCO[C@@H](CNC(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)c1 1471037950 WIVYQRCFTDAZHG-SANMLTNESA-N 446.595 4.103 10 10 IICE COc1cccc([C@@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1473327722 WDBWISXQXZZDLB-CVEARBPZSA-N 428.488 4.148 10 10 IICE CC[S@@](=O)CCn1c(CC2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1516872333 KFIRWSNQWBCZEJ-WJOKGBTCSA-N 443.661 4.016 10 10 IICE CCSCCCn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1516936927 BHOASUBCUAVUDK-UHFFFAOYSA-N 429.634 4.099 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@H]1CCc2ccccc21 1521696655 XPQDNBHNDUGDOR-VJOZSWGJSA-N 440.565 4.263 10 10 IICE CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)NCc1ccc(N(CC)CC)cc1 1534245582 FSMNQOPNSSGFKZ-LEWJYISDSA-N 427.545 4.413 10 10 IICE Cc1ncc([C@H](C)NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)s1 1534717844 JYVILIXHTKEPSD-HOXUKUGESA-N 437.637 4.372 10 10 IICE CN(C)c1ccc(F)cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1537145803 WWWBOEXBXNJPSK-WOJGMQOQSA-N 447.532 4.261 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(Sc3nncn3C)cc2)c1 1540717369 GBRHUQGEVPQENI-UHFFFAOYSA-N 431.521 4.439 10 10 IICE CCOc1ccccc1C(F)(F)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1542490047 BIGVLGVOXQLVSE-HXUWFJFHSA-N 432.511 4.451 10 10 IICE O=C(NCCCSc1nccs1)c1c(F)c(F)c(Br)c(F)c1F 1542956260 PCPALCWYZBBPRK-UHFFFAOYSA-N 429.258 4.374 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@@H](C(=O)OC(C)(C)C)CC[C@H]2C)cc1 1570475134 GUUPHJVIJRTQHH-UTKZUKDTSA-N 438.568 4.418 10 10 IICE CC[C@H](C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(=O)OC(C)(C)C 1584068278 YGVZCRWHYYZIKA-UUOWRZLLSA-N 441.616 4.280 10 10 IICE Cc1cc(C(=O)N2CCN(CC(F)(F)F)CC2)c(C)n1-c1ccc(Br)cc1 1587737776 QONPAQGJVZAXRV-UHFFFAOYSA-N 444.295 4.177 10 10 IICE O=C(NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1cc2cc(O)c(O)cc2s1 1597677576 RHSJMTSTHNLUBN-UHFFFAOYSA-N 433.411 4.447 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1ccc(Cn2cc(Br)cn2)cc1 1622319308 DVISVPPCFDYURF-UHFFFAOYSA-N 428.330 4.452 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 1622664203 LHNVOBYFJXFPLQ-JOCHJYFZSA-N 436.552 4.422 10 10 IICE Cc1cc(C(=O)N2C[C@H](C(F)(F)F)OC[C@@H]2C)c(C)n1-c1ccc(Br)cn1 1623755833 YGUMIUBLNOWJTL-XHDPSFHLSA-N 446.267 4.043 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2coc(Sc3ncccn3)n2)cc1 1624286941 RKQFEFQYNVKFLY-UHFFFAOYSA-N 435.509 4.117 10 10 IICE CCOc1ccc(N2CCN(C(=O)CSc3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 1636702157 FUDYEOPXHNXKKP-UHFFFAOYSA-N 435.933 4.088 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(c4cccc(Cl)c4)CC3)cc2)CC1 1638007887 ZWDQVEQTXHZMBG-UHFFFAOYSA-N 426.992 4.181 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@@H](C(F)(F)F)[C@H](NC(=O)OC(C)(C)C)C2)c1O 1648351335 IRIXJEOFSQTCGL-HZPDHXFCSA-N 434.430 4.011 10 10 IICE CCOC(=O)CS[C@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)C(F)(F)F 1650763486 UBFAFDTUMPYISH-QGZVFWFLSA-N 446.466 4.190 10 10 IICE C[C@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(C(F)(F)F)CC1 1653472264 FHQGYFMPWQWSEO-CYBMUJFWSA-N 430.426 4.063 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](C)c1ccc(N2CCCOC2=O)cc1 1682890132 VCHMZDHLPZSYND-RTBURBONSA-N 438.572 4.399 10 10 IICE CCN(CCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1710152096 QJQXUYQJUGJVGW-UHFFFAOYSA-N 447.631 4.307 10 10 IICE COCCN(CC(C)C)c1nnc(C2CCCC2)n1Cc1ccc2c(c1)CCCN2C 1712441595 VPHFIKCXAFKLQI-UHFFFAOYSA-N 425.621 4.475 10 10 IICE CC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCC(=O)N(C)C)CC1 1751717700 XQEIQTMPUQMKCU-UHFFFAOYSA-N 446.599 4.377 10 10 IICE CC1CCN(c2ccc(Cn3c(C(=O)NC(C)C)nnc3N3CCCC3(C)C)cc2)CC1 1752209450 YXURAGPHKIIJLQ-UHFFFAOYSA-N 438.620 4.080 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)N2CCCCC2)cc1 1865982222 JCFHAAZCRIXLPR-NRFANRHFSA-N 430.936 4.271 10 10 IICE CCc1ccc2[nH]cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(=O)c2c1 1866416018 HVHWLDOPQBTCHQ-VWLOTQADSA-N 446.595 4.114 10 10 IICE CC[C@@H](C)N1C(=O)C(NCc2ccccn2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164202 QOIMAXARYCWOHU-QGZVFWFLSA-N 428.536 4.157 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)c(Br)c1 2188889451 YGDNJHYRSSEKAP-NQIIRXRSSA-N 427.342 4.258 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1O 2227750474 JZNAKZXSHAIMKU-QWHCGFSZSA-N 429.355 4.089 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@@H](N)c3occc3Br)cc2)CC1 2286068316 MPVCUEASAMDXHM-QGZVFWFLSA-N 436.350 4.147 10 10 IICE CC1=NN(c2ccc(Br)cc2C)C(=O)C1=CNC(=O)Nc1ccc(F)cc1 2297511456 LZRZKTCFMSVOKI-UHFFFAOYSA-N 431.265 4.325 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1ccccc1OC 2313577335 AYEIATJMMLLNPG-UHFFFAOYSA-N 428.282 4.335 10 10 IICE Cc1cccc(NC(=O)CCN2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)c1 2314828389 SRIOZZNHZACIQA-UHFFFAOYSA-N 427.507 4.133 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3ccc(O[C@@H](C)C(=O)O)cc3)SC2=S)cc1 2314929053 GNAPBMMGBAOWPO-ZDUSSCGKSA-N 427.503 4.147 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380753057 BOSWBKJTMGMKQU-ZFWWWQNUSA-N 441.366 4.163 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3ccc4ccc(=O)oc4c3)c2C)cc1 15042695 LASMAXDRWYRSEU-UHFFFAOYSA-N 431.444 4.249 10 10 IICE CC1=NN(c2ccc(Br)cc2C)C(=O)/C1=C/Nc1cccc2nsnc12 101123496 LYUVNJYEEIVOCT-UKTHLTGXSA-N 428.315 4.481 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3c(C)cc([N+](=O)[O-])cc3C)n2)cc1OC 748613596 SKXMMRUUHMXIBB-UHFFFAOYSA-N 449.510 4.153 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2ccc(F)cc2)cs1 761343994 VHJPMDLIRLNUNZ-UHFFFAOYSA-N 447.513 4.107 10 10 IICE COc1cccc([C@@H]2[C@H](NC(=O)NCc3ccc(N4CCCC4)cc3)CCN2C2CC2)c1 778620550 NNSDMYKUCXZFFY-JWQCQUIFSA-N 434.584 4.073 10 10 IICE Cc1cc(Br)c(O)c(CNCc2nnc3c(Cl)cc(C(F)(F)F)cn23)c1 781627838 WFGFZWZIOSDINV-UHFFFAOYSA-N 449.658 4.468 10 10 IICE Cc1c(NC(=O)NCc2ccc(N(C)C)cc2)nnn1Cc1ccc(C(F)(F)F)cc1 801796317 AHQCAWMRJFVCTJ-UHFFFAOYSA-N 432.450 4.041 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccc(NC(=O)c2ccccc2)cc1 804737846 RAOCJNNZBNJXNZ-UHFFFAOYSA-N 425.282 4.337 10 10 IICE COc1cccc(CNC(=O)NCc2cc(Br)ccc2O)c1OC1CCCC1 805111480 MUTNYYXPSWGHCT-UHFFFAOYSA-N 449.345 4.484 10 10 IICE O=C(N[C@H]1C[C@H]1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)OCc1ccccc1 814177175 XXEVBKGAUNDJNA-UIOOFZCWSA-N 449.595 4.050 10 10 IICE Cc1sc(NC(=O)c2cnc3n2CCOC3)c(C(=O)OC(C)C)c1-c1ccccc1 1124795917 VSGBZOFCBBICDR-UHFFFAOYSA-N 425.510 4.268 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N(CC(F)(F)F)C1CCC1 1125023061 ZQYRKMYXABQEHB-GDNBJRDFSA-N 446.491 4.360 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2([C@@H]3CCCCO3)CCC2)NC(=O)OC(C)(C)C)cc1 1136903831 MUDJFBONDKFKNT-SFTDATJTSA-N 445.604 4.174 10 10 IICE Cc1csc([C@H](C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1147504434 FUGRGKTZRISCQW-CRAIPNDOSA-N 432.590 4.003 10 10 IICE COC(=O)[C@@H](C)[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1149304946 YSIYEYLZVYKZND-BVZFJXPGSA-N 432.520 4.116 10 10 IICE CCc1ccc([C@@H]2CN(C(=O)OC(C)(C)C)CCN2C(=O)Cc2ccc(O)c(O)c2)cc1 1155506812 OXAJLXZEURFXFB-FQEVSTJZSA-N 440.540 4.023 10 10 IICE COC(=O)/C=C\c1ccc(N(C)CC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c([N+](=O)[O-])c1 1162644306 JNECDYABBNVEER-FPISAVPCSA-N 435.521 4.157 10 10 IICE CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NCc1cc(Cl)ccc1O 1225061403 GPUSTPHUXYKFII-PIGZYNQJSA-N 427.726 4.384 10 10 IICE O=C1[C@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CCN1c1ccc(F)cc1 1251907392 GCUHRPZEJUWXQJ-OAQYLSRUSA-N 425.504 4.181 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)C2CCN(CC(F)(F)F)CC2)CCCC1 1275883928 COJSYXRSTJGNJK-UHFFFAOYSA-N 437.506 4.014 10 10 IICE CC[C@H](C)c1nnc(N(C)CCC(F)F)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291453097 BIWUNVYCXHFQLL-KRWDZBQOSA-N 435.563 4.140 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1 1292382168 OHQDFYTTYDPVNO-IBGZPJMESA-N 431.920 4.065 10 10 IICE CC[C@H]1CCCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1293387489 VTHBHJXPJDBPHJ-PMACEKPBSA-N 441.620 4.059 10 10 IICE CCO[C@@]1(c2nnc(N3CCC[C@@H]3CC)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1314128317 JPNHUQYCKFVBQT-OFVILXPXSA-N 441.620 4.204 10 10 IICE CO[C@H](Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O)C(C)C 1315191803 IEZROHAXGJYVAH-GOSISDBHSA-N 448.365 4.049 10 10 IICE CO[C@@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC[C@H]1C 1315714928 DJHNTXNHAVOGFO-SJLPKXTDSA-N 429.615 4.445 10 10 IICE CC(C)(C)n1nccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1351283848 VFOUWWCSFDWMHH-QINSGFPZSA-N 432.546 4.007 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)sc2c1CCCC2 1353914447 NYAIYVUDEVIKIC-GFCCVEGCSA-N 448.491 4.073 10 10 IICE CC(C)CCN(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1359911762 XDNUOKNKHJDQAU-DEOSSOPVSA-N 447.599 4.054 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@H]2CCC[C@H]2C)c(C)n1-c1ccccc1 1361044802 FRPPBWMZWMBRKF-DBXWQHBBSA-N 448.615 4.489 10 10 IICE CCCS(=O)(=O)Nc1ccc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1454624367 MHEWFQXWBYMSPU-UHFFFAOYSA-N 439.581 4.484 10 10 IICE Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)N[C@H](C)c3ccccc3O)c2)cc1F 1454806749 NBCOEZPRBMAFTP-OAHLLOKOSA-N 428.485 4.132 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)c(C)n1-c1ccc(F)cc1 1458930022 BPUZKNSXEJXYKR-DEOSSOPVSA-N 437.446 4.022 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CCc2ccc(O)cc21 1470248148 FBEDUQLMJDRIBU-ZCWPUFOUSA-N 444.603 4.239 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cccc(N(C)S(C)(=O)=O)c3)c2C)c1 1472295325 BYDUZPFQZNWBCL-UHFFFAOYSA-N 439.581 4.037 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]2c2cc[nH]n2)sc(C)c1-c1ccccc1 1473426321 VGVNROZBOABVHM-GOSISDBHSA-N 438.553 4.399 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCO[C@@H](C(C)C)C2)cc1 1515524488 FDIZFBCCUCWUIS-HSZRJFAPSA-N 434.588 4.096 10 10 IICE CC(C)c1nnc(N2C[C@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1544633490 VNGILJKVYJMYHF-SFHVURJKSA-N 429.634 4.007 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CCS1 1546735432 CJQHVPVVKUWXHD-OAHLLOKOSA-N 432.644 4.311 10 10 IICE CO[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1555181402 ACQNQPQFOOAQHV-OAQYLSRUSA-N 429.584 4.125 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CSc3nnnn3Cc3ccco3)c2C)cc1F 1559354468 SGCPCIHQRLQPKS-UHFFFAOYSA-N 425.489 4.144 10 10 IICE CCC1(CC)CN([C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CCS1 1559729395 VWGJTBOOMBEASZ-INIZCTEOSA-N 436.577 4.397 10 10 IICE CN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CCC[C@@H]1c1ccccc1 1564895269 CFJYGAXEUJMWKJ-KNQAVFIVSA-N 429.511 4.279 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(Cc2ccc(Br)cc2)CC1 1566656363 JFBKZSTVJRQTMB-UHFFFAOYSA-N 447.354 4.033 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnc2c(cnn2Cc2ccccc2)c1 1570027441 JQRGDYAGUFVGKZ-UHFFFAOYSA-N 427.291 4.422 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)C2CCCCCC2)cc1 1583621321 FVVMXNRDFNIPJM-JOCHJYFZSA-N 447.620 4.454 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)COCCc1ccc(Br)cc1 1584095230 LHKWXTPFUOLHJV-QGZVFWFLSA-N 433.390 4.130 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4cccc(OC(F)(F)F)c4)CC3)C2)cc1 1584444130 GQWWWXDHPCGCEZ-INIZCTEOSA-N 434.458 4.268 10 10 IICE Cc1cc(C(=O)Nc2ccc(N3CCCC3)nc2)c(C)n1-c1ccc(Br)cn1 1587786974 UPHHCSDBCMEBLA-UHFFFAOYSA-N 440.345 4.499 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]3C)ccc21 1597789343 VAMHUDNNUOTQCW-MOPGFXCFSA-N 443.588 4.374 10 10 IICE C[C@@H]1SCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)[C@@H]1C 1613037198 GVFRETIBTRZNLZ-GUXCAODWSA-N 433.597 4.103 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(-c2ccc(C)o2)n1CCCSc1nccs1 1615507759 BWNUVEAUFZSSHG-UHFFFAOYSA-N 443.602 4.245 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)CC2(C)OCCO2)c(C)n1-c1ccccc1Br 1618546824 YHVHQEIUWLAWFM-AWEZNQCLSA-N 435.362 4.376 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc3cc(Br)ccc3o2)N(C)C)cc1 1618635874 QYAZHDXYALNMKN-GOSISDBHSA-N 430.346 4.294 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)c1cc(Br)cnc1Br 1629758611 OFJACVCVZVCFBC-UHFFFAOYSA-N 439.151 4.137 10 10 IICE COc1cccc2c1CCN(C(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)C2 1632674985 PMHRHUIFUSXDGT-UHFFFAOYSA-N 440.341 4.459 10 10 IICE CN(c1cccc(Cl)c1)S(=O)(=O)c1cccc(C(=O)N2Cc3cccc(O)c3C2)c1 1632703485 KCBSBQCBHMGQEG-UHFFFAOYSA-N 442.924 4.027 10 10 IICE Cc1ccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1633708098 AUBFBOSRVYQINO-FQEVSTJZSA-N 437.584 4.230 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1(Cc2ccc(F)cc2)CCOCC1 1636263224 NFUGBIVYPFXFHG-IBGZPJMESA-N 427.564 4.222 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cc(O)c(Cl)cn1 1639373351 CBWVKAPTJUPSIK-QPEQYQDCSA-N 439.971 4.122 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1O 1643253124 BSYAMGQGBSEAFS-PKTZIBPZSA-N 440.515 4.261 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3cc(F)ccc3[N+](=O)[O-])c2C)cc1 1651720751 OYSAMGYRUXANPC-UHFFFAOYSA-N 426.400 4.190 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](Cn1ccnc1)c1ccccc1 1675535439 BKGLZDZGTBZIJL-LJQANCHMSA-N 443.345 4.324 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)CSc3ccc(C)cc3)CC2)c(OC)c1 1681483722 NEUZTTWJZBDINM-SFHVURJKSA-N 429.586 4.025 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 1682100436 BMVYMRHBNONHBF-XQBPLPMBSA-N 427.614 4.202 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CCNC(=O)NCc2c(O)cccc2F)c2ccccc21 1684557901 CBVJIWLSYGZBKF-HNNXBMFYSA-N 429.492 4.260 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)C[C@@H](C)S1 1726706814 LHUWSENFSNPDGV-HZPDHXFCSA-N 446.671 4.233 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@H](OC)C(C)(C)C)CC2)cc1 1730180452 QHCNITYZIFUKMN-QFIPXVFZSA-N 443.636 4.263 10 10 IICE CN1CCCc2cc(Cn3c(-c4cccn4C)nnc3N(C)CCC(F)(F)F)ccc21 1748060766 WVHFMJDELMARGQ-UHFFFAOYSA-N 432.494 4.103 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC(Cl)=C(Cl)C2)cc1F 1768494220 FDKXKPMJLBPYDO-UHFFFAOYSA-N 449.361 4.436 10 10 IICE COC(=O)c1c(NC(=O)CNC(=O)c2ccccc2)sc(C)c1-c1ccc(C)c(C)c1 1865989751 IVYOEGSIDFUEQR-UHFFFAOYSA-N 436.533 4.495 10 10 IICE COc1cc(C)c2nc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)cc(O)c2c1 1866508376 CWHJQGLOGOJCDD-UHFFFAOYSA-N 438.439 4.285 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1Br 1912015291 CDAQYUKLNGAJNF-BGYRXZFFSA-N 427.342 4.400 10 10 IICE C[C@H](NS(=O)(=O)c1cc(Br)sc1Br)c1ccccc1O 2192624223 JBTLDIOMZQUXFK-ZETCQYMHSA-N 441.166 4.018 10 10 IICE CCOc1c(Br)cc(C=C2C(=O)N(c3ccccn3)N=C2CC)cc1OC 2332127081 ZXTNFGHOTUXNBA-UHFFFAOYSA-N 430.302 4.448 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@](NCc3c(O)cccc3Br)(C2)C1 2333128801 FJGAOYAUPYRDPN-JLTOFOAXSA-N 425.367 4.424 10 10 IICE CCN(C[C@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2380757666 FKDXDAYSNDPIIL-AWEZNQCLSA-N 443.382 4.315 10 10 IICE CCN1CCCc2cc(CN(C(=O)Cn3c(=O)oc4ccccc43)C3CCCC3)ccc21 9688473 XDTKKTMQVWNUFZ-UHFFFAOYSA-N 433.552 4.338 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526400809 PXQMLXHWUCHYOX-QHCPKHFHSA-N 433.460 4.481 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CCCC(F)(F)C1 769338377 QZTPPCARACPWEJ-HLVNSREUSA-N 430.567 4.424 10 10 IICE CSc1ccccc1S(=O)(=O)Nc1nc(-c2ccc(CCNC(C)=O)cc2)cs1 780704431 WGWQESKIGILVEC-UHFFFAOYSA-N 447.607 4.011 10 10 IICE COc1ccccc1-c1ncc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cn1 794185790 ROFURUWVDXUHPA-UFWORHAWSA-N 449.513 4.287 10 10 IICE C[C@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1C[C@H]1c1ccccc1 802300089 CAPNROUHEZIHFR-VJBMBRPKSA-N 431.559 4.224 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@@H](c3ccc(Br)cc3)C2)c([N+](=O)[O-])c1 920337612 RXNUWERGAYTZEB-KFILLSGMSA-N 447.285 4.121 10 10 IICE O=C1NN(c2cccc(Cl)c2)C(=O)/C1=C/c1cc(Cc2ccccc2)cc([N+](=O)[O-])c1O 1081100832 CAUSUDHNCKFSMN-XDHOZWIPSA-N 449.850 4.006 10 10 IICE CC[C@@](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)(C(=O)OC)c1ccccc1 1142080239 CZLCJLQVYAOZCS-SANMLTNESA-N 432.520 4.157 10 10 IICE CCOc1ccc(C(=O)c2ccccc2C(=O)NCc2ccc(O)cc2O)cc1OCC 1142531172 XJHDFYLMAHJMBU-UHFFFAOYSA-N 435.476 4.056 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)N[C@@H](C)c3ccccc3O)cc2)c1C(F)(F)F 1151892114 JSTYVERZJWZPEL-ZDUSSCGKSA-N 447.413 4.264 10 10 IICE CCCCOc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)c1 1160960587 NBNXUMSTLXLCFV-GOSISDBHSA-N 432.948 4.325 10 10 IICE CO[C@@](C)(CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)COCc1ccccc1 1165972607 JJQBNARIOUWFGO-SANMLTNESA-N 434.536 4.258 10 10 IICE CCc1ccc(N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC(C)C)cc1 1169971450 QHQPWWOSSNGYIC-UHFFFAOYSA-N 427.564 4.004 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@H](C)[C@@H]2CCO)sc(C)c1-c1ccccc1 1171833895 KYKRRFKKBFENFF-LPHOPBHVSA-N 444.597 4.322 10 10 IICE C[C@@H](CCCCNC(=O)OC(C)(C)C)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1229369934 CRRAIOQMVLEPHG-AZUAARDMSA-N 449.592 4.166 10 10 IICE CC[C@@H]1[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)CCN1C(=O)OC(C)(C)C 1231194154 OQASDHAKRHWLMW-LSDHHAIUSA-N 432.348 4.286 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCSC(F)(F)F)CC2)cc1F 1315513033 SAXPXZLADOKGTE-UHFFFAOYSA-N 447.502 4.129 10 10 IICE COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1446862393 ANAGOSRGIUHGMV-DYESRHJHSA-N 448.361 4.103 10 10 IICE CCN(CC(=O)Nc1ccc(N2CCCCC2)nc1)Cc1cc(Br)ccc1O 1459576655 PKLJXSNRAAJNBW-UHFFFAOYSA-N 447.377 4.001 10 10 IICE Cc1ccccc1C1(NCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCC1 1460330499 FUBIRNCBGWZLFH-BGYRXZFFSA-N 439.575 4.033 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Cl)c1 1464503647 OGSDPYBKLWQIJE-JBYIUTFZSA-N 429.992 4.461 10 10 IICE COc1cccc(CNC(=O)CCc2cc(Br)c(Br)s2)c1O 1465991318 AWYSUSKCQHKPCW-UHFFFAOYSA-N 449.164 4.236 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)CCCc3cc(-c4ccccc4)no3)C2)cc1 1470773559 QPNKAQHEMAUFRK-FQEVSTJZSA-N 434.540 4.203 10 10 IICE CC(C)N(CC(=O)NCCc1ccc(OC(F)(F)F)cc1)Cc1ccc(N(C)C)cc1 1473116490 UKXVDGYNKCNDTK-UHFFFAOYSA-N 437.506 4.221 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC[C@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1479535048 RVWYZOLORRZBMN-OZXSUGGESA-N 445.611 4.076 10 10 IICE CCOCc1nnc(N(C)CC2CC(F)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1516465730 BNAJIUGJIXXKPV-UHFFFAOYSA-N 429.584 4.284 10 10 IICE COCCC1(Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCC1 1518974420 KJAFCOCOKFAGPP-UHFFFAOYSA-N 441.620 4.334 10 10 IICE CN(C)c1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1523516992 VHSNRVSKBBPIBL-AQTBWJFISA-N 429.542 4.122 10 10 IICE CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cn1 1525593411 KHPBGQNILPCPLB-UHFFFAOYSA-N 427.460 4.094 10 10 IICE COc1cc(Cl)cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1525805332 ARWFNFUXYSZJBH-UHFFFAOYSA-N 428.838 4.134 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1Br 1534308295 BEMAVFNRBWDDQB-GASCZTMLSA-N 435.337 4.440 10 10 IICE Cc1nc(SC2CCCC2)sc1CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 1536934310 UCYPAVPIMLYDFC-UHFFFAOYSA-N 444.670 4.097 10 10 IICE CC[C@@H]1CCCN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(CC)CC)cc1 1546680593 MHEIIELNUJIUDN-XJUOHMSHSA-N 441.620 4.275 10 10 IICE Cc1cc(C(=O)N(CCN2CCOCC2)[C@@H]2CCSC2)c(C)n1-c1cccc(Cl)c1 1556834887 WEFHAZKBVVLEJX-OAQYLSRUSA-N 448.032 4.027 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)C1(C(=O)NCc2ccc(N3CCCCC3)cc2)CCOCC1 1557139667 IJOWFKHJXXAMLK-IBGZPJMESA-N 445.604 4.003 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nc(C(F)(F)F)n3c2CCCC3)c1 1557978174 NYCVYKUAFNTIMW-UHFFFAOYSA-N 444.457 4.388 10 10 IICE CN(C)c1ccc(CNC(=O)CN(Cc2ccc(Br)cc2)C(C)(C)C)cc1 1560018235 KIIGRPCHBFVWKB-UHFFFAOYSA-N 432.406 4.432 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)c(OC)c1 1560083383 WGAVQKVVCKPZJJ-AWEZNQCLSA-N 438.355 4.160 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1c(F)cccc1F 1566359873 QISQRBASYBJCSQ-NRFANRHFSA-N 446.494 4.431 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(OCc4csc(C)n4)c3)C2)cc1 1585666039 ZHVOUQURYDURQT-GOSISDBHSA-N 437.565 4.295 10 10 IICE Cc1cc(C(=O)NCc2cn(C(C)(C)C)c(=O)nc2O)c(C)n1-c1cccc(C(C)C)c1 1595197124 APUNSYOWAOBRMI-UHFFFAOYSA-N 436.556 4.165 10 10 IICE Cc1cc(C(=O)NC[C@H](Cc2ccc(F)cc2)C(N)=O)c(C)n1-c1cccc(C(C)C)c1 1597713459 QNNRYAUZHRHZQV-NRFANRHFSA-N 435.543 4.431 10 10 IICE C[C@@H](Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)N(C)C(=O)OC(C)(C)C 1611600767 FRSBMHFVTOEYGL-INIZCTEOSA-N 431.581 4.173 10 10 IICE C[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1612782908 JCVMMAMWQWJMEY-HXUWFJFHSA-N 439.648 4.459 10 10 IICE CC[C@@H](c1ccc(Br)cc1)N1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 1616786375 UJEIUQORZVQKLZ-SFHVURJKSA-N 433.346 4.078 10 10 IICE Cc1cc(C(=O)N(C)CCN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccccc1Br 1623322298 RJRFNBKGGNLZRV-CALCHBBNSA-N 448.405 4.038 10 10 IICE CCOC(=O)[C@H]1[C@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)[C@H](C)C[C@H]1C 1623486206 AWKHUFKGPBUVIP-FFUKXMTKSA-N 440.584 4.353 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(CN3CCCC3)cc2)cc1 1628904603 MLWYRMOEWHHCAQ-UHFFFAOYSA-N 429.564 4.361 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1ccc(Cn2cc(Cl)cn2)cc1 1630351284 KPJWNXUKGDNPSG-UHFFFAOYSA-N 426.973 4.068 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCC(=O)Nc3cccc(F)c3)cc2Cl)C1 1634720299 SXXZEGYXSJKBME-OAHLLOKOSA-N 432.927 4.153 10 10 IICE COC(=O)c1cnc(CC2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)s1 1636882154 SXVIBTDCBQRDSO-UHFFFAOYSA-N 443.594 4.494 10 10 IICE Cc1cc(F)ccc1C1CCN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1638918540 XEZWMCPOOPVIGD-DEOSSOPVSA-N 426.580 4.392 10 10 IICE COc1cc(N2CCC([C@@H]3CCCN3C(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])cc1OC 1642157164 IQCLVPPFBIYYGR-INIZCTEOSA-N 435.521 4.228 10 10 IICE Cc1cc(COc2ccc(C=O)cc2)oc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1653421779 QKYYBOAYCCCMNV-XMMPIXPASA-N 449.551 4.078 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C(C)C)cc1 1657673115 SVVYHEZHKANSRZ-PMACEKPBSA-N 427.564 4.279 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H]1CCCc1ccccc1 1673472654 TZVOBOOMURWBPA-NRFANRHFSA-N 443.538 4.498 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCC1(Cc2ccccc2)CCCC1 1681089153 HGGINHAYVRUSFD-UHFFFAOYSA-N 443.538 4.404 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@H](C)NC(=O)OC(C)(C)C)CC1 1683421349 MMBVDVPUOURDRG-OALUTQOASA-N 446.636 4.327 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1cc(Cl)cc(Cl)c1F 1684281012 RLSPWCLQAWBPIA-UHFFFAOYSA-N 426.319 4.093 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2C[C@@H](C)N(CC)C[C@H]2C)cc1 1695618636 BHDMSTGPBNXPBJ-WOJBJXKFSA-N 435.620 4.087 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCC[C@](C)(OC)C2)cc1 1710028109 QBFYVQFPKJMBME-SANMLTNESA-N 448.615 4.164 10 10 IICE CCn1cc(CN(C)c2nnc(C3CCCC3)n2CCCSc2nccs2)cn1 1710180476 DAHGRSCUCMXSDM-UHFFFAOYSA-N 431.635 4.427 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCN1CC 1743727121 YZQQCVRCWLTXPC-UNMCSNQZSA-N 440.636 4.001 10 10 IICE CC[C@H](C)c1nnc(N2CCC(c3nc(C)no3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1772850763 LBAJZHFOUFPERG-HNNXBMFYSA-N 441.555 4.120 10 10 IICE CCCC1=NN(Cc2ccc(F)cc2)C(=O)/C1=C/c1cc2c(cc1[N+](=O)[O-])OCCO2 1865679315 GZPQOXAOGHBATN-LICLKQGHSA-N 425.416 4.087 10 10 IICE CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1 1866114368 SAZUKPIRAZXIFQ-XMMPIXPASA-N 428.492 4.228 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Cl)nc(C)c(Br)c3C)CC2)cc1 1892010944 WBWAEZQRWZRXSI-UHFFFAOYSA-N 438.753 4.085 10 10 IICE CCN(CCCOCc1ccccc1)c1cc2c(cc1Br)[C@@H](NC)C(=O)N2 2153185467 MFZPBYPWZRJFQJ-HXUWFJFHSA-N 432.362 4.095 10 10 IICE COc1ccc(CNC=C2C(=O)N(c3nc4ccccc4s3)N=C2C(F)(F)F)cc1 2296409889 DYJLTQMRBJTWEH-UHFFFAOYSA-N 432.427 4.244 10 10 IICE O=C(NN1C(=O)C(=Cc2ccco2)SC1=S)c1ccc(OCc2ccccc2)cc1 2297554987 UEOFXMKVHUGJKO-UHFFFAOYSA-N 436.514 4.405 10 10 IICE N=C1C(=Cc2cccc([N+](=O)[O-])c2)C(=O)N=C2SC(C34CC5CC(CC(C5)C3)C4)=NN12 2297630488 GEXHFOWXBJYTJR-UHFFFAOYSA-N 435.509 4.430 10 10 IICE Cc1ccc(CNC(=O)CN(CC(C)(C)C)C(=O)OC(C)(C)C)c(O)c1Br 2380719497 DAXUJCAMXZSRBL-UHFFFAOYSA-N 443.382 4.363 10 10 IICE CCCN1C(=O)COc2ccc(-c3csc(NS(=O)(=O)c4ccc(C)cc4)n3)cc21 11857459 MTFNIJUPHLKOBV-UHFFFAOYSA-N 443.550 4.055 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14471752 NBKUNXBYLPWQOX-KNKQGSTJSA-N 427.526 4.452 10 10 IICE CC(C)N1C(=O)/C(=C\c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33489112 REWRRPMMKFGJGK-FOWTUZBSSA-N 428.583 4.049 10 10 IICE CCOc1ccc(N2C(=O)N=C(O)/C(=C/c3cc(C)n(C[C@H]4CCCO4)c3C)C2=O)cc1 59109231 CUQUGLJHSBGGKX-TUNPGAEXSA-N 437.496 4.189 10 10 IICE COc1cccc([C@H]2CC(c3ccc(Br)cc3)=NC3(CCN(C)CC3)N2)c1O 65298213 UEBPYVDQTFDJDQ-LJQANCHMSA-N 444.373 4.109 10 10 IICE CCOC(=O)Cc1sc(NS(=O)(=O)c2cccc(Cl)c2)nc1-c1ccccc1 71556439 XDVDMWRYRAIZMA-UHFFFAOYSA-N 436.942 4.370 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC[C@H](Cc3noc(-c4cnccn4)n3)C2)cc1 169774056 VORGYIXFSJOYAK-LJQANCHMSA-N 442.523 4.029 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C12CCC2 715765322 GGORYCNNTQJLPK-GJZGRUSLSA-N 429.330 4.219 10 10 IICE Cc1cc(CCNC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)c(C)n1-c1ccccc1 729306023 GINRZESGETXCOA-SFHVURJKSA-N 442.556 4.144 10 10 IICE CC(C)c1noc2ncc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc12 742806605 SGQMNPJFBOKEBW-HNNXBMFYSA-N 430.455 4.346 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)NCc2c(O)ccc3c2CCCC3)C1 743601089 UKWHCSCZJWSYGH-KRWDZBQOSA-N 431.577 4.107 10 10 IICE Cc1ccccc1NC(=O)[C@H](C)OC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 769663694 PLMAGOCPFASYAA-IBGZPJMESA-N 433.552 4.287 10 10 IICE Cn1ccc([C@H](NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c2ccc(F)cc2)n1 775622236 SDUGDTMXANAOQI-JOCHJYFZSA-N 448.464 4.294 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(-c2ccc(Cl)cc2)c[nH]1 787401832 HAFHUESMUFBHOO-UHFFFAOYSA-N 427.907 4.365 10 10 IICE Cc1nc([C@@H]2CCCOC2)sc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 794238829 NJEACDLODXEQQK-RVKKMQEKSA-N 447.576 4.028 10 10 IICE Cn1c(C(F)F)nc2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccc21 798981885 QZJKELWOGSDQLA-INIZCTEOSA-N 448.901 4.264 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Nc3ccc(C(F)(F)F)nc3C)cc2F)CC1 801854153 YOWWSXAECSSTQQ-UHFFFAOYSA-N 439.457 4.012 10 10 IICE O=C(c1cnn(Cc2ccccc2)c1Cl)N(Cc1ccccc1O)C[C@@H]1CCCO1 802840079 RUQKBUCQYKOVQR-IBGZPJMESA-N 425.916 4.112 10 10 IICE CN1CC[C@@H](NC(=O)NCc2cc(Br)ccc2O)[C@@H]1c1ccc(Cl)cc1 805239744 PDCMDAUECQRUQG-AEFFLSMTSA-N 438.753 4.053 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)cc1 917186767 QWXXVDCDIYIRSH-UHFFFAOYSA-N 429.564 4.448 10 10 IICE CCCCc1nc(C(=O)OCC)c(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[nH]1 1128074169 PNEUACACRFIBPG-UHFFFAOYSA-N 440.544 4.399 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)nn1C(C)C 1129836668 AGTMYQXNYIJOLD-WJDWOHSUSA-N 432.546 4.142 10 10 IICE CC[C@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)[C@@H]1CCCCO1 1130494072 AZHSBDYDZLGACO-AFJCMSOJSA-N 438.640 4.193 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)N3CCCC3)c2C)c1 1142674907 WXPZMTISILQCDF-VWLOTQADSA-N 429.564 4.366 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(OCCC(C)C)c(OC)c1 1152402010 STZDPUGTECMTIW-UHFFFAOYSA-N 449.931 4.295 10 10 IICE CC1(C)CCCC[C@@H]1CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1264770795 LVIYKDUWLMTNMC-HXUWFJFHSA-N 439.579 4.165 10 10 IICE CSc1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1269555695 CCJOGEXOZXYGSM-LDADJPATSA-N 446.594 4.455 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC[C@H]1CC1(Cl)Cl 1280372602 DILBBNLLWBBQCY-GJSJWPQCSA-N 449.450 4.430 10 10 IICE CC(C)[C@@H]1CCCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1287239945 UCUWVSFDVXKIEA-FQEVSTJZSA-N 429.584 4.224 10 10 IICE Cc1cc(CC(=O)NCCCCN2CCN(c3ccccc3)CC2)c(C)n1-c1ccccc1 1291694556 BUVZGKCMHYMKDO-UHFFFAOYSA-N 444.623 4.355 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NC(C)C 1291705042 VZXQCAGXLBIVSC-GOSISDBHSA-N 436.604 4.360 10 10 IICE Cc1cc(C(=O)N2C[C@@H](CO)Cc3ccccc32)c(C)n1-c1ccc(Br)cn1 1298334460 QILKXLQDVQNLDP-INIZCTEOSA-N 440.341 4.063 10 10 IICE CN(C[C@H]1CCCO1)c1nnc(-c2ccccc2F)n1CCCSc1nccs1 1298785112 FTBJHYXMUGQYLJ-OAHLLOKOSA-N 433.578 4.338 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2 1298842756 VULDRWXLUVNBPW-JTSKRJEESA-N 449.334 4.364 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)c1)c1ccccc1O 1302532413 BGTIIFXOHNQNLP-IRXDYDNUSA-N 436.533 4.023 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)c(F)c1 1305370328 OHVFMBCHDFQJFN-OXJNMPFZSA-N 439.583 4.292 10 10 IICE Cc1cccc(-n2nnnc2SCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)c1 1307263549 HDAOBFSRCAMQDT-UHFFFAOYSA-N 438.944 4.402 10 10 IICE CCOC(=O)c1c(NC(=O)c2cnc(OCC)cn2)sc(C)c1-c1ccc(F)cc1 1351733543 REPKJLJWGDTMOP-UHFFFAOYSA-N 429.473 4.480 10 10 IICE C[C@@H](Cc1ccsc1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1357156280 BZEGHRZQIBDZKT-MFVBVHDHSA-N 434.583 4.226 10 10 IICE COc1cccc(C(F)(F)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1435334126 SONGTJCLTNZWHD-OAHLLOKOSA-N 426.410 4.174 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(COc4ccc(C)nc4)c3)CC2)cc1 1446416470 PTAZFNYBLWLQIE-UHFFFAOYSA-N 431.536 4.330 10 10 IICE COc1ccc(Br)cc1C1(C(=O)NCc2ccc3cccnc3c2O)CC1 1451958047 LQEZYCOSWPRDTI-UHFFFAOYSA-N 427.298 4.060 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)CCOCCN(C)C(=O)OC(C)(C)C)cc1 1453556036 XSZRATNDABNBCW-UHFFFAOYSA-N 429.561 4.050 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1 1460978573 ACBNXYSJOWLGCU-NVXWUHKLSA-N 448.394 4.468 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1csc(-c2ccc3c(c2)OCCO3)n1 1460984893 SNXMMVMTFBYPLN-MRXNPFEDSA-N 437.565 4.317 10 10 IICE Cc1cc(C(=O)N(C)CCOCCNC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1470998314 MTACVVLRXSDCMT-UHFFFAOYSA-N 449.979 4.361 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC)c(F)c2)sc2c1CC[C@H](C)C2 1473250469 JFQSYFFFBFILDN-ZDUSSCGKSA-N 434.533 4.272 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(C)=O)C[C@H]1C 1500458408 MBUGWDIHCIZTBI-LJQANCHMSA-N 434.588 4.210 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(=O)NC)C1 1514200266 ZRFNZRBXKWPCCE-PNWMKBJFSA-N 446.599 4.281 10 10 IICE CCSCC[C@H](C)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1523498327 LUJOOTJQJPESDD-ZSRMJVKVSA-N 440.631 4.407 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2ccc(F)cc2C1 1526380367 PTWQBHJQKGQQIB-ODLFYWEKSA-N 444.528 4.141 10 10 IICE CCOC(=O)c1cc(F)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1534056775 DQEFHNCCACZQDO-UHFFFAOYSA-N 437.515 4.362 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1 1540452655 NZRBEXNAQYABJW-AREMUKBSSA-N 429.564 4.402 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccccc2OCCn2ccnc2)c1 1542210916 DQYMXWDKKZYTBU-UHFFFAOYSA-N 428.492 4.434 10 10 IICE C[C@H]1CCCN(c2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)ccn2)C1 1545632482 NEZGLHQDCOFJBY-LAUBAEHRSA-N 442.991 4.071 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CC[C@@H]1C 1554592520 OCBUSOWZOKDVHX-GEQKSPFYSA-N 437.588 4.249 10 10 IICE Cc1ccc(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)cc1-n1c(C)cc(C=O)c1C 1556738399 HNEPKQPQVRCQFF-XMMPIXPASA-N 431.536 4.034 10 10 IICE COC(=O)c1ccc2nc(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)[nH]c2c1 1559216745 MBRRKBSKQMKOFM-UHFFFAOYSA-N 430.420 4.101 10 10 IICE CCCOC[C@H](Cc1cccc(Br)c1)NC(=O)NCc1c(O)cccc1F 1564599781 XOXDVQBKQVKMNV-INIZCTEOSA-N 439.325 4.131 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3ccccc3CN3CC[C@@H](O)C3)c2C)c1 1567483241 LPOMYZGITWMGEO-RUZDIDTESA-N 431.580 4.208 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(Br)c1O 1568378894 OQTSAIUVAMAPLD-UHFFFAOYSA-N 449.345 4.157 10 10 IICE CCOCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(CC)CCC1 1616885204 XBWOMXSHAJRJMS-UHFFFAOYSA-N 427.593 4.120 10 10 IICE CCCCC[C@@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1627934047 SMYXQXOJHCWEJI-YFDWJFFGSA-N 449.595 4.338 10 10 IICE Cc1c(C(=O)NCc2c(O)ccc3ccccc23)nnn1Cc1ccc(C(F)(F)F)cc1 1635969425 QBZNHQWWOZZSPQ-UHFFFAOYSA-N 440.425 4.442 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC(O)(CN3CCCCC3)CC2)c1 1647864229 GQWCIVNOUHZOTR-UHFFFAOYSA-N 429.992 4.201 10 10 IICE CCC1(CC)C(=O)N(C)C(=O)N(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1=O 1652005053 ICUPACBJHJIEBI-UHFFFAOYSA-N 435.484 4.268 10 10 IICE CC(C)c1ccc(Cn2[nH]ccc2=NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)cc1 1652319873 XGECWZXIHYIZKU-UHFFFAOYSA-N 445.611 4.146 10 10 IICE COc1ccc(CN(C)[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1652445713 MKPXPEJZOUKBSF-QGZVFWFLSA-N 442.515 4.238 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC2(c3ccc(F)cc3F)CCCC2)N(C)C)cc1 1681588522 WMYPOUVQRMUOAV-HSZRJFAPSA-N 444.570 4.445 10 10 IICE COC(=O)c1ccc2c(c1)OCCN(C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)C2 1684479305 WKURNBSHGHUIOF-UHFFFAOYSA-N 447.535 4.293 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2ccc(Cl)s2)cc1F 1696611839 XPYQBZAFWPUFQF-OAHLLOKOSA-N 449.983 4.387 10 10 IICE CO[C@@H](C)c1nc(Cn2c(C3CCCC3)nnc2N(C)Cc2ccccc2O)cs1 1697105569 UMFZIVZFDPHIAO-HNNXBMFYSA-N 427.574 4.490 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H](C)CN1CCCC1 1706378783 QGNHWQLPXSYLNT-JOCHJYFZSA-N 438.664 4.445 10 10 IICE CC[C@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1727275976 NVBQPCPYNJMYIO-HXUWFJFHSA-N 425.602 4.147 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCc1cccnc1 1729421095 ZKQWAKBOABWVQN-IFMALSPDSA-N 435.572 4.176 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCCCO3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1761674606 DUSLQPJBDLPCCM-NRFANRHFSA-N 437.588 4.129 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3ccc(C)s3)sc2CCC(=O)O)cc1 1858035371 ZVWUNOHUOCMCDU-UHFFFAOYSA-N 438.552 4.007 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3ccc(F)cc3F)SC2=S)N(C)C)cc1 1858594443 ZMNLVOWGWBYWDF-JHBOHYQCSA-N 434.533 4.478 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3CCCN(Cc4cccc(F)c4)C3)cccc21 1861858432 SAUWFCVNLUCXJL-SFHVURJKSA-N 442.490 4.452 10 10 IICE CN(C)c1ccc([C@H](NC(=O)/C=C/c2cccc(Br)c2)c2nccn2C)cc1 1866124452 FLVKGEXYKGEDHA-SQEWALACSA-N 439.357 4.168 10 10 IICE CCc1ccc(NC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(CCOC)C2=O)cc1 1873420119 GRDVIMPQZOFGKY-UHFFFAOYSA-N 443.547 4.495 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1ccc(O)cc1O 1952792511 IEFGJZIJCXSPKW-XUZZJYLKSA-N 445.471 4.495 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)[C@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 2044751718 DQJXJKACXVJPAW-BVAGGSTKSA-N 438.616 4.183 10 10 IICE CC[C@H](NCCO[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2165422812 ORNVESKWYKENGR-RDJZCZTQSA-N 443.382 4.221 10 10 IICE COc1ccccc1C(=O)NN1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2297317663 BEQIPWHEKFHQNN-UHFFFAOYSA-N 449.351 4.004 10 10 IICE CCN1C(=O)C(=Cc2c(NC3CCC(C)CC3)nc3c(C)cccn3c2=O)SC1=S 2314414734 KNONNKWVNIXDOU-UHFFFAOYSA-N 442.610 4.215 10 10 IICE Cc1ccsc1C=C1SC(=S)N(NC(=O)c2ccc(Br)cc2)C1=O 2314764543 GBUKAPXDPMNYFU-UHFFFAOYSA-N 439.381 4.365 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459367 FRKPVXNEQIVIQP-GCHBTCAUSA-N 428.554 4.304 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(O)c(OC)c1 100275595 FWQJTNIWGSQFJW-CXUHLZMHSA-N 444.281 4.041 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C/c1cccc(OCc2ccccc2)c1 107095839 QRVRBKSEELOAHB-WWOVWOHCSA-N 433.504 4.117 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741180865 DNUMCNFAAPYGAC-UXHICEINSA-N 434.458 4.436 10 10 IICE CC(=O)N(C)c1cccc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 746034892 KIDRXUVOJIZETG-UHFFFAOYSA-N 432.471 4.061 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)Nc1ccc([S@@](=O)C(F)(F)F)cc1 750620317 CBNYDFLBIXCIML-GDLZYMKVSA-N 443.516 4.189 10 10 IICE COc1cc([C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc(OC)c1OC 773144519 FVKICTDHRYJFRO-IBGZPJMESA-N 439.600 4.095 10 10 IICE COc1cccc([C@@H]2[C@H](N[C@H](C)c3ccc(N4CCOCC4)c(F)c3)CCN2C2CC2)c1 779176988 BLJGBVBQVBZQGP-DETVKUJNSA-N 439.575 4.300 10 10 IICE COc1cc(Br)cc(CNC2CC(N3CCC(C(F)(F)F)CC3)C2)c1O 793232145 JIYOPXDKWXQQDG-UHFFFAOYSA-N 437.300 4.058 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](C)Cc2ccc(OC)c(OC)c2)CCCC1 1126612062 SYAZRDBETVYREX-KRWDZBQOSA-N 436.552 4.293 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(Cl)cc4Cl)c3)CC2)cc1 1127189369 JQIIULPFTVAHLU-UHFFFAOYSA-N 431.323 4.150 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(Br)c(Cl)c2F)cc1 1130544763 TXUDGGHRCAVDLR-UHFFFAOYSA-N 429.717 4.459 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1cscc1Cl 1133603020 NBCCAYBKUOZRHP-VIZOYTHASA-N 440.974 4.448 10 10 IICE COCc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cc1F 1136903477 DXFMEFSEJSSBSV-NRFANRHFSA-N 445.535 4.034 10 10 IICE COc1ccc(C(=O)C[C@@H](C)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1137081313 CZWUYJATMSHKOZ-SJLPKXTDSA-N 446.494 4.291 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1137595927 WTXWALSMQCUQSO-CQSZACIVSA-N 431.920 4.483 10 10 IICE COc1cc(N[C@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)cc(OC)c1 1149999889 GIYXUTXLOMVJTG-AWEZNQCLSA-N 428.510 4.046 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@@H]21 1230199975 FHNMGYKTWPZWNU-LBPSXOOBSA-N 442.401 4.392 10 10 IICE Cc1ccc(C(=O)NC2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)s1 1264855148 OAUHKEZAINWDLL-UHFFFAOYSA-N 435.593 4.428 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC3(CNC(=O)OC(C)(C)C)CCCC3)ccc21 1293515458 PCXJBCJMRMXCBL-UHFFFAOYSA-N 443.588 4.472 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)CCS1 1293610053 BRYLGYKZVHUIOG-QGZVFWFLSA-N 446.671 4.235 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c(C)n1-c1ccc(Cl)cc1 1301443873 RAYPJLDNOWKVKY-XIKOKIGWSA-N 441.881 4.277 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)C3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1361048866 LNDUJYKKAUIKLU-MRXNPFEDSA-N 429.515 4.481 10 10 IICE COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1446862405 ANAGOSRGIUHGMV-UTKZUKDTSA-N 448.361 4.103 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC[C@@]2(C)C2CC2)sc(C)c1-c1ccccc1 1460912006 XKGADQZVORKJNN-DEOSSOPVSA-N 442.581 4.340 10 10 IICE C[C@]1(Cc2ccccc2F)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1470904702 HTDUCYOFTNOYEV-RUZDIDTESA-N 425.548 4.094 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)N1C[C@@H](C)O[C@H](C)C1 1495138205 UNGLGTSYVQQTPG-IPMKNSEASA-N 429.609 4.021 10 10 IICE CC(=O)c1nc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)sc1C 1522445180 KYSDWWXSBGQCND-ZROIWOOFSA-N 449.554 4.023 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@H](c3cccc(Cl)c3)C(C)C)CC2)cc1 1523442705 JMTMFBNRQIBMOV-DEOSSOPVSA-N 444.019 4.417 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(F)c2ncccc2c1 1525806378 RRRJQFBKFDEMFO-UHFFFAOYSA-N 433.405 4.159 10 10 IICE O=C(/C=C\c1ccsc1C(F)(F)F)NCc1cc(F)c(N2CCOCC2)c(F)c1 1535345521 BHMFQCPUPXZRJR-UPHRSURJSA-N 432.414 4.211 10 10 IICE C[C@@H]1CCC[C@](Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1543885587 LQDFULBKCUDMID-QNIAMRLHSA-N 441.620 4.372 10 10 IICE CC[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1nnc2n1CCCCC2 1544932277 TVDQXOBLSZZISD-NRFANRHFSA-N 433.556 4.414 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(NC(=O)C(C)C)ccc3Cl)C2)cc1 1584444624 UUHNBIPBFXHNOX-INIZCTEOSA-N 429.948 4.199 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)n1[C@@H]1CCCOC1 1598290935 IFUGGXZUXRZJOD-DNQXCXABSA-N 439.600 4.344 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCC(F)(F)F 1616683342 FYBJAMWAJZKNKI-UHFFFAOYSA-N 425.499 4.394 10 10 IICE Cc1c(Br)c2ccccc2n1CC(=O)N1CCOc2cc(N(C)C)ccc21 1618593166 GSVKYHUZLNMDJQ-UHFFFAOYSA-N 428.330 4.204 10 10 IICE COc1ccccc1N1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1624158008 RJXXOIDVKHSZIQ-UHFFFAOYSA-N 431.536 4.186 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3C[C@@H](NC(=O)OC(C)(C)C)C3)cc2Cl)C1 1626169112 NWQHBBZSVZHPDJ-RYQLBKOJSA-N 435.996 4.496 10 10 IICE CCOC(=O)[C@@H](CC1(OC)CCC1)NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1628496704 MBGWFYHUOYSUCI-HXUWFJFHSA-N 432.948 4.368 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1 1631543280 SMMAYBKPGMLKMA-HNNXBMFYSA-N 426.513 4.185 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c1 1634956199 VFXSGJVHHKBYNT-JOCHJYFZSA-N 435.911 4.095 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](C)Oc1ccc(Cl)cc1Br 1640256938 IJFBZBAEMBXWJV-LLVKDONJSA-N 433.726 4.378 10 10 IICE Cc1cc(C(=O)NCc2ccc3cccnc3c2O)nn1-c1ccccc1Br 1643285228 UMSUIHIRLMSROK-UHFFFAOYSA-N 437.297 4.127 10 10 IICE CCOC(=O)c1sc2nc(CN(CC3CC3)c3ccc(OC)cc3)nc(N)c2c1C 1654494978 FPUAQLWPIUKXLL-UHFFFAOYSA-N 426.542 4.184 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2CCc3cc(Br)ccc32)N(C)C)cc1 1675643257 DNEMQJGLHRGFGF-NHCUHLMSSA-N 445.405 4.105 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)C1 1680689978 QDOSAUQDBQHNKL-NSHGMRRFSA-N 432.609 4.079 10 10 IICE CC(C)(C)OC(=O)N(CCCCNC(=O)NCc1ccccc1O)OCc1ccccc1 1682050713 XLZLEEUJNZAKJH-UHFFFAOYSA-N 443.544 4.341 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NC(=O)NCc2cccc(Cl)c2O)Cc2ccccc21 1683757841 VDNIFIZGMSQCEF-MRXNPFEDSA-N 431.920 4.211 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@H](c3ccccc3F)C2(C)C)N(C)C)cc1 1685686973 UHXATCGJWODQTJ-FYYLOGMGSA-N 426.580 4.472 10 10 IICE C=CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(N(C)C)nc1 1705835123 AHMZEBGSPGCBIC-UHFFFAOYSA-N 441.583 4.484 10 10 IICE CC(C)CCN(C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1723384693 SUNAUTSLAPDHMH-UHFFFAOYSA-N 449.578 4.252 10 10 IICE Cn1cccc1-c1nnc(N2CC(C)(C)OC(C)(C)C2)n1CCCSc1nccs1 1729583997 GYRBCYKXWUHKOO-UHFFFAOYSA-N 446.646 4.316 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](CN3CCCCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1741455043 HPTBFWCKEKCTEB-OAQYLSRUSA-N 442.627 4.042 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC[C@@H](c3ccnn3C)C2)nnc1C(C)(C)C 1742141179 AJBVNLJQVIQMOH-HXUWFJFHSA-N 435.620 4.116 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1743446316 SLLFDRYPZYJYQH-HOYKHHGWSA-N 439.629 4.455 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763854763 LLGGWDKDMHFBBI-GCJKJVERSA-N 445.583 4.026 10 10 IICE COc1cc(C)c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1OC 1866044322 UUQATGILJGDUBK-JOCHJYFZSA-N 425.573 4.035 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CC3)C(=O)N(Cc3ccccc3F)C2=O)cc1 1873166846 JPHNHQCWMUFCIO-UHFFFAOYSA-N 429.495 4.265 10 10 IICE O=C(CCCCCN1C(=O)c2ccccc2C1=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1891460334 CBRDGMVQNHPMMS-UNMCSNQZSA-N 445.563 4.148 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@H](F)CNCc2c(O)cccc2Br)CC1 2106960603 ZILWBFDENRTELN-MRXNPFEDSA-N 431.346 4.230 10 10 IICE CC(C)(C)OC(=O)N1C[C@]2(F)CCC[C@@]2(NCc2cccc(Br)c2O)C1 2126058766 UUSQEPMGGJIGQE-RTBURBONSA-N 429.330 4.126 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC23CCC3)c1O 2279123039 RGIYJCUYYYKTRE-MRXNPFEDSA-N 441.366 4.043 10 10 IICE COc1ccc(OCCCOc2ccc(C=C3SC(=S)N(C)C3=O)cc2OC)cc1 2297347197 LXDBHMYPNVVUSK-UHFFFAOYSA-N 445.562 4.383 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)C2=Cc2ccc(O)c(OC)c2)cc1 2332134733 DUHGGAQGTAAPTM-UHFFFAOYSA-N 432.451 4.379 10 10 IICE Cc1ccc(CNC[C@@]23CC[C@@H](C2)N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352678156 CTPPCVLYAZFLGU-MGPUTAFESA-N 425.367 4.342 10 10 IICE Cc1ccc(CN(C)C(=O)/C=C/C(C)(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380786158 HSVDXKBXAPUSPF-ZHACJKMWSA-N 441.366 4.281 10 10 IICE CCn1c(/C=C/c2ccccc2[N+](=O)[O-])nc2cc(S(=O)(=O)C(F)(F)F)ccc21 14084532 CGIVDKGKGMNXJC-JXMROGBWSA-N 425.388 4.428 10 10 IICE COc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3cc(Cl)ccc3O)SC2=S)cc1 15046833 GPTABDIRCDLIAO-MTUBTWAWSA-N 448.953 4.283 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\c3nc4ccccc4[nH]3)SC2=S)cc1OC 27230406 CIDXSFVPUHQPKI-LDADJPATSA-N 425.535 4.024 10 10 IICE COc1ccc(OC)c([C@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 108446024 RIBIPTGWUZJFGU-BBWFWOEESA-N 445.535 4.017 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(\C)Nc2cccc(C)n2)cc1 205959935 RRNXFFNOHKRJOX-CJLVFECKSA-N 443.463 4.444 10 10 IICE COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)NCc1ccc(N(C)C)c(F)c1 749333825 WVGIAYWQJCIKMU-UHFFFAOYSA-N 442.535 4.238 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cccc(-c4noc(C5CC5)n4)c3)c2)CC1 767381581 DUSUIJNGIBPNEW-UHFFFAOYSA-N 431.540 4.397 10 10 IICE Cc1nc2ccccc2nc1COC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 769665405 RNXHVVFDCUHHSB-UHFFFAOYSA-N 428.536 4.403 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cnc(-c2ccc(F)c(F)c2)s1 780386256 XSUWILSKJJXAFR-UHFFFAOYSA-N 443.519 4.227 10 10 IICE Cc1cc(C(=O)CSc2nnc(C3CCC3)n2C)c(C)n1-c1ccc2c(c1)OCCO2 781606458 LOEHSZBTZZSDTF-UHFFFAOYSA-N 438.553 4.236 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(F)c(Br)cc1Cl 792880140 WFMJHDGUTQJGSD-UHFFFAOYSA-N 441.728 4.350 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1nnc(Cc2cccc(F)c2)s1 806260774 AASOITCIKMELIE-UHFFFAOYSA-N 437.294 4.058 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCO2)c2ccccc2n1 812292911 NBOWOPFKXMHHCD-IBGZPJMESA-N 429.524 4.323 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N(Cc1ccccc1)C[C@H](O)c1ccccc1C(F)(F)F 1138155016 WLINYLNTJHJJJY-QFIPXVFZSA-N 445.437 4.422 10 10 IICE CC(C)(C)OC(=O)Nc1ccoc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348303 OSLJBJPDRPXXKX-INIZCTEOSA-N 449.935 4.380 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)CC2)cc1 1151503439 VENFWMGHRWBKHI-OAQYLSRUSA-N 445.604 4.160 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCO[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 1155165479 MSKSPFRMPFFSMB-QGZVFWFLSA-N 449.347 4.278 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3ncon3)C2)c(C)n1-c1cccc(Br)c1 1156095939 ZTMMNSJEWYVAOT-OAHLLOKOSA-N 429.318 4.259 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2cc(Br)sc2[nH]1 1156792782 QHOMCOSPJKOUFR-UHFFFAOYSA-N 430.121 4.390 10 10 IICE CCN(C(=O)c1cc(C)n(-c2ccccn2)c1C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1181746962 KZCNKGOTDJGJDR-LJQANCHMSA-N 426.561 4.351 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@@H]3C[C@H]3CCCO3)cc2Cl)C1 1235832010 BWRPTYACZCQAKC-YZGWKJHDSA-N 435.996 4.056 10 10 IICE O=C(CN(C(=O)c1ccccc1)c1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 1295404985 CWHILWLPXSVIHO-XMMPIXPASA-N 444.531 4.247 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC(CCCO)CC2)cc1 1295421298 QOGXXOKBFUTSPA-HSZRJFAPSA-N 441.620 4.013 10 10 IICE Cc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(N)c1[N+](=O)[O-] 1304496778 DEIKENRXJYYLPK-UHFFFAOYSA-N 444.289 4.303 10 10 IICE CCOC(=O)c1c(NC(=O)COc2nc(C(C)C)no2)sc(C)c1-c1ccccc1 1307303369 YWOIGDGPPFVJJK-UHFFFAOYSA-N 429.498 4.424 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 1307473195 NVCYFWQCQQZGBA-SBHAEUEKSA-N 433.612 4.204 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(C)c3C)C2)sc2c1CCCC2 1347874830 GGHCDNHAOWERHY-MRXNPFEDSA-N 440.565 4.412 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](CC(C)C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1361049277 YKRXPLZAEMUFHO-OAQYLSRUSA-N 448.615 4.313 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c(C)n1-c1ccc(Br)cc1 1447529549 ZFKVARAWJWGDOY-OAQYLSRUSA-N 442.357 4.409 10 10 IICE Cc1cc(C(=O)NCCOC2CCSCC2)c(C)n1-c1ccc(Br)cc1 1456895548 WGUHAFYSTBPSGK-UHFFFAOYSA-N 437.403 4.499 10 10 IICE COc1cccc(CNC(=O)[C@@H]2CCCCC23CCN(C(=O)OC(C)(C)C)CC3)c1O 1465993552 SIALOONHNXXTTJ-SFHVURJKSA-N 432.561 4.225 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccoc2CN2c3ccccc3C[C@@H]2C)cc1 1469807163 VHLBPCRDMIEDTR-IBGZPJMESA-N 433.552 4.448 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@H]3c3cccc(Cl)c3)CC2)cc1 1473431063 YGLVITQYUMDISJ-NOZRDPDXSA-N 444.019 4.059 10 10 IICE C[C@H](NC(=O)N1C[C@@]2(C)CN(C(=O)OC(C)(C)C)C[C@@]2(C)C1)c1ccc(N(C)C)cc1 1478471482 YHDADHNFDCRVLD-YRUKQIKQSA-N 430.593 4.102 10 10 IICE CC1CCC(OC2CCN(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)CC2)CC1 1479532343 CMWRVIBOWXQWPJ-HTIOENIKSA-N 430.637 4.125 10 10 IICE CCC(C)(C)Cn1c(-c2cccnc2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1494748051 MRTMSRZUMLAMKD-UHFFFAOYSA-N 438.551 4.251 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@@H](C)[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1511540774 VGVVOEMBUSKNPZ-CVEARBPZSA-N 442.608 4.370 10 10 IICE Cn1ccc(Nc2nnc(Cc3ccccc3F)n2CCCSc2nccs2)n1 1517388433 UUTVQECWSAACHM-UHFFFAOYSA-N 429.550 4.124 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c1 1523116915 SQXMAXXPRQFFQP-QFIPXVFZSA-N 437.971 4.378 10 10 IICE CC(C)n1cc([C@@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1529076472 BHDCDQBVBQACMR-YFEUJDIGSA-N 446.573 4.072 10 10 IICE CC(C)(C)N1CCCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC1 1541193670 XPIZXCNWZSKUHB-UHFFFAOYSA-N 445.662 4.223 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3c[nH]c4ncc(Br)cc34)cc2)CC1 1543143280 YBORSPBYNJNXEA-UHFFFAOYSA-N 427.346 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)c1 1544893208 ALABECSGJIBKDM-UHFFFAOYSA-N 431.536 4.116 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCN1CCC[C@H]1C 1545504120 PCPJILMQHZSTPZ-LEWJYISDSA-N 440.636 4.001 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(COc4cccc(C=O)c4)c3)CC2)cc1 1545929765 LEWYNWQGAKBZAQ-UHFFFAOYSA-N 444.531 4.439 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 1566360002 VJQFIFCTLKKDKW-HSZRJFAPSA-N 432.486 4.342 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F 1596358745 ILGIWAXTDHZTMT-UYAOXDASSA-N 436.499 4.038 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@](C)(CC)CC(=O)OC)sc(C)c1-c1ccccc1 1616058820 BJJZTANGMAFYRZ-HSZRJFAPSA-N 446.569 4.160 10 10 IICE COC(=O)CC1(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCCC1 1618784689 IVRDMVIZSUDESZ-UHFFFAOYSA-N 433.346 4.462 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H](O)c1cc(Cl)cc(Cl)c1 1625608407 ZLPLBOWHUVHIFM-FQEVSTJZSA-N 437.367 4.206 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CC(N)=O)c3ccc(Cl)cc3)c2C)cc1 1629321655 FVNBMKPDDBELEF-OAQYLSRUSA-N 425.916 4.103 10 10 IICE COC(=O)[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)cc1 1640137452 OXMAYXJZTPSFCE-QFIPXVFZSA-N 436.483 4.041 10 10 IICE CCOC(=O)c1cnn(C2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)c1 1641015463 VOPOQZSZWJWZLW-UHFFFAOYSA-N 426.542 4.006 10 10 IICE CCOc1ccc(C(=O)c2ccccc2C(=O)NCc2c(O)cccc2F)cc1OCC 1646028454 IRHDMFWEZRLINK-UHFFFAOYSA-N 437.467 4.490 10 10 IICE O=C(NCCCSc1nccs1)[C@H](c1ccc(Br)cc1)N1CCCC1 1648541548 DUDVWFCPBQOLEJ-INIZCTEOSA-N 440.432 4.341 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)c3cccc4ccccc34)cc2F)C[C@@H](C)O1 1652347250 INYHOHGFXCRTDX-KDURUIRLSA-N 435.543 4.345 10 10 IICE Cc1cc(C(=O)NC[C@]2(OC(C)C)CCOC2)c(C)n1-c1ccc(Br)cc1 1652382129 OPQNKFXTSFXPLP-OAQYLSRUSA-N 435.362 4.171 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3ccc(F)cc3F)cc2Cl)C1 1680561659 CTYSCSXXDFXMER-JLTOFOAXSA-N 437.918 4.387 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@]2(CCN(C(=O)OC(C)(C)C)C2)C1 1683252971 BQICDRIZZPOULG-CLOONOSVSA-N 444.620 4.035 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)cc1 1685915780 UVDUIRSUORJFAM-OAQYLSRUSA-N 446.954 4.272 10 10 IICE C[C@H]1CCCN(CCCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1693682148 JUZVLJDVWXKDAK-FQEVSTJZSA-N 434.588 4.194 10 10 IICE C#C[C@@H](C)N(C)c1nnc(Cc2c(F)cccc2F)n1CCCSc1nccs1 1705496333 DSVWYXIJUJRFSM-CQSZACIVSA-N 433.553 4.244 10 10 IICE CC[C@H](C)c1nnc(N2CCCC[C@@H](COC)C2)n1Cc1ccc2c(c1)CCCN2C 1708501149 CIMJYSXKOSFLCI-PZJWPPBQSA-N 425.621 4.475 10 10 IICE COc1cc(OC)cc(-c2nnc(N3CC=CCC3)n2CCCSc2nccs2)c1 1711695956 MKZWYNSCWWKVEZ-UHFFFAOYSA-N 443.598 4.368 10 10 IICE Cc1ccc(OCc2nnc(Nc3ccn(C)n3)n2CCCSc2nccs2)cc1 1742283813 FXLQHXWJQZANRG-UHFFFAOYSA-N 441.586 4.282 10 10 IICE CS[C@@H](C)Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750241087 TWAKOYDDRFMDGK-IBGZPJMESA-N 436.629 4.252 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@H]3C)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1751408811 OFWLYBQZGOEAER-PKOBYXMFSA-N 434.588 4.112 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)OC3CCCC3)n2CCCSc2nccs2)n1 1751840127 PYHYDWGZMCUMDJ-UHFFFAOYSA-N 447.634 4.089 10 10 IICE CCC[C@H]1CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1763985264 YPRIMRZFQWGWBF-FCHUYYIVSA-N 427.593 4.029 10 10 IICE O=c1cc(CNc2ccc(Nc3ccccc3)cc2)n(Cc2ccco2)cc1OCCO 1870790672 KREZYCFWWRTJHF-UHFFFAOYSA-N 431.492 4.216 10 10 IICE C[C@](NC(=O)OCC1c2ccccc2-c2ccccc21)(C(=O)O)c1ccc([N+](=O)[O-])cc1O 1951729428 DCTYNRYNEXDXNS-XMMPIXPASA-N 448.431 4.139 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@@H]2[C@H](NCc3cc(Br)cc(F)c3O)[C@@H]21 1966019279 MNXMHMLOUJHWMH-VNQPRFMTSA-N 429.330 4.171 10 10 IICE O=C1NC(=S)NC(=O)C1=Cc1cn(Cc2ccc3ccccc3c2)c2ccc(Cl)cc12 2069413583 YNPDEEPROJUWCY-UHFFFAOYSA-N 445.931 4.411 10 10 IICE COc1ccc(O)c(Cn2nc(C3CC3)c(C(F)(F)F)c2I)c1 2079834961 VYFNPDOVGMIBHN-UHFFFAOYSA-N 438.187 4.146 10 10 IICE CC[C@@H]1[C@H](NCc2c(Br)ccc(OC)c2O)CCN1C(=O)OC(C)(C)C 2227747974 HZUCBALKDQHDRB-HUUCEWRRSA-N 429.355 4.041 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C)c1O 2227748806 QOVYYJVCDQBLPG-SWLSCSKDSA-N 429.355 4.041 10 10 IICE CCCN1C(=O)C(=Cc2ccc(OS(=O)(=O)c3ccccc3)c(OC)c2)SC1=S 2294732798 RWZMUNBZKQWWOD-UHFFFAOYSA-N 449.575 4.074 10 10 IICE COc1ccccc1N1C(=O)C(=Cc2ccc(Sc3ccccc3)o2)C(=O)NC1=S 2297556193 OMJRMKHPZDDQJF-UHFFFAOYSA-N 436.514 4.271 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)cc1OCC 2321576578 IMCNVBPFTPOFQD-UHFFFAOYSA-N 442.562 4.379 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc(OC)c1O)N2 14460113 PJQPMXCRGSUPTR-XLNZFTOWSA-N 435.568 4.299 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@H](c2ccccc2Cl)N3)CC1 14466116 JNCQFZUXRIAJTR-PMAPCBKXSA-N 444.000 4.103 10 10 IICE CC(C)(C)c1ccc(C(=O)NN2C(=O)/C(=C\c3ccccc3C(=O)O)SC2=S)cc1 16905862 CHRYHTZZXDHWHY-SFQUDFHCSA-N 440.546 4.229 10 10 IICE C[C@@H](NC(=O)c1ccccc1SC[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1 109179973 RIPOVRQLWVHHQQ-WIYYLYMNSA-N 426.582 4.285 10 10 IICE COC(=O)CCCN1C(=O)/C(=C/c2ccc(OCCC(C)C)c(OC)c2)SC1=S 206857955 ISAJDWZMBCXAMH-AQTBWJFISA-N 437.583 4.275 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(O)c(OC)c1)N2 226654188 RXQBFGRONAKLEI-PMAPCBKXSA-N 428.554 4.258 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(Cc3c[nH]c4ncccc34)no2)C1 554814136 OTVWBTRZYHFTJC-UHFFFAOYSA-N 426.524 4.306 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3CCC(c4nnc5n4CCC5)CC3)c2C)c1 728915493 URTHOCXCBVWWDT-UHFFFAOYSA-N 431.584 4.311 10 10 IICE C[C@H](NC(=O)CN(Cc1ccccc1)Cc1ccccc1)c1ccc(N2CCOCC2)cc1 746169291 YCDFBDBHVBTMGF-QHCPKHFHSA-N 443.591 4.403 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccc(F)cc2F)cc1 749473930 XUTOPMUAOTTWGB-ZQMYSKGWSA-N 441.522 4.121 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1nc(C(F)(F)F)cs1 768390169 GUWPHDDSFBWNMI-UHFFFAOYSA-N 439.507 4.016 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@@H](C)c2nc(O)c3ccccc3n2)C1 769665489 SVHRYEZQAVEGID-KRWDZBQOSA-N 444.535 4.361 10 10 IICE C[C@@H](NC(=O)C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccc(N(C)C)cc1 773846739 OAHCAVUXAJADJL-GFCCVEGCSA-N 443.853 4.163 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cccc4c(C)ccnc34)n2)cc1OC 777665068 BCBKRIAFBBUUGO-UHFFFAOYSA-N 441.534 4.485 10 10 IICE C[C@@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(N2CCOCC2)cc1 777811675 VPASZSRTUJIJDF-DENIHFKCSA-N 436.600 4.207 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1ccc(F)cc1Br 805115615 BAMHHTRBFBGRFR-UHFFFAOYSA-N 432.087 4.056 10 10 IICE Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)NCc1cc(Br)ccc1O 806341922 BSCPXRUQLPFRCG-UHFFFAOYSA-N 443.345 4.016 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C3CCC(c4ccccc4)CC3)CC2)cc1 1124514464 PSMJROTYZPLYAF-UHFFFAOYSA-N 435.612 4.298 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@]3(C)c3cccc(Br)c3)CC2)cc1 1125251097 LNFKDJCLUJTXCH-GMAHTHKFSA-N 443.385 4.474 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2cc(Br)ccc2Br)cc1 1138307381 WCEVRMLQBVSTIZ-UHFFFAOYSA-N 440.095 4.304 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1162114537 NMXMFVZVURUTQR-HTAPYJJXSA-N 441.572 4.236 10 10 IICE C[C@@H](COCC1CCCCC1)N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1176345710 NWGNBLNAKQQIIX-ZWKOTPCHSA-N 448.563 4.364 10 10 IICE Cc1cc(C(=O)N[C@H]2CN(C(=O)OC(C)(C)C)CC23CC3)c(C)n1-c1ccc(F)cc1 1180971243 LHUQEDBQIXAJGV-FQEVSTJZSA-N 427.520 4.363 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2CCCS(=O)(=O)c1ccc(NC(C)=O)cc1 1195324838 SGDNNOUPUGVJSH-HXUWFJFHSA-N 444.597 4.152 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(=O)c2ccc(Cl)cc2o1 1264992802 MVHTVCMSMPJENS-UHFFFAOYSA-N 448.853 4.447 10 10 IICE Cc1cc(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)nc(N2CCCC2)n1 1274756749 TYODYPMTQPSKRQ-UHFFFAOYSA-N 437.975 4.305 10 10 IICE COC(=O)c1ccc(CCNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)c(OC)c1 1307126947 MUWQFVJWUIDDHL-UHFFFAOYSA-N 434.448 4.276 10 10 IICE CS(=O)(=O)N1CC(CSc2ncc(-c3ccc(Cl)cc3)n2Cc2ccccc2)C1 1307258735 GRJSIVVRCICSLK-UHFFFAOYSA-N 448.013 4.235 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CCC(C(C)C)CC1 1361098577 WBUPCPWCUJJUEH-JOCHJYFZSA-N 425.621 4.467 10 10 IICE Cc1cc(C)c(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)c1Br 1440671583 CZMMRRMTZYPSIK-UHFFFAOYSA-N 431.374 4.483 10 10 IICE CC[C@@H]1CCCC[C@H]1OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1444501305 HRXXBBQKBCGJBK-BVYCBKJFSA-N 447.620 4.420 10 10 IICE Cc1cccc([C@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1445914454 ZSPWZRKMRHKIIY-LJQANCHMSA-N 428.330 4.023 10 10 IICE COC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1455817769 DGMRUNTZFOFKDY-JOCHJYFZSA-N 442.918 4.330 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)ccc1N(C)C 1459241037 SRQOJZRZCIEYQZ-FQEVSTJZSA-N 430.520 4.351 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3c(=O)cnc4ccc(Cl)cc43)c2C)cc1 1473064095 ZDUMJBVRWBMAEG-UHFFFAOYSA-N 449.894 4.127 10 10 IICE C[C@H](CSC(F)(F)F)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527246168 RURMLTYZLJLVDA-LLVKDONJSA-N 430.414 4.047 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccnc1Sc1ccccc1 1535345717 LUVIGFOBVPEJDY-UHFFFAOYSA-N 441.503 4.278 10 10 IICE C[C@@H](NC(=O)[C@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1)c1ccc(N(C)C)cc1 1537679053 DOZMFABVJKGWFI-VGOFRKELSA-N 439.625 4.443 10 10 IICE CC(C)[C@@H](Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1541307504 HDPQVKANIYTKNA-FCHUYYIVSA-N 435.572 4.349 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(C(F)(F)F)c(O)c1 1542702731 NCXPYNKJHNSRSA-UHFFFAOYSA-N 430.373 4.411 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3cccc(Br)c3)CC2)cc1F 1545606079 CANNZLDYRDKQPC-UHFFFAOYSA-N 439.350 4.038 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccco2)cc1 1547447773 FNLUIHXUASYCPY-UHFFFAOYSA-N 430.556 4.388 10 10 IICE CO[C@H](C)c1nc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cs1 1554588287 RQQLNNICVJLDTC-BEFAXECRSA-N 443.573 4.074 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1)OC 1555250709 UWHQEJLMNJOFHX-JOCHJYFZSA-N 437.588 4.250 10 10 IICE Oc1ccccc1CN(CCCN1CCN(c2ccc(Cl)cc2)CC1)C[C@H]1CCCO1 1559635283 QXPYRPRJTDXKAX-XMMPIXPASA-N 444.019 4.239 10 10 IICE CC(=O)Nc1ccc(S(=O)(=O)CCCN(C)c2ccc(-c3nccs3)cc2)cc1 1559896698 SNLUKYGDEGJGEI-UHFFFAOYSA-N 429.567 4.069 10 10 IICE Cc1cc(CC(=O)N[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c(C)n1-c1ccccc1 1570531979 VMDWDRSKKGZDMN-LEWJYISDSA-N 425.573 4.445 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NCc2ccc3c(c2)CCCN3C)c1 1583627941 MLBSPWSUCHDBLJ-UHFFFAOYSA-N 440.437 4.287 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(O)c(Br)c2)CCCC1 1595643749 YWMHEOUPZKEIPL-UHFFFAOYSA-N 443.341 4.313 10 10 IICE Cc1nnc(N(Cc2cccs2)C[C@@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1612547724 UYIUGWWEHVULBH-SFHVURJKSA-N 429.565 4.087 10 10 IICE Cn1c(C(F)(F)F)nc2cncc(C(=O)N(Cc3ccco3)Cc3ccccc3O)c21 1622310253 XWQHSUFDXVUKSF-UHFFFAOYSA-N 430.386 4.128 10 10 IICE Cc1ccc(C(=O)NCc2cnn(Cc3ccccc3)c2)cc1-n1c(C)cc(C=O)c1C 1624506614 DQCASYRFIVYZPS-UHFFFAOYSA-N 426.520 4.390 10 10 IICE Cc1cccc(F)c1-n1nc(C(=O)NCc2cccc(Br)c2O)c2c1CCC2 1626821783 GCFUHFHIVLDKMH-UHFFFAOYSA-N 444.304 4.207 10 10 IICE CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1634398104 COOFJLBREUEDOB-KNQAVFIVSA-N 440.588 4.193 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nn(-c2ccc(F)cc2F)c2c1CCC2 1635839408 CGYFSUXICDBOBN-UHFFFAOYSA-N 448.267 4.037 10 10 IICE Cc1cc(CNC(=O)N2CCN(CCOc3ccccc3)CC2)c(C)n1-c1ccccc1 1637578213 SAJHHIAQLTVCSW-UHFFFAOYSA-N 432.568 4.000 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CC(=O)N(C)[C@@H]3c3ccc(F)c(F)c3)c2C)c1 1644882381 IOBMSSGSMFOAQY-LADGPHEKSA-N 437.490 4.383 10 10 IICE CC[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1ncc(-c2ccccc2)[nH]1 1685608760 GDBJIXFJKZMYLD-JTHBVZDNSA-N 434.588 4.196 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC(C)(C)c1cccs1 1693460991 MLIKEILMWZFSIM-UHFFFAOYSA-N 425.602 4.099 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](C(=O)OC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1694046941 YDVLOILCYCCPES-CTNGQTDRSA-N 439.604 4.076 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCc1cnn(C)n1 1695294793 PCQYGLZUMDOMHK-UHFFFAOYSA-N 446.603 4.350 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CC4)n3CCSCC(C)C)CC2)cc1F 1711866291 VDQIJLRAAVKEQC-UHFFFAOYSA-N 433.597 4.019 10 10 IICE CO[C@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC1(C)C 1712078739 BTSXCAWWNYCNFQ-HOTGVXAUSA-N 437.635 4.020 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@@H](C(F)(F)F)C2)cc1F 1729328612 MXSATNJNPIKJHP-MRXNPFEDSA-N 448.468 4.372 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1Cc1ccsc1Br 1747035817 HQVWPNIYHXXSOR-UHFFFAOYSA-N 437.363 4.029 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCSC(C)C 1763747453 FWCKFOMEOBFEIJ-KRWDZBQOSA-N 435.613 4.408 10 10 IICE CCOCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCC[C@@H]1CC 1767936404 MBKPCODPJGYFDW-OALUTQOASA-N 445.583 4.115 10 10 IICE O=C1/C(=C\c2ccc3c(c2)OCCO3)SC(=S)N1c1ccc([N+](=O)[O-])cc1Cl 1860084154 NCWOLWUOWHRZKY-LZYBPNLTSA-N 434.882 4.425 10 10 IICE Cc1cc(O)c([C@@H](C)n2nc(C(F)(F)F)c(C=O)c2I)cc1C 2080030730 QWJHKGBECNVJGK-SECBINFHSA-N 438.187 4.251 10 10 IICE Cc1cc(O)c([C@@H](C2CCC2)n2nc(C(F)F)c(C(N)=O)c2Br)cc1C 2080056552 VGJRYGXGFPDSOE-OAHLLOKOSA-N 428.277 4.394 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@@H](NCc2cc(Br)ccc2O)C12CCC2 2118417016 BHBGDEYKTUBNDF-RHSMWYFYSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@H]1NCc1c(O)cccc1Br 2144130939 SRSDMIWWBWSAKT-MJGOQNOKSA-N 433.346 4.435 10 10 IICE Cc1cc(Br)ccc1N1C(=O)C(=CC=Cc2ccccc2)C(=O)NC1=S 2294235388 JRPIQLOVRDAIOH-UHFFFAOYSA-N 427.323 4.145 10 10 IICE CCc1cc(C)cc(OCCOc2cccc(C=C3C(=O)NN(c4ccccc4)C3=O)c2)c1 2296660285 TVLJVOKCUGGUFO-UHFFFAOYSA-N 442.515 4.477 10 10 IICE CCCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc4c(c3)OCO4)SC2=S)cc1 2321591107 CEWDAMGRPJJYMH-UHFFFAOYSA-N 427.503 4.388 10 10 IICE Cc1ccc(CN(C)C(=O)C2CC(N(C)C(=O)OC(C)(C)C)C2)c(O)c1Br 2380780760 CPTLEECXUORGOJ-UHFFFAOYSA-N 441.366 4.067 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@](C)(NC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2381135590 SXIIZEAOPMGSHE-FQEVSTJZSA-N 441.366 4.115 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccc(F)cc4)C3=O)c2C)cc1 16455266 KOXZNCNYVDGDGI-VWLOTQADSA-N 433.483 4.192 10 10 IICE O=C1N=C(O)/C(=C\c2ccc(N3CCOCC3)cc2)C(=O)N1c1cccc2ccccc12 59859759 WNXBDWGOCGKRBG-LTGZKZEYSA-N 427.460 4.183 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C\c3cccc(I)c3)C2=O)c(C)c1 59860118 IDXJIFPDMMLJFA-XNTDXEJSSA-N 446.244 4.415 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C/NCc2ccc(F)cc2)cc1 103764757 WXXNAQJFSCZWHF-PXLXIMEGSA-N 446.438 4.167 10 10 IICE Cc1cc2c(n1-c1ccc(I)c(Br)c1)CCC[C@H]2N 311771986 WUMVOHUPNVXBLK-CQSZACIVSA-N 431.115 4.489 10 10 IICE CC(C)CNC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 586618440 BDBKVVVFNIRNLN-UHFFFAOYSA-N 441.487 4.492 10 10 IICE C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 726567836 QRZKLIBPSLTKTQ-BTYIYWSLSA-N 443.494 4.281 10 10 IICE CSCc1cc(C(=O)Nc2cccc(N(CC(N)=O)Cc3ccccc3)c2)ccc1F 746599355 CXFCCSCSUCMMQY-UHFFFAOYSA-N 437.540 4.433 10 10 IICE C[C@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1cc(Br)c(F)cc1O 756596143 YBWXXNUPROHVAY-AWEZNQCLSA-N 435.337 4.497 10 10 IICE CCN(CC)CCNC(=O)c1ccc(NCc2cc(C)cc(Br)c2O)cc1 787787548 GGCMZLSFRAVCSF-UHFFFAOYSA-N 434.378 4.147 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc(OC(F)F)cc1F 801866122 MDNAZABGLONUEA-UHFFFAOYSA-N 448.489 4.281 10 10 IICE COC[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 803030166 MDFJSLFEGJBMNO-XLIONFOSSA-N 428.529 4.022 10 10 IICE C[C@H](Oc1ccc(F)cc1Br)C(=O)NCc1cc(Br)ccc1O 804735198 OZOHZKDIZYCAFE-VIFPVBQESA-N 447.098 4.140 10 10 IICE CO[C@](C)(c1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1)C1CC1 810336281 GBXBGXCBRLQUAX-VUVZNRFTSA-N 435.596 4.237 10 10 IICE COc1ccc([C@@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1F 918195404 REKMTYJDRBGHFZ-OWCLPIDISA-N 433.499 4.147 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cnc4c(F)ccc(F)c4c3)cc2F)C[C@@H](C)O1 1125255813 CCRXVNYZKOSHIW-ZIAGYGMSSA-N 429.442 4.196 10 10 IICE CN(CCc1cccs1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1126664659 UTOIXPOVGSXBOO-LGMDPLHJSA-N 434.583 4.180 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)CCC3CCCC3)CC2)c(C)n1-c1ccc(F)cc1 1141527886 FJGMYRPFHRVTCZ-UHFFFAOYSA-N 425.548 4.488 10 10 IICE Cc1ccc2c(c1)[C@@H](NC(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)[C@H](C)C2 1147340597 FEOOZWWONRIYKW-SZNDQCEHSA-N 442.562 4.226 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2nc(C(F)(F)F)cs2)cc1 1148104950 GYRLQVYNSQMTIR-UHFFFAOYSA-N 435.471 4.283 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c(C)n1C1CCCCC1 1155604236 QZLLNRRXJMHZJX-UHFFFAOYSA-N 436.600 4.242 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@]3(C)Cc3ccccc3F)C2)cc1 1252115914 NTLDIAZLYQKMND-DFBJGRDBSA-N 425.548 4.467 10 10 IICE COc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1OC1CCCC1 1275224728 WLDGGWKMKHXURP-UHFFFAOYSA-N 446.494 4.061 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1Cc1nc(C(C)(C)C)cs1 1298364183 UTLZLJMCEFVSHA-QGZVFWFLSA-N 441.601 4.316 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C[C@H]1c1ccccc1 1300121903 YPGSBLOGPAWZOI-BJKOFHAPSA-N 444.531 4.244 10 10 IICE CCN(CC(=O)Nc1ccc(OC)c(Cl)c1)Cc1cc(Br)ccc1O 1307496981 BYGDMFHXRXOFBC-UHFFFAOYSA-N 427.726 4.277 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3C(=O)N(C)Cc4ccccc43)cc2Cl)C1 1312591581 YELWZIVDGLXFGE-ZHRRBRCNSA-N 440.975 4.089 10 10 IICE CC(C)Cc1ccc([C@H](CNC(=O)NCc2cccc(Br)c2O)N(C)C)cc1 1312816831 DTFGQJYKOFVSRU-FQEVSTJZSA-N 448.405 4.455 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1(c2ccc(C(F)(F)F)cc2)CC1 1320517381 YRBUXMNUALFDEG-UHFFFAOYSA-N 436.449 4.154 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H](C[C@@H]2CCCO2)C(F)(F)F)cc1 1352929398 PQHIONUTXRRYPN-JKSUJKDBSA-N 426.401 4.391 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnc(OC2CCOCC2)c(Cl)c1 1436850598 QHBBLKSJKQKGGA-INIZCTEOSA-N 431.964 4.028 10 10 IICE CCOC(=O)[C@@H](CCCC(C)C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1439190074 IRBMBUVXXDPFTR-JOCHJYFZSA-N 441.616 4.282 10 10 IICE COc1ccc(N2CCN(Cc3ccc(Br)c4cccnc34)CC2)cc1F 1459748950 QGMVPWJQWMKEGY-UHFFFAOYSA-N 430.321 4.467 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3ncon3)C2)c(C)n1-c1ccc(Br)cc1 1471968758 YDVQTQGRWNOQGA-OAHLLOKOSA-N 429.318 4.259 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)OC(C)(C)C2)sc(C)c1-c1ccccc1 1473126080 BVXIGEXGZRYYKR-OAHLLOKOSA-N 430.570 4.338 10 10 IICE CCOC(=O)[C@@H](Cc1cccc(Cl)c1)NCc1ccc(N2CCC(OC)CC2)cc1 1473700921 WPPFOBMDRBUZFM-HSZRJFAPSA-N 430.976 4.219 10 10 IICE CCCN(C)c1nnc(Cc2cn3ccccc3n2)n1CCCSc1nccs1 1514597599 FXWAYODRBJFJIU-UHFFFAOYSA-N 427.603 4.002 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N(C)CCc2cnccn2)cc1 1515527899 OADPHUWARFFWTC-UHFFFAOYSA-N 445.571 4.210 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@]3(CCCOC3)C2)cc1F 1517004088 WGMSWVAMOKZDEP-XMMPIXPASA-N 429.584 4.127 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(C(F)(F)F)cc4)c3C)CC2)cc1 1519587932 YCMZVWRHKWQYGT-UHFFFAOYSA-N 444.457 4.171 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C(=O)c2ccc(Br)s2)cc1 1520970135 SODXVCFWCNCAEU-UHFFFAOYSA-N 449.292 4.350 10 10 IICE C[C@@H]1COc2ccccc2N1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1532846778 FBWDGAQICDZNJU-ONDHQXCVSA-N 442.537 4.231 10 10 IICE CO[C@H]1CN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1535142443 AZSYEQWJIPSQAO-PXDATVDWSA-N 441.572 4.125 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 1540488046 APOXCTUWWCSCLK-OAQYLSRUSA-N 427.589 4.425 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2cccc(CS(=O)(=O)C3CCCCC3)c2)cc1 1543278174 DMMUPKIRPSHJLH-UHFFFAOYSA-N 428.514 4.349 10 10 IICE C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632883 YBJPMXFCCHEESX-KKSFZXQISA-N 428.960 4.082 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1547446918 KQMDEFOELNOSBE-BWKNWUBXSA-N 441.620 4.072 10 10 IICE COC1CCN(c2ccc(CN3CC[C@H]4CC[C@@H](C3)N4C(=O)OC(C)(C)C)cc2)CC1 1559582714 MUGNUHWMVRTXMZ-YADHBBJMSA-N 429.605 4.276 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC1CC2(CC(NC(=O)OC(C)(C)C)C2)C1 1565485857 QYFGEKGUXPZJJO-UHFFFAOYSA-N 442.604 4.264 10 10 IICE C[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)[C@@H](C)c1ccccc1 1566185375 GGWDJBGTHILKMJ-CABCVRRESA-N 430.551 4.177 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)cc1 1583224853 NYDWCJAHLLNRSP-NRFANRHFSA-N 433.527 4.231 10 10 IICE Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1584510854 GMQDTBQNGBAVLS-UHFFFAOYSA-N 427.548 4.294 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](C)SCc2nc(O)c3ccccc3n2)cc1F 1585698519 PJZSQENIRVCWCY-OAHLLOKOSA-N 442.560 4.259 10 10 IICE COC[C@]1(C(=O)OC(C)(C)C)CCN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)C1 1587045582 ZATPXNLZPVJLGH-VWLOTQADSA-N 426.557 4.223 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@](C)(O)c2ccc(F)c(Br)c2)cc1 1624540727 BKJGBWZJIIOXQS-NRFANRHFSA-N 437.353 4.301 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(I)cc1Cl 1627026456 KDCGMDGMBOGCGN-UHFFFAOYSA-N 436.673 4.066 10 10 IICE Cc1cc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(C)n1-c1ccc(F)cc1 1627767920 JZCOWKXDEZWULP-QGZVFWFLSA-N 443.441 4.419 10 10 IICE Cc1cc(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1630461157 GOEYGQFJSSQPBO-UHFFFAOYSA-N 447.554 4.444 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCCCOc1ncc(C(F)(F)F)cc1Cl 1633970561 DAFRDBAXXOYDPE-UHFFFAOYSA-N 444.885 4.430 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H]2CCC[C@]2(NC(=O)OC(C)(C)C)C1 1636262269 DQAVIAPZQBJNLS-NNPDTBDGSA-N 444.620 4.081 10 10 IICE CC1(C)C(=O)Nc2ccccc2N1C(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 1653624112 ZUUKWSOBEWRDGH-UHFFFAOYSA-N 433.430 4.102 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)cc2)CC1 1683701638 FTZYSWUANCSISA-HXUWFJFHSA-N 446.517 4.156 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC(C)(C)C1 1698065580 UUNFIORUKPGWDH-UHFFFAOYSA-N 425.602 4.331 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1708739900 GNUVBOZIRRUYAT-KRWDZBQOSA-N 444.599 4.076 10 10 IICE CC(C)CCOCCn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1741535512 BVLPDMFHEOABML-UHFFFAOYSA-N 443.636 4.111 10 10 IICE COCC[C@H]1CCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1769627525 SZVPJMMBELHHPP-SJORKVTESA-N 437.635 4.021 10 10 IICE COc1ccc(N2CCN(C(=O)Cn3nc(-c4ccccc4)c4ccccc43)CC2)cc1 1858210425 DZUUGFZKSMDTBC-UHFFFAOYSA-N 426.520 4.061 10 10 IICE COc1ccc(CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)cc1C 2084723329 XABXURSPHUEQIV-HSZRJFAPSA-N 439.600 4.215 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3F)C2=O)ccc1O[C@H](C)C(=O)O 2314933730 CTQJBWPCSAYMKB-GFCCVEGCSA-N 447.509 4.482 10 10 IICE O=C(COc1ccc(Cl)cc1)NN1C(=O)/C(=C\c2ccccc2Cl)SC1=S 3079178 FGCQVEOUNOUYRV-OQLLNIDSSA-N 439.345 4.305 10 10 IICE O=C(Cn1cnc2ccccc2c1=O)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 10909154 KYODKEWFGHFSHL-SANMLTNESA-N 435.483 4.161 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccc[nH]2)SC1=S)c1ccc(OCc2ccccc2)cc1 27231270 OYFKGAYEDBRPQH-CPNJWEJPSA-N 435.530 4.140 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc(N(C)C)c([N+](=O)[O-])c3)C2=O)cc1Cl 35374511 MKTWERAVPJAUIV-ZSOIEALJSA-N 428.832 4.129 10 10 IICE COc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)cc1 39570418 MTBRBCKJIMDRFN-SANMLTNESA-N 445.519 4.061 10 10 IICE O=C(NN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S)c1cccnc1 40867477 RADWNAOAPHUXTH-MOSHPQCFSA-N 447.541 4.207 10 10 IICE COc1ccc(N2CCCN(C(=O)C(C)(C)c3cccc(Br)c3)CC2)cc1 726504777 ZGDAMQUWSNWIBQ-UHFFFAOYSA-N 431.374 4.474 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(F)cc3NC(=O)c3ccoc3)CC2)cc1 726561664 JLMUGAQYSDHYDJ-UHFFFAOYSA-N 437.471 4.078 10 10 IICE O=S(=O)(Nc1nc(-c2cc(F)ccc2F)cs1)c1cc2c(cc1Cl)OCCO2 727245802 DPEVEPKXTOWHOE-UHFFFAOYSA-N 444.868 4.314 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)c1cc(C)n(-c3ccccn3)c1C)O[C@@H](C)C2 730780937 UVLSPEUAWMZJLZ-XUEUYAKLSA-N 431.536 4.497 10 10 IICE Cc1nc(CNC(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)no1 743640069 AUPSJVZUFCTLOQ-KRWDZBQOSA-N 433.434 4.373 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)c([N+](=O)[O-])c1 747621046 SCQGPHVMFLTYBI-QJSCKGPTSA-N 436.386 4.378 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](Cn3ccnc3)c3ccc(C)cc3C)CC2)cc1 750390637 HHHGFJRSJMIVMA-VWLOTQADSA-N 447.583 4.172 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3n[nH]c(-c4ccccc4)n3)C2)c(C)n1-c1ccccn1 753198685 VEHQAFAGCLZKDG-FQEVSTJZSA-N 426.524 4.294 10 10 IICE C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1cc(Br)cc(F)c1O 756760483 JQUJZUXVKWGQRB-PSLIRLAXSA-N 433.115 4.441 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccc(Oc2nccs2)c1 768544072 ONZQIWUHSGJSGC-UHFFFAOYSA-N 448.592 4.397 10 10 IICE COc1ccc([C@@H](C)N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 769054697 KJMNIUOROVWACV-HXUWFJFHSA-N 436.600 4.130 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@]4(CCOC4)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802695025 PDUMUQRFGAFBLB-ATIYNZHBSA-N 447.583 4.148 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)O[C@@H]1CCc2cccnc21 1128192889 DTKAURGKQXRPGE-WISAJEAXSA-N 428.510 4.043 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C)n1C1CCOCC1 1136311122 GWAJAEXGJCYOCI-ROUUACIJSA-N 443.563 4.139 10 10 IICE C[C@H](NC(=O)[C@@H]1CCCN1Cc1ccc(Cl)cc1)c1ccc(N2CCOCC2)cc1 1136442954 KKXVLRFUSZIISH-MBSDFSHPSA-N 427.976 4.018 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(C)c4ccccc43)cc2F)C[C@@H](C)O1 1194792081 PULLSLVKICGYLX-KDURUIRLSA-N 439.575 4.243 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(Cc2ccc(Cl)cc2)CCC1 1253512752 YJCRRJXYUPAXMB-UHFFFAOYSA-N 427.976 4.266 10 10 IICE C[C@H](CNC(=O)OC(C)(C)C)Cn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C 1288720734 BZHPNFBMSJKFHZ-MRXNPFEDSA-N 431.581 4.078 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H]([C@H]4CCOC4)C3)nnc2C(C)(C)C)cc1 1295420430 ZYPAVJHZFFSDEN-SFTDATJTSA-N 425.621 4.333 10 10 IICE CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1296740373 CECYOAOFIGLZBW-MRXNPFEDSA-N 433.268 4.242 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cc(C(=O)OC(C)(C)C)ccn2)cc1 1301005322 UNELFZPSEZLBDM-UHFFFAOYSA-N 433.508 4.438 10 10 IICE COC[C@H]1CCN(c2nnc(-c3ccc(OC)cc3)n2CCCSc2nccs2)C1 1315910193 GECLNQDEHXRVTE-INIZCTEOSA-N 445.614 4.065 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCCCCC[C@@H]1NC(=O)OC(C)(C)C 1360847928 CMVFTSVHKCCMCB-MOPGFXCFSA-N 431.577 4.342 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(F)c(F)c(F)c1 1435282127 VIPPLLZJLOAFHU-VIZOYTHASA-N 440.443 4.473 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1 1440746532 LJJGFKXNHDJELB-UHFFFAOYSA-N 444.623 4.340 10 10 IICE CC[C@@](O)(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(Cl)c1 1441783720 MXUZUGJSRBZSTL-PXAQALGRSA-N 434.939 4.007 10 10 IICE Cc1ccc(C(=O)N[C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)c(O)c1O 1444952725 DSRRTAVZFCYLCZ-HXUWFJFHSA-N 425.868 4.350 10 10 IICE C[C@H](Cc1cccs1)N(C)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1445362173 GXQOBHHVUGFNDG-CYBMUJFWSA-N 436.580 4.019 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](C[C@@H]1COCCO1)C(F)(F)F 1446799429 FHMVEUOKRQEDEG-NSISKUIASA-N 437.458 4.466 10 10 IICE Cc1cc(C(=O)CN2C(=O)CN(/C=C\c3ccccc3)C2=O)c(C)n1-c1cccc(F)c1 1458925469 YJWYSOFFBSJHBG-QXMHVHEDSA-N 431.467 4.351 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(-c4cccc(Cl)c4)nc3O)CC2)cc1 1466210388 HEHNOVHKIGSECR-UHFFFAOYSA-N 437.927 4.469 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H]2C[C@@H](N3CCOCC3)C2(C)C)cc1 1469715235 HPPPNOZUNYXLOS-XZOQPEGZSA-N 435.572 4.397 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4ccc(Br)cc4C3)C2)cc1 1470595164 ZYJJANJYBGKWSM-INIZCTEOSA-N 444.373 4.052 10 10 IICE CC[C@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cc(F)ccc1OC 1473813109 HCAMIKAYYNTVLI-QFIPXVFZSA-N 446.478 4.289 10 10 IICE C[C@@H]1SCCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)[C@@H]1C 1494691637 XQTGYATYFURPOP-CVEARBPZSA-N 446.671 4.233 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N2CCC[C@](C)(OC)CC2)cc1 1501839893 VYBCNFHPKQNGIM-VWLOTQADSA-N 449.603 4.025 10 10 IICE CC(C)OCCCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1509861435 GGYNAXXGXYJAFJ-UHFFFAOYSA-N 443.636 4.155 10 10 IICE CC[C@H]1CN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)CCS1 1514160036 AHBJHBFUWVPHHL-CVEARBPZSA-N 439.676 4.143 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)cc4ccc(C)nc34)cc2F)CC1 1521016163 KSYLCTORZPLKSO-UHFFFAOYSA-N 440.950 4.408 10 10 IICE COC(=O)c1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)cc1C 1522522917 LCAQXFBEPQCFMP-UHFFFAOYSA-N 433.552 4.450 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Br)cc(N3CCCC3)c2)cc1 1527595033 GLLYURJFGHODCC-UHFFFAOYSA-N 446.389 4.266 10 10 IICE COc1ccccc1N1CC[C@@H](NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1=O 1535191648 ZMZSKPLSBBIGMT-HXUWFJFHSA-N 437.927 4.291 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H](C)N(C)Cc2ccccc2)C1 1538151975 ANUCBKOAAZNGNW-NRFANRHFSA-N 432.612 4.045 10 10 IICE CCc1nc(C(=O)NCc2ccc3c(c2)CCCN3C)nn1-c1c(Cl)cccc1Cl 1542389725 MIYQDCVHOSVCJE-UHFFFAOYSA-N 444.366 4.449 10 10 IICE COc1ccc(CN(C)c2nnc(C(C)C)n2CCCSc2nccs2)cc1O 1554914363 MCDOWGRRXZSDMA-UHFFFAOYSA-N 433.603 4.391 10 10 IICE Cc1cc(C(=O)NCCCCCN2CCCC2)c(C)n1-c1ccc(Br)cn1 1556748711 GNLGFDMHOPUMDT-UHFFFAOYSA-N 433.394 4.248 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1C[C@H](Oc2ccccc2)C1(C)C 1565127652 ZBXJGZUJRJIIDQ-ZEQRLZLVSA-N 437.584 4.035 10 10 IICE CCc1nn(C)c(OC)c1CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1566947398 UJIQILVSVNGPSS-UHFFFAOYSA-N 445.361 4.091 10 10 IICE Cc1cc(CNC(=O)OC(C)(C)C)oc1C(=O)NCc1cccc(Br)c1O 1568604490 IQQULJVAUCXUIK-UHFFFAOYSA-N 439.306 4.011 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)C3CC3)CC2(C)C)c(C)n1-c1ccc(Cl)cc1 1583940886 UUYQAILRDHXCEP-UHFFFAOYSA-N 427.976 4.149 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@@H](c2cccc(Br)c2)C1 1584549871 VVYUWDLJLYXRAP-MRXNPFEDSA-N 434.311 4.289 10 10 IICE COc1ccc(Cn2nccc2NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1584859266 XKZSLUUTIULEHV-UHFFFAOYSA-N 442.519 4.341 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C3CCOCC3)C2)c(C)n1-c1ccc(Br)cn1 1596437837 BFZMLAFQOHEECB-KRWDZBQOSA-N 432.362 4.140 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnc(-c4c(F)cccc4F)s3)C2)cc1 1598364887 YJBAHEDTBCNZIX-AWEZNQCLSA-N 429.492 4.353 10 10 IICE CC(C)c1nnc(N2CCS[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1602926578 JFDQANLMZDXDNJ-NRFANRHFSA-N 447.624 4.003 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1615768705 MUPYZXKXXWZUEB-QZTJIDSGSA-N 430.616 4.039 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cccc(F)c1O 1618369280 TWOGRGNRHXYKNB-UHFFFAOYSA-N 427.233 4.256 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H]4CC[C@H](C3)N4C(=O)OC(C)(C)C)ccc21 1623986429 MFFVDJVGVLSFIC-BGYRXZFFSA-N 441.572 4.128 10 10 IICE Cc1cc(C(=O)N2CCN(CC(F)(F)F)CC2)c(C)n1-c1ccccc1Br 1624766827 IQKVOPKGKXKYNH-UHFFFAOYSA-N 444.295 4.177 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1 1628857861 PDVLNONUDPKHID-HXUWFJFHSA-N 427.976 4.193 10 10 IICE CCNS(=O)(=O)c1cccc(C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)c1 1631531163 JFSDYCWAJDMPQY-SFHVURJKSA-N 438.549 4.094 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)cc(C(=O)OC(C)(C)C)c1 1631533825 HNOBOFAJLXAKLI-UHFFFAOYSA-N 447.915 4.125 10 10 IICE CC(=O)Nc1cc(F)c(F)cc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1631904166 SIEABDOWILYBMO-UHFFFAOYSA-N 425.435 4.324 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N[C@@H](C)C(C)C)c(C)n1-c1cccc(Cl)c1 1633273775 OIEDUBYMFMLWMI-YWZLYKJASA-N 434.005 4.423 10 10 IICE Cc1cc(CCNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)c(C)n1-c1ccccc1 1634632832 GNFDZSLYPDHUTB-QHCPKHFHSA-N 445.567 4.242 10 10 IICE CCCOc1ccccc1[C@H](CC(C)C)NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1635257683 ZOEJRCLCHIVTLY-IBGZPJMESA-N 434.558 4.070 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1 1635677195 ZOTHMNODZGCFLR-HOTGVXAUSA-N 447.373 4.431 10 10 IICE Cc1ccc([C@H]2CSCCN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1635992659 XTSBMUAOTUDZPC-OAQYLSRUSA-N 447.551 4.110 10 10 IICE CCc1nn(C)c(OC)c1CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1637400822 YOGYOJBAEIOTKT-UHFFFAOYSA-N 445.361 4.091 10 10 IICE Cc1cccc(CN(CC(C)C)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1638478396 ACNWDUDGIDDXEF-UHFFFAOYSA-N 436.600 4.065 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3n[nH]c(-c4ccc(O)c(Cl)c4)n3)ccc21 1638609613 VLJRNXXDOLAOEE-UHFFFAOYSA-N 439.903 4.301 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(F)c(F)cc2C(=O)c2ccccc2)cc1 1640771642 PJTZIPHSNPEORV-UHFFFAOYSA-N 438.474 4.413 10 10 IICE Cc1cncc(N(Cc2ncc[nH]2)C(=O)c2cccc3c2CCN3C(=O)OC(C)(C)C)c1 1645408304 RKABRWCSDQWTBQ-UHFFFAOYSA-N 433.512 4.258 10 10 IICE CCOC(=O)[C@@](C)(NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1652148929 OEZBLVUBPPQXIS-SANMLTNESA-N 432.520 4.423 10 10 IICE C[C@@H](Nc1ccc(C(=O)NCc2cccc(Cl)c2O)cc1[N+](=O)[O-])c1ccccn1 1653564011 WUMCJGPBEZJJLE-CYBMUJFWSA-N 426.860 4.452 10 10 IICE C[C@H](NC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1)c1ccc(N(C)C)cc1 1671852374 WSCQQDXZZQYQHI-VHKYSDTDSA-N 432.362 4.094 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@](C)(C(F)(F)F)C3)cc2Cl)C1 1682023654 ICSBKEMKYYHTGQ-AUUYWEPGSA-N 433.902 4.439 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@H]2Cc2ccccc2F)N(C)C)cc1 1685610232 WLIRGQCSBXOIDI-LADGPHEKSA-N 426.580 4.301 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1686096060 DLBVBYDNIILYFM-NOZRDPDXSA-N 427.564 4.197 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@@H]2C[C@@H](Oc3ccccc3)C2(C)C)N(C)C)cc1 1687807575 UNFWAPNDNCMPCA-RBZQAINGSA-N 438.616 4.243 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@H](c1cccs1)N(C)C 1696700492 FIUKNEZSLKNKSE-UYAOXDASSA-N 441.601 4.226 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@H]2C)n1Cc1ccc(N(CC)CC)cc1 1708724426 JMYOPTSIOBCSFW-RTBURBONSA-N 440.636 4.326 10 10 IICE COCC1(CCn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCCC1 1730506538 PZNRIRXEEZVMKC-FQEVSTJZSA-N 428.577 4.111 10 10 IICE CC(C)Cc1nnc(N(C)CC(F)(F)F)n1Cc1ccc(N2CCSCC2)cc1 1741430663 YOXUZNWFQOPJTK-UHFFFAOYSA-N 427.540 4.077 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4C)c(C)s2)cc1 1859570447 LFCUAKHRKJUMGL-UHFFFAOYSA-N 427.551 4.137 10 10 IICE Oc1c(Br)cc(Cl)cc1CNC[C@@H]1CC1(Br)Br 2213078671 DGKRTZOFJPHLKK-ZETCQYMHSA-N 448.380 4.404 10 10 IICE Cc1ccc(C(=O)NC(=Cc2ccc(N(C)C)cc2)C(=O)NCCc2ccccc2)cc1 2297232830 KEEGVIJSKSPEFY-UHFFFAOYSA-N 427.548 4.191 10 10 IICE CCOc1ccccc1C=C1C(=O)NC(=O)N(c2cc(C)c(C)cc2Br)C1=O 2313547864 DWBICSPVRUUHRT-UHFFFAOYSA-N 443.297 4.131 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c(C)c1 2313548626 AGGHWXXBSZERQE-UHFFFAOYSA-N 431.404 4.138 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)C1=Cc1cc(OC)c(OC)c(OC)c1 2313577460 YPNITJORWMBNQH-UHFFFAOYSA-N 437.492 4.288 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3ccc(F)cc3F)SC2=S)N(C)C)cc1 2323879964 ZMNLVOWGWBYWDF-GOSISDBHSA-N 434.533 4.478 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380758020 GZJJQZGAZQYNQD-FQEVSTJZSA-N 441.366 4.069 10 10 IICE COc1cc(/C=C2/C(=N)N3C(SC)=NSC3=NC2=O)ccc1OCc1ccccc1 20154751 HQSVPSPUNBYADA-HUHIGAQKSA-N 438.534 4.214 10 10 IICE Cc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)cc1 47152309 BZNPKPCJIWRHFS-MFVBVHDHSA-N 427.507 4.132 10 10 IICE COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C/c1ccc(C(=O)OC)cc1 103756383 NYRSTSRXPPDAQU-WOJGMQOQSA-N 425.868 4.312 10 10 IICE CC[C@H](NCCN1CCN(Cc2ccccc2)CC1)c1cc(Br)ccc1O 390702648 UKEOSIALHFWJJR-NRFANRHFSA-N 432.406 4.013 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OCc2cccnc2)cc1 728692374 KEUUZBLWXPBVQG-UHFFFAOYSA-N 432.524 4.161 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)NC(=O)OC(C)(C)C)cc1 742752232 FLGGGOWRZZVUMY-FSSWDIPSSA-N 441.547 4.377 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3oc(C4CC4)nc3C)c2C)cc1 759709971 ZDURBQBMHDADTP-UHFFFAOYSA-N 436.464 4.094 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc([N+](=O)[O-])cn2)c(C)n1-c1cccc(C(F)(F)F)c1 761980719 CUNWMPXQECFIBE-UHFFFAOYSA-N 447.369 4.456 10 10 IICE CCn1c(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)nc2ccccc21 766367408 JHYIRKNLCISCBQ-UHFFFAOYSA-N 429.568 4.094 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 768915366 KJVNLAQSYUZLFH-NQERJWCQSA-N 441.959 4.035 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cnn(CC(F)(F)F)c3)n2)c1C 775149704 SYWHPYBZSJDAOF-UHFFFAOYSA-N 447.508 4.198 10 10 IICE CCCN(CCC)C(=O)c1cccc(C(=O)NCc2cc(Br)ccc2O)c1 804739909 YFUJWPOUFPWRCE-UHFFFAOYSA-N 433.346 4.347 10 10 IICE CC(=O)O[C@H]1[C@@H]2O[C@@H](c3ccccc3)OC[C@H]2O[C@@H](Sc2ccccc2)[C@@H]1N=[N+]=[N-] 1082544991 BBGNXDOVHXFZJI-SOXBMFEASA-N 427.482 4.228 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nccn2CCc2ccccc2)cc1 1137269976 IKASNZHZRQEBGF-UHFFFAOYSA-N 440.547 4.205 10 10 IICE CCOC(=O)C[C@@H]1CCN(C(=O)C2=CCCN(C(=O)OC(C)(C)C)CC2)c2ccccc21 1159164822 JCMZPVIBMNZELF-IBGZPJMESA-N 442.556 4.417 10 10 IICE Cn1nccc1[C@@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C(=O)OC(C)(C)C 1195747333 CZMSJGVYRXZYFP-JOCHJYFZSA-N 448.527 4.447 10 10 IICE CC(C)(C)OC(=O)N[C@H]1Cc2ccccc2N(C(=O)/C=C/c2cnc3ccccc3n2)C1 1276403078 OKGANZNNXROHOX-HYSAVQALSA-N 430.508 4.126 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCCOc3ccccc3Br)C2)cc1 1278862140 YJWBHUWYXHJROL-MRXNPFEDSA-N 433.346 4.012 10 10 IICE Cc1c(O)nc2ccccc2c1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1292593818 JHPVXBSTUNUAII-UHFFFAOYSA-N 427.451 4.249 10 10 IICE COc1cc(OC)c(OC)cc1CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1292651322 XTGAHLGRZUFESQ-UHFFFAOYSA-N 436.508 4.171 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CC(F)F)CC1 1294593054 KNBNZVAUJHFAMG-UHFFFAOYSA-N 428.531 4.150 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H](OC)C(C)(C)C 1305526106 JJELAMAHWBAZOQ-UTKZUKDTSA-N 447.599 4.327 10 10 IICE CCN(CCc1cccs1)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)cc1 1313788767 BMLWWXAVHAQTTH-UHFFFAOYSA-N 439.629 4.417 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC[C@@H](C(F)(F)F)C1 1361098565 VVOAAIZGMOSDLY-IEBWSBKVSA-N 437.510 4.331 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4cccc(F)c4)c3C(F)(F)F)C2)cc1 1437580111 QMNHJMXFWCTQSL-OAHLLOKOSA-N 448.420 4.048 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)N[C@@H](C)c1ccc(N3CCOCC3)cc1)O2 1442408196 GHUYMJUOUUPTSK-AFMDSPMNSA-N 438.568 4.115 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCC2(OCCO)CCC(C(F)F)CC2)c1C 1456510600 DJIMHJUVKJLCGT-UHFFFAOYSA-N 434.527 4.335 10 10 IICE COc1ccc(S(=O)(=O)CC(=O)c2cc(C)n(-c3cccc(SC)c3)c2C)cc1 1459108738 DBGBISDOBXCJGI-UHFFFAOYSA-N 429.563 4.481 10 10 IICE CC[C@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1F 1469772074 QZAJUYBLZSIRBL-KRWDZBQOSA-N 434.514 4.275 10 10 IICE Cc1cc(CNC(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C[C@@H]2C)c(C)n1-c1ccccc1 1471036468 CZMKHQJJRURVLG-JXFKEZNVSA-N 426.561 4.291 10 10 IICE COc1ccc([C@@H](NC(=O)N2CCCN(c3ccc(OC)cc3)CC2)c2ccco2)cc1 1478834488 VDTMIZUIHJVULD-XMMPIXPASA-N 435.524 4.308 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](OCC3CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1495597151 GRUKDGDMYLWTQV-FXAWDEMLSA-N 429.584 4.440 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@H](NC(C)=O)Cc2ccccc21 1519477611 HNVOIYLEBUIEPR-CHHLAKQQSA-N 429.520 4.131 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H]2CCCN(c3nc4ccccc4s3)C2)cc1 1527596309 UZWGGHCDMZYSQX-SFHVURJKSA-N 438.597 4.116 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@]1(C)CC1(Br)Br 1529276868 BIKGZPRFQDEATA-BLLLJJGKSA-N 432.200 4.004 10 10 IICE CCCCCC(=O)NC1CCN(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CC1 1535855997 IUTSRBNJNLITEU-UHFFFAOYSA-N 439.600 4.216 10 10 IICE Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1539706327 JJWSCGGIRKZTNW-FQEVSTJZSA-N 444.551 4.495 10 10 IICE COC(=O)CNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)C[C@@H](C)C2 1540610198 LZFVIBWSBTYXAH-JFPYRBRCSA-N 443.547 4.327 10 10 IICE C[C@H](NC(=O)c1cc2ccc(C(F)(F)F)cc2nc1O)c1ccc(N2CCOCC2)cc1 1542403173 MMYPEONRCDISEP-AWEZNQCLSA-N 445.441 4.287 10 10 IICE Cc1cc(CCNC(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1543592925 BGWLQVDERLSSQV-IRLDBZIGSA-N 443.563 4.348 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)cc2Cl)C1 1556369994 ZQTMYULWGIRULS-OCQZMCQHSA-N 448.007 4.305 10 10 IICE CCn1cnc2c1CCN(C(=O)c1cc(C)n(-c3cccc(Br)c3)c1C)C2 1558511896 PSERNSFBMFRVQM-UHFFFAOYSA-N 427.346 4.272 10 10 IICE C[C@@H]1CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC[C@H]1c1ccccc1 1564895866 XNSGHHWJMCOWPS-YLJYHZDGSA-N 429.511 4.137 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)N(C)C)cc1 1586060325 GUUVPDJQAGLQKD-HXUWFJFHSA-N 446.473 4.459 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)c1 1586213319 SZCXGJCMVPZELV-OAQYLSRUSA-N 435.911 4.095 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C)CC(C)C 1586411856 AIBNPRSKFAKVJD-INIZCTEOSA-N 435.362 4.422 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(C)CCC2CCOCC2)cc1 1615378231 NERSHUZTKINSOL-UHFFFAOYSA-N 448.615 4.488 10 10 IICE CCCOc1nc2ccccc2cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1618649184 XYPXXIKCCNCSSW-UHFFFAOYSA-N 437.515 4.054 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)nc2)c(C)n1-c1ccc(Br)cc1 1625463306 XDFPMWFHEYJLHF-UHFFFAOYSA-N 427.346 4.248 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(C)c(C)c1 1625812008 OUISCALGRXOFGE-VWLOTQADSA-N 432.520 4.096 10 10 IICE Cc1c(NCC(C)(C)C)cccc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1626059298 XJHURQZFYZBTKU-UHFFFAOYSA-N 431.527 4.498 10 10 IICE CCOC(=O)N1[C@@H](C(=O)N(CC)Cc2ccc(N(C)C)cc2)CC[C@@H]1c1ccc(C)o1 1626885962 TUHTYWGDZRDDEB-NHCUHLMSSA-N 427.545 4.365 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc([C@]3(C)NC(=O)N(C)C3=O)cc2)c1C 1627740657 AYXLLJFRDXTXOT-VWLOTQADSA-N 430.508 4.052 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CC[C@H](C2CC2)N1C(=O)OC(C)(C)C 1630181027 RENKSIZOFAYYHK-WTOYTKOKSA-N 429.605 4.286 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](COC(C)C)C2)c(C)n1-c1cccc(Br)c1 1634448347 QLFRXQRQUVQQEB-LJQANCHMSA-N 435.362 4.123 10 10 IICE CCc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cnn1CCC(C)C 1635940250 ACKDMZLEHRMCGO-IBGZPJMESA-N 432.996 4.245 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1cccc(Cl)c1 1636130911 IOIXMEGCJBAUDU-GJZGRUSLSA-N 440.931 4.241 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](C)[C@H](C)C(=O)Nc3ncccc3O)c2C)c1 1636133454 ZSZNMGRRWRUQDA-ZWKOTPCHSA-N 434.540 4.205 10 10 IICE COc1cc(N2C[C@@H]3CCCC[C@]3(CNC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])cc1OC 1652337275 VKXKRHILJXVSGJ-NYHFZMIOSA-N 435.521 4.133 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](c3cccc(C)c3)c3ccccn3)CC2)c(OC)c1 1681007803 JUZHDIGNWFGZIP-VWLOTQADSA-N 446.551 4.028 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCOc2c(Br)cccc2C1 1683421128 GTCIWZMOMNANDE-INIZCTEOSA-N 446.389 4.359 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](c1ccc(F)cc1F)c1nccn1C 1684594109 WFQPAGUUPKALRT-QFIPXVFZSA-N 441.526 4.474 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3C[C@H]3c3cccc(C(F)(F)F)c3)CC2)c(OC)c1 1685013629 DCNYBDVINOVDSK-RBUKOAKNSA-N 449.473 4.110 10 10 IICE C#CCSCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCOC1 1705654190 ZOPPCEBOAJGENX-NRFANRHFSA-N 449.624 4.192 10 10 IICE CCC1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)NC)CC1 1709288897 MWUZFURNPSKWCG-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCCN(CC)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1709711335 TXXXVIVXDJOKJD-UHFFFAOYSA-N 435.551 4.006 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1709979962 QYJLMTCBWLOKDT-UHFFFAOYSA-N 436.604 4.313 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1CC1(N(C)C)CCCCC1 1711095206 FAZODFZVWXCFFB-OAQYLSRUSA-N 427.593 4.126 10 10 IICE CC(C)Cc1nnc(N2CCC(O)(C(F)(F)F)CC2)n1CCCSc1nccs1 1723300395 ARBNEHCGNAMWCL-UHFFFAOYSA-N 449.568 4.009 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1763242618 QJMGWISCEWCZSX-SIKLNZKXSA-N 425.621 4.376 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(F)cc4)n(CC(C)C)n3)CC2)cc1 1862374792 ZFXSDXSLRGUGDO-UHFFFAOYSA-N 436.531 4.316 10 10 IICE CCCCCCN1C(=O)C(NCCCOC)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165516 MGEROQLXXHDYHT-UHFFFAOYSA-N 437.584 4.380 10 10 IICE O=C(OCc1ccccc1)N1CC(CNCc2cc(Cl)cc(Br)c2O)C1 1914329172 YNYLNUCSLLKIEV-UHFFFAOYSA-N 439.737 4.166 10 10 IICE CN(CCN(Cc1ccccc1)c1cc2c(cc1Cl)[C@H](O)C(=O)N2)Cc1ccccc1 1946813333 PSXKTXJGSTVMEB-DEOSSOPVSA-N 435.955 4.464 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNCc1cccc(Br)c1O)C2 2103450758 IAXVOPZOAQDPKL-RBVVOMGSSA-N 425.367 4.422 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c1O 2227748000 ILNQOOBAQZUFFT-ZDUSSCGKSA-N 429.355 4.043 10 10 IICE Oc1c(Br)cccc1CNCCc1cccc(I)c1 2273848460 PCKYLJRSXHDSDG-UHFFFAOYSA-N 432.099 4.092 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)Nc1cccc2nonc12 2296558738 UFJQBGIBSIEBLS-UHFFFAOYSA-N 444.925 4.106 10 10 IICE CCOC(=O)CCN1C(=O)C(=Cc2ccc(OCc3ccccc3)cc2)SC1=S 2314741183 VIYQNLNOJXCUAC-UHFFFAOYSA-N 427.547 4.420 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(CCc3ccccc3)C2=O)cc1)C(=O)O 2314928973 FNKUWUKCWJCDHD-GOSISDBHSA-N 427.547 4.373 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1cc(Br)cc(F)c1O)[C@H]2F 2358241762 UOMXYRQLWGYAND-DMRZNYOFSA-N 447.320 4.262 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(C(=O)O)cc1 6241529 FHLYGDYSRTXJMB-LICLKQGHSA-N 442.265 4.025 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3ccc(OCc4ccccc4)c(Br)c3)C(=N)N2O1 20236815 QPPQGVVRQHYRIS-BHBBQXGTSA-N 438.281 4.478 10 10 IICE O=C(CCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccc2oc(=O)ccc2c1 33537667 KGJOOUWJDGVCQD-LFIBNONCSA-N 442.543 4.085 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc(Br)ccc1O)N2 226720780 GVDHMLUQYWVWLX-SIFCLUCFSA-N 449.370 4.232 10 10 IICE CN1CCN(S(=O)(=O)c2ccc(Nc3ccc(N=Nc4ccccc4)cc3)nc2)CC1 256020862 GTATUBJUZADMDA-UHFFFAOYSA-N 436.541 4.177 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(I)cc1Cl 727997065 ZQVIFMZJGDLMGY-UHFFFAOYSA-N 442.684 4.034 10 10 IICE CC1(C)CCCN1C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 728282063 AALQVRDQSDYBLH-GXDHUFHOSA-N 439.400 4.051 10 10 IICE CC1CCN(c2ccc(CNC(=O)N3CCC(NC(=O)C4CCCCC4)CC3)cc2)CC1 731047986 BEPXCZPLHWHHCI-UHFFFAOYSA-N 440.632 4.293 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1cccc(N2CCCCCC2)c1 761342304 ISGMKOGMIUDOFD-UHFFFAOYSA-N 443.569 4.225 10 10 IICE C[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1cc(Br)cc(Cl)c1O 765809954 PWWKOIORLXNXGS-LLVKDONJSA-N 444.732 4.030 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1Cc2ccccc2C2(CC2)C1 773236243 ILPAYVGNDTXAPE-UHFFFAOYSA-N 445.485 4.299 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CN[C@@H](c3ccc(Br)cc3)C3CC3)cc2)C1 774392568 PDUNCIXCGGENJR-SIKLNZKXSA-N 442.401 4.392 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cccnc3C(F)(F)F)n2)cc1[N+](=O)[O-] 808527311 DRMUHOGHVOMBOP-UHFFFAOYSA-N 444.416 4.241 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)/C=C/c2ccc(Br)o2)cc1 916566486 ZQTSLFXTSGCHHP-RDELFYGPSA-N 433.346 4.329 10 10 IICE CC(C)C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)c1cccs1 919655210 USXYQXUBHHVQML-QUCCMNQESA-N 428.602 4.036 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nnn(-c2ccc(F)c(Cl)c2)c1C 1129973335 HYGCXHXVWVVRMS-AWEZNQCLSA-N 429.927 4.104 10 10 IICE Cc1cccc([C@@H](CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)NC(N)=O)c1 1155727413 RDFPRQSPKSFNOE-LAUBAEHRSA-N 442.991 4.301 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCCN(C2CCCC2)CC1 1289423999 QOWBSTJWWCTSLG-UHFFFAOYSA-N 438.664 4.354 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1294472509 KJEAGAWEMJKZCY-QFIPXVFZSA-N 438.664 4.075 10 10 IICE COc1cccc(OCCN2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)c1 1295387647 YWKFRUICWBEIDD-UHFFFAOYSA-N 439.581 4.001 10 10 IICE O=C(NCC[C@H]1CCc2ccccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1298684107 CYZFAXTZSSFXAG-MRXNPFEDSA-N 442.562 4.104 10 10 IICE COc1ccc(-c2nnc(N(C)C3CC3)n2CCCSc2nccs2)cc1OC 1299996256 YAYAGKNKRSDKCS-UHFFFAOYSA-N 431.587 4.200 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3C[C@H](OC)C(C)C)CC2)cc1 1300246525 CBMFJJSCDFBINN-QHCPKHFHSA-N 441.620 4.332 10 10 IICE Cc1cc(N2CCN(C(=O)CSc3ncc(C(C)(C)C)s3)CC2)nc(C(C)C)n1 1307316794 RNUQAJQNQADXEJ-UHFFFAOYSA-N 433.647 4.103 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C(=O)N(C)Cc4ccccc43)cc2Cl)C1 1312591579 YELWZIVDGLXFGE-KSFYIVLOSA-N 440.975 4.089 10 10 IICE Cc1c(CN(C)c2nnc(C(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)cnn1C 1360931657 XRDPPMBUEZICNH-UHFFFAOYSA-N 435.620 4.364 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(C(=O)OC(C)(C)C)cn2)C1 1437261242 DXJPVJRRIIITBZ-UHFFFAOYSA-N 448.567 4.397 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CC(=O)N(c2ccc(F)c(C)c2)C1 1445660734 WYZGHJSDTSZUEC-OAHLLOKOSA-N 449.320 4.004 10 10 IICE COCCOCc1ccc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1450352692 WAMSAKZMYJQGLQ-UHFFFAOYSA-N 434.536 4.308 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2Cc3c(F)cc(C)cc3N2C(=O)OC(C)(C)C)c1 1465991300 AGMJUJUUCKIPPG-XOBRGWDASA-N 444.503 4.392 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cn1c(SC(F)F)nc2ccccc21 1469103882 MFFZSUPNBLCHDK-HNNXBMFYSA-N 432.540 4.473 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1Oc1ccccc1 1469859081 ISRUMJWBVPUXRU-YQVWRLOYSA-N 425.312 4.123 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cc1 1470218059 RPYXDNWHANUHGO-SBUREZEXSA-N 438.568 4.275 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H](OC)C(C)(C)C 1503012580 SUTHUPZWGYGXOV-NRFANRHFSA-N 429.609 4.112 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@@H](C(C)(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1511697445 OEWLFYUZCONHOS-JOCHJYFZSA-N 449.647 4.435 10 10 IICE CC(C)(C)SCCNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1519604071 DKRVCPXQZVSWGT-NTCAYCPXSA-N 426.604 4.065 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(-n4ccnn4)ccc3F)cc2Cl)C1 1524702572 CCBWHQCFQLEMCC-OAHLLOKOSA-N 427.911 4.226 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@@H]3C[C@H](C)c4c(C)cccc43)CC2)cc1 1531524597 NYCAPEOUVCDDPR-VXKWHMMOSA-N 435.612 4.313 10 10 IICE Cc1cc(C)c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1Br 1534308649 FMGAQZAKVDTXAZ-UHFFFAOYSA-N 435.337 4.280 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CO[C@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1534550448 XHFOVCWFTJCWTC-FYYLOGMGSA-N 440.584 4.280 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3Cl)cc2)CC1 1537840073 UUQLKTHVFPXGKN-UXHICEINSA-N 446.378 4.115 10 10 IICE COC(=O)[C@H]1CN(C(=O)c2ccccc2CCN(C)C(=O)OC(C)(C)C)c2ccccc21 1543744888 BUJOBERMBJYWTM-FQEVSTJZSA-N 438.524 4.013 10 10 IICE Cc1c(Br)c2ccccc2n1CC(=O)NCc1ccc2c(c1)CCCN2C 1544164357 HEDVGSNWOZZJFF-UHFFFAOYSA-N 426.358 4.411 10 10 IICE Cc1cc(Br)c(N)c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 1556090463 WXPUUIDKZYVNGB-UHFFFAOYSA-N 431.378 4.122 10 10 IICE Cc1cc(C(=O)CSc2nc(O)cc(C(F)F)n2)c(C)n1-c1ccc2c(c1)OCCO2 1559421759 XJFFOISARKUAKV-UHFFFAOYSA-N 447.463 4.274 10 10 IICE CCN(CC(=O)Nc1ccc(Br)cc1)Cc1cc(Br)ccc1O 1559568914 JJZNOWPDNMRTPN-UHFFFAOYSA-N 442.151 4.378 10 10 IICE CC(C)(C)c1ccc(S(=O)(=O)CCN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 1559634990 HDQDMQCXLNFILP-NRFANRHFSA-N 431.598 4.145 10 10 IICE CCN(C)c1ccc(CN2C[C@@H]3CC[C@H](C2)N3C2CCN(C(=O)OC(C)(C)C)CC2)cc1 1560146487 NPJYWRJQAOATPF-PSWAGMNNSA-N 442.648 4.191 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C/c1csc(C(F)(F)F)c1 1566849285 IXMXFTZAJWKWKT-GORDUTHDSA-N 433.835 4.341 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2ncsc2Br)C1 1598333284 GRNDNTYOOSEKSK-UHFFFAOYSA-N 448.386 4.370 10 10 IICE Cc1cc(C(=O)N2CCC(CCN(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1615920961 CXUVOIVDCCGIMU-UHFFFAOYSA-N 433.394 4.056 10 10 IICE O=C(C[C@H]1C(=O)Nc2c(Br)cccc21)NCc1cc(Cl)cc(Cl)c1O 1625688716 IACSLOVQGQYGBR-LLVKDONJSA-N 444.112 4.204 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)cc1)C1CCCCC1 1627001867 SZZKIXQSVWMBKV-OAQYLSRUSA-N 431.646 4.409 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)C2CC(O)(c3cccc(Cl)c3)C2)cc1 1627205332 NPTOTCCZMKHKTL-UXVFNKRRSA-N 442.987 4.211 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@@](C)(C(=O)OC(C)(C)C)C2)CCCC1 1629296814 LSSDXMLPZKSSSV-RUZDIDTESA-N 426.557 4.109 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C1 1629971708 FKVXZMDSHBWXQI-UONOGXRCSA-N 426.351 4.261 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[C@@](C)(NC(=O)C(F)(F)F)C2)c1 1632630144 RYJWINAKTOLUEZ-LJQANCHMSA-N 427.854 4.031 10 10 IICE CCc1cccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1O 1634162588 MMHRXAXSNFUSHO-FQEVSTJZSA-N 427.545 4.016 10 10 IICE COc1ccc(O)c([C@@H](C)Nc2ncnc3cc(I)sc23)c1 1642230413 YNLFUHZJNYUZLF-MRVPVSSYSA-N 427.267 4.183 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(=O)Nc4ccccc4C3)cc2Cl)C1 1681827718 KWXNJCWYUXUEFB-MRXNPFEDSA-N 426.948 4.240 10 10 IICE CCCN(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1683420937 BDVRZPNTLWLYRZ-KNQAVFIVSA-N 446.636 4.423 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3c(Cl)cccc3OC(F)F)C2)cc1 1687024478 BRKLWXIBGTWLSO-CYBMUJFWSA-N 425.863 4.028 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCCC4(CCCCCC4)C3)cc2)CC1 1687632979 WLIRWRAFTRRNDQ-UHFFFAOYSA-N 426.605 4.034 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1694800033 KUNIAVVVGKTSJV-SFGWALBWSA-N 429.609 4.050 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCOC2(CCCCC2)C1 1707305272 VLWAULLBYXBKCN-UHFFFAOYSA-N 425.621 4.439 10 10 IICE Cc1cccc(-c2nnc(N3C[C@H](C)S[C@@H](C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1707591607 XUWMUFXWHUQZJH-OALUTQOASA-N 436.629 4.401 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3C[C@H](C)SC)CC2)cc1F 1711865932 KSOYBMISQJYXAF-INIZCTEOSA-N 433.597 4.162 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1728027992 WHPVQMSRLWYWQW-RUZDIDTESA-N 434.588 4.067 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(OC)CCOC1)C(C)C 1764747263 ODMHMTUPJAITRU-RUZDIDTESA-N 437.588 4.393 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)C(C)C)CC1 1772877061 YVKFGKPXRNRMEN-UHFFFAOYSA-N 434.588 4.067 10 10 IICE CCc1sc(NC(=O)CCC(=O)O)c(C(=O)OC)c1-c1ccc(Br)cc1 1865946296 BWMRUGYUDZHYBP-UHFFFAOYSA-N 440.315 4.330 10 10 IICE COC(=O)c1c(C(F)F)nn([C@H](c2ccc(OC)cc2O)C2CCC2)c1Br 2079875075 OEBJHSPSSWNVNP-HNNXBMFYSA-N 445.260 4.474 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(NCc2c(O)cccc2Br)C[C@H]2CC[C@H]1C2 2131761083 QOCXKSPWQIWQJE-PJSUUKDQSA-N 425.367 4.328 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(CCCC(=O)OCC)C2=O)cc1OC 2314741167 URVXNGAFOBFFAU-UHFFFAOYSA-N 437.583 4.419 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(C)c3)C2=O)ccc1O[C@H](C)C(=O)O 2314930870 AEKFGIMBQDXGFY-CYBMUJFWSA-N 429.519 4.261 10 10 IICE Cc1ccc(CNC2CC3(C2)C[C@H]3NC(=O)OCc2ccccc2)c(O)c1Br 2327623191 FDAKDJHDCDGDDM-WUZYXKQASA-N 445.357 4.400 10 10 IICE C[C@@H](Oc1ccc(/C=C2/C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1)c1ccccc1 12383923 HXGJYYUVDGIFGQ-MPGAHLTBSA-N 426.472 4.489 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C/c3cccc(O)c3)SC2=S)cc1 15038164 DTTFKLPFNDAEAU-AQTBWJFISA-N 428.535 4.021 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3cccc(C)c3C)C2=O)c(C(=O)O)c1OC 16906144 QCJKVSBFKNDGQG-MHWRWJLKSA-N 429.519 4.425 10 10 IICE O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@H]32)c1 20705093 UBEIWOQSWLPNQS-KNKQGSTJSA-N 425.510 4.206 10 10 IICE O=C1/C(=C/c2ccc(-c3cccc(C(F)(F)F)c3)o2)SC(=S)N1N1CCOCC1 35519092 JWGVNXXTARZINK-WJDWOHSUSA-N 440.468 4.414 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cccc(C(F)(F)F)c4)c3N)CC2)cc1 40727769 AJDBRMGTSTZQML-UHFFFAOYSA-N 444.461 4.156 10 10 IICE CC1=NN(c2ccc(Br)c(C)c2C)C(=O)/C1=C/Nc1ccccc1C(=O)O 101123211 ZSHVMJLGUMRKBU-XNTDXEJSSA-N 428.286 4.483 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CCNCc1cc(Br)cc(F)c1O 721107021 XTGAWQOYVAHKRR-STQMWFEESA-N 431.346 4.277 10 10 IICE Cc1cc(C)nc(-n2cc(C(=O)NCc3ccc(N4CCCCC4)cc3)c(C(C)C)n2)n1 742588645 FFCRHPCLSIUNRP-UHFFFAOYSA-N 432.572 4.323 10 10 IICE C[C@H](N[C@@H]1CCN([C@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cc(F)cc(F)c1O 788982828 INQSBZZAEJLWIN-KPOBHBOGSA-N 446.494 4.005 10 10 IICE Cc1ccc(/C=C\C(=O)N2CCOc3c(NC(=O)/C=C/c4ccc(C)nc4)cccc32)cn1 791079041 XVTBKRHQPNBTQX-FAEGWCMCSA-N 440.503 4.184 10 10 IICE C[C@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)cc(F)c1O 797106356 WIYLCUDZSPITFX-JTQLQIEISA-N 444.732 4.231 10 10 IICE O=C1COc2cc(N[C@@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)ccc2N1 917640080 ZVFCYVFYCCEEFG-HXUWFJFHSA-N 441.447 4.177 10 10 IICE CCN(CC)C(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)cs2)cc1 920314179 MWPYRKFDJJKXGX-UHFFFAOYSA-N 445.566 4.102 10 10 IICE CN1CCN(c2ccc(CNC(=O)CCc3cccc(OCc4ccccc4)c3)cc2)CC1 1133123668 VSTNIUCJTLHBKI-UHFFFAOYSA-N 443.591 4.266 10 10 IICE Cc1ccc(C(=O)NCc2ccc(Cn3cccn3)cc2)cc1-n1c(C)cc(C=O)c1C 1135252890 GHCJOGUFECPWJF-UHFFFAOYSA-N 426.520 4.390 10 10 IICE Cc1cc(C(=O)N[C@H](CO)Cc2ccccc2)c(C)n1-c1ccc(Br)cc1 1138308449 ONEADJOKLPMWOP-IBGZPJMESA-N 427.342 4.190 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F 1147838439 WSVJNLLEJYCXIW-RBBKRZOGSA-N 430.951 4.498 10 10 IICE Cc1cc(C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)c(C)n1-c1cccc(Cl)c1 1151953485 LZPKCOCMKJZSAJ-UHFFFAOYSA-N 445.991 4.283 10 10 IICE Cc1cc(CNC(=O)NC[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1254079536 KTBJNBOOBBPASV-PUZFROQSSA-N 426.561 4.197 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)CCCC1 1264142467 CMLJUJBXSIYAIX-UHFFFAOYSA-N 446.956 4.224 10 10 IICE CC(C)C(C)(C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1287141420 VYKGSWQXDBPKQG-UHFFFAOYSA-N 448.615 4.495 10 10 IICE CC(C)c1nnc(N2CCN(CCC(C)(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1287225023 XWLZEOBUGSEKIW-UHFFFAOYSA-N 430.616 4.213 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@](C)(OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291532054 LIOHNQQZZKPESL-DVECYGJZSA-N 443.661 4.398 10 10 IICE COc1ccccc1Cn1cnc2cc(C(=O)NCCCSc3nccs3)ccc21 1292998009 XTVVPQVDMICZFK-UHFFFAOYSA-N 438.578 4.462 10 10 IICE CCOCCN(CC)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1297542811 YAWLPBGONCCRPQ-UHFFFAOYSA-N 445.677 4.331 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1C[C@H]1CCCO[C@H]1C(C)(C)C 1298363916 OLNNWVBGUXWMDL-DENIHFKCSA-N 437.588 4.467 10 10 IICE COc1ccc(N2CCN([C@@H](C)c3nc(-c4ccc(C)c(F)c4)no3)CC2)c(OC)c1 1308013828 FNPYWWVZWAHWGT-INIZCTEOSA-N 426.492 4.085 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@@H]1CCN(c2cccc(Br)c2)C1 1312601267 DDWYCKJZEVVKRG-QGZVFWFLSA-N 444.373 4.112 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(C)Cc3ccc(OCC(F)(F)F)cc3)C2)cc1 1312994920 POXHUWHCMRULGQ-QGZVFWFLSA-N 437.462 4.057 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC2CC2)n1CC[S@@](=O)C(C)(C)C 1314737776 VAELLQNGQWGHAL-WJOKGBTCSA-N 443.661 4.014 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)c(Br)cc3C)cc2F)CC1 1435072303 APDGJZDTTHADJS-UHFFFAOYSA-N 448.380 4.277 10 10 IICE CCOc1ccc(-c2nc(CC(=O)N(C)CCN(C)c3ccc(OC)cc3)cs2)cc1 1437380550 FEMYLZRYPAGEIS-UHFFFAOYSA-N 439.581 4.355 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NC(=O)c3ccc(N=NC(N)=O)cc3)C(C)(C)[C@@H]21 1454467476 NMTINWSKUCQVCM-IXDOHACOSA-N 429.521 4.003 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2(CC(=O)OC(C)(C)C)CCC2)C1 1469773830 OEBQUIOVOIFLNU-UHFFFAOYSA-N 439.600 4.179 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCN2CC(F)F)c(C)n1-c1ccccc1Br 1470151450 WCTNFGLOBQTHCW-HNNXBMFYSA-N 440.332 4.316 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3CC3CCCCC3)cc2F)C[C@@H](C)O1 1473131584 GTHZHVGIQPZHJI-VIZSFHNOSA-N 445.623 4.490 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(C3CCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1495651945 HWWAOQCIKRJUDE-LJQANCHMSA-N 442.627 4.500 10 10 IICE CCOC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1502539701 VHCPPRLTGIKCEU-OAQYLSRUSA-N 437.588 4.393 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2cccn2C)n1Cc1ccc2c(c1)CCCN2C 1505236481 WFKMPEGVPQMXPJ-SFHVURJKSA-N 438.645 4.292 10 10 IICE CCN(CC)C1CCN(c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1515557970 WAYYYBCUUOMYRB-UHFFFAOYSA-N 428.600 4.110 10 10 IICE C[C@@H](C1CCCCC1)N(C)c1nnc([C@H]2CCC(=O)N2)n1CCCSc1nccs1 1520602132 ODHMRYIIAMFYOQ-DOTOQJQBSA-N 448.662 4.273 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2ccccc2OC(F)F)C1 1522711876 GVZVHODURGOTNR-UHFFFAOYSA-N 441.522 4.368 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccsc1Br 1527245016 DWSCIOWZJJQAOZ-UHFFFAOYSA-N 449.292 4.296 10 10 IICE CCOC(=O)CN(Cc1ccccc1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1528635076 PIRDGIFGCNKRLG-UHFFFAOYSA-N 434.536 4.121 10 10 IICE CCOc1ccccc1N1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CC1 1540402425 KBPLABFFMQQGID-UHFFFAOYSA-N 431.536 4.268 10 10 IICE CC(C)c1nnc(N2CCN(c3cccc(O)c3)CC2)n1CCCSc1nccs1 1541362976 HEGQXIBJKJFESL-UHFFFAOYSA-N 444.630 4.073 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H](c3cccc(Br)c3)N3CCCC3)ccc21 1544164261 GHQSBEYCPSPNDN-JOCHJYFZSA-N 442.401 4.285 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1547444917 VUFQJCXDDURNOV-CVDCTZTESA-N 434.588 4.096 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@H](Oc1ccc(Br)cc1)c1ccccc1 1557084919 UDOHANAMVKBTEJ-HXUWFJFHSA-N 428.282 4.297 10 10 IICE Cc1cc(CC(=O)N2CCCC[C@@H]2CCn2ccnn2)c(C)n1-c1ccc(Cl)cc1 1558785152 HUBBTXMNJGBNOH-OAQYLSRUSA-N 425.964 4.353 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)[C@H]3C[C@H](Oc4ccccc4)C3(C)C)C2)cc1 1564962441 KZQOHVGBSCPZNN-YGOYIFOWSA-N 437.584 4.409 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1cccc(OC)c1 1583569275 GJCVKIKAEZUALZ-QFIPXVFZSA-N 441.572 4.376 10 10 IICE Cc1ccc(C(=O)NCc2cccc3c2OC(F)(F)O3)cc1-n1c(C)cc(C=O)c1C 1585682149 UMMULKLYMUIUPH-UHFFFAOYSA-N 426.419 4.467 10 10 IICE CCCc1c(C(=O)NCc2ccc(N(C)C)cc2)cnn1-c1cc(F)c(OC)cc1F 1587316902 OTAOQVXRQCCIAK-UHFFFAOYSA-N 428.483 4.108 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4c(OC(F)(F)F)cccc4[nH]3)CC2)cc1 1596732765 HLJDWVIAWKPECD-UHFFFAOYSA-N 433.430 4.428 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2ccc(F)c(F)c2)c2nccn2C)c1 1603572885 UPRULEDUBBMBQO-QHCPKHFHSA-N 448.473 4.438 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)C)n2CC2(C)CC2)c(C)n1-c1ccccc1 1611933811 PDCPOXLHYSGYPZ-UHFFFAOYSA-N 434.588 4.114 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C\c3ccc(F)c4ccccc34)cc2)CC1 1616601537 ZMBXESQGLFCXIO-WQLSENKSSA-N 431.511 4.010 10 10 IICE Cc1ccc(/C=C/C(=O)N2C[C@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)cn1 1617132960 MAPBRNPZTPIXEV-HKMNZKMDSA-N 425.504 4.273 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccsc2)cc1F 1617665380 FTVOZIMUYCCQJD-FQEVSTJZSA-N 429.565 4.471 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H](O)C(Cl)(Cl)Cl)cc2Cl)C1 1617900952 NIJHSXDZSKBURS-XHDPSFHLSA-N 428.187 4.314 10 10 IICE COc1ccc(N2CCCN(C(=O)C3=Cc4ccccc4O[C@@H]3C(F)(F)F)CC2)cc1 1626318927 NGKNHGPEJBXCHG-NRFANRHFSA-N 432.442 4.141 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)C2CCN(CCC(F)(F)F)CC2)cc1 1626357451 KLUSDOQZGHHTFP-UHFFFAOYSA-N 449.517 4.324 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(Nc2ccn(C)n2)cc1 1626511379 LTFIJTAAAIZXAX-UHFFFAOYSA-N 449.555 4.166 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1629168547 NVWQJXIVOVWBMI-UHFFFAOYSA-N 431.964 4.369 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)c1 1629281306 BNXXBPGTJBFYKB-QFIPXVFZSA-N 438.549 4.258 10 10 IICE Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2cccc(O)c2O)cc1 1630239204 GAKFBJHUSDECKL-UHFFFAOYSA-N 434.492 4.134 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCN(CCCc4ccccc4)C3=O)c2C)c1 1635228183 FKQXTDFNIMVANQ-VWLOTQADSA-N 429.564 4.366 10 10 IICE Cc1cc(C(=O)NCCc2ccc3c[nH]nc3c2)c(C)n1-c1ccc(Br)cn1 1635277768 BIYKUGVIUCYTTE-UHFFFAOYSA-N 438.329 4.100 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2c(Br)cncc2s1 1635839452 DMXIDFHKUVXGJP-UHFFFAOYSA-N 442.132 4.457 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3cc(O)ccc3O)[C@H]2c2cccs2)cc1 1637122605 JNYPYYYKBVQJED-CVDCTZTESA-N 436.533 4.268 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NN2Cc3ccc(Br)cc3C2=O)c1C 1641691940 HADUGTIVFBRLIT-UHFFFAOYSA-N 438.325 4.466 10 10 IICE C[C@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1)c1ccccc1O 1642827225 CKBFVEUXYHKLDD-AWEZNQCLSA-N 430.913 4.337 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1675045927 XBIUWZVLIWCWPW-QFIPXVFZSA-N 434.584 4.178 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccccc3)C[C@H](O)c3ccco3)C2)cc1 1683503910 FNFDAIVPGCLGOS-QPPBQGQZSA-N 449.551 4.060 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC=C(Br)C1 1693007760 GTWJWMIERNCECO-LJQANCHMSA-N 446.393 4.041 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CCC[C@H](C(C)C)C1 1707305280 VWRWYTRWEXVBSZ-UNMCSNQZSA-N 425.621 4.467 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCOC[C@H]1C 1741433379 HZSXQIVABVUVNY-IRLDBZIGSA-N 425.621 4.386 10 10 IICE CCc1nnc(N2C[C@@H](C)[C@H](C(F)(F)F)C2)n1Cc1ccc(N2CCSCC2)cc1 1763167538 SOVICDVVKAJFQR-CRAIPNDOSA-N 439.551 4.077 10 10 IICE CCOCc1nnc(N2CCC[C@H](CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1766354979 SXTXYJKQIWHUSI-IBGZPJMESA-N 429.634 4.043 10 10 IICE COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccccn2)cc1Cl 1858055707 XPUOLPHFUPWWMC-UHFFFAOYSA-N 437.304 4.429 10 10 IICE COc1ccc(N2CCN(C(=O)CCC(=O)c3ccc(C)c(Br)c3)CC2)cc1 1858153666 PZOOCDSWOPLBGP-UHFFFAOYSA-N 445.357 4.078 10 10 IICE CCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCOc2ccccc2)C1=O 1873164799 SKXGSGMIRYJYIT-UHFFFAOYSA-N 443.547 4.253 10 10 IICE O=C(NC[C@@H](NCc1ccc(Br)cc1O)C(F)(F)F)OCc1ccccc1 1942706852 NCMSRHGBHAMDFK-MRXNPFEDSA-N 447.251 4.102 10 10 IICE CCN1CCc2cc([C@H](N)[C@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044751774 FEDWSEHPXJLNJL-UPVQGACJSA-N 438.616 4.094 10 10 IICE Cc1ccc([C@@H](n2nc(C3CC3)c(CO)c2I)C2(C)CC2)c(O)c1 2079002394 ILJSURPPXRRMBU-QGZVFWFLSA-N 438.309 4.261 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1C[C@H](NCc2c(O)cccc2Br)C12CCC2 2118412398 AYMXHGLTJBRQFC-GUYCJALGSA-N 425.367 4.328 10 10 IICE CC[C@@H](NC[C@H]1[C@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2138291867 YZEGDZOJHWIRRX-KKBVYLPWSA-N 425.367 4.451 10 10 IICE CC[C@@H](C)NCc1ccc(N(C)C[C@@H](O)COCc2ccccc2)cc1Br 2240022787 ALIKBXHPJJGQMU-DYESRHJHSA-N 435.406 4.351 10 10 IICE CCCC1=NN2C(=N)C(=Cc3ccc(-c4ccc(OC)cc4[N+](=O)[O-])o3)C(=O)N=C2S1 2297348257 YOLLFRWZEYCNPG-UHFFFAOYSA-N 439.453 4.283 10 10 IICE CC(=O)c1cccc(N2C(=O)C(=Cc3cccc(O[C@H](C)C(=O)O)c3)SC2=S)c1 2314932404 VPTUKLDPWHTETC-CYBMUJFWSA-N 427.503 4.147 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(c2cccc(OC)c2)C1=O)C(=O)O 2314933306 VBKVCTPLZQWLDU-MRXNPFEDSA-N 429.519 4.343 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)N(C)C)cc1 2323880175 ZSZVLFXZBVFGPE-GOSISDBHSA-N 443.550 4.108 10 10 IICE CCOc1c(/C=C2\SC(=S)N(CC(=O)OC3CCCCC3)C2=O)cccc1OC 40888867 PIOZCXHLUXPVGK-ATVHPVEESA-N 435.567 4.171 10 10 IICE Oc1c(Cl)cc(Br)cc1[C@@H]1Nn2c(COc3ccccc3)nnc2S1 59168805 WVLZPTXGNYHEOP-OAHLLOKOSA-N 439.722 4.327 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(OC)c(O)c1)N2 226643978 DCTOPAUENYQMDX-OHUGHZGNSA-N 435.568 4.299 10 10 IICE COc1ccc(O)c(CNc2cc(I)ccc2Br)c1 311623832 JKITUOWJRURVEJ-UHFFFAOYSA-N 434.071 4.380 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(c4nccc5sccc45)CC3)ccc21 685198175 BZGJGMRYSSJGDF-UHFFFAOYSA-N 448.592 4.477 10 10 IICE Cc1cc(C(=O)Nc2ccc(F)c(N3CCCS3(=O)=O)c2)c(C)n1-c1ccc(F)cc1 731649207 ZMNIBLFWLBEYBX-UHFFFAOYSA-N 445.491 4.165 10 10 IICE CC(C)Cn1ncc2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc21 742805899 PLJIHHSTOYWSOE-GOSISDBHSA-N 443.498 4.088 10 10 IICE Cc1ccc(/C=C\C(=O)N[C@H](C)CN(C(=O)/C=C\c2ccc(C)nc2)c2ccccc2)cn1 754259223 GXCPMOHRTRBMEO-RIYWCQTLSA-N 440.547 4.358 10 10 IICE Cc1nccn1-c1ccc([C@H](C)NC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cc1 754913164 BNBRDBBCCXXVOW-MOPGFXCFSA-N 433.556 4.139 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)ccc1NC(=O)c1cccs1 758655195 VAQCMRBNVGUXMK-UHFFFAOYSA-N 435.549 4.075 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1c(F)cccc1I 760462069 IDWVJPQDXACNMR-UHFFFAOYSA-N 438.284 4.351 10 10 IICE COc1ccc(N2CCC(N3C(=O)N[C@@H](C[C@H]4CCCc5ccccc54)C3=O)CC2)cc1 761221183 ICOBOFHQXSNPKW-DVECYGJZSA-N 433.552 4.095 10 10 IICE Oc1cc2c(cc1CN(Cc1ccccc1)C[C@H](O)c1cccc(OC(F)F)c1)OCO2 770689786 TXWUAWNKRNUZBF-NRFANRHFSA-N 443.446 4.458 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N[C@H](c3ccccc3)[C@H]3CCOC3)cc2F)C[C@@H](C)O1 771940102 NRFLNFLACQWJJG-OPNQQPSUSA-N 441.547 4.016 10 10 IICE COc1cc(Br)cc(CN2CCC23CCN(C(=O)OC(C)(C)C)CC3)c1O 812770117 HTLYAZLPSQBOPS-UHFFFAOYSA-N 441.366 4.139 10 10 IICE Cc1ccc(/C=C/C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c(Br)c1 920881897 SQSLFMPXJIVRNU-PYUISTEWSA-N 429.358 4.485 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCO[C@H](CC)C2)sc(C)c1-c1ccccc1 1169675431 ICTFQLRJPSJTHY-GOSISDBHSA-N 430.570 4.340 10 10 IICE COC(=O)[C@]12C[C@H]1CCCN2C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1178547625 VQYSWSOQLLTRNW-VFNWGFHPSA-N 431.330 4.024 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCCN(c4ccccc4OC)CC3)c2C)cc1 1180666794 CDILYIKXAYLQHF-UHFFFAOYSA-N 433.552 4.464 10 10 IICE CNS(=O)(=O)c1ccc(CSc2ncc(-c3ccccc3)n2CC(F)(F)F)cc1 1188691940 CUQXWZAZVRUEGY-UHFFFAOYSA-N 441.500 4.313 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3nn(C)cc3C(F)F)cc2Cl)C1 1227207408 GAXICNYPNBIPCX-ZDUSSCGKSA-N 425.911 4.247 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3nccs3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1289353983 WKZROMKDHMHILF-UHFFFAOYSA-N 436.585 4.216 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC[C@@H]1OC 1291443259 VIQFDRWFZCFCFH-WPYKKVEZSA-N 441.620 4.080 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCOc1ncccc1F 1295092603 MCMXMWQWSAXJHH-UHFFFAOYSA-N 434.519 4.422 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnc(Nc2ccccc2)nc1C(F)(F)F 1297562909 SAXSSCIQOJONJB-UHFFFAOYSA-N 437.418 4.360 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1 1299438834 GHRYHCKHARONKF-RXVVDRJESA-N 439.556 4.330 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@@H](C(F)(F)F)C1 1304071866 FYSARWMZWMYGHC-NASPGAHYSA-N 434.530 4.140 10 10 IICE Cc1cc(F)cc(-n2cc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)nn2)c1 1350087208 ILOQWPUISUQGFF-UHFFFAOYSA-N 433.487 4.216 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C(C)=C\c3ccc(Cl)cc3)CC2)cc1 1350976893 SIQDPTSCTUVTEO-HNENSFHCSA-N 427.976 4.080 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCNC(=O)Cc2cccc(F)c2)cc1 1435001404 MMXWRNPXPYZHSS-UHFFFAOYSA-N 447.514 4.396 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3ccc(OC)cc3Br)CC2)cc1 1446420271 PFWKJWNQTUDADQ-UHFFFAOYSA-N 447.373 4.138 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H]1CCC[C@@H](C(F)(F)F)O1 1448683743 HXAZZTRQEGLYAZ-XLIONFOSSA-N 444.494 4.265 10 10 IICE O=C(Cn1c(-c2ccccc2)nc2ccccc21)NCc1cccc(Br)c1O 1448965731 RSZUKZKRJPFTSU-UHFFFAOYSA-N 436.309 4.488 10 10 IICE CC(C)(C)n1ncc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1-c1ccccc1 1454006424 POJXVZYJHHNTHA-UHFFFAOYSA-N 432.568 4.196 10 10 IICE Cc1ccc(-n2nc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)cc2C)cc1 1464607087 RQFALSZDFSUIOO-XMMPIXPASA-N 432.568 4.377 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C2CC2)nc2c1c(C)nn2C(C)(C)C 1467841686 ZSSFJBVYZRQQMN-UHFFFAOYSA-N 427.545 4.493 10 10 IICE CCN(Cc1nc2c(s1)C[C@H](C)CC2)C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1470772335 JRMSQPLPQWZWNR-IAGOWNOFSA-N 428.602 4.087 10 10 IICE Cc1cc(CCNC(=O)[C@H]2[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)c(C)n1-c1ccccc1 1470849971 NXYNEZQICZKKOL-ZRBLBEILSA-N 437.584 4.256 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(c2ccc(F)cc2Cl)CC1 1478841310 SZOASEYNJJGBSN-KRWDZBQOSA-N 432.971 4.316 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C[C@H]1C 1493971218 FNHUUZNZAPCALR-RBUKOAKNSA-N 443.611 4.373 10 10 IICE O=C(Cc1ccc(Cl)c(Cl)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1518307689 MGLUHVQJQWRYLP-UHFFFAOYSA-N 432.395 4.384 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccc(C)cc3)C2)sc2c1CCCCC2 1525383007 QMOUWFXZNNAPKA-QGZVFWFLSA-N 440.565 4.099 10 10 IICE Cc1ccc(NC(=O)c2ccc(C)c(O)c2O)cc1S(=O)(=O)Nc1cccc(Cl)c1 1540277305 FPNBLLOVXGCIBU-UHFFFAOYSA-N 446.912 4.421 10 10 IICE Cc1cc(CC(=O)N(CCN2CCOCC2)c2ccccc2F)c(C)n1-c1ccccc1 1544548462 COFDGLSKZJKSOB-UHFFFAOYSA-N 435.543 4.141 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1547131955 DYGYLHGUXAFJMX-UHFFFAOYSA-N 432.576 4.156 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCO[C@H](C(F)(F)F)C3)nnc2C(C)(C)C)cc1 1547448347 KWMFKLXWHYUZSE-SFHVURJKSA-N 439.526 4.238 10 10 IICE CC1(C)CCc2sc(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)nc21 1557098590 VPAISVQVNPMGIX-UHFFFAOYSA-N 449.579 4.187 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2ncccc2Br)cc1 1565471872 VXAHYWKLTKDGCL-UHFFFAOYSA-N 443.345 4.415 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c(C)n1[C@H]1CCCOC1 1584357101 XQODMSHGNPMVBF-FQEVSTJZSA-N 447.526 4.457 10 10 IICE CCC[C@H](C(=O)OCC)n1ccc(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)n1 1586986692 IIWGSJCFSJWSGT-OAQYLSRUSA-N 440.544 4.258 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)ncc1Br 1597780014 FCHBRPOIXKYBHT-UHFFFAOYSA-N 441.167 4.335 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1nn(-c2ccc(F)cc2F)c2c1CCC2 1597801208 ZBUZHFUKWHTTSK-MRXNPFEDSA-N 438.522 4.375 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1C[C@@H](C(F)(F)F)O[C@H](C)C1 1611963526 SPUDLGVQZVUEFF-APWZRJJASA-N 439.526 4.055 10 10 IICE Cc1noc(COc2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)cc2)n1 1617571801 NPALVCBBCIICSN-UHFFFAOYSA-N 444.491 4.358 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CCN(C(=O)OCc4ccccc4)C3)cc2)CC1 1627468127 VHUUSRIHJMCZPM-HSZRJFAPSA-N 435.568 4.198 10 10 IICE CCOC(=O)c1cc(COC)cc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1637449900 JSEWRBDUDQHECE-UHFFFAOYSA-N 434.492 4.482 10 10 IICE C/C=C/[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1638244096 RBOHNQHQCCPMKH-VBLMLBSQSA-N 429.605 4.167 10 10 IICE COC1CCN(c2ccc(CN(C)[C@@H](CO)c3cccc(Br)c3)cc2)CC1 1642297019 KTWWRUYNLOTXRY-QFIPXVFZSA-N 433.390 4.230 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H]2C(C)(C)O)sc(C)c1-c1ccccc1 1645002104 WVTUXJOMGFTFLJ-QGZVFWFLSA-N 430.570 4.074 10 10 IICE NC(=O)c1cc(NC(=O)c2cc(O)cs2)ccc1OCc1cccc(Br)c1 1645580110 KPNIIUIWUPBLAR-UHFFFAOYSA-N 447.310 4.146 10 10 IICE COCCOc1ccc(SCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1651936970 SFXLDHZOUDKUEU-UHFFFAOYSA-N 447.512 4.218 10 10 IICE CCOC(=O)c1c(NC(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)sc(C)c1C 1652317161 VEYLGDYTHBUQEU-UHFFFAOYSA-N 431.602 4.457 10 10 IICE CCOCCN(C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)[C@H]1CCc2ccccc21 1685686440 NOSYEOGETKZHHV-DQEYMECFSA-N 438.616 4.091 10 10 IICE CC(C)Cc1nnc(N2CCC(N3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1692146691 JLBIAPWMKFUUIX-UHFFFAOYSA-N 442.627 4.185 10 10 IICE C[C@@H]1C[C@@H](C)CN(C(C)(C)Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)C1 1707959701 OACFVEBSBUQBPQ-RTBURBONSA-N 436.604 4.372 10 10 IICE CC(C)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1723171489 FDBGYZFPJVOENK-UHFFFAOYSA-N 425.621 4.285 10 10 IICE CC(C)C[C@H]1CCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1723358403 QXQRBRLEWBWETL-WOJBJXKFSA-N 429.584 4.298 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)CCC2CCOCC2)cc1F 1729329939 KQOCNRAXMJMHMD-JOCHJYFZSA-N 445.583 4.026 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](OC)C(C)C 1730718801 VWLVZQPTVVNYDU-QFIPXVFZSA-N 425.577 4.106 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@H](C)CCSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1743546099 HBBZPRFFDMIWAU-QZTJIDSGSA-N 449.640 4.393 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@@H]1OC 1764228106 HFVZHUQHYXKYMO-REWPJTCUSA-N 437.588 4.250 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(=O)NC(C)C 1765324170 GTDBDLFZJWWLJD-WQLSENKSSA-N 434.588 4.280 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc(O)c(O)c3)c3ccccc3C2=O)cc1 2042434897 FBTLHEBDSRNSID-UHFFFAOYSA-N 429.428 4.002 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CNCc3cc(Br)cc(F)c3O)C[C@H]21 2140716813 FKAYPIZKHYUZDO-SGIREYDYSA-N 429.330 4.029 10 10 IICE CCC(CC)(CNC(=O)OC(C)(C)C)NCc1c(Br)ccc(OC)c1O 2227748119 KBPODZCOFDLDTO-UHFFFAOYSA-N 431.371 4.336 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C(=O)NC2=S)cc1 2296144683 AQRHOGCGAPAWFD-UHFFFAOYSA-N 445.544 4.242 10 10 IICE Cc1ccc(S(=O)(=O)NN2C(=O)C(=Cc3cccc4ccccc34)SC2=S)cc1 2297320624 MCSFLAIKRZEEOD-UHFFFAOYSA-N 440.571 4.243 10 10 IICE COc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3c[nH]c4ccccc34)SC2=S)cc1 2314836995 MTCWKZVYMLIXOE-ZDUSSCGKSA-N 437.546 4.405 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCCC(=O)NC3CCCCC3)C2=O)cc1OC 33436485 GIJMYVTYEJIAMN-XMHGGMMESA-N 448.610 4.134 10 10 IICE COc1ccc(C2=NN(c3ccccc3)C(=O)/C2=C(\C)NCCc2ccc(O)cc2)cc1 205965270 BJWRODMJKAJTTB-HKOYGPOVSA-N 427.504 4.258 10 10 IICE CCOc1ccc(N2C(=O)/C(=C/c3ccccc3OCCC(=O)O)SC2=S)cc1 210437810 JKNMCOOCJPXKEI-AQTBWJFISA-N 429.519 4.345 10 10 IICE CCN[C@@H]1C(=O)Nc2cc(N(C)CCCOCc3ccccc3)c(Br)cc21 384133524 SWRGEQAGWUUJEF-FQEVSTJZSA-N 432.362 4.095 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)c1O 740857471 PBSZRTMDRIFXGF-MGPUTAFESA-N 428.529 4.067 10 10 IICE O=C(Cn1cc(NC(=O)N(Cc2ccccc2O)C2CCCCC2)cn1)NC1CCCC1 747547791 ROEVYPJJSXCLEF-UHFFFAOYSA-N 439.560 4.014 10 10 IICE C[C@@H]1C[C@@H](c2noc(CCCN3C(=O)/C(=C/c4cccs4)SC3=S)n2)CCO1 762289106 NGHKFVIYOJYLFZ-HAQQTBRTSA-N 435.596 4.248 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nc(-c3ccsc3)no2)C1 766847247 DQELPRZXKDAFCL-UHFFFAOYSA-N 436.537 4.263 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N[C@@H](c1ccccc1)[C@H]1CCOC1 772495016 PRFCVVGWMOZCPC-JQVVWYNYSA-N 445.510 4.334 10 10 IICE COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)ccc1OCC(C)C 1083972585 GWDHSPQBKVCXPG-RQZCQDPDSA-N 428.872 4.050 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(-c4cccc(Cl)c4)nc3O)CC2)cc1 1125250633 ASIYSIIJRDEVKP-UHFFFAOYSA-N 437.927 4.469 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cc(NC(C)=O)c(F)cc2F)CCCC1 1125477989 DRFWIYYZELHGEM-UHFFFAOYSA-N 427.451 4.404 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C[C@H]2C(=O)Nc3c(Br)cccc32)cc1 1135735432 ODPNKASAAKBYII-GOSISDBHSA-N 444.373 4.380 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@]3(C)CC(c4ccccc4Cl)=NO3)CC2)cc1 1136546290 CKPFARFSEJLCFJ-HSZRJFAPSA-N 427.932 4.017 10 10 IICE COc1ccc(N(CC(=O)N=c2cc[nH]n2Cc2cccc(C)c2)Cc2cccs2)cc1 1167674405 LQPLVVPWOWVZQB-UHFFFAOYSA-N 446.576 4.377 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H]3COc3ccc(Cl)cc3)C2)cc1 1230859243 UVFKPFJBZISXOG-AZUAARDMSA-N 429.948 4.180 10 10 IICE C[C@@H](Sc1ccc(F)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1264640969 RBPUIVFKTCCHGM-CQSZACIVSA-N 442.478 4.478 10 10 IICE CN(C)c1ccc(CNC(=O)C2C[C@@H]3CCC[C@H](C2)C3NC(=O)OC(C)(C)C)cc1F 1264827044 MJOSSFQMEXAEPA-JOIKAWEESA-N 433.568 4.228 10 10 IICE CC(C)c1ncc(CN(C)c2nnc(CC3CC3)n2Cc2ccc(N(C)C)c(F)c2)cn1 1287172288 GUPDMAKMRYTRPI-UHFFFAOYSA-N 437.567 4.034 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCC[C@@H]2CC[C@@H](C(F)(F)F)O2)C1 1288684291 LHMFOVIFZCSPHU-KKSFZXQISA-N 437.506 4.024 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NC(C)C 1291705043 VZXQCAGXLBIVSC-SFHVURJKSA-N 436.604 4.360 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N(C)Cc1nnc2n1CCC[C@H]2C(F)(F)F 1303525860 SECNRYFXQDJYRJ-CQSZACIVSA-N 437.491 4.459 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1C[C@@H](C)OC(C)(C)C1 1304240074 GVCCNQQCZYTAGI-GOSISDBHSA-N 439.629 4.357 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(N)=O)C1 1305281165 VLKWDMRHPSRABF-FQEVSTJZSA-N 448.615 4.491 10 10 IICE C[C@@H](NC(=O)c1cc(Cl)cc(Br)c1O)c1ccc(N2CCOCC2)cc1 1306439936 SVUKNYGMTKGQQS-GFCCVEGCSA-N 439.737 4.136 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@H]2CC(C)(C)Oc3cc(F)ccc32)N(C)C)cc1 1312342142 MJBSYXGHONINBB-LEWJYISDSA-N 428.552 4.096 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N(C)CC2CCC2)cc1 1313679269 QAFXITLSNWOZMK-UHFFFAOYSA-N 435.620 4.271 10 10 IICE CCc1cc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1Cl 1350934147 ZFLZODWIMUSRIU-IYBDPMFKSA-N 434.939 4.350 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1nn(C)c(C(F)(F)F)c1Br 1352625995 FOSFTFCIYTVMNB-UHFFFAOYSA-N 445.283 4.074 10 10 IICE CC(C)c1nnc(N2CCC(N3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1359699129 WRBQOJCJDMWBOE-UHFFFAOYSA-N 428.600 4.110 10 10 IICE COc1ccc(CCCC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1OC 1435062592 BAGPWRIBWSWTGZ-UHFFFAOYSA-N 448.510 4.413 10 10 IICE COCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1446808517 XPHOISWPVPFTIZ-NQIIRXRSSA-N 442.556 4.412 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)c1 1464717620 BPMSILKZJHYWPN-JOCHJYFZSA-N 448.498 4.082 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1ccnn1 1500734765 GAEHJJUSTXLISY-UHFFFAOYSA-N 432.576 4.271 10 10 IICE Cc1ccc(F)c(CN(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 1524627640 CNIACEFKCRREET-UHFFFAOYSA-N 432.407 4.090 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C(C)C)n(-c4ccccc4)n3)cc2F)CC1 1528701649 NNLLDVIJWCQXOS-UHFFFAOYSA-N 449.574 4.207 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(C)CCN(C)c1ccc(OC)cc1)O[C@@H](C)C2 1531374387 AQAVGUHAHSTMPN-JWNTYJGQSA-N 438.568 4.116 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCC(=O)N3CCOc4ccccc43)c2C)c1 1535136227 IOTMKWCWDVSOQR-UHFFFAOYSA-N 431.536 4.225 10 10 IICE CO[C@@H](C(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C1CCCC1 1537251832 UOPWJUSDALDNDY-GOSISDBHSA-N 429.318 4.303 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(F)(F)c2cccc(Br)c2)N(C)C)cc1 1537483578 OXQANWMQJYWPDI-GOSISDBHSA-N 440.332 4.026 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4cccc(F)c4)C3)cc2Cl)C1 1539913932 WQSSEELOQYOYBW-WMZOPIPTSA-N 443.950 4.385 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1cccc(OCC=C(C)C)c1 1546152226 XSPDZLHOHQDCML-UHFFFAOYSA-N 431.916 4.135 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1547074194 HFQZBPHVXTWSIJ-QFIPXVFZSA-N 437.588 4.394 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C)c1ccccc1 1556217883 OALPPGYHAAGEBG-AREMUKBSSA-N 434.536 4.354 10 10 IICE CCOC(=O)c1csc([C@@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)n1 1564945948 IQOZGTIYQJIYMB-JXFKEZNVSA-N 444.601 4.172 10 10 IICE CCN(C(=O)OC(C)(C)C)C1CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 1564946382 NYYJLJSQCUUIPA-LJQANCHMSA-N 446.636 4.423 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@H](CSc3ccccc3)C2)N(C)C)cc1 1565452644 IOJPPRKEGYAMIL-WMZHIEFXSA-N 426.630 4.179 10 10 IICE COCCN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccc1 1587467862 DKDRBWWOFPVYOQ-SDXDJHTJSA-N 446.619 4.409 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCCN(C(=O)Cc3cccc(F)c3)CC2)cc1 1587825306 PMQSHHRBEYFSEV-UHFFFAOYSA-N 433.527 4.150 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)/C=C/c1ccc(S(C)(=O)=O)o1 1597567775 WCPMYSYWGWHYKA-ABDJAZHISA-N 425.506 4.192 10 10 IICE Cc1ccc(C(=O)N2CCC(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1611298906 SRJYYVFKWOAHLS-UHFFFAOYSA-N 429.564 4.366 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1613387158 TXBSASNKOQIXHF-WIYYLYMNSA-N 429.634 4.213 10 10 IICE CCc1nnc(N2CCO[C@H](c3ccc(Cl)s3)C2)n1Cc1ccc(N(C)C)c(F)c1 1614045545 KQXDXTFYQHZHMX-KRWDZBQOSA-N 449.983 4.387 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(C3CC3)[C@H]2c2cccc(OC)c2)cc1 1623451937 ORVDVLDYLDONOI-RSXGOPAZSA-N 449.595 4.252 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc21 1629055907 VGSYCYKHTXPCHC-MRXNPFEDSA-N 444.482 4.323 10 10 IICE Cc1cc(C(=O)NCCC(=O)N2CCCCCC2)c(C)n1-c1ccccc1Br 1631463562 MZNHANKOTWEZFC-UHFFFAOYSA-N 446.389 4.379 10 10 IICE COc1cccc(N(CC(=O)NCc2ccc(N(C)C)cc2C)C(=O)OC(C)(C)C)c1 1633340372 HDGNNEASHIQMHM-UHFFFAOYSA-N 427.545 4.128 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC(=O)c3cc4cc(O)c(O)cc4s3)CC[C@H]2C1 1638771292 BRZQOMMYUFFOTO-NWANDNLSSA-N 432.542 4.078 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC1CC2(C1)CC2(F)F 1640043710 BIDUYQNTEJFVJT-QPEQYQDCSA-N 428.551 4.034 10 10 IICE COC1CCN(c2ccc(CN3CC[C@H](CNC(=O)OC(C)(C)C)[C@H](C)C3)cc2)CC1 1656339492 RZMUPVWCFNRBNG-TZIWHRDSSA-N 431.621 4.285 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@@](C)(C(F)(F)F)C3)cc2Cl)C1 1682023656 ICSBKEMKYYHTGQ-IFXJQAMLSA-N 433.902 4.439 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)CC1 1711596220 SRSCZLICEKIHSZ-RUZDIDTESA-N 434.588 4.158 10 10 IICE CCN(CCn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)CCC(F)(F)F 1728539270 CWRIXJJEEIQKCT-UHFFFAOYSA-N 427.515 4.192 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1CC1(CC(C)C)CC1 1750123223 DTJBTGKIUMWYSS-FPOVZHCZSA-N 428.577 4.170 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCNC(C)=O)C1 1765158286 AZRRDXABPOMMDY-NRFANRHFSA-N 434.588 4.115 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1772860361 UFLUSXZWGSTWNM-WMZHIEFXSA-N 441.620 4.011 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)/C(=C\c3ccc4c(c3)OCCO4)SC2=S)c1 1860085338 FJGCCDIYNJBCMU-RQZCQDPDSA-N 447.921 4.304 10 10 IICE CCN[C@@H](c1ccc2c(c1)CCN2C)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2044754827 PZURYZPXUYJBMJ-UPVQGACJSA-N 439.600 4.440 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)C1=Cc1ccc(N(C)C)cc1 2294033910 CSIDXEPMIDTVGP-UHFFFAOYSA-N 426.900 4.292 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4cccnc4)SC3=NC2=O)c(C)n1-c1ccccc1 2296053604 IWHJBHIJLRIJHU-UHFFFAOYSA-N 426.505 4.157 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccc(Cl)c2)SC1=S)Nc1cccc2nonc12 2296559944 DHOFMBOZCNBJBN-UHFFFAOYSA-N 444.925 4.106 10 10 IICE CCOc1cccc2ccc(C=C3SC(=S)N([C@@H](CCSC)C(=O)O)C3=O)nc12 2296589828 HUNRZRPKVKMEOW-AWEZNQCLSA-N 448.591 4.041 10 10 IICE Cc1ccccc1NC(=O)CCCN1C(=O)C(=Cc2cccc3c2OCO3)SC1=S 2297325607 BASPXQUIJQAOQF-UHFFFAOYSA-N 440.546 4.344 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1ccc(O)c(OC)c1 2313499058 FWQJTNIWGSQFJW-UHFFFAOYSA-N 444.281 4.041 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccc(Cl)c(C(=O)O)c3)N=C2C)cc2sc(=O)oc12 12412705 CWDOAYXEHRQADW-XGICHPGQSA-N 444.852 4.021 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)ccc1OCC(=O)O 16915672 NQXWGYPMAVKYRE-LICLKQGHSA-N 433.482 4.094 10 10 IICE Cc1cccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1 20356348 MTMVBGOIJKQNEK-HRGNJQJKSA-N 432.553 4.075 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCc1ccccc1 35638440 PFGSUVDBKFRZDQ-XDJHFCHBSA-N 428.554 4.166 10 10 IICE CS(=O)(=O)c1cccc(C(=O)N[C@@H](c2ccccc2)c2c(O)ccc3ccccc23)c1 247554349 WVXFCHMJOWUUTJ-DEOSSOPVSA-N 431.513 4.468 10 10 IICE CC[C@@H](NCC1(NC(=O)OC(C)(C)C)CCOCC1)c1cc(Br)ccc1O 697002233 ZSZAWIGNCIGKKE-MRXNPFEDSA-N 443.382 4.269 10 10 IICE O=C(NCCCc1cccc(F)c1)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 731681817 IAMOBIKKSCUUBI-UHFFFAOYSA-N 439.453 4.113 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2noc(-c3ccc(F)cc3)n2)C1 766770664 XDBNTCCBTJVVPI-UHFFFAOYSA-N 448.498 4.340 10 10 IICE CCCCn1nc(C)c(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1Cl 768669956 JVPFAZPNVHHLIT-UHFFFAOYSA-N 430.040 4.467 10 10 IICE CC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1C(C)C 768913694 PLAATDODGQAPDA-UHFFFAOYSA-N 436.600 4.111 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc3nn(C(C)C)cc3c2)c(C)n1-c1ccccc1 774079185 PBNXIZYVGNBJOM-UHFFFAOYSA-N 443.551 4.322 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@H](C)C3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802678591 UDNKULMCRODMOY-XQBPLPMBSA-N 435.572 4.145 10 10 IICE CC(=O)C(=O)COC(=O)c1cc2c(C)nn(Cc3ccc(Cl)cc3Cl)c2s1 808494689 COOAJRFVGUZLBX-UHFFFAOYSA-N 425.293 4.076 10 10 IICE Cc1cc(C(=O)N[C@H](c2cnn(C)c2)C2(CO)CCC2)c(C)n1-c1cccc(Cl)c1 820175070 RVJUSTYGBGCGLY-OAQYLSRUSA-N 426.948 4.115 10 10 IICE CN(C)c1ccccc1N(C)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1127296195 FGLLCTQYWYHMKK-XMHGGMMESA-N 443.569 4.146 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c2C)c1 1132264555 WBPVVDZRKMQYRO-UHFFFAOYSA-N 436.468 4.468 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CSc2ccccc2Br)N(C)C)cc1 1134882439 PYUXRWUAKNWWTN-GOSISDBHSA-N 436.419 4.026 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)c1 1165617567 IEXPZOIRPTUMRU-AREMUKBSSA-N 429.564 4.296 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3n[nH]c(-c4c(F)cccc4F)n3)ccc21 1182745760 GTXBMFCNTNJTTJ-UHFFFAOYSA-N 425.439 4.220 10 10 IICE CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCc1c(O)cccc1F 1184349106 VFRWIABCWATUSC-KRWDZBQOSA-N 427.303 4.299 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc4nc(O)n(CC(C)(C)C)c34)C2)cc1 1276831818 FRHKVAQVYDHQGH-QGZVFWFLSA-N 436.556 4.053 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc(C(=O)OC(C)(C)C)c1 1291629334 UPCUWYOBOXYXDN-UHFFFAOYSA-N 426.582 4.434 10 10 IICE CN(Cc1ccccc1O)C(=O)c1ccc([C@@H]2CCCCN2C(=O)OC(C)(C)C)n1C 1294680557 WQLYMEIIEIIEAH-IBGZPJMESA-N 427.545 4.465 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 1294869438 MOZDCRLPLONJSQ-OAQYLSRUSA-N 426.513 4.015 10 10 IICE COc1ccc([C@@H]2CCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1F 1313417031 QHCIAGYDQPKUHR-FCHUYYIVSA-N 428.552 4.050 10 10 IICE COCCCn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1316044537 WDRRTWYXMJYFSX-UHFFFAOYSA-N 425.602 4.204 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1F 1357778468 BSROEXRGDSDHQV-UHFFFAOYSA-N 433.527 4.069 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2cccc(N3CCOC3=O)c2)cc1 1444270453 RMQLYGHNNVLYAA-GOSISDBHSA-N 445.519 4.283 10 10 IICE Cc1cc(C(=O)N2CCC[C@](CO)(C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1450193446 OYCHUIUDFYACMD-NRFANRHFSA-N 434.378 4.122 10 10 IICE Cc1nc(Cc2ccccc2)sc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460741004 KAWMBVSKOJWYBL-UHFFFAOYSA-N 443.519 4.087 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3cc(Br)ccc3Cl)C2)cc1 1461080762 ZEVQNAFMGWAOTA-AWEZNQCLSA-N 437.765 4.296 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4ccc(Br)cc4C3)C2)cc1 1470595166 ZYJJANJYBGKWSM-MRXNPFEDSA-N 444.373 4.052 10 10 IICE CC1CCC2(CC1)OC[C@H](CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)O2 1478324352 SAUFMVVLITYAQB-VMQIMYIWSA-N 441.572 4.379 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC[C@H]1CCC[C@H]1c1ccccc1 1478714099 ZARGAURIXATQGH-UXHICEINSA-N 429.511 4.185 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](CC)C1)OC 1497190250 GDYANROOUZSDIN-FCHUYYIVSA-N 437.588 4.393 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1516676946 HQAKKTUGDICTFA-FQEVSTJZSA-N 437.588 4.394 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N2CCC(CCCO)CC2)cc1F 1517003576 KTEQGHOAPYAMGY-UHFFFAOYSA-N 429.584 4.178 10 10 IICE CCSCC[C@@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1523667030 DGTXAGSPPFDJHX-OPCAMPFDSA-N 426.604 4.065 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(O[C@H]2CC2(F)F)cc1 1530287878 JOAMYBMVSKTKLW-IBGZPJMESA-N 438.421 4.473 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)C[C@@H](C)C1 1541084391 BZVPFUVRPJIVSZ-RTBURBONSA-N 448.615 4.361 10 10 IICE CC(C)CN(C)c1nnc(Cc2cn3ccccc3n2)n1CCCSc1nccs1 1541539693 XFUHBGQZMIOJDN-UHFFFAOYSA-N 441.630 4.248 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(F)c2)cc1)C1CCCCC1 1542412373 YGFRSPVKHHTHJG-UKILVPOCSA-N 437.559 4.430 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc([C@H]4CCCN(C)C4)c3)cc2F)C[C@@H](C)O1 1558915502 PXKFZHZELYDABE-PWHSHALESA-N 439.575 4.179 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccc(Cl)cc1O 1610900240 QQILGZBVJNAEKY-CXUHLZMHSA-N 436.917 4.415 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CNC(=O)OC(C)(C)C)C1CCCCCC1 1611430872 HTXOLROMDDEMSX-QFBILLFUSA-N 434.577 4.256 10 10 IICE CC1=C[C@@H]2C[C@H](C)CC[C@@H]2[C@](C)(/C(O)=C2/C(=O)NC(CO)=C2O)[C@H]1/C=C/C=C/C[C@@H](C)O 1615671370 AJDLKWSYDPWRCH-NOJPCFAKSA-N 443.584 4.208 10 10 IICE C[C@@H](Sc1nc2ccccc2s1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1616858196 IUXBHQNEEAKDIY-BEFAXECRSA-N 428.627 4.262 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3CC3CCC3)cc2F)C[C@@H](C)O1 1620441091 DCZJMXJYEKPPSQ-WOIUINJBSA-N 431.596 4.100 10 10 IICE CCN(CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)Cc1ccccc1Cl 1626107606 ZNHXBZURHTXRBL-QHCPKHFHSA-N 444.019 4.436 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@@H](C)[C@@H]2C(=O)OC(C)(C)C)cc1 1626995293 OBZGMVFIVSWTPC-MZNJEOGPSA-N 438.568 4.418 10 10 IICE CN(c1ccc(CNC(=O)C2(C(=O)OC(C)(C)C)CCOCC2)cc1)C1CCCCC1 1627005835 GYIWIVKFVAUMKG-UHFFFAOYSA-N 430.589 4.210 10 10 IICE O=C(Cc1cccc(C(F)(F)F)n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1629055181 CUVLATJQACWRGR-CQSZACIVSA-N 429.389 4.030 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)cc1 1629596303 QICUESOFTVXLKM-SFHVURJKSA-N 442.519 4.300 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCOc1ccc2c(c1)CCCC2 1632701755 MGDBCIWCDXDULI-UHFFFAOYSA-N 445.943 4.285 10 10 IICE CCN(C(=O)/C=C\[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1634247964 SWYOVOBMCNXCNF-LOJRPPCJSA-N 443.588 4.079 10 10 IICE CCCOc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1635941330 QJYLPXALEDTISN-GOSISDBHSA-N 432.948 4.237 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cc1c(Br)cnn1C 1637244272 ZMCGYCQXUISJAM-HNNXBMFYSA-N 428.330 4.221 10 10 IICE COC(=O)c1cnc(SCC(=O)N(C)[C@H](c2ccccc2)c2ccc(F)cc2)s1 1656581215 VHHAOSXVKGHWFD-LJQANCHMSA-N 430.526 4.409 10 10 IICE CC[C@](O)(CCC(F)(F)F)CNC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1684444973 VWWVNSVMIMDVCJ-NRFANRHFSA-N 425.495 4.419 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN([C@H](C)c2ccc(F)cc2F)CC1 1686826600 LITZSCJRHDCQDL-RBUKOAKNSA-N 444.570 4.359 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(CCc3ccc(C)cc3)C[C@@H]3CCCO3)C2)cc1 1687022866 IIJJAWRBWDLVBM-DHLKQENFSA-N 437.584 4.016 10 10 IICE Cc1nnc(N2CCC[C@H](CN3CCC(C)CC3)C2)n1CCCSc1nccs1 1707897610 KUCODQMQAJYELV-LJQANCHMSA-N 434.679 4.174 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2noc3c2COCC3)n1CCCC(C)(C)C 1711095640 SULCYYAUPLTBIC-UHFFFAOYSA-N 425.533 4.174 10 10 IICE CCOCc1nnc(N2CCCC[C@@H](SCC)C2)n1Cc1ccc(N(C)C)cc1C 1729052219 LKLKYVBPCZOYSW-OAQYLSRUSA-N 431.650 4.349 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1Cc1nc(C(C)(C)C)cs1 1729420397 PMWXHVBAEWMCIK-QGZVFWFLSA-N 427.574 4.274 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CC[C@H](OCC(C)C)C2)cc1 1766611999 YTMKGJFBNNJMQW-DEOSSOPVSA-N 448.615 4.486 10 10 IICE CN(CC1CC(F)C1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1768750002 HAQLVJHEDDAIKG-UHFFFAOYSA-N 443.611 4.017 10 10 IICE CCCN(CCC)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1772875793 YXURJXYPTIQIDM-UHFFFAOYSA-N 441.551 4.497 10 10 IICE CC(C)(C)OC(=O)N1CC(C2(NCc3cc(Cl)cc(Br)c3O)CC2)C1 1965936337 HTVOXVMGYVSETD-UHFFFAOYSA-N 431.758 4.297 10 10 IICE C[C@@H](c1ccccc1O)N(C)C(=O)C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2060163209 CVELSKQIHZRWGZ-AZUAARDMSA-N 442.556 4.412 10 10 IICE CC[C@H](NC[C@@H]1[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21)c1cc(Br)ccc1O 2119085632 ZMYHVLIPPBDIGL-YVSFHVDLSA-N 425.367 4.308 10 10 IICE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1c(Br)ccc(OC)c1O 2236056987 YNMYNAPPKSWYPR-CJNGLKHVSA-N 443.382 4.289 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)Nc1cccc(C(=O)O)c1 2293039535 JZFIUVXJNCAABO-UHFFFAOYSA-N 446.937 4.268 10 10 IICE CC1=NN2C(=N)C(=Cc3ccc(OCCOc4ccc(C)cc4C)cc3)C(=O)N=C2S1 2293541131 CDDFLMOPYXZBEJ-UHFFFAOYSA-N 434.521 4.400 10 10 IICE Cc1ccc([N+](=O)[O-])cc1-c1ccc(C=C2C(=O)NC(=O)N([C@H](C)c3ccccc3)C2=O)o1 2297348024 SDSPCQIJGZJSFK-OAHLLOKOSA-N 445.431 4.386 10 10 IICE O=C(O)CN1C(=O)C(=Cc2cccc(OCc3c(F)cccc3Cl)c2)SC1=S 2313653000 CABCWYNPJDFNBN-UHFFFAOYSA-N 437.901 4.344 10 10 IICE CC(=O)c1ccc(N2C(=O)C(=Cc3ccccc3O[C@H](C)C(=O)O)SC2=S)cc1 2314932026 SQIPLABVXUDYQI-CYBMUJFWSA-N 427.503 4.147 10 10 IICE Cc1ccc(CN[C@H]2C[C@H](CNC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352940323 DDOBQJRIWADFMX-CABCVRRESA-N 427.383 4.492 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccc(C)cc4)C3=O)c2C)cc1 8643542 GESADJHDVBXCLL-AREMUKBSSA-N 429.520 4.361 10 10 IICE COc1ccc(OC)c([C@@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 227086206 RIBIPTGWUZJFGU-IXDOHACOSA-N 445.535 4.017 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@]2(NCc2cc(Br)cc(F)c2O)C1 715736270 HFSOPBPCPHTCNY-DJJJIMSYSA-N 429.330 4.173 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCC(C(=O)c4ccc(C)cc4)CC3)CC2)cc1 726714249 WUSJDXKYVNCXMY-UHFFFAOYSA-N 435.568 4.277 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCC2CCN(C(=O)c3ccccc3)CC2)cc1F 738472306 GPLZDLPBSROTHI-UHFFFAOYSA-N 440.563 4.024 10 10 IICE Cc1cc(CCNC(=O)NCc2cccc(NC(=O)N(C)C)c2)c(C)n1-c1ccccc1 745391377 MMENTHRIPGDIQX-UHFFFAOYSA-N 433.556 4.230 10 10 IICE CN1CC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@H]1c1ccc(F)c(F)c1 764510005 CIPLBRRUPYANDF-FYYLOGMGSA-N 441.478 4.421 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Oc2ccc(C(=O)N3CCCC3)cc2)C1 766609854 WEGZLZJJWHJQOB-UHFFFAOYSA-N 445.563 4.249 10 10 IICE CCN(CC)C(=O)C1CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 799995531 NCKUEMSZBUSTHZ-SFHVURJKSA-N 449.039 4.366 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3nnn(C4CC4)c3C(F)(F)F)cc2Cl)C1 800049258 NSRITCAIWXNVGU-LBPRGKRZSA-N 441.885 4.452 10 10 IICE COc1ccc(-c2ncc(C(=O)NCc3cc(Br)ccc3O)s2)cc1OC 804736733 ZEOFEXXIOISFPY-UHFFFAOYSA-N 449.326 4.225 10 10 IICE C[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(N2CCCCC2=O)cc1 811974044 MHIFZEWZRRGNDK-CQSZACIVSA-N 446.345 4.232 10 10 IICE Cc1sc(NS(=O)(=O)c2c(Cl)nc3ccccn23)nc1-c1cccc([N+](=O)[O-])c1 917924529 XZQSCAFDLMPDIQ-UHFFFAOYSA-N 449.901 4.129 10 10 IICE Cc1cc(C(=O)NC2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Br)cc1 1136755676 CVXQBHAZUHMZHC-UHFFFAOYSA-N 448.361 4.206 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2ccc3n2CCN(C(=O)OC(C)(C)C)[C@H]3C)c1 1137473787 VYHCEVJERDGAPC-CABCVRRESA-N 429.517 4.005 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)cc1 1248440207 SUWDOWQKUNGACU-UHFFFAOYSA-N 430.858 4.040 10 10 IICE CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1270432844 RPNGWPIUAVYWAO-OXJNMPFZSA-N 438.037 4.284 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCCS1 1287179700 OIABFYADQJPFSZ-OAQYLSRUSA-N 429.634 4.160 10 10 IICE Cc1ccccc1Cc1nnc(N(C)[C@@H]2CCOC2)n1CCCSc1nccs1 1304547558 PNTLIYRSXFSTEH-GOSISDBHSA-N 429.615 4.041 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC(C)(C)c2ccccc2Br)N(C)C)cc1 1313420888 ZZXLKNIZDPHDHN-HXUWFJFHSA-N 447.421 4.352 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1313677268 NDDPOWMCXLBSNG-LJQANCHMSA-N 434.588 4.238 10 10 IICE CCn1nc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1C1CC1 1355469042 JFVNSQUXKFRKLX-BOPFTXTBSA-N 444.557 4.150 10 10 IICE CS(C)(=O)=Nc1cccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1361063305 MMQOXFHXSXNKHA-QGZVFWFLSA-N 437.512 4.046 10 10 IICE COc1cc(N2CCN(C(=O)Cc3csc4sc(C)cc34)CC2)cc(OC)c1OC 1435843963 XUOWHDZBULCNQN-UHFFFAOYSA-N 446.594 4.188 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Cl)c(Br)cc3F)C2)cc1 1437582063 VKNNRNZOFVPWFC-NSHDSACASA-N 427.701 4.259 10 10 IICE COc1ccccc1[C@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1446734486 SORDBLNDQSBVEE-FQEVSTJZSA-N 443.341 4.329 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(c3nc(F)c(F)cc3F)CC2)c1 1447652472 KXGLWFWXISXZII-UHFFFAOYSA-N 428.458 4.177 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@](O)(C3CC3)C2)sc(C)c1-c1ccccc1 1460389406 KNLMLOMASVLZMP-XMMPIXPASA-N 442.581 4.076 10 10 IICE CCC1(CC)CN(C(=O)c2c[nH]nc2-c2cnn(C)c2)c2ccc(Br)cc21 1465755776 TYYPWLLISQHSBH-UHFFFAOYSA-N 428.334 4.291 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)C2)cc1 1470774174 XARNHIKSHOVTMS-HXUWFJFHSA-N 441.959 4.232 10 10 IICE Cc1nnc(N2CCC[C@H](CN3CCCC[C@H]3C)C2)n1CCCSc1nccs1 1492846354 FPSVYMBHDUWTAM-IEBWSBKVSA-N 434.679 4.316 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)c(F)c2)C1 1500703072 LCTHIHMHIIKRGZ-AZUAARDMSA-N 430.616 4.213 10 10 IICE CO[C@@H](C)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1503944375 JHLNNRBQVIWNLT-SFHVURJKSA-N 425.602 4.202 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(F)c2cccnc12 1525806125 OOWXUICMOHITLW-UHFFFAOYSA-N 433.405 4.159 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@H]3c3ccc(OC(F)(F)F)cc3)C2)cc1 1526246321 JJIOUTIAWBFBNI-GQWLDOHISA-N 434.458 4.340 10 10 IICE CCOC(=O)c1c(NC(=O)COCc2nc(CC)no2)sc(C)c1-c1ccc(F)cc1 1531750543 ZQLVJTZFWYZQJB-UHFFFAOYSA-N 447.488 4.140 10 10 IICE Cc1ccc(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1I 1536549377 FKXBXTBPNANVKA-OAHLLOKOSA-N 436.337 4.335 10 10 IICE CSc1cc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)ccc1Br 1538714656 RJXJLLIDZLWIEJ-UHFFFAOYSA-N 448.386 4.092 10 10 IICE CC(C)NC1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1541708665 HNWCUJNIIOFYDA-UHFFFAOYSA-N 430.616 4.087 10 10 IICE CCOCc1nnc(N2CCc3ccccc3CC2)n1CCCSc1nccs1 1548139559 GDFOSAPEFUGHMK-UHFFFAOYSA-N 429.615 4.059 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@](C)(O)c2ccccc2Cl)C1 1556108700 YQDNWNAKBGYVHO-VWLOTQADSA-N 439.987 4.085 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(Cl)c(Br)cc1F 1583334707 NZIVIWUIRDNGMU-UHFFFAOYSA-N 427.701 4.008 10 10 IICE CCOc1ccc(N2C[C@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1596471870 JHZDPRWKXIUHRB-JOCHJYFZSA-N 445.563 4.471 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)CC2)cc1 1596963178 FNNWZGQSERHJOW-OAQYLSRUSA-N 447.620 4.406 10 10 IICE CCC1(CC)CN(C(=O)/C=C/C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc21 1597008104 MACVFXRPSWFYHF-CCEZHUSRSA-N 447.579 4.005 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1615768704 MUPYZXKXXWZUEB-MSOLQXFVSA-N 430.616 4.039 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn(C(C)(C)C)c2Br)cc1F 1616925563 YUCKBFHEYOKHTO-UHFFFAOYSA-N 425.346 4.316 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCSc1ncnc2[nH]cnc12 1623923672 BNKCMZRSSKHRGV-MRXNPFEDSA-N 433.537 4.331 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(c3cc(F)cc(Br)c3)CC2)N(C)C)cc1 1627463934 GXKUPBRBEJDKPJ-HXUWFJFHSA-N 448.380 4.105 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)OC(C)C)c(C)n1-c1ccc(Br)cc1 1628546176 JYFKLBYNAVROMR-IBGZPJMESA-N 433.346 4.413 10 10 IICE Cc1ccc(C(=O)N2C[C@H](c3ccccc3)[C@](F)(CO)C2)cc1-n1c(C)cc(C=O)c1C 1628760493 VXRUCOFQCRWEKC-ZEQKJWHPSA-N 434.511 4.155 10 10 IICE CC1CC(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)(c2cccc(Cl)c2)C1 1629963798 QAJMQSLJADOVHV-UHFFFAOYSA-N 430.951 4.424 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1 1632194310 ZAKMSBGUUQLDAO-UHFFFAOYSA-N 439.556 4.284 10 10 IICE Cc1cc(C(=O)NC[C@@H](CO)Cc2ccncc2Cl)c(C)n1-c1ccc(Cl)cc1 1635602276 OSNTWEJRKXRQCL-INIZCTEOSA-N 432.351 4.377 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3nc(C)cc(C)c3[N+](=O)[O-])c2C)cc1 1641025024 SDDFFPQERAOUNY-UHFFFAOYSA-N 437.452 4.062 10 10 IICE CSc1ccccc1OC[C@H](O)CN(C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(C)C 1671844318 NVAVRWLXDBQZCH-WIYYLYMNSA-N 445.629 4.395 10 10 IICE CCc1csc(CC2CCN(C(=O)NC[C@H]3CCN(c4ccc(OC)cc4)C3)CC2)n1 1686854924 JTYLMUNNZPEKFI-LJQANCHMSA-N 442.629 4.205 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC1(F)CCC1 1692077263 PAIRVJACOAOETH-UHFFFAOYSA-N 429.584 4.232 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(O)CCOCC1 1695280451 INDJQNQESZZRFW-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1696375449 JNGDDASXWYQZDR-NRFANRHFSA-N 434.588 4.097 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1712177029 VOTHNEGHJNKTHK-HKUYNNGSSA-N 443.592 4.279 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCCO1 1769559857 CHZUXLXSNISJGC-SIKLNZKXSA-N 437.588 4.393 10 10 IICE Cc1ccc2c(c1)c1c(n2C)[C@H](NC(=O)CCc2nn(CC3CC3)c3c2COCC3)CCC1 1857521703 XTBUSRCHIDILCK-HSZRJFAPSA-N 446.595 4.292 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)cc1O 1951841619 BKUAOFVLNCQLCE-VWLOTQADSA-N 433.460 4.326 10 10 IICE O=C(COC(=O)C=Cc1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 2040425673 BDUICEDTTJVYMY-UHFFFAOYSA-N 445.858 4.311 10 10 IICE O=C(CCC1CCCCC1)NCCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S 2040490918 RQBSFVJUHLOGDI-UHFFFAOYSA-N 446.594 4.093 10 10 IICE COC(=O)c1c(C2(C)CC2)nn([C@@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080039899 XVAKDALTUNCTJF-MRXNPFEDSA-N 435.318 4.197 10 10 IICE COc1cc(Cl)cc(CNCC2(F)CCN(C(=O)OCc3ccccc3)CC2)c1O 2161078756 LJKUWHNZZUXBRF-UHFFFAOYSA-N 436.911 4.285 10 10 IICE O=C(CN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)Nc1nc2ccc(F)cc2s1 2314563168 NFQAWZITZKRGOJ-UHFFFAOYSA-N 447.513 4.414 10 10 IICE CCCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314769027 NLZKCNRASMJNPB-SFHVURJKSA-N 442.518 4.491 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccc(Cl)cc1 2314828066 QARIXSPXNXDBBU-UHFFFAOYSA-N 447.925 4.478 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2cccc(Br)c2O)C[C@H]2CCC[C@H]21 2335123906 BPLXWEGFQABZPZ-UKPHBRMFSA-N 425.367 4.422 10 10 IICE O=C1/C(=C/c2ccc(Cl)cc2)N=C(c2ccccc2)N1c1ccc(S(=O)(=O)O)cc1 83302329 KMKRTXXWDHACKU-ZHZULCJRSA-N 438.892 4.421 10 10 IICE CCOc1ccc(N2C(=O)/C(=C\c3ccc(N4CCOCC4)cc3)N=C2SCC)cc1 96448887 ZMMBZRJGPMUKPH-OQKWZONESA-N 437.565 4.419 10 10 IICE CC[C@@H](C)Sc1ccc(NC(=O)NCc2ccc(N3CCNC(=O)C3)cc2)c(C)c1 109676690 ZALFMHDTUDYLMN-QGZVFWFLSA-N 426.586 4.144 10 10 IICE COc1ccc(OC)c(S(=O)(=O)Nc2nc(-c3ccc(OC)c(C)c3)c(C)s2)c1 170550925 LXCFFUVHDPKYQF-UHFFFAOYSA-N 434.539 4.254 10 10 IICE CCCCN(C(=O)/C=C\c1cc(C)n(-c2ccc(C)cc2)c1C)[C@@H]1CCS(=O)(=O)C1 206439081 IGQZNETXBWSOEE-UQBDUDKASA-N 428.598 4.232 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2nc(C3CCOCC3)cs2)C1 561392499 CWGVYDGUVKFORZ-UHFFFAOYSA-N 438.597 4.397 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2CNCc1cc(Br)ccc1O 703955053 NGNMHIQTTAXKNO-OAHLLOKOSA-N 425.367 4.282 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@@H](NCc1c(O)cccc1Br)C2 706831867 QUEWKCNRPJRULF-VDGAXYAQSA-N 445.357 4.434 10 10 IICE CC(C)[C@@H](NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2)C(N)=O 730509227 RNEQTYXSCBKGFP-MMYRTMNYSA-N 442.563 4.027 10 10 IICE C[C@@H](NCc1ccc(Cn2ccccc2=O)cc1)c1cc(Br)c(F)cc1O 756478155 DISNQXSFLLJPRE-CQSZACIVSA-N 431.305 4.355 10 10 IICE CCc1ccccc1NC(=O)COC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 769663004 JKVCNGUVLHVWQD-UHFFFAOYSA-N 433.552 4.152 10 10 IICE CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773845421 JEWHPJQKGWOFGK-GOSISDBHSA-N 433.556 4.088 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3nnc(-c4c(F)cccc4Cl)s3)CC2)cc1 775902523 DMOCOKQOFVZBGE-UHFFFAOYSA-N 447.923 4.360 10 10 IICE CCN1CC[C@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 782518772 AUUUUTQPJBOTOX-GMAHTHKFSA-N 444.501 4.115 10 10 IICE O=C1/C(=C/c2cccc3cnccc23)SC(=S)N1CCc1ccc2c(c1)OCCO2 782880243 LUESBYVOFAMOOL-BKUYFWCQSA-N 434.542 4.450 10 10 IICE C[C@@H]1C[C@@H](NC(=O)NCc2cc(Br)ccc2O)CCN1Cc1ccccc1 805177324 YEHJTHBMKZERJE-BEFAXECRSA-N 432.362 4.007 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(F)c3)C2)sc2c1CCCC2 1124198617 BNSBKNASGNQJIE-CQSZACIVSA-N 444.528 4.243 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(F)ccc3-c3ccoc3)cc2F)CC1 1125976012 HPPAGHQDDZGGGT-UHFFFAOYSA-N 425.479 4.297 10 10 IICE C[C@@H](OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ncccc1F 1128411704 LDAHIOXOVNTJMP-COOUDCDJSA-N 434.489 4.256 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(Cl)cc2Br)N(C)C)cc1 1134681948 ODGNOHOHAHPHFQ-IBGZPJMESA-N 438.797 4.130 10 10 IICE CO[C@H]1CN(C(=O)OC(C)(C)C)[C@](C)(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)C1 1135745934 IBWLBWXYUYKLMK-BWKNWUBXSA-N 445.604 4.050 10 10 IICE CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C1(CC)CC 1169565239 BBHLSMNBUPGZDB-UZFJHSOTSA-N 448.563 4.362 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(OCc4ccccc4)c(OC)c3)C2)cc1 1278860699 ACSBVQJTGSEYKV-NRFANRHFSA-N 432.520 4.292 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1293875049 PZEQSTZBHPZPHY-GOSISDBHSA-N 446.603 4.402 10 10 IICE CCc1nc2ccccc2n1CCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294161702 RYBJIGFXMZCJRB-KRWDZBQOSA-N 442.510 4.375 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2nc(-c3ccccc3)n(-c3ccc(F)cc3)n2)c1 1294937803 TWMSYYIYMQVCCN-OAHLLOKOSA-N 432.455 4.279 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCC(F)(F)CC2)cc1 1295414173 VYUAPEPVWDNJJO-UHFFFAOYSA-N 426.515 4.470 10 10 IICE CN1C(=O)CC[C@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(C(F)(F)F)cc1 1305085105 QOHPMZSNDLVJGU-YJBOKZPZSA-N 440.849 4.290 10 10 IICE C[C@@H](Cc1cccc(F)c1)N(C)CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307830129 XKEYAAUNSPUILH-INIZCTEOSA-N 430.479 4.103 10 10 IICE CN(C)c1ccc(Cn2c(N3CCN(c4cccs4)CC3)nnc2C(C)(C)C)cc1F 1314659015 PIEURRPMDSIPNV-UHFFFAOYSA-N 442.608 4.217 10 10 IICE COC[C@H]1CCN(c2nnc(-c3ccccc3OC)n2CCCSc2nccs2)C1 1315912002 XZEDEGJRCDNQSO-INIZCTEOSA-N 445.614 4.065 10 10 IICE Cc1sc(NC(=O)C[C@@H]2CCCS(=O)(=O)C2)c(C(=O)OC(C)C)c1-c1ccccc1 1358010353 XAZIDFLQPWUTDU-INIZCTEOSA-N 449.594 4.442 10 10 IICE O=C(/C=C\C1CCCCCC1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1358428735 MOVSSPSOLCWMRZ-LUAWRHEFSA-N 437.563 4.085 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCCC[C@@H]2COC(=O)NC(C)C)CCCC1 1436171082 NRJTWAHHRKCAIF-GOSISDBHSA-N 441.572 4.044 10 10 IICE Cc1ccc(-n2nc(Br)cc2C(=O)NCCCSc2nccs2)cc1 1443489928 NQNSMHUZPSLJRY-UHFFFAOYSA-N 437.388 4.312 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccccc3)CN3CCOCC3)c2C)c1 1465307297 DDOBHSMSRFPULZ-DEOSSOPVSA-N 431.580 4.076 10 10 IICE COC(=O)[C@@H](C)N(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CCC1 1466865590 YLZYVMTXCDVCMA-OAHLLOKOSA-N 433.346 4.413 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1CCOc2ccc(Br)cc21 1467764376 QICDIHUQGBNSAW-GFCCVEGCSA-N 441.119 4.100 10 10 IICE COc1ccc(CN2CC[C@@H]2CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1470246841 VJJZBZUDLGHOKV-XMMPIXPASA-N 445.563 4.228 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1 1478573142 LMJLUCOAOALKQZ-YLZJTPGZSA-N 440.554 4.097 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCCN2C(=O)c3ccccc3C2=O)c1 1531965757 KADSPWKKWWZEJU-UHFFFAOYSA-N 435.911 4.164 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnc2c(c1)c(C)nn2-c1ccccc1 1536549632 IGJGHKFIAIHUNO-GOSISDBHSA-N 427.552 4.464 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC3(CCCC3)OC[C@@H]2CN(C)C)c1 1539398125 QYLPNDFZXYZECZ-FQEVSTJZSA-N 429.992 4.463 10 10 IICE Cc1cc(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)c(C)n1-c1cccc(Cl)c1 1540613501 VOPPJNZSBIDASC-UHFFFAOYSA-N 443.956 4.441 10 10 IICE Cc1cc(N2CCOCC2)ccc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1540756642 YCYNQUSMKJQDJL-UHFFFAOYSA-N 431.536 4.233 10 10 IICE Cc1cc(-c2nnc(N(C)C3CCC3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1542179799 PPIUZQIMQXWWDM-UHFFFAOYSA-N 434.588 4.256 10 10 IICE CNc1cc(-n2nc(C)cc2NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)ncn1 1542548269 BLYSPFRTEVBUQW-UHFFFAOYSA-N 435.919 4.326 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2c(s1)-c1ccccc1OC2 1546151803 HRKYVZRGPMPDHV-UHFFFAOYSA-N 443.908 4.482 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1555648883 NPXVEHNRWPMQEK-IBGZPJMESA-N 429.609 4.051 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc([C@@]3(C)NC(=O)N(C)C3=O)cc2)c1 1557234240 HBEDLODDEBHMHC-RUZDIDTESA-N 430.508 4.052 10 10 IICE COC(=O)[C@H](CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)C1CCCCCC1 1558482460 DGZMATHIHFNDTG-JOCHJYFZSA-N 440.584 4.405 10 10 IICE O=C(NCc1c(O)cccc1F)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 1564602479 CQTUIKTWRCLNLO-LJQANCHMSA-N 444.304 4.472 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3ccc(C(C)(C)C)cc3)CC2)c(OC)c1 1587487272 XULVWADWQNTUCL-GOSISDBHSA-N 426.557 4.117 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCNC(=O)c1n[nH]c2ccccc12 1597567463 ORAZFNZDUDCDOC-SFHVURJKSA-N 442.519 4.178 10 10 IICE Cc1ccc(C(=O)N2CCCC[C@@H]2COC(=O)NC(C)C)cc1-n1c(C)cc(C=O)c1C 1623538212 ROKLJLONIMEKNT-JOCHJYFZSA-N 439.556 4.344 10 10 IICE Cc1cc(C(=O)NCCCN2CCCO[C@@H](C)C2)c(C)n1-c1ccccc1Br 1632818906 GPYYFZNQLWZPHJ-KRWDZBQOSA-N 448.405 4.087 10 10 IICE C[C@@H](OCc1ccccc1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634162949 PTYLCTYAKCCSTL-GCJKJVERSA-N 441.572 4.040 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc(N3CCCNC3=O)c2)cc1 1634851333 JHGAPWWJBKUUAB-UHFFFAOYSA-N 430.508 4.008 10 10 IICE COC1(c2ccccc2)CN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1640329427 IPCXDILKPRHWNV-UHFFFAOYSA-N 440.341 4.249 10 10 IICE COc1ccnc(N2CCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CC2)c1 1652459868 MEDWSXIHFYCYDH-UHFFFAOYSA-N 430.512 4.266 10 10 IICE COC(=O)c1cnc(S[C@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)s1 1656580715 PBKLSDKTTHHYBL-CYBMUJFWSA-N 430.551 4.231 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1C[C@H](Sc2ccccc2)C1 1687201664 KQTUWLHVJQHQAG-JKIUYZKVSA-N 425.598 4.018 10 10 IICE COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1687218086 ZJFBMCBSVJAEGG-OAQYLSRUSA-N 425.573 4.257 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3Cc3ccsc3)CC2)cc1 1711865364 SLVUCIVOXQLUEX-UHFFFAOYSA-N 425.602 4.411 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1766822934 LXDGZMXZFQGRJU-SJORKVTESA-N 437.635 4.164 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C2CCC2)n1CC[S@](=O)C(C)(C)C 1768651700 VSLIBULNMHGGSY-HKBQPEDESA-N 443.661 4.329 10 10 IICE O=C1/C(=C\c2ccc3c(c2)OCCO3)SC(=S)N1c1ccc(Cl)c([N+](=O)[O-])c1 1860085096 MOSWURRJUMCXFJ-LZYBPNLTSA-N 434.882 4.425 10 10 IICE Cc1cc2oc(=O)c(C(=O)N[C@H](c3ccc(N(C)C)cc3)c3nccn3C)c(C)c2cc1C 1866296149 DJXYCIZSKIESGU-HSZRJFAPSA-N 444.535 4.037 10 10 IICE Cc1ccc2nc(N3CC(C(=O)NCc4ccc(N5C[C@H]6CC[C@H]5C6)cc4)C3)sc2c1 1891489610 LDIQFVRCUOAOHH-RXVVDRJESA-N 432.593 4.346 10 10 IICE Oc1cc(Br)ccc1Cn1ncc(C2CCC2)c1I 2070222994 FCMQMFJOCRMKPZ-UHFFFAOYSA-N 433.087 4.272 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C(C)C)c(CN)c2I)c(O)c1 2080007120 NFRZDOYGVOLEDD-QGZVFWFLSA-N 443.329 4.029 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@@H](NCc1cc(Cl)ccc1O)CO2 2160180157 GMPKMHBQHCUQNT-HXUWFJFHSA-N 430.932 4.096 10 10 IICE Oc1c(Br)cc(Cl)cc1CNC[C@H]1CC1(Br)Br 2213078670 DGKRTZOFJPHLKK-SSDOTTSWSA-N 448.380 4.404 10 10 IICE CCOc1cccc(N2C(=O)NC(=O)C(=Cc3cccn3-c3ccc(Cl)cc3)C2=O)c1 2293476889 LFOMLPLJXLKJGX-UHFFFAOYSA-N 435.867 4.196 10 10 IICE CCOC(=O)c1ccccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccccc3C)C2=O)o1 2297333540 ZKUWHYBGNXQIBX-UHFFFAOYSA-N 444.443 4.098 10 10 IICE O=C(O)CCN1C(=O)C(=Cc2ccc(-c3ccccc3Br)o2)SC1=S 2297576243 GNWFYBKIAHJCMZ-UHFFFAOYSA-N 438.324 4.385 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](COCc2ccccc2)(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2312334069 KHHDYAFQCVQOKV-SELNLUPBSA-N 443.548 4.178 10 10 IICE COc1cc(C=C2SC(=S)N(CNc3ccccc3C)C2=O)cc(OC)c1OC 2313503153 VCOQCJLJPPCGMP-UHFFFAOYSA-N 430.551 4.292 10 10 IICE COc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccc(F)cc3)C2=O)cc1 2314831901 VHLBEBMUGWBNKO-UHFFFAOYSA-N 430.526 4.454 10 10 IICE Cc1ccc(CNC[C@@H]2[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]32)c(O)c1Br 2352944276 FXUZSQWHUKZVRG-BZUAXINKSA-N 425.367 4.056 10 10 IICE CC[C@H]1[C@H](C(=O)NCc2ccc(C)c(Br)c2O)CCN1C(=O)OC(C)(C)C 2381139923 CNOPWUGHHDNGTG-CABCVRRESA-N 441.366 4.115 10 10 IICE C[C@H](CCCCC(=O)Nc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1ccc(O)c(O)c1 2012435 ZRBLJEGNAJFUPE-JLTOFOAXSA-N 440.462 4.327 10 10 IICE O=[N+]([O-])c1ccccc1[C@H]1Nc2ccc(S(=O)(=O)N3CCCC3)cc2[C@H]2C=CC[C@H]21 14478043 OTHDFLUDLDVQNY-JKSBSHDWSA-N 425.510 4.206 10 10 IICE C[C@@H](NC(=O)COC(=O)c1ccc2c(c1Cl)C(=O)c1ccccc1C2=O)c1ccccc1 33579021 STNWZCBMXLTUKG-CQSZACIVSA-N 447.874 4.150 10 10 IICE CCCCn1c(N2CCCCCC2)c(/C=C2\SC(=S)N(C)C2=O)c(C)c(C#N)c1=O 39991277 MQIKWRSEEDODFO-AQTBWJFISA-N 444.626 4.040 10 10 IICE N=C1/C(=C/c2ccc(SCc3ccco3)o2)C(=O)N=C2SC(C(F)(F)F)=NN12 96475767 NCFAYPYDISOJDT-YKOBRFCNSA-N 426.401 4.346 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S)Nc1nccs1 210732521 VOOOLFHHUDHORD-XNTDXEJSSA-N 428.564 4.245 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(CN(C)C(=O)c3ccccc3)no2)C1 572323027 VEJNEWSZEWBBPP-UHFFFAOYSA-N 443.551 4.111 10 10 IICE Cc1cc(CCNC(=O)N(C)Cc2cn(C)nc2C(F)(F)F)c(C)n1-c1ccccc1 750253809 GZKCVAQKLSLWJU-UHFFFAOYSA-N 433.478 4.231 10 10 IICE COc1ccc(O)c([C@H](C)Nc2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)cn2)c1 756845750 RPZRGIUEMSMLBD-INIZCTEOSA-N 428.533 4.026 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)c1O 769508658 ZYGPQLPSPPLMKK-YSSFQJQWSA-N 442.943 4.144 10 10 IICE CCOc1c(Cl)cccc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1125187855 JTMHNXVKOYILIT-IYBDPMFKSA-N 434.939 4.350 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1 1127737680 HRZVPNVZFQWZGF-OAQYLSRUSA-N 425.891 4.422 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CN(Cc4ccccc4C)CCO3)c2C)cc1 1152111168 OPYHJNYUQKPTOQ-VWLOTQADSA-N 447.579 4.042 10 10 IICE COC1CCN(c2ccc(CN3CCCN(Cc4ccccc4)CCOCC3)cc2)CC1 1176494947 DNHPIXBVSPZKEV-UHFFFAOYSA-N 437.628 4.026 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@H]3C)n2CCCCCO)c(C)n1-c1ccccc1 1289360974 QLHSUGPLUJTOKA-LJQANCHMSA-N 439.629 4.457 10 10 IICE CC[C@@H](Cn1c(C2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1292214845 AGVJZWJBBSSCLI-NRFANRHFSA-N 427.593 4.086 10 10 IICE Cc1ccc(CN(C)c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)s1 1304344843 BDOKRIAOCGCIFO-OAHLLOKOSA-N 435.644 4.427 10 10 IICE CO[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1315700564 AXNWWIZSASAGRK-NRFANRHFSA-N 443.661 4.083 10 10 IICE COC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)COC)C1 1315773055 DFJDRLKGDDDLHW-NQIIRXRSSA-N 437.588 4.108 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCO[C@@H](c3nccs3)C2)nnc1C(C)(C)C 1361098688 ZKQURBMTSNGLGV-LJQANCHMSA-N 440.617 4.033 10 10 IICE Cc1ccc(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)cc1-n1c(C)cc(C=O)c1C 1446333462 JIIFAAPXMOVTMH-JOCHJYFZSA-N 429.520 4.030 10 10 IICE CC(C)[C@H]1N(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC12CCC2 1450392304 GCNYKKIZDKTALY-XYSGSMRZSA-N 432.586 4.454 10 10 IICE CC(C)N(CC(=O)N(C)Cc1cc(Br)cs1)Cc1ccc(N(C)C)cc1 1459332150 JLDYDGRODQMDIG-UHFFFAOYSA-N 438.435 4.446 10 10 IICE COc1ccc(N2C[C@@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)cc1 1464544800 ZUZRAQNAEYCGOE-FQEVSTJZSA-N 435.568 4.133 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2ccc(OCC(F)(F)F)nc2)c1 1467322863 BFHLQSVOSIUDPW-UHFFFAOYSA-N 445.441 4.215 10 10 IICE COC(=O)Cc1ccccc1CNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1469958836 HWNGUVFRLOQTEP-KRWDZBQOSA-N 443.975 4.291 10 10 IICE Cc1cc(CC(=O)N2CC3(CCOCC3)CC[C@H]2CO)c(C)n1-c1ccc(Cl)cc1 1471987999 YQDTTXDKIQTAFC-QFIPXVFZSA-N 430.976 4.070 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC(Cc4ccccc4C(F)(F)F)C3)C2)cc1 1478956466 GOIGCYKYDPKHCZ-GOSISDBHSA-N 433.474 4.177 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C(C)(C)C1 1479437623 MVAGXYDLENOGTH-HXUWFJFHSA-N 443.544 4.343 10 10 IICE COCOc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)cc1 1524825918 MBQUVOFKIWSDEM-SFQUDFHCSA-N 448.591 4.351 10 10 IICE O=C(CCOc1cc(Cl)cc(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528261327 JAZTVMYOPQZUHI-UHFFFAOYSA-N 445.293 4.194 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C3(Cc4ccccc4Br)CC3)C2)cc1 1531729588 IGOOVTSEQFNLSZ-KRWDZBQOSA-N 429.358 4.176 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(c3cccc(F)c3)C(=O)C2)c1 1536450512 YRSBUUYMCFSIMU-UHFFFAOYSA-N 425.891 4.376 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1539708021 VEQJGSNLMHSOJK-LJQANCHMSA-N 434.675 4.227 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NC[C@H]3CN(Cc4ccccc4)CCO3)c2C)c1 1540532541 SNWAUICTCXKMGX-VWLOTQADSA-N 431.580 4.342 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@]1(C)CCCS1 1541325574 CTKYVZRARSCZII-HSZRJFAPSA-N 429.634 4.160 10 10 IICE CC(C)c1nnc(N2CCCCCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541358440 WYBKPBVDUQKLQV-UHFFFAOYSA-N 425.621 4.429 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](c2cccs2)C(C)(C)CO)CCCC1 1557216544 OZXYPDCZSNMXAP-QHCPKHFHSA-N 426.582 4.466 10 10 IICE CC1(C)C[C@H](c2ccccc2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1564895623 OZFWXECDZLATHC-OAQYLSRUSA-N 429.511 4.484 10 10 IICE CC(C)Cc1nc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)cs1 1565882380 XEXWOPNQWZCVDG-GOSISDBHSA-N 446.617 4.403 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc2cc(OC)c(OC)cc2c1 1566850034 VMFKRAXOJXMPSI-UHFFFAOYSA-N 443.883 4.031 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccc4nc(O)n(CC(F)(F)F)c4c3)cc2)CC1 1585541189 XAGJAUMHUPZRGR-UHFFFAOYSA-N 446.473 4.471 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N(C)CCCc1ccccn1 1611963331 NFAKJOYWOQKXGF-QFIPXVFZSA-N 448.615 4.059 10 10 IICE CCc1nc(CCn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cs1 1613873574 UEANPBSOPNKQPY-LJQANCHMSA-N 427.574 4.123 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)Oc2ccc(Br)cc2)N(C)C)cc1 1618643738 NIGCWZUYUDLIFV-FQEVSTJZSA-N 448.405 4.092 10 10 IICE CCS(=O)(=O)c1ccc(O)c(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1623558939 NLBTZKOWAJYKFO-UHFFFAOYSA-N 432.929 4.499 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SC(C)C)CC2)c(OC)c1 1623764074 IUCQGKRMXGSMBU-UHFFFAOYSA-N 445.541 4.075 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(Br)cc(C=O)c2)cc1 1627205390 QCBMVXQTYKTBJV-OAQYLSRUSA-N 445.357 4.149 10 10 IICE CN1CCCc2cc(CNC(=O)CCc3cnc(NC(=O)OC(C)(C)C)s3)ccc21 1631322291 HGWXWQQAPVVVBA-UHFFFAOYSA-N 430.574 4.122 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)[C@]12CCCO2 1633710345 JOVWCYHWNFRUEC-TUNNFDKTSA-N 447.373 4.313 10 10 IICE COC(=O)[C@H]1C[C@@H](C)CCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1634661650 UJMANYPKUNFXRK-ORAYPTAESA-N 433.346 4.270 10 10 IICE O=C(NCCc1cccc(Br)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1635996976 UIWIMFRNFLAAQB-IBGZPJMESA-N 433.346 4.088 10 10 IICE Cc1ccc([C@H]2[C@@H](C)CCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1644683116 ZAKDXRFCDIANNW-RXFWQSSRSA-N 439.575 4.060 10 10 IICE O=C(CCN(Cc1ccccc1O)C[C@@H]1CCCO1)Nc1ccccc1Br 1657726345 ZFXBNHDZPWTHIO-KRWDZBQOSA-N 433.346 4.165 10 10 IICE COC(=O)c1ccc([C@H]2CCCCN2Cc2ccc(N3CCC(OC)CC3)cc2)n1C 1660646066 BKABOWLTQMQTSC-HSZRJFAPSA-N 425.573 4.154 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](O)Cc3ccc(F)cc3)cc2Cl)C1 1681828580 UPBXWSXNKPEJOD-OXQOHEQNSA-N 433.955 4.118 10 10 IICE Cc1ccc(CC2CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)cc1 1681849709 FXSAUNHZTYLMRQ-UHFFFAOYSA-N 443.538 4.274 10 10 IICE CCc1ccc(C2CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)cc1 1683195998 WLGGDABXUJJDGA-UHFFFAOYSA-N 443.538 4.453 10 10 IICE CN(C)c1ccc(CN(C(=O)NCc2ccc(Br)cc2[N+](=O)[O-])C2CC2)cc1 1684884397 XXOLRUKXKZLPHK-UHFFFAOYSA-N 447.333 4.298 10 10 IICE C[C@H]1CCC[C@](Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1693632415 ZROBWIDVCZFLEI-FNZWTVRRSA-N 448.615 4.116 10 10 IICE CC[C@H](C)c1nnc(N2CCC(c3nc(C)no3)CC2)n1Cc1ccc(N(C)C)cc1C 1708449271 WXYGGGPECPDSKD-INIZCTEOSA-N 437.592 4.290 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCCC2)nnc1N1CCC(CCCO)CC1 1724237085 XAIOEGDXPZKNEI-UHFFFAOYSA-N 425.621 4.347 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCCC(F)(F)C1 1726354421 IEOIUMRWFYYGOE-FQEVSTJZSA-N 433.547 4.275 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H](C)C2)n1Cc1ccc(N(CC)CC)cc1 1727210737 JGMDBUSVNPOZRK-IBGZPJMESA-N 440.636 4.327 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@H](C)CC(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1749940020 QATPTGOPHSJLDS-UYAOXDASSA-N 443.636 4.297 10 10 IICE CC[C@H](C)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752767625 GKJAHJHKEAFAOU-OALUTQOASA-N 429.584 4.442 10 10 IICE CC(C)[C@@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O)c1cccnc1 1760872801 XQQPCJCVUIDSEO-OAQYLSRUSA-N 430.556 4.460 10 10 IICE CC(C)CS(=O)(=O)c1ccccc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1865734158 NBIRKRKIBHPCPJ-UHFFFAOYSA-N 447.512 4.144 10 10 IICE O=C1CCc2cc(S(=O)(=O)Nc3nc(-c4ccc(Cl)cc4)cs3)cc3c2N1CC3 1891488570 GCTKROAVTMGOAV-UHFFFAOYSA-N 445.953 4.100 10 10 IICE CC[C@H](O)CN(Cc1ccccc1)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 1915379557 AVCKKQFZTBPZSK-IBGZPJMESA-N 425.573 4.340 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)C1(CN)CCN(Cc2ccccc2)CC1 2074365721 XJYVQBUTQCVEBL-UHFFFAOYSA-N 438.616 4.141 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C(C)C)c(C=O)c1I 2079997836 IPKDDALGBXTIBS-AWEZNQCLSA-N 428.270 4.137 10 10 IICE C[C@@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1cc(F)ccc1O 2084724212 FLYHLBJUBYBZDW-NQIIRXRSSA-N 443.563 4.303 10 10 IICE Cc1cccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(O)cc4)c3C)C(=O)NC2=S)c1C 2293779450 JWBPFLYCFDWMPG-UHFFFAOYSA-N 445.544 4.248 10 10 IICE CC[C@H](C)Oc1ccc(C=C2C(=O)NC(=S)N(c3ccc(Cl)cc3)C2=O)cc1OC 2294216957 UGYAXVWQMBJZHI-ZDUSSCGKSA-N 444.940 4.357 10 10 IICE COc1ccc(Br)cc1C=C1SC(=S)N(CCCCCC(=O)O)C1=O 2314413899 LESZZOBFKGTLDT-UHFFFAOYSA-N 444.372 4.304 10 10 IICE COc1ccccc1N1CCN(N=Nc2ccc(I)cc2C)CC1 2330234384 GXQWBKGWAWDSEP-UHFFFAOYSA-N 436.297 4.429 10 10 IICE CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380768507 LDVLOHYERBMHDP-BLLLJJGKSA-N 443.382 4.361 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CC[C@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381136228 CDBNHENNGOXPKI-SWLSCSKDSA-N 441.366 4.115 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnc(N4CCCCC4)c4ccccc34)CC2)cc1 33073167 DVWQTMVJXNEJSZ-UHFFFAOYSA-N 430.552 4.196 10 10 IICE C[C@@H]1[C@@H](NCc2c(O)cccc2Br)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709436155 KVHYSLMUHGPSFP-UTJXIGIESA-N 425.367 4.421 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1 741897928 DQPGPQPNKXFBLT-DHIUTWEWSA-N 432.520 4.449 10 10 IICE CO[C@H](C)c1noc(CN(C)C(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1 747932713 GZXFVVUDYSASMC-CQSZACIVSA-N 447.333 4.219 10 10 IICE O=C(CCC(=O)c1ccc(F)c(F)c1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 755416420 PMSUUIGWTHIJHV-OAHLLOKOSA-N 438.421 4.314 10 10 IICE C[C@@H](NCc1cccnc1N(C)C)c1cc(Br)cc(Br)c1O 756409988 CMHOQUXRXMNQEH-SNVBAGLBSA-N 429.156 4.229 10 10 IICE O=C(/C=C\c1ccc2ccccc2n1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768534372 YHBSXUVOECUSNA-KAMYIIQDSA-N 426.564 4.096 10 10 IICE COc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc(Cl)c1O 785599048 ZTIVSGPHOYHSCV-CYBMUJFWSA-N 426.847 4.054 10 10 IICE CCN(CC)c1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1 792042121 ZJHUJLHVOSSPFS-UHFFFAOYSA-N 426.527 4.137 10 10 IICE C[C@H](NC[C@@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(Cl)c(Cl)cc1O 797022903 XWDXCYUJXTXHHX-RYUDHWBXSA-N 435.398 4.122 10 10 IICE Cc1cc(-c2nnc(N3CCC4(CCO4)CC3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802685819 PBFHPHYUVLWJMU-JOCHJYFZSA-N 447.583 4.291 10 10 IICE CC(C)(C)OC(=O)Nc1ccccc1CC(=O)NCc1cc(Br)ccc1O 804738178 FYWUZXLSRRJOKU-UHFFFAOYSA-N 435.318 4.361 10 10 IICE COc1ccc(C)cc1-c1csc(NS(=O)(=O)c2cccnc2C(F)(F)F)n1 808528046 VOTXMTWTZFQCOK-UHFFFAOYSA-N 429.445 4.342 10 10 IICE O=C(c1cc(Cl)c[nH]1)N1CCC(NCc2ccc(OCc3ccccc3)cc2O)CC1 809709511 OXOLJYMPDAIIAK-UHFFFAOYSA-N 439.943 4.347 10 10 IICE Cc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c(Cl)n1 919253641 RVROMTHJDGBPQP-UHFFFAOYSA-N 426.856 4.219 10 10 IICE Cc1nn(C)c(Sc2ccccc2)c1C(=O)NCc1ccc(N2CCSCC2)cc1 1136282146 ZVYYESVZNJFVNP-UHFFFAOYSA-N 438.622 4.363 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCNc2ccc(-c3ccccc3)nn2)c1 1137259635 XHTGSGYXTBQYKD-UHFFFAOYSA-N 439.519 4.206 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Cl)cc2NCC(F)(F)F)N(C)C)cc1 1158716956 JHGUKPSLCFXRHN-LJQANCHMSA-N 442.913 4.413 10 10 IICE COc1ccc(CCNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c(Cl)c1OC 1251379619 LGDVGTYDKJAVOD-UHFFFAOYSA-N 431.964 4.342 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCOC3)n2CCCOC(C)C)c(C)n1-c1ccccc1 1304188244 ABKUYNOMLNGVQN-JOCHJYFZSA-N 437.588 4.393 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)COCCO1 1306796145 OSBNRPFCZYWCRS-RUZDIDTESA-N 437.588 4.394 10 10 IICE C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)N(Cc1ccco1)Cc1ccccc1O 1313137153 KOAAKBOUQNYOAA-REWPJTCUSA-N 433.552 4.465 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCSC1)C(C)C 1313581878 JOEAWDSOVTXPPG-XMMPIXPASA-N 439.629 4.455 10 10 IICE CO[C@H](C(=O)Nc1nc(-c2cc(C)n(-c3ccc(F)cc3)c2C)cs1)[C@H]1CCOC1 1353908921 VNWWHYJMKSZXGS-YWZLYKJASA-N 429.517 4.347 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CC(=O)N2CCCCCC2)C(C)C)CCCC1 1436191745 UWGCPYUHOZXLLP-UHFFFAOYSA-N 439.600 4.168 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cn2c(-c3ccccc3)nc3ccccc32)N(C)C)cc1 1439962732 WVDOTKPSAVUKAQ-RUZDIDTESA-N 441.579 4.188 10 10 IICE COc1ccc([C@@H](CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)N2CCOCC2)cc1 1440722609 MKZJDMWRDBZTSU-AREMUKBSSA-N 447.579 4.214 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(Cc4ccccc4C)CCO3)c2C)c1 1454918265 FIMNLOQUOQLFCH-RUZDIDTESA-N 431.580 4.342 10 10 IICE C[C@H]1[C@@H](c2ccccc2)c2ccccc2CCN1CC(=O)NCc1ccc(N(C)C)cc1 1459786598 MHNYRIZIFMZDGK-KMRXNPHXSA-N 427.592 4.448 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccc(Cl)cn1 1466940613 ZGULBOQPEQTTLV-VAKHEIKFSA-N 449.960 4.343 10 10 IICE OC1CCN(c2ccc(CNc3ncnc4cc(F)c(Br)cc34)cc2)CC1 1472839519 DUSNWGATHBPPGL-UHFFFAOYSA-N 431.309 4.105 10 10 IICE COC[C@H](F)Cn1c(-c2cc3c(s2)CC[C@@H](C)C3)nnc1N(C)Cc1ccccc1O 1518748327 YPPCXUYRLFJVJX-CRAIPNDOSA-N 444.576 4.458 10 10 IICE Cc1noc(C)c1C(C)(C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1520853621 BMEIREDGXZOPLR-LFIBNONCSA-N 447.557 4.073 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C(C)(C)Cc3ccc(Cl)cc3)CC2)cc1 1523442987 MTJLEMGYHYZHJD-UHFFFAOYSA-N 444.019 4.246 10 10 IICE CCSCC[C@@H](C)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1523498321 LUJOOTJQJPESDD-CPZHOGDASA-N 440.631 4.407 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc4cc(OC)ccc4nc3Cl)C2)cc1 1526246451 MLRRCJXVSORXNV-OAHLLOKOSA-N 425.916 4.162 10 10 IICE CCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccccc1Cl 1529403997 MINVLNFWUKFMPE-QGZVFWFLSA-N 438.959 4.353 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(NC(=O)c4ccccc4)cc3)C2)cc1 1529404280 SHMROFWBOWNYGR-IBGZPJMESA-N 429.520 4.204 10 10 IICE CCOc1ccccc1OC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1530482315 ZQHMQFBUUDDJAL-QGOAFFKASA-N 431.510 4.421 10 10 IICE Cc1cc(C(=O)N2CCCc3c(OCC(N)=O)cccc32)c(C)n1-c1cccc(Cl)c1 1556694410 HARLOQRGQLBSQD-UHFFFAOYSA-N 437.927 4.205 10 10 IICE Cc1ccc(C(=O)N2[C@H](C)CN(C(=O)C(C)(C)C)C[C@H]2C)cc1-n1c(C)cc(C=O)c1C 1556755919 YHTUHNXJDPLVCP-RTBURBONSA-N 437.584 4.323 10 10 IICE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1ccc2cccnc2c1O 1557122003 OHLXSKOEJHEFQH-LJQANCHMSA-N 425.916 4.055 10 10 IICE C[C@H]1C[C@H](c2ccc(Br)cc2)CN1CC(=O)NCc1ccc(N(C)C)cc1 1560061675 PRGVVLGVGCQCAF-LPHOPBHVSA-N 430.390 4.009 10 10 IICE Cc1cc(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)c(C)n1-c1ccc(F)cc1 1567495897 UBVYWQAUNKQZKY-XMMPIXPASA-N 435.543 4.120 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)/C(F)=C/c3ccc(C(F)(F)F)cc3)cc2)CC1 1567591551 IPFKRZCDBMPBDD-STZFKDTASA-N 449.448 4.001 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C12C[C@H]3C[C@@H](CC(NC(=O)OC(C)(C)C)(C3)C1)C2 1568737997 WHVHQLOOJGWTHY-IMWZJCIKSA-N 449.588 4.358 10 10 IICE Cc1cc(CC(=O)N2CC(=O)Nc3cc(Br)ccc32)c(C)n1-c1ccccc1 1584070838 ICBIMXKPQXZKIG-UHFFFAOYSA-N 438.325 4.384 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCc1c(NC(=O)OC(C)(C)C)cnn1C 1596953599 OHCWOFHMCGSWGH-UHFFFAOYSA-N 443.592 4.203 10 10 IICE Cc1cc(NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)ccc1S(=O)(=O)N(C)C 1597811388 DJCDMUINZUIHTM-UHFFFAOYSA-N 429.517 4.044 10 10 IICE CCCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1Cc1ccccc1 1598364793 WJBFUWMLURAHNY-OAQYLSRUSA-N 432.568 4.149 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@@H](C)O1 1614218460 LLLOQXYRVHGWTP-CVEARBPZSA-N 433.603 4.489 10 10 IICE COc1cc2c(cc1OC)CCN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)CC2 1626641791 VHBXSRXPCZBXAV-UHFFFAOYSA-N 446.547 4.473 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC1C[C@@H]2CC[C@H](C1)S2 1627074473 FVSCYLXABVXQCS-SAGCSEQPSA-N 438.665 4.272 10 10 IICE CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NCc2cc(Cl)ccc2O)c1 1628666946 NFFRGRLIVCQKKK-UHFFFAOYSA-N 444.940 4.191 10 10 IICE O=C(Nc1ccccc1F)Nc1cccc2c1CCCN2C(=O)Cc1ccc(O)c(O)c1 1629164497 VLVXFFKZBVWXPI-UHFFFAOYSA-N 435.455 4.403 10 10 IICE COc1ccc(N2CCN(C(=O)CC[C@H](O)c3ccc(C(C)(C)C)cc3)CC2)cc1F 1630202309 SKMLFVKOTPYHHW-QFIPXVFZSA-N 428.548 4.294 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccccn3)C2)c(C)n1-c1ccccc1Br 1630822297 BYURQIVPYDBNGN-KRWDZBQOSA-N 439.357 4.260 10 10 IICE CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1633503948 SXWXIRNKISBDQP-DEOSSOPVSA-N 434.536 4.349 10 10 IICE Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1)C2=O 1637244163 VJLPFWXPABPOKG-OALUTQOASA-N 442.515 4.475 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCCO[C@H](CNC(=O)OC(C)(C)C)C3)c2C)c1 1638644658 UEDNORPVWONSKP-OAQYLSRUSA-N 441.572 4.158 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F 1643285383 YGSFERIWEDMMAK-UHFFFAOYSA-N 430.361 4.214 10 10 IICE COC(=O)c1ccc2cc(CCNC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)oc2c1 1653569175 BSMUZPLHSWVLSW-UHFFFAOYSA-N 444.487 4.412 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](c3ccccc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1653592777 IWYWFXHJIOSQEG-HHJKRLRDSA-N 441.591 4.433 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC[C@H](C)c2ccc(Br)cc2)cc1 1676410383 UXZDULYWSWYCOC-INIZCTEOSA-N 434.378 4.339 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCN([C@H](C)c2ccc(F)cc2)C1=O)c1ccc(N(C)C)cc1 1681780222 ZEVZEUXHZFSEJZ-GSHUGGBRSA-N 426.536 4.004 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccc4)C(=O)C3)cc2Cl)C1 1681828265 QZYXSTHZYGUGEW-GOSISDBHSA-N 440.975 4.135 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 1685011402 DYAUJCOQXQUCPO-LEWJYISDSA-N 433.474 4.240 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(C(C)C)n2Cc2ccc3c(c2)CCCN3C)C1(C)C 1696191335 PSPPSCRHKJPAOF-VXKWHMMOSA-N 425.621 4.472 10 10 IICE CCCCn1c(Cc2ccsc2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1709630288 PNDCDZONDJTCPQ-UHFFFAOYSA-N 429.565 4.205 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(Cl)s2)n1Cc1ccc(N(C)C)c(F)c1 1710646028 SLKZDPYGONXOIQ-UHFFFAOYSA-N 437.972 4.419 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@H]3CCO[C@@H]3C(C)C)CC2)cc1 1730181911 VEAJTAMWYHLINX-NZQKXSOJSA-N 441.620 4.188 10 10 IICE CCCn1c([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nnc1N(C)Cc1ccccc1O 1772878188 SURWNZVWMDHWES-GOSISDBHSA-N 429.565 4.145 10 10 IICE CCCC(=O)NCc1ccc(OC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1858891087 HCPRJXQBJMIGLR-UHFFFAOYSA-N 442.471 4.489 10 10 IICE CCN1C(=O)Cc2cc(-c3nc(NS(=O)(=O)c4ccc(C)cc4C)sc3C)ccc21 1859572389 DSZJWAAOGOJRTM-UHFFFAOYSA-N 441.578 4.445 10 10 IICE Cc1cc(Br)ccc1S(=O)(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1891659538 MPMVMOQVYHAGEI-LPHOPBHVSA-N 435.387 4.225 10 10 IICE COc1ccc(O)c(Cn2nc(C(C)(C)C)c(C3CC3)c2I)c1 2079806043 AWZRJXZRPRTULQ-UHFFFAOYSA-N 426.298 4.425 10 10 IICE Cc1cc(O)c([C@H](n2nc(C)c(CO)c2I)C(C)(C)C)cc1C 2079933746 IZZMLGACFCWDER-INIZCTEOSA-N 428.314 4.246 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2c(O)cccc2Br)CC12CC2 2115368291 PZRDKCVWBRQYFQ-AWEZNQCLSA-N 425.367 4.424 10 10 IICE COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)C1=Cc1ccc2c(c1)OCO2 2294034439 ZWHYQHXWFCPQKZ-UHFFFAOYSA-N 431.366 4.311 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccccc2O)SC1=S)Nc1ccc(O)cc1 2314831992 XFPYRYZWFJZRRG-UHFFFAOYSA-N 442.562 4.498 10 10 IICE CCC1=NN(Cc2cccc(F)c2)C(=O)C1=Cc1cc(Br)c(O)c(OC)c1 2332107649 QWPKGQZBQHFMBN-UHFFFAOYSA-N 433.277 4.494 10 10 IICE COc1cc(C=C2C(=O)N(Cc3ccc(C)cc3)N=C2C(F)(F)F)cc(OC)c1OC 2332114878 ASBSXLJPLLUMFV-UHFFFAOYSA-N 434.414 4.365 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)/C1=C/c1cc(C)n(-c2ccccc2F)c1C 1053690 IHHLMAHPYOQRDU-CVNFFVDQSA-N 438.499 4.085 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C/c1ccc(Br)cc1 6172083 DCPRCMVYYLHPTP-LDADJPATSA-N 428.282 4.335 10 10 IICE O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)cc1O)N2 13639984 QTLAHGOYFLVJGI-ZYLNGJIFSA-N 448.544 4.403 10 10 IICE COC(=O)c1ccc([C@@H]2Oc3ccccc3[C@@H]3CC(c4cc(OC)ccc4O)=NN32)cc1 20071293 JVZMRXCGKOAJSZ-URXFXBBRSA-N 430.460 4.430 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc3c(c2)OCO3)SC1=S)Nc1ccc(Cl)cc1 33319466 WITWWJZQBZACJC-LICLKQGHSA-N 446.937 4.299 10 10 IICE O=C1N=C(Nc2ccc3c(c2)OCO3)S/C1=C/c1ccc(-c2ccc3c(c2)COC3=O)o1 33339416 WUMORDLJVWRIFT-AWQFTUOYSA-N 446.440 4.428 10 10 IICE CN(C)c1ccc([C@@H]2Nc3ccc(Cl)cc3C(=O)N2NC(=O)Cc2ccccc2)cc1 39919612 WVWMZAMADHCGFA-HSZRJFAPSA-N 434.927 4.246 10 10 IICE CCCOC(=O)CCN1C(=O)/C(=C\c2ccc(OC(C)C)c(OCC)c2)SC1=S 206848580 AUEFQHIAVOZTKZ-QGOAFFKASA-N 437.583 4.417 10 10 IICE CNC(=O)c1ccc(Cl)c(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435551131 JOLISDGGGVBDEA-UHFFFAOYSA-N 438.959 4.060 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)c(OC)c3)cs2)c(C)c1 727242979 NLHDIXUGWWKDBT-UHFFFAOYSA-N 434.539 4.335 10 10 IICE CCOc1ccc(-c2csc(NS(=O)(=O)c3ccc(C(=O)OC)cc3C)n2)cc1 727248904 MMWOVOANKQKYOZ-UHFFFAOYSA-N 432.523 4.105 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@@H](c3ccc(Cl)cc3)C2)c1 732187218 PRKXLFUPGUWSMV-LJQANCHMSA-N 428.960 4.070 10 10 IICE COc1cc(N2CCN(C(=O)N[C@@H](CC(C)C)c3cccs3)CC2)cc(OC)c1OC 760094977 KLTCNKFLGULHFS-SFHVURJKSA-N 447.601 4.393 10 10 IICE Cc1cc(C[C@H](C)NC(=O)NCc2cc(Br)ccc2O)n(-c2ccccc2)n1 805224510 XEWJVBGENNSJEZ-AWEZNQCLSA-N 443.345 4.079 10 10 IICE CC(F)(F)c1ccc(CNC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 814463912 KHVFIDJLCBMEST-UHFFFAOYSA-N 442.554 4.330 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3ccc(C(C)(C)C)cc3)cc2F)CC1 1125908668 VUULFIXZLDSCBF-LJQANCHMSA-N 441.591 4.349 10 10 IICE CC[C@H](NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2)C(=O)NC 1129926296 ZWURRVQULXVJNB-KNIWAEIXSA-N 442.563 4.042 10 10 IICE CC1CCN(c2ccc(CNC(=O)C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C)cc2)CC1 1136705654 WITKHXAMKQSJTR-TZIWHRDSSA-N 429.605 4.432 10 10 IICE Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)NCc1cc(O)ccc1O 1176748471 SXPHPRKPLNOSQB-UHFFFAOYSA-N 434.876 4.443 10 10 IICE COc1ccccc1COC1CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251981456 MIPPMPMYYWEAEY-FQEVSTJZSA-N 439.600 4.391 10 10 IICE C[C@H](CC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)n1cc(Br)cn1 1265001673 FPDPLGIJVABQEB-CYBMUJFWSA-N 447.299 4.254 10 10 IICE C[C@@H](CSc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266259187 SUZLXEITIWJQGM-IBGZPJMESA-N 441.616 4.402 10 10 IICE CNS(=O)(=O)c1ccc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1 1289997534 RDWLEEUWBZBUCQ-UHFFFAOYSA-N 425.554 4.378 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CC[C@@H](OCC(C)C)C2)cc1 1295413573 AJYAULRCGJKZGH-JOCHJYFZSA-N 436.604 4.419 10 10 IICE CCO[C@]1(c2nnc(N(CC(C)C)C(C)C)n2Cc2ccc(N(C)C)cc2C)CCOC1 1296563575 VFJBWNOAFAJKBZ-RUZDIDTESA-N 443.636 4.224 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCOc1cc(Cl)ccc1Cl 1299699522 RZBHCILVPICNSS-UHFFFAOYSA-N 426.296 4.060 10 10 IICE CC(C)[C@@H]1C[C@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ccccc21 1312833804 OIFAXXWUEDXTPZ-UGKGYDQZSA-N 429.511 4.485 10 10 IICE COc1ccc(-c2nc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)n[nH]2)c(OC)c1 1357628693 FSNVUHWHUQZYBZ-UHFFFAOYSA-N 431.496 4.078 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(c2ccc(F)cc2F)CCCC1 1436624945 VIAJEQKGOVSNPI-UHFFFAOYSA-N 436.449 4.208 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1C[C@@]12CCCN(C(=O)OC(C)(C)C)C2 1436848304 MJAFNZLOWHBZMC-NXQMDHLFSA-N 429.605 4.145 10 10 IICE CC(C)COc1ccc(C(C)(C)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1439961248 QFHYBNFZOVTBHH-XMMPIXPASA-N 425.617 4.484 10 10 IICE C[C@@]1(C(=O)NCc2ccc(N3CCSCC3)cc2)CC(c2ccccc2Cl)=NO1 1441630635 KNCRUJLFXLETSW-QFIPXVFZSA-N 429.973 4.093 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2ccc(C(F)(F)F)cn2)C1 1456193442 DFZDIZSLCIADFE-UHFFFAOYSA-N 444.501 4.181 10 10 IICE COc1ccc(N(CC(=O)N[C@@H](C)Cc2c(F)cccc2F)Cc2ccco2)cc1F 1459671248 LMGUYIQYNRZDRU-HNNXBMFYSA-N 432.442 4.460 10 10 IICE Cc1cc(C)c2c(c1)N(CC(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)CCC2 1459723535 SWJPHGFINZEOSC-PMACEKPBSA-N 439.575 4.125 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@H]2C[C@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1465834354 KUXHROMCSQMXMI-YADHBBJMSA-N 442.943 4.234 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnn(-c2ccc(Cl)cc2)c1C 1466399133 YWJDXRONXKYILS-UHFFFAOYSA-N 448.306 4.009 10 10 IICE CC[C@H]1CN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1514178832 ZBLFXCLFSCRSRQ-IRLDBZIGSA-N 443.661 4.398 10 10 IICE COCCN(CC(C)C)c1nnc(-c2ccc(C)o2)n1Cc1ccc2c(c1)CCCN2C 1519130879 QLMWKRQPXMAHCW-UHFFFAOYSA-N 437.588 4.386 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\c3csc(C(F)(F)F)c3)CC2)c(OC)c1 1534283045 MNYRCKHYCXNOON-UTCJRWHESA-N 426.460 4.146 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)c2C)cc1 1543856573 CJKRCAMVRDWOCK-INIZCTEOSA-N 429.561 4.336 10 10 IICE CCC(C)(C)Cn1c(Cc2ccncc2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1545199455 ALPYWEWRHCASJE-UHFFFAOYSA-N 448.615 4.425 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@@H]2CC)n1Cc1ccc(N2CCOCC2)c(F)c1 1545410181 GDAZKRWOIWWVOC-UEXGIBASSA-N 429.584 4.440 10 10 IICE CC(C)CCC1CCN(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 1559601613 HZFOXGUIBRHOKA-BGYRXZFFSA-N 433.612 4.204 10 10 IICE Cc1cc(N(C)C)cc(C)c1CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1584357455 ZORSLDOAONIXCV-UHFFFAOYSA-N 431.527 4.299 10 10 IICE O=C(Cc1coc2c(F)c(F)ccc12)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595584081 LPHBEPHIYOVVJO-INIZCTEOSA-N 434.870 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2cscn2)cc1 1615382134 NIPASGDKMQTRLC-UHFFFAOYSA-N 447.612 4.251 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1615573646 GZSZIEXVWDBXSG-LJQANCHMSA-N 443.592 4.189 10 10 IICE Cc1ccc(C2=NO[C@@H](CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2)cc1C 1617523652 IVUIXGAJVBOYJQ-RUZDIDTESA-N 443.547 4.375 10 10 IICE C[C@@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)N1CCC(Cc2ccccc2)CC1 1623641597 WEOUNNBJFZKCJT-SQJMNOBHSA-N 436.596 4.243 10 10 IICE CCCOc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(OC)c1 1626107226 WAJDLVRJKSJGEY-QFIPXVFZSA-N 426.557 4.371 10 10 IICE Cc1cc(C(=O)N[C@@H](Cc2ccc(Cl)cc2)C(N)=O)c(C)n1-c1cccc(Cl)c1 1626982110 WNDKZVJQFWSAAC-FQEVSTJZSA-N 430.335 4.227 10 10 IICE COC(=O)[C@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(F)cc1 1640137451 OXMAYXJZTPSFCE-JOCHJYFZSA-N 436.483 4.041 10 10 IICE Cc1cc(C(=O)Cn2cnc(C(C)C)cc2=O)c(C)n1-c1cccc(Br)c1 1641041823 ZGBBFWYEMSRYCW-UHFFFAOYSA-N 428.330 4.420 10 10 IICE Cc1cc(C(=O)Cn2cnc3c(Br)cccc3c2=O)c(C)n1-c1ccccc1 1652610272 PXSDLCPJAUOQRI-UHFFFAOYSA-N 436.309 4.449 10 10 IICE CC(=O)N1CCN(c2ccc(NCc3ccc(OCc4ccccc4)cc3O)cc2)CC1 1652999817 CAHVXLCVUURWOE-UHFFFAOYSA-N 431.536 4.252 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3ccccc3OCCC(C)C)C2)cc1 1680077802 KGAXBCBMBLZMRZ-HXUWFJFHSA-N 425.573 4.446 10 10 IICE CCOCCCCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1710797353 XWKSYLTVDHYGKF-UHFFFAOYSA-N 427.593 4.088 10 10 IICE CO[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC[C@H]1C 1712065607 CQLLAPVVQRDAAH-WIYYLYMNSA-N 443.661 4.038 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCOC2)nnc1N(C)[C@@H](C)c1cccs1 1724235037 LWYMRRVAMVRVJZ-HKUYNNGSSA-N 425.602 4.464 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CC[C@H](N3CCCCC3)C2)cc1F 1729330002 LXZCCPCQTREAJQ-FQEVSTJZSA-N 442.627 4.185 10 10 IICE CC(C)[C@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1760950012 IIHZSDMBGJDPKR-JOCHJYFZSA-N 425.621 4.376 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccco2)cc1 1764937514 RORNTBNJSKEFKC-UHFFFAOYSA-N 430.556 4.388 10 10 IICE CCOCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1768064663 QSCBTBSGAXRPIE-JOCHJYFZSA-N 437.588 4.394 10 10 IICE O=C(Nc1c(Cl)cccc1C(=O)O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O 1859544688 JGLQOAWRCLKRGX-UHFFFAOYSA-N 448.862 4.129 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866140469 BUGGARRDWOFUKS-IBGZPJMESA-N 434.492 4.190 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@H](NCc1ccc(Br)cc1O)C2 1878876074 ZAPHLZQKQDAQHM-QSJFSLAZSA-N 429.330 4.123 10 10 IICE COc1cc(Br)c(C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1OC 1890504229 FGFABMBIHFNAJI-RDJZCZTQSA-N 445.357 4.385 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2c(O)cccc2Br)C12CCC2 2120838352 YWUGRTQKVZCPRE-CQSZACIVSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CCCCN2C(=O)OC(C)(C)C)c1O 2236057109 ZPBSCRGUMPBPHK-AWEZNQCLSA-N 443.382 4.433 10 10 IICE CCCN1C(=O)C(=Cc2c(Sc3ccccc3)nc3ccccn3c2=O)SC1=S 2296706749 NYCZPXGTMHCOHQ-UHFFFAOYSA-N 439.587 4.457 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2296755630 UMCJCWDCMOSYKD-UHFFFAOYSA-N 447.925 4.478 10 10 IICE CC1=CC2=NC(=O)C(=Cc3cc(C)n(-c4ccc(Br)cc4)c3C)C(=N)N2O1 2297347751 YXXODBNEOKIGTH-UHFFFAOYSA-N 425.286 4.307 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(=O)[nH]c5ccc(C)cc5c4s3)CC2)cc1 9857704 WFIIKUSLEFQUEB-UHFFFAOYSA-N 433.533 4.022 10 10 IICE CCOC(=O)COc1ccc(/C=C2/SC(=S)N(CCCc3ccccc3)C2=O)cc1 33448426 NDMNMXYBVZSWGE-HMMYKYKNSA-N 441.574 4.463 10 10 IICE CCN1CCC2(CC1)N=C(c1ccc3c(c1)OCO3)C[C@H](c1cc(Cl)ccc1O)N2 65298037 VHRZBYICHQVXJH-LJQANCHMSA-N 427.932 4.110 10 10 IICE biogenic COC(=O)c1ccccc1N1C(=O)C(O)=C(c2ccc(C)cc2)[C@H]1c1ccc(O)c(O)c1 526481585 IFNQSYSLDVUJNT-JOCHJYFZSA-N 431.444 4.250 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCO[C@@H](c2ccsc2)C1 758740565 NAAFYVQBIWNYHW-LJQANCHMSA-N 437.512 4.101 10 10 IICE CC[C@H](c1ccccc1)N1CC(=O)N(Cc2ccc(N3CCN(CC4CC4)CC3)cc2)C1=O 761929552 KROAOHJBTZLORF-RUZDIDTESA-N 446.595 4.134 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H]1C[C@@H]1C 764894387 GSTAFOUYAVQTRM-QFBILLFUSA-N 439.556 4.027 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(-n3cncn3)c(Cl)c2)C1 766548114 NGYXGKJEIFYLHJ-UHFFFAOYSA-N 448.958 4.281 10 10 IICE CC[C@@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1cc(Br)ccc1O 775497144 NDURYDJVAKYJLB-YVEFUNNKSA-N 427.364 4.328 10 10 IICE O=C(NCc1ccc(O)c(O)c1)c1cccnc1Oc1ccc(F)cc1Br 778926816 YFMGQABKROJKQC-UHFFFAOYSA-N 433.233 4.117 10 10 IICE Cc1cc(Br)c(O)c(CN[C@@H](C)C(=O)Nc2cccc(N3CCCC3)c2)c1 781632503 YDVVXJFZYYXQJC-HNNXBMFYSA-N 432.362 4.180 10 10 IICE Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cccc(OCC(F)(F)F)c2)cc1 784109710 YZJZPWFRRBELOM-UHFFFAOYSA-N 435.446 4.372 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)/C=C(\C)c3ccccc3C(F)(F)F)cc2)CC1 786258928 INZQKVPJZQDOFJ-BMRADRMJSA-N 445.485 4.094 10 10 IICE CN1CCCc2cc(CNC(=O)CCC(=O)Nc3nnc(C4CCCCC4)s3)ccc21 787269309 WPVDDPZUNBHBIQ-UHFFFAOYSA-N 441.601 4.003 10 10 IICE Cc1cc(Br)c(O)c(CN[C@@](C)(CO)c2ccc(Br)cc2)c1 796471417 QCUQLHFVZQMJPE-KRWDZBQOSA-N 429.152 4.223 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCOC2)CC[C@@H]1C 802761101 KDTYFKKMUQJEKV-SNYIIPAISA-N 449.599 4.250 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCCN2Cc2ccc(N3CCOCC3)c(F)c2)C1 816658271 JDVVTLMEUSGCGH-IFMALSPDSA-N 447.595 4.274 10 10 IICE C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 919895900 YXPXFTIOOLAMAH-MHECFPHRSA-N 432.568 4.065 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(OCC(F)(F)F)c3)cc2F)C[C@@H](C)O1 1125188237 OGKULHIKMHNGOS-GASCZTMLSA-N 440.437 4.310 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccnc(Oc4ccc(F)cc4F)c3)C2)cc1 1130827152 URWCNNHNOUAKBR-KRWDZBQOSA-N 425.435 4.169 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CSCc2cccs2)NC(=O)OC(C)(C)C)cc1 1136903852 NMSISBCPAWCVCS-IBGZPJMESA-N 449.642 4.430 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1ccc(Oc2ccccc2F)nc1 1136960607 APZIBAXIQBKRSP-UHFFFAOYSA-N 435.499 4.152 10 10 IICE CO[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1227208220 LVTGVANCURWKDO-AUUYWEPGSA-N 433.902 4.439 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@]3(C)Cc3ccc(F)c(F)c3)C2)cc1 1230858189 IWMSIZOJSQUBIJ-MHECFPHRSA-N 429.511 4.359 10 10 IICE CCOC(=O)N1CCC([C@@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1235345319 ZMNZHRONBCQJRO-LJQANCHMSA-N 440.588 4.459 10 10 IICE Cc1ccc(NC(=O)CS[C@@H](C)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1 1276284145 QCPWHSDIXTWOKY-MOPGFXCFSA-N 427.614 4.177 10 10 IICE CC(C)NC(=O)c1nnc(N2CC=C(C(C)(C)C)CC2)n1CCCSc1nccs1 1288080680 VOQZRJRBGFEWSQ-UHFFFAOYSA-N 448.662 4.238 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2nnn(-c3ccc(F)c(Cl)c3)c2C)cc1 1290324796 ZZVPASXZNWAXMN-UHFFFAOYSA-N 429.927 4.487 10 10 IICE O=C(Nc1cccc(S(=O)(=O)c2ccccc2)c1)c1cc2cc(O)c(O)cc2s1 1301396411 YFAJVXDROSLDJZ-UHFFFAOYSA-N 425.487 4.398 10 10 IICE COc1cc(NC(=O)Cc2cccs2)c(C(=O)N[C@@H](C)c2ccccc2O)cc1OC 1302532891 SZNZDJZRBQFILB-AWEZNQCLSA-N 440.521 4.143 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1306529801 UQCKVJBRUDDNDF-XMMPIXPASA-N 437.588 4.129 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1313679458 KFEDZOJCSPFMJR-HSZRJFAPSA-N 448.615 4.404 10 10 IICE CCOCC(C)(C)Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1314280098 CPHZPSLZSOWCAK-UHFFFAOYSA-N 429.609 4.190 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C(C)(C)S(=O)(=O)c1ccc(Cl)cc1 1351162675 IPDRUOXGBCBINI-UHFFFAOYSA-N 434.989 4.151 10 10 IICE CN(C)[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1c(F)cccc1Cl 1354113257 BOHVSKFOKVGXDE-OAQYLSRUSA-N 436.870 4.496 10 10 IICE Cc1cc(CN(C)c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)no1 1361060126 KFTPPEPHXWBANV-MRXNPFEDSA-N 434.591 4.091 10 10 IICE COc1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC(C)C)c1 1435331274 CUHQQPANGZEHIH-INIZCTEOSA-N 434.483 4.483 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C(=O)c3cc4cc(O)c(O)cc4s3)C[C@@H]21 1446660216 SNEQBICBCIULJQ-VHDGCEQUSA-N 432.542 4.078 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H](C)Oc3ccc(C)cc3Br)C2)cc1 1461077955 QZSXTVJMVBKMEL-IRXDYDNUSA-N 447.373 4.176 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccco2)N(C)C)c(C)n1-c1ccccc1Br 1463649590 IPQAPPUJPAOINN-IBGZPJMESA-N 430.346 4.482 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1[C@@H](CNC(=O)OC(C)(C)C)C1(F)F 1463786794 VXHVDEMZNIKISX-RTBURBONSA-N 437.531 4.041 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCOC3(CCSCC3)C2)cc1 1466193713 YGWIRSZEIUXMRU-OAQYLSRUSA-N 426.582 4.010 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c(C)n1-c1cccc(Cl)c1 1470498235 OKUZMUNJGOATQX-XIKOKIGWSA-N 441.881 4.277 10 10 IICE CCN(Cc1nc2c(s1)C[C@@H](C)CC2)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1471546484 CENPLUVERVVQBZ-UWJYYQICSA-N 443.661 4.168 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@](CC)(CO)C2)sc(C)c1-c1ccccc1 1473409636 GQNQNHKFUKNWBN-DEOSSOPVSA-N 444.597 4.323 10 10 IICE Cc1cc(CN2CCNC(=O)[C@H]2c2ccc(Br)cc2)ccc1N1CCCCC1 1473419951 WIFZUJJNWNLVAQ-JOCHJYFZSA-N 442.401 4.421 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)C1 1503135877 BBNWVPLDMHKJDY-LJQANCHMSA-N 441.551 4.353 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC3(C(=O)OCc4ccccc4)CCC3)ccc21 1527913696 XGTNKTSRQPXIPC-UHFFFAOYSA-N 434.536 4.300 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1532655549 MKFDKKAGNIIHKP-BTYIYWSLSA-N 448.350 4.004 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c(F)c3)C2)c(C)n1-c1ccccc1 1534247852 WADRMGKTTPDNDJ-LJQANCHMSA-N 437.490 4.084 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C\c1cncc(C)c1)CCC2 1537024014 IJRPPBIYQORPLG-HJWRWDBZSA-N 432.476 4.341 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@H]1C[C@H](F)C1 1541427280 HDUYMZQALNKMJM-MEMLXQNLSA-N 429.584 4.088 10 10 IICE CCS(=O)(=O)c1ccc(CCC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1544078875 DBZCYJKKISPVTP-UHFFFAOYSA-N 438.593 4.445 10 10 IICE CN(C)c1ccc(Cn2c(N3CCN(C4CCCCC4)CC3)nnc2C(C)(C)C)cc1F 1552837162 KRRUPANSPASQNN-UHFFFAOYSA-N 442.627 4.284 10 10 IICE CCc1nn(C)c(CC)c1CNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1564385645 YXQOKSHYSLOSHN-MRXNPFEDSA-N 432.012 4.434 10 10 IICE Cc1ccc(C(=O)Nc2cccn(CC(F)(F)F)c2=O)cc1-n1c(C)cc(C=O)c1C 1566407863 GCJUWZRZDVKJTO-UHFFFAOYSA-N 431.414 4.191 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1ccc(Br)cc1=O 1566850066 VSHUAZSNSJUTDP-MRXNPFEDSA-N 441.325 4.106 10 10 IICE Cc1sc2ncnc(N3CCC(C(=O)NCc4cc(Cl)ccc4O)CC3)c2c1C 1583818305 ZCVZWBQVUQSVLU-UHFFFAOYSA-N 430.961 4.200 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](C)COc2ccccc2OC)CCCC1 1596597676 PRHRSISTFKLXIF-SFHVURJKSA-N 436.552 4.369 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1-n1c(C)cc(C=O)c1C 1611468812 GGSJOIYSRLGVKY-KRWDZBQOSA-N 429.520 4.225 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)N(CCN2CCCC2)c2ccccc2)C1 1618187623 OYGHALNYVYQAQE-DZFTYQQFSA-N 427.589 4.319 10 10 IICE Nc1c(Br)cc(Cl)cc1C(=O)NCc1cccc(Br)c1O 1623364888 UZCVQAMSSIXRQY-UHFFFAOYSA-N 434.515 4.083 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(S(C)(=O)=O)c(Cl)cc1Cl 1631265611 JFBYQNKCNYXMGF-UHFFFAOYSA-N 429.369 4.125 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](c1ccncc1)C1CCCC1 1631425347 CMFDMABYBOSMJU-GGAORHGYSA-N 427.976 4.495 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2[nH]c3ccccc3c2Br)N(C)C)cc1 1637004839 SOGDIFRDXLZVAF-SFHVURJKSA-N 429.362 4.029 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NCC(=O)N1CCCCc2ccccc21 1638758002 DUEZAJIRKCQFCK-UHFFFAOYSA-N 434.584 4.188 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@@H](C)c2ccc(Cl)c(Cl)c2)ccc1N(C)C 1644178552 DQVNABBRAQDOCZ-LBPRGKRZSA-N 425.312 4.102 10 10 IICE COc1cc(N2CCC3(CCN(Cc4ccccc4)CC3)CC2)c([N+](=O)[O-])cc1OC 1651347478 AWSSKJUMBLERHV-UHFFFAOYSA-N 425.529 4.495 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCC2(c3ccc(Br)cc3)CC2)cc1 1685023224 IWQDZVGGJCURHI-UHFFFAOYSA-N 446.389 4.267 10 10 IICE CO[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC1(C)C 1697687803 YFXHJVGZTOAGDS-OAQYLSRUSA-N 425.621 4.159 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCC(C)(C)C 1723562026 YLMNDMRKYWSDPM-UHFFFAOYSA-N 440.636 4.479 10 10 IICE CC[C@H](C)c1nnc(N(C)OC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726891536 HNZKIJRRIAZXNE-IBGZPJMESA-N 441.620 4.359 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1(OC)CCC1 1730716219 VISNGPIEOZIMIR-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CC(C)c1nnc(N2CC[C@H](CN3CCCCC3)C2)n1CCCSc1nccs1 1741351580 TZHIJTOGHAFOOW-GOSISDBHSA-N 434.679 4.353 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCCC[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1762447624 HWJGPCDPWGFBNK-QGZVFWFLSA-N 439.583 4.020 10 10 IICE CCc1nnc(N2CCC(C(=O)c3cccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1764780253 CSTGUECNMREHJU-UHFFFAOYSA-N 441.576 4.255 10 10 IICE CC[C@H]1CCCN1c1nnc([C@H]2OCC[C@H]2COC)n1CCCSc1nccs1 1765154976 PZOXBZCBXJCLJL-ULQDDVLXSA-N 437.635 4.020 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3ccccc3O)C2=O)cc(Br)c1O 1860086403 FKHWMFXKLIBENK-RIYZIHGNSA-N 438.324 4.275 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)[C@H]2CCCN2c2ccc(Cl)cc2)c2nccn2C)cc1 1866145325 KNQAFPBYEQJGRL-FGZHOGPDSA-N 437.975 4.014 10 10 IICE O=C(O)C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951321657 AZLMYDKWDCRTMV-MRXNPFEDSA-N 433.460 4.022 10 10 IICE CCc1c(C2CC2)nn(Cc2c(O)cccc2Br)c1I 2079829794 PBJUPLKINNEKFF-UHFFFAOYSA-N 447.114 4.444 10 10 IICE Cn1ncc(CNC(=O)OC(C)(C)C)c1NCc1cc(Cl)cc(Br)c1O 2126516511 XFPBMSQPYBVJDL-UHFFFAOYSA-N 445.745 4.178 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCC(C)(C)N(C(=O)OC(C)(C)C)C2)c1O 2236055055 NTCLJYUTNFWWTR-ZDUSSCGKSA-N 443.382 4.431 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3CCCOc3ccccc3)C2=O)cc1 2296932624 DKLMNHSRMHENHB-UHFFFAOYSA-N 443.503 4.186 10 10 IICE O=C(Oc1ccc(C=C2SC(=S)N(C[C@H]3CCCO3)C2=O)cc1)c1cccs1 2297497545 PPJKERXDELZNHS-OAHLLOKOSA-N 431.560 4.348 10 10 IICE CCCNc1nc2ccc(C)cn2c(=O)c1C=C1SC(=S)N(C2CCCCC2)C1=O 2314413609 CANDMXSPABOMLM-UHFFFAOYSA-N 442.610 4.359 10 10 IICE CCCCCN1C(=O)C(=C2SC(=S)N(CCCCCC(=O)O)C2=O)c2ccccc21 2314753735 CXMXKOYYRREUPE-UHFFFAOYSA-N 446.594 4.440 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3cccc(O)c3)SC2=S)cc1 2314836362 DPKQKPVESCFNCU-ZDUSSCGKSA-N 428.535 4.019 10 10 IICE CC[C@@H](CO)N1C(=O)C(=Cc2ccc(OCc3ccccc3)c(OC)c2)SC1=S 2323807811 CQOGKOMEWLHNSJ-KRWDZBQOSA-N 429.563 4.246 10 10 IICE COc1ccccc1/C=C1/SC(=S)N(NC(=O)c2ccc(Br)cc2)C1=O 33796880 BXVXBAPGHUXZKT-XNTDXEJSSA-N 449.351 4.004 10 10 IICE CCC(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2)[C@H]1c1ccc(N(CC)CC)cc1 59074309 ZGSFBMBCMXTFMP-DEOSSOPVSA-N 443.613 4.173 10 10 IICE CCn1ncc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1C(F)(F)F 466514414 LSHBWIYBVZNVOU-UHFFFAOYSA-N 433.478 4.282 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cc(F)ccc3F)[C@H]2c2ccc(O)c(O)c2)cc1 526555702 HGEXYXCPEOTXGX-NRFANRHFSA-N 425.387 4.442 10 10 IICE COc1ccc(C)cc1S(=O)(=O)N(c1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 586248452 WNKCGPRWPKAHGJ-UHFFFAOYSA-N 449.528 4.383 10 10 IICE CN(CCCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)C(=O)OC(C)(C)C 726566182 SHVRVRWZOHKZJT-UHFFFAOYSA-N 441.519 4.020 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N3CCCCC3)CC2)c(C)n1-c1ccc(F)cc1 727237167 GLTRBAOYIZBIRR-UHFFFAOYSA-N 425.548 4.140 10 10 IICE Cc1ccccc1C(=O)NC1CCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)CC1 728196156 RCZKPONIPCRMMO-UHFFFAOYSA-N 444.531 4.032 10 10 IICE O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1ccc(OCC(F)F)c2ccccc12 742028131 SHPANAZPPRTICR-UHFFFAOYSA-N 448.491 4.121 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Nc1cc(C(=O)OC)c2cc[nH]c2c1 808873959 YKVVXRIYWNCBKI-UHFFFAOYSA-N 446.301 4.477 10 10 IICE CCN1C(=O)C(=C/C=C\C2=C3N(CCC2)c2ccccc2C3(C)C)C(=O)N(CC)C1=S 1082889305 CVFYDBZPVYXUDQ-LUAWRHEFSA-N 435.593 4.310 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccccc1OCc1cccc(F)c1 1083985343 UMRUNQXXCWYTCO-MOSHPQCFSA-N 434.398 4.210 10 10 IICE Cc1ccccc1-n1ncc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1C(F)F 1125518482 HAASQPANEVDKPM-KRWDZBQOSA-N 440.494 4.446 10 10 IICE O=C(C[C@H]1CSc2ccccc2O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1125878421 SELWBVZZYTUBMN-SFHVURJKSA-N 434.508 4.316 10 10 IICE C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126658585 TVLNYZOPZIBNCN-LPHOPBHVSA-N 430.495 4.329 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C(F)(F)F)ccc3Br)CC2)cc1 1127188657 BSZXMWQYJQRCMN-UHFFFAOYSA-N 443.263 4.439 10 10 IICE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1134881689 DOESURHSZYEFSU-OFVILXPXSA-N 448.652 4.049 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1c2ccccc2C[C@H]1C 1136743196 LELVSZKTQSREBR-CTUHWIOQSA-N 433.596 4.461 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)n[nH]2)c1 1157369373 YRXMNLPUYBMBRI-UHFFFAOYSA-N 447.926 4.318 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)CCCNC(=O)OC(C)(C)C)cc1 1159428127 TWUKTOXFNVWYMP-QGZVFWFLSA-N 441.572 4.259 10 10 IICE Cc1cc(C(=O)N2[C@@H](C)[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccn1 1162925907 LEMPEQLNYRUVSW-KURKYZTESA-N 426.561 4.348 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)N[C@@H](C)c3ccccc3O)cc2)cc1 1171723107 MHCNYPDTJIVURK-INIZCTEOSA-N 440.521 4.083 10 10 IICE Cc1ccc(N(Cc2cnn(C)c2)C(=O)/C=C\[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1177596124 LBRBESTXWBBZII-IMTHGLKYSA-N 438.572 4.465 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC[C@H](NC(=O)C(F)(F)F)[C@@H]2C)c1 1183849356 IICRUQRFPQNHDZ-KSSFIOAISA-N 441.881 4.419 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(NC(C)=O)nc1 1295094279 ZUJQSVPKEFIHNO-UHFFFAOYSA-N 443.555 4.210 10 10 IICE CCN(CCC1CCN(c2nnc(C)n2Cc2ccc(N(C)C)cc2C)CC1)CC1CC1 1295805969 DJRVVLXXBMCQEK-UHFFFAOYSA-N 438.664 4.348 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@@H](O)c1cccnc1 1302356308 JCOQFKZKAPUSOM-RPWUZVMVSA-N 449.551 4.008 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3ccc(OC(F)F)cc3)cc2F)C[C@H](C)O1 1355129985 KHDXWJPUFBQYIZ-HZVDNRATSA-N 448.485 4.461 10 10 IICE Cc1cc(-c2nnc(N(C)CCOC(C)(C)C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1361048426 CHSLDWSFZLFJPF-UHFFFAOYSA-N 439.604 4.375 10 10 IICE CN(C)[C@@H](C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(Cl)cc1 1435066259 UGZMGDBUJOSAPD-HXUWFJFHSA-N 437.918 4.329 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)s2)cc1 1436624536 PUFHMYWWLRHTSU-UHFFFAOYSA-N 443.519 4.472 10 10 IICE CC(C)(C)OC(=O)N1CCCCC[C@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1441627302 BCKCQAUDSJPSMI-FQEVSTJZSA-N 433.618 4.036 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 1446563229 DOODXRQKFKGTAA-XMMPIXPASA-N 432.520 4.434 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Br)c(Cl)c1 1446817955 UCWAOTQLEBKYPW-UHFFFAOYSA-N 447.112 4.277 10 10 IICE CN(C)c1ccc([C@@H](CNc2ccc([N+](=O)[O-])c(OCc3ccccc3)n2)N(C)C)cc1 1458678190 BKBOJLRUUXOAAB-JOCHJYFZSA-N 435.528 4.350 10 10 IICE COc1ccc(N2CCN(CCNC(=O)/C=C(/C)c3ccccc3C(F)(F)F)CC2)cc1 1464537333 FDIOYIQJWGCBLC-ZCXUNETKSA-N 447.501 4.056 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1 1469104247 OPULWNUXCUYDLU-ICSRJNTNSA-N 440.563 4.191 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H]3CC3CCCCC3)cc2F)C[C@@H](C)O1 1473131583 GTHZHVGIQPZHJI-TXTKFYIRSA-N 445.623 4.490 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1496089849 XNEFNALWBHKYQC-HXUWFJFHSA-N 448.615 4.406 10 10 IICE COc1ccc(N2CCCN(C(=O)CSc3cccc(Br)c3)CC2)cc1 1517318479 ZMRGKQJYIOUYBB-UHFFFAOYSA-N 435.387 4.289 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(-n4ccnn4)ccc3F)cc2Cl)C1 1524702570 CCBWHQCFQLEMCC-HNNXBMFYSA-N 427.911 4.226 10 10 IICE CCOC(=O)COc1cccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1525158888 AWKVOLOEWQBJRK-UHFFFAOYSA-N 436.508 4.109 10 10 IICE C[C@H](CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cc1F 1526015352 NBLHYYANOSWTOE-GOSISDBHSA-N 427.539 4.307 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3coc(-c4c(F)cccc4F)n3)cc2F)C[C@@H](C)O1 1527481947 SKOAZSTZSXLDMI-OKILXGFUSA-N 445.441 4.303 10 10 IICE C[C@H](NC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(N(C)C)cc1 1537679636 LXCVKXOJZRUXEQ-KPFBPEDLSA-N 434.367 4.456 10 10 IICE COc1ccc(N2CCN(C(=O)CCc3ccc(C)cc3Br)CC2)c(OC)c1 1543633342 ZIKTVOMUPZSGOL-UHFFFAOYSA-N 447.373 4.056 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCOc2ccc(F)c(Cl)c2)C1 1543795902 WTOPRNHFBZNKGM-UHFFFAOYSA-N 443.950 4.396 10 10 IICE O=C(CCSc1ccccc1F)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1544721725 VCYHWBVVTPXCCJ-UHFFFAOYSA-N 427.589 4.156 10 10 IICE CCOCc1nnc(N2CCC[C@H](OC(C)(C)C)C2)n1Cc1ccc(N(CC)CC)cc1 1548150062 AROWZAHKEOXVRL-QFIPXVFZSA-N 443.636 4.493 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@@H](N(C)C)C23CCC3)c(C)n1-c1cccc(Br)c1 1557693390 GVXULLDCWXIWRP-VQTJNVASSA-N 430.390 4.459 10 10 IICE CC(C)CCOC1CCN([C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC1 1559513585 VPOPHEJJGJXMGA-GOSISDBHSA-N 448.563 4.316 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)C(C)(C)C 1566686229 KNYKIXOAJJUUQQ-ICSRJNTNSA-N 434.577 4.229 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCCCn1cc(Br)cn1 1568629009 LDVFDVNKFDUCMX-UHFFFAOYSA-N 443.345 4.076 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2[C@H](C)CC[C@@H]2C(=O)OC(C)(C)C)C1 1585587708 HGUHJMCVUPPWLY-WZONZLPQSA-N 439.600 4.129 10 10 IICE C[C@@]1(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1(Cl)Cl 1587670838 AWVSQSFSBDDBEF-RCLKMUNOSA-N 449.450 4.430 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCC[C@H]2c2cnn(C)c2)cc1 1615380445 AHQIWVGLIZYJFY-QHCPKHFHSA-N 435.620 4.446 10 10 IICE Cc1nc(-c2ccco2)cc([C@@H]2CN3CC[C@H]2C[C@H]3CNCc2ccc(N(C)C)cc2)n1 1616154080 MLYXHGNGICMIJC-ACIOBRDBSA-N 431.584 4.079 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccc(F)cc3)c2-n2cccc2)cc1 1616534394 OJACCUCYMQONOI-UHFFFAOYSA-N 447.514 4.019 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1CCNc1ncc(Cl)cc1Cl 1617941091 OBVGWAMEDPUKKT-UHFFFAOYSA-N 447.370 4.387 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)COc1ccc(Cl)c(F)c1 1618427434 OTINPCXCRKLADD-UHFFFAOYSA-N 436.911 4.247 10 10 IICE COCCN(Cc1c(C)nn(C)c1C)C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1629329278 NBTBDJRTCDFZIF-UHFFFAOYSA-N 428.964 4.387 10 10 IICE O=C([C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N(Cc1ccccc1O)C[C@H]1CCCO1 1631219171 OOCHJTWGKBWZOU-IIBYNOLFSA-N 449.334 4.400 10 10 IICE C[C@H](NC(=O)N[C@H]1C[C@H]2CC[C@@H]([C@H]1C)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1634434689 FIZLWBQCRCLZAV-BQEVRZRTSA-N 430.593 4.289 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3OC[C@H]2F)c(C)n1-c1ccc(Br)cn1 1638067476 WAERJSMBVVCTOQ-XLIONFOSSA-N 444.304 4.453 10 10 IICE Cc1cc(C(=O)CSCCN2CCOCC2)c(C)n1-c1cccc(C(F)(F)F)c1 1643615428 KBLSCAKDCIPEME-UHFFFAOYSA-N 426.504 4.361 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCc2ccccc2N1Cc1ccc(N2CCOCC2)cc1 1643784834 UYATVJRURCBMPS-QHCPKHFHSA-N 437.584 4.369 10 10 IICE CC(C)c1ccc([C@H]2CCCN2CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1 1645165997 FUQYOVKZGTUTEO-XMMPIXPASA-N 439.575 4.239 10 10 IICE COc1ccccc1-c1csc(C2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)n1 1651000646 DRIRLNANVAPALI-UHFFFAOYSA-N 428.485 4.389 10 10 IICE CC(C)c1ccc(CN(C(=O)CN[C@H](C)c2ccc(N3CCOCC3)cc2)C2CC2)cc1 1653993750 KRAQZNRGTYGJMP-OAQYLSRUSA-N 435.612 4.488 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3cc(F)cc([N+](=O)[O-])c3)c2C)cc1 1656398333 JGUMUQOFYHOAHV-UHFFFAOYSA-N 426.400 4.190 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1c(F)cccc1F 1657153940 AATFPBFKWLATGO-UHFFFAOYSA-N 434.442 4.201 10 10 IICE O=C(NCC(F)(F)c1cc(F)cc(F)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1675672143 AUILDWGJJKOPAS-SFHVURJKSA-N 426.410 4.153 10 10 IICE Cc1nc(CC2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)CC2)no1 1681827442 HCDJXNSYCJJURT-MRXNPFEDSA-N 445.995 4.432 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccccc3)C[C@@H](O)c3ccco3)C2)cc1 1683503912 FNFDAIVPGCLGOS-XUZZJYLKSA-N 449.551 4.060 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)CC(C)(C)CNC(=O)OC(C)(C)C 1686826447 IKKODUGRAZOXNK-GOSISDBHSA-N 434.625 4.184 10 10 IICE CC[C@@]1(C)CC[C@H](Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)O1 1694426698 IUHVOLJDTDLCHU-RDGATRHJSA-N 441.620 4.475 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1696404358 WFRKNEMTPHDEAI-UHFFFAOYSA-N 425.602 4.332 10 10 IICE CC(C)CN(c1nnc(-c2cnn(C)c2)n1Cc1ccc(N(C)C)c(F)c1)C1CCCC1 1706491154 CPTBSKYCSKJYJA-UHFFFAOYSA-N 439.583 4.337 10 10 IICE Cc1cnc([C@H](C)Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)s1 1707712833 DBAHWCLCPYOWGW-MRXNPFEDSA-N 434.569 4.175 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](OC)C1 1726798683 FMHVFKQDHLIKNH-SQJMNOBHSA-N 437.588 4.129 10 10 IICE CCN(CC)c1ccc(Cn2c(N(C)Cc3ncc(Cl)n3C)nnc2C(C)(C)C)cc1 1728382501 AMDQNQUIKYIJGZ-UHFFFAOYSA-N 444.027 4.493 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCCC[C@H](COC)C2)cc1 1746089289 KLAMYAVNHQQBLH-QFIPXVFZSA-N 448.615 4.488 10 10 IICE Cc1cc(-c2nnc(N(C)CCNC(=O)C(C)C)n2[C@H]2C[C@H]2C)c(C)n1-c1ccccc1 1751408818 OISKPMSRVUPFMU-VGSWGCGISA-N 434.588 4.142 10 10 IICE C[C@@H]1SCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)[C@H]1C 1752455989 KIPYNIXFNMIIQL-JYJNAYRXSA-N 439.676 4.489 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](NC(C)=O)C1 1763605770 LOFZIFIMDPANEP-RWKBYAJOSA-N 446.599 4.424 10 10 IICE O=C1/C(=C\c2ccc(F)c(Br)c2)SC(=S)N1CCCn1ccnc1 1858590876 MRSNACCIMSGGPE-NTEUORMPSA-N 426.336 4.076 10 10 IICE CCCOc1cccc(/C=C2/SC(=S)N(C3CCN(C(=O)OCC)CC3)C2=O)c1 1858591765 ZOMXHVSRRNPOTC-NBVRZTHBSA-N 434.583 4.298 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3ccccc3Cl)N=C2C(F)(F)F)cc(OC)c1O 1865680141 ZNANPGOCBHUTKW-QPEQYQDCSA-N 440.805 4.407 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(Br)c2O)N2CCCCC2)cc1 1866247356 UWKXNJKNSQZNRI-HXUWFJFHSA-N 446.389 4.178 10 10 IICE COC(=O)c1c(NC(=O)c2c[nH]c3c(O)cccc3c2=O)sc(C)c1-c1ccccc1 1866411867 KRGDSVIYVOIVED-UHFFFAOYSA-N 434.473 4.310 10 10 IICE CC[C@H](NC[C@]1(N(C)Cc2ccccc2)CCOC1)c1cc(Br)ccc1O 2155164640 CJNTUKFXNWUVIT-RBBKRZOGSA-N 433.390 4.487 10 10 IICE C[C@@]1(CCOCc2ccccc2)CCN1c1cc2c(cc1Br)[C@H](O)C(=O)N2 2197750972 BBKPWGXWFFOUMB-FPOVZHCZSA-N 431.330 4.010 10 10 IICE COc1ccc(Br)c(CNCC2(NC(=O)OC(C)(C)C)CCCCC2)c1O 2236056791 XMZXXCSTCSLSNA-UHFFFAOYSA-N 443.382 4.481 10 10 IICE Cc1ccc(C)c(N2C(=O)C(=Cc3ccc(-c4ccccc4C(=O)O)o3)C(=O)NC2=S)c1 2293769010 JKFWNYPDDJLBLQ-UHFFFAOYSA-N 446.484 4.093 10 10 IICE O=C1/C(=C\NCCc2ccccn2)C(c2ccccc2)=NN1c1nc2ccccc2s1 13175821 LJKYOFFTERVUPE-MNDPQUGUSA-N 425.517 4.158 10 10 IICE COc1cc([N+](=O)[O-])cc(CN2CCCn3cccc3[C@H]2c2cccc([N+](=O)[O-])c2)c1O 36347331 JZUOARFVPGQWJH-OAQYLSRUSA-N 438.440 4.014 10 10 IICE C/C(=C1\SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O)c1ccc(C)c(C)c1 210234335 JXOCNRFZDQLSEJ-SFQUDFHCSA-N 427.503 4.496 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]nc1-c1ccc(F)cc1 742806251 QWUIFELIGHJKRV-MRXNPFEDSA-N 430.430 4.216 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2C)c1 743808432 UGFSAUXQQNJUPR-FZKQIMNGSA-N 431.330 4.412 10 10 IICE Cc1ccccc1-n1nccc1[C@H]1OCC[C@@H]1C(=O)NCCCSc1nccs1 753057582 NSRSYSJIXRNKJS-LPHOPBHVSA-N 428.583 4.013 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H](O)c2c(F)cccc2Cl)C1 768045704 QPDYNGORNUHINT-QFIPXVFZSA-N 443.950 4.050 10 10 IICE COc1ccc(N2CCC(NC(=O)c3c(F)ccc(Br)c3F)CC2)cc1 783174840 HRBOJZNSXPMGCQ-UHFFFAOYSA-N 425.273 4.135 10 10 IICE COc1ccc(CNC(=O)NCc2cc(-c3c(OC)ccc4ccccc34)no2)c(O)c1 793043842 PSMYWOFQBIOUBL-UHFFFAOYSA-N 433.464 4.217 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc(-c3cccc(C)n3)n2C[C@H]2CCCO2)cc1 802683231 FLOOUYQJCWXWPX-JOCHJYFZSA-N 434.588 4.310 10 10 IICE O=C(C[C@H](c1ccc(O)cc1)C1CC1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 857472232 IXHCWTOJLIZXJZ-UNMCSNQZSA-N 428.960 4.416 10 10 IICE COc1ccc(C[C@H](C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1127693373 XNZRFEISOMVZDR-FQEVSTJZSA-N 433.596 4.411 10 10 IICE C[C@H](OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1cncc(F)c1 1129618746 CMTCQJAUXSOROL-OYZNXWOWSA-N 434.489 4.256 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c1 1129641332 SSZPQADHMFSPDS-SFHVURJKSA-N 447.963 4.113 10 10 IICE Cc1cc(CNC(=O)[C@H](CC(C)C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c(C)n1-c1ccccc1 1132264646 ZAKDJDQAHRZAOC-HJOGWXRNSA-N 447.579 4.076 10 10 IICE CC(C)(Cc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCOCC2)cc1 1136397181 WZFFGXQBFDCCBP-UHFFFAOYSA-N 431.374 4.171 10 10 IICE COc1ccccc1N1CC[C@@H](NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1=O 1137511574 KDPITRXDQIIOIK-HXUWFJFHSA-N 437.927 4.291 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c2ccc(Br)cc2)c1 1147961660 GWQGVCXRJODBJT-GOSISDBHSA-N 449.345 4.345 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)C(=O)NCc3ccccc3)cc2Cl)C1 1235835262 VNJGDUYHEHIZAK-QZTJIDSGSA-N 442.991 4.080 10 10 IICE CCc1nc2ccc(Cl)cn2c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1264689252 NRDLHSGDVMZMEF-HUUCEWRRSA-N 444.938 4.233 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cc1 1266053355 MTNQZFXBWCPKCV-QFIPXVFZSA-N 429.442 4.243 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1cc(Br)cn1C 1295052237 VIPHMAMFJHAUJC-UHFFFAOYSA-N 428.330 4.280 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1Cc1sccc1Br 1298365338 VHKSIMHRKGGADZ-MRXNPFEDSA-N 449.374 4.344 10 10 IICE Cc1cc(-c2nnc(N(C)CCCCCO)n2[C@@H]2C[C@H]2CF)c(C)n1-c1ccccc1 1304192012 JMQKKTYBVSXOFE-SIKLNZKXSA-N 425.552 4.482 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(F)c(F)cc1F 1353107502 QWLCKVUQXFRMBG-FRKPEAEDSA-N 440.443 4.473 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cccc(Cn3nc([N+](=O)[O-])cc3C)c2)cc1 1440675780 UWJIFQIBNWIMQY-UHFFFAOYSA-N 435.528 4.266 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C/C(=O)N2CCN(CC3CC3)c3ccccc32)C1 1445059622 SKRLYJLIQOJJCZ-JXOMPUQVSA-N 425.573 4.453 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](O)c1cc(Cl)cc(Cl)c1 1445879111 DBMJNLBUKQYHSD-MJGOQNOKSA-N 443.758 4.167 10 10 IICE O=C(Cn1ccc2ccc(Cl)cc21)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445886248 SQJOXNIZNNOVPZ-IBGZPJMESA-N 432.351 4.435 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@H](O)CCO3)c(C)n1-c1ccccc1Br 1456152478 YMCIRVQSBYPFPO-QGZVFWFLSA-N 447.373 4.003 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cncc(N4CCCC4=O)c3)cc2Cl)C1 1459576874 JBNRRJUESHXGOO-INIZCTEOSA-N 426.948 4.028 10 10 IICE CCCS(=O)(=O)Nc1cccc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1 1471011739 BRAOYLLKTARJDN-UHFFFAOYSA-N 439.581 4.484 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](c3cn(C)nn3)C2)c(C)n1-c1ccccc1Br 1472327109 AUKMEHHFAQGYCR-MRXNPFEDSA-N 442.361 4.005 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)c1ccc([N+](=O)[O-])cc1F 1472953109 NDKWYNFBTUSLGM-UHFFFAOYSA-N 443.456 4.364 10 10 IICE C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)CCc2ccc(Cl)cc21 1479030276 GCHIVUOKBWQLLQ-QGZVFWFLSA-N 427.976 4.173 10 10 IICE CCCNC(=O)CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1515071737 FEEFWBDIYSSBTD-UHFFFAOYSA-N 440.636 4.020 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc([N+](=O)[O-])c(Cl)c1 1524070245 SZPFTRPMVLILMM-ZDUSSCGKSA-N 425.819 4.248 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CCCCC2 1526893147 INHPVTZFFCMQBE-OAHLLOKOSA-N 432.586 4.313 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1530817338 ASVHUCJZQFYACS-QFIPXVFZSA-N 434.458 4.146 10 10 IICE CC1(C)[C@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1(F)F 1533331765 CYCCXGPIPIAKEB-SUIFULHWSA-N 430.567 4.137 10 10 IICE Cc1csc(N(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C2CC2)n1 1538641725 CBWCOAPLWMSCOW-MHWRWJLKSA-N 447.582 4.378 10 10 IICE CCC(=O)Nc1cccc(COC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1540026701 MEPIFHZZEAWVIB-UHFFFAOYSA-N 433.552 4.500 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc3scnc23)NC(=O)OC(C)(C)C)cc1 1544269115 PVQWCOBZMFWTIW-SFHVURJKSA-N 440.569 4.358 10 10 IICE C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N(C(C)(C)C)C3)c2C(=O)OC(C)(C)C)C1 1544362692 YYGAXGVQBLLQLN-ZIAGYGMSSA-N 434.602 4.414 10 10 IICE CC[C@@]1(C)CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CCO1 1546097453 KQSZPTOUQWZGOW-DEOSSOPVSA-N 439.629 4.358 10 10 IICE CCC[C@@H](Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)OC 1546913998 FSCOICCKZUEQKG-QFIPXVFZSA-N 443.636 4.155 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1556415037 ICTPKXWPPHDTMI-HXUWFJFHSA-N 431.305 4.459 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c(C)n1-c1ccccc1Br 1557924073 BBUKCEWOSQAJSX-BEVDRBHNSA-N 431.374 4.478 10 10 IICE COC(=O)[C@H]1C[C@@H](C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)C1 1558919659 XGILNAXZMCIERK-ZRGWGRIASA-N 434.458 4.497 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@@H](C(=O)NCCCSc2nccs2)C1 1565620218 MPGPRWXDKPHOBB-KRWDZBQOSA-N 433.599 4.276 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Cl)c(O)c2)NC(=O)OC(C)(C)C)cc1 1565883987 FWKNYBRWMFJSGW-SFHVURJKSA-N 433.936 4.107 10 10 IICE Cc1ccc([C@H](O)[C@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1570715648 PUCUJYIOISAMCO-YCRPNKLZSA-N 442.357 4.412 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN(C)c2ccccc2[N+](=O)[O-])cc1 1585493189 SLIIRYRSGYUTHX-UHFFFAOYSA-N 448.523 4.339 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC[C@H]1CCC2(CCC2)O1 1611085220 HKQVHLHMXWPUOL-SOGDLCAJSA-N 448.585 4.025 10 10 IICE CCCCn1ncc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1C 1623512247 DBHPYRGKDBUXQG-LDADJPATSA-N 446.573 4.361 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)N2CCCC2)C(C)C)c(C)n1-c1ccccc1Br 1631019642 IRFCSEINZRBCKT-FQEVSTJZSA-N 446.389 4.233 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(C(F)(F)F)n(C)n2)cc1 1633066019 IIVMBSICGULSJH-UHFFFAOYSA-N 432.446 4.361 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)c1 1634683910 MOZAZXPKUOKQHM-UHFFFAOYSA-N 447.501 4.442 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 1642997887 QTEJYFKCRFLSDT-PGRDOPGGSA-N 425.573 4.374 10 10 IICE COc1ccc(N2CCN(C(=O)c3ncsc3Nc3ccc(C)cc3)CC2)c(OC)c1 1643035702 LUMQAJYOYLUFPR-UHFFFAOYSA-N 438.553 4.175 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cc(C)ccc1C 1648030260 JFIGEVCZIXUWKZ-ROKPMTFOSA-N 441.591 4.413 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C12CCC2 1683862686 TXWYIMNODAMXFN-HNNXBMFYSA-N 444.359 4.430 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(CCc3cccc(F)c3)C3CCCC3)cc2)CC1 1684970290 IZWBKTIYXKFJHZ-UHFFFAOYSA-N 438.591 4.274 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC3C[C@@H](C)O[C@H](C)C3)CC2)cc1 1697471274 YFOPFFBSJKHTTI-WOJBJXKFSA-N 441.620 4.330 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1OCCC1(C)C 1708526973 IVKFALLJWBYTCO-LAUBAEHRSA-N 445.583 4.081 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C)OC 1712148190 LCBDYLZTJKQJIE-OAQYLSRUSA-N 425.577 4.106 10 10 IICE CC[C@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCOCC3)cc2)CCS1 1763471434 ZHGLJKBGJOPUHQ-NQIIRXRSSA-N 429.634 4.008 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1765510997 KLJXNICQJBSZMQ-KRWDZBQOSA-N 432.576 4.154 10 10 IICE CCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1-c1ccc(F)c(C)c1 1862347670 APHABAIRIYJLIZ-UHFFFAOYSA-N 436.531 4.379 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccncc3)C(=O)N(CC(C)C)C2=O)cc1 1873164289 UOPCEPNDMMJLPC-UHFFFAOYSA-N 428.536 4.015 10 10 IICE CN[C@@H](c1ccccc1O)[C@]1(COCc2ccccc2)CCN(C(=O)OC(C)(C)C)C1 1997460517 WSXCTXCXNNSMRE-WIOPSUGQSA-N 426.557 4.497 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3cc(Cl)cc(Br)c3O)[C@H]1C2 2038340298 WLEIWTXHUROHFJ-COLVAYQJSA-N 431.758 4.296 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2060621976 UJSPYAYJXPYYHJ-SXLOBPIMSA-N 445.564 4.424 10 10 IICE COC(=O)c1c(C(C)(C)C)nn([C@H](C)c2ccc(C)cc2O)c1I 2079034880 UTEGLIPDQARREX-LLVKDONJSA-N 442.297 4.195 10 10 IICE C[C@H](NCc1cc(Br)ccc1O)[C@@H](NC(=O)OC(C)(C)C)c1ccco1 2116250709 IXVNJISBPXSNJM-YVEFUNNKSA-N 425.323 4.492 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=Cc2ccc([N+](=O)[O-])cc2)cc1 2293934556 QOOTZLYGDYDHFK-UHFFFAOYSA-N 444.403 4.346 10 10 IICE CCN(CC)c1ccc(C=C2C(=O)NC(=S)N(c3cccc(Cl)c3)C2=O)c(OC)c1 2297559551 KSQVIGJUVJOYHJ-UHFFFAOYSA-N 443.956 4.026 10 10 IICE Cn1c(=O)n(C)c2cc(C=C3SC(=S)N(c4cccc(C(F)(F)F)c4)C3=O)ccc21 2297577746 XAIOGHCUMSOWMB-UHFFFAOYSA-N 449.479 4.302 10 10 IICE CCCOc1c(Br)cc(C=C2C(=O)N(c3ccccn3)N=C2C)cc1OC 2332114083 QRZLZLYKUCSCIE-UHFFFAOYSA-N 430.302 4.448 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@@H](NCc1cc(Br)cc(F)c1O)C2 2358587673 OUCWRXNCLXMEIM-XNJGSVPQSA-N 443.357 4.419 10 10 IICE CCOC(=O)c1sc2ncn(CC(=O)c3cc(C)n(-c4ccccc4)c3C)c(=O)c2c1C 23643637 GIKMPJIVAFTVLC-UHFFFAOYSA-N 449.532 4.234 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3cc(Br)ccc3OC)CC2)cc1 110353934 TZBVAYAJPAWGDU-XCVCLJGOSA-N 445.357 4.265 10 10 IICE CCCCOC(=O)CN1C(=O)/C(=C\c2ccc(OCCCC)c(OC)c2)SC1=S 206456059 RMKPOXCFBXWMIK-QGOAFFKASA-N 437.583 4.419 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(O)=C(c3cccs3)[C@@H]2c2ccc(O)c(O)c2)cc1 526278481 ZOCCZIXSVCBYPX-FQEVSTJZSA-N 437.473 4.393 10 10 IICE CN(C)c1ccc(CN(C2CC2)S(=O)(=O)/C=C\c2ccc(Br)cc2)cc1 727448371 IOQBPNJFIDKIEL-YPKPFQOOSA-N 435.387 4.480 10 10 IICE CCOc1ccc(CNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1F 730029503 RKIMPLMHSQJFHE-UHFFFAOYSA-N 437.462 4.294 10 10 IICE CN1CCC[C@H](CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)[C@H]1c1cccs1 745847028 IDJSLBYKRNPDLU-XQFWAAQXSA-N 443.613 4.227 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCO[C@@H]1c1ccnn1-c1ccccc1C 752922604 IBJRBRPCPDWSFY-DHLKQENFSA-N 432.568 4.373 10 10 IICE O=C1CCc2cc(S(=O)(=O)Nc3cccc(N4CCCCCC4)c3)cc3c2N1CCC3 758395950 HZVOXVGZEVPSRA-UHFFFAOYSA-N 439.581 4.093 10 10 IICE Cc1noc(C)c1CO[C@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)C1 762630936 AKUUBFLQBJIFRT-NRFANRHFSA-N 425.504 4.312 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 768915363 KJVNLAQSYUZLFH-LPTQZCDUSA-N 441.959 4.035 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)cc1 777809025 FKDMCADLIHVUIP-HXUWFJFHSA-N 436.600 4.287 10 10 IICE CCN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ncccc1C 798549983 QQWFZHYNNVXDLP-SSZFMOIBSA-N 431.608 4.486 10 10 IICE C[C@@H]1COCC[C@@H]1c1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 799672408 YIIAVJBRGKYUPE-TYRKMKIJSA-N 435.596 4.105 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(=O)N2CCCC2)CC1 801906052 ZHWVNJZSVQEYSX-UHFFFAOYSA-N 446.599 4.211 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC=C(c4ccnn4C)CC3)cc2Cl)C1 805450535 JWWKCRWRYQWNLN-KRWDZBQOSA-N 427.980 4.309 10 10 IICE Cc1cc(C(=O)COC(=O)c2ccc(N3CCOC3=O)cc2)c(C)n1-c1ccc(F)cc1 915509196 YAWKWFODPKQRJW-UHFFFAOYSA-N 436.439 4.230 10 10 IICE Cc1cc(-c2csc(NC(=O)c3nnn(C)n3)n2)c(C)n1-c1cccc(C(F)(F)F)c1 1124341963 DPGWMTNOLDNTLA-UHFFFAOYSA-N 447.446 4.012 10 10 IICE CN(C)c1ccc(CNC(=O)CCOc2ccc(Cl)cc2Br)cc1F 1125534531 KWKLRQNNCQRKGH-UHFFFAOYSA-N 429.717 4.393 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(NC(=O)OC(C)(C)C)c(C)c3)C2)cc1 1130826945 ODRSJFCQPYELCC-GOSISDBHSA-N 425.529 4.359 10 10 IICE Cc1cc(CCNC(=O)c2cnn3cccc(Br)c23)c(C)n1-c1ccccc1 1131784961 FBAOFPURFLPIQV-UHFFFAOYSA-N 437.341 4.477 10 10 IICE Cc1cc(C)n(-c2ccc(CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cn2)n1 1136290007 ZWEOALQPIYZVOV-UHFFFAOYSA-N 427.508 4.034 10 10 IICE CC1CCC(N2C[C@@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)CC1 1142528213 MTAMAUFMQOMOCR-MMPATGFWSA-N 425.617 4.499 10 10 IICE COc1ccc(NC(=O)c2cccc(NC(=O)c3cc4cc(O)c(O)cc4s3)c2)cn1 1143422801 KADFMBRMRUQHNE-UHFFFAOYSA-N 435.461 4.221 10 10 IICE C[C@H](CSC(F)(F)F)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1147505481 JXDMMOGVNPIJDB-CJNGLKHVSA-N 449.539 4.324 10 10 IICE O=C(NCc1ccc2ccccc2c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1148462209 POVLEDQCIDQOIH-UHFFFAOYSA-N 438.530 4.338 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2ccc([C@H]3CC(=O)NC(=O)N3)cc2)c1 1148650377 ZGVXGOCILSEPHT-HXUWFJFHSA-N 436.899 4.270 10 10 IICE CC(C)N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1cccc(F)c1 1167172097 QXISKPNSWBTNCH-UHFFFAOYSA-N 430.479 4.450 10 10 IICE O=C(COc1c(Cl)cc(Cl)cc1Cl)NCc1ccc(N2CCC(O)CC2)cc1 1167763054 WHFFFHZFSQGSJG-UHFFFAOYSA-N 443.758 4.303 10 10 IICE Cc1cc(C(=O)CN2C=Nc3ccccc3S2(=O)=O)c(C)n1-c1ccc(F)c(Cl)c1 1188660962 VOYPZSYEACHBFF-UHFFFAOYSA-N 445.903 4.434 10 10 IICE COc1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1F 1269952519 AMCAFINAGMNNML-WJDWOHSUSA-N 434.489 4.203 10 10 IICE Cc1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1Oc1ccncc1 1275224642 RVBGTUGJTVWLAG-UHFFFAOYSA-N 439.462 4.227 10 10 IICE Cc1cccc(-n2cnc3cc(C(=O)NC[C@H](c4ccc(N(C)C)cc4)N(C)C)ccc32)c1 1289602734 WVIGJYGXSBKDRR-AREMUKBSSA-N 441.579 4.433 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CC3)nnc2N(C)Cc2ncc(Cl)n2C)cc1 1295414684 JUOBNGLKFMCXLS-UHFFFAOYSA-N 427.984 4.073 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc([C@H]3CCCC(=O)N3)c2)cc1 1303729707 HYAPKRGEUMOFGB-XMMPIXPASA-N 429.520 4.429 10 10 IICE CCC(CC)(NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1 1307531628 LIGIKAPLKFHQLX-UHFFFAOYSA-N 447.982 4.237 10 10 IICE CN(CCOC(C)(C)C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1314879043 UVOJUMSSJOIMOH-UHFFFAOYSA-N 443.636 4.003 10 10 IICE CC(C)c1nnc(N(C)Cc2cccs2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359681593 JNFNLKJDYVVTIV-UHFFFAOYSA-N 439.629 4.356 10 10 IICE CCc1cnc(CN(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1361168869 NLPNNWNOECBDMS-YBEGLDIGSA-N 449.598 4.095 10 10 IICE COC(=O)c1c(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)sc2c1CCCC2 1459351602 PCYPIRWRZUYNGO-UHFFFAOYSA-N 441.597 4.083 10 10 IICE COc1ccc(N(CC(=O)N(C)CC(=O)Nc2ccc(C)cc2)Cc2cccs2)cc1 1459661213 FGSHUJJJFZXYCE-UHFFFAOYSA-N 437.565 4.169 10 10 IICE Brc1cc(CNc2cccc(CN3CCOCC3)n2)ccc1N1CCCCC1 1461402506 FFQFZDSEORWXIT-UHFFFAOYSA-N 445.405 4.279 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3cc(Cl)ccc3Br)CC2)cc1F 1465930115 GKQYCLFZIPEWIW-UHFFFAOYSA-N 441.728 4.142 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCO[C@@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1470774120 WBDBGWCKRQVYTF-GHTZIAJQSA-N 449.473 4.076 10 10 IICE CCC(C)(C)Cn1c(C(=O)N2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1494731599 FVTNUHVTZZUHAN-UHFFFAOYSA-N 438.620 4.187 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)OC2CCCC2)cc1 1501840744 OFPLKIJKCODDGB-HXUWFJFHSA-N 427.593 4.377 10 10 IICE Cc1cc(-c2nnc(N(CC(C)C)C(C)C)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1510625040 YGTMIWGGYCIIHT-UHFFFAOYSA-N 436.604 4.312 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1516378934 IPRJRIISCBITQC-RTWAWAEBSA-N 429.584 4.439 10 10 IICE C[C@H](COc1ccccc1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1529037702 NTPLYRQLJPYUCS-JPVKTXQWSA-N 444.553 4.001 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCN(C)C)Cc2cccc(F)c2)CCCC1 1530273340 LRZZPUGUOCQPKM-UHFFFAOYSA-N 437.559 4.258 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@H]3C[C@@H](C)c4c(C)cccc43)CC2)cc1 1531524595 NYCAPEOUVCDDPR-FGZHOGPDSA-N 435.612 4.313 10 10 IICE CC(C)(C)c1ncc(/C=C\C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1535568612 GWAXQKNAXFTKJX-KHPPLWFESA-N 438.641 4.302 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CO[C@@H]3C[C@H](C)CC[C@H]3C(C)C)cc2F)CC1 1537534675 FYGUUJCYTXWEFJ-NHCICSSKSA-N 433.612 4.061 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H](C)n3nnc(-c4ccccc4)n3)cc2Cl)C1 1538422124 UKLQZDQVPZPNKS-IAGOWNOFSA-N 438.963 4.107 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(O)CCCCC1 1541427326 ILQQYEBXIHAKHD-UHFFFAOYSA-N 425.621 4.408 10 10 IICE C[C@@H]1CCCN(CCn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)C1 1544179738 HNORKBZCJCCZRR-QGZVFWFLSA-N 440.979 4.067 10 10 IICE Cc1ccccc1COc1ccccc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1557638959 DPBYDNIRAPQQEL-UHFFFAOYSA-N 430.548 4.465 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCC1(N(C)Cc2ccccc2)CCOCC1 1565322860 NHZRYVAIMKQGDV-UHFFFAOYSA-N 439.600 4.385 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3csc(-c4cccc(Cl)c4)n3)cc2)CC1 1596523391 QJKCDVWXGBVECS-UHFFFAOYSA-N 426.973 4.145 10 10 IICE CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1 1628056643 PITXKWKVOPESKY-GOSISDBHSA-N 439.581 4.110 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)c1 1628980715 KYHBBHHEYKBXDV-DEOSSOPVSA-N 429.520 4.174 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)c1ccc([N+](=O)[O-])cc1F 1634381077 FBMANVGEMJGJBI-OAHLLOKOSA-N 445.491 4.226 10 10 IICE Cc1ccc(Br)c2[nH]c(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cc12 1647140399 MNTWGJWBGBYEQA-FQEVSTJZSA-N 443.389 4.338 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)Cc1csc(CN2C(=O)c3ccccc3C2=O)n1 1653190608 PALSFLFYOVLPGX-UHFFFAOYSA-N 448.592 4.416 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 1672156387 RQGXHWYOGVKKQE-SAABIXHNSA-N 435.902 4.200 10 10 IICE CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1674713007 TUHYUFUQHNVPDZ-HSZRJFAPSA-N 425.548 4.265 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C(C)C)[C@H](O)c3ccc(Cl)cc3)C2)cc1 1682188136 HNIFTBHLRIPNON-MQNAVGNWSA-N 445.991 4.232 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](CCNC(=O)NCc2c(O)cccc2F)c2ccccc21 1684557902 CBVJIWLSYGZBKF-OAHLLOKOSA-N 429.492 4.260 10 10 IICE CC1CCN(c2ccc(Cn3c(N(C)Cc4cnccn4)nnc3C(C)(C)C)cc2)CC1 1693702882 WZZLLAFDKFUNKY-UHFFFAOYSA-N 433.604 4.287 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1(C)C 1709898717 ANDZQRWUFULNDZ-UHFFFAOYSA-N 434.588 4.210 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1C[C@@H](C1CCCCC1)N(C)C 1729420220 JXNMBQKXRNNJNM-YADHBBJMSA-N 441.620 4.025 10 10 IICE Cc1cccc(-c2nnc(N3CCC(F)(F)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1742325332 WCMMRGZDONAHEU-UHFFFAOYSA-N 426.515 4.307 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1743827913 FBTXKSJKZZOLLA-LJQANCHMSA-N 434.588 4.016 10 10 IICE CC[C@H](c1ccccc1)c1nnc(N2CCOCC2)n1CCCSc1nccs1 1764009081 JQUSFUCIIGSKPO-GOSISDBHSA-N 429.615 4.296 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1Cc1ccc(OC(C)(C)C)nc1 1767111681 BGLDBHKWHQQOCB-UHFFFAOYSA-N 446.555 4.246 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1C1CC1 1768681655 LOFOQUVZDHBAEZ-QGZVFWFLSA-N 427.549 4.070 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ccc(F)cn2)sc(C)c1-c1ccc(F)cc1 1860747025 PZJUCIRIBVRCMM-UHFFFAOYSA-N 445.447 4.151 10 10 IICE COC(=O)c1c(NC(=O)c2cc(=O)c3ccc(O)cc3[nH]2)sc(C)c1-c1ccccc1 1866480590 LJGMVVAJDRNJJB-UHFFFAOYSA-N 434.473 4.310 10 10 IICE CC(C)(C)OC(=O)N1CC(N(CCCC(=O)Nc2ccc(N)cc2)Cc2ccccc2)C1 2044681454 NPOUBXMRNQWHFF-UHFFFAOYSA-N 438.572 4.109 10 10 IICE O=C1N=C(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)SC1=Cc1ccc(Cl)cc1 2053515179 HHMILKFLHGYWRD-UHFFFAOYSA-N 428.901 4.041 10 10 IICE CC(C)(C)OC(=O)Nc1cc(OCCNCc2cccc(Br)c2O)ccn1 2240602976 WTUCLIQMYISFDE-UHFFFAOYSA-N 438.322 4.065 10 10 IICE C[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S 2314650636 SSUFFEBQHXCUOG-MRVPVSSYSA-N 438.870 4.183 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3C[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352670651 JTTYOPLJYXHIKT-CWRNSKLLSA-N 425.367 4.198 10 10 IICE O=S(=O)(c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@H]32)cc1)N1CCOCC1 876921 PZYXUOKZHZFZJV-JQVVWYNYSA-N 430.957 4.187 10 10 IICE O=C(CCN1C(=O)/C(=C/C=C\c2ccccc2)SC1=S)Nc1cccc2nonc12 33545071 QTBQKYNWNGMOCZ-RFYPFHFPSA-N 436.518 4.009 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 35638385 VHWOSZSHVSZVKH-SDNWHVSQSA-N 428.373 4.384 10 10 IICE COC(=O)C1=C(C)Nc2nc(SCc3ccccc3)nn2[C@@H]1c1ccc(N(C)C)cc1 54642356 BJPNSCVSQMXFMA-HXUWFJFHSA-N 435.553 4.098 10 10 IICE COc1cc(/C=C2\C(=O)N(C)C(=S)N=C2O)cc(Cl)c1OCc1cccc(F)c1 96476548 KKTUOZPCFGNQEV-AUWJEWJLSA-N 434.876 4.164 10 10 IICE Cc1ccc(-n2c(C)cc(CC(=O)N3CCC(NC(=O)c4ccccc4)CC3)c2C)cc1 96998784 ZJJAERBDRSUHAL-UHFFFAOYSA-N 429.564 4.366 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3c(O)cccc3Br)CC[C@H]2C1 706854150 PSUQNMGFYFPUGU-RRFJBIMHSA-N 425.367 4.280 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(-c4noc(C(F)F)n4)cc3)CC2)cc1 727032687 UIRRJNJTEDUNDR-UHFFFAOYSA-N 429.427 4.037 10 10 IICE COc1ccc(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)cc1 727248266 MABUDLAFHZPXQZ-UHFFFAOYSA-N 431.358 4.444 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cnc(-c2ccncc2)s1 741561258 FHBDZTCVKYXNEF-UHFFFAOYSA-N 430.480 4.205 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N3CC[C@@H](C)C[C@@H]3c3ccco3)cc2F)CC1 745808030 JNEKJFPLUHHCRG-XMSQKQJNSA-N 428.552 4.243 10 10 IICE O=C(Cc1c[nH]c2cccc(Cl)c12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 814319340 YNMVXFBRXABABP-UHFFFAOYSA-N 436.987 4.212 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H]3CCN(c4ccccc4Cl)C3)cc2F)C[C@@H](C)O1 1125187537 GIPWMPBZHUHJTG-SCTDSRPQSA-N 445.966 4.235 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2cccc(OCC(F)F)c2)CCCC1 1125741910 KQWHGIYJLFLHPT-UHFFFAOYSA-N 428.479 4.489 10 10 IICE COCCc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1128018948 INUVIIHSDNFKKD-XMHGGMMESA-N 444.553 4.245 10 10 IICE Cc1sc2ncc(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)c(=O)n2c1C 1128384011 HWTMQTMESPFGGH-CYBMUJFWSA-N 444.988 4.193 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Cc3cccc(C(F)(F)F)c3)CC2)c(OC)c1 1132032180 NEPKBQQXCKXVJY-INIZCTEOSA-N 436.474 4.250 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2csc3nc(-c4ccccc4)cn23)N(C)C)cc1 1134682061 RQYSOYFNIRXONH-QHCPKHFHSA-N 447.608 4.090 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccc(N(C)C)cc2)c1 1135825407 SAVSLUKRNUSKLZ-UHFFFAOYSA-N 437.565 4.100 10 10 IICE CC(C)c1cccc(-n2cc(O)c(C(=O)NCc3ccc(N4CCSCC4)cc3)n2)c1 1136281947 UJPKTZINVRGXRT-UHFFFAOYSA-N 436.581 4.185 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)C(=O)NCc1ccc2cccnc2c1O 1142730845 FSTAXGJSSJWCEE-IBGZPJMESA-N 427.545 4.420 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Oc3cc([S@](C)=O)c(C)cc3OC)c2C)cc1 1162504776 QTDWYFJOBGDZMP-PMERELPUSA-N 427.522 4.376 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)N[C@@H](C)c3ccccc3O)c2)cc1 1171731046 WVCBWWGQYSQCIB-INIZCTEOSA-N 440.521 4.083 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Cn3cc(Br)cc([N+](=O)[O-])c3=O)c2C)c1 1188980161 RGWODFTUIGTFMY-UHFFFAOYSA-N 444.285 4.118 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H](CCC(=O)OC(C)(C)C)C3)C2)cc1 1230301137 RCKLPNQPDNBQPJ-WOJBJXKFSA-N 445.604 4.065 10 10 IICE CC1CCC(N(C)c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1291060521 IEABHMOUJFXRDP-SYYJFZTOSA-N 429.584 4.440 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1294860183 RUCJXRUSQWSZKV-QGZVFWFLSA-N 449.910 4.148 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C(F)=C\c3ccc(C(F)(F)F)cc3)cc2)CC1 1303721144 UPHMDVDVJMIJTM-DEDYPNTBSA-N 449.448 4.034 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1nccnc1C 1305380265 DHYWBSYKGNRSMG-LJQANCHMSA-N 433.604 4.369 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1CCOCC(F)(F)C(F)F 1314753556 RMXDHQHQEIBHRK-UHFFFAOYSA-N 430.446 4.195 10 10 IICE CCn1ncc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c1Br 1353488901 UVTDMJWYCURLBB-UHFFFAOYSA-N 431.334 4.167 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@H](C)c3cccc(CC(C)C)c3)CC2)cc1 1353707504 UDYICFHKEPTPFJ-JOCHJYFZSA-N 437.628 4.326 10 10 IICE CN(C)c1ccc(CN(C(=O)C[C@@H]2C(=O)Nc3c(Br)cccc32)C2CC2)cc1 1354142812 VOTRFIHVWWHYAC-SFHVURJKSA-N 442.357 4.132 10 10 IICE CCCCOc1ccc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)c(Cl)c1 1442472883 NFDNUCZACWMHBV-UHFFFAOYSA-N 445.991 4.080 10 10 IICE CC(C)c1ccc(C2(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)CCCC2)cc1 1443801925 HYTFKLOLSOCSFN-UHFFFAOYSA-N 430.570 4.129 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccc1OCc1cn2cccc(C)c2n1 1449117350 HEDVZRSDGIGKQZ-UHFFFAOYSA-N 436.508 4.343 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc2cccnc2c1O)c1ccc(F)cc1F 1451951054 BNBXISUXPIGOAV-LJQANCHMSA-N 443.450 4.101 10 10 IICE Cc1cc(C(=O)Nc2cncnc2N2CCCC2)c(C)n1-c1ccc(Br)cc1 1465851510 WBDKDAWGIZKSSP-UHFFFAOYSA-N 440.345 4.499 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)c1ccc(Br)cc1 1466398739 QXGCGQVTAQAMJM-GFCCVEGCSA-N 440.721 4.113 10 10 IICE CCCCN1CCCC[C@H]1Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1500534644 GTJSGXNBUKZEGI-YADHBBJMSA-N 441.620 4.169 10 10 IICE CC(C)c1nnc(N(C)[C@@H](C)c2ccco2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1508892979 ABFCWWNOODYKEL-IBGZPJMESA-N 437.588 4.449 10 10 IICE C[C@H]1CCC[C@](Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1512122455 XMRZELIGNKSAOE-FNZWTVRRSA-N 448.615 4.116 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)nc1 1516251115 ULGDCAWFLKWSDD-UHFFFAOYSA-N 430.468 4.391 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CCC(C)(C)C2CC2)CCOC1 1541718422 PVTKBVCXSBLERU-VWLOTQADSA-N 442.604 4.487 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC(CCCO)CC1 1542226556 BWCPSRQJUMYMRG-UHFFFAOYSA-N 427.637 4.278 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2ccccc2CCN(C)C(=O)OC(C)(C)C)c2ccccc21 1543744889 BUJOBERMBJYWTM-HXUWFJFHSA-N 438.524 4.013 10 10 IICE CCc1nc2ccccc2n1CCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1544677087 PJMNFAVJBBMPPY-HDICACEKSA-N 438.547 4.058 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1OC(F)(F)F 1544721824 VQIMXMWZLBHBKW-UHFFFAOYSA-N 447.501 4.356 10 10 IICE Cc1ccc(O)c(CNc2ccc(S(=O)(=O)NC3CCC(C)CC3)cc2[N+](=O)[O-])c1 1559240538 TYVIWPCIQUYNNN-UHFFFAOYSA-N 433.530 4.078 10 10 IICE COc1ccc([C@@H](NC(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)c2ccco2)cc1 1564938240 QOWHGUAIYHDYSG-HSZRJFAPSA-N 439.487 4.057 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cn2cc(-c3ccccc3)nn2)cc1 1565656191 RYTKQGPCPBCMDP-UHFFFAOYSA-N 441.535 4.253 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)cc1 1587811188 VTJAUAKYGGFUJQ-RUZDIDTESA-N 444.510 4.228 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCC[C@H]2CSC)cc1 1615380944 NLRSWWDMIYTOAY-FPOVZHCZSA-N 429.634 4.008 10 10 IICE C[C@H]1Cc2cc(NC(=O)CCN3C(=O)/C(=C/c4ccc(F)cc4)SC3=S)ccc2O1 1616190224 KUDHPAQULXSHIP-JFENUBAZSA-N 442.537 4.379 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCc1cc(F)ccc1[N+](=O)[O-] 1618427660 ZGLGVPHVTJWWHL-UHFFFAOYSA-N 445.491 4.055 10 10 IICE CSCCCN(C)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)cc1C 1620287551 OPHOLYPEEZUHGI-UHFFFAOYSA-N 444.674 4.246 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](NC(=O)OC(C)(C)C)C3CCCCC3)CC2)cc1 1623430343 YTEMLFLQXQAQTI-JOCHJYFZSA-N 445.604 4.208 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(-c2cccc(Cl)c2)on1 1626055891 KPUGNKYJGFREAK-UHFFFAOYSA-N 433.842 4.040 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@@H](CO)C2CC2)c(C)n1-c1cccc(Br)c1 1628157142 STZDBQNVBUXYGH-LEWJYISDSA-N 431.374 4.384 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(C2CCCC2)[nH]n1 1628620496 HOAHYOVGKINQDO-GZTJUZNOSA-N 444.557 4.436 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC3(NC(=O)OC(C)(C)C)CCC3)ccc21 1632495418 QZTJPHYTSZJJSV-UHFFFAOYSA-N 429.561 4.082 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC(OC(=O)Nc3cccc(F)c3)C2)cc1 1634222914 POYSNVNFIUTNPC-UHFFFAOYSA-N 449.482 4.048 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C)C[C@H](C(=O)OC(C)(C)C)C3)ccc21 1638264776 FTCFLQRWFRPFPX-JXFKEZNVSA-N 428.573 4.344 10 10 IICE CCOC(=O)c1nc(N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc(C(C)(C)C)n1 1639729559 YURMGHMMMHRTOV-FQEVSTJZSA-N 440.588 4.202 10 10 IICE Cc1cc(C(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1-c1ccc(Cl)cn1 1640890701 RYUITDXYAFVGJP-UHFFFAOYSA-N 436.859 4.192 10 10 IICE CC1(C)CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)[C@@H]2CCC[C@@H]21 1653290761 ZDQOYQRBGBREOC-TYUUCJPQSA-N 432.586 4.454 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(CC3CC3)c3cccc(C(F)(F)F)c3)nc12 1654632675 WYCSGEKTTMQURM-UHFFFAOYSA-N 434.418 4.047 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(C)C[C@@H](O)Cc3ccccc3)cc2Cl)C1 1682023108 ALRYTMYCWBEFHR-RXVVDRJESA-N 429.992 4.321 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccc(OC(F)(F)F)c3)CC2)cc1F 1683852488 RFLCDRSGXNXIBN-CQSZACIVSA-N 441.425 4.326 10 10 IICE CCCN(CCC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1709729180 DPDASNJMABPXNA-UHFFFAOYSA-N 432.576 4.156 10 10 IICE Cc1cc(Cn2c(N(C)Cc3ccc(N4CCOCC4)cc3)nnc2C(C)(C)C)cs1 1724228751 YZBYSRRFSJFOGS-UHFFFAOYSA-N 439.629 4.467 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2Cc2ccncc2Cl)cs1 1742565105 GGOLKBZKLAFECL-UHFFFAOYSA-N 440.960 4.073 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1)OC 1745267138 SAFMFHGKOOKTMW-UGKGYDQZSA-N 437.588 4.393 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1 1770784255 LODFVCXFWTXQPX-QKLQHJQFSA-N 425.552 4.429 10 10 IICE CSC1(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CC1 1771418405 SOJZFFUJIDVUBK-IEBWSBKVSA-N 430.618 4.434 10 10 IICE CNc1cc(C(=O)N2CCN(c3ccccc3F)CC2)c(Nc2ccccc2)c(F)c1N 1858181185 HCGXHCZSRWCGGT-UHFFFAOYSA-N 437.494 4.295 10 10 IICE CCCCN1C(=O)C(NCc2cccnc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873163909 CFDXCJGDTNNESQ-UHFFFAOYSA-N 428.536 4.159 10 10 IICE O=C(OCc1ccccc1)N1CCC[C@H](NCc2cc(Br)cc(F)c2O)C1 1948128445 CTHQFXWGNMEWOJ-KRWDZBQOSA-N 437.309 4.185 10 10 IICE Cc1ccc([C@H](C2CCC2)n2nc(C(F)(F)F)c(C(N)=O)c2Br)c(O)c1 2079037186 DYMXSKDLJVXVLS-ZDUSSCGKSA-N 432.240 4.167 10 10 IICE Oc1c(Br)cccc1CN[C@@H]1CN(Cc2ccccc2)[C@]2(CCCOC2)C1 2156277242 ISUFCJTYSQOJSM-SIKLNZKXSA-N 431.374 4.068 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)CC2)c1O 2236051016 NDQOMUBVUKVLFY-UONOGXRCSA-N 443.382 4.479 10 10 IICE CCN[C@H](c1ccccc1O)C1(COCc2ccccc2)CN(C(=O)OC(C)(C)C)C1 2248463213 NKFIFDLCWLOJLC-JOCHJYFZSA-N 426.557 4.497 10 10 IICE COc1cc(C=C2C(=O)N(c3ccccc3)N=C2C)ccc1OS(=O)(=O)c1ccccc1 2293335502 OTSBHYWBOWHUNY-UHFFFAOYSA-N 448.500 4.269 10 10 IICE Cc1ccc(N2C(=O)C(=Cc3ccc(Br)s3)C(=O)NC2=S)cc1Cl 2294229020 FHVWDDOBSWYFQI-UHFFFAOYSA-N 441.759 4.304 10 10 IICE CCCN1C(=O)C(=C2SC(=S)N(CCCCCC(=O)OCC)C2=O)c2ccccc21 2314755189 XMIWCBTXUKKNNM-UHFFFAOYSA-N 446.594 4.138 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N([C@H](C(=O)O)[C@H](C)CC)C1=O)C(C)=O 2314927361 DNRRYXQCQNBQPB-MRAWALMUSA-N 435.567 4.134 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2ccc(OC)c(OC)c2C(=O)O)SC1=S 2314929991 VWQSBXZEQXGTOO-UHFFFAOYSA-N 445.518 4.207 10 10 IICE Cc1cc(I)ccc1N1C(=O)C(=Cc2ccc[nH]2)SC1=S 2318753423 YNDRXEBDCCMTPC-UHFFFAOYSA-N 426.304 4.334 10 10 IICE CCOC(=O)c1c(NC(=O)CCCCCN2C(=O)[C@H](C)SC2=S)sc(C)c1C 11636553 ADGQHAPDCMGILW-ZDUSSCGKSA-N 442.628 4.289 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@H](c2ccc(Cl)cc2)N3)CC1 14465086 NTFMATRYGUUETK-MZKRTTBSSA-N 444.000 4.103 10 10 IICE Cc1ccccc1-n1nc(C)c(/C=C2\C(=O)N(c3cccc(Cl)c3)C(=O)N=C2O)c1O 34222264 HYEBDRNMIAOHMO-BOPFTXTBSA-N 436.855 4.355 10 10 IICE Cc1ccc(-c2nnc(CCC(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)o2)cc1 105038835 KVWRUFKDIOXOSD-QHCPKHFHSA-N 448.567 4.251 10 10 IICE COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)/C2=C/NC2Cc3ccccc3C2)cc1 206229062 KISFHWMNGPTKBY-LFVJCYFKSA-N 427.479 4.226 10 10 IICE CC1CCC(OC2CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)CC1 731047396 NWSMCAORLORZKV-LRZVDXDASA-N 429.605 4.354 10 10 IICE C[C@H](NCC1CCN(C(=O)c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1Cl 766094567 MPPGFRIRBJWHEQ-IBGZPJMESA-N 442.003 4.380 10 10 IICE COc1cccc(CNC(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)c1O 810366733 AYAKISKNUASLKK-UHFFFAOYSA-N 426.856 4.101 10 10 IICE CCOc1cccc(N2C(=O)NC(=O)/C(=C/c3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)c1 1084034933 LNDDIMYHPGJGMC-XKZIYDEJSA-N 447.466 4.298 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(OCCCN(C)C)cc2)CCCC1 1125946590 BYEZTMOCXRHSKB-UHFFFAOYSA-N 435.568 4.498 10 10 IICE Cc1nc(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c(C)s1 1134542282 PBIYLSGSBSAESV-UHFFFAOYSA-N 442.342 4.413 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 1136767824 CEUFNGOOHHCPFY-UHFFFAOYSA-N 436.581 4.234 10 10 IICE COc1ccc2[nH]cc(CCNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)c2c1 1146253083 NTECMHPBOQVQAV-UHFFFAOYSA-N 429.520 4.298 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@H]21 1230199973 FHNMGYKTWPZWNU-HFKLLZPISA-N 442.401 4.392 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H]3c3ccc(OC)cc3OC)C2)cc1 1230300848 KGICVSMWNHNACB-JPYJTQIMSA-N 439.556 4.085 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N[C@H]3CCC[C@H](c4ccccc4)CC3)cc2)CC1 1251104647 PCRNNTBLRANOKJ-UPVQGACJSA-N 448.611 4.304 10 10 IICE COc1ccc(OC)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1264227362 RLANRPIHZALQRC-WQRHYEAKSA-N 446.525 4.073 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCCCNC(=O)OC(C)(C)C 1291445322 KRKHDMDLSLRQIM-QGZVFWFLSA-N 431.581 4.439 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)NCc3ccc(N4C[C@H](C)O[C@@H](C)C4)c(F)c3)cc21 1291755638 IMICHWSIHVSMPN-HOTGVXAUSA-N 440.519 4.006 10 10 IICE CN(Cc1cscn1)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1298433801 ZOXACLAJZZBLEN-UHFFFAOYSA-N 431.616 4.015 10 10 IICE CO[C@H](Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C)C(C)(C)C 1299720715 YRJIRIKHIJOYER-OAQYLSRUSA-N 443.636 4.110 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3coc4ccc(Cl)cc34)CC2)cc1 1351469375 GUJNKKGGUBIOGA-UHFFFAOYSA-N 427.932 4.037 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CSC[C@@H]2C(=O)N[C@H](C)C(C)C)c1 1360236124 HXZZAHKBEZFXSV-OXQOHEQNSA-N 434.005 4.423 10 10 IICE Cc1cc(CC(=O)N2CC3(CCCC3)OC[C@H]2CN(C)C)c(C)n1-c1ccc(Cl)cc1 1437768425 INDACMAAUHKFLY-HSZRJFAPSA-N 444.019 4.392 10 10 IICE CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)c1cc(NS(=O)(=O)c3cccs3)ccc1O)C2 1441273985 ULLYBJCYCIQGNX-IFCGJNOESA-N 434.583 4.199 10 10 IICE CCN(CC)C(=O)COc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1Cl 1441321963 MGSXEJGBQWCSEK-UHFFFAOYSA-N 448.928 4.465 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1 1441597692 ACCMOMLCQRMIOQ-UHFFFAOYSA-N 441.984 4.336 10 10 IICE Cc1ccc(C(=O)NCCCC(=O)N2Cc3ccccc3C2)cc1-n1c(C)cc(C=O)c1C 1465196992 GZTWZGICCJUKAB-UHFFFAOYSA-N 443.547 4.267 10 10 IICE CC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1466682042 HEPZMNMHJGZYKT-HXUWFJFHSA-N 440.341 4.182 10 10 IICE Cc1ccc(N2CCNC2=O)cc1NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1467521150 OELIZWKASCBWLS-UHFFFAOYSA-N 430.508 4.305 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C)nc2c1cnn2Cc1ccc(C)cc1 1467841144 SURRQVKGVARPEN-UHFFFAOYSA-N 435.524 4.218 10 10 IICE Cc1ccccc1Cc1nnc(N2C[C@H](C)O[C@H](C)C2)n1CCCSc1nccs1 1492590527 LYSMXHJYEQJHOS-HDICACEKSA-N 443.642 4.430 10 10 IICE CC[C@@H]1CC2(CCC2)CN1c1nnc(C(=O)NC(C)C)n1CCCSc1nccs1 1514032595 HFVQHIPVVZUAFC-MRXNPFEDSA-N 448.662 4.214 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1515530523 CJMMRGDCEQZPNY-JTHBVZDNSA-N 441.620 4.277 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4ccc(F)cc4)n3C)cc2F)CC1 1521009272 GPRQAIPXELQZRK-UHFFFAOYSA-N 438.522 4.042 10 10 IICE CSCC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1nnc2ccccn12 1525072258 DLCQZIJDNQJJHY-OAQYLSRUSA-N 433.581 4.290 10 10 IICE Cc1ccccc1C[C@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1527450644 SIDQKMYFJMIONF-IEOAWGNMSA-N 442.581 4.473 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnccn2)nnc1N(C)[C@@H](C)c1cccs1 1542227351 ZZPQGYWPSZKNDU-KRWDZBQOSA-N 433.585 4.417 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC(Cn3cccn3)CC2)nnc1C(C)(C)C 1542228699 SGYBBZQTPPFZGS-UHFFFAOYSA-N 435.620 4.111 10 10 IICE O=C(NCCCSc1nccs1)c1cnn(Cc2ccccc2)c1Br 1616241105 JKMMBQFOLMHXRY-UHFFFAOYSA-N 437.388 4.063 10 10 IICE CCOC(=O)C[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1616746306 XLXWRMCPMHYCIZ-KRWDZBQOSA-N 430.854 4.290 10 10 IICE CCOc1ccc(NC(=O)c2ccc(NC(=O)CN[C@H](C)c3ccccc3O)cc2)cc1 1620504201 MBCXBBYGKIUZDF-QGZVFWFLSA-N 433.508 4.333 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)Cc2ccccc2I)cc1 1623452463 WNUBBXOXYIVKBE-UHFFFAOYSA-N 436.337 4.339 10 10 IICE Cc1scc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1C 1624048073 OHHVJJDBYZDSPF-MFOYZWKCSA-N 434.583 4.412 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c1C 1627157257 OAGWBWFZSVNMOT-RUZDIDTESA-N 435.543 4.345 10 10 IICE Cc1ccc(C(=O)NCc2ccn(Cc3ccccc3)n2)cc1-n1c(C)cc(C=O)c1C 1627161092 ZAVIVPXERILJFB-UHFFFAOYSA-N 426.520 4.390 10 10 IICE Cc1c(Br)cnn1CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1632697261 JKJZJFSHBWAVTJ-OAHLLOKOSA-N 428.330 4.450 10 10 IICE Cc1cc(C(=O)NCCCN2CCCO[C@H](C)C2)c(C)n1-c1cccc(Br)c1 1633950751 WHIFBGGQFJHSLH-QGZVFWFLSA-N 448.405 4.087 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc(OCc2cn3cc(C)ccc3n2)c1 1636058462 CXNXQPLXHGCKEI-UHFFFAOYSA-N 436.508 4.343 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C(C)=C\c1ccc(Br)o1 1637248073 YSAKXCZHMHUEBK-XFFZJAGNSA-N 442.693 4.006 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(Br)cc(Cl)c1O 1638196455 IEOJOTIPCUBPHN-UHFFFAOYSA-N 441.778 4.291 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)[C@@H]1Oc1ccccc1 1639222166 PAKJWKITAXKOBE-SDHSZQHLSA-N 434.536 4.458 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1cc(F)cc(F)c1O 1639451618 HYBSHSGMNVYWCV-VIZOYTHASA-N 438.452 4.040 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(OC(F)(F)F)cccc3[nH]2)N(C)C)cc1 1653421886 UXSMCQWSFVZUSN-IBGZPJMESA-N 434.462 4.165 10 10 IICE Cc1ccc(CC2CCN(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)CC2)cc1C 1675579934 DVSFTCXQCVQFGV-UHFFFAOYSA-N 434.628 4.220 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](C(C)C)[C@@H](O)c3ccc(Cl)cc3)C2)cc1 1682188138 HNIFTBHLRIPNON-VSDWSMLSSA-N 445.991 4.232 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C[C@@H](C(F)(F)F)O1 1686269460 PYYFWBIUFMGNHN-GLJUWKHASA-N 433.902 4.438 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3Cc4ccc(Br)cc4C3)C2)cc1 1686854829 FVGHHGFJDHMDLR-OAHLLOKOSA-N 430.346 4.009 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCSCC2)cc1 1694185761 ZLJWYPQSMCAVRU-LJQANCHMSA-N 438.645 4.367 10 10 IICE CCc1nc(CCn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(CC)CC)no1 1694582935 RQOSQBWTOKYSDE-UHFFFAOYSA-N 433.560 4.387 10 10 IICE CCN(c1nnc(C(=O)N2CCCC2)n1CCCSc1nccs1)C1CCCCC1 1709925973 BLAHXLRQIMKRSP-UHFFFAOYSA-N 448.662 4.312 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCCSC 1761877979 LHFGCQXNDAZUBJ-KRWDZBQOSA-N 435.613 4.409 10 10 IICE Nc1ccc(OC(=O)Nc2ncccc2OCC(=O)Nc2ccc(F)c(Cl)c2)cc1 1858682151 CXVKIYPJSSGTAZ-UHFFFAOYSA-N 430.823 4.085 10 10 IICE CN(C)c1ccc([C@H](NC(=O)[C@H]2CCCN2c2ccc(Cl)cc2)c2nccn2C)cc1 1866145327 KNQAFPBYEQJGRL-YADHBBJMSA-N 437.975 4.014 10 10 IICE C/C(=C\c1ccccc1)C(=O)N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866809166 CVVKPZDRJIGUQJ-IWLLYFRBSA-N 438.483 4.009 10 10 IICE Cc1ccc(CN2C(=O)C(NC3CC3)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)cc1 1873166469 AFLMZEWKEPFAPA-UHFFFAOYSA-N 425.532 4.435 10 10 IICE CCN(CC)CCCCN1C(=O)C(NC2CC2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873167016 ONKUAICFXMFDON-UHFFFAOYSA-N 448.611 4.048 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccc(Br)cc1[N+](=O)[O-] 1890482128 MGVNLRITLFRCGE-YOEHRIQHSA-N 430.302 4.276 10 10 IICE COc1cccc(O)c1CNc1ccc(Br)cc1I 2231654111 AUQLEKQULCTJSP-UHFFFAOYSA-N 434.071 4.380 10 10 IICE Cc1ccc(C)c(OCCOc2cccc(C=C3C(=O)NN(c4ccccc4)C3=O)c2)c1 2293615642 UHYMHJQQALIRLR-UHFFFAOYSA-N 428.488 4.223 10 10 IICE Cc1cccc(Oc2nc3ccccn3c(=O)c2C=C2SC(=S)N(C(C)C)C2=O)c1 2296849532 JURCBIQGXFFTQM-UHFFFAOYSA-N 437.546 4.405 10 10 IICE CCOc1ccc2ccc(OCC)c(C=C3C(=O)NC(=O)N(C4CCCCC4)C3=O)c2c1 2297454208 KAOGWEQMIJVAPH-UHFFFAOYSA-N 436.508 4.432 10 10 IICE CC(NCc1ccc2c(c1)OCO2)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 2313682478 DBBREAIAJNSIAJ-UHFFFAOYSA-N 429.451 4.369 10 10 IICE Cc1cccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)c1C 20356349 APJKGVNMCVGUQM-DMNVVODESA-N 446.580 4.383 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc([N+](=O)[O-])cc1 33315571 AWAHDUZUFPJUAH-LICLKQGHSA-N 443.253 4.235 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc([C@H]3COc4ccccc4O3)no2)C1 567311032 NFFJTIQLAYUBOP-HSZRJFAPSA-N 430.508 4.352 10 10 IICE C[C@@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(N)ccc1O 687810027 CDZLSEMSIDWLGP-VWLOTQADSA-N 432.476 4.203 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](CNCc2c(O)cccc2Br)C1 717002269 YKDHSXIXTNHRHU-LBPRGKRZSA-N 435.309 4.137 10 10 IICE COC(=O)c1cccc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c1 729110447 IMLBPWQVTFTMCY-UHFFFAOYSA-N 442.440 4.123 10 10 IICE C[C@H](NCc1ccc(OCc2ccccc2)cc1O)c1cccc(NS(C)(=O)=O)c1 753551444 LWSGZMZFAMPDNU-KRWDZBQOSA-N 426.538 4.194 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(Cc3c(O)ccc4c(=O)c(-c5ccccc5)c(C)oc34)[C@@H]2C1 754800039 UJTTZSWBAOHIFP-AAIMPIBUSA-N 435.520 4.242 10 10 IICE COc1cc(Br)cc(CNC2(c3ccc(F)cc3F)CCOCC2)c1O 760457687 GRDHJJXGVRNQSI-UHFFFAOYSA-N 428.273 4.237 10 10 IICE CCn1c(O)nnc1C1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 762392377 AOQLNDFZOSWUDO-UHFFFAOYSA-N 433.516 4.237 10 10 IICE O=C(c1c[nH]c2cccc(Br)c12)N(Cc1ccccc1O)C[C@@H]1CCCO1 764196925 LGBIWSDOMTVESS-HNNXBMFYSA-N 429.314 4.457 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cc(COC(C)(C)C)on2)C1 774220331 WKSMHKUTIGSMRM-UHFFFAOYSA-N 439.556 4.454 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F 782083200 QFVTXJOSPHXYRQ-UHFFFAOYSA-N 444.457 4.226 10 10 IICE C[C@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)c1ccc(N(C)C)cc1 782083597 RZKIHVOMXKMKOL-AWEZNQCLSA-N 434.462 4.477 10 10 IICE C[C@@H]1C[C@]2(CCO1)CN(C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)C[C@@H](C)O2 797440067 LVEQXRLWKVDEBX-UMEGOILYSA-N 429.605 4.324 10 10 IICE Cc1cc(CC(=O)N2CCC(C(=O)N3CCCC3)CC2)c(C)n1-c1ccc(Cl)cc1 800661586 ZMVDLBAKTWCUIC-UHFFFAOYSA-N 427.976 4.151 10 10 IICE C[C@H](Oc1ccc(F)cc1)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCO1 812264444 JCDFQRJPEODEEJ-OXJNMPFZSA-N 426.492 4.078 10 10 IICE COc1ccccc1-c1ncc(CNCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cn1 813770248 PINPBKDUNCFDFY-HDICACEKSA-N 436.531 4.195 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 915644765 OZHAWDTYMUMGQD-GOSISDBHSA-N 432.490 4.233 10 10 IICE Cc1ccc(/C=C/C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(Br)c1 917707516 KNKHVOHOWCZWTL-FNORWQNLSA-N 433.321 4.063 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)cc(C)c3Br)cc2F)CC1 1125976361 WZBLJOPKEBILQY-UHFFFAOYSA-N 448.380 4.277 10 10 IICE C[C@@H](NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1)c1ccc(N(C)C)cc1 1128242644 YZLIWFBOZFAGKE-GOSISDBHSA-N 443.613 4.197 10 10 IICE C[C@@H]1C[C@@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCS1 1134491329 CFMCQMAODFCIJV-HAQQTBRTSA-N 426.654 4.130 10 10 IICE CC(C)(CCc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1136578421 MEDLAPYQWVSEJR-UHFFFAOYSA-N 444.578 4.396 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCCN(CCc2ccccc2)C1 1137351153 ZEGHFEZFHRDSOW-IBGZPJMESA-N 445.401 4.458 10 10 IICE Cn1nccc1[C@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)C(=O)OC(C)(C)C 1195747334 CZMSJGVYRXZYFP-QFIPXVFZSA-N 448.527 4.447 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@H](CC(F)(F)F)C3)cc2Cl)C1 1227208266 MZDDEWANPQPMSR-GDBMZVCRSA-N 433.902 4.439 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CCO[C@H](c4nccn4C)C3)cc2Cl)C1 1227210269 ZDFRGWICDPQNGB-MMOPVJDHSA-N 445.995 4.029 10 10 IICE Cc1cc(CC(=O)N2CSC[C@H]2C(=O)N[C@@H](C)C(C)C)c(C)n1-c1ccc(Cl)cc1 1293236757 RLYJVFBCRNCUFQ-KKSFZXQISA-N 448.032 4.352 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)CCCC1 1294703183 DEJALSDTPJNCIT-RUZDIDTESA-N 436.552 4.166 10 10 IICE CON(C)C(=O)[C@H](CCSC)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1295416654 MSEPNWKCWJUYDS-NRFANRHFSA-N 431.602 4.089 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC1CN(C(=O)OCc2ccccc2)C1 1307138300 IJFMIRLXKRHBTQ-UHFFFAOYSA-N 431.448 4.259 10 10 IICE CC1(C)[C@H](c2ccccc2F)CCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313065644 UDJWNCQLHFJKKH-QFIPXVFZSA-N 425.548 4.265 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCC(F)(F)C1 1314305108 IHYMOJLMPPPBPI-LJQANCHMSA-N 433.547 4.487 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1C[C@@H](C1CCCCC1)N(C)C 1314750093 HPZUXFAOYOIZBE-QFIPXVFZSA-N 434.588 4.193 10 10 IICE CCO[C@@H]1C[C@@](NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)(C(=O)OC)C1(C)C 1326016277 NUWRGOVXNPDFOH-AUSIDOKSSA-N 432.948 4.224 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1ccc(F)c(F)c1 1355590776 XBFNLOVRLNGQEX-LICLKQGHSA-N 436.480 4.012 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CSCCS1 1359680177 HVCIAORPPOMZOT-HXUWFJFHSA-N 431.675 4.487 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(Br)nc(Br)c1 1445902448 QOYAAAORGRWLCO-UHFFFAOYSA-N 440.135 4.121 10 10 IICE Cc1cc(C(=O)N(CCn2ccnc2)Cc2cnn(C)c2)c(C)n1-c1ccc(C(C)C)cc1 1449256839 AJEASYWDOAABHX-UHFFFAOYSA-N 444.583 4.490 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C/c1ccccc1OC(F)(F)F 1466398185 JYWNKFWCTXYPOE-RMKNXTFCSA-N 443.805 4.159 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@]3(C=Cc4ccccc4O3)C2)N(C)C)cc1 1471546812 FUZSVNRPIFNAOH-ZEQKJWHPSA-N 434.584 4.005 10 10 IICE CCS[C@H](C)c1noc(CN(C)C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)n1 1533761226 YGVYQWYUTIYDBM-OAHLLOKOSA-N 442.585 4.384 10 10 IICE Cc1ccc(OCc2ccc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)o2)c(C)c1 1536925550 YWBGRBAPIAXYAZ-UHFFFAOYSA-N 433.552 4.157 10 10 IICE Cc1ncsc1CCC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1539361097 OWTSYFQOTQZERX-UHFFFAOYSA-N 442.342 4.495 10 10 IICE Cc1ccc(CC(=O)N2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)cc1 1544950692 YLLVLNZHHPCSIM-UHFFFAOYSA-N 429.564 4.238 10 10 IICE CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1564587569 JJWMHFXEABFARE-FPOVZHCZSA-N 440.588 4.459 10 10 IICE CC[C@@H](c1ccccc1)N1CCN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 1564962681 NDUVIIJZSKPACR-BWKNWUBXSA-N 436.600 4.000 10 10 IICE CCN(C[C@@H]1COc2ccccc2O1)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1565585756 UMNSNNSGCSVMJD-HSZRJFAPSA-N 432.520 4.138 10 10 IICE COC(=O)/C=C/c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)o1 1565656384 ZPWUUQPGFUQKLM-JQIJEIRASA-N 434.492 4.387 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(Br)c1O 1566154719 GXJYPWQKLNJMQX-GFCCVEGCSA-N 441.272 4.155 10 10 IICE O=Cc1cc(F)c(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1F 1597560579 GVVKFUUOLOIFOK-UHFFFAOYSA-N 449.501 4.394 10 10 IICE Cc1nnc(N2CCO[C@@H](c3ccc(F)c(F)c3)C2)n1CCCSc1nccs1 1612611113 MXBWUZBRNDKJDO-QGZVFWFLSA-N 437.541 4.082 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2csc([C@H]3CC[C@H](C)CC3)n2)N(C)C)cc1 1616867297 UKHAOGRZKBFSMR-JLMWRMLUSA-N 428.646 4.464 10 10 IICE COC[C@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1619698208 AASQEYJSIPHBGK-IRXDYDNUSA-N 437.635 4.021 10 10 IICE CCS[C@H]1CCCC[C@H]1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1621898755 WVSPAAWQLKYHBA-WBVHZDCISA-N 440.612 4.049 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCCn3cc(Br)cn3)c2C)c1 1625545349 BSFBZLFNFMUMME-UHFFFAOYSA-N 429.362 4.490 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccc(C)cc2)cc1 1632050100 RZECXYGNRMXUNZ-QFIPXVFZSA-N 441.572 4.164 10 10 IICE Cc1ccc(C(=O)N(Cc2cccc(C(N)=O)c2)C2CC2)cc1-n1c(C)cc(C=O)c1C 1635775448 KMJLWXGORIXNNF-UHFFFAOYSA-N 429.520 4.119 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Br)cc1 1642155309 MVBJICOWZBDUDM-UHFFFAOYSA-N 431.374 4.004 10 10 IICE CCc1nsc(N2CCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CC2)n1 1644722527 AVLGNIUPDPZKJQ-UHFFFAOYSA-N 435.557 4.277 10 10 IICE CCOC(=O)c1nn(CC(=O)c2cc(C)n(-c3ccccc3C)c2C)c2ccccc2c1=O 1652650885 KAKCOIJOTMJARY-UHFFFAOYSA-N 443.503 4.172 10 10 IICE COC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCN(c2ccc(OC)c(F)c2)CC1 1653749683 UQNZFBLKKHRZEW-IBGZPJMESA-N 427.303 4.177 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(C)[C@@H](Cc4ccccc4)C3)c2C)c1 1683303321 MCPNAYUXBFAIOD-SANMLTNESA-N 430.596 4.471 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCCO[C@H]3c3ccc(Cl)cc3)C2)cc1 1683504109 LABHBTSWHPBDLD-IMRHEYAYSA-N 443.975 4.394 10 10 IICE Cc1[nH]c2ccc(F)cc2c1CCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1684434552 WBSFCHILSJGAII-IBGZPJMESA-N 425.504 4.254 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694096435 SSANMZOKZRWGIP-GHTZIAJQSA-N 429.584 4.440 10 10 IICE Cc1noc(C2CCN(c3nnc(C(C)(C)C)n3CCCSc3nccs3)CC2)n1 1742890032 XODFZUYWMHQCJU-UHFFFAOYSA-N 447.634 4.290 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@H](C)[C@@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1761678495 GMTMMMVWCNEJRF-PKOBYXMFSA-N 439.629 4.454 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC(F)(F)F)n1Cc1ccc(N2CCC(CO)CC2)cc1 1763491627 SRCIQBYCHQPEIU-MRXNPFEDSA-N 439.526 4.047 10 10 IICE CCN(CC)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N2CCC(C)CC2)cc1 1764966425 PXWCEYHXSOKLMI-GMAHTHKFSA-N 441.620 4.133 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CC[C@@H](C)[C@H](OC)C2)cc1 1766615069 VTRPWHKPWRGEKQ-HYBUGGRVSA-N 448.615 4.020 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(Cc4ccc(F)cc4)n4ccccc34)CC2)cc1 1858350742 YFDGEVPVJWSSFE-UHFFFAOYSA-N 444.510 4.035 10 10 IICE COC(=O)c1c(NC(=O)c2c[nH]c3ccc(O)cc3c2=O)sc(C)c1-c1ccccc1 1866410103 HQZXYWBFVFWVPK-UHFFFAOYSA-N 434.473 4.310 10 10 IICE CCCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCO[C@@H](C)C2)n1 1868386733 GIUQRUYOEGTSSK-INIZCTEOSA-N 442.519 4.173 10 10 IICE COC(=O)c1ccc(CNC(=O)c2ccc3[nH]c(-c4ccc(N(C)C)cc4)nc3c2)cc1 1872741904 AHXOTIFMYMVBEJ-UHFFFAOYSA-N 428.492 4.013 10 10 IICE CN(Cc1nccn1Cc1ccccc1)c1ccc(C=CC(=O)O)cc1Br 1915072513 USUDJKVARWJRMR-UHFFFAOYSA-N 426.314 4.428 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(C)(C)C)c(CO)c2I)c(O)c1 2079032509 FCVURWHXSNJCCG-MRXNPFEDSA-N 440.325 4.291 10 10 IICE COc1cccc(OCCCOc2ccc(C=C3C(=N)N4C=CSC4=NC3=O)cc2)c1 2297313926 XTHAETDLAIMUBR-UHFFFAOYSA-N 435.505 4.320 10 10 IICE COC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(Br)o2)SC1=S 2314769199 ORBRJMIBUMZZKB-AWEZNQCLSA-N 438.324 4.158 10 10 IICE CCOC(=O)c1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccccc3)SC2=S)cc1 2314836102 ABGLVOYEBQBVLI-CQSZACIVSA-N 440.546 4.092 10 10 IICE Cc1ccc(CN[C@H]2CN(C(=O)OC(C)(C)C)CC23CCC3)c(O)c1Br 2352680498 QJXQTQHNLVVSDI-HNNXBMFYSA-N 425.367 4.342 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](C(C)C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2381131734 ROVQNZWAZJQZJE-INIZCTEOSA-N 443.382 4.313 10 10 IICE O=C(NN1C(=O)/C(=C\c2ccc(Cl)cc2Cl)SC1=S)c1ccccc1O 7002440 JYSJQIHURMNOAN-VGOFMYFVSA-N 425.318 4.245 10 10 IICE Cc1cccc(N2C(=O)C[C@@H](N3C(=O)/C(=C/c4ccc(Cl)cc4)SC3=S)C2=O)c1 15050899 CDKWFMDEUHXLAP-FNTDYBJHSA-N 442.949 4.182 10 10 IICE COc1ccc(N2CCN(c3nc4cc(C)c(C)cc4nc3C(=O)OC(C)C)CC2)cc1 64690592 LQIUJVOBPQVBTF-UHFFFAOYSA-N 434.540 4.147 10 10 IICE COc1ccc(O)c(C2=NN3[C@H](c4ccc(OC)c(O)c4)Oc4c(OC)cccc4[C@H]3C2)c1 245296687 ORUDZAJOEHNUPV-CLOONOSVSA-N 448.475 4.366 10 10 IICE COc1ccc(CNc2cc(Br)ccc2I)c(O)c1 388284843 SLERJFLOWNJIAX-UHFFFAOYSA-N 434.071 4.380 10 10 IICE Cc1cccc(C2=C(O)C(=O)N(c3ccc4c(c3)OCCO4)[C@H]2c2ccc(O)c(O)c2)c1 526159720 AVJURZNHCWKPML-QHCPKHFHSA-N 431.444 4.235 10 10 IICE COc1cccc(F)c1[C@H](C)NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 743661189 WIZFBHWYGUAZBM-AWEZNQCLSA-N 437.462 4.465 10 10 IICE Cc1cc(CCNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)c(C)n1-c1ccccc1 746427397 WKMMXCYINXGLQU-UHFFFAOYSA-N 430.957 4.124 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1CNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 760167344 OJWSLHGGAUSHQA-FQEVSTJZSA-N 447.583 4.393 10 10 IICE C[C@H](c1ccc(N2CCOCC2)cc1)N1C(=O)N[C@@H](C[C@H]2CCCc3ccccc32)C1=O 761160108 OTGSPODCEMIDCY-JLGINSKQSA-N 433.552 4.015 10 10 IICE O=C(Cc1ccc(Br)s1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 768916450 QUTNFWJQAUAPJJ-AWEZNQCLSA-N 443.794 4.193 10 10 IICE O=C(NCc1ccn(C2CCCC2)n1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770107089 IFFFMKLRPVZLJQ-KRWDZBQOSA-N 433.503 4.068 10 10 IICE COc1ccc(N2CCC(N[C@H]3CC(=O)N(C)[C@H]3c3ccc(Cl)c(F)c3)CC2)cc1 773102059 FFVFCRSWMKOCCG-GMAHTHKFSA-N 431.939 4.018 10 10 IICE CC(C)N1CC[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1c1ccc(F)c(F)c1 778826314 ISWMTRWBWMZVLR-DHIUTWEWSA-N 430.543 4.396 10 10 IICE CC(C)Cn1cc([C@H]2N(Cc3cc(Br)ccc3O)CC23CCOCC3)cn1 849479644 TVZRPIHTZLJIRU-HXUWFJFHSA-N 434.378 4.361 10 10 IICE Cc1cc(C(=O)CS(=O)(=O)Cc2ccccc2)c(C)n1-c1ccc(OC(F)F)cc1 914460741 DULHUGWDPJVERG-UHFFFAOYSA-N 433.476 4.493 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)CCCC1 1128319817 UQNKCAHBIKVWNR-UHFFFAOYSA-N 435.524 4.054 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cn(-c4ccc(C)cc4)nc3C(C)(C)C)C2)cc1 1130826962 OPSTYEDRJJJJBX-LJQANCHMSA-N 432.568 4.496 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCO[C@@H](CCc3ccccc3)C2)cc1 1153859693 WDBZTRQCISLLTA-SANMLTNESA-N 430.548 4.309 10 10 IICE CCOC(=O)[C@@H](CC1CC1)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1154182949 MGWZMTFXKFABAT-GOSISDBHSA-N 433.346 4.318 10 10 IICE COCCOC1(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)CCOCC1 1158483963 UVTRWJOWPYQIGW-UHFFFAOYSA-N 428.573 4.160 10 10 IICE O=C1[C@@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CCN1c1ccc(F)cc1 1251907391 GCUHRPZEJUWXQJ-NRFANRHFSA-N 425.504 4.181 10 10 IICE CCc1c(C(=O)Nc2c(Cl)ccc3nonc23)nnn1-c1ccc(OC(C)C)cc1 1271355381 DHNUPDMNSSQOBH-UHFFFAOYSA-N 426.864 4.059 10 10 IICE C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1288335021 WUJCWXVCCNFOCX-NRFANRHFSA-N 429.564 4.189 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)cc21 1291755639 IMICHWSIHVSMPN-HZPDHXFCSA-N 440.519 4.006 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncn(C)n1 1293875057 PZEQSTZBHPZPHY-SFHVURJKSA-N 446.603 4.402 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)OC(C)(C)C)c2ccnn2C)c(C)n1-c1cccc(Cl)c1 1300240231 LHFXTZPFUBTOKN-FQEVSTJZSA-N 442.947 4.294 10 10 IICE Cc1cc(C(=O)N[C@H](CO)Cc2ccc(F)cc2)c(C)n1-c1cccc(Br)c1 1448803929 GEBOSCSZWKSWDW-IBGZPJMESA-N 445.332 4.329 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCCc1cc(N)n(-c2ccccc2)n1 1465307741 KQEVJHQUODRFHC-UHFFFAOYSA-N 441.535 4.037 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1467497293 IEGKOKRKWRACIO-KRWDZBQOSA-N 426.504 4.413 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](Cn2ccnc2)c2ccc(C)cc2C)cc1 1469503334 XIHZPDHOQOHIAT-DEOSSOPVSA-N 435.572 4.028 10 10 IICE Cc1ccc(C[C@@H](CO)CNC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cc1Br 1469854482 RPXSPNRBTJWDMM-FUHWJXTLSA-N 448.405 4.035 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](C)C[C@@H]2[C@H](C)O)sc(C)c1-c1ccccc1 1473390025 BAJCDVAAZALRIE-TXPKVOOTSA-N 444.597 4.320 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC[C@H](COC)C2)cc1 1501839033 NTYCRNMTKFAWDE-NRFANRHFSA-N 436.604 4.041 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](C(C)C)C1 1503930428 NSJHVJAXQWEAPS-XXBNENTESA-N 437.588 4.249 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@@H](C)C2 1525452642 DENUVMRZYMAFIU-CVEARBPZSA-N 440.565 4.430 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1 1529278414 RHZCLTUPPHHMBG-INIZCTEOSA-N 426.948 4.444 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1530833045 AVFHKOKXGCZERH-UWJYYQICSA-N 434.367 4.204 10 10 IICE C[C@@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(F)cc1 1537220637 DWSPXIJOKFRHJD-FDIDITGRSA-N 432.517 4.434 10 10 IICE CCOC(=O)[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1558919675 XVTXBIYSVVULHU-ZHALLVOQSA-N 434.458 4.497 10 10 IICE Cc1ccc(C2=CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)cc1 1564895730 SCSWQXCJEVMTAA-UHFFFAOYSA-N 427.495 4.109 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3ccnc3)nc2)c(C)n1-c1ccc(Br)cn1 1588267721 ADOYQDSPNPULQQ-UHFFFAOYSA-N 437.301 4.085 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nnc(-c3ccccc3)s2)cc1 1595814710 MNMYYYZYDULLLG-UHFFFAOYSA-N 430.533 4.284 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(NS(=O)(=O)C3CC3)c2)c1 1606630122 FHLLSBQWKLQYIC-UHFFFAOYSA-N 437.565 4.237 10 10 IICE Cc1ccc(NC(=O)CN(C)c2nnc(C(C)C)n2CCCSc2nccs2)cc1 1612113648 QOOMZPSHZOAXDO-UHFFFAOYSA-N 444.630 4.424 10 10 IICE Cc1cc(CN2CCC([C@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)CC2)ccc1N(C)C 1618529673 UCRYJYZYIDIZMX-FYYLOGMGSA-N 431.621 4.345 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2cc(C)cc(Br)c2o1 1627013778 KHPUTIFNMGAYTE-UHFFFAOYSA-N 446.297 4.415 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cn2nc(C(F)F)cc2C(F)F)cc1 1631612186 JYDPNIOOYRNPHE-INIZCTEOSA-N 442.457 4.032 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](c2cccs2)C(C)(C)CO)C1 1639152914 WVRFRHJNDTYVDZ-XMMPIXPASA-N 439.625 4.345 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)cc1C 1644804115 JINBPTWCTQMVKN-WOJBJXKFSA-N 427.564 4.199 10 10 IICE Cc1cccnc1[C@H](N[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(C)C 1644901139 NZCUYYPSHZYEGN-GAJHUEQPSA-N 441.531 4.479 10 10 IICE COC(=O)[C@@H](c1ccc(Cl)cc1Cl)N1CCN(c2ccc(OC)cc2OC)CC1 1648083992 AQKWCCNJOVTSQT-HXUWFJFHSA-N 439.339 4.047 10 10 IICE Cc1ccnc(-c2noc(CN3CCCc4cc(CNC(=O)OC(C)(C)C)ccc43)n2)c1 1652476655 RCZKMGZZFNAMIA-UHFFFAOYSA-N 435.528 4.418 10 10 IICE COc1ccc(C(C)(C)NCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1F 1655115140 ODYGJMDDWGLBAP-UHFFFAOYSA-N 446.478 4.073 10 10 IICE COC(=O)c1c(NC(=O)CN(Cc2ccccc2O)C2CCCC2)sc2c1CCC2 1657277268 UVDCQOHUOXFAKK-UHFFFAOYSA-N 428.554 4.112 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](c1ccccc1)c1cccc(F)c1 1674711953 DNIABVZUZZLILL-VWLOTQADSA-N 433.527 4.376 10 10 IICE Cc1cc(CCNC(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c(C)n1-c1ccccc1 1683148854 DWGIWTMCKIZDJQ-KNQAVFIVSA-N 437.506 4.419 10 10 IICE COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)CC3 1686827318 ZZLMWIPPJHWULO-KRWDZBQOSA-N 448.567 4.028 10 10 IICE CCc1nc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)cs1 1694602690 RFYUYJCYFBEYQN-UHFFFAOYSA-N 425.583 4.340 10 10 IICE CC[C@@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 1694970042 VVWZXDNURJMLHT-YLJYHZDGSA-N 429.584 4.268 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1708445084 DGTYYQKZJGPADD-GBESFXJTSA-N 429.584 4.298 10 10 IICE CCC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1727989406 AUVPHDGJWXNXRC-DHIUTWEWSA-N 441.620 4.420 10 10 IICE CC(C)c1nnc(N2CCC(N3CCCCC3=O)CC2)n1CCCSc1nccs1 1741353298 WZLMSYNYBVISHA-UHFFFAOYSA-N 448.662 4.022 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCS1 1752609994 SHJXZDNACSPXEM-GHTZIAJQSA-N 429.634 4.160 10 10 IICE Cc1noc(C)c1CN(C)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1762658787 PYONXTQXENJCPY-KRWDZBQOSA-N 448.618 4.400 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)C1 1762876624 ZUXJDNGTXIYLQG-SIKLNZKXSA-N 441.620 4.372 10 10 IICE CSC1(Cn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CCC1 1770468779 CJVLWIVCWJUQSK-UHFFFAOYSA-N 443.661 4.235 10 10 IICE C[C@H]1CCCN(C(=O)CCn2c3c(c4ccccc42)CCn2c-3nc3ccccc3c2=O)C1 1860344922 HPWMKCJWJICMNG-SFHVURJKSA-N 440.547 4.223 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@H](NCc2ccc(Br)cc2O)C12CCC2 2118413755 QQJQVPZNRCZAKD-PBHICJAKSA-N 425.367 4.328 10 10 IICE C[C@@H](NC(=O)C1(COCc2ccccc2)CN(C(=O)OC(C)(C)C)C1)c1ccccc1O 2256684971 LIIHVIIMHIFKKK-GOSISDBHSA-N 440.540 4.023 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Sc4ccccc4)o3)C2=O)cc1 2294131013 SLXQOEUZLHZIAX-UHFFFAOYSA-N 434.473 4.496 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(O)c3)C2=O)cc(Br)c1O 2321601565 UDZLOBHEZMSXCO-UHFFFAOYSA-N 438.324 4.275 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccccc3F)=NC2=O)ccc1OCCC(=O)O 16920107 UFNUUFZYIGNXPH-LDADJPATSA-N 430.457 4.160 10 10 IICE Cc1sc2ncn(CCC(=O)NCc3ccc(N4CCC(C)CC4)cc3)c(=O)c2c1C 731017074 UZLLRIFEOPRIMI-UHFFFAOYSA-N 438.597 4.018 10 10 IICE COc1ccc(O)c(CNC(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)c1 734063445 VEUYZRLFEAFPJG-UHFFFAOYSA-N 448.306 4.239 10 10 IICE CN(CCCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)OC(C)(C)C 742806925 VEUWZXYBFFFIFL-MRXNPFEDSA-N 441.519 4.020 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc([C@H]2CCCOC2)c1 767087690 KQUFKWQQGDDPBN-SIKLNZKXSA-N 428.960 4.334 10 10 IICE Cc1nc([C@H]2CCCN2C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cs1 773238315 UDGRPXBIGYAHQT-LRAJWGHMSA-N 432.565 4.251 10 10 IICE Cc1sc(NC(=O)[C@H]2CCc3nncn3CC2)c(C(=O)OC(C)C)c1-c1ccccc1 1124793784 JQFBYHBTJRZXSZ-KRWDZBQOSA-N 438.553 4.471 10 10 IICE Cc1cc(CCNC(=O)CCN2C(=O)CCc3cc(F)ccc32)c(C)n1-c1ccccc1 1131781702 KJWJFAYGYJTGAK-UHFFFAOYSA-N 433.527 4.261 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)N(C)C)cc1 1134882437 PYSCTXJNIAIYCV-IBGZPJMESA-N 446.473 4.459 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCOc1ccc(Cl)cc1Cl 1142686877 JBCGIVMYPPGALK-UHFFFAOYSA-N 426.296 4.060 10 10 IICE Cc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOc2cc(N(C)C)ccc21 1147888249 LRKFLRJJDDIXRS-OAQYLSRUSA-N 425.529 4.052 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cccc(C(=O)N2CCCC2)n1 1152394293 FJJNMMAMSYDGHO-LJQANCHMSA-N 429.520 4.427 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Oc2ccncc2)c(Cl)c1 1162539832 MXXSSOCNFFQCSG-UHFFFAOYSA-N 440.883 4.438 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCCc2cc(Cl)ccc2Br)c1 1224453081 NNTCGONZOHGSDB-NSHDSACASA-N 427.726 4.420 10 10 IICE Cc1cc(CC(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c(C)n1-c1ccccc1 1265632809 XHCYYKDTCDXHOZ-VWLOTQADSA-N 429.564 4.448 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N1CCC(n2ccc(C(F)(F)F)n2)CC1 1289418738 BTOUIYAGYHIMIY-UHFFFAOYSA-N 447.509 4.066 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1 1294101283 ZLNIJXOZTQDARR-UHFFFAOYSA-N 431.536 4.116 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(F)(F)F 1301038226 DCWHWWGTKOCLGT-INIZCTEOSA-N 439.457 4.336 10 10 IICE COCCN(C)c1nnc(-c2cc3ccccc3o2)n1CCCSc1nccs1 1301692858 VGMUYYWZCNFRDO-UHFFFAOYSA-N 429.571 4.413 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@@H]1/C=C/c1ccccc1 1312833193 GJYYIMHOOMEFFV-NDDJGDGRSA-N 427.495 4.189 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)c1ccc2nc(O)oc2c1 1313091646 IWNWAZBOOOBGKL-NSHDSACASA-N 434.290 4.294 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)C[C@H]2CCCOC2)cc1F 1314659203 SFLDWNMEQJLTKY-HXUWFJFHSA-N 429.584 4.127 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(=O)N2CCCC2)n1C[C@@H]1CCCCC(F)(F)C1 1314751519 USZCKUDXXULWMC-QGZVFWFLSA-N 447.530 4.072 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccnc(OCC(F)(F)F)c2)CCCC1 1360852946 WKIATQPTPYYREC-UHFFFAOYSA-N 447.457 4.181 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(OC2CCCC2)nc1 1435332984 OROAWYMAJMCBBT-KRWDZBQOSA-N 431.483 4.403 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CN(Cc4ccccc4)CCO3)cc2Cl)C1 1436046199 AVUKQKYGVWZOPT-YADARESESA-N 442.003 4.094 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(N4CCCCC4)n3)cc2Cl)C1 1459581454 MMVBDZCRBVTSDQ-QGZVFWFLSA-N 427.980 4.287 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CNC(C3CCCCC3)C3CCCCC3)CC2)cc1 1460688062 IPSCLKHSDZJLAS-VWLOTQADSA-N 443.676 4.297 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)c1 1465328206 CCLRGUDITUXAEI-OAQYLSRUSA-N 430.596 4.343 10 10 IICE Cc1cc(CN2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)ccc1N1CCCCC1 1473157632 JZAOKOPGAOCSGE-VWLOTQADSA-N 428.020 4.490 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCCNC(=O)CCCc3ccccc3)c2C)c1 1478856354 HUELXNQSTKLZTA-UHFFFAOYSA-N 446.595 4.341 10 10 IICE CC(C)(c1ccc(F)cc1)C1(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1 1479030547 KZWMEXYERAFBEB-UHFFFAOYSA-N 425.548 4.096 10 10 IICE CCCN1CCCC[C@H]1Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccccc1O 1500992997 AIPZYRMOXYNHJW-NRFANRHFSA-N 434.588 4.255 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(F)F)C1 1504891516 BDKYIBQXPKEWOQ-SFHVURJKSA-N 429.515 4.481 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCSC1(C)C 1513905026 XSKSFQJCWYAHSV-SFHVURJKSA-N 429.634 4.098 10 10 IICE C[C@@H](c1cccs1)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541795936 LGSYEGVIWSJKFH-RDJZCZTQSA-N 429.565 4.294 10 10 IICE COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)NCc2c(O)cccc2F)c(OC)c1 1558454605 DBYZWCVOSQCTMO-UHFFFAOYSA-N 447.466 4.331 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1 1624340083 YYVBVKGCLBTSPO-UHFFFAOYSA-N 434.559 4.094 10 10 IICE CCCCNC(=O)C1(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CCCCC1 1627549889 QPQNYXMYGWJSDG-UHFFFAOYSA-N 437.584 4.185 10 10 IICE COc1ccc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)cc1 1631305250 CMBUFUSEXBLGTF-NRFANRHFSA-N 443.341 4.329 10 10 IICE Cc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1N1CCOCC1 1631459536 QFSQLLWUBKYKRC-UHFFFAOYSA-N 431.536 4.233 10 10 IICE Cc1ccc(C(=O)N(C)CC(=O)Nc2cc(F)cc(F)c2)cc1-n1c(C)cc(C=O)c1C 1632312485 AKMPFISPMLRUQR-UHFFFAOYSA-N 439.462 4.204 10 10 IICE CCN(C(=O)/C=C/[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccc(N2CCOCC2)cc1 1634247968 SWYOVOBMCNXCNF-ZTVSIKPCSA-N 443.588 4.079 10 10 IICE CC(=O)c1ccc(N2CCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CC2)c(F)c1 1637578491 YSTKVGMZBUPWJA-UHFFFAOYSA-N 448.542 4.468 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@H]3CCNC3=O)n2)c(C)n1-c1cccc(C(F)(F)F)c1 1638077627 YLERSFRDZHROQD-HNNXBMFYSA-N 448.470 4.311 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3nc(-c4ccccn4)ccc3=O)c2C)c1 1641305162 MSSREEWKDPFEDU-UHFFFAOYSA-N 430.533 4.318 10 10 IICE COC(=O)[C@H](C[C@@H]1CCCOC1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1643523609 DSFFGWITCSKQQE-JTSKRJEESA-N 438.528 4.256 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)COc3ccc(S(=O)(=O)N(C)C)cc3)c2C)cc1F 1651799479 NFYXUKIYSGXVKD-UHFFFAOYSA-N 444.528 4.054 10 10 IICE COC1(C(F)(F)F)CN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1652684549 SAKOXJLSANTRDW-UHFFFAOYSA-N 431.252 4.260 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](c4cccc(C(F)(F)F)c4)C3)C2)cc1 1687023845 WOPMOBMVVWWCQQ-HKUYNNGSSA-N 433.474 4.492 10 10 IICE Cc1cccc(OCc2nnc(N(C)[C@H]3CCOC3)n2CCCSc2nccs2)c1 1693217577 ZEKLDGZNHUXDLC-KRWDZBQOSA-N 445.614 4.030 10 10 IICE Cc1nc(Cc2nnc(N3C[C@@H](C)[C@H](C)C3)n2CCCSc2nccs2)cs1 1693346876 HQZVSOUYLXLNLE-ZIAGYGMSSA-N 434.660 4.365 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCC[C@](C)(OC)C2)cc1 1710028565 XMDFRZVFCSPBMH-SANMLTNESA-N 448.615 4.164 10 10 IICE CO[C@@H](Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)C(C)C 1711583332 MGOSKIOKZQSBCP-HLAWJBBLSA-N 430.593 4.210 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@H](OC)C(F)(F)F 1727503191 CEJFZZMVNBISJD-SFHVURJKSA-N 425.499 4.045 10 10 IICE CS[C@H](Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1731056168 PSOXMJHFAHTARL-HXUWFJFHSA-N 425.602 4.384 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1)OC 1763437419 NFLBJHHHZNDFSF-WZONZLPQSA-N 437.588 4.250 10 10 IICE C[C@H](c1ccccc1O)N(C)c1ncc(I)cc1Br 1877546429 UQXQGIZNLATEKO-SECBINFHSA-N 433.087 4.352 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCNCc1cc(Br)ccc1O)C(F)(F)F 1913259198 ATPHTSOXSXMMJQ-CYBMUJFWSA-N 427.261 4.090 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)[C@@H](N)c1ccc(N2CCCC2)cc1 1999537238 VRUBYAYSIILFOO-PKTZIBPZSA-N 425.573 4.397 10 10 IICE CCN1CCc2cc([C@@H](N)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044753861 FKTVGWBYPOPDTO-QHCPKHFHSA-N 438.616 4.096 10 10 IICE CC[C@@H](NC[C@]1(C)CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2143387431 OYWSHBIOAQLZNN-OXQOHEQNSA-N 443.382 4.221 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)c1O 2227748773 QKVHZXXLAKLRRB-GJZGRUSLSA-N 429.355 4.089 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3cc(Br)cc(Cl)c3O)C2=O)c1 2293410425 IVBBJLUJUJXTOO-UHFFFAOYSA-N 449.688 4.091 10 10 IICE CCOc1cc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc(Cl)c1O 2297342003 YOOWGBRISIQJBG-UHFFFAOYSA-N 435.263 4.073 10 10 IICE CC(=O)OCCNc1cc(N2C[C@@H](C)C[C@H](C)C2)c2noc3c2c1C(=O)c1ccccc1-3 9641359 AJBURZRJCQBHAX-GJZGRUSLSA-N 433.508 4.497 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459060 RXQBFGRONAKLEI-PNCHPQGNSA-N 428.554 4.258 10 10 IICE COc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3cc(Cl)ccc3O)SC2=S)cc1 15046829 GPTABDIRCDLIAO-VBYYMIJXSA-N 448.953 4.283 10 10 IICE COc1cccc(OC)c1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N1CCc2ccccc21 15780697 QBDHLXOZAPPMAV-HSZRJFAPSA-N 445.563 4.304 10 10 IICE COc1ccc(N2CCn3c(nc4ccccc43)C2)cc1NC(=O)COc1ccccc1C 19855489 OCLIVNSACFSOCT-UHFFFAOYSA-N 442.519 4.391 10 10 IICE CCCN1C(=O)/C(=C/c2c(NC3CCC(C)CC3)nc3ccccn3c2=O)SC1=S 33459293 GTDHXAXEQKPBEF-LGMDPLHJSA-N 442.610 4.296 10 10 IICE CCOc1ccc(N2C(=O)[C@@H]3ON(c4ccccc4)[C@@H](c4ccccc4O)[C@]3(C)C2=O)cc1 36058301 NKXRAMBQNGIYDP-FXSPECFOSA-N 444.487 4.232 10 10 IICE Cc1ccc2nc(N3CCOCC3)c(/C=C3\SC(=S)N(CC(C)C)C3=O)cc2c1 38732295 OQHFYSDWHDENFU-UNOMPAQXSA-N 427.595 4.237 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccc(C)cc4C)c3[N+](=O)[O-])CC2)cc1 40611155 ZGYXWRXIJMKXOJ-UHFFFAOYSA-N 434.500 4.080 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1)N2)N1CCOCC1 226711441 RUTXHTQTSSBPOE-XQBPLPMBSA-N 430.957 4.187 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cc(C)ccc3OC)[C@H]2c2ccc(O)c(O)c2)cc1 526445842 ASQKDDLSEHCMCM-QHCPKHFHSA-N 433.460 4.481 10 10 IICE Cc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(N2CCCC2)n1 683490474 PSHPZBUNEJPPJO-UHFFFAOYSA-N 445.611 4.028 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1 743337066 PBHRGOYIBSJFEB-AEFFLSMTSA-N 428.529 4.104 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 747503846 FTMFMJBGACSVNU-OAQYLSRUSA-N 431.458 4.365 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N(C[C@H]3CCCO3)C3CCCC3)cc2F)C[C@@H](C)O1 749553607 JFYCIUKYUDPMBB-DBXWQHBBSA-N 433.568 4.073 10 10 IICE O=C(NCc1ccc(C(F)F)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 765327256 SKRSXXLCQIIOJW-UHFFFAOYSA-N 428.527 4.156 10 10 IICE COC(=O)[C@H](NCc1cc(C)cc(Br)c1O)c1ccc(Br)cc1 779175067 TWFQTFJYHOCAQC-OAHLLOKOSA-N 443.135 4.230 10 10 IICE CC(=O)[C@@H](C)CCCCC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 783222120 NWBOWMUIXCBODE-RDJZCZTQSA-N 449.503 4.118 10 10 IICE Nc1ccc(N(CC2CCCC2)C(=O)C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1 784109742 XFNNJUXXEAHJNU-UHFFFAOYSA-N 444.539 4.093 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)Nc1nnc(C2CCCCC2)s1 787247568 KANCYELJXBEQAO-UHFFFAOYSA-N 443.617 4.419 10 10 IICE CCn1c(CNCc2ccc(N3CCOCC3)c(F)c2)nc2cc(Br)ccc21 792202040 NBJPLXMWXFGZIB-UHFFFAOYSA-N 447.352 4.084 10 10 IICE C[C@H](NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1)c1ccc(N2CCOCC2)cc1 801001732 PFLPQDMUMIJYGK-QFBILLFUSA-N 425.495 4.348 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 810631807 ODZLPADMGOLVMY-INIZCTEOSA-N 437.993 4.086 10 10 IICE Cc1cc(-c2nnc(N3CCC4(CC3)OCCO4)n2CC(C)C)c(C)n1-c1ccccc1 812211452 YYIVNHMRZHZSGC-UHFFFAOYSA-N 435.572 4.352 10 10 IICE COC(=O)c1cc2ccccc2c(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1O 921056230 YMLQVAMFSSKUCK-UHFFFAOYSA-N 444.531 4.133 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)c1 1165617568 IEXPZOIRPTUMRU-SANMLTNESA-N 429.564 4.296 10 10 IICE CC(C)[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)[C@H](O)c1ccc(Cl)cc1 1251501035 MOEYGNUKAHNBAW-XPWALMASSA-N 447.023 4.066 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](C)c3noc(COC(C)C)n3)c2C)c1 1251572883 JIHWIUPEJSBUEY-QGZVFWFLSA-N 425.533 4.271 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](CCOC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291500475 YCNYLDWQDGRCQK-CTNGQTDRSA-N 443.661 4.256 10 10 IICE O=C(C[C@H]1CCc2sccc2C1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294161602 PMGLQAVQKQLUMW-HUUCEWRRSA-N 434.508 4.270 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1295414496 IWKFCRYFABWHMD-OIBXWCBGSA-N 441.620 4.275 10 10 IICE CC(C)c1nc(CCn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)cs1 1302552252 IUZZKZICQHWSNJ-UHFFFAOYSA-N 448.596 4.429 10 10 IICE CC(C)[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1302762999 WNMPEWVFWIEXEJ-NRFANRHFSA-N 425.621 4.234 10 10 IICE CN1C(=O)CC[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(C(F)(F)F)cc1 1305085104 QOHPMZSNDLVJGU-QAPCUYQASA-N 440.849 4.290 10 10 IICE CCc1nnc(N2CC[C@H](N(C)Cc3ccccc3)C2)n1CCCSc1nccs1 1306138397 DPLPXVHAQKGJER-IBGZPJMESA-N 442.658 4.190 10 10 IICE COc1ccc(N2CCCN(CCCN3CCN(c4ccc(Cl)cc4)CC3)CC2)cc1 1307425009 ZRLFUBSKFPDYPV-UHFFFAOYSA-N 443.035 4.073 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN(CC(=O)OC)Cc1cc(Cl)ccc1O 1307539461 NMJONROGGFFOIE-UHFFFAOYSA-N 449.809 4.009 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCc1ccccc1Cl 1358161752 UTJDGKQKTUPCNP-AQTBWJFISA-N 448.972 4.429 10 10 IICE CC(C)c1nnc(N2CCS[C@H](C)[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1359726479 MYMWGOZVMDTGRE-ZWKOTPCHSA-N 431.675 4.333 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4ccc(F)cc4)o3)cc2F)CC1 1435077759 YECVGBFMCROXFV-UHFFFAOYSA-N 425.479 4.297 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(C(=O)N4CCCC4)C3)cc2Cl)C1 1436047045 JBDWSARENLJMJQ-QUCCMNQESA-N 447.023 4.120 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3F)C2=O)c(C)n1-c1ccccc1 1438303779 MWLFFGASYUIJJD-OAQYLSRUSA-N 439.918 4.351 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-c4ccc(C=O)cc4)cc3)cc2F)CC1 1443594985 ZZUCDNGEQUMLBC-UHFFFAOYSA-N 445.538 4.377 10 10 IICE C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445878778 BWOKVJAXFUYKGT-PBHICJAKSA-N 449.960 4.215 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(c2cccc(Cl)c2)CCCCC1 1447350492 XIBQNSALJBIGJZ-IBGZPJMESA-N 445.943 4.244 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccncc1OCC(F)(F)F 1448429217 LNOULFUKAJBNSQ-UHFFFAOYSA-N 431.414 4.173 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sc4ncccc4c3Cl)cc2F)CC1 1456126435 DXQHIGJMUXLTTA-UHFFFAOYSA-N 432.952 4.161 10 10 IICE Cc1ccccc1-c1nnc(N2CCN(C(C)C)CC2)n1CCCSc1nccs1 1492568758 YKOUPYTVJHNXBO-UHFFFAOYSA-N 442.658 4.423 10 10 IICE CCc1nnc(N(Cc2cccs2)C[C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1498784266 UDBYTJKJWSMAEX-GOSISDBHSA-N 443.592 4.341 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CSCN3C(=O)C(C)(C)C)cc2Cl)C1 1524245942 UGAJMJOFDBPWES-KXBFYZLASA-N 438.037 4.140 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(OCC(C)C)c1 1534308872 IJWHVHVFYFFFFG-ROUUACIJSA-N 444.547 4.413 10 10 IICE Cc1cc(-c2nnc(N3CCCOCC3)n2CCOC(C)(C)C)c(C)n1-c1ccccc1 1542183715 COWWLXCSKORYSF-UHFFFAOYSA-N 437.588 4.394 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1546884247 FQKWGVKOANZHBL-IBGZPJMESA-N 436.604 4.155 10 10 IICE CCCN(C)C[C@@H]1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1547102576 WKSXKULNPLZHAS-FQEVSTJZSA-N 442.627 4.357 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1C[C@H](c1ccsc1)N(C)C 1617940860 SFNMABKPWOKCHT-TZIWHRDSSA-N 441.601 4.226 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(c2cccc(OC(F)(F)F)c2)CC1 1624537610 NJPVUSCRIPSZQP-UHFFFAOYSA-N 434.458 4.112 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN([C@@H](C)c3ccccc3F)C2=O)c(C)n1-c1ccccn1 1624785426 XGXLYCYBLOUBIL-JTSKRJEESA-N 434.515 4.110 10 10 IICE COc1cccc(OC(F)(F)F)c1C(=O)NCc1ccc(N2CCSCC2)cc1 1624892618 LVNCWFUCPBDGMX-UHFFFAOYSA-N 426.460 4.077 10 10 IICE CO[C@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1627005825 GWHFHIYLDCVCDL-NRFANRHFSA-N 433.593 4.002 10 10 IICE Cc1cc(CC(=O)N[C@H](c2cnn(C)c2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1628292083 HPYITMIYLDYZGE-HSZRJFAPSA-N 440.975 4.044 10 10 IICE Cc1c(C(=O)N(Cc2ccco2)Cc2ccccc2O)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 1631142928 ACSAFEFNOYZBTN-UHFFFAOYSA-N 425.397 4.261 10 10 IICE Cc1cccc(NC(=O)N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1631837982 FTZAUNRPOCEVTN-UHFFFAOYSA-N 444.535 4.205 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C2CC2)cc1 1633701022 CSRYVWMOWPAOMR-NRFANRHFSA-N 444.938 4.025 10 10 IICE Cc1cc(C(=O)NC[C@H](N2CCOCC2)C(F)(F)F)c(C)n1-c1ccc(C(C)C)cc1 1634904738 HQBOSMLZZAKXBP-NRFANRHFSA-N 437.506 4.210 10 10 IICE COC(=O)c1ccc2c(c1)CCCCN2C(=O)/C=C\[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1636044039 LSURKXYZNWVSFE-GFBZKKKVSA-N 442.556 4.346 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCC3(OCCO)CCC(C(F)F)CC3)c2C)c1 1639668475 VQHLVGYIROHINH-UHFFFAOYSA-N 434.527 4.335 10 10 IICE CN(C)c1ccc(CNC(=O)CNC2(c3cc(Cl)cc(Br)c3)CC2)cc1 1644344152 CBDOUGMPUYNCDW-UHFFFAOYSA-N 436.781 4.064 10 10 IICE COc1ccc(N2CCN(CCCC(=O)Nc3c(C)cc(C)cc3C)CC2)c(OC)c1 1648084025 CBNMSJLMQKNDOE-UHFFFAOYSA-N 425.573 4.170 10 10 IICE CCOC(=O)c1cc([N+](=O)[O-])c(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1C 1650651774 YEHIGYFTTAAAEC-HOTGVXAUSA-N 445.491 4.445 10 10 IICE COC(=O)COc1ccc(N(C)CC(=O)Nc2ccc(Oc3cccc(C)c3)cc2)cc1 1653257696 CBDZSZPVQKWRBN-UHFFFAOYSA-N 434.492 4.414 10 10 IICE CN(CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)c1ccc(OCc2ccccc2)cc1 1653310885 PHBUJHDDOHOXCP-UHFFFAOYSA-N 449.576 4.380 10 10 IICE CC(C)c1ccc([C@@H](CNC(=O)c2c(F)ccc(O)c2O)NC(=O)OC(C)(C)C)cc1 1654307184 UOPXNSJRKNKDOR-QGZVFWFLSA-N 432.492 4.356 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)CCC1CCN(c2ccncc2)CC1 1673745879 YBBFNZURPKWIPL-OAQYLSRUSA-N 437.632 4.335 10 10 IICE C[C@H](c1ccccc1)N(CC1CCC1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1676126624 TWBPYJSQUBMWGK-HXUWFJFHSA-N 448.611 4.461 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CC[C@H](C(F)(F)F)O3)cc2Cl)C1 1680562817 NGIQWYCJRRUYTR-DDUZABMNSA-N 433.902 4.485 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](NC4CCOCC4)C3)cc2Cl)C1 1682024554 UHTFVIIVACRFOK-NQIIRXRSSA-N 449.039 4.019 10 10 IICE CC(C)[C@H](NC(=O)NCc1ccc(N2CCN(C)CC2)cc1)c1ccc(Cl)cc1F 1686071967 FOOLYOPMWMQKQD-QFIPXVFZSA-N 432.971 4.427 10 10 IICE CCNC(=O)C(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)C1 1695908439 PHSFNVPCAKAWRR-GOSISDBHSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1710026957 UKCVYTHQFANVKK-TZIWHRDSSA-N 441.620 4.070 10 10 IICE CO[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC1(C)C 1712078741 BTSXCAWWNYCNFQ-JKSUJKDBSA-N 437.635 4.020 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H]4OCCC[C@H]4C3)nnc2C(C)(C)C)cc1 1728383681 RDJDCFAKAKEYOQ-RBBKRZOGSA-N 425.621 4.475 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1749981394 GWEWDUCSLSSHPN-DENIHFKCSA-N 429.609 4.050 10 10 IICE Oc1cc(Br)ccc1CN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878724093 XVONLBODLYHWEK-DLBZAZTESA-N 429.280 4.307 10 10 IICE CN1CCc2cc([C@@H](N)c3ccc(I)c(Br)c3)ccc21 2163125485 CPPCXSLPGAHZGW-MRXNPFEDSA-N 443.126 4.094 10 10 IICE Cc1ccc(OCCCOc2cccc(C=C3C(=O)NN(c4ccccc4)C3=O)c2)cc1 2293488657 FUIUMQBZUZFYHV-UHFFFAOYSA-N 428.488 4.304 10 10 IICE O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1cccn1-c1cccc(C(F)(F)F)c1 2294143745 FAOVNSQURIAIKS-UHFFFAOYSA-N 425.366 4.163 10 10 IICE CCOc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(Cc4ccccc4)C3=O)c2C)cc1 2313631462 NQGZTUYYOZLMIK-UHFFFAOYSA-N 443.503 4.155 10 10 IICE CCOc1cc(C=C2SC(=S)N(Cc3ccc(C(=O)O)cc3)C2=O)ccc1OC 2318684012 MMUXCAHMVKWACG-UHFFFAOYSA-N 429.519 4.194 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(O)cc3)C2=O)cc(Br)c1O 2321569865 QMWPXGGCIHWZDR-UHFFFAOYSA-N 438.324 4.275 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccc(O)c(C(=O)O)c3)C2=O)cc1OCC 2321681351 NBTBGIFTVSADRC-UHFFFAOYSA-N 445.518 4.294 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@@H]1[C@@H](NCc1cc(Br)ccc1O)C2 2333987008 NPXSFUXFGZVIHC-NKKGCODLSA-N 425.367 4.326 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380760120 UXIJKLMRQOYTHA-HNNXBMFYSA-N 441.366 4.069 10 10 IICE COc1ccc(/C=C2\C(=O)N(c3ccccc3)C(=S)N(c3ccccc3OC)C2=O)cc1 756249 BJGJCTXTQIUSPJ-CAPFRKAQSA-N 444.512 4.452 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccccc3O)SC2=S)cc1 15047426 UQCZMVXREWAXJQ-FDIDITGRSA-N 428.535 4.019 10 10 IICE COC(=O)CN1C(=O)/C(=C\c2ccc(OCc3ccc(Cl)cc3)cc2)SC1=S 33326994 XEJQTQIOGVWQCY-LICLKQGHSA-N 433.938 4.293 10 10 IICE CC1=NN2C(=N)/C(=C\c3cn(Cc4ccc5c(c4)OCO5)c4ccccc34)C(=O)N=C2S1 34718898 DMORCOAEZZMHMO-QSXRYBJSSA-N 443.488 4.057 10 10 IICE Cn1c(=O)c(C2=NNC(=O)/C2=C/c2c3ccccc3cc3ccccc23)c(O)c2ccccc21 108889490 OVYGFXBMPFWOHL-PXLXIMEGSA-N 445.478 4.468 10 10 IICE CN(C)c1ccc(/C=C\CN2CCC3(CC[C@H](CNC(=O)c4ccccc4)O3)CC2)cc1 210915824 VISLHQDOIJQNOT-CVUHLLMESA-N 433.596 4.209 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3ccc(Br)cc3O)C[C@H]2C1 691426238 HRWMMCJJDQILLC-YQQAZPJKSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCc3ccc(Br)cc3O)CC[C@H]2C1 691426239 HRWMMCJJDQILLC-ZMSDIMECSA-N 425.367 4.280 10 10 IICE COc1ccc(Cl)cc1CNC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743538999 XGLCJHJSFJJNHR-INIZCTEOSA-N 439.890 4.418 10 10 IICE O=C(COC(=O)c1cc(Oc2cccc(Br)c2)ccn1)c1ccc(O)c(O)c1 784152934 FWGCTNNLMZOFGV-UHFFFAOYSA-N 444.237 4.087 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCc2cnn(C(C)C)c2C1 790581505 FFTGZEADYLFBRV-KRWDZBQOSA-N 435.366 4.021 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2cccnc2Br)C1 805933860 YXBPLRORCHTNSP-UHFFFAOYSA-N 442.357 4.309 10 10 IICE COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCc1cc(Br)ccc1O 809713458 QWZQJTHWFXQYQX-LLVKDONJSA-N 427.726 4.324 10 10 IICE CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c1 1136591110 LAPULOFYKLGLEM-GOSISDBHSA-N 439.581 4.110 10 10 IICE CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438452 LCUHNWIHTRYPEJ-PXNSSMCTSA-N 445.947 4.303 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 1230200883 NLGFZIVUIAJBNE-UXHICEINSA-N 446.636 4.328 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC2(C(C)(C)c3ccc(F)cc3)CC2)N(C)C)cc1 1251501401 QOWPHNCDXGXKRN-JOCHJYFZSA-N 426.580 4.304 10 10 IICE COC(=O)c1cc(F)c(COC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(F)c1 1289069679 POIXGRWJQYDYAW-UHFFFAOYSA-N 443.446 4.337 10 10 IICE Cc1cc(C)cc(Oc2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)cc2)c1 1291855816 DQMABSZMTOXADR-UHFFFAOYSA-N 426.494 4.425 10 10 IICE COc1ccc(CN(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1O 1445643429 DSXAWYWTWSGFMS-UHFFFAOYSA-N 444.329 4.238 10 10 IICE Cc1cc(C(=O)N(C)C(C)(C)CN2CCCC2)c(C)n1-c1ccc(Br)cn1 1451855967 BQXRPTPYRKWUPM-UHFFFAOYSA-N 433.394 4.198 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1C[C@@]1(F)c1ccccc1 1452000450 YJONZUSIVABWIC-ZGAMTSKGSA-N 446.594 4.483 10 10 IICE Cc1cc(C(=O)Cn2nnnc2-c2ccccn2)c(C)n1-c1cc(Cl)cc(Cl)c1 1458943979 YWRDYCWESUSHPS-UHFFFAOYSA-N 427.295 4.332 10 10 IICE CCN(CC)C(=O)OC[C@@H]1CCCCN1C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1459855688 MAEZKAHIPNLWKK-QHCPKHFHSA-N 425.573 4.496 10 10 IICE Cc1cc([C@@H]2CCCN2CC(=O)NCc2ccc(N(C)C)cc2)ccc1Br 1460025422 UZHMMBXKHIFVNE-NRFANRHFSA-N 430.390 4.277 10 10 IICE COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1462080704 BCQJHYUVYVQWMY-XMMPIXPASA-N 449.551 4.042 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C\c1ccc2cc(OC)ccc2c1 1466398756 RLEPHAPJPLWTGL-WMZJFQQLSA-N 439.895 4.422 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3ccc(O)cc32)c(C)n1-c1ccc(Br)cn1 1470253668 JZZDSVMYWJOJQY-IBGZPJMESA-N 426.314 4.375 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CCCC2 1515316859 IFBBIUPPFZRWLK-CQSZACIVSA-N 444.528 4.323 10 10 IICE CC(C)C(=O)Nc1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)ccn1 1519552086 SLXOBUIKPCHILD-INIZCTEOSA-N 428.964 4.496 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 1528924700 QNFSTZUMWJWMDH-CVDCTZTESA-N 439.600 4.417 10 10 IICE CC(C)(C)OC(=O)N1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C(=O)C1 1529620647 SVWDXXGGVNXHJQ-UHFFFAOYSA-N 437.500 4.120 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](F)c3ccc(C(F)(F)F)cc3)cc2F)CC1 1530376740 NCVCGFBYOUGQBG-FQEVSTJZSA-N 441.444 4.313 10 10 IICE Cc1cc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)ccc1F 1533210294 MHOYJYPJCPAPRW-HXUWFJFHSA-N 449.526 4.375 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(C(=O)OC(C)(C)C)CCCCCC2)N(C)C)cc1 1537484733 ZVGVABGHQCPUKI-NRFANRHFSA-N 431.621 4.154 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1CO[C@H](CCC(=O)OC(C)(C)C)C1 1540464547 IFCFKVFUIBJCBP-IFMALSPDSA-N 430.589 4.162 10 10 IICE COC(=O)C[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccc(C)cc1 1540467438 UCFKLEIDLGBISI-XMMPIXPASA-N 432.520 4.178 10 10 IICE COc1ccccc1N1C[C@H](C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1=O 1544080459 NDJCPKOPXFINSF-OAQYLSRUSA-N 431.536 4.080 10 10 IICE CCCN(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H](CC)c1ccccc1 1544179878 JPTFHSZFAXOILQ-UPTOSOBMSA-N 449.595 4.290 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)OC2CCCC2)c(C)n1-c1ccc(Br)cc1 1545163333 CKJZPRKRJGGJEX-AWEZNQCLSA-N 433.346 4.461 10 10 IICE Cc1cc(CCNC(=O)[C@H]2[C@@H](CNC(=O)OC(C)(C)C)C2(F)F)c(C)n1-c1ccccc1 1557819298 ZMPQUDOHBNBPFT-WOJBJXKFSA-N 447.526 4.159 10 10 IICE CC(C)(C)OC(=O)NC1(CNC(=O)NCc2cc(Cl)cc(Cl)c2O)CCCC1 1565046464 PQCKQQKZKJGZEU-UHFFFAOYSA-N 432.348 4.336 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(Cc2ccccc2)s1 1566356310 BHLAAPBQFXIUDV-LJQANCHMSA-N 441.984 4.487 10 10 IICE CO[C@@H](C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(Br)s1 1566685786 DXNFPKRTWHRSRR-RDTXWAMCSA-N 440.359 4.112 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)Nc4cc(F)ccc43)cc2Cl)C1 1586081890 JYKINNBSAFBCLC-KSSFIOAISA-N 429.923 4.458 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)c1ccccc1 1596408017 AZYKNRJEEBLZOB-IBGZPJMESA-N 428.330 4.369 10 10 IICE Cc1cc(-c2csc(NC(=O)C[C@@H]3CCC(=O)NC3)n2)c(C)n1-c1ccc(F)cc1 1609791614 IUJGPCRMMXAWCG-HNNXBMFYSA-N 426.517 4.212 10 10 IICE COC[C@H]1CCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)C1 1619698206 AASQEYJSIPHBGK-DLBZAZTESA-N 437.635 4.021 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nnn(-c2ccc(-c3ccccc3)cc2)c1C 1623574700 XWVSTFOXOLQCKH-UHFFFAOYSA-N 433.508 4.364 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1C[C@@H](F)CN1C(=O)OCc1ccccc1 1627209504 FNHZSMQZNVSIAW-FYYLOGMGSA-N 439.531 4.042 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc(I)ccc1N 1628873669 HZZZCJGAQQOVEJ-UHFFFAOYSA-N 449.336 4.136 10 10 IICE Cn1cccc1[C@H]1CCCN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1628950791 LDDIJABERSBDHY-XWALVKJWSA-N 443.569 4.119 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccc(F)cc2)c(O)c1O 1641144652 RDCMNRVXKCJGHT-IEBWSBKVSA-N 444.503 4.068 10 10 IICE O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NCc1c(O)cccc1F 1645048274 NTIAXIMGXGIGCK-UHFFFAOYSA-N 434.496 4.188 10 10 IICE C[C@@H](NC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1)c1ccc(N(C)C)cc1 1671852373 WSCQQDXZZQYQHI-JSNMRZPZSA-N 432.362 4.094 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)[C@@H](C)C3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1692981471 GUIPDWOCPCASIB-OALUTQOASA-N 448.615 4.217 10 10 IICE CCOCc1nnc(N2CC=C(C(F)(F)F)CC2)n1CCCSc1nccs1 1710670056 IYNIBTUFPSJTQD-UHFFFAOYSA-N 433.525 4.152 10 10 IICE CSC[C@@H]1CCCN1c1nnc(-c2ccccn2)n1CCCSc1nccs1 1731092715 SRQABAMLQWLFCG-HNNXBMFYSA-N 432.644 4.311 10 10 IICE CC(C)c1nnc(N(C)CCc2nccs2)n1Cc1ccc(N2CCSCC2)cc1 1760900302 YMDNJROEKJEIGS-UHFFFAOYSA-N 442.658 4.138 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnn(C)c2)nnc1N1CCC(Cl)=C(Cl)C1 1761697315 BZNWUXHYEYLKBE-UHFFFAOYSA-N 446.386 4.001 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](CNC(C)=O)C1 1764371309 KUCINAODRHUDKX-OAQYLSRUSA-N 434.588 4.115 10 10 IICE CNc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)c(Nc2ccccc2)c(F)c1N 1858181488 UIFFDINVTYFFAN-UHFFFAOYSA-N 449.530 4.164 10 10 IICE Cc1cccc(OCCOCCOc2ccc(C=C3SC(=S)N(C)C3=O)cc2)c1 2297306589 RIZCQGMWLVLNGM-UHFFFAOYSA-N 429.563 4.300 10 10 IICE CCN1C(=O)/C(=C2/SC(=S)N(CC(C)C)C2=O)c2cc(Br)ccc21 2509011 RKGYEWVICRHMSD-BUHFOSPRSA-N 425.373 4.043 10 10 IICE CCOC(=O)[C@H]1CCCN(c2cc(N3CCCC3)c3noc4c3c2C(=O)c2ccccc2-4)C1 9642145 QQFXHJOCYHWPFO-INIZCTEOSA-N 445.519 4.419 10 10 IICE Cc1ccsc1[C@H]1Nc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2[C@H]2C=CC[C@H]21 14456145 TVZJABPZMJNSFD-JWVYWZTKSA-N 430.595 4.340 10 10 IICE O=C(COc1cccc(/C=C2\SC(=S)NC2=O)c1)Nc1cccc(C(F)(F)F)c1 15056014 SYWUUCXCIDXZGO-NVNXTCNLSA-N 438.452 4.212 10 10 IICE CCOC(=O)c1cccc(N2C(=O)/C(=C/c3ccc(O)c(OCC)c3)SC2=S)c1 40859642 LAXHLUCSENTDCD-WQRHYEAKSA-N 429.519 4.373 10 10 IICE CCOC(=O)C1=C(C)Nc2nc(SCc3ccccc3)nn2[C@@H]1c1ccc(N(C)C)cc1 54642414 RWAFMQCEDFJDBF-OAQYLSRUSA-N 449.580 4.488 10 10 IICE CCOC(=O)[C@H]1CCCN([C@@H]2CC(=O)N(c3ccc(/N=N\c4ccccc4)cc3)C2=O)C1 100712839 XMVWGUNIZDVFBX-PXZDZVMLSA-N 434.496 4.009 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)C(C)(C)C(=O)N4C)cs2)c(C)c1 170549580 XQHSPIDZHJOIBC-UHFFFAOYSA-N 441.578 4.482 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCCC(=O)c3ccccc3)cc2F)CC1 730286630 SJYYFVYNELFZNW-UHFFFAOYSA-N 425.548 4.027 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCCCSc2nccs2)C[C@H]2CCCC[C@H]21 733975016 VIWPXQCYGWEGMD-OAGGEKHMSA-N 425.620 4.310 10 10 IICE CN(C)c1ccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 742800334 ITWWKDAVAAVBOH-VOQZNFBZSA-N 429.511 4.243 10 10 IICE CN1CC[C@@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)[C@@H]1c1ccc(Cl)cc1 760305229 CRZOPVFKDSELBZ-YADHBBJMSA-N 445.032 4.138 10 10 IICE Cc1nccn1-c1ccc([C@@H](C)NC(=O)NCc2cccc(Br)c2O)cc1 765538414 PLAQEVKYRUHMRV-CYBMUJFWSA-N 429.318 4.209 10 10 IICE Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 766595703 KEGDICXWNWQUPJ-ULQDDVLXSA-N 445.583 4.260 10 10 IICE COc1cccc(CNC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c1O 767945445 PXTAVHKRIBJING-UHFFFAOYSA-N 442.541 4.166 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccc(F)cc3NC(=O)c3ccoc3)c2)CC1 771637672 SEOJTOPTAWKTRX-UHFFFAOYSA-N 436.487 4.065 10 10 IICE Cc1cc(Br)cc(CN2CCC(C(=O)N3CCc4ccccc43)CC2)c1O 775665223 ZYIYFHAYLKVYHN-UHFFFAOYSA-N 429.358 4.264 10 10 IICE COc1cc(N2CCN(C(=O)[C@@H](CCc3ccccc3)C(C)C)CC2)cc(OC)c1OC 816100946 ZUTRBHPMRHZUKQ-QFIPXVFZSA-N 440.584 4.266 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CNC(=O)c2ccccc2C)cc1 842897959 NCCXSEZPOWOWCW-UHFFFAOYSA-N 431.536 4.033 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 919968564 IDXDSRNRPAVSMR-HNNXBMFYSA-N 437.367 4.286 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N[C@@H]1CCCC[C@H]1c1ccccc1 920052133 ZKBHVJDVKGVKOC-JTHBVZDNSA-N 425.548 4.312 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@](C)(Cc3ccccc3)C(C)C)CC2)cc1 1124585734 RNJMCJGHYXKFRD-MHZLTWQESA-N 437.628 4.229 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)nn1-c1ccc(Br)cc1 1125534535 LCHYNZSRUDVBKI-UHFFFAOYSA-N 431.309 4.078 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](Oc3ccc(Cl)cc3)C(C)C)cc2F)CC1 1125906891 DPZWEBPWIFCAJO-HSZRJFAPSA-N 447.982 4.341 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@@H](NC(=O)OC(C)(C)C)c3ccccc3)C2)cc1 1130826629 FREKVZGAXVJWCJ-DENIHFKCSA-N 439.556 4.046 10 10 IICE Cc1cc(C(=O)Nc2cc([C@@H]3CCCO3)nn2C)c(C)n1-c1ccc(Br)cn1 1156880387 IUSRERFNVATZKM-KRWDZBQOSA-N 444.333 4.089 10 10 IICE O=S(=O)(c1ccc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1)C(F)F 1162436737 APUUWCGQTNUFNT-INIZCTEOSA-N 430.904 4.118 10 10 IICE COc1ccc(N(CC(=O)NCc2cc(F)cc(F)c2)Cc2ccccc2)cc1OC 1177022903 VSRBOPHDIIGRRS-UHFFFAOYSA-N 426.463 4.305 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@H]3CCC4(CCOCC4)O3)cc2Cl)C1 1235832794 GWWQRMVJFAHJAN-PKOBYXMFSA-N 435.996 4.104 10 10 IICE COc1ccc(CNC(=O)N[C@@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)c(O)c1 1253016127 GDPGFMLJFMUAFY-LJQANCHMSA-N 427.501 4.235 10 10 IICE CCN(C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)C(C)(C)C 1274138227 PSVBJKQSKQMSCZ-GXDHUFHOSA-N 441.416 4.297 10 10 IICE CC1CCN(c2ccc(CNC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(F)F)cc2)CC1 1293146439 UWYCBFRKESSQPG-GOSISDBHSA-N 425.520 4.088 10 10 IICE COC(=O)[C@@H](Cc1ccncc1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1298477562 QIXXQTZJDBWZMY-JOCHJYFZSA-N 431.496 4.077 10 10 IICE CC[C@H](C)CN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1305585622 KRQJIVHDVSUOHJ-SFHVURJKSA-N 431.600 4.373 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)C[C@H](C)O1 1306397389 MLWFEHFXJZMOFP-RXVVDRJESA-N 437.588 4.127 10 10 IICE CCN(C)c1ccc(CN2CCN(C(=O)[C@H](C)Oc3ccc(C)cc3Cl)CC2)cc1 1307491417 WWKQSIZUOHPFQE-IBGZPJMESA-N 429.992 4.216 10 10 IICE O=C(CCc1cc(F)ccc1[N+](=O)[O-])NC1CCN(c2ccc(OC(F)F)cc2)CC1 1360045884 VOKXVMSUUUVHHX-UHFFFAOYSA-N 437.418 4.053 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4cccc(Cl)c4nc3C)cc2F)CC1 1360093416 DNXKDEFNABZMFE-UHFFFAOYSA-N 440.950 4.408 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccn1 1361098324 QVXIYBGRRDUNGV-UHFFFAOYSA-N 432.597 4.385 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(-c4ccc(C(C)=O)cc4)o3)CC2)c(OC)c1 1438187434 QOHAMZFXUPIYOQ-UHFFFAOYSA-N 434.492 4.129 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@H](c2ccccc2Br)C1 1442669759 SFRJQXJVYVRHIE-INIZCTEOSA-N 434.311 4.289 10 10 IICE COc1ccc(Cn2ccc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)n2)cc1 1448058260 RJKLQOXFHGHFQP-UHFFFAOYSA-N 442.519 4.341 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@]3(C)CC(c4cccc(Cl)c4F)=NO3)C2)cc1 1452033527 UPVYCOKLYURBFD-WNSKOXEYSA-N 445.922 4.014 10 10 IICE Cc1cc(C(F)F)n2ncc(C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)c2n1 1456083395 GZKJLKCSHGSEJW-UHFFFAOYSA-N 441.404 4.246 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)c(C)c1 1473006844 DCPURSZVWQERED-AREMUKBSSA-N 447.510 4.500 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC(C)(C)C1 1512379767 OICUONMZBCHFKA-IBGZPJMESA-N 425.621 4.333 10 10 IICE COC[C@H](F)Cn1c(-c2cc3c(s2)CC[C@H](C)C3)nnc1N(C)Cc1ccccc1O 1518748331 YPPCXUYRLFJVJX-MAUKXSAKSA-N 444.576 4.458 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c1 1521156294 JIHBZJJSLYAALK-UHFFFAOYSA-N 449.935 4.389 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN(C)c1ccc(C(F)(F)F)cc1C=O 1542170264 SWRLTUDIEXGBJC-UHFFFAOYSA-N 435.490 4.457 10 10 IICE CC(=O)c1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)ccc1OC(C)C 1542285241 INKZWERWGUQSQZ-UHFFFAOYSA-N 435.568 4.461 10 10 IICE CCC[C@H](Cn1c(C2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1546911630 HWXCOOQTGAVCTR-HXUWFJFHSA-N 445.583 4.225 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1547545943 NLYAVLJTSRFCSM-OAQYLSRUSA-N 443.661 4.182 10 10 IICE Cc1ccc(C(=O)N[C@@H](COC(=N)O)Cc2ccccc2)cc1-n1c(C)cc(C=O)c1C 1557030828 PROVRWLLHXITJJ-JOCHJYFZSA-N 433.508 4.066 10 10 IICE CN(C(=O)CSc1ccccc1C(=O)NCc1c(O)cccc1F)C1CCCCC1 1558455220 JXKJXXDSNAYOMG-UHFFFAOYSA-N 430.545 4.345 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H](COc4ccccc4Cl)C3)C2)cc1 1565055634 HSAHMMABFJJNFS-MOPGFXCFSA-N 443.975 4.428 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1ccc(N2CCCCC2=O)cc1 1583314467 ABAOCNILQDKZGA-UHFFFAOYSA-N 429.520 4.354 10 10 IICE CCc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)ccc1Br 1586864219 FIZKWFIXRWBEMW-UHFFFAOYSA-N 435.337 4.042 10 10 IICE COC(=O)[C@]12CCC[C@H]1CN(C(=O)c1cc(C)n(-c3ccccc3Br)c1C)C2 1589661892 OLLNTINFSVEVQU-AOMKIAJQSA-N 445.357 4.272 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])cc1 1597748190 WVYFYENEAAUSFY-UHFFFAOYSA-N 439.899 4.370 10 10 IICE CC(C)c1nnc(N2C[C@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1612891695 BSKNEYKYTOUZLY-HDICACEKSA-N 431.675 4.333 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1615381863 GWKVTUXPCWGZDB-QHCPKHFHSA-N 448.615 4.020 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN(Cc3ccccc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1616214704 HRLFIQMKKKPBHF-WOJBJXKFSA-N 441.591 4.356 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1C1CCOCC1 1620753641 LNILVXPONJKAMP-GOSISDBHSA-N 447.526 4.457 10 10 IICE O=C(C[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1)NCc1ccc(F)cc1 1627502092 GBXXWSUWZYXRLG-OAHLLOKOSA-N 442.512 4.010 10 10 IICE Cc1ccc(N(CCC(=O)N[C@H](C)c2ccccc2O)S(=O)(=O)c2ccccc2)cc1 1632246945 NZKGSYZFZYUQRS-LJQANCHMSA-N 438.549 4.163 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C 1634938251 CPRLBPUZXXUFFM-QGZVFWFLSA-N 425.566 4.358 10 10 IICE CCc1cc(N2CCC(NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)ncn1 1635315087 LSCDSCBCRABNNQ-UHFFFAOYSA-N 437.975 4.499 10 10 IICE Cc1cc(C(=O)Cn2cncc(Br)c2=O)c(C)n1-c1ccc(F)c(Cl)c1 1643749997 UQBXDSDGJWUPSJ-UHFFFAOYSA-N 438.684 4.089 10 10 IICE CC[C@](O)(CCC(F)(F)F)CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1645753535 KDCYWXWUVRGPGA-NRFANRHFSA-N 426.479 4.129 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H]3CC[C@H]2[C@H](C)C(=O)C3)sc(C)c1-c1ccccc1 1648020220 PTHAQWLGQHUJSK-WBAXXEDZSA-N 440.565 4.281 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CCC2)[C@H]2CCOC2)c(C)n1-c1ccc(Br)cn1 1648998445 GTQVTDBNGVLCJH-JXFKEZNVSA-N 432.362 4.187 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@@H]2c2cc(F)cc(Br)c2)cc1 1658168950 MUHLTAGSPQXXQR-HXUWFJFHSA-N 434.353 4.108 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(C)CCCOc3ccc(Cl)cc3)C2)cc1 1673823255 NBSGQHVKBSVASP-SFHVURJKSA-N 431.964 4.285 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@@H](C)C1)OC 1694370416 SOBDPFFSXUYEGW-CNNODRBYSA-N 437.588 4.391 10 10 IICE CC[C@]1(C)CCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1694431962 JIFAMHHXZLEAJR-YADARESESA-N 429.609 4.051 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc([C@H](C)OCCOC)n1Cc1ccc2c(c1)CCCN2C 1694821300 FLRRTKULUKPAQO-XQBPLPMBSA-N 441.620 4.058 10 10 IICE CCCN(CCC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1695331665 MCEFWZUVHNWQNS-QFIPXVFZSA-N 427.593 4.031 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1COCCO1 1708575476 XIDQDLRAWFNCLO-AVRDEDQJSA-N 437.588 4.250 10 10 IICE CCc1nc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)cs1 1709002630 XOCUKDLGZJDRRS-UHFFFAOYSA-N 440.960 4.403 10 10 IICE COC[C@@H]1CCCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1730547507 UIIYKIBCILDONV-NFBKMPQASA-N 441.620 4.195 10 10 IICE CC[C@H](C)[C@H](Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O)OC 1743537826 ISGCHQGJBFDCQF-YWZLYKJASA-N 429.590 4.037 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCCN1CC 1743727120 YZQQCVRCWLTXPC-RBBKRZOGSA-N 440.636 4.001 10 10 IICE COC(=O)C1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)CC1 1748313900 FTTBVNRSVSCNRV-UHFFFAOYSA-N 439.604 4.076 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2C[C@@H]2CCOC2)c(C)n1-c1ccccc1 1751409417 BRAHBWYNNBXQEE-SFHVURJKSA-N 429.515 4.481 10 10 IICE CCC(C)(C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1752496462 WSKHJANTYPLWLM-UHFFFAOYSA-N 434.588 4.249 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C)nnc1N(Cc1cccs1)C[C@@H]1CCCO1 1761698118 RMEBSKSPSHEEAF-NRFANRHFSA-N 425.602 4.256 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1767968834 RLBBUIOJBXXVMK-UHFFFAOYSA-N 425.602 4.331 10 10 IICE COc1ccc2[nH]cc(C=C3C(=O)Nc4ccc(NC(=O)CCN5CCCCC5)cc43)c2c1 1903855622 INQUULPXCZAKMS-UHFFFAOYSA-N 444.535 4.484 10 10 IICE CN1CCCc2cc([C@H](N)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536841 POLFJUGGVPLYBW-GMAHTHKFSA-N 425.573 4.179 10 10 IICE CC[C@H](CN(C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2)NC(=O)OC(C)(C)C 2053100095 LKVDIWSEQXPBSM-MRXNPFEDSA-N 448.608 4.302 10 10 IICE COc1ccccc1OCCCOc1c(C=C2SC(=S)NC2=O)cccc1OC 2293500611 ZIZHCVWSEXYVGB-UHFFFAOYSA-N 431.535 4.041 10 10 IICE COc1cc(C=C2SC(=S)N(CCCC(=O)Nc3ccc(F)cc3)C2=O)ccc1O 2314831327 INOPYHOYXKNSQH-UHFFFAOYSA-N 446.525 4.160 10 10 IICE CCCCOCCCN1C(=O)C(=Cc2cc(OC)c(OC)c(OC)c2)SC1=S 2323744086 WAEUSBZPVWBSRV-UHFFFAOYSA-N 425.572 4.120 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N([C@@H](CC(C)C)C(=O)O)C3=O)n12 2323812778 HTSTXLPCQHOXMB-JTQLQIEISA-N 429.976 4.058 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]3CCC[C@@H]23)c(O)c1Br 2352679347 IZKRGAUKCKENQN-ARFHVFGLSA-N 425.367 4.341 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2 20754787 ZMAAHQOQRSBLTG-JEBQKTDQSA-N 428.529 4.110 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3ccccc3F)nc3c(C)cccn3c2=O)SC1=S 39835986 IEVDXUZRBLFZPK-LFIBNONCSA-N 441.509 4.155 10 10 IICE Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(OCCN(C)C)c1 435873481 DJMLHZMUBSBLGY-UHFFFAOYSA-N 448.611 4.295 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@H]2CN(Cc4ccccc4)C[C@@H]32)c(Br)c1 705882441 JDAPJTRHTHXLKY-AQCRLBJHSA-N 426.402 4.255 10 10 IICE Cc1ccc(/C=C/C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(Br)c1 749407274 ULRMWYLUSIIOGQ-FNORWQNLSA-N 447.348 4.187 10 10 IICE O=C(CCCc1c[nH]c2ccccc12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768532450 GFRFTKUHPRCFOL-UHFFFAOYSA-N 430.596 4.339 10 10 IICE CC[C@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1cc(Br)ccc1O 775497141 NDURYDJVAKYJLB-PXAZEXFGSA-N 427.364 4.328 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1ccc(Cl)cn1 775830581 IVXYMQKFFGHLEO-DHDCSXOGSA-N 437.999 4.094 10 10 IICE CCC(CC)[C@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 778748802 MMMAJIJMDGVYLK-UKILVPOCSA-N 442.648 4.002 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Nc3cc(-c4ccsc4)nn3C)cc2F)C[C@@H](C)O1 786189228 FDVNVRLASGFVMD-HUUCEWRRSA-N 443.548 4.223 10 10 IICE COc1ccc(N2CCC(N[C@@H](C)c3c[nH]ccc3=NC(=O)OC(C)(C)C)CC2)cc1 796743962 KDLWQOYPNNQDMJ-KRWDZBQOSA-N 426.561 4.179 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nccn3CC(F)(F)F)cc2Cl)C1 799919554 QVULVIGPLMBYOF-CQSZACIVSA-N 443.901 4.335 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)s1 810631808 ODZLPADMGOLVMY-MRXNPFEDSA-N 437.993 4.086 10 10 IICE CC(C)Cn1cc([C@H]2N(Cc3cc(Cl)cc([N+](=O)[O-])c3O)CC23CCOCC3)cn1 849477656 ALCFZVGMRVIENO-HXUWFJFHSA-N 434.924 4.160 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2c(Cl)cccc2Br)N(C)C)cc1 1134686550 OIQLQBWOTWXMAR-LJQANCHMSA-N 438.797 4.130 10 10 IICE CN(c1ccc(CNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)cc1)C1CCCCC1 1136446398 HFLLHBQOQKAAGX-VWLOTQADSA-N 439.575 4.284 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(Br)nc3O)cc2Cl)C1 1139139546 WJVXPUGYYKERER-GFCCVEGCSA-N 438.753 4.369 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c(C)n1-c1ccccc1Br 1150029418 FCFOLUCHLQIWSV-YLJYHZDGSA-N 430.390 4.413 10 10 IICE CCO/C=C\[C@](O)(CNC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)C(F)(F)F 1159754012 VYLWGMOWYONVMH-VJIACCKLSA-N 430.854 4.321 10 10 IICE COc1ccc([C@H](NC(C)C)C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1 1160693031 LKWYCHMOSNIZLP-QFIPXVFZSA-N 447.526 4.121 10 10 IICE CCOC(=O)[C@]1(F)CN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC12CCC2 1166337759 NODGGBPJPNLHAH-RUZDIDTESA-N 440.515 4.113 10 10 IICE O=C(CSCC(=O)OC1CCCCC1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1189204887 BZKYKVSJJGHCAF-UHFFFAOYSA-N 437.517 4.010 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCC3(c4cccc(F)c4F)CCCC3)cc2)CC1 1226270538 LJRPBRCFLKQCQA-UHFFFAOYSA-N 442.554 4.028 10 10 IICE C[C@H](NC(=O)[C@@H]1CCc2cc(Br)ccc21)c1ccc(N2CCOCC2)cc1 1264822419 QEDYRHODKRNNFX-YCRPNKLZSA-N 429.358 4.193 10 10 IICE Brc1cc(CN2CCCN(C[C@H]3CCCO3)CC2)ccc1N1CCCCC1 1308649777 XHKXEFHFPVTHJU-HXUWFJFHSA-N 436.438 4.126 10 10 IICE Cc1cc(CNC(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)c(C)n1-c1ccccc1 1313132456 NMXCUQNZLXNIHO-UHFFFAOYSA-N 436.600 4.274 10 10 IICE CCOc1ccc(C[C@H](C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1357834735 AQOZSLAVXZBTHV-GBESFXJTSA-N 428.548 4.333 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(F)(F)F)C2)c(C)n1-c1ccc(Br)cc1 1444406673 JAWGUBSFPMRRDM-MRXNPFEDSA-N 431.252 4.260 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCOC1)OC 1497193684 OCSJKPXOFORIIM-IRLDBZIGSA-N 437.588 4.250 10 10 IICE CN(CCCCCO)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1517288731 POBYVIIBTRTKIN-UHFFFAOYSA-N 445.677 4.067 10 10 IICE CC(C)(C)c1cccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)c1 1526481568 PZVITGCECMKGDM-UHFFFAOYSA-N 447.558 4.170 10 10 IICE CCC(CC)(CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)SC 1533115292 HFEPHUTXOCEVTP-FOWTUZBSSA-N 440.631 4.455 10 10 IICE COc1cccc(Oc2ccc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)nc2)c1 1535558681 PIDNYKZLMKBANL-GOSISDBHSA-N 433.508 4.210 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2ccc(Br)c(F)c2)cc1 1542488678 LIAGBMCALRYHFZ-LJQANCHMSA-N 449.364 4.405 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)[C@@H](C)C1 1545187511 GIWXHXVPXIJXFU-IBGZPJMESA-N 448.615 4.456 10 10 IICE CCO[C@@]1(c2nnc(N3CC[C@@H](CC)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1547892602 KUVAMMCBYRIVDN-NLFFAJNJSA-N 441.620 4.061 10 10 IICE CCc1c(C(=O)NCc2cccc(Br)c2O)cnn1-c1cccc(Cl)c1 1556480527 VQYXQSGCRAWSSR-UHFFFAOYSA-N 434.721 4.486 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 1564945564 RMPYCHSPPNEGKU-GOSISDBHSA-N 432.559 4.044 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)Cc1ccc(O)cc1 1565616415 HFEQMDYENVZQDM-GOSISDBHSA-N 440.927 4.215 10 10 IICE Cc1c(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)[nH]c2c1C(=O)CC(C)(C)C2 1566356346 CGJDDRYGBQFSDO-KRWDZBQOSA-N 443.975 4.232 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCCN(C(=O)Oc2ccccc2)CC1 1606615217 BWHRUKCDFKBJKY-UHFFFAOYSA-N 445.519 4.254 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(F)(F)c2ccccc2Br)N(C)C)cc1 1616858988 XSRVCZFUGNVFOT-GOSISDBHSA-N 440.332 4.026 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(Cl)c2c(c1)OCCO2 1618427458 PYNVQUPZHFNHHM-UHFFFAOYSA-N 446.931 4.113 10 10 IICE Cc1ccc(C(=O)Nc2cccc(CN3CCN(C)CC3)c2)cc1-n1c(C)cc(C=O)c1C 1631008940 GCIFGGPQGPNSQQ-UHFFFAOYSA-N 444.579 4.215 10 10 IICE Cc1cc(C(=O)Nc2n[nH]c3nc(O)ccc23)c(C)n1-c1ccccc1Br 1636841462 FEVZKCDQJZSBMN-UHFFFAOYSA-N 426.274 4.086 10 10 IICE CCCCc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n[nH]1 1639307816 GKMMBMDWQIKZCV-LFIBNONCSA-N 432.546 4.121 10 10 IICE COc1ccc(N2CCCN(CC(=O)NCC3(c4ccccc4)CCCCC3)CC2)cc1 1644371412 RNUCGNYKJAFQJF-UHFFFAOYSA-N 435.612 4.226 10 10 IICE Cc1cc(C(=O)NCCc2ccc(O)c(CO)c2)c(C)n1-c1cccc(Br)c1 1651175774 MDBIQJWNLFBOEY-UHFFFAOYSA-N 443.341 4.027 10 10 IICE CCOC(=O)C[C@H](SCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)C(=O)OCC 1651961781 SQNXLCNIVZSSFU-FQEVSTJZSA-N 435.517 4.034 10 10 IICE CCOC(=O)c1c(NC(=O)CNC(C)(C)C(=O)OC(C)C)sc(C)c1-c1ccccc1 1655829889 JSEJDDDXYWRZQG-UHFFFAOYSA-N 446.569 4.159 10 10 IICE CCc1nnc(N2CCC[C@H](CN3CCC(C)CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1709112411 IGJFTSLXXRIONZ-OAQYLSRUSA-N 442.627 4.042 10 10 IICE CCOCc1nnc(N(C)Cc2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1710648549 PBOWGSRQNIEJEV-UHFFFAOYSA-N 434.588 4.131 10 10 IICE Cc1cc(-c2nnc(N(C)C3CC3)n2CC[S@@](=O)C(C)(C)C)c(C)n1-c1ccccc1 1742118319 ZWTUUAYOWDWOQA-WJOKGBTCSA-N 439.629 4.498 10 10 IICE CC(C)c1nnc(N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1763061325 ZCWZWMHYMPPASZ-CHWSQXEVSA-N 435.541 4.196 10 10 IICE COc1ccc(N2CCN(c3nnc(C)n3C[C@H](C)Cc3cccs3)CC2)cc1F 1770258818 QJOMDFGPXLAEPW-MRXNPFEDSA-N 429.565 4.001 10 10 IICE COc1ccc(CCCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1OC 1868167910 GQESCIFQDYLGGS-UHFFFAOYSA-N 429.472 4.441 10 10 IICE C[C@@H]1N(Cc2ccccc2)CC[C@]1(CN)N(C)c1ccc(CNC(=O)OC(C)(C)C)cc1 2074363238 CEGCWJOHXOMUQW-RXFWQSSRSA-N 438.616 4.139 10 10 IICE COc1cccc(Cn2nc(C3CCC3)c(C(F)F)c2I)c1O 2079744410 BLFDQXAZPQEDIX-UHFFFAOYSA-N 434.224 4.455 10 10 IICE COCCNCc1ccc(N(C)[C@H]2CC[C@H]2OCc2ccccc2)c(Br)c1 2156439600 XNIGBJLNVXXOKK-FCHUYYIVSA-N 433.390 4.369 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cc(Br)cc(F)c3O)C[C@@]2(C)C1 2172909933 QZNOVLDYDSZTNA-KPHUOKFYSA-N 443.357 4.419 10 10 IICE CC(C)C1=NN2C(=N)C(=Cc3ccccc3OCCOc3ccccc3)C(=O)N=C2S1 2297307209 KATIHWFLTCUOAE-UHFFFAOYSA-N 434.521 4.420 10 10 IICE O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(Cl)cc1Cl 2297314395 MUILFSHWWWHGIW-UHFFFAOYSA-N 440.080 4.422 10 10 IICE COc1ccc(Cl)cc1-n1cccc1C=C1C(=N)N2C(SC)=NSC2=NC1=O 2297346784 CIJMYVNVRWKFLQ-UHFFFAOYSA-N 431.930 4.079 10 10 IICE Cc1ccc(CNC(=O)CC[C@@H](C)CNC(=O)OC(C)(C)C)c(O)c1Br 2352943400 SRGUCDLGVJCTBT-GFCCVEGCSA-N 429.355 4.020 10 10 IICE CCC1(C(=O)NCc2ccc(C)c(Br)c2O)CC(NC(=O)OC(C)(C)C)C1 2380753609 HYBLCXIMZBCHJK-UHFFFAOYSA-N 441.366 4.163 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccccc3CC)=NC2=O)ccc1OCC(=O)O 16916138 GEHQRPLFDBRQOC-XDHOZWIPSA-N 426.494 4.194 10 10 IICE CCC1=NN2C(=N)/C(=C/c3ccccc3OCCOc3ccc(C)cc3)C(=O)N=C2S1 27531182 JPZZPWYIOXKZBU-ZUGBYVCQSA-N 434.521 4.482 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C/c1ccccc1[N+](=O)[O-] 33315618 XWTWHVUXSIIEFL-XNTDXEJSSA-N 428.828 4.134 10 10 IICE CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)NN(c4ccc(Cl)cc4)C3=O)o2)cc1 33924680 IIOQAGZRAJGCPI-CPNJWEJPSA-N 436.851 4.238 10 10 IICE COC(=O)Cc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526625608 UFPKBYWBIDYHAP-QHCPKHFHSA-N 449.434 4.010 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc(Br)cc([N+](=O)[O-])c1Cl 750841373 COYGXVCVTIBRGE-UHFFFAOYSA-N 440.681 4.100 10 10 IICE Cc1nccn1-c1ccc([C@H](C)NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 754925968 MFIRQXCKOMKUDM-FDDCHVKYSA-N 434.540 4.338 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1noc(-c2scnc2C)n1 760238886 FBSZLEFNJDJPKG-UHFFFAOYSA-N 441.538 4.448 10 10 IICE COc1ccc(CCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1Cl 768544098 PCKMOPUCXDXZRT-UHFFFAOYSA-N 442.003 4.130 10 10 IICE COC(=O)[C@@H](NCc1cc(C)cc(Br)c1O)c1ccc(Br)cc1 779175059 TWFQTFJYHOCAQC-HNNXBMFYSA-N 443.135 4.230 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COc2ccc(Cl)cc2C1 1126582290 LAJRYRNFKJVWSP-DOTOQJQBSA-N 436.886 4.278 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C[C@@H]3C(=O)Nc4c(F)cccc43)cc2Cl)C1 1128490518 UBUWFZDVQZAXCY-YOEHRIQHSA-N 429.923 4.458 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCCc3ccc(Br)cc3)C2)cc1 1129992941 CCEQTIAHEFQGKI-SFHVURJKSA-N 431.374 4.423 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H]2CS(=O)(=O)Cc3ccccc32)c1 1131318113 WUXHDIXFDFXNHJ-NRFANRHFSA-N 428.941 4.147 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@]1(c2ccccc2)CCC(=O)NC1 1137816625 MVKVIWBZMKXQPS-CCLHPLFOSA-N 428.532 4.330 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccc(F)c(F)c1O 1141877090 DNEFQIJPJCBCDE-LCYFTJDESA-N 440.518 4.352 10 10 IICE Cc1cc(C(=O)N[C@@H](C(=O)OC(C)(C)C)c2ccnn2C)c(C)n1-c1ccc(Cl)cc1 1164516152 MIGHCQWOJDOMMV-HXUWFJFHSA-N 442.947 4.294 10 10 IICE COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1234325364 CVEOHEKMUXIVAV-OAQYLSRUSA-N 437.462 4.040 10 10 IICE COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NCc2ccc(N(C)C)cc2C)c1 1265094327 UYPVMKWSIVJASB-UHFFFAOYSA-N 428.426 4.279 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1CC(F)(F)C1 1301683643 QAUKJUQXRLNDJY-UHFFFAOYSA-N 429.515 4.481 10 10 IICE CCn1cnc2c1CCN(C(=O)c1cc(C)n(-c3ccccc3Br)c1C)C2 1304002183 MWRHZKGJQANTHY-UHFFFAOYSA-N 427.346 4.272 10 10 IICE CC(C)(C)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1Cl 1355064590 KJVCRXDWFGBFDS-GOSISDBHSA-N 427.976 4.269 10 10 IICE C[C@H](NC(=O)c1cc(Br)cnc1C1CC1)c1ccc(N2CCOCC2)cc1 1434913410 ZBAMRUHWVUPKHY-AWEZNQCLSA-N 430.346 4.049 10 10 IICE COc1ccc(N2CCN(CCNC(=O)Cc3ccc(C4CCCCC4)cc3)CC2)cc1 1442477109 VPBPAUKUOBUEMX-UHFFFAOYSA-N 435.612 4.224 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Cc1ccc(O)cc1 1443460238 LVLZFXKQLKDWHH-NRFANRHFSA-N 434.536 4.178 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)c1 1465375383 XJFNWBCHSFNIFI-QFIPXVFZSA-N 449.938 4.485 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c(C)n1-c1ccccc1Br 1467747974 ZKCXTDICARWTFI-YHEJKZAPSA-N 447.373 4.265 10 10 IICE CC(C)CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCCC1 1473127276 CVGIIHHFWDBKDX-BGYRXZFFSA-N 433.612 4.346 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H](c3ccc(F)cc3)CC2)N(C)C)cc1 1479533626 HSXZHRTUIFXOEA-YADARESESA-N 426.580 4.474 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1ccc(F)cc1F 1524915116 BTJBBXKHJJVUKV-RQZCQDPDSA-N 436.480 4.012 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)sc2c1CCCCC2 1526893248 JUGJGECQHUYFOU-OAHLLOKOSA-N 430.501 4.397 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4ccccc4C)c3C(F)F)C2)cc1 1528318371 UYISNTLKBIEXJF-INIZCTEOSA-N 426.467 4.136 10 10 IICE CCCN(C)c1ccccc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1534296714 IDHJUAMNAISUGQ-UHFFFAOYSA-N 443.459 4.469 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cccnc1OCC(F)(F)F 1540754778 GDRGSSSHCQAMLV-UHFFFAOYSA-N 431.414 4.173 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCC(=O)N2)nnc1N(CC(C)C)C1CCCC1 1542227178 VIOHQOFUUXQZTR-QFIPXVFZSA-N 438.620 4.057 10 10 IICE COCCN(c1nnc(-c2ccc[nH]2)n1Cc1ccc(N(C)C)cc1C)[C@H]1CC[C@H](C)C1 1555537095 YHCKAUGXGUIKTJ-AVRDEDQJSA-N 436.604 4.337 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc(C)c1OCc1cccnc1 1557638699 DIFJQXPJSPIWKX-UHFFFAOYSA-N 445.563 4.169 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc(Oc2ccccc2)cn1 1568378691 KAZUKOLOIAFMHU-UHFFFAOYSA-N 448.523 4.271 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)cc1 1583873460 UXTZJTMETPACRV-XGSMCBPESA-N 440.569 4.254 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)Cc1ccc(NC(=O)OC(C)(C)C)cn1 1584095465 NIUFOTFKCIBOKE-KRWDZBQOSA-N 426.561 4.093 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(-c3ccccc3)nn2)cc1 1585492801 MZTCTIJCGDAHSB-UHFFFAOYSA-N 427.508 4.189 10 10 IICE O=C(Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1)c1c(F)cccc1[N+](=O)[O-] 1597560477 DJQYSVNTFURLLY-UHFFFAOYSA-N 448.498 4.351 10 10 IICE CCc1cc(=O)oc2c(C)c(O)c(CN(CCOC)C[C@@H]3CCCN4CCCC[C@@H]34)cc12 1614472423 HUCOICWDMNKTBK-REWPJTCUSA-N 442.600 4.082 10 10 IICE Cc1cc(CCNC(=O)CCn2c(=O)oc3cc(Cl)ccc32)c(C)n1-c1ccccc1 1623733451 IVRGJZXDCDVJCN-UHFFFAOYSA-N 437.927 4.404 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCOCC2)cc1)[C@H](O)c1cc(Cl)cc(Cl)c1 1625608408 ZLPLBOWHUVHIFM-HXUWFJFHSA-N 437.367 4.206 10 10 IICE Cc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1C 1626169772 ZZRIPQYHEVVUSR-MRXNPFEDSA-N 427.976 4.239 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc([C@@]3(C)NC(=O)N(C)C3=O)cc2)c1C 1627740656 AYXLLJFRDXTXOT-RUZDIDTESA-N 430.508 4.052 10 10 IICE Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)c2ncon2)cc1-n1c(C)cc(C=O)c1C 1631494144 WXVLUGYINIIUBF-QFIPXVFZSA-N 428.492 4.312 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(OC)cc3O)nn2-c2ccccc2)cc1 1635042981 YXQRZDCBTVPIDK-UHFFFAOYSA-N 429.476 4.192 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCc3c(Br)ccc([N+](=O)[O-])c3C2)c1O 1643073310 LRLXQPMXDSDABW-UHFFFAOYSA-N 439.693 4.477 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H]3CC[C@H]2[C@@H](C)[C@H](O)C3)sc(C)c1-c1ccccc1 1644016029 YEYPQQIHVLCXHA-GRGSLBFTSA-N 442.581 4.072 10 10 IICE CC[C@@H]1CN(Cc2ccc(N3CCC(OC)CC3)cc2)CC[C@@H]1NC(=O)OC(C)(C)C 1645160970 VSDYSHHQFKUDKK-OFNKIYASSA-N 431.621 4.427 10 10 IICE COC(=O)c1cc(NC(=O)[C@@H](C)Sc2ncc(C(C)(C)C)s2)cc(C(=O)OC)c1 1651864047 BVLVNAKFQLNKRI-LLVKDONJSA-N 436.555 4.133 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@H]1CC[C@@H](C(N)=O)C1 1654253674 VLQFPZIIJQCMGG-VCBZYWHSSA-N 433.474 4.200 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2C(=O)c3ccc(Cl)cc3S2(=O)=O)c1C 1656550254 YNYLQCFFQQOSRP-UHFFFAOYSA-N 442.924 4.083 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)CC1(C)C 1673745260 RRYDOWJHPBRGOP-RXVVDRJESA-N 446.636 4.327 10 10 IICE C[C@@]1(Cc2ccc(F)cc2)CCCN1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1674711914 DCONTGFZTVDLAU-VWLOTQADSA-N 425.548 4.094 10 10 IICE CCN(CC)CC[C@@H](NC(=O)NCc1cccc(Br)c1O)c1ccccc1 1676794531 RWSUZNOUIWFXBP-LJQANCHMSA-N 434.378 4.427 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCSC[C@@H]1c1ccc(Cl)cc1 1682987182 ZLCQROHLMHCXTD-JOCHJYFZSA-N 446.016 4.301 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cc(C)on1 1697110336 KPMPGBAZKRZYFT-SFHVURJKSA-N 434.544 4.320 10 10 IICE CC(C)[C@@H]1OCCC[C@H]1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1723250840 XLZNLCXSZPRHRJ-NNWRFLSQSA-N 428.577 4.313 10 10 IICE Cc1ccc(-c2nnc(N3CCOC(C)(C)[C@@H]3C)n2CCCSc2nccs2)o1 1724324257 HIXUNOKHZXYMCL-HNNXBMFYSA-N 433.603 4.489 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)CCS1 1745001501 JWWPSTDVGFUGCZ-HXUWFJFHSA-N 439.629 4.455 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1(CC)CCOCC1 1747030274 PPDWQBPWMFMWML-UHFFFAOYSA-N 441.620 4.258 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1749273062 AELJVJUNHYYMPP-NRFANRHFSA-N 437.588 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@@](C)(OC)C2)cc1 1764942085 MXQBKZFTKDJGIB-ZJSXRUAMSA-N 427.593 4.029 10 10 IICE CC[C@@H](C)NC(=O)CCn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@@H]21 1860344774 FRQWZLINBHMOCN-CRICUBBOSA-N 430.552 4.093 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(O)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)cc1 1872957090 WIGLDBSEOXOEOY-UHFFFAOYSA-N 430.460 4.113 10 10 IICE O=c1c2ccc(Cl)cc2nc2n1CCC2=Cc1cc2ccccc2nc1N1CCOCC1 2040454595 ZDARPNJLKCRLAV-UHFFFAOYSA-N 444.922 4.379 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](NCc2cc(Br)ccc2O)(C(F)(F)F)C1 2103577887 PQSYZUMNZBOJRQ-INIZCTEOSA-N 439.272 4.186 10 10 IICE C[C@@H](O)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)cc1Br 2144886990 YFOMGCKAANEUMC-GOSISDBHSA-N 433.390 4.231 10 10 IICE COc1cc(C=C2SC(=S)N(C(C)C)C2=O)ccc1OCC(=O)Nc1ccccc1 2293571159 JRBOUPFKCVELTH-UHFFFAOYSA-N 442.562 4.322 10 10 IICE Cc1ccc(C2=NN3C(=N)C(=Cc4cccc(Br)c4)C(=O)N=C3S2)cc1 2297341357 DKXJWNFBMVZMHI-UHFFFAOYSA-N 425.311 4.425 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N([C@H](C)CC)C1=O 2314414038 OHFHLJNFDUJCJD-CQSZACIVSA-N 430.599 4.296 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 2314717658 KMHIPZFKIDAPDZ-UHFFFAOYSA-N 433.898 4.103 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccc(F)cc3)C2=O)ccc1O 2314837956 YYNJLZVFUYDSCO-GFCCVEGCSA-N 446.525 4.158 10 10 IICE COc1cc(C=C2SC(=S)N(C[C@@H](c3ccccc3)N3CCCC3)C2=O)ccc1O 2323882336 PTYNZGFWFKDUFX-SFHVURJKSA-N 440.590 4.439 10 10 IICE Cc1ccc(CNC(=O)CC[C@H]2CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380748145 ZWJMMYZPXZSPSD-OAHLLOKOSA-N 441.366 4.259 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)c(O)c1Br 2380755267 ZRPJSRJSIMYXDP-HIFRSBDPSA-N 441.366 4.115 10 10 IICE COc1cc(/C=C2/SC(Nc3cccc(C)c3C)=NC2=O)ccc1OCCC(=O)O 16912228 GMIISPUDRONJQH-XDHOZWIPSA-N 426.494 4.248 10 10 IICE O=C(O)CCCCCCCCCCN/C=C1/C(=O)N(c2ccc(F)cc2)C(=O)N=C1O 103120942 HVWORGHCDZXKAQ-OBGWFSINSA-N 433.480 4.318 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)SC1=S)Nc1ccc(F)cc1 210715527 SEEMDVCDXBRJNH-SFQUDFHCSA-N 445.497 4.354 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCc4cc(OC)c(OC)cc4CC3)ccc21 483379996 SNFNNMBPOJFRSH-UHFFFAOYSA-N 436.552 4.163 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H](C)Cc3ccc(Br)cc3)CC2)cc1 726610377 DVTMTYHGAFXYKF-MRXNPFEDSA-N 446.389 4.357 10 10 IICE COC(=O)c1cccc(-c2nc(CN(C)c3cc(OC)c(OC)c(OC)c3)cs2)c1 743849926 BIBBZJLIWJJRSM-UHFFFAOYSA-N 428.510 4.259 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)NCc2cccc(Br)c2O)c1 765734992 BHLZRICOZMACCR-LJQANCHMSA-N 445.357 4.083 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc([C@H]4CCCOC4)c3)cc2F)C[C@@H](C)O1 766367796 PPPCVAZHGBTQGU-HMFYCAOWSA-N 426.532 4.263 10 10 IICE COc1ccc(O)c(CNC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c1 768056773 YQRHNYOBBNGVAE-UHFFFAOYSA-N 442.541 4.166 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)c1nnc([C@H]2CCOC2)n1Cc1ccccc1 802213673 IANBEGRQONRVTG-QHCPKHFHSA-N 431.584 4.457 10 10 IICE Cc1onc(-c2cccc(F)c2)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1125187430 FVUFGJXFGPJIPT-GJZGRUSLSA-N 441.478 4.472 10 10 IICE C[C@H](Cc1cccs1)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1125807454 FGVUPNQBXZFSDC-KAECEXQPSA-N 434.583 4.226 10 10 IICE Cc1cccc(O[C@H](C)C(=O)N2CCN(C(=O)c3ccc(-n4c(C)ccc4C)cc3)CC2)c1 1126070428 VTQAKSHFQBBTNC-JOCHJYFZSA-N 445.563 4.154 10 10 IICE Cc1ccc(-c2ncc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)s2)c(C)c1 1129662362 YYWNXQSCUOOHMX-UHFFFAOYSA-N 443.519 4.472 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@]3(C)C[C@@H](NC(=O)OC(C)(C)C)CCO3)cc2)CC1 1136705126 BPBVETZUBBVMKW-NBGIEHNGSA-N 445.604 4.002 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1141737748 HAMGAKNFYDWFAC-INIZCTEOSA-N 441.311 4.443 10 10 IICE Cc1cc(S(C)(=O)=O)cc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c1C 1142528010 DWVAYBVGPLHTIA-UHFFFAOYSA-N 428.598 4.406 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](CCO)c2ccc(Cl)cc2)CCCC1 1160209355 LAOVAFWEUOEKGT-OAQYLSRUSA-N 426.944 4.422 10 10 IICE Cc1cc(C(=O)Nc2cccc(-c3cnn[nH]3)c2)c(C)n1-c1ccc(Br)cn1 1161136164 QEHQDPSQGSLJJA-UHFFFAOYSA-N 437.301 4.289 10 10 IICE COc1ccc(N2CCN(Cc3cc(Br)cc4cccnc34)CC2)cc1F 1168069350 VDTPWLYMWXHRMW-UHFFFAOYSA-N 430.321 4.467 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2C[C@H](OCc3ccccc3)C2(C)C)cc1 1226856091 BHRHTUKDLZECQO-GOTSBHOMSA-N 425.573 4.157 10 10 IICE CC(C)[C@H]1OCC[C@@H]1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1287304815 DMBYUZUHMKOHNH-DENIHFKCSA-N 426.586 4.334 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CN(CC(C)C)C(=O)OC(C)(C)C 1294686058 VJDPVTLQCIJHER-UHFFFAOYSA-N 443.382 4.396 10 10 IICE Cc1ccc(C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)cc1-n1c(C)cc(C=O)c1C 1298023467 BDPJZAYHNLOVCD-NHTMILBNSA-N 448.567 4.339 10 10 IICE CC(C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C1(CO)CCCC1 1300067337 UUTUFMKEMHEKQF-VWLOTQADSA-N 425.617 4.101 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H](OC)C(C)(C)C 1305384812 VRWZAITWVSPYSD-DENIHFKCSA-N 443.636 4.326 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H](C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 1307473232 NVCYFWQCQQZGBA-ZVDOUQERSA-N 433.612 4.204 10 10 IICE C[C@@H]1CCN(CC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)[C@H](C(F)(F)F)C1 1308175420 ZIZRPZADHVLOQL-YJYMSZOUSA-N 430.426 4.063 10 10 IICE C[C@H](NC(=O)N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccc(N(C)C)cc1 1312530558 DQEDSXKJWHYELM-YJBOKZPZSA-N 439.510 4.270 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](C)[C@H]2CNC(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1445158651 OONHPMKZFUJJLX-OXJNMPFZSA-N 426.561 4.255 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(c4cccc(F)c4)CCCC3)cc2F)CC1 1456124911 DBVUZYNFVLQRJO-UHFFFAOYSA-N 427.539 4.235 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnc(-c3ccccn3)nc2)cc1 1465003323 JOVHAYARKDGYQG-UHFFFAOYSA-N 439.519 4.460 10 10 IICE COc1cc(/C=C/C(=O)NCc2c(O)cccc2F)ccc1OCc1c(C)noc1C 1471976056 QHLUOPDJPXQKQB-CSKARUKUSA-N 426.444 4.053 10 10 IICE COC(=O)c1cnc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C(F)(F)F 1472686945 LSIRBNNAEUWOER-CQSZACIVSA-N 443.853 4.323 10 10 IICE COc1ccc(N(CC(=O)Nc2cccc(I)c2)CC2CC2)cc1 1473485909 NPBJXGIPVAWHQG-UHFFFAOYSA-N 436.293 4.155 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC[C@@](C)(CC)O1 1503013917 HNLHGQBYBIWTIE-RCZVLFRGSA-N 441.620 4.399 10 10 IICE COCCO[C@H](C)c1nnc(N(C)CC2CCCC2)n1Cc1ccc2c(c1)CCCN2C 1504946386 UULHBSOSZZCUAE-LJQANCHMSA-N 441.620 4.059 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)sc2c1CCCCC2 1525452512 CRMARUAVVDJHKT-QGZVFWFLSA-N 440.565 4.181 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nn(-c2cc(C)ccc2F)cc1O 1545508637 IXQAMCWPXBYYIT-UHFFFAOYSA-N 448.292 4.156 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(Cc2ccccc2)C[C@@H](O)C(F)(F)F)c1 1556156668 FIPRCOXMWGLDQD-JOCHJYFZSA-N 444.453 4.472 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCC(=O)c1ccc2c(c1)CCCC2 1566849269 IOFRYADEKBODKN-UHFFFAOYSA-N 443.927 4.089 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1c(C)nn(Cc2ccccc2)c1Cl 1615934699 BRBFOXVYMXEVFR-UHFFFAOYSA-N 448.350 4.427 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C(F)(F)F 1616410948 MPDOCNMLRQJOAZ-HXUWFJFHSA-N 447.457 4.144 10 10 IICE CC(C)(C)c1cnc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1621898626 SJSBEPWYQBYXHQ-XNTDXEJSSA-N 447.557 4.019 10 10 IICE COC(=O)C(C)(C)c1csc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)n1 1624850137 HVCRBVMZABBHNR-UHFFFAOYSA-N 439.537 4.374 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)NCc3ccc(N4CCSCC4)cc3)on2)c1 1624897066 CBASEDHSCCSBIC-UHFFFAOYSA-N 443.956 4.487 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccn(C3CCOCC3)n2)cc1 1628565211 HZRICFAJUURPOL-UHFFFAOYSA-N 434.540 4.156 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](CN1CCCC1)c1ccccc1 1629972289 QXGLNLNVFUMRHO-FQEVSTJZSA-N 431.374 4.383 10 10 IICE C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1631531144 IZYVOMFEMWXBEZ-ROUUACIJSA-N 442.519 4.177 10 10 IICE Cc1cc(C(=O)N2CCC=C(Br)C2)c(C)n1-c1ccc(Br)cn1 1633954546 NDJQJRPIRBLAGG-UHFFFAOYSA-N 439.151 4.376 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2N1C(=O)OC(C)(C)C 1636058617 KBKWBYGKDGQXRK-KURKYZTESA-N 437.577 4.452 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(C)c(NC(=O)NC(C)(C)C)c3)C2)cc1 1638644780 BBBLYOQOKLJREB-SFHVURJKSA-N 438.572 4.180 10 10 IICE CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NCc2c(O)cccc2O)CC1 1639292966 XLVPYNRAEDDTNJ-UHFFFAOYSA-N 440.540 4.217 10 10 IICE CCOc1cccc(N2CCC(NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)n1 1640548266 HYDYEZXMUXIQQC-UHFFFAOYSA-N 436.531 4.426 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)CN3C(=O)CN(c4ccccc4)C3=O)c2C)c1 1640866655 QIBJPUJLDSQVEO-UHFFFAOYSA-N 433.533 4.468 10 10 IICE Cc1cc(C(=O)N[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c(C)n1-c1cccc(Cl)c1 1641665076 SFTGAVVOROWQBP-PMOLBWCYSA-N 429.948 4.343 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 1642997901 QZPOTHSWDZLBPG-JLTOFOAXSA-N 431.989 4.265 10 10 IICE C[C@@H](NC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1)c1ccccc1O 1643738475 CKBFVEUXYHKLDD-CQSZACIVSA-N 430.913 4.337 10 10 IICE CC(=O)c1cc(F)cc(CN2CCc3nc[nH]c3[C@H]2c2ccc(Br)cc2)c1O 1644596703 NWCYEEYCFBSVMA-HXUWFJFHSA-N 444.304 4.367 10 10 IICE COc1ccc(N(CC(=O)Nc2cccc(CN3CCSCC3)c2)C(C)C)cc1F 1644925404 SGZXJHDGTBKELT-UHFFFAOYSA-N 431.577 4.237 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C)c4ccccc43)cc2F)C[C@@H](C)O1 1645224449 VDXCJPDIDAFTKG-AQNXPRMDSA-N 439.575 4.459 10 10 IICE Cc1cc(C(=O)N2CCC([C@@H](O)c3ccnn3C)CC2)c(C)n1-c1cccc(Cl)c1 1646322036 RUHLVBWJFFBIQI-JOCHJYFZSA-N 426.948 4.067 10 10 IICE O[C@H](c1ccc(Br)cc1)[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 1653761985 SDLWTFSDMQKGOM-NZQKXSOJSA-N 445.401 4.231 10 10 IICE C[C@H](NC(=O)N[C@@H]1Cc2ccccc2N(C(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1671851990 OBHZNELRDCWWKX-FXAWDEMLSA-N 438.572 4.479 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@H]3C[C@H](O)c3ccco3)c2C)c1 1683302825 BXOKALVVUDPAFK-PKTZIBPZSA-N 437.540 4.030 10 10 IICE CCO[C@@H]1C[C@@H](N(C)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C12CCCCC2 1685681201 BZKWKWIIJGVHKO-DNVJHFABSA-N 430.637 4.125 10 10 IICE CCc1nnc(N(C)[C@@H](C)c2cccs2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1694628359 ZVHBHMQHPOZIIZ-SFHVURJKSA-N 439.629 4.356 10 10 IICE CSC(C)(C)Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1698327271 QZZVCKSJUARZTF-IBGZPJMESA-N 429.634 4.160 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2CCC(C)C)n1 1707817339 XMPCBVRRQYONQX-UHFFFAOYSA-N 435.620 4.422 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCS[C@@H](C)C2)cc1 1728383139 SEIXUNKJTIDZPI-GHTZIAJQSA-N 429.634 4.356 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H](Oc3ccccn3)C2)cc1 1728383738 YXUQMKZZBKMNER-HSZRJFAPSA-N 448.615 4.424 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCOC4)n3CCCC(C)C)CC2)cc1F 1730180916 WJKVIVXGFSNXLS-IBGZPJMESA-N 445.583 4.083 10 10 IICE C[C@@H](c1cccc(O)c1)N(C)c1nnc([C@@H]2CCOC2)n1CCCSc1nccs1 1741785151 WVKGORJAXGRNJR-DOTOQJQBSA-N 445.614 4.324 10 10 IICE CN(Cc1cccs1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1747765937 ULPLNSMVZNANFG-UHFFFAOYSA-N 443.592 4.298 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCOC1 1748380231 IOSPYLJWABZDMH-PZJWPPBQSA-N 437.588 4.250 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1 1766737430 SWBOGEYPJPMLRZ-DRKIFQHWSA-N 439.629 4.358 10 10 IICE CCN1CCC[C@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1767060607 PGQLTMAMAZTQMP-TUNNFDKTSA-N 441.620 4.023 10 10 IICE O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1C1CCN(Cc2ccccc2)CC1 1858594170 OEFLJPGAOQKTTA-FYJGNVAPSA-N 438.574 4.281 10 10 IICE CCc1sc(NC(=O)[C@@H](N)C(C)C)c(C(=O)OC)c1-c1ccc(Br)cc1 1865915471 GSYLYUKPLUWCDL-INIZCTEOSA-N 439.375 4.448 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCOc5ccccc54)nc(C(C)C)n3)CC2)cc1 1867950461 ZONAQGZOVBGWSU-UHFFFAOYSA-N 445.567 4.466 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCC3)C(=O)N(Cc3ccccn3)C2=O)cc1 1873165514 MAYIJKDEQPOYTE-UHFFFAOYSA-N 440.547 4.301 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2cc(Br)ccc2O)CC12CC2 2115365699 FIRBFWGBVHVYET-CQSZACIVSA-N 425.367 4.424 10 10 IICE COc1cc(C=C2C(=O)NN(c3ccccc3)C2=O)ccc1OCCCOc1ccccc1 2293239056 LQNOQCHSZAYZGG-UHFFFAOYSA-N 444.487 4.005 10 10 IICE Cc1cccc(OCCOCCOc2ccccc2C=C2SC(=S)N(C)C2=O)c1 2297306566 AMSYMXZKQHJRNO-UHFFFAOYSA-N 429.563 4.300 10 10 IICE CC1=NN(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(N(C)C)c([N+](=O)[O-])c1 2297311192 YJMFVSSKTWAROM-UHFFFAOYSA-N 429.274 4.229 10 10 IICE CC[C@](C)(NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352943964 ARNJDUKTJAVKJV-IBGZPJMESA-N 429.355 4.115 10 10 IICE CCCN1CCN(c2cc(NCCCOCC)c3c4c(onc24)-c2ccccc2C3=O)CC1 20857898 PRRLUIVFUNJXBQ-UHFFFAOYSA-N 448.567 4.410 10 10 IICE O=[N+]([O-])c1ccc(-c2ccc(C(=S)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)o2)cc1 26771257 LRUXSIGDVAWEQZ-UHFFFAOYSA-N 438.465 4.261 10 10 IICE CC(=O)N1CCC(C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)(c2ccccc2)CC1 32807673 QZWWHWFNLIHOGO-UHFFFAOYSA-N 433.596 4.216 10 10 IICE CN(C)c1ccc(CN(C(=O)C(=O)Nc2nc3c4c(ccc3s2)CCCC4)C2CC2)cc1 733856032 OONKHPITBALGSL-UHFFFAOYSA-N 448.592 4.371 10 10 IICE COc1ccc(CC2CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2)cc1 749933668 QEYOIDQUIWYRKC-HXUWFJFHSA-N 437.584 4.257 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)NCc2cccc(Br)c2O)c1 765734991 BHLZRICOZMACCR-IBGZPJMESA-N 445.357 4.083 10 10 IICE Cc1ccccc1C1CC(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 783548771 CCSJURXVYWOPJZ-UHFFFAOYSA-N 431.559 4.287 10 10 IICE C[C@@H](NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)c1ccc(N2CCOCC2)cc1 812015494 QXGJXDFMUJPORU-UTKZUKDTSA-N 439.560 4.172 10 10 IICE COCCc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1128018947 INUVIIHSDNFKKD-RGEXLXHISA-N 444.553 4.245 10 10 IICE COC(=O)[C@H](C[C@H]1CCCc2ccccc21)NC(=O)c1cc2cc(O)c(O)cc2s1 1138094959 GTQRFHURXUGKOZ-PBHICJAKSA-N 425.506 4.094 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@](C)(Cc2ccccc2)[C@@H](C)O)C1 1140089256 LOIVFHOELDKYJM-PIKZIKFNSA-N 447.623 4.154 10 10 IICE COc1ccc(C[C@@](C)(O)CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)cc1OC 1160305279 KHUQYXXFIZLWRY-AREMUKBSSA-N 436.552 4.143 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC(Cc3nc(-c4cccc(C)n4)no3)CC2)c1O 1176145989 PPLXYHFWFVJTLI-UHFFFAOYSA-N 440.931 4.456 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCCOCC(F)(F)C(F)F)cc2Cl)C1 1227208696 PVHJIMMBKYIUDX-ZDUSSCGKSA-N 439.881 4.293 10 10 IICE Cc1ccc(Oc2ccc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)cc2)nc1 1265349308 OEXRUGIBRGMHKZ-UHFFFAOYSA-N 430.508 4.136 10 10 IICE Cc1cc(Oc2ccccc2)ccc1C(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1 1351346803 IGTAHEHDNPLUDK-UHFFFAOYSA-N 436.533 4.274 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1cccnc1Cl 1439874243 NKSZAYPJHRSMJO-UHFFFAOYSA-N 428.677 4.460 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NC3(c4cccc(Br)c4)CCC3)C2)cc1 1470772341 JUPLVKSIXGYYAC-GOSISDBHSA-N 444.373 4.415 10 10 IICE O=C(NCc1cccc(Oc2ccc(F)cc2)n1)NCc1cccc(Br)c1O 1478927178 HGOIUHLWTHIMEU-UHFFFAOYSA-N 446.276 4.481 10 10 IICE CCN(CC(C)C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1501711754 SFVGNHRPASDXLT-QFIPXVFZSA-N 445.583 4.026 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCC2)nnc1N1C[C@H](C)O[C@H](C(F)(F)F)C1 1510671581 DADAOOGKOZFWIS-KXBFYZLASA-N 437.510 4.124 10 10 IICE CCc1cnc(CN(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)s1 1513708993 OMZPVANEGXZKCE-UHFFFAOYSA-N 428.581 4.454 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC(C(C)C)CC2)cc1 1515520979 BGFKEVCKFBVPTB-UHFFFAOYSA-N 440.636 4.183 10 10 IICE O=C(COc1ccc(Cl)c(Cl)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1518326942 VNXHTGWRTLBTKL-UHFFFAOYSA-N 448.394 4.221 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)[C@H](Cc3ccccc3)C(=O)OC)ccc21 1525821936 KXGZVBSAPHQLJR-JPYJTQIMSA-N 436.552 4.055 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccccc2SCCC(N)=O)CCCC1 1528189035 FNVJNIAOOLAYFU-UHFFFAOYSA-N 437.565 4.135 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)COc3c(Cl)cc(Cl)cc3Cl)C2)cc1 1532104435 BSIUTHGAEXVIKD-ZDUSSCGKSA-N 429.731 4.429 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H]2CCC[C@H]2C(=O)OC(C)(C)C)CCCC1 1539144574 WDWLYJUXEAHJBI-QUCCMNQESA-N 426.557 4.155 10 10 IICE CCOc1ccc(C[C@@H](CNC(=O)c2ccc(-n3c(C)ccc3C)cc2)C(=O)OC)cc1 1543972998 ZCEUIUNEKTXMOX-QFIPXVFZSA-N 434.536 4.255 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC[C@H]1OC 1545503753 HOIGYZJDOHWWEQ-MIZPHKNDSA-N 441.620 4.332 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCC1CCC(OC)CC1 1546516925 WKWKIDUHJVIPHA-UHFFFAOYSA-N 441.620 4.161 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCS(=O)(=O)C1CCCCC1 1559342019 LYQJQZMTFAAWCJ-UHFFFAOYSA-N 436.599 4.181 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccccn2)c1C)Cc1ccc2ccccc2c1 1565706916 LGWFHLVDFGVVMR-HSZRJFAPSA-N 441.531 4.404 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CNC(=O)c3ccccc3Cl)cc2Cl)C1 1568140338 NXJSLZVEJBCFFU-HNNXBMFYSA-N 434.367 4.276 10 10 IICE CCN(CCOc1ccccc1OC)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1588289575 AAVXSGNMBNEURJ-UHFFFAOYSA-N 436.552 4.465 10 10 IICE CCO[C@H]1C[C@@](NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)(C(=O)OC)C1(C)C 1625393112 KWFPWGOEPSHNIR-SQJMNOBHSA-N 426.557 4.188 10 10 IICE CCON(CC1CCCCC1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1626179929 MXRDRVDAYNNWSA-UHFFFAOYSA-N 438.571 4.229 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CCCC1 1628191996 OTXGUVWPLAUIIW-QGZVFWFLSA-N 441.572 4.044 10 10 IICE CC1(C)CN([C@@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)c2ccc(Cl)cc2)CCO1 1628668710 BQGJXEQYWFFUNE-IBGZPJMESA-N 443.935 4.084 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1NCC(F)(F)F 1631425581 JIRAFISDVFKNIW-INIZCTEOSA-N 441.881 4.414 10 10 IICE COc1ccc(N2CCN(CCNC(=O)[C@H](c3cccc(Cl)c3)C(C)C)CC2)cc1 1631442680 GEWACSNTNILBGG-QHCPKHFHSA-N 429.992 4.027 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 1631675530 OYHDVGAEDCOPHW-SQJMNOBHSA-N 443.591 4.476 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](CC)N(C)C(=O)OC(C)(C)C 1635489462 ZBKYZHMUJBMFRC-HXUWFJFHSA-N 449.592 4.021 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccc(F)cc2)on1 1635941025 MSFCBZIZNGCSIB-SFHVURJKSA-N 429.879 4.234 10 10 IICE CCc1c(Br)cc(C(=O)NCc2ccc(O)c(O)c2)cc1Br 1635958897 CFBUNSDLYNNURQ-UHFFFAOYSA-N 429.108 4.115 10 10 IICE Cc1cc(C(=O)N2CCC3(CC2)C[C@H](O)CCO3)c(C)n1-c1cccc(Br)c1 1639080658 JCTHHRJTZBBDIW-LJQANCHMSA-N 447.373 4.003 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)CCNS(=O)(=O)c1ccc(C(C)(C)C)cc1 1639521871 BPPWTZZSGFCTCE-UHFFFAOYSA-N 446.613 4.187 10 10 IICE COCC[C@H](Cc1cccc(Br)c1)C(=O)NCc1cc(Cl)ccc1O 1639965000 AMHHFFZVZCJFFG-CQSZACIVSA-N 426.738 4.320 10 10 IICE C[C@@]1(Cc2cccc3ccccc23)CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1641129408 QUEDMEXDPLLDFH-DEOSSOPVSA-N 438.549 4.154 10 10 IICE CCN(CCOc1ccccc1OC)C(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1642300816 XEPDPPQUOVKBEU-UHFFFAOYSA-N 434.536 4.385 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H](C)c3cccc(C4CC4)c3)cc2F)C[C@@H](C)O1 1653716442 LKSJTHRMNOPOLQ-GUDVDZBRSA-N 439.575 4.284 10 10 IICE CCOC(=O)c1cn(C)nc1NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1654074520 HRLNEDZJWHDYEN-UHFFFAOYSA-N 445.317 4.019 10 10 IICE COC(=O)/C=C\c1ccc(N2CC(Cc3cccc(OC(F)(F)F)c3)C2)c([N+](=O)[O-])c1 1655235918 KXEGCYOGXGQERX-VURMDHGXSA-N 436.386 4.359 10 10 IICE CC(C)Cn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nnc1N(C)Cc1ccccc1O 1692415613 RFSGKHUYANNVOO-UHFFFAOYSA-N 443.592 4.391 10 10 IICE Cc1cc(-c2nnc(N3CC=CCC3)n2CCSCCCO)c(C)n1-c1ccccc1 1692985905 NPONWXBGCBHHIX-UHFFFAOYSA-N 437.613 4.235 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)CC[C@@H]1C 1696998544 SIHCCZKSOKBSEH-MSOLQXFVSA-N 434.588 4.114 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C)OC 1712148189 LCBDYLZTJKQJIE-NRFANRHFSA-N 425.577 4.106 10 10 IICE Cc1ccc(-c2nnc(N3CCN(C(C)(C)C)CC3)n2CCCSc2nccs2)o1 1724318674 LQYBVHHRSXXBEM-UHFFFAOYSA-N 446.646 4.406 10 10 IICE CCOCC(C)(C)Cn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1728964713 UOHXUYDADLXZPS-UHFFFAOYSA-N 445.583 4.083 10 10 IICE CC[C@H](C)c1nnc(N2CCc3c(ccnc3O)C2)n1CCCSc1nccs1 1743676518 FNPYITHHJPGJKI-AWEZNQCLSA-N 430.603 4.094 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cn1 1766608553 OESVVWGZXHOMLN-UHFFFAOYSA-N 433.604 4.113 10 10 IICE COc1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)[C@H](C)C(=O)N3)cs1 1859573393 JFPPGISPLYUEHD-JTQLQIEISA-N 449.941 4.329 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)c1OC 1860087060 XLKCDDZKCGUZIJ-SFQUDFHCSA-N 425.535 4.024 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(CCNCc2c(O)cccc2Br)C1 2140328797 IGERNQWZVGFKDO-VLIAUNLRSA-N 425.367 4.282 10 10 IICE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1c(Br)ccc(OC)c1O 2236056989 YNMYNAPPKSWYPR-CZUORRHYSA-N 443.382 4.289 10 10 IICE C[C@H]1Oc2ccccc2C=C1C=C1SC(N2CCN(Cc3ccccc3)CC2)=NC1=O 2314433401 MWCKZGZQIYNGJF-GOSISDBHSA-N 431.561 4.182 10 10 IICE COc1ccc(C=CC(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1OC 2325263893 LUIUARRHCVLPTP-HSZRJFAPSA-N 437.584 4.126 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H](NCc1c(O)cccc1Br)[C@@H]2F 2333274432 IVIAUTWDKGZDHT-LCSDZXHASA-N 429.330 4.123 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C\c2ccc(OCCC(=O)O)cc2)SC1=S 16907829 MUDFEEWHOIJLNF-QGOAFFKASA-N 429.519 4.345 10 10 IICE COC(=O)c1ccc([C@@H]2Oc3ccccc3[C@H]3CC(c4cc(OC)ccc4O)=NN23)cc1 20071299 JVZMRXCGKOAJSZ-QPPBQGQZSA-N 430.460 4.430 10 10 IICE CN(C)c1ccc(Cn2nccc2NC(=O)CSc2ccc(C(F)(F)F)cn2)cc1 98080469 YQXSFXGCFNWHPC-UHFFFAOYSA-N 435.475 4.142 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3c(O)cccc3Br)C[C@H]2C1 706854151 PSUQNMGFYFPUGU-SOUVJXGZSA-N 425.367 4.280 10 10 IICE Oc1c(Br)cc(Cl)cc1CNCC[C@@H]1CN(Cc2ccccc2)CCO1 708074565 CZTQNBBQPUQVGU-GOSISDBHSA-N 439.781 4.189 10 10 IICE CN(c1ccc(CNC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cc1)C1CCCCC1 734273296 MCZWMRPEERMMSJ-XMMPIXPASA-N 434.584 4.228 10 10 IICE O=C(Cc1ccc(Br)s1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 742799900 NGLPXCJWCZUKSN-GFCCVEGCSA-N 445.329 4.440 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(OC)c(OC)cc1NC(=O)[C@H]1C[C@@H]1C 764894385 GSTAFOUYAVQTRM-LPHOPBHVSA-N 439.556 4.027 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CSc3ccc(N)cc3Cl)cc2F)C[C@@H](C)O1 767204570 PEYHDXWIKFWQFL-ZIAGYGMSSA-N 437.968 4.083 10 10 IICE C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 776173365 RYWRBWNVQIWPAS-UTKZUKDTSA-N 438.538 4.091 10 10 IICE C[C@@H]1C[C@]2(CCO1)CN(Cc1cc(Br)cc(Br)c1O)C[C@@H](C)O2 797604481 GTPQTSYOTJSPLB-PSTGCABASA-N 449.183 4.076 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)NCc2cc(Br)ccc2O)n1 806430393 NOSPVMPJHNEHAU-UHFFFAOYSA-N 425.333 4.365 10 10 IICE CC(C)c1nn(CN(C)Cc2ccc(N3CCOCC3)cc2)c(=S)n1Cc1ccco1 813043844 SLOAUPGCIPQSRT-UHFFFAOYSA-N 441.601 4.105 10 10 IICE Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1nc(-c2ccc(OC(F)F)cc2)c(C)s1 917870689 BBZQEYBQXDSKMH-UHFFFAOYSA-N 448.904 4.216 10 10 IICE CC(C)n1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1Br 1126783354 IQKWXEHDRQBEFM-UHFFFAOYSA-N 425.290 4.189 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccnc3SCC3CCCCC3)cc2)CC1 1132899529 XWWKGFCQLOVKCQ-UHFFFAOYSA-N 438.641 4.436 10 10 IICE CSCC1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 1134441854 JJIVCMSNOGKLQH-VBKFSLOCSA-N 440.681 4.331 10 10 IICE Cc1ccccc1CN(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1135248592 LKSKGNSCLQDODC-UYRXBGFRSA-N 428.554 4.384 10 10 IICE CN1CCCc2cc(CNC(=O)c3cnn(-c4cccc(F)c4)c3C(F)(F)F)ccc21 1136437153 XWCFWWVZQSEXEP-UHFFFAOYSA-N 432.421 4.343 10 10 IICE Cc1cc(C(=O)NCc2nc(C(C)(C)C)n[nH]2)c(C)n1-c1cccc(Br)c1 1141989499 UYVDJPBHYMVSSX-UHFFFAOYSA-N 430.350 4.202 10 10 IICE COC(=O)c1cc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc([N+](=O)[O-])c1 1142528149 KIIXSVYRVHOJPY-UHFFFAOYSA-N 425.485 4.080 10 10 IICE COc1ccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)cc1OC(F)F 1142712875 JHTTYWQWCRFVHH-HXUWFJFHSA-N 448.510 4.113 10 10 IICE Cc1ccc(C(=O)NCc2cccc(C3(C)OCCO3)c2)cc1-n1c(C)cc(C=O)c1C 1160081628 MCVUXGDGFFYEDL-UHFFFAOYSA-N 432.520 4.365 10 10 IICE CC(C)c1nnc(N2CCC[C@H](c3ccnn3C)C2)n1CCCSc1nccs1 1287205876 GEJDCUHFYQBSON-INIZCTEOSA-N 431.635 4.158 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H](C)c1nccs1 1297056232 OPAWVLAHNMBIDZ-GOSISDBHSA-N 440.617 4.311 10 10 IICE Cc1cc(CC(=O)N[C@H](c2ccccc2)C2(CO)CCOCC2)c(C)n1-c1ccccc1 1299970917 GOYVMYLZMFQRRD-AREMUKBSSA-N 432.564 4.283 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCC[C@@H]2CCCCO2)cs1 1304655282 VQZNEVLXNOHSOP-FQEVSTJZSA-N 441.601 4.325 10 10 IICE CC[C@H](C)c1nnc(N2CCC(CC(=O)NC)CC2)n1Cc1ccc(N(CC)CC)cc1 1305439406 NAFXMCVELKWEHA-IBGZPJMESA-N 440.636 4.039 10 10 IICE COc1cccc(CNC(=O)N[C@H]2CC3(CCC3)Oc3ccc(Br)cc32)c1O 1313320265 NWPYGGNULKBEOP-INIZCTEOSA-N 447.329 4.409 10 10 IICE COc1ccc(N2CCC(NC(=O)CCCCc3ccc(OC)c(OC)c3)CC2)cc1 1352537954 QYOSTTCIAUEIBG-UHFFFAOYSA-N 426.557 4.210 10 10 IICE CN(C)c1ccc(CNC(=O)c2cccc(Nc3nccc(C(F)(F)F)n3)c2)cc1F 1442473429 LMAOSGWUECMGIG-UHFFFAOYSA-N 433.409 4.374 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2c(C(C)C)noc2n1 1445889524 YTAUWQRIJNFJJX-QGZVFWFLSA-N 442.947 4.408 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCNC(=O)[C@H]2c2ccc(C(F)(F)F)cc2)cc1 1458482570 QAMZWJDXHZJJJQ-OAQYLSRUSA-N 441.453 4.426 10 10 IICE Cc1cc(CC(=O)N2CCCN(C(=O)c3ccccc3F)CC2)c(C)n1-c1ccccc1 1464476505 NYNIITCMLPTSII-UHFFFAOYSA-N 433.527 4.150 10 10 IICE Cc1ccc(NC(=O)c2sccc2-n2c(C)ccc2C)c(C)c1S(=O)(=O)NC1CC1 1468657446 BODQBYZQBFUBDA-UHFFFAOYSA-N 443.594 4.465 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1470556536 XEOJDQNUNXYUOK-JEEBJRHZSA-N 444.620 4.079 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCC[C@H]1c1ccc(F)cc1F 1470904062 CXONYOAHGNFTJL-QHCPKHFHSA-N 429.511 4.363 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)CC1(O)CCOCC1 1472496549 GIXISGCIAVERES-LJQANCHMSA-N 436.474 4.230 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(C)[C@@H](CCc2ccccc2)C(F)F)N(C)C)cc1 1479535629 XWHSZCNFRKYYMI-FCHUYYIVSA-N 432.559 4.263 10 10 IICE CC(C)[C@H](Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1508866617 KOVCTYKJCPKYSD-QHCPKHFHSA-N 442.567 4.441 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@@H](NC(C)=O)Cc2ccccc21 1519477612 HNVOIYLEBUIEPR-GNNUASRNSA-N 429.520 4.131 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccc(OC)c(Cl)c1 1537603666 NEQSXDGQUCKJQD-HSZRJFAPSA-N 440.927 4.329 10 10 IICE Cc1ncc(/C=C/C(=O)N2C[C@@H](CNC(=O)OC(C)(C)C)Cc3cc(F)ccc32)s1 1538218511 NOJNIQHZFIGRLT-PMGBHYCQSA-N 431.533 4.334 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)c1 1544032026 WMWXGYKWNLWJPR-UHFFFAOYSA-N 431.536 4.056 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(OC(F)F)c(Br)c3)CC2)cc1 1544746352 WAPIAIHTKUNJHC-UHFFFAOYSA-N 441.272 4.022 10 10 IICE CC/C=C/Cn1c(Cc2ccsc2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1546798748 ZIEIBVUYSJGFAG-SNAWJCMRSA-N 441.576 4.371 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@@H]2CCCC[C@@H]12 1557394439 IGTIOHAYCKOHMD-YTFSRNRJSA-N 436.552 4.409 10 10 IICE Cc1nn(C)c(C)c1[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)C(F)(F)F 1566177041 UNVJCADMEYEYCZ-HXUWFJFHSA-N 432.446 4.290 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1cccc(O)c1 1595595283 AMQQBSGJDYEDGJ-OAQYLSRUSA-N 426.900 4.487 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc4scc(Br)c4c3)cc2)CC1 1598277822 ZRCQTLYNNKAJQN-UHFFFAOYSA-N 444.398 4.346 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(N4CCOCC4=O)c(C)c3)c2C)cc1 1598416542 LJPIPRAMMRVFQZ-UHFFFAOYSA-N 433.508 4.027 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(CC)CC)cc1 1614103450 QOGIHMWQCBIGIJ-TZIWHRDSSA-N 438.620 4.033 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)[C@H]2CCSC2)cc1 1615381134 RCJXGSHZHBDPEH-QFIPXVFZSA-N 436.629 4.100 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CCN(C(=O)COc4ccccc4)C3)c2C)c1 1617763343 VMMDEPQLPYISTF-JOCHJYFZSA-N 445.563 4.121 10 10 IICE Cc1cc(CN2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)ccc1N1CCCCC1 1618340522 MOINQTCICPMJBU-HSZRJFAPSA-N 442.648 4.112 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1620254334 FSMICHGEHLJCLX-JKSUJKDBSA-N 439.676 4.490 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(CC3CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1620755401 GMNDZOBEUFFTIN-IBGZPJMESA-N 445.405 4.246 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c(C)n1-c1ccccc1Br 1623757219 ISCIGAHFXMRLFB-IAGOWNOFSA-N 448.405 4.086 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(CCN2CCOCC2)cc1 1626397929 KSBOFESVDDNWCN-UHFFFAOYSA-N 431.536 4.034 10 10 IICE COC(=O)C[C@](C)(NC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)c1cccc(OC)c1 1628947848 FWWGSMBHWGWJBW-VWLOTQADSA-N 438.499 4.450 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@]2(C)CCc3ccccc32)NC(=O)OC(C)(C)C)cc1 1629679330 NTUNOPHCTGBMDG-NVQXNPDNSA-N 437.584 4.339 10 10 IICE Cc1cc(C(=O)NCCC2SCCS2)c(C)n1-c1ccc(Br)cn1 1630387057 ABBDILJPJZFHGK-UHFFFAOYSA-N 426.405 4.178 10 10 IICE Cc1ccc(C(=O)N2CCC(NC(=O)c3ccsc3)CC2)cc1-n1c(C)cc(C=O)c1C 1631037191 AAXUMNWJZSZAOM-UHFFFAOYSA-N 449.576 4.311 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Cl)c(Br)c1 1631534119 PMWSTUGIRSLQKP-UHFFFAOYSA-N 447.112 4.277 10 10 IICE Cc1ccc2[nH]c(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)cc2c1Br 1633793303 DYODUWZYUSKGIL-UHFFFAOYSA-N 442.357 4.130 10 10 IICE CCO/C=C\[C@@](O)(CNC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1637578319 UUMYGPBSBZAWST-VFCOFNOGSA-N 439.478 4.045 10 10 IICE O=C(CN1CCCCC[C@@H]1C(F)(F)F)Nc1cccc2c1C(=O)c1ccccc1C2=O 1654778333 YQIFHVSFLPOGMT-GOSISDBHSA-N 430.426 4.207 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NCCc2cn(C)c3cc(Cl)ccc23)N(C)C)cc1 1671688215 RBZDAPWQEUDZOW-QHCPKHFHSA-N 442.007 4.042 10 10 IICE Cc1cc(CCNC(=O)N(C)C[C@@H]2CN(c3ccccc3)C(=O)O2)c(C)n1-c1ccccc1 1674930599 ZFTHARVSBGGPTG-XMMPIXPASA-N 446.551 4.303 10 10 IICE C[C@@]1(c2ccccc2)CCCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1681849754 IIRCSSJHQIISJI-RUZDIDTESA-N 443.538 4.455 10 10 IICE Cc1cc(CCNC(=O)N[C@H](c2ccncc2)C2(CO)CCC2)c(C)n1-c1ccccc1 1684444151 JHSTVBVGCUCYBU-XMMPIXPASA-N 432.568 4.235 10 10 IICE C[C@@H]1CN(CCOc2ccc(CCNC(=O)NCc3cccc(Cl)c3O)cc2)C[C@@H]1C 1685931805 JQKJYPLKZULYBY-HDICACEKSA-N 445.991 4.054 10 10 IICE CC[C@H](CNC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)C(=O)OC(C)(C)C 1687669163 JHKHFBKNIHGDSL-LJQANCHMSA-N 429.561 4.425 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1722851763 SFYVQEHIOMVEDR-UHFFFAOYSA-N 432.572 4.035 10 10 IICE CC(C)[C@@H]1CCN(c2nnc(Cc3ccncc3)n2CCCSc2nccs2)C1 1723224566 YDLVGQRZSRDPCO-GOSISDBHSA-N 428.631 4.385 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nnc(C(C)(C)C)s1 1726355696 WLYDWHDPNSTDSC-UHFFFAOYSA-N 425.606 4.020 10 10 IICE CCN(c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N(C)C)cc1C)C1CCCCC1 1728283125 NUPBFEUDQSJVFC-UHFFFAOYSA-N 438.620 4.096 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CCN1CC=CCC1 1729404695 GLWPNNAXNHBESL-UHFFFAOYSA-N 436.648 4.365 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCOC1 1730682039 HUGAMXCLYJOFOH-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1750280996 FHINYYXWAPDCII-IFMALSPDSA-N 443.661 4.317 10 10 IICE CC(C)c1nnc(N2CCSC3(CCOCC3)C2)n1CCCSc1nccs1 1750656232 YRTBYPDNBNPCGO-UHFFFAOYSA-N 439.676 4.143 10 10 IICE Cc1ccccc1Cc1nnc(N2CCCOCC2)n1CCCSc1nccs1 1762108502 UHRKPIFHPAANRM-UHFFFAOYSA-N 429.615 4.043 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCOC(C)(C)C 1769853158 JCTRGOOOBHHKIH-UHFFFAOYSA-N 425.577 4.250 10 10 IICE CCN(CC)c1cc(C)c2nc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)cc(O)c2c1 1866561678 TVBGMZOJAHIPPL-UHFFFAOYSA-N 448.567 4.066 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3CC(=O)N(c4cccc(Cl)c4)C3)cccc21 1874178985 FZMKSFWLDIQBJU-AWEZNQCLSA-N 444.874 4.107 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1Br 1911927886 IEAMOZGPYMJVRV-RTBURBONSA-N 427.342 4.115 10 10 IICE C[C@H](c1ccccc1O)N(C)C(=O)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2010160075 YDRYHTCTSUAGRI-XLIONFOSSA-N 428.529 4.022 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(F)(F)F)c(N)c2I)c(O)c1 2079048735 VGKDSDDPMOLBQC-LBPRGKRZSA-N 437.203 4.102 10 10 IICE CC[C@H](NC[C@H](CCOC)NC(=O)OC(C)(C)C)c1cc(Br)ccc1O 2225569036 LLYFUQUPJJLNRE-HOCLYGCPSA-N 431.371 4.125 10 10 IICE CN(Cc1ccccc1I)c1cc(Br)c(CN)cc1F 2280260890 GMTCZVHWJIDXQF-UHFFFAOYSA-N 449.105 4.288 10 10 IICE C[C@@H](C(=O)N1CCCC[C@H]1c1cccnc1)N1C(=O)C(=Cc2ccco2)SC1=S 2296303806 JOYYRXNCKHUNDT-YOEHRIQHSA-N 427.551 4.018 10 10 IICE COc1cccc(C=C2SC(=S)N(CCNC(=O)Nc3cccc(Cl)c3)C2=O)c1 2320656158 CFYBZCFVCURFAQ-UHFFFAOYSA-N 447.969 4.372 10 10 IICE Cc1ccc(CNC2CC3(C2)C[C@@H]3NC(=O)OCc2ccccc2)c(O)c1Br 2327623190 FDAKDJHDCDGDDM-DKTYTTGXSA-N 445.357 4.400 10 10 IICE Cc1ccc(CNC(=O)c2occc2NC(=O)OC(C)(C)C)c(O)c1Br 2352947213 HIJOPEQONGUWOW-UHFFFAOYSA-N 425.279 4.333 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3ccc(Oc4ccccc4C)cc3)CC2)cc1 33642850 WLBHKURUOFTNME-UHFFFAOYSA-N 438.549 4.307 10 10 IICE COc1ccc(N(C(=O)CC(C)C)C2CCN(Cc3cccc(OC)c3O)CC2)cc1 34683216 KRUWMTOAYQOSOL-UHFFFAOYSA-N 426.557 4.453 10 10 IICE COc1cc(/C=C2/SC(=S)N(CCCC(=O)Nc3cccc(C)c3)C2=O)ccc1O 210712163 RTROCKFTQLKNDX-CPNJWEJPSA-N 442.562 4.329 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1 443944582 HFOATSYSDAABMJ-NRFANRHFSA-N 430.596 4.051 10 10 IICE Cc1ccc(N2C[C@@H](C(=O)Nc3c(-c4ccccn4)nc4ccccn34)CCC2=O)cc1C 760533372 XMVMLBONVBKJMW-IBGZPJMESA-N 439.519 4.395 10 10 IICE COc1ccc(S[C@@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768542750 HDJGTVABKCRMKI-IBGZPJMESA-N 439.625 4.024 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1nn(C)cc1[N+](=O)[O-] 772909422 JLHQRNRCQWFGDQ-MRXNPFEDSA-N 447.417 4.254 10 10 IICE COC(=O)c1ccc(-c2csc(NS(=O)(=O)c3c(F)cccc3Cl)n2)cc1 780704534 ORLGIGOEVBWTGN-UHFFFAOYSA-N 426.878 4.190 10 10 IICE O=C(NCc1ccc(O)c(O)c1)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1 789994879 ANMDVHZAERKKOP-FCHUYYIVSA-N 436.939 4.283 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(ccc(NC(=O)/C=C/c3ccc(O)c(O)c3)c2F)C1 803585870 RBKOUAFGRXLKFH-WEVVVXLNSA-N 428.460 4.182 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC[C@H](c4ccccc4)O3)cc2F)C[C@@H](C)O1 808237807 GTIOCAXBTKJDAW-ZUXGEGRZSA-N 441.547 4.159 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)NCc1cnc(-c2ccccc2)s1 1116186502 CDFVJYQRAQSAOH-UHFFFAOYSA-N 436.581 4.018 10 10 IICE C/C(=C/C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(C(F)(F)F)c1 1133626347 HXRCQZMYVFBGNI-SSZFMOIBSA-N 445.485 4.127 10 10 IICE COC(=O)CC[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1136633284 HJAOIGPYMVOZNN-DEOSSOPVSA-N 432.520 4.260 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1csc(-c2cccc(Cl)c2)n1 1162540006 PPAQYRFSCKLQFY-UHFFFAOYSA-N 430.913 4.375 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3ccc4c[nH]nc4c3)cc2Cl)C1 1227209379 UHJMDUOMZJBUOP-MRXNPFEDSA-N 425.964 4.495 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)N(Cc1ccco1)Cc1ccccc1O 1251426363 WLJHRBIVVONHKM-HOJAQTOUSA-N 441.528 4.237 10 10 IICE CNC(=O)c1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c(Cl)c1 1266503409 BZMZXYMZXQDYIZ-UHFFFAOYSA-N 425.916 4.180 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCC(CN(C)C(C)C)CC1 1289422607 BJOMYUQMCHHUKA-UHFFFAOYSA-N 438.664 4.210 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCC([C@H]3CCOC3)CC2)nnc1C(C)(C)C 1289427671 WYVAMYXCPHQXLA-NRFANRHFSA-N 425.621 4.251 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCCSC[C@@H]2C(F)(F)F)CCCC1 1289694678 LFZMQNGHVZBVDT-LJQANCHMSA-N 426.504 4.425 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c1 1295774440 JJOKMPMFSCMVCQ-MSOLQXFVSA-N 439.556 4.377 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCC3CCOCC3)CC2)cc1 1315515873 TZZPFHHAUODSAW-UHFFFAOYSA-N 441.620 4.118 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nnn(-c3ccccc3Br)c2C)cc1 1355909988 HDEWEWUUBSXABN-UHFFFAOYSA-N 442.361 4.114 10 10 IICE CC(C)(C)c1ncc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1434895443 GKASJINTVCLTNZ-YBEGLDIGSA-N 444.557 4.143 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C2(C(F)(F)F)CCN(C(=O)OC(C)(C)C)CC2)c1 1445968434 MFUKGRXVTBBKOL-ZDUSSCGKSA-N 446.466 4.158 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCc2cccc(O)c21 1447111116 NLWZTVYARVYNNR-QGOAFFKASA-N 442.537 4.102 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1c(F)ccnc1F 1460582885 AQMZCZVWMUVTLQ-FMIVXFBMSA-N 425.507 4.041 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)[C@@H]1CCC[C@@H](OC)C1 1461289787 XZJRLGZJLSRAOP-HGHGUNKESA-N 432.948 4.224 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1csc(NC(=O)c2cccs2)n1 1469105261 XZQOUOJRRHBYFC-OAHLLOKOSA-N 442.610 4.121 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@H]3CCCC34CCCCC4)cc2F)C[C@@H](C)O1 1473639902 BNHUJXQEEARZFM-PWHSHALESA-N 431.596 4.148 10 10 IICE C[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)CC1 1512216905 HLYQMDAIWUYTMV-HXUWFJFHSA-N 425.621 4.378 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1513117686 UPHYRUXXKOMHCM-LJQANCHMSA-N 436.604 4.013 10 10 IICE CCC1(CC)CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1513588288 OZZNZVJHLCHBHR-UHFFFAOYSA-N 425.621 4.477 10 10 IICE CCN(CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)C1CC1 1515750821 RADISVVULWWSHN-IFMALSPDSA-N 441.620 4.023 10 10 IICE COc1ccc(N2CCCN(C(=O)CC[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1527714536 AXZHVDVODUHMLM-FQEVSTJZSA-N 445.604 4.161 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[S@@](=O)C(C)(C)C 1541427249 FWDWRHZDDZRVOZ-WJOKGBTCSA-N 445.677 4.260 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnccn2)nnc1N(C)[C@H](C)c1cccs1 1542227352 ZZPQGYWPSZKNDU-QGZVFWFLSA-N 433.585 4.417 10 10 IICE CN(c1ccc(CNC(=O)c2cc(NC(=O)OC(C)(C)C)nn2C)cc1)C1CCCCC1 1542411829 BAQOXEDMARNALW-UHFFFAOYSA-N 441.576 4.466 10 10 IICE Cc1cc(C(=O)Nc2cccc(-n3ccnn3)c2)c(C)n1-c1ccc(Br)cn1 1545693491 XFTBCTODILGBCJ-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CC=C(c4ccc(F)cc4)CC3)CC2)c(OC)c1 1564440448 IPIOQVHTNFYZQO-OAQYLSRUSA-N 439.531 4.311 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cn(-c4cccc(C(F)(F)F)c4)nn3)cc2)CC1 1565663020 IZIKDUKKWSQWAP-UHFFFAOYSA-N 443.473 4.452 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(Nc2cnccn2)c1 1566306260 FSLNKAZAUWBOSB-UHFFFAOYSA-N 427.302 4.351 10 10 IICE COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)s1 1570103272 MCSADLWRZIPCRZ-UHFFFAOYSA-N 437.565 4.213 10 10 IICE COc1cc(C(N)=O)ccc1NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1570295149 HUNVLWHKRLWWLG-UHFFFAOYSA-N 442.313 4.216 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1 1583917651 CJHAOTZKRWXXRQ-HXUWFJFHSA-N 443.519 4.282 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnc3c(c2)NC(=O)CS3)cc1 1585493636 WRAYKUVVVCRVKU-UHFFFAOYSA-N 448.548 4.047 10 10 IICE CCC(CC)(CNC(=O)OC(C)(C)C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1596962931 BQDYKSSOIZSRBQ-UHFFFAOYSA-N 433.593 4.065 10 10 IICE Cc1noc(C)c1CN(Cc1c(C)noc1C)C(=O)c1cc2cc(O)c(O)cc2s1 1610924987 LXPGAOLPDJUZDI-UHFFFAOYSA-N 427.482 4.365 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCCS1 1613295206 COIFJOWXDQLEQV-RXVVDRJESA-N 429.634 4.413 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@]1(C)CCCO1 1613295228 CVRFFOUAMHWYJB-NTKDMRAZSA-N 427.593 4.086 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)COc3ccc(OCc4ccccc4)cc3)C2)cc1 1617255094 FQLGTLGNBUYSKA-OAQYLSRUSA-N 432.520 4.048 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1630698326 SNQDWVCLBSTJME-YLJYHZDGSA-N 431.577 4.054 10 10 IICE Cc1cc(C(=O)N2CCC([C@H]3CCOC3)CC2)c(C)n1-c1ccc(Br)cn1 1631396840 BJGKFNLIMXDNTG-KRWDZBQOSA-N 432.362 4.140 10 10 IICE CSc1ccccc1[C@@H](C)NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1653407171 GKHOKEZMZZIFIE-OAHLLOKOSA-N 430.529 4.473 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)N(c3nccs3)C3CCCCC3)CC2)cc1 1653841322 ZELWOBWWHAKJPS-LJQANCHMSA-N 442.629 4.418 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 1683253294 GTTWMGLTAQYSLS-UXHICEINSA-N 446.636 4.281 10 10 IICE CCCCN(Cc1ccccc1F)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1684168469 ATVOKURXPPQDTH-UHFFFAOYSA-N 440.563 4.039 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@H]2CCC(=O)OC(C)(C)C)N(C)C)cc1 1684612105 NOHOGMAZVMDLEQ-FCHUYYIVSA-N 446.636 4.041 10 10 IICE COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)CC3 1686827319 ZZLMWIPPJHWULO-QGZVFWFLSA-N 448.567 4.028 10 10 IICE CCN(c1nnc(C(=O)N2CCCC2)n1Cc1ccc(N2CCC(C)CC2)cc1)C(C)C 1709925562 OWQWVRKLAIQRFU-UHFFFAOYSA-N 438.620 4.033 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCCOC2CCCC2)cs1 1742566630 ZDHOPZYFTVSKEU-UHFFFAOYSA-N 441.601 4.325 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1C 1748379541 FGGYWCBQCOXADH-GOSISDBHSA-N 447.587 4.066 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)C[C@H]2CCCCO2)cc1 1766614085 KJQSFIJLXJRIAP-XMMPIXPASA-N 448.615 4.164 10 10 IICE CN(CCC(F)(F)F)c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1768831241 PXYRRUUCCVNTTE-ZDUSSCGKSA-N 435.541 4.200 10 10 IICE CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc3[nH]c(-c4ccc(N(CC)CC)cc4)nc3c2)C1 1873507134 WOEQPUUHRHGDKO-HXUWFJFHSA-N 448.567 4.491 10 10 IICE CN(C[C@@H](O)COCc1ccccc1)c1ccc(CNC(C)(C)C)c(Br)c1 1916344781 OTLIPYGWVXMAJG-HXUWFJFHSA-N 435.406 4.351 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N2CCC[C@H]2CN=[N+]=[N-])C1 2060638750 AMIXSIAQKXPPCH-CVDCTZTESA-N 443.548 4.132 10 10 IICE COc1ccc([C@@H](C2CCC2)n2nc(C3CC3)c(N)c2I)c(O)c1 2080012653 RWKJAOSZLSBALL-QGZVFWFLSA-N 439.297 4.051 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CN(Cc3ccccc3)CC2(C)C)c1O 2236053230 RDQLOTDBELGRKA-KRWDZBQOSA-N 433.390 4.411 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(Br)cc(F)c2O)C(F)(F)C1 2264438287 ZTIJPVOQXHLTPQ-CYBMUJFWSA-N 439.272 4.028 10 10 IICE COc1cc(OC)c(OC)cc1C=C1SC(=S)N(c2ccc(N(C)C)cc2)C1=O 2296681979 PRAQVYYURKAEQV-UHFFFAOYSA-N 430.551 4.184 10 10 IICE COc1ccccc1-n1c(C)cc(C=C2C(=N)N3C(SC)=NSC3=NC2=O)c1C 2297341022 GMFFWAORMYPEQR-UHFFFAOYSA-N 425.539 4.042 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@H]1C[C@H]2NCc1cc(Br)cc(F)c1O 2329598698 SWWOXFVOKLOKOW-DPDCMNJDSA-N 429.330 4.075 10 10 IICE COc1cc(OC)c(OC)cc1C=C1C(=O)N(Cc2ccc(C)cc2)N=C1C(F)(F)F 2332141028 CVQJBEXPGWFOBL-UHFFFAOYSA-N 434.414 4.365 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472270 QLJBGIYWAKSRKB-ARESOWRYSA-N 427.526 4.498 10 10 IICE COC(=O)CNC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)cc1 45850716 AJWLMTXKUUFGFP-UHFFFAOYSA-N 447.535 4.373 10 10 IICE COc1ccc(N2CCN(c3nc(C(=O)NCc4ccc(Cl)cc4)cs3)CC2)cc1 65211518 HOYXFIBEOZPTBV-UHFFFAOYSA-N 442.972 4.062 10 10 IICE CCCOc1ccc(Br)cc1/C=C1\SC(=S)N(CCC(=O)OC)C1=O 98031550 MPEFTDYUKCJWEX-UVTDQMKNSA-N 444.372 4.002 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C/c3ccc(-c4ccc(C(=O)OC)cc4)o3)C(=N)N12 104372510 ZPPKESRGSKXKCN-JVDIEWMDSA-N 440.506 4.063 10 10 IICE O=C(COc1ccc(/C=C2/SC(=S)N(Cc3ccco3)C2=O)cc1)N1CCCCC1 211949005 DKUAZVMPDQYZRE-CPNJWEJPSA-N 442.562 4.072 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CCSc3ccccc3Cl)CC2)cc1 302853322 ANEGJTLYLXENDF-UHFFFAOYSA-N 448.032 4.159 10 10 IICE COc1ccc(O)c(CNc2ccc(I)cc2Br)c1 388708580 UUUIUZWPYNSPNY-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2nnc(-c3ccccc3)o2)C1 766583027 AOWFCBZWZRQSIB-UHFFFAOYSA-N 430.508 4.201 10 10 IICE Cc1noc(C)c1CSc1ncccc1C(=O)NCc1cc(Br)ccc1O 804738744 CMGVLIVEGHEYNY-UHFFFAOYSA-N 448.342 4.377 10 10 IICE COc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1N1CCCCC1=O 806207355 ORTRPTHICHGGQB-UHFFFAOYSA-N 448.317 4.002 10 10 IICE CC(=O)C(=O)CSc1nnc(COc2ccccc2F)n1[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 808010273 RDSMVRYBQAQVSC-BSWAZPDLSA-N 431.533 4.244 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2[C@H]3CC[C@H]2[C@@H](CO)C3)sc(C)c1-c1ccccc1 810102232 GWAREJPWYUAFNC-QYZOEREBSA-N 442.581 4.074 10 10 IICE CCN(C)Cc1cc(O[C@@H]2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)ccn1 856624158 URXWXADVMSYXQQ-AREMUKBSSA-N 446.595 4.163 10 10 IICE O=C1COc2ccc(N[C@@H]3CC(=O)N(c4ccc(N=Nc5ccccc5)cc4)C3=O)cc2N1 913098489 ACEDLGQNNYSMJN-HXUWFJFHSA-N 441.447 4.177 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC(=O)NCCc2ccccc2)cc1 1124986195 YQNVBJGOARZCIK-UHFFFAOYSA-N 429.524 4.257 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1C 1136441271 YLPZVBLMUIWQQY-UHFFFAOYSA-N 432.524 4.269 10 10 IICE CN(C)CCN(Cc1ccc(Br)cc1)C(=O)c1cc2cc(O)c(O)cc2s1 1136507315 CXESVOYQRHOGCJ-UHFFFAOYSA-N 449.370 4.279 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)c(C)n1-c1ccccn1 1137148682 OMADWYYMOLKXKB-QGZVFWFLSA-N 442.441 4.043 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1sc(Cc2ccccc2)nc1C 1137816872 TWJNGZHFPUDAJG-UHFFFAOYSA-N 444.940 4.217 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3Cl)CC2)cc1 1140318594 ZXARCBBKUVOTGW-UHFFFAOYSA-N 439.825 4.484 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1 1182414350 VSVMGOPEKBSSIP-JOCHJYFZSA-N 425.573 4.285 10 10 IICE C[C@H](NC(=O)NCC[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 1254215058 GTHKKRUNNRFASH-PKOBYXMFSA-N 427.545 4.279 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1306274819 KNHWEJDRMCOHGS-QAPCUYQASA-N 445.662 4.403 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccc(N(C)C)cc1 1312530551 DQEDSXKJWHYELM-MAUKXSAKSA-N 439.510 4.270 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H]3c3ccc(OC)c(F)c3)C2)cc1 1312903365 XYWCGPCIZCTQDE-VGSWGCGISA-N 427.520 4.216 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 1352893335 ZCMZKAFFIWCLNY-VQTJNVASSA-N 431.439 4.085 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Oc3cccc4ccccc34)cc2F)CC1 1360091263 LJGJMUBSUVGMDZ-LJQANCHMSA-N 435.543 4.205 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC[C@@H]1CCC[C@H]1C1CC1 1436752356 VXAJECIETISHRU-IWWAEQQJSA-N 432.586 4.360 10 10 IICE CNC(=O)OC[C@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1450705737 JIHHHCCYRLJITF-GOSISDBHSA-N 448.361 4.207 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCO[C@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1470774121 WBDBGWCKRQVYTF-NQIIRXRSSA-N 449.473 4.076 10 10 IICE O=C(NCc1cccc(O)c1O)c1ccccc1OCc1ccc(Br)cc1 1471644819 ZSSGQYDHQUYJRB-UHFFFAOYSA-N 428.282 4.369 10 10 IICE COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NCc1c(O)ccc2ccccc12 1472086023 IMPFETCQJAPNKQ-HXUWFJFHSA-N 438.911 4.128 10 10 IICE CC[C@@]1(C)CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1513562468 CQSKUIHKYKARGY-VWLOTQADSA-N 425.621 4.378 10 10 IICE CCCN1CC[C@H](Cn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)C1 1514875615 PZLDUAWYSIKXHD-QHCPKHFHSA-N 438.664 4.445 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCN(C(C)(C)C)CC3)nnc2C(C)(C)C)cc1 1515529709 PQDZCZTZXAIRLM-UHFFFAOYSA-N 426.653 4.391 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1 1540537671 FLDDHWWVSMSZQH-IBGZPJMESA-N 439.547 4.384 10 10 IICE C[C@@H]1CCCCN1CCCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1544016962 MONNIDJSFYQYDF-OAQYLSRUSA-N 448.615 4.261 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@H](C(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1545578328 ZEBDZDCBBMNGHM-GCJKJVERSA-N 425.621 4.474 10 10 IICE COc1cccc2c1CC[C@]2(NC(=O)OC(C)(C)C)C(=O)NCc1cc(Cl)ccc1O 1557386563 IZOFTGPGQJYDEE-HSZRJFAPSA-N 446.931 4.037 10 10 IICE Cc1ccccc1C[C@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1564895857 XGHPFZGXQPTOMK-HXUWFJFHSA-N 429.511 4.027 10 10 IICE Cc1cnc(NC(=O)[C@@H]2CSCN2C(=O)c2ccc(-n3c(C)ccc3C)cc2)s1 1565574795 RBMCAXQNSQLFNE-SFHVURJKSA-N 426.567 4.013 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(Br)cc4cccnc34)C2)cc1 1585664418 BEHBAVUZNWEZKL-OAHLLOKOSA-N 440.341 4.262 10 10 IICE COc1cc(/C=C/C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc(Br)c1O 1595317887 GVEPSKLZZMOIOA-IZZDOVSWSA-N 445.357 4.434 10 10 IICE CCC1CCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1614189322 MLTJYLVHGFCDOM-UHFFFAOYSA-N 439.648 4.360 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c1 1624086697 MCCISHSDQCQFAX-UHFFFAOYSA-N 429.520 4.398 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCCc2nc3ccccc3n2C)cc1 1627784709 TVYYRYISSLSUDU-UHFFFAOYSA-N 428.536 4.085 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1cnn(Cc2ccccc2)c1 1628975597 WVDFVDNMPNMAEB-UHFFFAOYSA-N 426.520 4.424 10 10 IICE COc1ccc(SCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1630257271 UGNRPCUDTNQNMP-SFHVURJKSA-N 434.989 4.317 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c(C)n1-c1ccc(Br)cc1 1631252493 NCIJTUAULGLMRJ-UWJYYQICSA-N 430.390 4.413 10 10 IICE Cc1cc(CC(=O)NC[C@H]2CN(c3ccc(Cl)cc3)CCO2)c(C)n1-c1ccccc1 1632972653 LNUJFNGDVVSQQQ-DEOSSOPVSA-N 437.971 4.312 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1scc(Br)c1Br 1638348297 QRDDENDVEKOSGK-SSDOTTSWSA-N 435.137 4.045 10 10 IICE COC(=O)/C=C\c1ccc(N2CC[C@]3(CCCCN3C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 1643220488 WGHMAIFYRCQZIA-MLJJGGTESA-N 445.516 4.151 10 10 IICE Cc1cc(C(=O)CSc2nc3ccsc3c(=O)n2C)c(C)n1-c1ccc(Cl)cn1 1656158073 NTMVZVPRBXWWPK-UHFFFAOYSA-N 444.969 4.426 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(C(F)(F)F)(C(F)(F)F)C3)C2)cc1 1683336762 JULGXMFIYRZSPX-ZDUSSCGKSA-N 439.400 4.048 10 10 IICE CCC(C)(C)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1693906656 HPBXPHAPJZUPIE-UHFFFAOYSA-N 448.615 4.173 10 10 IICE CSC[C@H]1CCCN1c1nnc(-c2cccn2C)n1CCCSc1nccs1 1712787362 NBMASUIMHOFOAX-OAHLLOKOSA-N 434.660 4.254 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N(C)CCc1cccs1 1724234136 AHGILEKANPYFRT-HXUWFJFHSA-N 439.629 4.335 10 10 IICE C[C@H]1COC(C)(C)CN1c1nnc(CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1731158557 UXUYMKZIZDOECJ-SFHVURJKSA-N 425.621 4.301 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](COCCOC)C1 1764371762 RSXJOCRXTUZATP-NRFANRHFSA-N 437.588 4.252 10 10 IICE CC[C@@H](O)CN(Cc1ccccc1)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 1915379558 AVCKKQFZTBPZSK-LJQANCHMSA-N 425.573 4.340 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(C)(C)C)c(CN)c1I 2079037119 DBNHPYHDWUKWCQ-CQSZACIVSA-N 427.330 4.257 10 10 IICE COc1ccc(Br)c(CN[C@@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1O 2227748126 KDFRDYCMKROHLM-IBGZPJMESA-N 431.371 4.192 10 10 IICE Cc1ccc(C)c(-c2nn(-c3ccccc3)cc2C=C2SC(=S)N(CC(=O)O)C2=O)c1 2296538169 CPVNROLROIJTRQ-UHFFFAOYSA-N 449.557 4.442 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)C1=Cc1cccc(OC)c1O 2313499138 QGKIHLQQPLMFRH-UHFFFAOYSA-N 444.281 4.041 10 10 IICE COc1ccc(/C=C/C(=O)Oc2ccc(/C=C3/SC(=S)N(C)C3=O)cc2OC)cc1 33339366 PBBJIENWQFPQNY-MMWWNLEXSA-N 441.530 4.154 10 10 IICE O=C(CSc1ncc(-c2ccccc2)n1CC(F)(F)F)N1CCO[C@@H]2CCCC[C@@H]21 109624523 VMVGOWWTEZJVPQ-FUHWJXTLSA-N 439.503 4.375 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCc2cc(C(F)(F)F)ccn2)C1 506864732 QVYOPFQYDLBTGY-UHFFFAOYSA-N 444.501 4.181 10 10 IICE COC(=O)c1csc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c1 729114680 PUMYUPCBZNHWLR-UHFFFAOYSA-N 448.469 4.185 10 10 IICE O=C(CC/C=C\c1ccccc1)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 737516236 RBRIFQMIFNVLER-WTKPLQERSA-N 445.542 4.052 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)N[C@H]1CCC(=O)N(C)C1 738500553 OQQFAXWDFVCREM-QFBILLFUSA-N 448.489 4.102 10 10 IICE Cc1cc(C(=O)CN2CCC[C@@H](c3nncn3C(C)C)C2)c(C)n1-c1ccc2c(c1)OCO2 746450625 NAOZLLUOCAIEOZ-LJQANCHMSA-N 449.555 4.058 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCCC[C@@H]1CCc1ccccc1 760820631 QTVAKQKBZICZQX-JOCHJYFZSA-N 439.575 4.484 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CCCC[C@H]1CCc1ccccc1 760820642 QTVAKQKBZICZQX-QFIPXVFZSA-N 439.575 4.484 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)C2CC2)cc1 764511441 ICQZUTDXCZSOLE-DHIUTWEWSA-N 428.527 4.150 10 10 IICE Cc1ccc(/C=C/C(=O)NCc2ccc(N(C)C(=O)/C=C/c3ccc(C)nc3)cc2)cn1 765480561 MSSJRWKFIQVYOL-WFYKWJGLSA-N 426.520 4.099 10 10 IICE COc1ccc2c(CC(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)coc2c1 768915881 NUZNPDGHKIAOND-SFHVURJKSA-N 428.916 4.124 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc4ncsc4c3)n2)cc1OC 775140334 UQPVUWGLFYBPTK-UHFFFAOYSA-N 433.536 4.238 10 10 IICE CCN(Cc1c[nH]c2ccccc12)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 785890882 WXXMUZHSJPVJLZ-UHFFFAOYSA-N 445.611 4.432 10 10 IICE CCN(CC)c1ccc(CNC(=O)N2CCCC[C@@H]2c2nnc(CC(F)(F)F)o2)cc1 812009353 OFOWHBIABSXXQL-QGZVFWFLSA-N 439.482 4.457 10 10 IICE CCOc1ccc(Br)cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 916090591 IBIVQWHRRLVABZ-UHFFFAOYSA-N 440.344 4.167 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccn(-c4cccc(Cl)c4)n3)cc2F)C[C@@H](C)O1 918161650 LOTFBPKIDJDUCU-HZPDHXFCSA-N 442.922 4.208 10 10 IICE C[C@@H](NC(=O)C1(c2cccc(OC(F)(F)F)c2)CC1)c1ccc(N2CCOCC2)cc1 1125451804 MBOWYPNCGHVQKO-MRXNPFEDSA-N 434.458 4.331 10 10 IICE CC1(C)OC(=O)c2ccccc2[C@@H]1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1125877277 DHUPGCDWLYUYIZ-HXUWFJFHSA-N 444.478 4.106 10 10 IICE Cc1ccc(CNC(=O)N[C@@H](CC(C)C)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 1137443471 QZXZUVYNPWKTHY-QHCPKHFHSA-N 437.584 4.110 10 10 IICE CCNc1ccc(C)cc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1147520522 YZTLZJDNGDLPTC-QFIPXVFZSA-N 440.588 4.489 10 10 IICE O=C(C/C=C/c1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)cc1 1148705313 HKEDWPLUTUYNCJ-OWOJBTEDSA-N 429.358 4.130 10 10 IICE COc1cccc(CNC(=O)c2c(Nc3ccc4c(c3)CCCC4)cc(C)nc2O)c1O 1150544151 YVZMKQANARDADB-UHFFFAOYSA-N 433.508 4.362 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@@H]1CCCOC1 1155617556 FTMHKQNVVTZOPE-UZLBHIALSA-N 435.362 4.028 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3CC(c4ccc(Cl)cc4Cl)=NO3)C2)cc1 1162718787 QQAUQAZMMUAFNS-LHSJRXKWSA-N 448.350 4.138 10 10 IICE CCNC(=O)c1cccc(NC(=O)CN(CCc2ccccc2)c2ccc(OC)cc2)c1 1167880512 BIVKXKPMNJSLKU-UHFFFAOYSA-N 431.536 4.133 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(Sc2ccccc2)n1 1264688044 UUKVRSJPKDLYKH-UHFFFAOYSA-N 437.540 4.447 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C 1292178533 GVOOIPQLVSCRKY-HSZRJFAPSA-N 437.584 4.463 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2cnccn2)n1CCC(C)(F)F 1298315030 OTDFKJLZRABVSG-UHFFFAOYSA-N 427.503 4.017 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1305554753 RJUQDKAXYALCDH-QFBILLFUSA-N 439.526 4.454 10 10 IICE Cc1cc(CNC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c(C)n1-c1ccccc1 1313131460 GYDYOSCKGFONEK-UHFFFAOYSA-N 446.595 4.302 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(Oc2cccc(Cl)c2)cn1 1350931700 BRVRGUCKFQHBNE-UHFFFAOYSA-N 441.890 4.433 10 10 IICE Cc1ccc([N+](=O)[O-])cc1OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1354533919 UFGPIKJZYACATA-YVLHZVERSA-N 446.481 4.239 10 10 IICE CCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H]1C[C@H](OCC)C1(C)C 1459521447 BEYYVAONJMCWHW-GOTSBHOMSA-N 448.563 4.316 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccccc2OCCN2CCOCC2)c1 1464519930 PLUWRSYMXHPIFC-UHFFFAOYSA-N 447.579 4.044 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2 1470555105 BBAMBRCAEMBPKG-HCYUJWNOSA-N 444.620 4.223 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCN([C@H](C)c4ccc(Cl)cc4)CC3)C2)cc1 1470772362 JWPDDKKLOTZGNB-WIYYLYMNSA-N 442.991 4.016 10 10 IICE CCCCN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@H](C)c1ccccc1 1471369524 LJULVEAFEURDSY-HXUWFJFHSA-N 436.600 4.461 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)[C@H](OC)c3ccccc3Cl)C2)cc1 1478466438 ITPHTRFWRHRKAX-YVHKJVDXSA-N 431.964 4.250 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1CNC(=O)NCc1cc(Cl)ccc1O 1479206861 JJMSKSUPMSRRSK-LJQANCHMSA-N 445.947 4.207 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCS(C)(=O)=O 1500033243 SYFKTWSSNNKZGY-QGZVFWFLSA-N 443.617 4.022 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC[C@H]1C 1503798563 RTWRLDDCNUEULV-WIYYLYMNSA-N 448.615 4.361 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cccc3cnccc23)NC(=O)OC(C)(C)C)cc1 1544269532 TTZVRMQYDDSHAP-HSZRJFAPSA-N 448.567 4.226 10 10 IICE Cc1ccc(C(=O)N2CCC[C@@H](Oc3ncccc3F)C2)cc1-n1c(C)cc(C=O)c1C 1556487160 MXGJNMIIWLPFCH-OAQYLSRUSA-N 435.499 4.433 10 10 IICE Cc1ccc(C(=O)N2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1-n1c(C)cc(C=O)c1C 1556849301 ZMANPHDMHOHZNN-HHHXNRCGSA-N 448.538 4.421 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O 1564554502 ZEGOAKSRMXJLOX-AOYPEHQESA-N 439.575 4.341 10 10 IICE CCn1c(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cnc1Br 1568142198 OYDBLMNOBYUBMB-CYBMUJFWSA-N 439.785 4.485 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CNC(=O)c1sc2ccccc2c1Cl 1570417191 XASUGTXJMSSTAN-OAHLLOKOSA-N 444.000 4.406 10 10 IICE Cc1cc(CC(=O)Nc2cc(F)c(F)cc2N2CCOCC2)c(C)n1-c1ccccc1 1586931463 KOJKTTXCSORAMP-UHFFFAOYSA-N 425.479 4.390 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CN(Cc4ccccc4)C[C@H]3CC(C)C)C2)cc1 1587112105 AZBHMQFHKJOJMA-MVERNJQCSA-N 435.612 4.184 10 10 IICE CC[C@@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N(C)C(=O)OC(C)(C)C 1587150114 AHSPMVDBIHXMLH-QAPCUYQASA-N 441.519 4.019 10 10 IICE CC(=O)[C@H]1CC(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)=NN1c1ccccc1 1587880480 CKGVBNYTASXEDD-RUZDIDTESA-N 428.536 4.243 10 10 IICE CSc1ccccc1NC(=O)CN(C)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1588006464 BVPITPJYEFEBMO-UHFFFAOYSA-N 435.549 4.339 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCOC2)nnc1N1CCC(Cl)=C(Cl)C1 1611963746 ZDQHPSZEJXZSDW-MRXNPFEDSA-N 436.387 4.104 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)C1 1616602594 MXYNQZJOVWLMHJ-SJORKVTESA-N 437.635 4.164 10 10 IICE Brc1cc(CNCCc2nnc3n2CCCCC3)ccc1N1CCCCC1 1620712679 CQRMZTVHNWYQNZ-UHFFFAOYSA-N 432.410 4.090 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@](C)(Cc2ccccc2)[C@H](C)O)CCCC1 1623463172 GXZLPLDFTVYVFB-PPHZAIPVSA-N 434.580 4.275 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnc(CNC(=O)OC(C)(C)C)s2)cc1F 1628770129 XIPHJRUNNHSRDT-UHFFFAOYSA-N 436.553 4.083 10 10 IICE COc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OCC(C)C 1630257072 MPWRZWXVELNNKS-HXUWFJFHSA-N 446.975 4.483 10 10 IICE Cc1ccc(C(=O)Nc2n[nH]c(Cc3cccc(F)c3)n2)cc1-n1c(C)cc(C=O)c1C 1639701843 CJDFZZRTERARNU-UHFFFAOYSA-N 431.471 4.315 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)Cc3cccc4ccccc34)cc2F)C[C@@H](C)O1 1644342847 UONLFRYJFLBBTR-BGYRXZFFSA-N 449.570 4.341 10 10 IICE Cc1cc(CC(=O)N(C)Cc2nnc3n2C[C@H](C(F)(F)F)CC3)c(C)n1-c1ccccc1 1645382318 UHFZVZSGLHRMGX-GOSISDBHSA-N 445.489 4.011 10 10 IICE CCOC(=O)CS[C@@H](CNC(=O)c1sccc1-n1c(C)ccc1C)C(F)(F)F 1650766325 YZORJKSUDDCCNY-AWEZNQCLSA-N 434.505 4.113 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1([S@](C)=O)CCC1 1693994038 ANSIHLFHXGNQNI-KKIUXKEOSA-N 443.661 4.329 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CCC[C@@H](C(C)C)C1 1707305278 VWRWYTRWEXVBSZ-IRLDBZIGSA-N 425.621 4.467 10 10 IICE Cc1cc(Cn2c(-c3cc(C)n(-c4ccccc4)c3C)nnc2N(C)[C@@H](C)CC#N)on1 1707946142 FMOAJWKDCUYKMK-KRWDZBQOSA-N 429.528 4.436 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC[C@H](OCCOC)C3)nnc2C(C)(C)C)cc1 1728384119 YDFGXYVRDYVAGZ-QFIPXVFZSA-N 443.636 4.102 10 10 IICE COC[C@@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1730562166 NCIQPCJWXIISJP-HXUWFJFHSA-N 425.621 4.160 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@H](C)[C@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1742333539 CBBIPSZAAMQOTQ-RTBURBONSA-N 436.629 4.401 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)cc1C 1743605965 FSMOYCGTSQVCPA-URLQWDBASA-N 439.526 4.370 10 10 IICE O=C(C1CCN(c2nnc(C3CC3)n2CCCSc2nccs2)CC1)C(F)(F)F 1771554384 QMPGOIWMVSRUQJ-UHFFFAOYSA-N 445.536 4.142 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3ccc(Br)cc3O)C[C@]2(C)C1 2116294338 MTRINBYFJUUOML-DKICVRJWSA-N 425.367 4.280 10 10 IICE Cc1ccc(-n2c(C)cc(C=C3C(=O)NC(=O)N(Cc4ccco4)C3=O)c2C)cc1Cl 2313540633 LVERMKNQXQIRRX-UHFFFAOYSA-N 437.883 4.311 10 10 IICE COc1cc(C=C2SC(=S)N(C3CCN(Cc4ccccc4)CC3)C2=O)ccc1O 2323874546 WQCNRALLGBGFAI-UHFFFAOYSA-N 440.590 4.267 10 10 IICE Cc1ccc(CN(C)C(=O)C(C)(C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2352671820 KWVRMAPXOSXAEA-UHFFFAOYSA-N 429.355 4.067 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2[C@@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380771939 KUYXCBJPQCQBNV-BBRMVZONSA-N 441.366 4.067 10 10 IICE CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)c2cc(C)n(-c3ccccc3)c2C)C1=O 8891495 SDLHPBPPRAYPMJ-RUZDIDTESA-N 433.483 4.273 10 10 IICE C[C@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3ccc(Cl)c(Cl)c3)s2)C1=O 11635439 SSUYBLRSPVUBFL-MRVPVSSYSA-N 446.406 4.228 10 10 IICE COc1cc(/C=C2/SC(Nc3cccc(Cl)c3)=NC2=O)ccc1OCCC(=O)O 16912298 DJXGYMPDPLEIIN-LICLKQGHSA-N 432.885 4.285 10 10 IICE COc1ccc([C@@H]2Nc3c(C(=O)NC[C@@H]4CCCO4)cccc3[C@@H]3C=CC[C@@H]32)cc1OC 226855216 IHMYISQGBICZFI-YDLHNXBPSA-N 434.536 4.439 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(NC(=O)c4ccoc4C)CC3)c2C)cc1 727402941 NDFXSBSDOPSDDU-UHFFFAOYSA-N 435.524 4.039 10 10 IICE CCCc1ccc(S(=O)(=O)Nc2nc(-c3ccc(CCNC(C)=O)cc3)cs2)cc1 731059001 MASOSTCAMKYYMV-UHFFFAOYSA-N 443.594 4.242 10 10 IICE CC(=O)N[C@H](CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)c1ccc(F)cc1F 741664642 DOLHIIAAYGVNRB-XMMPIXPASA-N 439.506 4.299 10 10 IICE Cc1cccc(C(C)C)c1NC(=O)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743975763 UZNPPZRKNBVIOH-QGZVFWFLSA-N 445.510 4.444 10 10 IICE Cc1cc(-c2csc(NC(=O)c3cc(C(N)=O)cn3C)n2)c(C)n1-c1ccc(F)cc1 755678212 NWKDZQIVNGHNHG-UHFFFAOYSA-N 437.500 4.046 10 10 IICE Cc1nc(C)c([C@H](C)N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 769044666 WWNKILSFULXAIQ-SFHVURJKSA-N 441.645 4.195 10 10 IICE Cc1cc(Br)cc([C@H](C)NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c1O 797087063 OKXCAMUTESOIPX-LBPRGKRZSA-N 440.769 4.400 10 10 IICE COc1ccc2occ(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)c2c1 799314735 QNFSLGDBYMKJEM-UHFFFAOYSA-N 434.414 4.227 10 10 IICE CCOCc1cc(CNC[C@H]2CN(Cc3ccccc3)CC23CCOCC3)ccc1OC 815149755 YRFJMAXKSDWIQN-VWLOTQADSA-N 438.612 4.250 10 10 IICE CCCOc1cccn2c3c(nc12)CCN[C@H]3c1cc(Cl)cc(Br)c1O 821242586 JASYKERMEWNPBC-INIZCTEOSA-N 436.737 4.480 10 10 IICE Cc1nn(C)c(C)c1CCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 914767920 VODSKIQQEHXXNB-UHFFFAOYSA-N 429.362 4.179 10 10 IICE COc1ccccc1N1C(=O)/C(=C\c2ccc(I)o2)SC1=S 916662862 SCKGBKISTOLGKW-XYOKQWHBSA-N 443.287 4.299 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3csc(-c4ccccc4F)n3)cc2F)CC1 1125907077 GIUSCNFZMCRCCB-UHFFFAOYSA-N 442.535 4.160 10 10 IICE C[C@@H]1CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)[C@@H]2CCCC[C@@H]12 1137788978 WVFVVGZFZYEHRD-CFSSAELTSA-N 432.586 4.454 10 10 IICE CSCC[C@@H](CC(=O)NCc1cc(Cl)cc(Cl)c1O)NC(=O)OC(C)(C)C 1141737978 QFTPEPJCLMLJSP-ZDUSSCGKSA-N 437.389 4.352 10 10 IICE COc1ccc(CNC(=O)c2c[nH]nc2NC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1150578602 ZMEJCXQBLZHKQJ-UHFFFAOYSA-N 443.507 4.008 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)C2)cc1 1224641357 JWPFTWUCHMVLJN-IIBYNOLFSA-N 427.520 4.262 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 1225677143 YTPAOIRIZANBOI-OAQYLSRUSA-N 446.954 4.271 10 10 IICE C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1233605140 SGFQVXSAHBBJJI-KRWDZBQOSA-N 449.517 4.439 10 10 IICE CC(=O)Nc1cccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1264201364 AYSZSNKBGQKKOH-WOJGMQOQSA-N 443.525 4.014 10 10 IICE CC1CCN(c2cccc(NC(=O)c3ccccc3S(=O)(=O)C(F)(F)F)c2)CC1 1265359544 MYUFULDLPSMXDN-UHFFFAOYSA-N 426.460 4.469 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)c1 1293984687 BNDHAJQLXHCJTO-QFIPXVFZSA-N 430.426 4.087 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(C(=O)OC(C)(C)C)nn1C 1295590856 QLUMTYLBTVAQLB-QGZVFWFLSA-N 435.524 4.485 10 10 IICE Cc1ccc2c(C(=O)N[C@@H](C)Cc3ccc(O)c(O)c3)cc(-c3cnn(C)c3)nc2c1C 1296246993 QEFHGKOUCNKBBV-HNNXBMFYSA-N 430.508 4.024 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(c2cc(Cl)ccc2OC)C1 1297005629 KRGJEFYFSMCATL-QGZVFWFLSA-N 430.932 4.236 10 10 IICE Cc1cc(-c2nnc(N3CCN(C)C(=O)[C@@H]3C)n2CCCC(C)C)c(C)n1-c1ccccc1 1304195227 AQLNXKZFPLPGBC-NRFANRHFSA-N 448.615 4.456 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cc1 1312444771 XLMUXFYIQINPOB-NRFANRHFSA-N 446.954 4.272 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(F)cccc1-n1cccn1 1352893272 YRJZFJJCFIPGNG-UHFFFAOYSA-N 430.430 4.012 10 10 IICE CCCNC(=O)c1cccc(CNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1441615564 PKBYOUXXWBHILK-UHFFFAOYSA-N 431.536 4.285 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2cc(-c3ccccc3)n[nH]2)cc1 1456974479 WIWMBUFRUKUJNS-UHFFFAOYSA-N 426.520 4.498 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCCN1CCCC1 1503489382 SJGGIAURVUJKOJ-IFMALSPDSA-N 441.620 4.025 10 10 IICE COc1cccc(-c2nnc(N3C[C@H](C)O[C@@H](C)C3)n2CCCSc2nccs2)c1 1518379861 XSGHSFWMTCLYJS-HOTGVXAUSA-N 445.614 4.206 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(OC)cc1 1523472668 MKROVHMTRVRIIY-QHCPKHFHSA-N 440.927 4.329 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@@H]3CCCC[C@H]32)sc2c1CC[C@@H](CC)C2 1523797600 UQDZFMKBHZCSQT-YALNPMBYSA-N 432.586 4.073 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)N(C)C)cc1 1539707866 ULWLUIOQORJBRT-XMMPIXPASA-N 448.542 4.177 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N(C)C[C@H]1CCCCO1 1542228563 NUMXDXQUUVGNCG-HSZRJFAPSA-N 425.621 4.439 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1545295950 CFRWEKFSGCOKSZ-XMSQKQJNSA-N 447.599 4.012 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(F)ccc(Br)c3C)CC2)cc1F 1545608549 XIONVPMKXNNBMX-UHFFFAOYSA-N 425.273 4.007 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)N(C)C)CC1 1555315897 CVHCGYDNDKUCPV-FQEVSTJZSA-N 448.615 4.086 10 10 IICE CCC1(N2CCOCC2)CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 1557823436 PCFYNQDKDOEHOK-UHFFFAOYSA-N 429.992 4.465 10 10 IICE Cc1cc(COc2ccc(C(=O)NCc3c(O)cccc3F)cc2Br)no1 1558454155 AKZKMUAZWVGVCU-UHFFFAOYSA-N 435.249 4.099 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)NCc2ccc(C)cc2)c(OC)c1 1559666382 IUDYJYNQFAGURK-UHFFFAOYSA-N 447.535 4.017 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)c1 1566374292 BXHLSCNWGQAKQC-OIAISFKWSA-N 448.922 4.369 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(CCN4[C@@H](C)CC[C@H]4C)CC3)c2C)c1 1584484220 FTKUDMRGCJXHNQ-SZPZYZBQSA-N 436.644 4.342 10 10 IICE CC(=O)[C@@H]1CC(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)=NN1c1ccccc1 1587880482 CKGVBNYTASXEDD-VWLOTQADSA-N 428.536 4.243 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)CC[C@@H]3C)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1611935050 FLHNVQCILTVGIT-MSOLQXFVSA-N 434.588 4.066 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc4cc(OC)ccc4c3=O)c2C)cc1 1613652399 HBPPQRUTEGDOFR-UHFFFAOYSA-N 431.492 4.094 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@]2(C)Cc2ccc(OC(F)(F)F)cc2)cc1 1620158015 XZYWPWWLFMKRDE-HSZRJFAPSA-N 449.517 4.365 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cccc(S(=O)(=O)C(F)(F)F)c2)cc1 1624540983 IFHAJNRWFQJOAO-UHFFFAOYSA-N 428.476 4.099 10 10 IICE Cc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1628880190 GFIIEBOGTJJWKB-WZONZLPQSA-N 429.520 4.139 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@@]3(CCCOC3)C2)c(C)n1-c1ccc(Br)cc1 1634157253 ZXXXXYQCRSFQGX-AOMKIAJQSA-N 447.373 4.267 10 10 IICE CCCCn1ncc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 1634161739 CMZYVSWZDYQNHB-OAQYLSRUSA-N 443.592 4.053 10 10 IICE CC(C)(C)OC(=O)N[C@H](C[C@@H]1CCCN(C(=O)Cc2ccc(O)c(O)c2)C1)C1CCCC1 1637561208 ICTLTGNHONSGPU-AZUAARDMSA-N 446.588 4.353 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1640569520 BQJFVDBULJXWGC-MBSDFSHPSA-N 434.536 4.253 10 10 IICE CCOc1ccc(N2CCN(CC(=O)N[C@@H](c3ccc(F)cc3)C3CCCC3)CC2)cc1 1642354562 OKLAFXWIBFEKIM-AREMUKBSSA-N 439.575 4.394 10 10 IICE CC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccccc1OC 1654581919 SDSVGVFBQHQEHW-HXUWFJFHSA-N 428.488 4.150 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCCc2ccc(OCC(F)(F)F)nc2)cc1 1671950632 ZMQIEVBUIAATHY-UHFFFAOYSA-N 438.494 4.253 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CCC(C)(C)CN1C(=O)OC(C)(C)C 1675208839 XBXKGQIEKQNKFZ-HXUWFJFHSA-N 432.609 4.320 10 10 IICE CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1682096844 BVEXVRWBYRSZRT-SQJMNOBHSA-N 437.632 4.083 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(Cc2cc3ccccc3[nH]2)CC1 1682101357 OYRVKFGUNQUIEG-FQEVSTJZSA-N 433.600 4.001 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC([C@@H](O)c4ccc(Cl)cc4)CC3)C2)cc1 1682646599 UPZHSPFAYAHCRL-OFNKIYASSA-N 443.975 4.083 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCCc1c[nH]c2cc(F)c(Cl)cc12 1687224685 LFMPZYCNELFWJH-UHFFFAOYSA-N 444.938 4.181 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N(C)[C@H](C)c1ccco1 1693005559 JMSOPXVXXZTQKA-LJQANCHMSA-N 430.556 4.477 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1OCCC1(C)C 1694110077 VGMHNNYXXJFTAC-SIKLNZKXSA-N 441.620 4.332 10 10 IICE CCO[C@H](CCn1c(C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)C1CCCC1 1695998006 AGMMBEWOODJVGZ-XMMPIXPASA-N 441.620 4.297 10 10 IICE CN(CCCn1c(N(C)Cc2ccccc2O)nnc1C(C)(C)C)C(=O)OC(C)(C)C 1696803871 YEWLFVJEKZOSKF-UHFFFAOYSA-N 431.581 4.175 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@H]3CCCCCC[C@H]32)n1CCCSc1nccs1 1723580804 SNPPTKSNDPUJFK-IAGOWNOFSA-N 448.662 4.214 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CCC[C@H](C)C2)cc1 1746093785 OTTAFEWIOMHTKC-IBGZPJMESA-N 435.620 4.271 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@](=O)CC)C(C)C 1764745281 AOWLQTQDBGJPGM-SSEXGKCCSA-N 427.618 4.356 10 10 IICE O=C(CNCc1cc(Cl)cc(Br)c1O)Nc1cccc(Br)c1 1860721215 HUVBKQVJNKCPDG-UHFFFAOYSA-N 448.542 4.299 10 10 IICE CCC(=O)Nc1ccc(N2C(=O)C(O)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)cc1 1872957636 BCSAAPXCZUAWTA-UHFFFAOYSA-N 429.476 4.285 10 10 IICE C[C@@H](C(=O)O)[C@@H](Cc1ccc(O)c(O)c1)NC(=O)OCC1c2ccccc2-c2ccccc21 1951904169 ZSIPUMNIWPINFS-IVZQSRNASA-N 447.487 4.268 10 10 IICE Oc1ccc(C(F)(F)F)cc1Cn1nc(I)cc1C(F)(F)F 2079171958 HFBJRTQKXWXBCS-UHFFFAOYSA-N 436.093 4.279 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CNCc3ccc(Br)cc3O)CCC[C@H]12 2087289476 MWJIXYMTFLRLKA-FXAWDEMLSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)NCC1CC(F)(CNCc2cc(Br)cc(F)c2O)C1 2115638431 VJLBJUHDOJKPCJ-UHFFFAOYSA-N 435.309 4.026 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NCc1cc(Br)ccc1O 2144145372 RMTXEHVTVILOKT-IEBWSBKVSA-N 433.346 4.435 10 10 IICE CCC1(NCc2c(Br)ccc(OC)c2O)CCN(C(=O)OC(C)(C)C)CC1 2236054554 JRGAGAMEHCRUKS-UHFFFAOYSA-N 443.382 4.433 10 10 IICE O=C(O)[C@@H](Cc1ccccc1)N1C(=O)C(=Cc2ccc(Br)cc2)SC1=S 2293039572 NWNRPXAZPNUBGV-OAHLLOKOSA-N 448.363 4.346 10 10 IICE O=C(NN1C(=O)C(=Cc2nc3ccccc3[nH]2)SC1=S)c1ccc(Cl)cc1Cl 2296883385 VQORZZSDACWMBW-UHFFFAOYSA-N 449.344 4.416 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(c3ccc(OC)cc3)C2=O)c1)C(=O)O 2314930639 GZEFGHSOCZIIFZ-KRWDZBQOSA-N 429.519 4.343 10 10 IICE Cc1nn(CC(=O)N[C@@H](c2ccccc2)c2c(O)ccc3ccccc23)c(C)c1[N+](=O)[O-] 10909504 FMBWHGZATUYUGP-QHCPKHFHSA-N 430.464 4.173 10 10 IICE O=C(CN1C(=O)/C(=C/c2cccc(Cl)c2Cl)SC1=S)Nc1nccs1 15037034 GVNUYLIUFQFUJE-POHAHGRESA-N 430.363 4.290 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCC1 20681699 HCTRFWHLEDSEDK-PNCHPQGNSA-N 426.538 4.099 10 10 IICE C=CCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(CCCCCC)C1=O 33475534 QOYHMIRTNUEXSS-PEZBUJJGSA-N 428.583 4.074 10 10 IICE Cc1cc(/C=C\C(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)c(C)n1-c1ccccc1 208114560 CFQBEDMHVMDUSU-GTPZACKGSA-N 442.607 4.212 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 226830168 AQVIQLTVKYNCGI-JLHGSKIFSA-N 427.526 4.452 10 10 IICE C/C(=C\C(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1)c1ccccc1C(F)(F)F 745274225 UQWUSEOQCBQOKF-DTQAZKPQSA-N 434.458 4.377 10 10 IICE CCOC(=O)c1sc([C@@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)nc1C 757269703 BYIKGTVAPIEKLK-OAHLLOKOSA-N 430.574 4.129 10 10 IICE Cc1cccnc1[C@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)C(C)C 768727881 PPIFHGWBBWXUDW-XMMPIXPASA-N 435.616 4.119 10 10 IICE CN(Cc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769038639 VCBPMHJOMDEVRH-UHFFFAOYSA-N 426.992 4.214 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)c3ccc(C(=O)C(C)C)cc3)cc2F)CC1 801671027 WALPFYVZOJCRBV-IBGZPJMESA-N 439.575 4.226 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1C(=O)Nc2c(Br)cccc21 1124872007 DPOMTEXFWINKDU-SFHVURJKSA-N 444.373 4.378 10 10 IICE CN1CCN(c2ccc(CNC(=O)CSCc3ccc(C(C)(C)C)cc3)cc2)CC1 1132903230 WXMOMKFZIJLHBW-UHFFFAOYSA-N 425.642 4.286 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cnn(-c2ccc(Cl)cc2Cl)c1 1167762129 HDITXTVEISVINB-UHFFFAOYSA-N 445.350 4.070 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)N1CCC(OC)CC1 1291444891 BZCXNOWNYYZOAU-GOSISDBHSA-N 429.609 4.023 10 10 IICE CC(C)(C)OC(=O)N1CCC=C(C(=O)N(Cc2ccco2)Cc2ccccc2O)CC1 1294674824 YKSGTUVKIINDGT-UHFFFAOYSA-N 426.513 4.471 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H]([C@@H]3CCOC3)C2)cc1 1295420555 SIKRKNITZYSAGU-FGZHOGPDSA-N 425.621 4.234 10 10 IICE Cc1ccccc1Cc1nnc(Nc2ccn(C)n2)n1CCCSc1nccs1 1304560382 MTIBHRPURAIQKN-UHFFFAOYSA-N 425.587 4.293 10 10 IICE Cc1cc(CN2C(=O)c3ccc(Br)cc3S2(=O)=O)ccc1N1CCCCC1 1307342604 ZIKDYIYEPUANFC-UHFFFAOYSA-N 449.370 4.093 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN[C@H](C)c1ccc(N2CCOCC2)cc1 1307642901 QGKRUOZXGIOHKQ-CQSZACIVSA-N 426.435 4.163 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H]3C[C@@H]32)c(C)n1-c1ccccc1 1313099195 BSBPFVBVCOYWSC-FCHUYYIVSA-N 438.572 4.040 10 10 IICE CCOc1cccc(CCC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1 1355707707 JHACSLZLCZVVAY-UHFFFAOYSA-N 436.474 4.190 10 10 IICE COc1ccc2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)cnc2c1 1360045603 NNPVBZGIZPHYMV-UHFFFAOYSA-N 427.451 4.244 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1 1451326251 LNFFMHRNCIVVFI-UHFFFAOYSA-N 431.583 4.485 10 10 IICE COc1ccc(N2CCC(NC(=O)c3c(C)nn(C)c3Sc3ccccc3)CC2)cc1 1455929129 FSGPGERZHYMSEE-UHFFFAOYSA-N 436.581 4.287 10 10 IICE CCO/C=C\[C@](O)(CNC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)C(F)(F)F 1468483587 RBEWMADPKBJXBC-QJRAZLAKSA-N 444.881 4.250 10 10 IICE C[C@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccc(-n2cccn2)c(F)c1 1470299245 BBVRZKPAARVVSV-FXAWDEMLSA-N 438.503 4.169 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4cccnc4)n3CCC=C(C)C)CC2)cc1F 1504295095 FYPDDIJPFRGTBE-UHFFFAOYSA-N 436.535 4.171 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NC[C@@H]1CCCCC(F)(F)C1)c2[N+](=O)[O-] 1523817376 FXSUHSCEMLZEII-CYBMUJFWSA-N 442.418 4.316 10 10 IICE C[C@@H](CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)CC(F)(F)F 1525651367 VYKWBRSYZZZHAI-JYVXZMADSA-N 436.546 4.434 10 10 IICE COc1ccc(N2CCCN(C(=O)COc3ccccc3Cc3ccccc3)CC2)cc1 1526237420 JGAOQBOPIHQTJN-UHFFFAOYSA-N 430.548 4.404 10 10 IICE CC(C)(Oc1ccc(C(F)(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1527482227 VMLJRXHJSYHSKO-UHFFFAOYSA-N 440.437 4.155 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2CCN(c3nc4ccccc4s3)CC2)cc1 1530895685 AYLYULGCXOTCTK-UHFFFAOYSA-N 438.597 4.116 10 10 IICE Cc1ncc([C@H](C)NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)s1 1534717846 JYVILIXHTKEPSD-LUHPIMIVSA-N 437.637 4.372 10 10 IICE Cc1ccccc1-n1ncc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1C(C)C 1537483140 MIUJTWGJMPWQNG-DEOSSOPVSA-N 433.600 4.403 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1ncoc1C1CCN(C(=O)OC(C)(C)C)CC1 1540440589 MMDIJQBCDRYOIV-UHFFFAOYSA-N 442.560 4.127 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1 1540452656 NZRBEXNAQYABJW-SANMLTNESA-N 429.564 4.402 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2(C)CCCC2)CCOC1 1541718709 WLTGQEGRDHCSEI-DEOSSOPVSA-N 428.577 4.241 10 10 IICE Cc1cc(C(=O)N[C@@H](C)COc2ccccc2)c(C)n1-c1ccc(Br)cn1 1542624452 DHYRJVPBEQIYMI-AWEZNQCLSA-N 428.330 4.449 10 10 IICE Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1543594113 ONEZCUWPWRTJSR-VWLOTQADSA-N 429.564 4.252 10 10 IICE Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1545005196 HXEDFGUFMOEWCM-IBGZPJMESA-N 439.556 4.202 10 10 IICE CCS(=O)(=O)c1ccc(O)c(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c1 1545998128 FHLJHIOHEAGDPM-UHFFFAOYSA-N 426.538 4.462 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H](N3CCCCC3)C2)cc1 1547446941 KYSTYHAYSYNAKR-XMMPIXPASA-N 438.664 4.436 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)Oc1ccc2c(c1)CCC2 1556426393 LCYUDSVXFCOZKK-GOSISDBHSA-N 438.568 4.331 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccc(CCNC(=O)OC(C)(C)C)cc1 1557063723 XNFYGIDPNZNLLF-IBGZPJMESA-N 439.600 4.489 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3nnc(-c4ccccc4[N+](=O)[O-])n3)c2C)cc1C 1559473688 DALUXXYKQNXMIP-UHFFFAOYSA-N 430.468 4.156 10 10 IICE Cc1cc(C(=O)NC[C@@H](Cc2ccccc2Cl)C(N)=O)c(C)n1-c1ccc(Cl)cc1 1565782396 TXFFGTMUEUNXDN-QGZVFWFLSA-N 444.362 4.475 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@H](O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cn1 1566326065 YFJHRHYEFCKPPY-RBZFPXEDSA-N 446.320 4.243 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1615381693 CSPHINHUBGTIML-HXUWFJFHSA-N 448.615 4.162 10 10 IICE CCc1ccc(O)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1624313926 ZUKFFJOEQUKTHX-PDGQHHTCSA-N 430.526 4.324 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)N(C)C2CC2)c(C)n1-c1cccc(C(C)C)c1 1624648181 BQQMCUHLUUUGEP-QFIPXVFZSA-N 425.598 4.353 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C)(NC(=O)OC(C)(C)C)CC2)c1 1625315339 YHVBKBMNRGWQKM-UHFFFAOYSA-N 439.556 4.426 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@@H]3CCC[C@H](C(C)(C)C)CC3)CC2)cc1 1625352961 OIJUQQUHFNCURG-BDNPHABPSA-N 441.616 4.011 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1csc(Br)c1 1631425376 DBOSITNLLGRXFH-AWEZNQCLSA-N 429.767 4.264 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3cc(Cl)ccc3OC)C2)cc1F 1633259690 WCXUPPKBLISHSR-MRXNPFEDSA-N 447.938 4.003 10 10 IICE Cc1ccc(C(=O)NC[C@H](c2ccc(Cl)cc2)N(C)CCC(F)(F)F)c(O)c1O 1636422504 OSJIBSQPALECQQ-MRXNPFEDSA-N 430.854 4.415 10 10 IICE Cc1cc(C(=O)NCc2ccc(CN3CCNC3=O)cc2)c(C)n1-c1cccc(Cl)c1 1642808082 UIFJXKLMALRGIO-UHFFFAOYSA-N 436.943 4.203 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H]3CC[C@H]2[C@@H](C)[C@@H](O)C3)sc(C)c1-c1ccccc1 1644016028 YEYPQQIHVLCXHA-FCLVOEFKSA-N 442.581 4.072 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])c1 1655534260 JBTFVBWVUDVXTR-WCYCAPIHSA-N 445.516 4.008 10 10 IICE Cc1cc(CCNC(=O)N2CCCC[C@H]2COC(=O)NC2CC2)c(C)n1-c1ccccc1 1684443622 CMWMUPMMQRVPOW-QHCPKHFHSA-N 438.572 4.089 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCN(CC)C(=O)OC(C)(C)C 1693995435 CYDWKMDNODTZHO-KRWDZBQOSA-N 431.581 4.391 10 10 IICE Cc1csc(CN(C)c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)cc2)c1 1707728106 FJRZOPSPMVHQMB-UHFFFAOYSA-N 439.629 4.368 10 10 IICE CCCN(CCC)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1766021760 BXYPCNQZVOYBJI-HSZRJFAPSA-N 441.620 4.013 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C3CCC3)c(CN)c2I)c(O)c1 2079006003 UBBOVJUVVCRZLH-GOSISDBHSA-N 439.341 4.473 10 10 IICE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCc1cc(Br)cc(F)c1O 2107376161 CTCAWJLJENADGW-LRDDRELGSA-N 431.346 4.419 10 10 IICE Brc1cc(N2C[C@@H]3CCN(Cc4ccccc4)[C@H]3C2)ccc1CNC1CC1 2188882473 ZDNUZTDSAKJPRV-CVDCTZTESA-N 426.402 4.412 10 10 IICE Cc1cc(C=C2SC(=O)N(CC(=O)OC(C)C)C2=O)c(C)n1-c1ccc(N(C)C)cc1 2293998899 KLTIEFBWOBEBKF-UHFFFAOYSA-N 441.553 4.148 10 10 IICE CCOc1cc(C=C2C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)c(Br)cc1O 2296907962 KGXXZYOINJOCOM-UHFFFAOYSA-N 445.269 4.058 10 10 IICE COC(=O)c1ccc(N2NC(=O)C(=Cc3ccc(-c4ccc(C)c(Cl)c4)o3)C2=O)cc1 2297458331 RIBMFHVFWMGODT-UHFFFAOYSA-N 436.851 4.156 10 10 IICE C[C@@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)C(=CC=Cc2ccccc2)SC1=S 2314837831 XEQBBNFFVROLEV-AWEZNQCLSA-N 438.530 4.169 10 10 IICE CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380759048 LDVLOHYERBMHDP-LRDDRELGSA-N 443.382 4.361 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@H](c2ccc(Cl)cc2)N3)CC1 14465084 NTFMATRYGUUETK-VIZSFHNOSA-N 444.000 4.103 10 10 IICE CCOc1ccccc1N1C(=O)/C(=C\c2ccc(OC)c(OC)c2C(=O)O)SC1=S 16906155 VWQSBXZEQXGTOO-LFIBNONCSA-N 445.518 4.207 10 10 IICE OCCN1CCN([C@H]2Cc3ccc(F)cc3Sc3ccc(C(F)(F)F)cc32)CC1 33874629 JRWBLUYTPUBWAF-SFHVURJKSA-N 426.479 4.203 10 10 IICE O=C(NN1C(=O)/C(=C/c2ccc(Br)o2)SC1=S)c1ccc(Cl)cc1 40839750 HRLQNJGTDIKMMH-XFFZJAGNSA-N 443.731 4.242 10 10 IICE COc1cc(/C=C\C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)ccc1OC(F)F 229823432 VUELEVCLMLENOL-XFFZJAGNSA-N 442.466 4.259 10 10 IICE Cn1ncc(CNCc2cc(Cl)cc(Br)c2O)c1NC(=O)OC(C)(C)C 708078460 XMAKUCZNOQYPCM-UHFFFAOYSA-N 445.745 4.178 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCCCN1C(=O)c2ccccc2C1=O 754162492 KJZFHXOPKZANBB-UHFFFAOYSA-N 433.552 4.102 10 10 IICE COc1cc(OC)cc(N2CC[C@H](CN[C@@H](C)c3ccc(Br)cc3O)C2)c1 756648940 BIDWIVUGLFOHRW-LSDHHAIUSA-N 435.362 4.349 10 10 IICE CCN(CC)c1ccc(CNC(=O)N[C@H](c2c(C)nn(C)c2C)C(F)(F)F)cc1F 757886208 NMDHLTSVCDLXJB-GOSISDBHSA-N 429.462 4.125 10 10 IICE C[C@H]1CN(c2ccc(CN[C@@H](c3ccc(F)cc3)c3ccn(C)n3)cc2F)C[C@@H](C)O1 775621510 KTPQDGFOACZJIE-SRGWNRLKSA-N 426.511 4.191 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CC3CCC(C(F)(F)F)CC3)CC2)cc1 783384693 OPTBUHYZYIGGMK-UHFFFAOYSA-N 441.538 4.082 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(OCc4ccccc4)cc3)C2)cc1 1129993318 OYZYQZTUDIJERD-HSZRJFAPSA-N 430.548 4.459 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1136442912 JENPOKBYIBFLDD-UEXGIBASSA-N 433.593 4.030 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)c1 1137696082 NTKCUVUASOIKQE-IBGZPJMESA-N 430.552 4.257 10 10 IICE CCOC(=O)C1(NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)CCCC1 1142202646 SESXDXCWKKEGEY-UHFFFAOYSA-N 433.346 4.462 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C\c1ccccc1C(F)(F)F 1152401828 PXNYFSOBKOAKFF-TWGQIWQCSA-N 427.806 4.279 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)[C@H]1CCCOC1 1155617547 FTMHKQNVVTZOPE-JXFKEZNVSA-N 435.362 4.028 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1C[C@@H](OC(C)(C)C)[C@@H]1n1cccn1 1158288833 OWZAIBIXHJXDMR-YMPZKCBVSA-N 434.540 4.030 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@@H]2c2nccn2C)c(C)n1-c1ccc(Br)cn1 1158741854 MRLXEVROVUENMC-SFHVURJKSA-N 442.361 4.208 10 10 IICE Cc1ccncc1/C=C/C(=O)N1C[C@@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1178394000 BLHIBICTZAKXRI-ZGRWHYIRSA-N 425.504 4.273 10 10 IICE CCC[C@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccccc1 1198632885 MXQJNZVEWHDATB-DYLHXGEVSA-N 441.591 4.361 10 10 IICE COc1cccc([C@H]2CCN(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)C2(C)C)c1 1256237020 PBTCYPFYPMHFME-DNQXCXABSA-N 438.616 4.342 10 10 IICE Cc1cc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)c(C)n1-c1ccccc1Br 1298102551 MDQTUOTUEQFNTC-QFIPXVFZSA-N 430.390 4.415 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC(C)(C)C(F)(F)F)CC2)cc1F 1300245906 AGBHSDPGNVIRRK-UHFFFAOYSA-N 443.489 4.464 10 10 IICE CNc1ccc(C(F)(F)F)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1355129532 FRIHVVMYCXQHRC-KBPBESRZSA-N 439.453 4.430 10 10 IICE CNc1ccc(C(F)(F)F)cc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1355129534 FRIHVVMYCXQHRC-ZIAGYGMSSA-N 439.453 4.430 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(Cl)c1 1355707852 KEAPOYALTUHVMD-UHFFFAOYSA-N 426.866 4.363 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCSC[C@@H]1C 1361095650 NANKKZKLLLSVMY-INIZCTEOSA-N 443.020 4.358 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cn(-c4ccccc4)nc3C(C)(C)C)C2)cc1 1436971664 OLCRJMIEAMUVCS-IBGZPJMESA-N 432.568 4.435 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Cl)c1O 1457034385 FRUGWRGDEDFFBZ-HNAYVOBHSA-N 448.947 4.160 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C/COc2ccccc2)NC(=O)OC(C)(C)C)cc1 1465324835 JKBPMQKZLOMLMY-FQTAANOTSA-N 439.556 4.070 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cnn(-c2cccc(Br)c2)c1 1465953664 IBBLPIYSMWBPSZ-UHFFFAOYSA-N 426.314 4.149 10 10 IICE Cc1noc(C[C@@H]2CCCN(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)C2)n1 1469961613 WFRUCTOAJOYTFJ-LPHOPBHVSA-N 445.995 4.432 10 10 IICE CCS(=O)(=O)Nc1ccccc1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1471012572 HRCIZZHUSCIFFZ-UHFFFAOYSA-N 425.554 4.094 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1nccnc1C(=O)Nc1ccc(Cl)cc1 1472085898 CJKWLKKAEABNJT-UHFFFAOYSA-N 432.867 4.171 10 10 IICE CCCN(c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1 1472689012 SOKYFFRVDVATAV-VMSUTVGLSA-N 433.505 4.007 10 10 IICE COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)c1 1472976790 BPISCAAPDMDJIO-UHFFFAOYSA-N 443.843 4.099 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@](C)(O)C1CC1 1503472958 FRMCYPSEGPHDPJ-VWLOTQADSA-N 425.621 4.264 10 10 IICE CCO[C@@H]1CCCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1516400948 GOMSYECGKAVGPG-DENIHFKCSA-N 443.661 4.398 10 10 IICE CN(Cc1ccc(F)cc1)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1517120878 PQUXUHBVADNMOK-INIZCTEOSA-N 433.578 4.196 10 10 IICE COCOc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)cc1 1524825917 MBQUVOFKIWSDEM-ATVHPVEESA-N 448.591 4.351 10 10 IICE CCn1ncnc1-c1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc1 1524936632 DMYCPAXFUXBYIU-UHFFFAOYSA-N 429.524 4.467 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccc(C)cc3)C2)sc2c1CCCCC2 1525383006 QMOUWFXZNNAPKA-KRWDZBQOSA-N 440.565 4.099 10 10 IICE COC(=O)C(C)(C)c1cccc(OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1534032071 IPYDJTMTKGWMRL-UHFFFAOYSA-N 448.563 4.464 10 10 IICE CC[C@@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)c1cc2cc(O)c(O)cc2s1 1545993846 GURAAGPECHUYRQ-BEFAXECRSA-N 439.581 4.389 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)NCc1cc(Cl)ccc1O 1557386382 SMJDWWGEQMDLKK-XPGWFJOJSA-N 426.944 4.446 10 10 IICE Cc1cc(C(=O)COc2cc(F)ccc2[N+](=O)[O-])c(C)n1-c1ccc2c(c1)OCCO2 1559351250 QJYAIEORJYAPCR-UHFFFAOYSA-N 426.400 4.174 10 10 IICE COc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1F 1585109681 AJHMATBCTCVXEF-YVLHZVERSA-N 434.489 4.203 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccc(C(C)(C)C)cc3)CC2)c(OC)c1 1587487273 XULVWADWQNTUCL-SFHVURJKSA-N 426.557 4.117 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H](C)c1nccs1 1598413413 KNCUAERLKATCNW-GOSISDBHSA-N 440.617 4.135 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@]1(C)CCCO1 1613295229 CVRFFOUAMHWYJB-YADARESESA-N 427.593 4.086 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCN(C(=O)OC(C)(C)C)C[C@H]2c2cccnc2)c1O 1617538494 BRVYRJCAEQBOPD-FQEVSTJZSA-N 445.947 4.437 10 10 IICE COC(=O)c1c(NC(=O)CN(CC2CC2)c2ccc(OC)cc2)sc2c1CCCC2 1618017745 FMRCMFFELGWMSP-UHFFFAOYSA-N 428.554 4.277 10 10 IICE Cc1ccc(O)c(CNC(=O)CCSCc2nc(O)c3c4c(sc3n2)CCCC4)c1 1633282945 QIICVLFNVQOCIV-UHFFFAOYSA-N 443.594 4.229 10 10 IICE CC(C)CNS(=O)(=O)c1cc(C(=O)N[C@H](C)c2ccccc2O)c(Cl)cc1Cl 1635793698 DHNIMQDFRBIGRD-GFCCVEGCSA-N 445.368 4.124 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](CCNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1636488419 RJLYUFMZTLFBGD-FQEVSTJZSA-N 425.573 4.400 10 10 IICE Cc1ccc(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1Br 1638160530 KGNCSROQFZPCAI-SFHVURJKSA-N 433.346 4.354 10 10 IICE Cc1cc([C@H](CC(=O)NCc2c(O)cccc2F)NC(=O)OC(C)(C)C)cc(Cl)n1 1638863676 PROQOLJYQCLGNH-INIZCTEOSA-N 437.899 4.160 10 10 IICE Cc1cc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(F)c4)c3C)C2=O)c(C)o1 1640895157 SUMZSGLZZKERSL-DEOSSOPVSA-N 437.471 4.093 10 10 IICE CCc1ccccc1Nc1nc(N)nc(CN2CCCc3cc(OC(F)F)ccc32)n1 1652727191 PSHQDAGOGBCNNY-UHFFFAOYSA-N 426.471 4.314 10 10 IICE COCCCC[C@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccccc1 1672443497 TUCBBVQRQQKBRI-QFIPXVFZSA-N 441.572 4.093 10 10 IICE CCC[C@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CCO1 1695159032 MPIMGXRGPIUXHU-NRFANRHFSA-N 425.621 4.303 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1696207109 ONXTVFORBSNSJR-YPAWHYETSA-N 441.620 4.192 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CCN(C(C)(C)C)CC2)cc1 1728383234 SZOMZQZILSFKRM-UHFFFAOYSA-N 426.653 4.292 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@H](C(=O)OC)C2)cc1 1728383277 VGPDOELAXQJBDQ-FQEVSTJZSA-N 441.620 4.151 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCOC(C)(C)C2)cc1 1746089967 KZVIESBNSJMIDG-UHFFFAOYSA-N 434.588 4.158 10 10 IICE COc1ccc(OCCN2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)cc1 1858587320 VNMRMNVCRVUDQE-LICLKQGHSA-N 445.591 4.301 10 10 IICE CCCCN(C)C(=O)CCn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@H]21 1860347430 PBHACWNRHJAHNI-SANMLTNESA-N 444.579 4.437 10 10 IICE CCOC(=O)c1c(C)nn([C@@H](c2ccc(C)cc2O)C(C)C)c1I 2079116014 KQXYBYGOAUBDFG-MRXNPFEDSA-N 442.297 4.232 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)c1O 2227748320 MWKPIAIIQMSNPL-BETUJISGSA-N 429.355 4.089 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)[C@H](Cc1cccc(Br)c1)NC(=O)OC(C)(C)C 2237413322 DHWPMYARZGWVKB-HNNXBMFYSA-N 440.342 4.044 10 10 IICE CCN1C(=O)C(=C2SC(N3CCCCCC3)=NC2=O)c2cc(Br)ccc21 2296827738 DBHYGOVRDMRZFJ-UHFFFAOYSA-N 434.359 4.032 10 10 IICE COc1cc(C=C2C(=O)N(Cc3ccccc3F)N=C2c2ccccc2)cc(OC)c1O 2332147817 ZMSMWDOCWLUWDM-UHFFFAOYSA-N 432.451 4.379 10 10 IICE COc1ccc(NC2=NC(=O)/C(=C\c3cc(OC)c(N4CCCC4)cc3OC)S2)cc1 33432461 HFTQOAWJSXLUHV-FYJGNVAPSA-N 439.537 4.395 10 10 IICE O=C(CSc1nc2cc(F)c(F)cc2[nH]1)Nc1ccc([N+](=O)[O-])cc1Br 105636426 KQHOAWNEDFTSHJ-UHFFFAOYSA-N 443.229 4.243 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 210722921 PBCXQVCLTJEEAA-GHRIWEEISA-N 427.507 4.215 10 10 IICE CCN1C(=O)/C(=C/c2c(Oc3cccc(C)c3)nc3c(C)cccn3c2=O)SC1=S 213177014 KCCOKCSTJLEKTK-ATVHPVEESA-N 437.546 4.325 10 10 IICE CCc1cc(=O)c2cc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)ccc2[nH]1 436049967 KMZMGWGIZNAVHV-UHFFFAOYSA-N 442.563 4.450 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(C(C)=O)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526260972 IYFFGPURSLAPTM-HSZRJFAPSA-N 431.444 4.366 10 10 IICE COc1ccc(Cc2noc(Cn3c4c(c5ccccc53)CN(C(C)C)CC4)n2)cc1OC 581513937 PPCSEFNJPIJRAB-UHFFFAOYSA-N 446.551 4.447 10 10 IICE CN(Cc1cc2ccccc2o1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769056819 FIAAPYZKSSNWON-UHFFFAOYSA-N 432.568 4.306 10 10 IICE O=C(NCc1ccnc(Oc2ccccc2)c1)NCc1cc(Br)ccc1O 804946957 VGNIITKPWIRKDB-UHFFFAOYSA-N 428.286 4.341 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2OCC[C@H]2c2ccccc2)n1C[C@@H]1CCCCO1 812438024 JLJBNOMEKFQSHT-FIXSFTCYSA-N 448.567 4.434 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCN(Cc3cccc(Br)c3O)CC[C@H]2C1 816636275 NXLQOODVXQTDFU-GASCZTMLSA-N 425.367 4.234 10 10 IICE Cc1cc(C(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)c(C)n1-c1ccc(C(C)C)cc1 856605314 JUGPVGLGJQPUOD-BJKOFHAPSA-N 444.579 4.208 10 10 IICE CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1132048431 VAKBTEMNGWHIGP-XMMPIXPASA-N 445.563 4.414 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)c2noc(-c3ccccc3)n2)cc1 1137533098 YSCAGFVTKNXKAM-QGZVFWFLSA-N 428.492 4.377 10 10 IICE O=C(NCc1cc(Cl)ccc1O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1 1146233559 WAIXMCPVLJZERR-PDGQHHTCSA-N 437.912 4.075 10 10 IICE Cc1cc(C(=O)Nc2cc3oc(O)nc3cc2F)c(C)n1-c1ccc(Br)cn1 1146824448 DXUNRWRICSHOKG-UHFFFAOYSA-N 445.248 4.490 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCC4)CC3)cc2F)C[C@@H](C)O1 1193430673 OIWYYDPVTGTIRF-NHCUHLMSSA-N 445.623 4.492 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCc3ccc(Br)cc3)C2)cc1 1230301099 QAALWXNHMKPDLS-GOSISDBHSA-N 446.389 4.168 10 10 IICE CCN(CC1CCN(c2ccccn2)CC1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1251982832 XFMUINBMSNAKGI-OAQYLSRUSA-N 437.632 4.335 10 10 IICE Cc1cc(C)c(C(=O)Nc2cccc(N3CCC(C(N)=O)CC3)c2)cc1Br 1265348853 BEHIVZRPNTZIIA-UHFFFAOYSA-N 430.346 4.020 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(N3CCc4ccccc4C3)cc2)cc1 1278289027 TUAWVOKQLCVSPS-UHFFFAOYSA-N 429.564 4.466 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CCCN3C(=O)OCC(F)(F)F)c2C)c1 1287660938 SCFAFXQYZGVFKN-IBGZPJMESA-N 437.462 4.182 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccccn2)nnc1N(C)Cc1scnc1C 1289422928 DRMNHVPQDGXZHN-UHFFFAOYSA-N 447.612 4.088 10 10 IICE CCc1ccc([C@@H](CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)N(C)C)cc1 1290310761 YPIMFPOZZMEMTF-HHHXNRCGSA-N 446.639 4.389 10 10 IICE CCC[C@H](C)CN(C)c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1293876316 XMNWTCBKFFIIQI-SFHVURJKSA-N 449.603 4.221 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CC(=O)NC)CC1 1294595627 VXDZZXJNUIPEGR-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CC=C(C(F)(F)F)CC2)cc1F 1298061216 RTIURFKTRQNANB-GOSISDBHSA-N 439.457 4.082 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1(N(C(=O)OC(C)(C)C)C2CC2)CCC1 1299478280 LKEVWBXCMPGWQV-GOSISDBHSA-N 429.605 4.430 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(=O)C(C)C 1306787107 VJZJBQJQAQUEKB-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)sc2c1CC[C@@H](C)C2 1349304978 OMKJDVKMQUDZGS-CABCVRRESA-N 432.586 4.169 10 10 IICE CSc1ccc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)CC2=O)cc1 1355635633 JDNZNWVCIMMVIU-IBGZPJMESA-N 425.598 4.265 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1360273601 NRMOBSSXHJNOCB-PZVJUEDKSA-N 439.987 4.425 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3ccccc3Oc3ccccc3)cc2)CC1 1439315180 RNLRZNLZNJWESA-UHFFFAOYSA-N 429.520 4.111 10 10 IICE COC(=O)c1cccc2c1CN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)CC2 1452194564 SFBCLEOXPIFOGZ-UHFFFAOYSA-N 430.504 4.200 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H](C)[C@@H]3CNC(=O)OC(C)(C)C)cc2)CC1 1459604867 BLSPCOJUGASNAU-CVDCTZTESA-N 431.621 4.427 10 10 IICE COc1ccc(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)c(OC)c1 1460978623 VILRNMZVQTUCJH-UHFFFAOYSA-N 436.508 4.366 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(NC(=O)C(C)(C)C)ccc3F)C2)cc1 1461075282 DILDEYKOHNAKCX-MRXNPFEDSA-N 427.520 4.075 10 10 IICE Cc1cc(CC(=O)N2CCCN(C(=O)c3cccc(F)c3)CC2)c(C)n1-c1ccccc1 1464003473 GOLXAKRSOHGNCG-UHFFFAOYSA-N 433.527 4.150 10 10 IICE Cc1ccc(C(=O)NCCc2nc3ccc(F)cc3n2C)cc1-n1c(C)cc(C=O)c1C 1464955305 VGOUIOKUDREXII-UHFFFAOYSA-N 432.499 4.213 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2c(C)ccc(Br)c2[nH]1 1469229724 AVCQOMOOFRZJQO-UHFFFAOYSA-N 445.313 4.150 10 10 IICE C[C@H](NC(=O)NCc1ccc(I)c(Cl)c1)c1ccccc1O 1478526145 YSYFOSFWJYZOSL-JTQLQIEISA-N 430.673 4.211 10 10 IICE Cc1cccc(-c2nnc(N(C)CC(F)(F)F)n2CCCSc2nccs2)n1 1492498133 SLIOSNAYXUXZIC-UHFFFAOYSA-N 428.509 4.286 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@@H]4CCOC4)n3CCCC(C)(C)C)CC2)cc1 1518310599 ZNKNFKQZZINLTC-HXUWFJFHSA-N 441.620 4.334 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]2C2CCC2)n1Cc1ccc(N(C)C)c(F)c1 1519297115 IQSACFNYOOBYQB-DYESRHJHSA-N 445.583 4.024 10 10 IICE CCc1ccc(Br)cc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524850984 BBFHRXSVVIEZAM-UHFFFAOYSA-N 439.300 4.056 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cn(C)nc3-c3ccc(Cl)s3)C2)cc1 1526246157 CYPBEMNEORDZKQ-CQSZACIVSA-N 430.961 4.067 10 10 IICE COC(=O)c1cc(F)cc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1F 1531289627 SOFORKPLKJKTLF-UHFFFAOYSA-N 428.435 4.232 10 10 IICE Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1538458281 UWOOVIJRFKCRSM-DEOSSOPVSA-N 431.536 4.193 10 10 IICE CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1539127605 CGRCRPFMMPDOOK-UHFFFAOYSA-N 448.566 4.212 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2CC(C)C)c(C)n1-c1ccccc1 1542181349 SATWKTSEKYPFEH-UHFFFAOYSA-N 436.604 4.360 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H]3Cc3cc(F)ccc3F)C2)cc1 1564962728 OKFSMKAHQBZWLM-LAUBAEHRSA-N 429.511 4.216 10 10 IICE CCC(CC)n1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1565881752 HUNGAVOLOYVKGO-NRFANRHFSA-N 443.592 4.306 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCc1ccc2c(c1)CCCC2 1566849621 OCZVGPVUKUPUFV-UHFFFAOYSA-N 429.944 4.449 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(C(F)F)nc2)NC(=O)OC(C)(C)C)cc1 1586619236 FUZLRNXCVSLUGV-SFHVURJKSA-N 434.487 4.081 10 10 IICE COc1ccc(N2CCN(C(=O)C(F)(F)c3ccc(C(C)(C)C)cc3)CC2)c(OC)c1 1595997648 ZQWRQXGHNXFDGF-UHFFFAOYSA-N 432.511 4.442 10 10 IICE COc1ccc(Cl)cc1NCCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1598292736 UTBOEMCKIGXNJU-NRFANRHFSA-N 445.991 4.424 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)Cc2nnc(C)s2)sc(C)c1-c1ccccc1 1620444357 ALSFYMLNBWHPRR-UHFFFAOYSA-N 444.582 4.131 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)c(-c4ccccc4)s3)cc2)CC1 1625198613 ITUIABVWFCQZDF-UHFFFAOYSA-N 433.577 4.322 10 10 IICE CCOC(=O)c1cccc(N(CC)C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)c1 1625302141 OMJRUZFNJTWTHW-UHFFFAOYSA-N 439.512 4.223 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)c1 1626395347 MEOUWWAGJSJSHQ-JOCHJYFZSA-N 443.507 4.479 10 10 IICE CCO[C@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccc1 1629678641 FGOVHGBROGAHRB-VXKWHMMOSA-N 441.572 4.212 10 10 IICE O=C(N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cc2cc(O)c(O)cc2s1 1633694956 MYQOYTYOJRNUOK-LBPRGKRZSA-N 438.427 4.220 10 10 IICE COC(=O)[C@H]1C[C@H](C)CCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1634661648 UJMANYPKUNFXRK-BFUOFWGJSA-N 433.346 4.270 10 10 IICE CC(=O)Nc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1Cl 1635946435 KIBMKBNRICOGNB-QGZVFWFLSA-N 436.339 4.052 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](CN3CCCC3)c3ccc(OC)cc3)ccc21 1636587959 QRUQCUKKEWHFPV-VWLOTQADSA-N 449.595 4.480 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1csc(NC(=O)c2ccccc2)n1 1639340659 AYGWHUDEYBHBBA-QGZVFWFLSA-N 436.581 4.060 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2COC)sc(C)c1-c1ccccc1 1643411584 YLKUEMLIIHOMNH-GOSISDBHSA-N 430.570 4.340 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ccc2nnc(-c3ccc(F)cc3)n2n1 1650853593 LZRGOZSNOJRLRF-UHFFFAOYSA-N 442.292 4.425 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnc(-c4ccc(F)c(C)c4)n3)c2C)cc1 1651792351 WKMROFHWFSBODR-UHFFFAOYSA-N 433.487 4.477 10 10 IICE CCN(C)c1ccc(CN2CCC(CO[C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1654430615 XNJXBUDMKOYAHY-QHCPKHFHSA-N 431.621 4.381 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1679153634 BTGIQSVMTUWRSY-INIZCTEOSA-N 433.911 4.302 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C12CCC2 1687055056 NWRUYTYKTDGSNA-FQEVSTJZSA-N 429.561 4.002 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC(C)(C)O1 1693814057 YYSKVWDLYFLJJS-HZPDHXFCSA-N 437.635 4.162 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1COCCO1 1695206935 AACOQKPMRDMGBS-JOCHJYFZSA-N 437.588 4.394 10 10 IICE C[C@H](CN(C)C(=O)OC(C)(C)C)Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O 1741820935 LQWRVFMBBVAQBE-QGZVFWFLSA-N 443.592 4.391 10 10 IICE CCCN(CC1CC1)c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1745622663 QOWQYPIFBFSCOU-UHFFFAOYSA-N 425.621 4.285 10 10 IICE CC[C@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(=O)N(C)C)C1 1762447722 KPNXUEPBPNTIDY-AREMUKBSSA-N 448.615 4.457 10 10 IICE CCOCc1nnc(N2CCC(OC(C)(C)C)CC2)n1CCCSc1nccs1 1767854043 KBZKVDWLDPVHJE-UHFFFAOYSA-N 439.651 4.237 10 10 IICE COCCO[C@H](C)c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc2c(c1)CCCN2C 1771207711 LFOYVJNEODBPTO-DENIHFKCSA-N 441.620 4.058 10 10 IICE OCc1cnc(Sc2cc(I)ccc2Br)s1 1900819995 ZWYVRKPXOINZPF-UHFFFAOYSA-N 428.114 4.154 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1csc(=NCc2ccc(Br)cc2O)[nH]1 2082946121 DKLWIPAMYMTABG-JTQLQIEISA-N 428.352 4.231 10 10 IICE CC(C)CN1C(=O)C(=Cc2c(Oc3ccccc3)nc3ccccn3c2=O)SC1=S 2296731272 KQIKEVGDVGWTQJ-UHFFFAOYSA-N 437.546 4.344 10 10 IICE CCCCCN1C(=O)C(=Cc2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 2296732293 RJVORJUGJLEWAM-UHFFFAOYSA-N 444.626 4.462 10 10 IICE CCCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314769025 NLZKCNRASMJNPB-GOSISDBHSA-N 442.518 4.491 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2314831595 OAPXFMPYRQALMK-UHFFFAOYSA-N 445.497 4.354 10 10 IICE Cc1ccc(CNC(=O)CCN(C(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2352942280 BXFKWUTXNBHECR-UHFFFAOYSA-N 429.355 4.115 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478055 AQVIQLTVKYNCGI-HYFFOGBASA-N 427.526 4.452 10 10 IICE COc1ccc(N2C(=O)N=C(O)/C(=C/c3ccc(-c4ccccc4C(=O)O)o3)C2=O)cc1 20248887 UDVQTQWYQCNGTG-PDGQHHTCSA-N 432.388 4.160 10 10 IICE CC(C)CC[C@@H](N)c1cc(I)cc(I)c1O 95780402 JTRFZWJIYWEFSH-LLVKDONJSA-N 445.082 4.037 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 734687541 HPXBMWKRRXOPML-QFIPXVFZSA-N 440.975 4.372 10 10 IICE CSc1ccc(N2C[C@@H](C(=O)Nc3c(-c4ccccn4)nc4ccccn34)CC2=O)cc1 751302674 OVVHKSRTOHHQNS-INIZCTEOSA-N 443.532 4.110 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H](CC3CC3)c3ccccc3)CC2)cc(OC)c1OC 760124902 XKOHDXQNCNNGKS-OAQYLSRUSA-N 439.556 4.085 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C1C[C@@H]2CCC[C@H](C1)C2NC(=O)OC(C)(C)C 794853941 QUTQCWMBLDERPB-SYURHXKASA-N 429.605 4.431 10 10 IICE CCCOC(=O)c1ccc(Cn2nc(Cc3ccc(N)cc3)c3ccccc3c2=O)cc1 821187616 ZBLADBMZIIARMU-UHFFFAOYSA-N 427.504 4.185 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cn2nc(C(F)F)cc2C2CC2)cc1 1125893457 NBRDWDXEWDHSFL-UHFFFAOYSA-N 430.421 4.355 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1Br 1129661507 NXSUVZZKGVXBEY-UHFFFAOYSA-N 445.691 4.147 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCC(=O)Nc1ccc(Br)cc1 1136304223 WJJWTENNJYAPAA-UHFFFAOYSA-N 432.343 4.287 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](O)COc1cccc(C(F)(F)F)c1 1150135799 INYONBQDNMGTBE-INIZCTEOSA-N 438.471 4.344 10 10 IICE COC(=O)[C@H](COC1CCC1)N(C)C(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1295019291 DLCZZGRJEGVERI-QHCPKHFHSA-N 426.557 4.400 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCCC2(C)C)n1CCCSc1nccs1 1302301830 SROMMXWJQZGLQO-HOTGVXAUSA-N 437.635 4.020 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC[C@@H](C(F)(F)F)O2)c(C)n1-c1ccc(Br)cn1 1303441555 DGOLDMHGHMVCFJ-ZFWWWQNUSA-N 446.267 4.091 10 10 IICE Cc1cc(C(=O)Cn2c(-c3cccnc3)noc2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 1307298431 CNEFHVONCGHKHC-UHFFFAOYSA-N 443.290 4.496 10 10 IICE CC(C)[C@H]1N(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC12CCCCCC2 1313304944 NDEHNFDOICPMSV-HSZRJFAPSA-N 440.632 4.279 10 10 IICE COc1ccc(Cl)cc1N1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)CC1=O 1350044391 JSKKVFBTRLJGSE-GOSISDBHSA-N 443.975 4.205 10 10 IICE CN(C)c1ccc(CNC(=O)c2coc(-c3ccc(Br)cc3F)n2)cc1F 1357192505 LCGFGPCUBDYGLJ-UHFFFAOYSA-N 436.256 4.378 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 1452947795 SSTIKYSUURWDMJ-INIZCTEOSA-N 427.715 4.273 10 10 IICE C[C@@H](COCC1CCCCC1)N[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1460812719 DOHCVIOCPOGAKD-ROUUACIJSA-N 448.563 4.364 10 10 IICE COc1ccc2c(c1)nc(CNC(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)n2C 1467310248 UBYORIGBUJWAND-UHFFFAOYSA-N 430.508 4.040 10 10 IICE Cc1ccc(C(=O)Nc2nccc(Br)c2O)cc1-n1c(C)cc(C=O)c1C 1470748321 IHETWZYDVNHPIP-UHFFFAOYSA-N 428.286 4.330 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC(CNC(=O)OCc3ccccc3)CC2)c1O 1473433542 VPEUSWFWHZGHKI-UHFFFAOYSA-N 430.932 4.387 10 10 IICE CC(C)(C)OC(=O)Nc1nc(CNCc2cc(Br)cc(F)c2O)cs1 1474741504 KELXCZCRRQUYEW-UHFFFAOYSA-N 432.315 4.387 10 10 IICE COc1ccc(N2CCCN(C(=O)NC/C=C\c3ccc(Br)cc3)CC2)cc1 1478701531 XAFKVVCGWMAFIM-RQOWECAXSA-N 444.373 4.393 10 10 IICE CC(C)C1CCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1509064116 UOTLKNUDEHKZBP-FQEVSTJZSA-N 429.584 4.298 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N(CC)CC)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1516598319 AFDPJVVIPZVEEB-FQEVSTJZSA-N 426.952 4.107 10 10 IICE Cc1ccc([C@@H](NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)[C@H](C)S(C)(=O)=O)cc1 1519787730 UKAZJXGKZRKGDF-CPJSRVTESA-N 438.593 4.236 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)cc1 1545517040 HAODRJHPHIWXMM-RUZDIDTESA-N 434.536 4.086 10 10 IICE COc1cccc(-c2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)on2)c1 1545632140 CYMZGIKONRKXNQ-SFHVURJKSA-N 441.915 4.104 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCOc2ccc(C(F)(F)F)cn2)cc1 1545725470 VBIOTBOJZZEZMU-UHFFFAOYSA-N 445.441 4.058 10 10 IICE CCCN(C)c1nnc([C@H]2COc3ccccc3O2)n1CCCSc1nccs1 1547091524 RQYGNVLBUCBLAZ-QGZVFWFLSA-N 431.587 4.276 10 10 IICE COc1cc(/C=C\C(=O)NCc2ccc(N3CCCCC3)cc2)cc(Br)c1O 1570581784 IXPGJLIDBAHRMV-YFHOEESVSA-N 445.357 4.483 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)CCNC3=O)c(C)n1-c1ccc(Br)cc1 1584298969 WTWHDFGGRMWRLA-UHFFFAOYSA-N 438.325 4.395 10 10 IICE Cc1nn(C)c(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1Cl 1586068438 KBBDKEMUSQXPES-FMIVXFBMSA-N 441.003 4.064 10 10 IICE Cc1cccc(CN2CCO[C@H](CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)c1 1587489247 DCJSDAGFYWJLCZ-XMMPIXPASA-N 431.580 4.342 10 10 IICE CC1CCN(c2ccc(Cn3c(N4CCOC(C)(C)C4)nnc3C(C)(C)C)cc2)CC1 1612825799 HHCAVVMPBAICLF-UHFFFAOYSA-N 425.621 4.475 10 10 IICE CCOC(=O)c1c(NC(=O)CSC[C@H](C)C(=O)OC)sc(C)c1-c1ccccc1 1613556282 JGNZXZNEYULIQG-ZDUSSCGKSA-N 435.567 4.381 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)C[C@@H](C)C3CCCCC3)cc2F)C[C@@H](C)O1 1620486156 WNXUTIFCLDKBLJ-AQNXPRMDSA-N 433.612 4.204 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(Br)c(F)c1 1622634770 IGKRPQGZHYRJPX-HNNXBMFYSA-N 441.728 4.342 10 10 IICE Cc1c(O)nc2ccccc2c1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1630280930 TZVFEULQEHUTIG-HNNXBMFYSA-N 427.451 4.249 10 10 IICE O=C(CCSc1ccc(Br)cc1)NCc1ccc(N2CCC(O)CC2)cc1 1630283203 OIVFRGFXUOIZJW-UHFFFAOYSA-N 449.414 4.209 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccccc1O)c1ccccc1Br 1630363559 UFCWOLOPVUEAFW-QGZVFWFLSA-N 435.318 4.037 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)cc1 1640970920 VSECKCBOEDCCSX-HHHXNRCGSA-N 443.591 4.225 10 10 IICE Cc1ccc(-n2cc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)c(C(C)(C)C)n2)cc1 1642155500 VBOKONMXPMWNCN-UHFFFAOYSA-N 446.595 4.369 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCCN([C@@H](C)c2ccc(F)cc2)C1=O 1673046637 RLMCXHVYDKNXCG-LAUBAEHRSA-N 427.520 4.205 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3)C2)cc1 1680824972 RQSNRJGPOWDTGB-JKSUJKDBSA-N 449.382 4.159 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1695070438 AWYYEOGDDJXLBD-NLFFAJNJSA-N 443.636 4.366 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1728381515 HRKZFYFTMNKLFH-UGKGYDQZSA-N 441.620 4.418 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)=C(C)C1 1750031175 VJENVTLPORXRCG-UHFFFAOYSA-N 446.599 4.425 10 10 IICE CCOCCN(CC)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1766570351 ZBHBHCJMVRXEQB-UHFFFAOYSA-N 448.615 4.488 10 10 IICE CCN(C[C@@H]1CCCO1)c1nnc(C(C)C)n1Cc1ccc(N2CCSCC2)cc1 1766814626 CSIZHZGVIRQMIW-NRFANRHFSA-N 429.634 4.008 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)C3CCN(Cc4ccc(F)cc4)CC3)cccc21 1861852852 NBBIDJZWYJHLOJ-UHFFFAOYSA-N 442.490 4.452 10 10 IICE CCc1sc(NC(=O)[C@H](N)C(C)C)c(C(=O)OC)c1-c1ccc(Br)cc1 1865915472 GSYLYUKPLUWCDL-MRXNPFEDSA-N 439.375 4.448 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNCc2cc(Br)cc(F)c2O)C1(C)C 1885866467 PNRZEOPFSGZVOE-SWLSCSKDSA-N 431.346 4.323 10 10 IICE CCOC(=O)c1c(C(C)C)nn([C@H](C)c2ccc(C)cc2O)c1I 2078977386 KSMFDIRQVYLGOJ-GFCCVEGCSA-N 442.297 4.411 10 10 IICE CN(C)c1ccc([C@@H](N)C2(COCc3ccccc3)CN(C(=O)OC(C)(C)C)C2)cc1 2248453991 NVFDITUTUBZMPY-JOCHJYFZSA-N 425.573 4.206 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCCOc3ccccc3)C2=O)cc1 2293188494 LMIQSQRUPIIPNJ-UHFFFAOYSA-N 442.471 4.119 10 10 IICE Cc1ccc(C=C2SC(=S)N(CCCC(=O)Nc3ccccc3C(=O)O)C2=O)cc1 2295924423 XFRKEEAWXJEAFP-UHFFFAOYSA-N 440.546 4.313 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc(OC)c(OC(C)=O)c(OC)c3)SC2=S)cc1 2297578098 UTCGHHQGBFYAJV-UHFFFAOYSA-N 445.518 4.044 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380744196 CHMKBWVVMUAZKS-OAHLLOKOSA-N 441.366 4.259 10 10 IICE Cc1cccc(OCCOCCOc2cccc(/C=C3/SC(=S)N(C)C3=O)c2)c1 27531641 XZNYOKLJYPUUBT-HMMYKYKNSA-N 429.563 4.300 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2ccc(OCc3cccc(C)c3)cc2)SC1=S 40937955 SLRBGRJSBOZXNQ-CPNJWEJPSA-N 427.547 4.338 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@H]3CCN(c4ncccc4Cl)C3)cc2)CC1 757689572 RRXWOXFFJHYGRB-IBGZPJMESA-N 427.980 4.049 10 10 IICE COc1cc(N2CCN(C(=O)/C(C)=C/c3ccc(Cl)cc3)CC2)cc(OC)c1OC 759226042 SHBYTRITQPVXPB-DTQAZKPQSA-N 430.932 4.118 10 10 IICE CC(C)(C)OC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)cc1 764884855 HTHHQVXIDQLQIR-ATVHPVEESA-N 440.546 4.147 10 10 IICE CC[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cccc(OC)c1 765283235 YAWVZBAJWAWXSC-HSZRJFAPSA-N 435.547 4.192 10 10 IICE COc1cc(O)c(CN[C@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cc1OC 783602275 CDPRMVWJIJAVRB-HTAPYJJXSA-N 436.911 4.042 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)c1nnc2n1CCCCC2 799860527 CEZSLLTUIGIKDH-SJORKVTESA-N 445.011 4.455 10 10 IICE C[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(NC(=O)C2CC2)cc1 806404415 IEHMSUOPUNDNSZ-GFCCVEGCSA-N 432.318 4.064 10 10 IICE Oc1ccc(Br)cc1CNCc1cc(Br)c2c(c1)OCCCO2 809713576 UBGMPIVEXYHLLI-UHFFFAOYSA-N 443.135 4.368 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](C)c2ncc(Br)cn2)c(C)n1-c1ccccc1 814441645 MCISMFBGFLXCJG-HNNXBMFYSA-N 442.361 4.250 10 10 IICE COc1cc(OC)c(C2CCN(c3ccc(/C=C\C(=O)O)cc3[N+](=O)[O-])CC2)c(OC)c1 915213745 LTHJTEARSFFRPM-ALCCZGGFSA-N 442.468 4.102 10 10 IICE COc1ccc(-n2cc(CNC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)nn2)cc1 1126952567 JFCMMTIQVBHIJU-UHFFFAOYSA-N 435.915 4.267 10 10 IICE CCCn1c(=O)n(CCC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c2ccccc21 1131781766 NMIVXBOPGUHRCS-UHFFFAOYSA-N 444.579 4.370 10 10 IICE Cc1cc(CCNC(=O)C(F)(F)n2cc(-c3ccccc3)nn2)c(C)n1-c1ccccc1 1131784979 FRRWOPNNOWDGNC-UHFFFAOYSA-N 435.478 4.261 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1135744383 AUDJIRGTFOMDOB-RXVVDRJESA-N 445.604 4.396 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc(F)c(OCc2ccccc2)c(F)c1 1136397211 XVLSVFLZLLWCJA-UHFFFAOYSA-N 438.474 4.310 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CCNC(=O)OC(C)(C)C)C(F)F)c1 1141286501 RDQCXFVGTNYJHQ-LJQANCHMSA-N 449.498 4.185 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN([C@@H](C)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 1185519302 XXFMDZHQSHCPCE-FIRRRZPPSA-N 429.904 4.318 10 10 IICE COc1cccc(CNC(=O)NCC[C@H]2CN(C(=O)OC(C)(C)C)c3ccccc32)c1O 1254192607 ABFSVGUZQNFXBL-KRWDZBQOSA-N 441.528 4.129 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1c(F)c(F)c(Br)c(F)c1F 1293955339 GSJMJMRMWOCJBR-UHFFFAOYSA-N 433.199 4.111 10 10 IICE Cc1ccc(C(=O)NCC2CCN(c3ccncc3)CC2)cc1-n1c(C)cc(C=O)c1C 1295593193 AUBSEXVGZHFMLN-UHFFFAOYSA-N 430.552 4.256 10 10 IICE Cc1cc(C(=O)COc2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccc(C(C)(C)C)cc1 1307281474 WTLXGVLJURGRNR-UHFFFAOYSA-N 440.565 4.301 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccc(C)cc1 1307644703 WTGLBGRGJBPIMW-YDHSSHFGSA-N 427.564 4.105 10 10 IICE CCC[C@@H](CC(C)C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1351298624 MMGOFGCTRRMDAL-FQEVSTJZSA-N 427.568 4.021 10 10 IICE C[C@]1(c2cccc(Br)c2)C[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1357836534 XDAXIMZSNUJVBW-PGRDOPGGSA-N 447.348 4.019 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C(=O)c1ccc(F)cc1 1439871444 JGNCIFLCMHRDPL-UHFFFAOYSA-N 439.244 4.119 10 10 IICE Cc1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)nc1 1444664465 QAQVYKFEGKVWGT-UHFFFAOYSA-N 431.536 4.321 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Nc2nccs2)cc1F 1446815461 LESZSAIUBLDKED-UHFFFAOYSA-N 449.891 4.200 10 10 IICE CC(C)(C)OC(=O)N1CCOc2c(cccc2C(=O)NCc2cc(Cl)ccc2O)C1 1452935643 JETHMYIHTFGQPP-UHFFFAOYSA-N 432.904 4.105 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cccc(Cl)c3Cl)CC2)c(OC)c1 1461979778 GCSDWNUUUNTAQZ-AWEZNQCLSA-N 439.339 4.127 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccc(Cl)cc4C[C@H]3C)cc2F)C[C@@H](C)O1 1473901916 NRIURCJSIZISIW-ZACQAIPSSA-N 445.966 4.160 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(n2c(O)nc3ccccc32)CC1 1478841176 QLNRSICSDGNUEI-GOSISDBHSA-N 435.572 4.094 10 10 IICE CSC(C)(C)Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1505155957 JQBSIZYGICMPHQ-UHFFFAOYSA-N 431.650 4.091 10 10 IICE COC(=O)[C@H](C)Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1514852667 GHNTUAMTRHLPPG-LJQANCHMSA-N 447.579 4.398 10 10 IICE CCN(CC1CCC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1515662810 PINLZNZJSQRCND-UHFFFAOYSA-N 425.621 4.378 10 10 IICE Cc1ccc([C@@H](NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)[C@@H](C)S(C)(=O)=O)cc1 1519787734 UKAZJXGKZRKGDF-NLFFAJNJSA-N 438.593 4.236 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(CC(C)C)C2)sc(C)c1-c1ccc(F)cc1 1525141569 SJIVHSDTHLTDIT-MRXNPFEDSA-N 446.544 4.482 10 10 IICE CCCCN(C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1cccnc1 1532128130 BFDFMUSYQJLEKJ-UHFFFAOYSA-N 429.432 4.212 10 10 IICE Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1539707408 RMRXAFSSBUTBKT-QFIPXVFZSA-N 440.588 4.441 10 10 IICE CC(C)COc1cccc(OCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1545632437 LVAPEKUIQCERTP-HXUWFJFHSA-N 446.975 4.240 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccsc2)cc1F 1552835456 WXXFJHIASMUMGO-UHFFFAOYSA-N 436.560 4.215 10 10 IICE CN(CCn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1554295261 NCOBOYQRTPKNIR-UHFFFAOYSA-N 443.592 4.220 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccnn1C1CCC1 1558704485 UFFCUKZFBIXELT-NTCAYCPXSA-N 432.596 4.290 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1cccs1 1568737624 GKTCFCIYVNXFRT-WOJBJXKFSA-N 441.593 4.471 10 10 IICE COc1c(N)c(C(=O)NCc2ccc3c(c2)CCCN3C)cc(Cl)c1Br 1583628349 UPXHNMGDCAGJSL-UHFFFAOYSA-N 438.753 4.006 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1586561149 QCRNHAWWKHQJDC-INIZCTEOSA-N 431.252 4.260 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](c3cccc(F)c3)N3CCOCC3)c2C)c1 1587880763 HWHWLHFTDBWZIC-VWLOTQADSA-N 435.543 4.231 10 10 IICE Cc1cc(C(=O)NCc2ccc(OC(C)C)nc2)c(C)n1-c1ccc(Br)cn1 1596076835 VAQKPPMFGOLSIE-UHFFFAOYSA-N 443.345 4.364 10 10 IICE CC(C)Cc1nnc(N2CC(C)(C)OC(C)(C)C2)n1Cc1ccc2c(c1)CCCN2C 1603384886 ZSSRKWDMJHSCCZ-UHFFFAOYSA-N 425.621 4.301 10 10 IICE COC(=O)[C@@H]1c2ccccc2OCCN1C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1627201881 NUVJMHCAHKDBRK-QFIPXVFZSA-N 438.911 4.496 10 10 IICE Cc1cc(CCNC(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)c(C)n1-c1ccccc1 1631356956 VADYAYMZWUQWAS-UHFFFAOYSA-N 429.480 4.365 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COc1ccc(C=O)cc1[N+](=O)[O-] 1631531118 HVQFYISAOVQTEO-QGZVFWFLSA-N 434.448 4.282 10 10 IICE CCOc1ccc([C@H](O)C2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)cc1 1636715068 JSIRSOFXCMGETR-QFIPXVFZSA-N 427.522 4.297 10 10 IICE COc1ccccc1[C@@](N)(C(=O)NCc1cc(C)n(-c2ccccc2)c1C)C(F)(F)F 1638983029 CBZMHQKXNCBUDC-JOCHJYFZSA-N 431.458 4.135 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)[C@@H](C)c3cccs3)nc12 1652367120 PAHDDJNXXGDVHI-INIZCTEOSA-N 436.537 4.437 10 10 IICE O=C(NCC[C@H]1CSc2ccccc2O1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1673863785 VAIOTVOVCLRMOZ-OALUTQOASA-N 428.554 4.026 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(O)(c2ccccc2Cl)CC1 1683421558 RTCBBSQNXNNKPN-GOSISDBHSA-N 429.992 4.339 10 10 IICE Cc1cc(CCNC(=O)N[C@H](COC(=N)O)Cc2ccccc2)c(C)n1-c1ccccc1 1684444260 LJZMCAYBKGNGEL-QFIPXVFZSA-N 434.540 4.057 10 10 IICE Cc1cc(CCNC(=O)NCCOc2cccc(C(F)(F)F)n2)c(C)n1-c1ccccc1 1685961057 XMUAVMRCGRGZAX-UHFFFAOYSA-N 446.473 4.429 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1CC[C@@H](OCC(C)C)C1 1693006260 SOVOTAOEMUTEJU-PKTZIBPZSA-N 441.620 4.194 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1696380580 YRCSSCGDSQFDIJ-OAQYLSRUSA-N 434.588 4.097 10 10 IICE CCc1nc(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)cs1 1709003919 NLPOEQRIDRKCLQ-UHFFFAOYSA-N 440.598 4.043 10 10 IICE CCC[C@@H](Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1709516078 MARSUMQWAQYXSI-GGAORHGYSA-N 441.620 4.224 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1710027241 BXXXEAIDYYIVNU-SANMLTNESA-N 448.615 4.164 10 10 IICE FC(F)(F)[C@H]1CCCN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)C1 1712858037 PPDYURFPMHLYLO-KGLIPLIRSA-N 447.552 4.200 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCC(F)(F)C1 1723271691 UHKPWVUUIYFCIW-HXUWFJFHSA-N 447.574 4.385 10 10 IICE CC(C)N(C)CCCn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1723519977 RTXKGDIPBWVWMR-UHFFFAOYSA-N 447.631 4.307 10 10 IICE CC/C=C\Cn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727846363 ZFSGDNZEGAPATB-DAXSKMNVSA-N 445.571 4.128 10 10 IICE CC(C)[C@H]1CN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1760966436 WFLVNIKPVHXQDH-HXUWFJFHSA-N 428.581 4.104 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(OC)CCCC1 1761879872 ZZZWYIVWZMIFSE-SFHVURJKSA-N 445.583 4.225 10 10 IICE CCC(CC)(Cn1c([C@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1762136237 YAAIWFQTKATFRM-NRFANRHFSA-N 441.620 4.224 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(Cl)c(Cl)c4)n(C)n3)CC2)cc1 1858102291 WZOOLWYUGOFBHW-UHFFFAOYSA-N 445.350 4.365 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)CCCOc4ccccc4)cn3)CC2)cc1 1858420923 RFZAKRDGFGRASI-UHFFFAOYSA-N 446.551 4.215 10 10 IICE CCCOc1cccc(/C=C2/SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 1858592665 UDGAVSGMHHUXHT-UIMCMNAESA-N 443.546 4.078 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccccc4Br)on3)CC2)cc1 1891037959 DUFZKNHWXIKZTA-UHFFFAOYSA-N 442.313 4.075 10 10 IICE O=C(O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc([N+](=O)[O-])ccc1O 1951368712 SEQMYHHHJNWZQO-NRFANRHFSA-N 448.431 4.355 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@H](CN)c1ccn(Cc2ccccc2)n1 2078949529 XRNKOICOXVWBNC-HSZRJFAPSA-N 435.572 4.092 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CC[C@H](NC(=O)OC(C)(C)C)CC2)c1O 2236054236 GLKAOYHUFLWRJE-HDJSIYSDSA-N 443.382 4.336 10 10 IICE Cc1cccn2c(=O)c(C=C3SC(=S)N(C)C3=O)c(N[C@H](C)c3ccccc3)nc12 2296715407 ZMLFJDIBEMEMGQ-CQSZACIVSA-N 436.562 4.007 10 10 IICE COc1ccc2c(c1)c(C=C1SC(=S)N(Cc3ccc4c(c3)OCO4)C1=O)cn2C 2323758628 RLAQZZMEPIKGBX-UHFFFAOYSA-N 438.530 4.317 10 10 IICE CSC1=NSC2=NC(=O)/C(=C\c3ccc(OCc4ccc(F)cc4)cc3)C(=N)N12 20114584 UBPIHLYMOHDHAD-ATKCCKKESA-N 426.498 4.344 10 10 IICE Cc1ccc(-n2c(C)cc(/C=C/C(=O)NC3CCN(C(=O)c4ccoc4)CC3)c2C)cc1 30876828 XBKWGFLTXNDTEG-RMKNXTFCSA-N 431.536 4.430 10 10 IICE COc1ccc(-c2nn(-c3ccccc3)cc2/C=C2/SC(=S)N(C)C2=O)cc1OC 33638068 RDUZOZHAFQVBAU-XDHOZWIPSA-N 437.546 4.388 10 10 IICE COc1ccc(N2CCC(NC(=O)c3c(C)nn(-c4ccc(F)cc4)c3Cl)CC2)cc1 110358854 SLNPUSNGQBEXQV-UHFFFAOYSA-N 442.922 4.381 10 10 IICE C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1ccc(N2CCOCC2)cc1 741182962 MEVDGCIIRNMSSI-RYGJVYDSSA-N 434.458 4.403 10 10 IICE COc1cc(N(C)CC(=O)N(C)C(c2ccccc2)c2ccccc2)cc(OC)c1OC 741794975 FURACDMNJDXJCG-UHFFFAOYSA-N 434.536 4.397 10 10 IICE COC(=O)/C=C\c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)cc1 747857287 LKVYUJSQUHZUIB-MLPAPPSSSA-N 444.534 4.114 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)[C@@H](c1c(F)cccc1Cl)N1CCCCC1 753803754 RSBYCJYYFRDTQO-HSZRJFAPSA-N 445.966 4.159 10 10 IICE O=C(Nc1ncn(C2CCCCC2)n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 758161379 FLQMRAPETFGDLU-UHFFFAOYSA-N 434.491 4.175 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3c(F)cccc3Cl)n2)cc1OC 780704672 QSFUDEGZDDTYKT-UHFFFAOYSA-N 428.894 4.421 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@H]2CCC(F)(F)C2)NC(=O)OC(C)(C)C)cc1 797892398 FVRHONHYFNXXSD-QAPCUYQASA-N 425.520 4.260 10 10 IICE Cc1cc(C(=O)N2CC[C@]3(CCCN(C(=O)OC(C)(C)C)C3)C2)c(C)n1-c1ccccn1 802323554 LDVOMYKNPNRZNV-RUZDIDTESA-N 438.572 4.352 10 10 IICE C/C(=C\c1cccc(C(F)(F)F)c1)CNCc1ccc(N2CCS(=O)(=O)CC2)cc1 808389431 HGIOIGFXGQESLC-GHRIWEEISA-N 438.515 4.133 10 10 IICE C[C@@H](NCc1c2c(nn1C)CCCC2)c1cc(Br)cc(Br)c1O 812736978 KVUJKRHRBOCJDF-SNVBAGLBSA-N 443.183 4.380 10 10 IICE Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c2c(C)noc2n1 812883760 ZNUIUCIPHFNQJB-UHFFFAOYSA-N 447.447 4.016 10 10 IICE COC(=O)C[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccc(C)cc1 1124707550 IADJDYRLGQDRDG-HSZRJFAPSA-N 447.579 4.137 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H](c2ccc(Br)cc2)N2CCCC2)cc1F 1125534796 NBSHDFXMZVZMPU-FQEVSTJZSA-N 434.353 4.108 10 10 IICE CCc1nc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cs1 1126259798 HDXSNQWTHNPFGM-SEJMYLSOSA-N 449.598 4.313 10 10 IICE O=C(Cc1nc(C2CCCCC2)cs1)NCc1ccc(N2CCC(CO)CC2)cc1 1147837344 FOFWZAXNZHVCQY-UHFFFAOYSA-N 427.614 4.258 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cc(Cl)cc3c2OCC(=O)N3)cc1 1157090775 COBBEFGKVWINCV-UHFFFAOYSA-N 437.883 4.072 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc3c(nc2O)CC(C)(C)CC3=O)cc1 1163900675 AXDULLGLSCORQI-UHFFFAOYSA-N 449.473 4.213 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(Br)c(CO)c1 1164011647 SEMHIEUYILEGEG-UHFFFAOYSA-N 427.298 4.414 10 10 IICE CCc1ccc(N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)CC(C)(C)C)cc1 1194410945 WXSLWSNKOMEFDP-UHFFFAOYSA-N 441.591 4.394 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3cc(F)c(C(F)(F)F)cc3F)C2)cc1 1248501549 OCEWCPYYARKEPN-CYBMUJFWSA-N 443.416 4.318 10 10 IICE CCOC(=O)c1c(NC(=O)Cn2ncc3cccnc32)sc(C)c1-c1ccc(F)cc1 1264290449 HFZDPBAWSUEFKP-UHFFFAOYSA-N 438.484 4.423 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2CCCC(C)C)c(C)n1-c1ccccc1 1289353161 LULJHNZZPMZMSV-GOSISDBHSA-N 436.604 4.489 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)COCCO1)C(C)C 1295151908 KXFADNLVSHPUAP-RUZDIDTESA-N 437.588 4.393 10 10 IICE CCN1C[C@@H](C)N(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)cc2C)C[C@H]1C 1295977424 OOZHUHOXOUCRPE-RTBURBONSA-N 436.604 4.188 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(CCN(C)C)Cc3cccc(OC)c3)c2C)cc1 1296392802 JWGWSHMKOARDCV-UHFFFAOYSA-N 435.568 4.315 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)c1 1298012280 UWFTVFLMEVNEOZ-ZWKOTPCHSA-N 429.520 4.003 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1299538095 IFYHHKVFIGYKSR-ZWKOTPCHSA-N 425.602 4.329 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)N[C@@H](C)c3ccccc3O)cc2)c1 1302532630 LZGNUCVOEDQNQJ-KRWDZBQOSA-N 425.506 4.268 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)cc1C 1305740797 RBAZUWKAJGYSLU-IEBWSBKVSA-N 440.636 4.244 10 10 IICE CSc1ncc(I)c(NCc2ccc(N3CCCCC3)cc2)n1 1307155467 SPQSXPBEWZHNGR-UHFFFAOYSA-N 440.354 4.406 10 10 IICE Cc1cc(C(=O)N[C@@]2(C(=O)O)CCCN(Cc3ccccc3)C2)c(C)n1-c1ccc(F)cc1 1345729013 GNKWQGMXKPNNMS-SANMLTNESA-N 449.526 4.082 10 10 IICE CC(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1357129298 PZHXOLQKKXSTFL-GEWUYGHSSA-N 449.639 4.495 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@@H](C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1361052852 YIJFSKCOHKTFRK-SFHVURJKSA-N 439.629 4.455 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@H](c1cccc(Br)c1)N1CCCC1 1451956974 QNOQMMAYZAKJDW-HXUWFJFHSA-N 440.341 4.156 10 10 IICE COC1CCN(c2ccc(CN3CCOc4c(Br)cccc4C3)cc2)CC1 1460054122 VMKIWIHWLNQOAM-UHFFFAOYSA-N 431.374 4.459 10 10 IICE Cc1cc(C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)c(C)n1-c1ccc(C(C)C)cc1 1464099185 VXPGXIURJXQFCC-UHFFFAOYSA-N 430.552 4.406 10 10 IICE COc1ccc(CN(C)C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1OC(F)F 1470556207 OKJVZCSYWDBPHT-INIZCTEOSA-N 435.515 4.444 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](c1ccc(F)cc1)c1cccs1 1470905931 YRTNTJSQSGZBLX-QHCPKHFHSA-N 439.556 4.437 10 10 IICE COc1ccc(N2CCN(Cc3cn(-c4ccc(Cl)c(Cl)c4)nn3)CC2)cc1F 1473269639 FZWSBQFJVQXBOK-UHFFFAOYSA-N 436.318 4.044 10 10 IICE C[C@@H]1CN(CC(=O)NCc2ccc(N(C)C)cc2)c2ccccc2N1Cc1ccccc1 1473394519 YWCADPLCURPGKG-OAQYLSRUSA-N 428.580 4.284 10 10 IICE CCc1ccc(-c2nnc(N3CCO[C@@H](C)C3)n2CCCSc2nccs2)cc1 1513658293 NDTQYKPEEUJOQX-INIZCTEOSA-N 429.615 4.372 10 10 IICE COC[C@@H](F)Cn1c(-c2cc3c(s2)CC[C@@H](C)C3)nnc1N(C)Cc1ccccc1O 1518748334 YPPCXUYRLFJVJX-QAPCUYQASA-N 444.576 4.458 10 10 IICE C[C@H](COc1ccccc1)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1529037701 NTPLYRQLJPYUCS-DQPIFXJKSA-N 444.553 4.001 10 10 IICE Cc1cc(CC(=O)NCc2cccc(N3CCOCC3)c2)c(C)n1-c1ccc(Cl)cc1 1534378412 RGAQDUZVGYJKEA-UHFFFAOYSA-N 437.971 4.443 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)COc2ccccc2Cc2ccccc2)N(C)C)cc1 1537477723 INPDNOPJPLIEPP-RUZDIDTESA-N 431.580 4.141 10 10 IICE CC1(C)CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CCS1 1542012139 HMCYCFKRQZFRFA-CQSZACIVSA-N 425.649 4.100 10 10 IICE Cc1nc(NC(=O)Cc2ccc(O)c(O)c2)sc1Cc1cccc(Br)c1 1543251136 XHSOLFVBKBIGDZ-UHFFFAOYSA-N 433.327 4.397 10 10 IICE Cc1ccc(C(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1545005197 HXEDFGUFMOEWCM-LJQANCHMSA-N 439.556 4.202 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(OC2CCCC2)nc1 1545632583 PNBHZUFDVPRCAZ-IBGZPJMESA-N 429.948 4.156 10 10 IICE COc1ccccc1N1CC[C@H](CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)C1 1546198626 CNKJRGZHIIAVQN-HXUWFJFHSA-N 431.536 4.172 10 10 IICE CC[C@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)cc2C)CCS1 1546759056 FXXUZMIZWYDQDS-QFIPXVFZSA-N 436.629 4.018 10 10 IICE CCN(c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)cc1)[C@H](C)C1CCC1 1547375550 DUSKXRMEQXLLNY-HXUWFJFHSA-N 425.621 4.376 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)n1-c1cccc(Cl)c1 1557939829 ZQKAXKZIPFZTKG-QFIPXVFZSA-N 427.888 4.293 10 10 IICE Cc1ccc(CN(CCCC(C)C)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)o1 1565272851 DTCSDDIESSBGLD-UHFFFAOYSA-N 426.605 4.488 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCCCSc1nccs1)c1c(F)cccc1F 1565620022 HYPQQSHHFJSGRV-HNNXBMFYSA-N 443.541 4.286 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2ccccc2)c(C)n1-c1ccc(Br)cc1 1586795251 LNMBZPNBGPWZPV-LJQANCHMSA-N 441.369 4.438 10 10 IICE O=C(COc1ccc2c(c1)CCCC2)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595585632 ZGSIZEZKOOINOF-NRFANRHFSA-N 428.960 4.084 10 10 IICE Cc1nn(C)c(C)c1CN(C)c1nnc(CC(C)(C)C)n1CCCSc1nccs1 1612461675 QNRSIZZWJMIWQL-UHFFFAOYSA-N 447.678 4.492 10 10 IICE CCCc1ccc([C@@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(C)C)cc1 1616506641 WAAMDJLIMIIJAD-SANMLTNESA-N 441.591 4.218 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc2c(c1)CCCN2C 1620002460 SWXRSEBPOQZGAA-IBGZPJMESA-N 441.620 4.059 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCc1nc(-c2ccncc2)cs1 1631900411 XUJGKMGTZQUIPO-UHFFFAOYSA-N 430.533 4.398 10 10 IICE CC(C)N1C(=O)CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CC1(C)C 1634720132 OORQCGDQFBIAFP-QGZVFWFLSA-N 435.012 4.117 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3cnccn3)C2)c(C)n1-c1ccc(Br)cc1 1635791445 GKOXMVHILCGFNP-MRXNPFEDSA-N 425.330 4.276 10 10 IICE CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635997161 ZUOFRJQQEKVMQW-LJQANCHMSA-N 447.501 4.418 10 10 IICE Cc1cc(CNC(=O)NCCNC(=O)CCCc2ccccc2)c(C)n1-c1ccccc1 1636334318 CHFVWJKABCDMEF-UHFFFAOYSA-N 432.568 4.032 10 10 IICE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)c3cc(C)n(-c4cccc(Br)c4)c3C)[C@@H]2C1 1636370041 UFNOQNBJPLDYMK-ITKAJJHTSA-N 445.357 4.174 10 10 IICE CCOC(=O)c1oc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1C(F)(F)F 1639305822 LNJOTTZDLJRNLE-TXEJJXNPSA-N 445.413 4.235 10 10 IICE CCC[C@H](C)c1cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)n[nH]1 1640006948 ANZNPJVFFQQIAB-LBPRGKRZSA-N 434.543 4.134 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H](c3ccc(Br)cc3)N3CCCC3)ccc21 1641197382 IHFHDQWWTBGKMZ-JOCHJYFZSA-N 442.401 4.285 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3COc3cccc(C=O)c3)C2)cc1 1643346122 JXCFQGYBBFHJAK-OAQYLSRUSA-N 444.531 4.343 10 10 IICE Cc1cccc(OC[C@@H](O)CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1672133535 WDXKJVOCOPZDLL-ICSRJNTNSA-N 445.991 4.124 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C(C)C)[C@H](O)c3ccc(Cl)cc3)C2)cc1 1682188137 HNIFTBHLRIPNON-NLSFWIRASA-N 445.991 4.232 10 10 IICE CCC[C@](C)(O)Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695046306 HGHFEOFOBJYIQR-VWLOTQADSA-N 443.636 4.143 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763405220 UNVNDYCLMOPZMW-NYHFZMIOSA-N 429.952 4.133 10 10 IICE CC[C@@H](C)N1C(=O)C(NCc2ccncc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164355 XWJMDDOZMVLRDU-QGZVFWFLSA-N 428.536 4.157 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC(CN=[N+]=[N-])CC1 2010403661 HVJWTQQXPIIADW-LJQANCHMSA-N 431.537 4.036 10 10 IICE COc1cc(C=C2C(=O)NC(=S)N(c3cccc(Cl)c3C)C2=O)ccc1OC(C)C 2294208546 ZESHYSNTARHXSO-UHFFFAOYSA-N 444.940 4.276 10 10 IICE Cc1ccc(N2C(=O)C[C@H](N3C(=O)C(=Cc4ccc(Cl)cc4)SC3=S)C2=O)cc1 2296741696 LQYKGZNJNUAIKR-INIZCTEOSA-N 442.949 4.182 10 10 IICE COc1ccccc1C=C1SC(=S)N(CCCC(=O)Nc2ccc(F)cc2)C1=O 2314831857 UESQGVCHVVRXJD-UHFFFAOYSA-N 430.526 4.454 10 10 IICE CCCOc1cccc(C=C2SC(=S)N(c3ccc4c(c3)OCC(=O)N4C)C2=O)c1 2321736711 QUVWNMSCLJGJBP-UHFFFAOYSA-N 440.546 4.236 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCCC1 20681682 JKOMCCPTKZDSGT-KHCICDEESA-N 440.565 4.489 10 10 IICE CCCCC1(C)OC(=O)C(=Cc2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)cc2)C(=O)O1 59336993 GDJODZRILNXBET-UHFFFAOYSA-N 439.420 4.204 10 10 IICE COc1cc(/C=C/C(=O)Nc2ccnn2Cc2ccc(N(C)C)cc2)ccc1OC(F)F 98080291 VUELEVCLMLENOL-YRNVUSSQSA-N 442.466 4.259 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1 435828528 UPPHVKUUJVYYOE-FQEVSTJZSA-N 441.579 4.471 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3CCC(c4nnc5n4CCC5)CC3)c2C)cc1C 728914967 KJTYFHFFPAHWFO-UHFFFAOYSA-N 431.584 4.311 10 10 IICE CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 729345864 AMADXRDQUCGSDZ-RUZDIDTESA-N 433.596 4.293 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 743808122 LXLSBHQUKYWGML-IAGOWNOFSA-N 432.314 4.078 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@@H](c3cccc(Br)c3)C2)c([N+](=O)[O-])c1 748793819 NDPVHQBCLPXXOK-ZLQZBKBYSA-N 447.285 4.121 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N[C@H](c3ccccc3)[C@@H]3CCOC3)cc2F)C[C@@H](C)O1 771940104 NRFLNFLACQWJJG-YVXPOVKHSA-N 441.547 4.016 10 10 IICE Cc1c([C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)nnn1-c1ccc(F)cc1 773143615 BPWSXPYKFNHEME-IBGZPJMESA-N 448.590 4.098 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(F)c(F)c2)c1 778826924 NSWNKWBVTSHTFS-OTPBECDQSA-N 433.499 4.263 10 10 IICE C[C@@H](NC(=O)c1c(F)ccc(Br)c1F)c1ccc(N2CCOCC2)cc1 782868090 BBMJRHFCPBJBQU-GFCCVEGCSA-N 425.273 4.055 10 10 IICE COc1ccc(CNCc2cc(Br)ccc2O)cc1OCc1cccnc1 809713327 MOYGBACITNFWRB-UHFFFAOYSA-N 429.314 4.427 10 10 IICE C/C(=C\c1c(Cl)cccc1Cl)C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 1125326196 VSQCTAVESYLZPE-OKACTXMXSA-N 446.378 4.415 10 10 IICE CCOC(=O)[C@](C)(CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1128033080 IJBZSSHLHYUWLH-HHHXNRCGSA-N 448.563 4.166 10 10 IICE COc1cc2c(cc1OC)CN(C(=O)Cc1ccc(-n3c(C)cc(C=O)c3C)cc1)CC2 1136109639 HJOWDVPRPXJSRW-UHFFFAOYSA-N 432.520 4.051 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](COC)c1cccc(OC)c1 1230733176 LDUZQICEEQPBPL-SFHVURJKSA-N 437.334 4.083 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@]3(C)Cc3ccc(F)c(F)c3)C2)cc1 1230858190 IWMSIZOJSQUBIJ-UUOWRZLLSA-N 429.511 4.359 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccccc2-n2ncc(Cl)c(Cl)c2=O)cc1 1264668227 DWOXCJVYFYUGTH-UHFFFAOYSA-N 445.350 4.316 10 10 IICE CC(C)COc1ncc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1Cl 1264689023 GYYHNQKMBZFDRW-HOTGVXAUSA-N 449.954 4.453 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CC(C)(C)N2CCCCC2)n1 1289918420 DFEPEXLBSQMCAR-UHFFFAOYSA-N 434.588 4.255 10 10 IICE CCC[C@H](C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)c1cccc(Cl)c1 1292281715 HFWZGMGRPYTQNE-QHCPKHFHSA-N 429.992 4.171 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)C2CCCCC2)cc1 1295411903 YKMHLNDOPJIOHE-UHFFFAOYSA-N 426.609 4.080 10 10 IICE Cc1cc(C(=O)NC[C@]2(C)CCO[C@H]2C2CC2)c(C)n1-c1ccc(Br)cn1 1296126398 QPUVUKRORLWQQD-FPOVZHCZSA-N 432.362 4.187 10 10 IICE CO[C@](C)(Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O)C1CC1 1299506013 SBMPIXPDBDNEKB-JOCHJYFZSA-N 427.936 4.151 10 10 IICE COCCC1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1 1301326263 YBAUINHXALKZPZ-VKAVYKQESA-N 438.640 4.005 10 10 IICE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1301350761 YRIWMNNRXFGMID-PEZBUJJGSA-N 434.458 4.266 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@@H](C(C)(C)C)CC3)cc2F)C[C@@H](C)O1 1307473231 NVCYFWQCQQZGBA-SVFBPWRDSA-N 433.612 4.204 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C(F)(F)c3cc(F)cc(F)c3)cc2F)C[C@@H](C)O1 1355131081 SNUTUQWVXYGQOU-CHWSQXEVSA-N 428.401 4.126 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3c(Cl)cccc3OCC3CC3)cc2F)CC1 1360093738 LLXJMYGQXOMDCF-UHFFFAOYSA-N 445.966 4.340 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc2ccc(Br)cc2c(=O)o1 1442341196 DSODFDCGEAHKOL-UHFFFAOYSA-N 429.314 4.284 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(Cc4cccc([N+](=O)[O-])c4)CC3)c2C)c1 1442404873 IEGWAHGUZYEWDK-UHFFFAOYSA-N 432.524 4.269 10 10 IICE Cc1cc(C(=O)N2C[C@H](O)Cc3ccccc32)c(C)n1-c1ccc(Br)cc1 1448678073 LSMMMPFOVZXOLE-LJQANCHMSA-N 425.326 4.420 10 10 IICE COc1cc(CCNC(=O)/C=C\c2ccc(O)c(O)c2)cc(OC)c1OCc1ccccc1 1453973298 PFNFOLAJRPPRHA-LUAWRHEFSA-N 449.503 4.066 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H]4CC[C@@]43CNC(=O)OC(C)(C)C)cc2)CC1 1460905323 INZVTHWFDJGMJJ-NBGIEHNGSA-N 429.605 4.181 10 10 IICE O=C(Cc1ccc(O)c(O)c1)NCCCCCCc1nc(-c2ccc(Cl)cc2)no1 1467360715 SXGRIYLRQMXDNI-UHFFFAOYSA-N 429.904 4.263 10 10 IICE O=C(COCCc1ccc(Br)cc1)NCc1ccc(N2CCCCC2)cc1 1469303184 PWECZKVYVDWEDY-UHFFFAOYSA-N 431.374 4.315 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(n2c(O)nc3ccccc32)CC1 1478841177 QLNRSICSDGNUEI-SFHVURJKSA-N 435.572 4.094 10 10 IICE CC[C@H](C)N(C)CCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1496200989 ZKYISIYMPUOJSE-NZQKXSOJSA-N 440.636 4.097 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCSCC(C)C)CC2)cc1F 1518310101 UXDLSBZXVBTMKO-UHFFFAOYSA-N 449.640 4.439 10 10 IICE O=C(/C=C/c1ccc(Cl)nc1)N(CC1CCOCC1)c1ccc(Br)cn1 1534841190 NMZJLRGSXAHXQG-QHHAFSJGSA-N 436.737 4.366 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1c(O)cnc2c(Br)cccc12 1542371000 MUYZUKNJTKJALC-UHFFFAOYSA-N 428.330 4.431 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@@H](N(C)C(=O)OC(C)(C)C)C1 1542646401 OBWBISFWVQZQDJ-HXUWFJFHSA-N 439.556 4.378 10 10 IICE Cc1cc(CNC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)c(C)n1-c1ccccc1 1544081103 RGQVXRSAALPJEO-KRWDZBQOSA-N 428.529 4.102 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@@H](C)N(C(=O)c1cc(C)n(-c3cc(C)cc(C)c3)c1C)C2 1558416534 SIHLUHFTMAIYEC-GOSISDBHSA-N 434.540 4.129 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1nn(-c2ccccc2Cl)cc1C 1566848899 CCYGAIBEURYMMX-UHFFFAOYSA-N 448.306 4.009 10 10 IICE COc1ccc(N2CCN(C(=O)c3ncsc3Nc3ccccc3C)CC2)c(OC)c1 1586630417 KMHLSCYDHDIRJK-UHFFFAOYSA-N 438.553 4.175 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(C)n1[C@H]1CCCOC1 1598290937 IFUGGXZUXRZJOD-ZEQRLZLVSA-N 439.600 4.344 10 10 IICE Cc1csc(CNc2cccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)c2)n1 1603554766 KLPXLJRPYVQLCV-JOCHJYFZSA-N 437.613 4.162 10 10 IICE COc1cc([C@@H](C)NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)ccc1S(C)(=O)=O 1607749478 NXHPOFOUSNHOEY-GOSISDBHSA-N 440.565 4.306 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1614226815 AOKLKCQKVMPLFV-UGKGYDQZSA-N 436.604 4.182 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H](C)C1 1615091420 QXRZSULPFQYVPL-RTBURBONSA-N 448.615 4.313 10 10 IICE COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N1CCN(c2ccc(OC)c(F)c2)CC1 1616275299 MAMZFCWHTTXJHR-IBGZPJMESA-N 427.303 4.177 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)COc1ccccc1Br 1629968468 HFSYUVPFSHTUIF-UHFFFAOYSA-N 443.135 4.345 10 10 IICE CC[C@@H](CO)NC(=O)Cc1ccc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc1 1631430030 MGVGYUDXZXTBKO-QFIPXVFZSA-N 447.579 4.393 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1634184702 AFJSWEHKNFXYPZ-SANMLTNESA-N 432.520 4.157 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cccc([C@@]3(C)COC(=O)N3)c2)cc1 1636867842 UZUYSHWUXOWJHN-RUZDIDTESA-N 431.492 4.043 10 10 IICE Cc1cc(C(=O)N2CC(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Br)cc1 1637525341 SBKQVERVOYLGQA-UHFFFAOYSA-N 433.346 4.270 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](O)c2ccccc2Br)c1 1637961193 RGZUSBKGUWYQHQ-NRFANRHFSA-N 441.325 4.133 10 10 IICE COC(=O)CCCc1nc(CN(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)no1 1642025326 VZPRDBZNGJPVTR-TWGQIWQCSA-N 449.507 4.057 10 10 IICE COC(=O)CN(Cc1cncc(OCc2ccccc2)c1)Cc1cc(Cl)ccc1O 1653611848 NYWFJMXTXJWTJA-UHFFFAOYSA-N 426.900 4.195 10 10 IICE COC1CCN(c2ccc(CN3C[C@H]4C[C@H](NC(=O)OC(C)(C)C)C[C@H]3C4)cc2)CC1 1655848772 UUHFJVUHFYBCEX-JAXLGGSGSA-N 429.605 4.179 10 10 IICE COc1ccc(N2CCCN(CC(=O)Nc3ccccc3C(=O)c3ccccc3)CC2)cc1 1657023549 HBSVXGACSLDVEK-UHFFFAOYSA-N 443.547 4.077 10 10 IICE COc1cc(NCCNC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc(OC)c1 1683149295 NNVBPIVEWCYCEK-UHFFFAOYSA-N 436.556 4.065 10 10 IICE CC[C@@H]1CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC[C@@H]1c1ccccc1 1685328391 VHEHUGXBZQCSGY-BWKNWUBXSA-N 448.611 4.114 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@@H]2Cc2ccccc2F)N(C)C)cc1 1685610231 WLIRGQCSBXOIDI-ISKFKSNPSA-N 426.580 4.301 10 10 IICE Cc1noc(-c2ccc(CNC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)cc2)n1 1686039569 MBTINVDWEHYOEM-UHFFFAOYSA-N 429.524 4.494 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1cncn1 1695078652 VRVXNQIQQFGKRF-SFHVURJKSA-N 432.576 4.269 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@@H]3CC=CCC3)CC2)cc1F 1697471721 LYAHHJZGHBENDJ-LJQANCHMSA-N 427.568 4.307 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C[C@@H](C)S1 1708241951 SWWFEUVFZKEQCB-QLFBSQMISA-N 425.649 4.099 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1CC)C(C)C 1728288533 BBNTYXAPZXTNJI-UHFFFAOYSA-N 432.576 4.247 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1728382884 QSGKBBPBORATLH-GOTSBHOMSA-N 441.620 4.420 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CC[C@@H](F)C3)CC2)cc1 1770258299 NKEJFBNDYRTCHV-RTBURBONSA-N 429.584 4.439 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(c3cccc(C(=O)OC)c3)C2=O)cc1OC 1860086715 CLCFFSRASBPQGC-WOJGMQOQSA-N 429.519 4.286 10 10 IICE Cc1cc(S(=O)(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)ccc1Br 1891659309 CSIJMWAGCQHPBQ-WMZOPIPTSA-N 435.387 4.225 10 10 IICE CN(C)Cc1cc([C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)ccc1O 1951626895 ZOCJMBYVHXGQDI-DEOSSOPVSA-N 446.503 4.118 10 10 IICE CC(C)(C)OC(=O)NCC1(NCc2cccc(F)c2O)CCN(Cc2ccccc2)CC1 2067210680 WJSWVJFOEDJIKS-UHFFFAOYSA-N 443.563 4.180 10 10 IICE CC(C)=CCc1c2c(c3occ(-c4ccc(O)c(O)c4)c(=O)c3c1O)C[C@H](O)C(C)(C)O2 2069682064 KMIAVXXXWOJFRF-IBGZPJMESA-N 438.476 4.160 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@H](CNCc1c(O)cccc1Br)C2 2126087276 PHRZEOMOQWCKJW-ZQIUZPCESA-N 425.367 4.280 10 10 IICE O=C1C(=Cc2ccccc2F)SC(=S)N1CC(=O)N1CCCC[C@H]1c1cccnc1 2296266107 XPOSSRIPTPYRCF-SFHVURJKSA-N 441.553 4.176 10 10 IICE CCCOc1ccc(C=C2SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)cc1 2314926692 PMUBCFLEPGREOY-GOSISDBHSA-N 427.547 4.373 10 10 IICE O=C(O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2Br)SC1=S 2323865474 HDTCWNSAWCDJOD-HNNXBMFYSA-N 434.336 4.476 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)N(C)C)cc1 2323880176 ZSZVLFXZBVFGPE-SFHVURJKSA-N 443.550 4.108 10 10 IICE COC(=O)c1ccc(N2NC(=O)/C(=C\c3ccc(-c4cccc(Cl)c4C)o3)C2=O)cc1 678131 BMMVEZSEQWYQQE-LDADJPATSA-N 436.851 4.156 10 10 IICE C[C@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)C1=O 11635437 DRHYTFFWRZTPRP-MRVPVSSYSA-N 446.406 4.228 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 15047417 JNEWKRPCIVFFKZ-CYUIRQCWSA-N 430.526 4.453 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3F)[C@H]2c2ccc(O)c(O)c2)cc1OC 526203119 JYVKCOZYOBLKMN-QFIPXVFZSA-N 437.423 4.311 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(OC)cc3OC)[C@H]2c2ccc(O)c(O)c2)cc1 526217004 RZGMGWQTXXUETL-HSZRJFAPSA-N 449.459 4.181 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3C(C)=O)[C@H]2c2ccc(O)c(O)c2)cc1 526610635 OIBMWSAEMLCRFZ-QHCPKHFHSA-N 431.444 4.366 10 10 IICE O=C(O)/C=C/c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c(Br)c1 705929623 GUFTVCVQXIEFBT-NNIASQDCSA-N 427.342 4.115 10 10 IICE Brc1cc(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)ccc1CNC1CC1 707850186 YBNNRQIPPSNIRE-WOJBJXKFSA-N 426.402 4.269 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(-c4noc(CC(C)(C)C)n4)c3)CC2)cc1 741517000 DPZWIECIERIRQX-UHFFFAOYSA-N 434.540 4.296 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N(Cc3ccccc3)C3CCCCC3)cc2)C1 745690781 DMNYEDGLTMCTDV-QHCPKHFHSA-N 448.611 4.433 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)/C=C/c3ccc(F)cc3)cc2)cc1 747593884 IBXDVMONARMFRW-CCEZHUSRSA-N 446.525 4.348 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCC(C2CCOCC2)CC1 752680569 HYVSCDFUZUQCCU-LJQANCHMSA-N 437.531 4.105 10 10 IICE Cc1cc(C(=O)NCCN(C)Cc2ccccc2)c(C)n1-c1ccc(Br)cn1 1136392732 QDDLWYSICIIUQB-UHFFFAOYSA-N 441.373 4.113 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccccc2CN2CCC(O)CC2)c1 1153182527 UNHNRCKAYOYCQL-UHFFFAOYSA-N 431.536 4.116 10 10 IICE O=C(Nc1ccccc1-c1ncco1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1167439685 DFVVFARYBYGFIB-UHFFFAOYSA-N 441.490 4.162 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(-c4cc(OC)ccc4Cl)no3)CC2)cc1 1264732676 FRYCJHAGAFMJAD-UHFFFAOYSA-N 441.915 4.365 10 10 IICE CC(C)(C)O[C@H]1C[C@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1277661824 YQWRCCHNGYKKII-AUSMZJMNSA-N 438.640 4.192 10 10 IICE CC(C)[C@@H](NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1290482985 HVLFYQGDIKRRTO-HXUWFJFHSA-N 430.551 4.382 10 10 IICE CCc1nnc(N2CCC[C@@H](OC(C)(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1293045123 RDCBDDPEURBAFA-OAQYLSRUSA-N 443.661 4.226 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCC[C@H]2CCCCO2)cs1 1304655283 VQZNEVLXNOHSOP-HXUWFJFHSA-N 441.601 4.325 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)c3ccc(Br)cc3)CC2)c(OC)c1 1312599862 WCXBOBPTPXOOCX-HNNXBMFYSA-N 448.361 4.059 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H](O)C1 1316378486 VLWJQQNPYRUXSB-CDMIOBSGSA-N 439.629 4.311 10 10 IICE CC(C)OC(=O)c1c(NC(=O)C[C@@H]2C(=O)Nc3c(F)cccc32)sc2c1CCCC2 1350440056 MNMPGNQWDJOSIT-AWEZNQCLSA-N 430.501 4.396 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@@H](C)C2 1354327543 YCBIJIHIKGVGHA-CABCVRRESA-N 432.586 4.168 10 10 IICE Cc1nn(-c2cccc(F)c2)cc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1355131775 ZHSQNNIMNZFTFZ-HZPDHXFCSA-N 440.494 4.003 10 10 IICE COc1ccc(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1F 1357313649 KLRRWBURGHKUBR-YVLHZVERSA-N 435.473 4.170 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2nc(-c3cccs3)no2)cc1 1449319699 NYFULTIEERKMEI-UHFFFAOYSA-N 434.521 4.219 10 10 IICE COc1cccc(CN2CCC(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1453144159 LZDOHVZSCCAEFS-UHFFFAOYSA-N 431.580 4.426 10 10 IICE COC(=O)Nc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1F 1457088687 ASYDLWVNIGZVRJ-CQSZACIVSA-N 437.418 4.004 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H](CCNC(=O)OC(C)(C)C)C3)cc2)CC1 1460020797 WNIRMJHZFHPASU-FQEVSTJZSA-N 431.621 4.429 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1463886193 KHYQMQQSCRXQFW-CALCHBBNSA-N 448.405 4.086 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(Cc1cccc(O)c1)[C@H]1CC[C@H](O)CC1 1470556232 PBLGWRBIVADZLM-ZFJSRUIDSA-N 439.600 4.213 10 10 IICE Oc1c(CNc2ncnc3ccc(I)cc23)ccc2cccnc12 1472810841 ZXLSSXBAILCYKZ-UHFFFAOYSA-N 428.233 4.100 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC3CC3)C3CCCCC3)cc2F)C[C@H](C)O1 1473148010 XTPQNCJSYZUTLW-OALUTQOASA-N 431.596 4.100 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC(C4CCCCC4)CC3)cc2F)C[C@@H](C)O1 1473617138 FOASRERZHWGIBS-BGYRXZFFSA-N 445.623 4.348 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H](C)c3cccc(C4CC4)c3)CC2)cc(OC)c1OC 1478720307 QQXYILRHHSMXCF-QGZVFWFLSA-N 439.556 4.183 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC[C@@H](OCC4CC4)C3)nnc2C(C)(C)C)cc1F 1503394244 QFDCGRJSZOTQNU-LJQANCHMSA-N 429.584 4.224 10 10 IICE CN(CC(F)(F)F)c1nnc(C2CCC2)n1Cc1ccc(N2CCSCC2)cc1 1503452273 ALULGZQBRTYZMW-UHFFFAOYSA-N 425.524 4.146 10 10 IICE CCN(CC(C)C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1515459749 OREQISKFFMXCAH-XMMPIXPASA-N 447.599 4.054 10 10 IICE CCOCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCCO1 1516715221 BRFFIOAKCCZFJM-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1CCC1CC(OC(C)(C)C)C1 1517142528 NERWMTOTRWNCNW-UHFFFAOYSA-N 438.576 4.004 10 10 IICE CS[C@@H]1CCCCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1519292104 PALUHHQUOGJFMD-QRYYFKOISA-N 438.615 4.161 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3ccc(C)c(Cl)c3Cl)CC2)cc1 1524982528 UYBBGMPMLXMACM-UHFFFAOYSA-N 436.383 4.253 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@@H](C)[C@@H]2C(=O)OC(C)(C)C)CCCC1 1526122692 SNXDKTPLDGDGLY-MZNJEOGPSA-N 440.584 4.498 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(F)(F)c3cccc(Br)c3)C2)cc1 1526247593 ZPPQEECUVWIYKG-AWEZNQCLSA-N 439.300 4.192 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3OCCC3(C)C)CC2)cc1 1554958515 DRGVMYMOZOMWJV-NRFANRHFSA-N 441.620 4.116 10 10 IICE CCOC(=O)CS[C@@H](CNC(=O)c1cc(C)ccc1-n1c(C)ccc1C)C(F)(F)F 1558053427 BPFSQVOPXQWXEF-SFHVURJKSA-N 442.503 4.360 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4cnn(C)c4c3)cc2Cl)C1 1564649680 JQYNJHDFYKTEET-INIZCTEOSA-N 425.964 4.462 10 10 IICE CCCc1sc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1Br 1585539335 DLGPQRMEZZQJMM-UHFFFAOYSA-N 437.403 4.354 10 10 IICE CC[C@H](C)c1ncc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1585946378 YXEKVMJQXHOYDR-VZWMTCDZSA-N 444.557 4.359 10 10 IICE Cc1cc(C(=O)NC[C@]2(O)CCc3ccccc32)c(C)n1-c1ccccc1Br 1597080298 HLEOTWJOKMOLHR-HSZRJFAPSA-N 439.353 4.420 10 10 IICE CCc1c(Br)cc(C(=O)NCc2c(O)cccc2O)cc1Br 1597573242 APGJKFMUYMXTRD-UHFFFAOYSA-N 429.108 4.115 10 10 IICE COCC(=O)N1CCCc2ccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)cc21 1616228027 IAONXMHCJOLNIV-UHFFFAOYSA-N 431.536 4.201 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H](CC)[C@@H]2CCCO2)sc(C)c1-c1ccccc1 1617103420 LSQUBPFJUMLSLQ-ROUUACIJSA-N 430.570 4.386 10 10 IICE COc1ccc(N(CC(=O)Nc2nnc(C(C)(C)C)s2)Cc2ccccc2)cc1OC 1620686132 YIFWEVFADZTDOW-UHFFFAOYSA-N 440.569 4.498 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCC2(C(=O)OC(C)(C)C)CCOCC2)c1 1627353920 YMJADXDHHFBCTF-UHFFFAOYSA-N 426.557 4.271 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)C1(c2cc(F)cc(F)c2)CCCC1 1629962982 GWTJPEPRAZIYAC-UHFFFAOYSA-N 432.486 4.193 10 10 IICE COc1ccc(-n2ccnc2SCC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1 1630181057 SIYSTKDFCPWWEL-GOSISDBHSA-N 438.597 4.095 10 10 IICE COc1ccc(SCCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1630257270 UGNRPCUDTNQNMP-GOSISDBHSA-N 434.989 4.317 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3=Cc4ccccc4O[C@H]3C(F)(F)F)C2)cc1 1630618749 GLJAYCABHMTJQD-YCRPNKLZSA-N 432.442 4.045 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCc3ccc(Br)c(C)c3)CC2)cc1 1630991865 ABWZSPCMCLHTKG-UHFFFAOYSA-N 431.374 4.438 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1ccccc1C 1631377919 UNIXVZQIRRNDKI-UHFFFAOYSA-N 436.531 4.243 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)Cc2ccccc2)c(C)n1-c1cccc(Br)c1 1633557539 LRSNSSJXYGEXAL-LJQANCHMSA-N 427.342 4.190 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NC[C@H](CO)Cc3ccc(F)c(F)c3)c2C)c1 1637578154 QMYKPAVYQCPELW-HXUWFJFHSA-N 441.522 4.331 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639929325 ZBWPMQZHNCZDMZ-OXJNMPFZSA-N 432.362 4.187 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1O 1643253123 BSYAMGQGBSEAFS-GOTSBHOMSA-N 440.515 4.261 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c(C)n1-c1ccc(Cl)cc1 1643911403 YRZMDQXZGBCMIA-HNNXBMFYSA-N 441.881 4.278 10 10 IICE COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1648478399 FCFIASSNHVYSFG-IAGOWNOFSA-N 442.515 4.457 10 10 IICE O=C(NCc1cccc(O)c1O)c1cccnc1Sc1ccc(Br)cc1 1651173169 SJZDQGZAPLMHAA-UHFFFAOYSA-N 431.311 4.337 10 10 IICE CC[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1cccc2ccccc12 1654816275 YSJKTYILEFGGJD-XMMPIXPASA-N 435.543 4.173 10 10 IICE CN(C)c1ccc(CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C2CC2)cc1 1655004828 YUUPQOVFXPYPQQ-UHFFFAOYSA-N 443.447 4.123 10 10 IICE CCOC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)o1 1672133655 ZPDGXYTZTLRYRR-HNNXBMFYSA-N 433.936 4.345 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCn4c(nnc4C(C)(C)C)C3)cc2Cl)C1 1681828330 SGLMYARXOAIADO-MRXNPFEDSA-N 445.011 4.191 10 10 IICE Cc1cccc(-c2nnc(N3CC[C@H](OCC(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1724492930 JMQLSHZCUMNEHU-QHCPKHFHSA-N 448.615 4.323 10 10 IICE CCc1nnc(N2CCN([C@H](C)c3ccsc3)CC2)n1CCCSc1nccs1 1727603215 XVQCSXYQHUKYTD-MRXNPFEDSA-N 448.687 4.424 10 10 IICE CCOCc1nnc(N2C[C@@H](C)[C@H](C(F)(F)F)C2)n1Cc1ccc(N(CC)CC)cc1 1729092027 QULTVGXBBPGJHV-VQIMIIECSA-N 439.526 4.344 10 10 IICE CCCC(=O)N[C@@H]1CCCN(c2nnc(C3CCC3)n2CCCSc2nccs2)C1 1765387175 KUNNINYEBYZTGH-QGZVFWFLSA-N 448.662 4.070 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(C)CCOCC3CC3)ccc21 1769069087 NBLUMXMPRYMXHK-UHFFFAOYSA-N 425.621 4.160 10 10 IICE Nc1ccc(CS(=O)(=O)Cc2ccc(-c3csc(Cc4ccccn4)n3)cc2)cc1 1857849829 KNTCLGAJEBSTMS-UHFFFAOYSA-N 435.574 4.493 10 10 IICE CCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2cccnc2)C1=O 1873164553 HEBHURSFIFXGIX-UHFFFAOYSA-N 428.536 4.159 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2060639976 OBWAYDSYHKRMCR-PMACEKPBSA-N 445.564 4.426 10 10 IICE Cc1cc(O)c([C@H](n2nc(C)c(C(=O)O)c2I)C(C)(C)C)cc1C 2079935125 WCCOENSZIYCBFM-HNNXBMFYSA-N 442.297 4.452 10 10 IICE N[C@H]1C(=O)Nc2cc(N(CCC(F)(F)F)Cc3ccccc3)c(Br)cc21 2095859538 JBJHFTSYYGNQAD-MRXNPFEDSA-N 428.252 4.360 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccc(Br)c2)SC1=S)Nc1ccccn1 2296882543 YYZTUAVSOITDLA-UHFFFAOYSA-N 448.367 4.074 10 10 IICE COc1cc(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc(OC)c1OC 2313609502 KBMMPAJGLUFOQG-UHFFFAOYSA-N 446.506 4.335 10 10 IICE CCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1OCC 2314764995 QYTHRCAEFOWBIJ-UHFFFAOYSA-N 442.562 4.339 10 10 IICE CC(=Cc1ccccc1)C(=O)N[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 2330422379 CVVKPZDRJIGUQJ-KRWDZBQOSA-N 438.483 4.009 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4c(Br)cccc4[nH]3)CC2)cc1 726562070 DOPHBOWLYLIEAX-UHFFFAOYSA-N 428.330 4.338 10 10 IICE CCS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1 728269985 CDVRMCNANHERRD-UHFFFAOYSA-N 428.598 4.108 10 10 IICE COC(=O)/C=C\c1ccc(N(C)Cc2cc(OC)c(OC)cc2SC)c([N+](=O)[O-])c1 741244007 SXNPEORHRYJNMG-CLFYSBASSA-N 432.498 4.157 10 10 IICE CN(C(=O)NCc1ccc(N2CC=CC2)cc1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 752674864 XUIRQAZYCURUQA-CBQGHPETSA-N 440.588 4.135 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCn4c(cc5cc(Cl)ccc54)C3)CC2)cc1 755673362 LNQQZOVAZHAOOQ-UHFFFAOYSA-N 438.959 4.498 10 10 IICE COc1ccc(N2CCN(C(=O)C[C@H](C)C3CCN(C(=O)OC(C)(C)C)CC3)CC2)cc1 764527592 HTJBBQYEZAMKKS-IBGZPJMESA-N 445.604 4.017 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3ccc(Br)cc3OC)SC2=S)cn1 781549822 JUBRKWMDOCTCOE-VGOFMYFVSA-N 437.340 4.267 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc(CN(C)C)cc2)nc1-c1c(F)cc(F)cc1F 789725763 BZMOJJBTJIJDLW-UHFFFAOYSA-N 441.500 4.398 10 10 IICE COC(=O)C[C@@](C)(NCc1cc(F)cc(C(C)=O)c1O)c1ccc(Br)cc1 796497876 QCKRGECPVVYERX-HXUWFJFHSA-N 438.293 4.065 10 10 IICE CC(=O)N[C@H](CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)c1ccccc1 800048515 DBZFYGSNJIQMFI-VGOFRKELSA-N 427.976 4.460 10 10 IICE Cc1cccn(Cc2c(F)cccc2NC(=S)NCCCN(C)c2ccccc2)c1=O 806608510 AAOOKIYQMBVBDC-UHFFFAOYSA-N 438.572 4.157 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cnnn1-c1cc(Cl)ccc1Cl 1124550122 ZDZQCOMKSFVGEK-UHFFFAOYSA-N 430.339 4.447 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CCCCC2 1125113979 WGYQUQOGNHNDBZ-CQSZACIVSA-N 444.528 4.324 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)C1CCC(F)(F)CC1 1129480178 FOFCDAJGYXHUCD-FOWTUZBSSA-N 442.528 4.453 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N1C[C@@H](C(=O)OC)Cc2ccccc21 1134141449 QADKOKMISNNLKB-IWGBCORSSA-N 430.504 4.415 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C1(C(F)(F)F)CCN(C(=O)OC(C)(C)C)CC1 1136743822 CPJPSWVPYMBVNW-UHFFFAOYSA-N 443.510 4.257 10 10 IICE Cc1nc(C(C)C)oc1CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1141412271 FEBRAODASFDOBY-MHWRWJLKSA-N 449.623 4.466 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 1142419388 QARZABRPSULROS-YKSBVNFPSA-N 439.600 4.449 10 10 IICE Cc1cc(CNC(=O)c2ccc(I)c(O)c2)c(C)n1-c1ccccc1 1151153920 PPBCTKSYIPZHPW-UHFFFAOYSA-N 446.288 4.334 10 10 IICE CCOC(=O)[C@H]1CSCCN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1264337952 AJPQSYIZJYXBCA-HXUWFJFHSA-N 426.542 4.289 10 10 IICE CC(C)[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1287288825 TYUHISWIJZMZFJ-SJORKVTESA-N 437.635 4.020 10 10 IICE CCN(CC)Cc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 1291755252 BNHQZTGCUAXWNE-OALUTQOASA-N 427.564 4.211 10 10 IICE O=C(C[C@@H]1CCC[C@H](C(F)(F)F)O1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860038 PRFOEOBPNQVKMZ-SOLBZPMBSA-N 434.886 4.016 10 10 IICE Cc1cc([C@@](C)(O)Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccccc2O)c(C)o1 1304152457 NRLFZDOYBUXBHW-DEOSSOPVSA-N 426.561 4.326 10 10 IICE Cc1cc(N2CCC[C@@H](NC(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)C2)n(C)n1 1324667912 UUTXXZKCAOQDPO-GOSISDBHSA-N 425.964 4.188 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)s2)c(F)c1 1355129819 HQXAALRDNPVSIC-UHFFFAOYSA-N 443.519 4.472 10 10 IICE COc1cc(CN2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)cc(OC)c1 1445462921 QJTOGTGKGRTOLD-UHFFFAOYSA-N 439.581 4.131 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H](Oc3ccccc3)C(C)(C)O)cc2Cl)C1 1448445370 ANOPKGKFHHZMOD-JTSKRJEESA-N 430.976 4.411 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1ccc2cc(OC)ccc21 1448676814 UHNIASBJLSKPFL-UHFFFAOYSA-N 437.540 4.039 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@]3(c4ccccc4)CCC(=O)NC3)cc2Cl)C1 1459574433 FOHOXYUTZWUOBV-IQGLISFBSA-N 439.987 4.041 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H]2CCN(c3ccccc3F)C2)cc1 1468504381 DANFZSSHMQDMDE-OAQYLSRUSA-N 433.527 4.231 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C1CCN(CCC(F)(F)F)CC1 1470555292 CIUGXKNQSOITAE-QGZVFWFLSA-N 428.543 4.050 10 10 IICE COC(=O)CC[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1530074743 GZHXQUHPTMMOLT-QHCPKHFHSA-N 447.579 4.219 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C)CCCC1 1535272871 LANMKLNRPIWRBA-FQEVSTJZSA-N 428.573 4.401 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1CC[C@@H](C2CC2)N1C(=O)OC(C)(C)C 1540488217 IWQURSQJBAMHJL-VXKWHMMOSA-N 427.589 4.423 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN2CCCC[C@H]2C)n1 1542564146 SOSQVSJVANXKPX-HXUWFJFHSA-N 434.588 4.255 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC[C@@H]1OC 1545503752 HOIGYZJDOHWWEQ-JTAQYXEDSA-N 441.620 4.332 10 10 IICE CC(C)C1CCC(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 1545540739 CVCVOQXAQWYSBL-UHFFFAOYSA-N 436.599 4.447 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1cccc(Cl)c1Cl 1546152285 ZNHBLWBSZGGLLX-NSHDSACASA-N 446.714 4.322 10 10 IICE Fc1ccc(Cc2nnc(N3CCC(F)(F)C3)n2CCCSc2nccs2)cc1 1555979255 BYXIDVYTYWVARS-UHFFFAOYSA-N 439.532 4.492 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCC2(OCCO)CCC(F)(F)CC2)c1 1557549510 WUMFQYQDAACKHW-UHFFFAOYSA-N 440.918 4.434 10 10 IICE Cc1ccc(CSCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cc1C 1559387679 FQTJZGRDABTLQR-UHFFFAOYSA-N 442.606 4.474 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnc(Cc4ccccc4C)n3)c2C)cc1 1559390377 NOENDFJLJKNXJK-UHFFFAOYSA-N 429.524 4.261 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CO[C@@H]1C[C@@H](C)CC[C@H]1C(C)C 1566848919 CTKDKGOCDIWAED-ZAAXVRCTSA-N 425.953 4.025 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(c4cccc(Br)c4)CC3)C2)cc1 1584438252 AWPPBVHPOCABOC-MRXNPFEDSA-N 429.358 4.132 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)cc1 1585445250 YSVVRIXVMSCLGM-UHFFFAOYSA-N 442.947 4.316 10 10 IICE CNC(=O)[C@]1(C)CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)C)C1 1618578362 WVADJPTUCFJADR-AREMUKBSSA-N 448.615 4.361 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)c1 1628980716 KYHBBHHEYKBXDV-XMMPIXPASA-N 429.520 4.174 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CC(C)C)NC(=O)NCc1ccc(C)cc1 1631265825 OAONEOKRJRCRRS-XMMPIXPASA-N 438.616 4.324 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc(I)c(Cl)c3)ccc21 1631322133 DIVWYTLBKDIEAN-UHFFFAOYSA-N 440.712 4.257 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCC12CCN(C(=O)OC(C)(C)C)CC2 1633818089 DOBXYLQJEHBNCX-IEBWSBKVSA-N 446.588 4.353 10 10 IICE O=C(NCc1cccc(O)c1O)c1cccnc1SCc1ccc(Br)cc1 1637034488 IVMBVBJPFCZZLW-UHFFFAOYSA-N 445.338 4.478 10 10 IICE CCCn1c(C)c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c2cc(OC)ccc21 1641200783 NITSQFUVSNGXTB-UHFFFAOYSA-N 435.568 4.259 10 10 IICE Cc1cc(C(=O)Nc2cc([C@H]3CCCO3)[nH]n2)c(C)n1-c1ccc(Br)cn1 1643743545 SENMUSMJRGSUPE-MRXNPFEDSA-N 430.306 4.079 10 10 IICE CC[C@H](C)n1nc(C)c(-c2cc(C(=O)N(C)CCN(C)c3ccc(OC)cc3)n[nH]2)c1C 1644438105 LRVHEWUSCYIQLF-INIZCTEOSA-N 438.576 4.078 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccccc2F)c(C)n1-c1ccc(Br)cc1 1652029010 DMVITTKUAHMFLG-LJQANCHMSA-N 445.332 4.329 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3ccc(F)cc3Br)C2)cc1 1682646722 UYWGJUHPRJGMGL-INIZCTEOSA-N 436.325 4.017 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CO)c3c(F)cccc3F)cc2Cl)C1 1686268963 JBEYGSJAFUSBGE-AUUYWEPGSA-N 437.918 4.387 10 10 IICE Cc1cc(CCNC(=O)NC[C@@](C)(O)c2ccccc2Cl)c(C)n1-c1ccccc1 1687217061 ODOBRXPVBWEYRM-XMMPIXPASA-N 425.960 4.497 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCOCCCO 1694877061 POVWTTYDQZAMLA-OAQYLSRUSA-N 437.588 4.130 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CC=C(C(F)(F)F)CC2)cc1F 1729328471 LZYOZBPVPVGNJT-UHFFFAOYSA-N 434.441 4.225 10 10 IICE CO[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1)C(C)(C)C 1748420306 IHIVMYNZEFAJOO-QFIPXVFZSA-N 437.588 4.250 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H](OC)[C@@H](C)CC 1763748652 RZADWVFNWIFVEZ-NPPFBWRTSA-N 447.599 4.327 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC(=O)N1 1764839400 DCQDYPPKNCGJCQ-HXUWFJFHSA-N 434.588 4.114 10 10 IICE COCC1(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCCCC1 1770835875 LCTKOTPGKOTSCV-NRFANRHFSA-N 428.577 4.459 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1772854413 VHYLTGBWFUILNV-SFHVURJKSA-N 436.604 4.313 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)/C2=C/c2ccc3c(c2)OCCO3)cc1 1865671427 AIWJPGAHAFRZCS-HYARGMPZSA-N 444.462 4.436 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@H]1CNCc1c(O)cccc1Br 1965971498 YMPZTENKBUSEBH-AWEZNQCLSA-N 425.367 4.424 10 10 IICE CC(C)CN(Cc1ccccc1)C(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 2080888098 PNRNAHMZQGNKOF-FQEVSTJZSA-N 442.556 4.218 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cccc(Br)c2O)C(F)(F)CC1 2093435781 DZURRKTWAWVEOO-AWEZNQCLSA-N 435.309 4.279 10 10 IICE CC[C@H](NC[C@@H]1[C@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2)c1cc(Br)ccc1O 2138291868 YZEGDZOJHWIRRX-NKKGCODLSA-N 425.367 4.451 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@H](NCc1cc(Br)cc(F)c1O)C2 2193314636 UOMXYRQLWGYAND-UKMLZYKCSA-N 447.320 4.262 10 10 IICE Cc1ccc(C)c(NC(=O)COc2ccc(Cl)cc2C=C2SC(=S)NC2=O)c1 2314486327 KJXSLQGKPKCYEB-UHFFFAOYSA-N 432.954 4.463 10 10 IICE Cc1cccc(N2C(=O)C[C@@H](N3C(=O)C(=Cc4ccc(Cl)cc4)SC3=S)C2=O)c1 2314832214 CDKWFMDEUHXLAP-MRXNPFEDSA-N 442.949 4.182 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccccc3C)C2=O)ccc1O 2314836927 LVIPJLYEESTABZ-AWEZNQCLSA-N 442.562 4.328 10 10 IICE COc1ccc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)cc1OC 2321689121 INMLPEUCAPWCQY-UHFFFAOYSA-N 431.564 4.436 10 10 IICE Cc1ccc(CN[C@@H]2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)c(O)c1Br 2352680340 PZJSPPFUSCEJCC-BZUAXINKSA-N 425.367 4.198 10 10 IICE Cc1nc2c(C(=O)NCCc3ccccc3)cnn2c(O)c1Cc1ccc(F)cc1Cl 8592930 XOVPUMJSZFUADE-UHFFFAOYSA-N 438.890 4.099 10 10 IICE COc1cccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@H]3C=CC[C@H]32)c1O 14459731 BNXIVOFWWPVMKY-GCKMJXCFSA-N 428.554 4.304 10 10 IICE CC(C)OC(=O)CN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S 33332499 QSXABLIAQBVNNG-XDHOZWIPSA-N 427.547 4.418 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@@H]2c3ncccc3C(=O)N2c2ccc(Cl)cc2)cc1 65307567 AOHISTNLXQPTST-OAQYLSRUSA-N 434.927 4.209 10 10 IICE CN1C(=O)/C(=C\c2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCCO3)SC1=S 210031714 MLIXIUPNOMWBKN-XDHOZWIPSA-N 435.530 4.142 10 10 IICE COc1ccc(N2CCN3c4ccccc4C[C@H](C(=O)NCc4cccc(F)c4)[C@H]3C2)cc1 245279579 IVXDRHJUAOJLMH-AZGAKELHSA-N 445.538 4.018 10 10 IICE O=C1C(O)=C(c2ccc(F)cc2)[C@H](c2ccc(O)c(O)c2)N1c1ccc2c(c1)OCCO2 526158091 DHTQJRJGRFDLTH-QFIPXVFZSA-N 435.407 4.065 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cccc(OC)c3OC)[C@H]2c2ccc(O)c(O)c2)cc1 526217892 CRDUGXKAYPDSTR-JOCHJYFZSA-N 449.459 4.181 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](Cc3nccn3C)c3ccccc3)ccc21 608208421 NQSJMOXFFPXRAC-HSZRJFAPSA-N 430.552 4.352 10 10 IICE CCOc1ccc(-n2ncc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c2C)nn1 742416612 HDALFZWRXPHVHA-UHFFFAOYSA-N 448.571 4.068 10 10 IICE COC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cc1 747859157 WVHOKHOOLZYGEZ-RUDMXATFSA-N 436.461 4.075 10 10 IICE COC(=O)C(C)(C)[C@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1ccccc1 767146197 VZKZHHHOVOKJKF-IFMALSPDSA-N 440.540 4.023 10 10 IICE Cc1ccsc1-c1nsc(NC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)n1 771268267 HHLBUCIVTIHPJW-UHFFFAOYSA-N 443.598 4.105 10 10 IICE C[C@@H]1C[C@H]1c1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1125177843 QMKUOTXABLEKQY-AJIOOVMDSA-N 444.553 4.450 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)C2)cc1 1130827342 ZHLNDSYIBUIVMF-IBGZPJMESA-N 446.507 4.224 10 10 IICE CC(C)c1cc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)nn1C 1134542063 GQLOBNOIFZXEFG-UHFFFAOYSA-N 439.317 4.268 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC[C@H](C2CCC2)C1 1147998585 HRWRMNLDRCVOCR-NFBGKYEXSA-N 432.586 4.456 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc(Cl)c1OCC(C)C 1148701389 WCDRRFPFPHKSQX-UHFFFAOYSA-N 446.975 4.275 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cccc(CN4CCN(C)CC4)c3)c2C)c1 1151154096 ROYQBYZLPLQIOW-UHFFFAOYSA-N 430.596 4.080 10 10 IICE C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1274765370 MQMPXBDBOFXMGM-FTCLHHFLSA-N 442.537 4.055 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CS(=O)(=O)CCCc3ccccc3)c2C)c1 1287659752 CXTHXPOPSKJGHG-UHFFFAOYSA-N 438.593 4.066 10 10 IICE Cc1nc(O[C@@H](C)C(F)(F)F)ccc1C(=O)NCc1cccc(Br)c1O 1297440797 QNDGNOJWKUZUQX-JTQLQIEISA-N 433.224 4.118 10 10 IICE COC(=O)C[C@@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CC1 1300812891 ZRUSBHHACFXUDR-INIZCTEOSA-N 433.346 4.176 10 10 IICE C[C@@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N1CCOc2cc(N(C)C)ccc21 1307647302 BBJZEHBEPVXRTI-SFHVURJKSA-N 429.520 4.210 10 10 IICE COC[C@@]1(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CCCCN1C(=O)OC(C)(C)C 1352744685 QGZVFCBUCHJJLM-RUZDIDTESA-N 445.604 4.050 10 10 IICE CCOC(=O)c1sc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)nc1C 1353008328 OIUVJZFNLNYWMY-UHFFFAOYSA-N 427.526 4.109 10 10 IICE C[C@@]1(c2cccc(Br)c2)C[C@H]1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1357836532 XDAXIMZSNUJVBW-AVRDEDQJSA-N 447.348 4.019 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C(C)C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1359798808 QHJKMYNNPLYKCK-HSZRJFAPSA-N 439.648 4.216 10 10 IICE CCOc1ccc(C[C@@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 1435572663 LHDRDGWWXYJYNM-OAQYLSRUSA-N 435.612 4.112 10 10 IICE Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)Cc2ccc(O)c(O)c2)cc1 1441545401 ATVLPSRNLATFKI-UHFFFAOYSA-N 448.519 4.063 10 10 IICE Cc1cc(C(=O)N2CCC[C@@](CO)(C(C)C)C2)c(C)n1-c1ccc(Br)cn1 1450193449 OYCHUIUDFYACMD-OAQYLSRUSA-N 434.378 4.122 10 10 IICE O=C(c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)N1Cc2cccc(O)c2C1 1455037332 PNOZJJPFUCMKQL-UHFFFAOYSA-N 428.897 4.002 10 10 IICE COc1ccc(NC(=O)c2cc(O)cs2)cc1S(=O)(=O)Nc1ccc(Cl)cc1 1463698935 JMSASGLAWUNZOL-UHFFFAOYSA-N 438.914 4.169 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(Cn2cc(Br)cn2)s1 1465958606 QGUHYVSRWUILLI-UHFFFAOYSA-N 446.370 4.270 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C1 1470465479 GSNGGOVTFMRQNA-YZGWKJHDSA-N 431.577 4.349 10 10 IICE C[C@H](NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1)c1ccccc1O 1471195438 IMOIPBBCWIOFOS-KRWDZBQOSA-N 436.533 4.025 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NC(=O)NCc1cccc(Cl)c1O 1471455357 FUEYCTOWXJYYSY-QZTJIDSGSA-N 431.920 4.036 10 10 IICE C[C@@H](NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)c1ccc(N(C)C)cc1 1478471349 UXJCFVGRCPQVQL-GOSISDBHSA-N 430.556 4.255 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CC[C@H]3CCOC3)CC2)cc1 1504292899 VEFXYSWYDMZTEP-FQEVSTJZSA-N 441.620 4.019 10 10 IICE Cc1cccc(COc2cccc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2)c1 1516820066 VUVIWINHKFUGHL-UHFFFAOYSA-N 434.511 4.480 10 10 IICE CO[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC[C@@H]1C 1518623041 UKBNKOVUJUVSKE-YESZJQIVSA-N 437.635 4.020 10 10 IICE CC[C@H](Oc1ccccc1C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245944 OWDMORDYIXSDTN-FQEVSTJZSA-N 436.474 4.324 10 10 IICE COC(=O)c1ccoc1COc1cccc2c1N(C(=O)/C=C/c1scnc1C)CCC2 1528101144 BMNXGBCMUSPREW-CMDGGOBGSA-N 438.505 4.403 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCc2ccc(-c3nncnn3)cc2)cc1 1530543120 FGXJBXSXMKNUSL-UHFFFAOYSA-N 438.495 4.345 10 10 IICE CC(=O)c1ccc(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(F)c1 1537173985 MTNZHMHTJSRXQO-ZDLGFXPLSA-N 447.484 4.364 10 10 IICE COc1cccc(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1OC 1537657033 LGEZTTGPQFWOAW-FOWTUZBSSA-N 448.591 4.385 10 10 IICE CC(=O)CC(C)(C)CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1538920956 YFGKLGHKLVWOQZ-UHFFFAOYSA-N 429.318 4.493 10 10 IICE Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1538975322 CBVPYYMJONHOFP-OALUTQOASA-N 443.613 4.115 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3CCN(C(C)C)C[C@H]3c3cnn(C)c3)c2C)c1 1544079323 FIYAOORLHPVTGC-FTJBHMTQSA-N 447.627 4.266 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cc(C)on1 1555491179 XCBUIDZLYUUETH-UHFFFAOYSA-N 434.544 4.322 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(S(=O)(=O)N(C)C)c(C)c2)c1C 1558559754 BNQAJHGSCFXWCP-UHFFFAOYSA-N 425.554 4.214 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1566298847 SXSJHPAJGIAOLG-IBGZPJMESA-N 426.900 4.455 10 10 IICE CC[C@@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)[C@H](O)c1c(F)cccc1F 1566341270 CWVUJAPNPFWVAI-GGAORHGYSA-N 426.463 4.427 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2cscn2)cc1 1615381020 OQZIRDSXZATAAZ-IBGZPJMESA-N 440.617 4.160 10 10 IICE CC(=O)c1cc(Cl)cc(CN(CCO)Cc2cc(Br)ccc2F)c1O 1615423642 WWYVJSQZLJNRRZ-UHFFFAOYSA-N 430.701 4.144 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](/C=C\C(=O)N(CCN2CCCC2)c2ccccc2)C1 1618187624 OYGHALNYVYQAQE-HJBMFWNLSA-N 427.589 4.319 10 10 IICE COc1ccc(C(=O)CCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1622635306 XCBBUTWMKBVENP-FQEVSTJZSA-N 444.959 4.188 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3csc(Nc4cc(F)cc(F)c4)n3)C2)cc1 1627154377 OIZKHWIBIXFWPS-AWEZNQCLSA-N 444.507 4.430 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1F 1633259542 RGGIJQBBDUCFDA-UHFFFAOYSA-N 441.547 4.337 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C/c2ccc(O)c(O)c2)C1 1638739928 VOUJULSIEPFJFE-GMIBQGTOSA-N 430.545 4.139 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cnn(Cc4ccccc4)c3N)cc2Cl)C1 1639533187 DQDWNIASDZTIBB-QGZVFWFLSA-N 437.975 4.333 10 10 IICE COC1CCN(c2ccc(CN3C[C@@H]4CCC[C@H](C3)N4C(=O)OC(C)(C)C)cc2)CC1 1642769811 FCDIMJBYSOVOKM-SZPZYZBQSA-N 429.605 4.276 10 10 IICE Cc1cccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)NCc3c(O)cccc3F)c2)c1 1645046294 UHAMGZQZNRQDNY-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1671424417 BUMRXAQEMSNVHT-ILBGXUMGSA-N 448.611 4.147 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1Cc1ccnc(OC(F)F)c1 1696701264 ZHPZRLKQQPHPBM-UHFFFAOYSA-N 429.471 4.322 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC(C)(F)F 1743751931 OTNLDBXNAOEJGT-HNNXBMFYSA-N 425.499 4.311 10 10 IICE CCO[C@@]1(c2nnc(N3CCCC3(C)C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1746718856 JSITXTJKJSGLRT-VWLOTQADSA-N 441.620 4.204 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CCS1 1765317719 HLCHPVQQJCRRHC-LSDHHAIUSA-N 425.649 4.100 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCCC4)nc(-c4ccccc4)n3)CC2)cc1 1867968058 JUEZFFXMFNFDJZ-UHFFFAOYSA-N 429.568 4.469 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1cc(O)ccc1O 1952824079 ROIUWVQTTVQKPC-GBXCKJPGSA-N 445.471 4.495 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@H](NC(=O)OC(C)(C)C)CC2)c1O 2227748321 MWKPIAIIQMSNPL-JOCQHMNTSA-N 429.355 4.089 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CCC(C)(C)N(C(=O)OC(C)(C)C)C2)c1O 2236055054 NTCLJYUTNFWWTR-CYBMUJFWSA-N 443.382 4.431 10 10 IICE Cc1cc(N2CCCC2)ccc1C=C1C(=O)NC(=S)N(c2cccc(Cl)c2)C1=O 2294208479 GVESNCJOGOHISN-UHFFFAOYSA-N 425.941 4.080 10 10 IICE Cc1ccc(-c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)o2)c(Br)c1 2296425997 LSWBAHHPSLYGGY-UHFFFAOYSA-N 438.324 4.303 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CC[C@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2380760979 BYGBITGEVJTZOK-DZGCQCFKSA-N 441.366 4.210 10 10 IICE O=C(CN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S)Nc1ccccc1 34808350 SBNABCSNAPGHAH-XNTDXEJSSA-N 433.352 4.289 10 10 IICE C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726567303 GWOTXCRUVGURKX-BTYIYWSLSA-N 443.494 4.281 10 10 IICE Cc1c(Cl)cccc1S(=O)(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726600262 DZGZYYNNDQGYNQ-UHFFFAOYSA-N 430.904 4.197 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1cccn(C)c1=O 729522871 WGFJQCGTEKFQMS-LJQANCHMSA-N 429.442 4.311 10 10 IICE COc1ccc(Nc2nc(C(=O)N3CCN(c4ccc(OC)c(F)c4)CC3)cs2)cc1 753731284 LKFFOCIVSHOILB-UHFFFAOYSA-N 442.516 4.005 10 10 IICE C[C@H](N[C@@H](C)c1cc(Br)c(F)cc1O)c1cccc(NS(C)(=O)=O)c1 756494461 MCTJVXPEBGEFJP-QWRGUYRKSA-N 431.327 4.077 10 10 IICE C[C@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cc(Br)ccc1O 757638913 SVMBZVQLSPXKEH-LRDDRELGSA-N 431.309 4.218 10 10 IICE O=C(Nc1ncn(C2CCCCC2)n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 758161239 BIMDTZJNUWZZCV-OAHLLOKOSA-N 434.491 4.175 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC(CC(F)(F)F)C1 760070557 GFIRTQBGASQZJK-QPEQYQDCSA-N 434.530 4.140 10 10 IICE C[C@H](NC(=O)c1ncc(Br)cc1Br)c1ccc(N(C)C)cc1 773987739 HALQEWKQCNHLLU-JTQLQIEISA-N 427.140 4.164 10 10 IICE Cc1cc(Br)cc([C@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)c1O 779019639 XZUXTMANCBGHBB-STQMWFEESA-N 427.364 4.246 10 10 IICE Cc1cc(C)cc(-n2ncc(CNCc3ccc(N4CCOCC4)cc3C(F)(F)F)n2)c1 781412126 IBDQJYLGWNIJRP-UHFFFAOYSA-N 445.489 4.029 10 10 IICE CCN1CC[C@@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1cc(F)c(F)c(F)c1 782498815 FQPLHHJDKNCXGD-GGAORHGYSA-N 446.517 4.339 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@@H]1C[C@H]1c1ccc2ccccc2c1 798085847 CUOAYLMZJUGCCG-IZZNHLLZSA-N 429.564 4.404 10 10 IICE CCN(CC)c1nc2sc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)cc2s1 1127275365 KAFKFZLKTRCYRQ-UHFFFAOYSA-N 430.599 4.175 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)cc1 1130744710 FXWAFNXMWUXFNE-UHFFFAOYSA-N 433.339 4.396 10 10 IICE Cc1nc(Cc2nnc(N3C[C@H](C)C[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290403748 ATDFIHRUNOWKQD-HZPDHXFCSA-N 442.608 4.370 10 10 IICE COc1ccc(OC)c(CN2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)c1 1290646777 NHHDFFQHDKZCCC-UHFFFAOYSA-N 439.581 4.131 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)[C@@H](C)c2ccco2)cc1 1295413625 BUYOOXDWUJISGX-SFHVURJKSA-N 431.544 4.420 10 10 IICE COc1ccc([C@]2(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)C[C@H](O)C2)cc1 1297010357 NRHCFNWRBVFZLA-SZUKKWSHSA-N 442.987 4.294 10 10 IICE Cc1ccc(C(=O)N2CCN(c3cccc(F)c3F)CC2)cc1-n1c(C)cc(C=O)c1C 1297334772 LNMJFUSJUOKXBR-UHFFFAOYSA-N 437.490 4.456 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ccc(C)nc1 1305382637 NFAHQHHJIDWCEX-LJQANCHMSA-N 434.588 4.016 10 10 IICE Cc1nc2c(F)cccc2cc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1354659296 VARSTRQPXJAJRE-HUUCEWRRSA-N 425.479 4.365 10 10 IICE Cc1cc(CC(=O)Nc2cc(N(C)C)c(Br)cn2)c(C)n1-c1ccccc1 1436270414 AWNHBQOVDYJLCM-UHFFFAOYSA-N 427.346 4.499 10 10 IICE Cc1cc(C(=O)NCC2(c3ccccn3)CCC2)c(C)n1-c1ccc(Br)cn1 1449213528 JAFLAHLDZONANB-UHFFFAOYSA-N 439.357 4.498 10 10 IICE Cc1cc(C(=O)NCc2ccncc2OCCCN(C)C)c(C)n1-c1cccc(Cl)c1 1450613719 VSDBNWNCWZBAFB-UHFFFAOYSA-N 440.975 4.403 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2CCOc1ccc([N+](=O)[O-])cc1 1459467071 RQDHIEMYPUNPBQ-UHFFFAOYSA-N 427.501 4.451 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H](C)[C@H]3CNC(=O)OC(C)(C)C)cc2)CC1 1459604866 BLSPCOJUGASNAU-AUSIDOKSSA-N 431.621 4.427 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(Br)cc3OC(C)C)C2)cc1 1461497543 SUVSZUUETWVBRF-MRXNPFEDSA-N 433.346 4.254 10 10 IICE COC(=O)C[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(OC)cc1 1464005654 SZRHUQYEOKXVMS-QHCPKHFHSA-N 448.519 4.258 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H](CNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1471091234 LLWOZUYKVGFRPI-MAEOIBBWSA-N 429.517 4.000 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1CCC1CC(OC(C)(C)C)C1 1503487878 OVTXDPWMKNEZGD-SYYJFZTOSA-N 428.577 4.108 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@](C)(OC)C1 1519072404 WGAUZERSORXIJW-RUZDIDTESA-N 437.588 4.394 10 10 IICE COc1ccc(C[C@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 1523860511 GKDCFLCTGXJQAA-IBGZPJMESA-N 449.595 4.172 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)[C@@H]4CCCCS4(=O)=O)n3)c2C)cc1 1523937283 QQNXKNGJYKUZLK-FQEVSTJZSA-N 443.594 4.432 10 10 IICE C[C@@H](SCc1nc(O)c2ccccc2n1)C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1531692829 DXOJOUCHCJJFLQ-QGZVFWFLSA-N 436.581 4.216 10 10 IICE CCn1ncc(Br)c1C(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1533209169 BBSBHGBEDVHCLM-UHFFFAOYSA-N 431.334 4.167 10 10 IICE CC(C)(C)OC(=O)NCC[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2cncc(F)c2)C1 1536029519 UTQVQFPZWTZRMQ-GFOMBABLSA-N 425.504 4.354 10 10 IICE C[C@@H](NC(=O)c1cnn(Cc2ccccc2)c1Br)c1ccc(N(C)C)cc1 1537680245 RMNBIRAOBIFUHD-OAHLLOKOSA-N 427.346 4.251 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](C)N3CCN(c4ccccc4)CC3)c2C)cc1 1540831170 DIUDVCUIBFMYAV-NRFANRHFSA-N 446.595 4.043 10 10 IICE O=C(NCCCSc1nccs1)c1ccc(I)c(Cl)c1 1542956102 KEBBXRGCAIPCIG-UHFFFAOYSA-N 438.743 4.313 10 10 IICE Cc1ccc(C(=O)c2ccccc2C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cc1C 1543233420 LKWAOVNHOZZWOR-UHFFFAOYSA-N 446.522 4.440 10 10 IICE COC(=O)[C@@H](C)Oc1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1F 1557528177 NKBPLFZFXYMGPU-MRXNPFEDSA-N 438.455 4.238 10 10 IICE Cc1cc(C(=O)N2Cc3c[nH]nc3CC(C)(C)C2)c(C)n1-c1ccc(Br)cn1 1586009591 FYUJYXMUHFQXND-UHFFFAOYSA-N 442.361 4.199 10 10 IICE COC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)C1CCCCC1 1587974064 GMQKOIXLHHUWPV-IBGZPJMESA-N 448.361 4.103 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC34CN(C(=O)OC(C)(C)C)C4)cc2Cl)C1 1617901013 OYWNPRAFFRYEDF-FUHWJXTLSA-N 448.007 4.450 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)c(C)n1-c1ccc(F)cc1 1626059803 GWMSUKSURUZTGL-DEOSSOPVSA-N 439.506 4.176 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Br)ccc1F 1631425903 RQDBXZHKQACIBB-HNNXBMFYSA-N 441.728 4.342 10 10 IICE Cc1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(O[C@H]2CCOC2)c1 1631630030 HJPIPTPZAAEYNN-VWLOTQADSA-N 446.547 4.242 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC=C(c3cn(C(C)C)nn3)CC2)c1 1636376094 UHRNUJFANGXIQP-UHFFFAOYSA-N 431.540 4.399 10 10 IICE COc1c(Br)cccc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 1637939802 SXYOZLIWVZFVDK-UHFFFAOYSA-N 432.362 4.240 10 10 IICE COc1ccc(N2CCN([C@H](C)c3nc(Cc4ccc(Cl)cc4)no3)CC2)c(OC)c1 1644225811 ZJBXRYQFQLHZKK-MRXNPFEDSA-N 442.947 4.214 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SC[C@@H](C)S(C)(=O)=O 1651677134 NTPPBVPFBPMMKB-CYBMUJFWSA-N 431.421 4.494 10 10 IICE COC(=O)c1cc(OCC(=O)N2CCCCC[C@@H]2c2ccc(OC)cc2)ccc1N(C)C 1656826184 QXSDPIPSBRSMPC-JOCHJYFZSA-N 440.540 4.071 10 10 IICE CC(C)N(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccc(F)cc1 1657084532 OPCIBNPTZAACSV-UHFFFAOYSA-N 430.479 4.450 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(C(F)(F)F)(C(F)(F)F)C3)C2)cc1 1683336761 JULGXMFIYRZSPX-CYBMUJFWSA-N 439.400 4.048 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@H](c4cncn4C(C)(C)C)C3)C2)cc1 1683339760 FTMKSMWOQUXKPI-UXHICEINSA-N 439.604 4.062 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCCC2)nnc1N1CCO[C@H](C(F)(F)F)C1 1693006278 TXNIMNLWFGJWFU-IBGZPJMESA-N 437.510 4.126 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(C(=O)NCC)CC1 1709620376 RSMSTQSGEJJBFP-UHFFFAOYSA-N 449.603 4.004 10 10 IICE CC[C@@H](C)[C@H](Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O)OC 1743537824 ISGCHQGJBFDCQF-QRWLVFNGSA-N 429.590 4.037 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1747509337 TUKVPWVMXTXFAY-OXQOHEQNSA-N 435.613 4.351 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@@H]2CCOC2)n1CCCC(C)(C)C 1747720000 JAGXMAZPUOWMTD-OAQYLSRUSA-N 441.620 4.081 10 10 IICE CC(C)CSCCn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750871857 GPYBJDRYJZWNQP-OAQYLSRUSA-N 443.661 4.408 10 10 IICE COCC1(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)CCCCC1 1770839185 VGCKQASVCDMUIS-UHFFFAOYSA-N 435.572 4.203 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)sc2c1CC[C@@H](C(C)(C)C)C2 1865922660 LGPIJZLURBEONH-UONOGXRCSA-N 434.602 4.271 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3CCCN3Cc3ccccc3F)cccc21 1868173983 KHWWHYUXWXNJOR-JOCHJYFZSA-N 428.463 4.204 10 10 IICE Oc1cc(Br)ccc1CN[C@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1878724095 XVONLBODLYHWEK-SJORKVTESA-N 429.280 4.307 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(Br)cc2O)C[C@@H]1C1CC1 1895872820 BLQJFVBUWSVDHE-DLBZAZTESA-N 425.367 4.422 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(C)C)c(C(=O)O)c2I)c(O)c1 2079138069 SXXWKVMDTCPLQN-INIZCTEOSA-N 440.281 4.323 10 10 IICE COc1ccc([C@@H](n2nc(C(F)F)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2079857076 YGLMLEJOTZOGJG-CYBMUJFWSA-N 432.265 4.032 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)C1=Cc1ccc(N2CCCC2)cc1 2294095538 WEEILMIMMZVFCA-UHFFFAOYSA-N 430.291 4.260 10 10 IICE CCOC(=O)c1ccc(NC(=O)CN2C(=O)C(=Cc3ccc(C)cc3)SC2=S)cc1 2297283891 ZLIYVWRDARUKMR-UHFFFAOYSA-N 440.546 4.012 10 10 IICE O=C1NC(=S)N(c2ccc(Cl)c(Cl)c2)C(=O)C1=Cc1ccc(N2CCCC2)o1 2313560100 JGJATLHTNYIXMW-UHFFFAOYSA-N 436.320 4.018 10 10 IICE CCOc1cc(C=C2SC(=S)N(CC(=O)O)C2=O)ccc1OCc1cccc(C)c1 2313653031 GUYZQJOJNIRUJG-UHFFFAOYSA-N 443.546 4.259 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N([C@H](CC(C)C)C(=O)O)C3=O)n12 2323812779 HTSTXLPCQHOXMB-SNVBAGLBSA-N 429.976 4.058 10 10 IICE COc1cc(C=CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(OC)c1OC 2326988529 SJTKHYYZWMAAGT-UHFFFAOYSA-N 443.455 4.140 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2cccc(OC)c2O)cc1 2332099638 PEBTXKFVQPDSGS-UHFFFAOYSA-N 430.460 4.253 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C[C@H]2CCCO2)c2ccncc2)C1 435877457 RAICOIDUMJLNDZ-OAQYLSRUSA-N 432.568 4.015 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H]2CCN(c3ccccc3F)C2)C1 462373841 YGOMZWNSNSPVKM-HXUWFJFHSA-N 448.586 4.190 10 10 IICE O=C(NCc1ccc2ccccc2n1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 734276216 JQIGHFFJLLKUDD-UHFFFAOYSA-N 426.467 4.304 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)cc1F 747583911 IEDATTLNXXDMCK-IBGZPJMESA-N 425.426 4.194 10 10 IICE Cc1ccc(C(=O)CCCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 766136858 NXVMPXQZCBMKBF-KDURUIRLSA-N 426.532 4.417 10 10 IICE C/C(=C\C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 783912169 JASANXVJRKJXHJ-NTCAYCPXSA-N 449.429 4.170 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](c3cnn(C)c3)C(F)(F)F)cc2Cl)C1 800565219 IMYMCOPJOHLGNE-FZKQIMNGSA-N 443.901 4.413 10 10 IICE CC(C)Cn1c(CCOc2ccccc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 802677561 XJDVCPPKTYNJOT-UHFFFAOYSA-N 449.599 4.029 10 10 IICE CCCNC(=O)c1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1Cl 806227872 RRKROWHAYSSCCX-UHFFFAOYSA-N 440.725 4.270 10 10 IICE Cn1ccc([C@@H](NC(=O)NCc2cc(Br)ccc2O)c2ccc(Cl)cc2)n1 807111895 LVPLRDNYVJEKHL-SFHVURJKSA-N 449.736 4.130 10 10 IICE O=C(Nc1ccc(C2CCC2)cn1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 819030353 FKZPTJGIMAZOKA-UHFFFAOYSA-N 429.523 4.169 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1C(=O)Nc2c(Br)cccc21 1124872006 DPOMTEXFWINKDU-GOSISDBHSA-N 444.373 4.378 10 10 IICE COCCOc1cn(-c2ccccc2)nc1C(=O)NCc1cc(C)n(-c2ccccc2)c1C 1132264468 SKWDTRQERVPZSQ-UHFFFAOYSA-N 444.535 4.235 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2[C@H]3C[C@H]3CN2C(=O)OC(C)(C)C)cc1)C1CCCCC1 1136446481 KENYQOKEDBUDHN-YUXAGFNASA-N 427.589 4.327 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)cc1 1137533097 YSCAGFVTKNXKAM-KRWDZBQOSA-N 428.492 4.377 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2ccc(F)cc2)c(C)n1-c1ccccc1Br 1141368075 BREQTPSKTXRACY-IBGZPJMESA-N 431.305 4.459 10 10 IICE Cc1cc(C(=O)Nc2nc(CN(C)C)cs2)c(C)n1-c1ccc(Br)cn1 1161059257 MCZVSVDKIGLTKO-UHFFFAOYSA-N 434.363 4.022 10 10 IICE CCCCN(Cc1cc(C)n(-c2ccc(OC)cc2)c1C)c1nccc(S(C)(=O)=O)n1 1162725601 PSCNTDYNRMGMPJ-UHFFFAOYSA-N 442.585 4.103 10 10 IICE Cc1cc(CNC(=O)N[C@@H](C)c2ccc(N3CCNC3=O)cc2)c(C)n1-c1ccccc1 1252157835 QCKDWKZIUHEXRK-SFHVURJKSA-N 431.540 4.184 10 10 IICE CCCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1253807773 IFMWZFVNPRFLCF-AUSIDOKSSA-N 438.616 4.363 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(C)c(Br)c3C)cc2F)CC1 1265012000 KDDPBJIEVIKYCE-UHFFFAOYSA-N 448.380 4.277 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@](C)(O)CSc1cccc(F)c1 1294684069 DNTQZNGKBHGZCF-IBGZPJMESA-N 442.350 4.186 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1ccnc(Cl)c1 1299330314 CUSJYFLAYPKPTB-UVTDQMKNSA-N 437.999 4.094 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@](C)(O)CC)CCO1 1306396654 JFXSOYKLOJCLPL-OFVILXPXSA-N 437.588 4.129 10 10 IICE Cc1cc(CCNC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)c(C)n1-c1ccccc1 1438177891 LOALWVCSFKUMOU-JOCHJYFZSA-N 438.616 4.221 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)cc1 1445158559 KFVNNJUCYWDCIU-UHFFFAOYSA-N 429.564 4.305 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C3)c2C)cc1 1447015298 XWWNPRQMNXZRKM-HKUYNNGSSA-N 441.572 4.478 10 10 IICE CCc1c(C(=O)NCc2cccc(Br)c2O)cnn1-c1ccc(Cl)cc1 1448961046 HFFXTXLNQXOMTA-UHFFFAOYSA-N 434.721 4.486 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1ccc(OCc2ccccc2)cc1 1451926182 ZISRBKAXGRICAX-UHFFFAOYSA-N 433.504 4.106 10 10 IICE Cc1cc(CC(=O)NOC[C@@H](C)NC(=O)OC(C)(C)C)c(C)n1-c1ccc(Cl)cc1 1466137693 MRLAFKCZYZAGFF-CQSZACIVSA-N 435.952 4.251 10 10 IICE O=C(NCc1ccc(O)cc1O)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1 1469158545 AVQVCRIYTCQNMX-UHFFFAOYSA-N 433.504 4.041 10 10 IICE COc1ccccc1[C@](N)(C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(F)(F)F 1472608779 JRWWACRVAGULHI-QHCPKHFHSA-N 445.485 4.444 10 10 IICE COC(=O)/C=C/c1ccc(N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c([N+](=O)[O-])c1 1472687107 SDZQKGFNFUQJMF-QKYXPGDISA-N 445.903 4.217 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](N3CCCC3=O)C2)n1CCCSc1nccs1 1512965842 IQMKAKKSVWAVLN-DLBZAZTESA-N 448.662 4.022 10 10 IICE COc1c(Br)ccc(C)c1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1526968287 QGDCPANCAPESBA-HNNXBMFYSA-N 433.346 4.094 10 10 IICE CC(C)Cn1ccc2c(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cccc21 1527864277 MEOWXDRMEPGINW-UHFFFAOYSA-N 427.495 4.342 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@]3(C)CCNC(=O)C3)n2)c(C)n1-c1ccc(F)cc1 1532706638 LEAFMXVZVYNUFK-JOCHJYFZSA-N 426.517 4.212 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cc(C(C)C)ccc3C)CC2)c(OC)c1 1534586285 BGAUZUCESUDIMV-IBGZPJMESA-N 426.557 4.252 10 10 IICE CC(C)c1ccc(C2(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CCC2)cc1 1535156792 OXLGHPVSJXESDI-UHFFFAOYSA-N 433.596 4.250 10 10 IICE COc1ccccc1CCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1544268655 MNLYKKBVCBRXBW-OAQYLSRUSA-N 441.572 4.076 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H](O)C2CCCCCCC2)NC(=O)OC(C)(C)C)cc1 1544269064 PCPPYNKNJFUALL-YADHBBJMSA-N 447.620 4.156 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@@H](NC(=O)c4ccccc4)C3)c2C)cc1 1544510374 WJNRMFGXKWXQSL-OAQYLSRUSA-N 431.536 4.137 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(C)n(-c2ccc(F)cc2)n1 1545509028 XBZOLBDEZJWINO-UHFFFAOYSA-N 432.293 4.450 10 10 IICE Cc1nc2c(F)cccc2cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632493 NGIAZQXOPSEYTN-SFHVURJKSA-N 427.907 4.436 10 10 IICE Cc1nc(CC(F)(F)F)sc1CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1546034499 XWSHCECSHUISJA-HNNXBMFYSA-N 428.476 4.012 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cnc(-c2c(F)cccc2F)s1 1556481306 QFAYPOHYBXLCRM-UHFFFAOYSA-N 425.254 4.486 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)/C=C\[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1557063794 ZOOQJGFZENGGKL-WOQOMJGYSA-N 429.605 4.312 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCCC[C@@]3(C)NC(=O)OC(C)(C)C)C2)cc1 1557133380 JXBYQCKOKQVRRM-DHTSOJEISA-N 445.604 4.111 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@]3(O)CCc4ccccc43)cc2Cl)C1 1564650257 UUMRDNMIDZXSGN-XDHUDOTRSA-N 427.976 4.210 10 10 IICE CN(Cc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1565363046 GSOVOQMVMBHTID-UHFFFAOYSA-N 436.600 4.027 10 10 IICE CCc1nc(OC)ccc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1585711801 HPXLUNKXNIDUPM-FOWTUZBSSA-N 447.607 4.334 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)c(C)n1-c1ccc(Cl)cc1 1617151196 FWWVYYYUXLVYRY-UHFFFAOYSA-N 439.918 4.485 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSc1nc2ccccc2[nH]1 1618427643 YLGXEQOFRVZDJN-UHFFFAOYSA-N 440.569 4.044 10 10 IICE COCC1(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)CCOCC1 1619643162 LXCGUZJBYCINKA-UHFFFAOYSA-N 441.620 4.081 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(O[C@@H](C)C(F)(F)F)nc3C)CC2)cc1 1623429673 LORVDHAJCJDSJY-INIZCTEOSA-N 437.462 4.081 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O 1627806441 ATEJRIUVNHQFKS-DEOSSOPVSA-N 429.520 4.174 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@@H](CO)C2CC2)c(C)n1-c1cccc(Br)c1 1628157145 STZDBQNVBUXYGH-SFTDATJTSA-N 431.374 4.384 10 10 IICE CC1CCN(c2ccc(CNC(=O)C3=CCCN(C(=O)OC(C)(C)C)CC3)cc2)CC1 1628608843 NJUXZICCLYDGPF-UHFFFAOYSA-N 427.589 4.496 10 10 IICE CC[C@@H](C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1)c1ccc(Br)cc1 1630202214 PINZUJIOAFMDSG-GOSISDBHSA-N 435.337 4.439 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1ccc(Cl)c(Cl)c1 1630280634 OTJJDQXOZMPNSV-FZKQIMNGSA-N 445.293 4.413 10 10 IICE O=C(NCCCSc1nccs1)c1cc(Br)cnc1OCC1CC1 1632806766 BHNDVFGAEWQQHR-UHFFFAOYSA-N 428.377 4.002 10 10 IICE Cc1cc(CCNC(=O)[C@@H](CC2CC2)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1634866918 QRXKQQLYTKRULH-JOCHJYFZSA-N 425.573 4.446 10 10 IICE CCCOc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1635941331 QJYLPXALEDTISN-SFHVURJKSA-N 432.948 4.237 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)c1 1638767973 RDXFCMSRGBFFAA-BTZRARBUSA-N 445.563 4.429 10 10 IICE COC1CCN(c2ccc(CN(C)C[C@H](O)c3ccccc3Br)cc2)CC1 1643431861 YBKKFYWIXMZECT-QFIPXVFZSA-N 433.390 4.230 10 10 IICE Cc1ccc(C(=O)N2CCN(C)C[C@@H]2Cc2ccccc2)cc1-n1c(C)cc(C=O)c1C 1644443480 SGGBPQYLWXKHCP-VWLOTQADSA-N 429.564 4.214 10 10 IICE Cc1ccc(N(Cc2cnn(C)c2)C(=O)c2ccnc3c2CCN3C(=O)OC(C)(C)C)cc1 1645166996 LLRIUTYWRRECHQ-UHFFFAOYSA-N 447.539 4.268 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(c4ccncn4)CC3)cc2Cl)C1 1680563305 SXXGJCCMJLSHJA-QGZVFWFLSA-N 427.980 4.456 10 10 IICE COc1ccc(N2CCN(C(=O)NC[C@@H](C)Oc3ccc(C(C)C)cc3)CC2)c(OC)c1 1680995160 GDEKCGOBEQIIGB-LJQANCHMSA-N 441.572 4.126 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCCN(Cc4cc(C)on4)CC3)c2C)c1 1683304301 VWLUQQBHYYVQFT-UHFFFAOYSA-N 435.572 4.116 10 10 IICE COc1ccc(N2C[C@H](NC(=O)N(Cc3ccccc3O)C3CCCCC3)CC2=O)cc1 1687009917 IRKUZHKTUDLGOY-LJQANCHMSA-N 437.540 4.051 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694096437 SSANMZOKZRWGIP-RXVVDRJESA-N 429.584 4.440 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@@H]3C)n2CCCOC(C)C)c(C)n1-c1ccccc1 1707273738 CDWSRYGQZVUZOC-FQEVSTJZSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC[C@@H](c3ccnn3C)C2)cc1 1710023978 JKPVAFPRXAXPKY-OAQYLSRUSA-N 435.620 4.414 10 10 IICE COCC1(CCn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)CCC1 1712195304 ZWGFAVIJQBAYHZ-UHFFFAOYSA-N 441.601 4.183 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccccn3)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1724198158 LRVFRRYZPDGPIM-HXUWFJFHSA-N 443.599 4.334 10 10 IICE CC(C)Cc1nnc(N2CCCCCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1750745241 RGRJFECIBYGJEL-UHFFFAOYSA-N 429.584 4.271 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(CC)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1764273607 SXOKGMHXNBGSOL-HSZRJFAPSA-N 438.664 4.293 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N2CCN(C(C)C)CC2)cc1 1764935829 BDWAHTFCGXOHEW-UHFFFAOYSA-N 438.664 4.436 10 10 IICE CCN(c1nnc(-c2cc(Br)c[nH]2)n1Cc1ccc(N(C)C)c(F)c1)C1CC1 1772879600 NGAXVXOXXQZTAO-UHFFFAOYSA-N 447.356 4.278 10 10 IICE Cc1cc(C)n(-c2ccccc2)c(=O)c1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1868183933 SMDSASIOFNYTQN-UHFFFAOYSA-N 448.478 4.482 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCC(C)C)C(=O)N(Cc3cccnc3)C2=O)cc1 1873167255 YHVMMPCFCUZGMY-UHFFFAOYSA-N 428.536 4.015 10 10 IICE Cc1cc(C)cc(N2C[C@H](C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)CC2=O)c1 1874179277 WAYNJVIFHVCWKG-QGZVFWFLSA-N 438.483 4.070 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C(F)(F)F)c(N)c2I)c(O)c1 2079046678 CVAAQHWYDOWFNZ-GFCCVEGCSA-N 439.219 4.348 10 10 IICE CCc1nn([C@@H](c2ccc(C)cc2O)C(C)C)c(I)c1C(=O)OC 2079123913 CBCDXBNFJPUANQ-MRXNPFEDSA-N 442.297 4.096 10 10 IICE O=C1NN(c2cc(Cl)cc(Cl)c2)C(=O)C1=Cc1cccn1-c1ccc([N+](=O)[O-])cc1 2297312753 FSQPFOVICRATBY-UHFFFAOYSA-N 443.246 4.154 10 10 IICE O=C1C(=Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C(c2ccccc2)=NN1c1ccccc1 2332141137 ISHQTRIRLBNEJD-UHFFFAOYSA-N 427.416 4.201 10 10 IICE COc1ccc(C2(N3CCN(c4cccc(C)c4C)CC3)C(=O)c3ccccc3C2=O)cc1 20178133 BTARDGRZSMPISR-UHFFFAOYSA-N 440.543 4.409 10 10 IICE Cc1cc(C(=O)Nc2cccc(N3CCCC3=O)c2)c(C)n1-c1ccc2c(c1)OCCO2 28478788 LTAXPIUBUJNWLA-UHFFFAOYSA-N 431.492 4.244 10 10 IICE CCCOC(=O)CCN1C(=O)/C(=C\c2ccc(OCCC)c(OCC)c2)SC1=S 206848178 CWVTVGWRMVIKTF-NBVRZTHBSA-N 437.583 4.419 10 10 IICE CC(=O)N1CCCN(C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c2ccccc21 683444984 XXEGWCFZOZBHLJ-UHFFFAOYSA-N 444.579 4.198 10 10 IICE Cc1cc(C(=O)[C@H](C)OC(=O)/C=C\c2cnccn2)c(C)n1-c1ccc(OC(F)F)cc1 735936732 TXMZDGLTTUOHJI-SGNXQUTQSA-N 441.434 4.313 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3noc(-c4scnc4C)n3)ccc21 761148195 ZIBFPUZSAVGPEN-UHFFFAOYSA-N 426.498 4.076 10 10 IICE C[C@@H]1[C@@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C[C@@H]1c1ccccc1 783657586 ZYSFGWYDPWDYLG-APTRMMRNSA-N 431.559 4.224 10 10 IICE Cc1ccc(N2CCNC2=O)cc1NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 786265372 OUUIJPPANFTFBP-UHFFFAOYSA-N 431.540 4.296 10 10 IICE CC1(C)Cc2ccc(Cl)c(NC(=O)NCc3ccc(N4CCOCC4)c(F)c3)c2O1 797685009 CFEUVWIIHHUNHK-UHFFFAOYSA-N 433.911 4.351 10 10 IICE CC1(C)Cc2ccc(Cl)c(NC(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)c2O1 797685578 OEKGVFREKZWFJB-UHFFFAOYSA-N 447.938 4.475 10 10 IICE Cc1cc(C(F)(F)F)ncc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 810265737 MHUCTLJTYUENOZ-UHFFFAOYSA-N 447.505 4.263 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccn(-c4cccc(Cl)c4)n3)cc2F)C[C@@H](C)O1 918161651 LOTFBPKIDJDUCU-IYBDPMFKSA-N 442.922 4.208 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@H](C)Cc2ccc(OC)c(OC)c2)CCCC1 1126612063 SYAZRDBETVYREX-QGZVFWFLSA-N 436.552 4.293 10 10 IICE COc1cc(N2CCN(C(=O)C(C)(C)Cc3ccc(Cl)cc3)CC2)cc(OC)c1OC 1127933044 PPAWHLBHRUUNOU-UHFFFAOYSA-N 446.975 4.283 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCCCN2C[C@@H](C)C[C@H](C)C2)CCCC1 1136255173 MJEWNRQFZIEMER-PMACEKPBSA-N 425.617 4.403 10 10 IICE COC(=O)c1cc(Cl)cc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1O 1140308355 MAYJDIOWKCFUCR-UHFFFAOYSA-N 426.856 4.305 10 10 IICE CCOC(=O)c1sc2nc(CN3CCCCC3)nc(NCc3ccccc3O)c2c1C 1162313176 IFXYIAXZANBKMQ-UHFFFAOYSA-N 440.569 4.480 10 10 IICE COC(=O)c1nc(CNC(=O)N(Cc2ccccc2O)C2CCCCC2)ccc1Cl 1230799351 OPMOBNJMJFMAGJ-UHFFFAOYSA-N 431.920 4.272 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)[C@@H]1Oc1ccccc1 1234567689 ZJSLWWBLXKQPJL-VXNXHJTFSA-N 425.573 4.298 10 10 IICE O=C(N[C@H]1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)C1)OCc1ccccc1 1294672389 PYNXCRSXFMMBCU-OYRHEFFESA-N 434.492 4.219 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)[C@@H](CC(C)C)c3ccc(Cl)cc3)cc2)CC1 1296400882 UOQIQAXYVKIUOY-DEOSSOPVSA-N 442.003 4.455 10 10 IICE CC(C)[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1302770076 MZCJNMFZMGPPFR-NRFANRHFSA-N 443.661 4.038 10 10 IICE Cc1ccc(CN(C)c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)s1 1304344842 BDOKRIAOCGCIFO-HNNXBMFYSA-N 435.644 4.427 10 10 IICE CC(=O)N1C[C@H]2[C@@H](NCc3ccc(N4CCCCC4)c(Br)c3)CCC[C@H]2C1 1308424372 SOMAPAIHWXZFDF-ZVDOUQERSA-N 434.422 4.176 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1312405837 XNEDFLWRZCLKAM-HKUYNNGSSA-N 447.023 4.309 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)c1ccco1 1315045098 RXRNOPYDKZISLM-IBGZPJMESA-N 446.555 4.279 10 10 IICE CC[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1nc(C)cs1 1353069890 XPLPLUXWVQTUTO-BMANGOCTSA-N 449.598 4.449 10 10 IICE Cc1cc(CC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)n1-c1ccccc1 1353171920 WLBQESVYHQBEKD-UHFFFAOYSA-N 437.565 4.060 10 10 IICE CC1(C)OC(=O)c2ccccc2[C@H]1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333611 SCPZXOVUOURZET-QRWLVFNGSA-N 444.478 4.106 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1 1453875559 FCNGVNWDSFYCSK-DEOSSOPVSA-N 425.529 4.036 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1456462533 QNFOCODSTUAQQE-WOJBJXKFSA-N 447.963 4.112 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4ccccc4cc3OC(F)F)CC2)c(OC)c1 1461978005 MJQHVUKWFUMIMH-UHFFFAOYSA-N 442.462 4.421 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4ccccc4F)nc3)CC2)cc1F 1465930438 RTBFJHSRKVUUTE-UHFFFAOYSA-N 425.435 4.123 10 10 IICE CCOc1ccccc1[C@@](N)(C(=O)NCc1ccc(N2CCC(C)CC2)cc1)C(F)(F)F 1472508292 OFTZGJKMALGUNF-HSZRJFAPSA-N 449.517 4.354 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)Nc3cc(C)c(Cl)cc3OC)CC2)cc1 1473297187 WPYAAJBUNINFQM-KRWDZBQOSA-N 431.964 4.205 10 10 IICE COc1ccc(N2CCN(C[C@H]3CC[C@H](CNC(=O)OC(C)(C)C)CC3)CC2)c(OC)c1 1473732397 RIVOITIHGVFMEK-MXVIHJGJSA-N 447.620 4.157 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)C[C@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1496759627 CUWZUJZBOUCWIS-QFBILLFUSA-N 444.599 4.075 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CC[C@H](CCOC)C2)cc1 1501840440 GSZGDGKUPLLBEF-FYYLOGMGSA-N 441.620 4.277 10 10 IICE COc1cccc(C(=O)NCCNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)c1 1542585089 DOBHVVBEMUDUSW-UHFFFAOYSA-N 433.552 4.386 10 10 IICE CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]([C@@H]2CCCO2)C1 1545504670 AOHLZJGYWVUVPO-UZKOGDIHSA-N 446.588 4.326 10 10 IICE CN(CCC(F)(F)F)c1nnc(-c2cccn2C)n1CCCSc1nccs1 1554250710 IMJFZUZITCRKSG-UHFFFAOYSA-N 430.525 4.311 10 10 IICE Cc1ccc(C(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1557646568 BKQZZNNPZSEIFW-MRXNPFEDSA-N 427.545 4.200 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCO[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1 1566255187 IRAPBMQTIVPMBD-DENIHFKCSA-N 441.572 4.157 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC4(CC(OC)(OC)C4)[C@@H]3C(C)C)c2C)cc1 1570876482 LVNBUHBWUXQDPS-QFIPXVFZSA-N 426.557 4.352 10 10 IICE COc1cccc(N2CCC(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1584129569 CJIAJFCWJDIVNH-UHFFFAOYSA-N 431.536 4.314 10 10 IICE COC(=O)[C@@H](C)CN(C(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CC1 1584448455 NXFDPUGRJHMUFX-ZDUSSCGKSA-N 433.346 4.270 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccccc3C(=O)N=S(C)(C)=O)ccc21 1588086441 ZVEGCYZQSMDZQV-UHFFFAOYSA-N 441.553 4.025 10 10 IICE Cc1cc(C(=O)NCc2cn(C(C)(C)C)c(=O)nc2O)c(C)n1-c1ccc(C(C)C)cc1 1595197673 YBMCGQZFCHQCDM-UHFFFAOYSA-N 436.556 4.165 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)c(C)n1-c1ccccc1 1595950638 SWVSRVMTPXMCIF-LJQANCHMSA-N 437.490 4.084 10 10 IICE Cc1nc(-c2cccc(Cl)c2)sc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1598268131 RDWIJSJWJJTXAE-UHFFFAOYSA-N 441.000 4.454 10 10 IICE Cc1cc(-c2nnc(N3CCCC3(C)C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1611935800 WHCCFQZMROEEDO-UHFFFAOYSA-N 434.588 4.210 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H](C)C1 1615091418 QXRZSULPFQYVPL-RBUKOAKNSA-N 448.615 4.313 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](C)N2CCc3ccccc3C2)cc1 1626305969 VOOPNXNIAKAWGC-HXUWFJFHSA-N 429.564 4.012 10 10 IICE COc1cc(NC(=O)CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc(OC)c1 1629392507 JVDVTQAKAAYPRC-UHFFFAOYSA-N 441.915 4.133 10 10 IICE CCN(CCC1CCN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1)CC(C)C 1636353728 HZSCAEXVBOLKTQ-HSZRJFAPSA-N 444.664 4.311 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC3(c4cccc(OC(F)(F)F)c4)CC3)C2)cc1 1636854075 RPYAHNQVLNKGIJ-INIZCTEOSA-N 435.446 4.161 10 10 IICE C[C@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cc(Cl)cc2c1OCC2 1638652173 XBEBINGORFKFAK-HNAYVOBHSA-N 430.932 4.432 10 10 IICE COCC(=O)N1CCc2cc(NC(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)ccc21 1639137337 ZUVFYQCTVRBOSC-UHFFFAOYSA-N 431.536 4.499 10 10 IICE CCOC(=O)Cc1cccc(N(C)C(=O)c2cccc3c2CCN3C(=O)OC(C)(C)C)c1 1647921167 IDWHNYOXDXSHCD-UHFFFAOYSA-N 438.524 4.366 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnn(C)c2)nnc1N(C)[C@H](C)c1cccs1 1693006203 ROPYZUVGSZPRCO-QGZVFWFLSA-N 435.601 4.360 10 10 IICE C[C@@H](C#N)CN(C)c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCCSc1nccs1 1706068653 NWVSZXPNFOVQEC-AWEZNQCLSA-N 443.558 4.088 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC(Oc3ncccc3F)CC2)cc1 1728380763 HVINCTZTJGBZFD-UHFFFAOYSA-N 438.551 4.063 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1730479535 JCVHGLRQFCEWOJ-ICSRJNTNSA-N 443.592 4.279 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N2CCCC[C@@H](C)C2)cc1 1746085333 BSHAUSLOMODYSH-HXUWFJFHSA-N 438.620 4.035 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763825697 GJJXKKVQLYMIQL-PGRDOPGGSA-N 445.583 4.169 10 10 IICE COc1cccc(O)c1[C@@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)C[C@@H]1C(=O)O 1952756749 HWUMWSNYKZVHEI-FQRUVTKNSA-N 445.471 4.239 10 10 IICE Cc1ccc([C@H](n2nc(C(F)(F)F)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2079039608 DYQFFTGIQRNDLR-ZDUSSCGKSA-N 434.256 4.413 10 10 IICE Oc1cccc(F)c1Cn1nc(C2CC2)c(C(F)(F)F)c1I 2079836035 TVIISIFURMIDLH-UHFFFAOYSA-N 426.151 4.277 10 10 IICE CCC(CC)(CNCc1c(Br)ccc(OC)c1O)NC(=O)OC(C)(C)C 2227749694 VLIOTMTTYDZZRZ-UHFFFAOYSA-N 431.371 4.336 10 10 IICE COc1ccc(Br)c(CNC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)c1O 2236053919 BTDNCBBXNWLWFL-HOTGVXAUSA-N 433.390 4.410 10 10 IICE COc1cccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c1OC 8608777 GYTQYLJCKXUREF-DEOSSOPVSA-N 445.563 4.304 10 10 IICE COC(=O)c1ccc([C@H]2Oc3c(OC)cccc3[C@@H]3CC(c4ccccc4O)=NN32)cc1 20071059 JLBGWTJPMBEFJB-GBXCKJPGSA-N 430.460 4.430 10 10 IICE CCc1ccccc1NC(=O)CN(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435631846 IENNLGOWDPMNPQ-UHFFFAOYSA-N 446.595 4.067 10 10 IICE CCN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1ccc(OC(C)C)cc1 586257156 VNHHINSBPTZLPD-UHFFFAOYSA-N 449.528 4.464 10 10 IICE COc1ccc(N2CCC(NC(=O)NC[C@@H]3CCCN(C)[C@H]3c3cccs3)CC2)cc1 745795667 IBXUMZBRAUTXNR-FDDCHVKYSA-N 442.629 4.108 10 10 IICE O=C(C[C@H]1C(=O)Nc2ccc(Br)cc21)NCc1cc(Cl)cc(Cl)c1O 1160599281 HSKJCNNLMTZQNU-GFCCVEGCSA-N 444.112 4.204 10 10 IICE CC(C)Cc1ccccc1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1167675318 PUDBWKVRTBJSOR-UHFFFAOYSA-N 444.578 4.383 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nc(Br)ccc2Br)cc1 1264669599 AEEKCHNAYUWFEX-UHFFFAOYSA-N 441.167 4.383 10 10 IICE Cc1cc(C(=O)NC(C)(C)[C@H](O)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1302811223 HJMVPBLXAINFKV-INIZCTEOSA-N 433.268 4.288 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(COC)CCCCC1 1306178491 FOFJDWTUOYXREN-UHFFFAOYSA-N 441.620 4.163 10 10 IICE Cc1cnc2c(c1)N(C(=O)CCCN1C(=O)/C(=C/c3cccs3)SC1=S)CC2 1436453028 FSYQPIZWLBVOTL-BOPFTXTBSA-N 429.592 4.022 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1c1ccc(Cl)c(F)c1 1450723083 UZEBLIBLPKVEPU-YVEFUNNKSA-N 445.705 4.327 10 10 IICE COc1ccccc1Nc1nc(N)nc(CN(C)c2ccc(OCc3ccccc3)cc2)n1 1459957206 HMORWZFASFPGIB-UHFFFAOYSA-N 442.523 4.421 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(=O)c3ccc(Cl)cc3o2)cc1 1464596852 NNZAYFAJQRIPTG-LJQANCHMSA-N 440.927 4.334 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)[C@@H]1CCCOC1 1466780767 RVWWYRUQTOZNFS-NFBKMPQASA-N 426.557 4.306 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)C1CCN(CCC(F)(F)F)CC1 1470555291 CIUGXKNQSOITAE-KRWDZBQOSA-N 428.543 4.050 10 10 IICE CCCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1C[C@@H](OCC)C12CCCC2 1470771084 AFHZARUDPARBPH-WTIAFYNJSA-N 429.605 4.433 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)c1 1472599994 NYVGLJPNCKJYSW-UHFFFAOYSA-N 430.913 4.085 10 10 IICE CCc1nnc(N(Cc2cccs2)C[C@@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1498784272 UDBYTJKJWSMAEX-SFHVURJKSA-N 443.592 4.341 10 10 IICE CCOCc1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1503028169 AONUXPDKUIYBKE-RBUKOAKNSA-N 429.634 4.041 10 10 IICE CC[C@H](C)c1nnc(N2CCC(CCCO)CC2)n1Cc1ccc2c(c1)CCCN2C 1512891449 KKSHZCHDJJZHGV-IBGZPJMESA-N 425.621 4.211 10 10 IICE Cc1ccc([C@H](CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)N2CCOCC2)cc1 1517288483 JVLJQUBJPGCJQI-SANMLTNESA-N 431.580 4.135 10 10 IICE COC1CCC(CCn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)CC1 1518558268 SYHPEXLAFUYDQH-UHFFFAOYSA-N 435.572 4.201 10 10 IICE CCOC(=O)C[C@H](NC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)c1ccc(F)cc1 1526962288 FQASNPPTHRVPIO-QFIPXVFZSA-N 440.515 4.468 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc2c(c1)CCCO2 1529350097 LYSQXOXXSVGBGN-UNOMPAQXSA-N 442.537 4.381 10 10 IICE Cc1cnc(C(C)(C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1532433514 KOKIWHKTVXAYOY-GDNBJRDFSA-N 449.598 4.233 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)nc(C(C)(C)C)c3)cc2F)CC1 1537534993 KFJRQZMJXPPKQE-UHFFFAOYSA-N 432.971 4.244 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(C)n(C3CCOCC3)n2)cc1 1543115333 MSTIZMPONLFRTH-UHFFFAOYSA-N 448.567 4.465 10 10 IICE CN(c1ccc(CNC(=O)C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1)C1CCCCC1 1544245425 BOXLNPUGWMYVHO-QFIPXVFZSA-N 445.604 4.098 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1 1544816105 VZJIXKZPDWLIOH-QGZVFWFLSA-N 425.891 4.422 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)cc2Cl)C1 1556369993 ZQTMYULWGIRULS-DZKDUJFISA-N 448.007 4.305 10 10 IICE O=C(NCc1cccc(Br)c1O)C1=Cc2cc(Br)ccc2OC1 1556480182 HAFXUFFDXZEZMX-UHFFFAOYSA-N 439.103 4.009 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC(Cc4cc(F)cc(F)c4)CC3)C2)cc1 1565055430 CPTNPDMEMPXQBD-NRFANRHFSA-N 429.511 4.216 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cc(C(F)(F)F)no1 1586326475 SIVQFSYOZAQTCB-JXMROGBWSA-N 447.485 4.375 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3ccc(Br)cc3Cl)CC2)cc1F 1595482128 KJZTWLHUDARDDD-UHFFFAOYSA-N 441.728 4.142 10 10 IICE C[C@@H]1CCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)[C@@H]1C 1612838629 SARQRKFFLMMCRS-HUUCEWRRSA-N 428.943 4.482 10 10 IICE Cc1nc(-c2ccco2)cc([C@@H]2CN3CC[C@H]2C[C@@H]3CNCc2ccc(N(C)C)cc2)n1 1616154081 MLYXHGNGICMIJC-MDNUFGMLSA-N 431.584 4.079 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccc(Cl)nc1 1618368045 BXZPIIRAMLRBFP-UHFFFAOYSA-N 428.677 4.460 10 10 IICE CCOc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)nc1C 1618665048 VCQBXYNEUVBEIA-ATVHPVEESA-N 445.541 4.158 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Sc3nc4ccccc4s3)CC2)cc1F 1622564090 PIFYMYMUJJTPMV-AWEZNQCLSA-N 431.558 4.273 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@](C)(Cc2ccccc2)[C@@H](C)O)CCCC1 1623463175 GXZLPLDFTVYVFB-XHCCPWGMSA-N 434.580 4.275 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN([C@@H](C)c3ccccc3F)C2=O)c(C)n1-c1ccccn1 1624785425 XGXLYCYBLOUBIL-HTAPYJJXSA-N 434.515 4.110 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 1625458886 PZISSYBDJBKARF-UITAMQMPSA-N 438.524 4.323 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C[C@@H]1CCCO1)C(F)(F)F 1626510940 CVNDVUVSMCEUQE-ZWKOTPCHSA-N 444.494 4.123 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)s1 1627007019 ONYWAVWNJNJEAC-CVEARBPZSA-N 439.585 4.210 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)cc1F 1627604334 DQEGSVXCXCZYTO-OALUTQOASA-N 427.564 4.211 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(C(C)(C)C)nc2O)C1 1632005215 ZSQJOYRHYUAVFO-UHFFFAOYSA-N 434.584 4.122 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3cn(C(F)F)c4ccccc34)CC2)cc1F 1637530101 UGMOPEUBMVWALF-UHFFFAOYSA-N 432.446 4.216 10 10 IICE COc1cn(C)nc1[C@@H](C)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1652635271 SCTJGKWJSVNLCW-CYBMUJFWSA-N 431.334 4.090 10 10 IICE O=C(CN(Cc1ccccc1O)C1CCCC1)NCCc1ccc(OC(F)(F)F)cc1 1653338991 DHTXIGWSTFFMEZ-UHFFFAOYSA-N 436.474 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1695624035 JDZWYIIARYMJQN-YKSBVNFPSA-N 448.615 4.020 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3ccccc3Cl)n2CCCSc2nccs2)C1 1698274667 FDYFVEFFSRWNCG-CQSZACIVSA-N 436.006 4.463 10 10 IICE CC(C)CN1CCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)CC1 1706513938 DZWCZRZPNPTKCT-UHFFFAOYSA-N 448.706 4.428 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)[C@H]2CCCc3c2cnn3C)nnc1C(C)(C)C 1707305468 AQIXCQQDALEBQC-NRFANRHFSA-N 435.620 4.246 10 10 IICE CC/C=C/Cn1c([C@H]2OCC[C@H]2COC)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709407116 OBHOOYJFQWVUID-KJJUAODWSA-N 439.604 4.205 10 10 IICE COC[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1712256744 LNKXTUKDAXSOCI-OAQYLSRUSA-N 425.621 4.333 10 10 IICE C[C@H]1COCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763208318 HYOAIZILOHEXFG-RDJZCZTQSA-N 427.936 4.008 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)CCOC)C(C)C 1766432688 KLJDMEHLMRSZOQ-VWLOTQADSA-N 439.604 4.375 10 10 IICE CN(C[C@H]1CCCCO1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1767223228 CQJCGZZCNCWIHH-IAGOWNOFSA-N 437.635 4.164 10 10 IICE CCOCCC1(Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CC1 1768048433 VHJKVAHJLDXPAO-UHFFFAOYSA-N 445.583 4.083 10 10 IICE Clc1ccc(-c2nnc(N3CCSCC3)n2CCCSc2nccs2)cn1 1771508073 DNHNMAFUXBYNBJ-UHFFFAOYSA-N 439.035 4.186 10 10 IICE CCN(CC)c1ccc(NC(=O)CNCc2cc(Cl)cc(Br)c2O)cc1 1860720959 AFNDWIWFMJTQHF-UHFFFAOYSA-N 440.769 4.383 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccccn3)C(=O)N(CC(C)C)C2=O)cc1 1873164383 ZEHFYGDOWHSUOM-UHFFFAOYSA-N 428.536 4.015 10 10 IICE O=C(O)[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C[C@H]1c1ccc(O)c(O)c1 1894504775 GAUJAKYPDCXJKP-LEWJYISDSA-N 445.471 4.147 10 10 IICE COc1cc(C=C2SC(N3C[C@H](C)O[C@H](C)C3)=NC2=O)ccc1OCc1ccccc1 2053496910 PERNXZAKWQXXKK-CALCHBBNSA-N 438.549 4.354 10 10 IICE C[C@@H](NC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1cc(F)ccc1O 2084724214 FLYHLBJUBYBZDW-WIYYLYMNSA-N 443.563 4.303 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNCc1cccc(Br)c1O)C2 2126082872 MFIQLMNZQVKWMX-LXZKKBNFSA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)c1O 2236053531 WJZYURPZHKNGMZ-KGLIPLIRSA-N 443.382 4.146 10 10 IICE COc1ccc(Br)c(CN[C@H](C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236053895 BMLGOOCFYGQYKL-ZIAGYGMSSA-N 443.382 4.289 10 10 IICE CCCN1C(=O)C(=Cc2c(N(CCC)CCC)nc3ccc(C)cn3c2=O)SC1=S 2296846703 WDFOUBMKJKWYLT-UHFFFAOYSA-N 444.626 4.241 10 10 IICE Cc1ccc(CN(C)C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380784691 UUFXPVVKFYYIEB-OAHLLOKOSA-N 439.350 4.035 10 10 IICE O=C(CN1C(=O)c2ccccc2C1=O)N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12 3070891 QDBGIMNRQDPMPP-VWLOTQADSA-N 436.467 4.047 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)c3cc4ccccc4o3)c3ccco3)CC2)cc1 38940503 YBLMHTZVTUXBMW-QFIPXVFZSA-N 445.519 4.328 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3ccc(OC(F)F)c(OC)c3)CC2)cc1 110362724 KJOKJYFQWWRGQU-ONNFQVAWSA-N 432.467 4.104 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cccs3)[C@H]2c2ccc(O)c(O)c2)cc1OC 526379987 JLUDEMRIWBERBY-HXUWFJFHSA-N 425.462 4.234 10 10 IICE CC(C)[C@@H](C)CNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 739631750 YNBZWLFAEKVAHC-AAWHYMEISA-N 441.416 4.059 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2CCN(C(C)C)[C@@H]2c2ccc(F)c(F)c2)c1 778826925 NSWNKWBVTSHTFS-PRPYNDMISA-N 433.499 4.263 10 10 IICE COCCN(Cc1c(O)ccc2c(=O)c(-c3ccccc3Cl)c(C)oc12)[C@@H]1CCOC1 782962842 PKJBTCAAIYOPMG-MRXNPFEDSA-N 443.927 4.365 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CC3CCC(C(F)(F)F)CC3)cc2F)CC1 783044244 DDYNTIVVIJIAIB-UHFFFAOYSA-N 429.502 4.343 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1(c2ccccc2Br)CC1 789770008 IINOUBKZMCBQED-UHFFFAOYSA-N 443.385 4.006 10 10 IICE O=S(=O)(NCCCSc1nccs1)c1c(Cl)cccc1Br 800912608 PJCKURJCIUZHBV-UHFFFAOYSA-N 427.798 4.020 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccc2Br)n1C[C@H]1CCCO1 812265386 STTDMAYKGAYOQU-MRXNPFEDSA-N 443.345 4.229 10 10 IICE Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c(Cl)n1 919252829 NJPDKOYRZFTFJB-CYBMUJFWSA-N 448.862 4.003 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1c(F)cccc1I 1124549429 IATYVWRIDXVEMW-UHFFFAOYSA-N 438.284 4.303 10 10 IICE CC(=O)c1cccc(OCc2cc(C(=O)N(C)Cc3ccc(N4CCCC4)cc3)no2)c1 1124549484 KDOCFKKEJVARDC-UHFFFAOYSA-N 433.508 4.329 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)OCc1cc(Cl)ccn1 1125693115 ZFEGLQBZUMBEIE-CXUHLZMHSA-N 436.917 4.209 10 10 IICE Cc1cccc(N2CCN(Cc3ccc(NC(=O)c4ccc(C)c(O)c4O)cc3)CC2)c1 1136217187 ORTZELUHDITFFO-UHFFFAOYSA-N 431.536 4.289 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1141738140 XJHDXBRRXBKQEY-JTQLQIEISA-N 431.678 4.161 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1 1142419386 QARZABRPSULROS-HYBUGGRVSA-N 439.600 4.449 10 10 IICE O=C(Cc1ccc(O)c(O)c1)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1 1142817088 BOARPXFJEOWUJC-UHFFFAOYSA-N 436.895 4.412 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)c2ccccc2C)cc1 1144880323 ZKNWLGLDBUTLAS-JOCHJYFZSA-N 441.572 4.164 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nn(C(C)(C)C)cc2Br)cc1F 1144977286 FAMPRGBNAUAENG-UHFFFAOYSA-N 425.346 4.316 10 10 IICE COc1ccc(CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)[C@@H](C)C2CC2)cc1 1233605143 SGYWNMCZMCKPBQ-IBGZPJMESA-N 437.584 4.167 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@]3(C)CN(C(=O)OC(C)(C)C)CCO3)c2C)c1 1287660172 BVSGYZLRDRATLZ-VWLOTQADSA-N 441.572 4.045 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1nccs1 1304238173 LLOMTPUXLGEEJF-IBGZPJMESA-N 426.590 4.035 10 10 IICE CCC(CC)[C@@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)N1CCOCC1 1448445668 CASUKZCEEGDXFU-JPYJTQIMSA-N 436.040 4.330 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1c(F)ccc(S(=O)(=O)CC2CC2)c1F 1452055176 ZLBBAXNXQUQMFK-UHFFFAOYSA-N 448.535 4.069 10 10 IICE CC(=O)N[C@@H](C(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1)C(C)C 1457572316 FTGUUPJSWHEDTK-PZJWPPBQSA-N 435.490 4.459 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)ccc1N(C)C 1459237589 MGUKWZRWTTXVHD-HSZRJFAPSA-N 428.504 4.105 10 10 IICE CC[C@H](c1ccccc1)N(CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(C)C 1459718290 IWZCGRPDSUJJCN-XMMPIXPASA-N 441.591 4.388 10 10 IICE CCOC(=O)CN(Cc1ccc(F)cc1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1464569350 LZAHYUKEGFCZHS-UHFFFAOYSA-N 436.483 4.251 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC12CCC(C(C)(C)CC)CC2 1466674548 ZPXDXWGAHMXAOG-UDJCVHACSA-N 431.573 4.321 10 10 IICE Cc1cc(C(=O)Nc2ccnn2[C@@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1472261649 KPZCUAPUKWOGNH-MRXNPFEDSA-N 444.333 4.052 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@@H](CSc4ccccc4)C3)C2)cc1 1478859017 AGGKPGPRCQJWNI-WOJBJXKFSA-N 425.598 4.345 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@H](C)[C@@H]2C)n1Cc1ccc(N2CCOCC2)cc1 1513095947 WKFJBWPFGMATPN-GBESFXJTSA-N 429.634 4.007 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3ccc(C)cc3Br)C2)cc1 1526246199 FPUWASAJEWFDTF-KRWDZBQOSA-N 431.374 4.341 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C3(Cc4ccccc4Br)CC3)C2)cc1 1531729589 IGOOVTSEQFNLSZ-QGZVFWFLSA-N 429.358 4.176 10 10 IICE CCOC1CCC(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CC1 1532491685 CDLXRRKSJVFUSO-AQTBWJFISA-N 437.558 4.308 10 10 IICE CCS[C@@H]1CCC[C@@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1532501294 FSMYYSHAHHWEEP-NHMNYBGFSA-N 438.615 4.207 10 10 IICE CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C(=O)c1cc(C)n(-c2ccccc2C)c1C 1540700797 HGAOUOYDOCUQTQ-UHFFFAOYSA-N 447.535 4.275 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 1542403084 JJNLCDVLIRREKG-LJQANCHMSA-N 431.536 4.234 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F 1544629888 DIZLLPXSBMGJHR-PKOBYXMFSA-N 434.914 4.389 10 10 IICE Cc1cc(C(=O)N(CCN2CCOCC2)Cc2ccco2)c(C)n1-c1cccc(Cl)c1 1557029102 IVFPJCNQISNKDW-UHFFFAOYSA-N 441.959 4.315 10 10 IICE COC(=O)CN(CCOc1ccccc1C(=O)OC(C)(C)C)Cc1cc(Cl)ccc1O 1559607541 PJMTYZLEGWKWCC-UHFFFAOYSA-N 449.931 4.055 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCCc3cccc4c3OCCO4)cc2Cl)C1 1564649792 NENUOKNVEBLXBB-QGZVFWFLSA-N 443.975 4.389 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@]1(C)CCN(C(=O)OC(C)(C)C)C1 1566306458 LNJRJTJNIQTEJZ-HXUWFJFHSA-N 441.366 4.150 10 10 IICE C/C=C/c1ccc(OCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(OC)c1 1566356488 GSRDFMPFFMVKCD-HQMUEHRGSA-N 444.959 4.247 10 10 IICE CN(c1ccc(CNC(=O)CN2CC[C@H](c3ccccc3)NC2=O)cc1)C1CCCCC1 1583698877 BYBVNJHBIMQELA-XMMPIXPASA-N 434.584 4.228 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2cccc(F)c2)c(C)n1-c1ccc(Br)cc1 1595419298 UPHOHSGIYZLIMP-HXUWFJFHSA-N 431.305 4.459 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C[C@H](c3ccc(O)cc3)C3CC3)cc2F)C[C@@H](C)O1 1596693992 ATXMUXZFOQVYES-JKSBSHDWSA-N 426.532 4.345 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2CC2(C(C)C)CC2)c(C)n1-c1ccccc1 1611933509 HASWDLLNPIEMBA-GOSISDBHSA-N 448.615 4.489 10 10 IICE CCc1nnc(N2CCO[C@@H](c3ccc(Cl)s3)C2)n1Cc1ccc(N(C)C)c(F)c1 1614045546 KQXDXTFYQHZHMX-QGZVFWFLSA-N 449.983 4.387 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)C2CCCCC2)n1Cc1ccc(N(C)C)cc1C 1620084045 OJFBUDOJOICJRB-REWPJTCUSA-N 441.620 4.194 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](C)[C@H](C)C(=O)Nc2ncccc2O)c1 1627090251 IMBSUMHIYCNECZ-HOTGVXAUSA-N 440.931 4.241 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CCCc2cccnc21 1627171625 UGVXPVDFZZFQNQ-UDLNKVAWSA-N 443.619 4.318 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3cncn3)cc2)c(C)n1-c1ccc(Br)cn1 1629404731 CLWVMVKONDXQGA-UHFFFAOYSA-N 437.301 4.085 10 10 IICE COCCOc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(Cl)c1 1631608358 UVALGADHXCQHGV-NRFANRHFSA-N 446.975 4.253 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](CC(C)C)C(=O)OC(C)(C)C)cc1 1631724000 XMSWJHUQZRFBRI-QFIPXVFZSA-N 426.557 4.322 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C/C=C(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1634161691 BYOCUCPTWOQZGU-BVBGJJFLSA-N 428.360 4.310 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCCc1cccc(O)c1 1635489280 RBPMAWQNQDOFFB-UHFFFAOYSA-N 426.557 4.494 10 10 IICE COc1ccccc1O[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C1 1636262468 HIQKFSLFNJOKBV-SIKLNZKXSA-N 425.573 4.254 10 10 IICE Cc1nccn1-c1ccccc1CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1639852948 DNEGVZXFAQQUJC-UHFFFAOYSA-N 426.520 4.260 10 10 IICE CC(C)c1ccc(O[C@H](C)CNC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1672572253 QBYAISNPGBUTSQ-DVECYGJZSA-N 426.605 4.245 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)C[C@H]3C)cc2Cl)C1 1682023197 BLXNMTKBSKZNIY-RTBURBONSA-N 442.007 4.392 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCC(F)(F)c2ccc(Br)cc2)c1 1684209423 XCEVSILOFDXHMS-NSHDSACASA-N 429.261 4.316 10 10 IICE CCc1noc([C@@H]2CC[C@@H](NC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)C2)n1 1684438043 ZRTWVVRYCMRKKC-RTBURBONSA-N 437.544 4.339 10 10 IICE C[C@]1(Cc2ccccc2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725696 RUHONMCQSZRABB-XMMPIXPASA-N 429.511 4.108 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1(Cc2cccc(F)c2)CCOCC1 1686826169 CEPLGYFYOLNMTG-LJQANCHMSA-N 427.564 4.222 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCOC(C)C 1694129470 DJPDUKXJONBFEV-GOSISDBHSA-N 433.572 4.081 10 10 IICE C#CCN(CC#C)c1nnc(Cc2ccc(Cl)cc2)n1CCCSc1nccs1 1705583978 RVHSFOXNOAUQAU-UHFFFAOYSA-N 442.013 4.234 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N(C)C2CCCCC2)cc1 1710023954 IUDAJJBSLSDLBD-UHFFFAOYSA-N 438.620 4.178 10 10 IICE C[C@@H](C1CCCCC1)N(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1731138124 PFHAUXWCCDEQGT-PXNSSMCTSA-N 429.584 4.440 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1744778360 GKZFTICMBJPTIK-WZONZLPQSA-N 448.615 4.456 10 10 IICE CCCN1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC)CC1=O 1745722505 VOBQKWCTCBFLCW-UHFFFAOYSA-N 434.588 4.211 10 10 IICE C[C@H]1CN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)CC(C)(C)C1 1752334961 JZHMAXHJYBCYFO-OAHLLOKOSA-N 429.619 4.246 10 10 IICE CO[C@H]1CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CC1(C)C 1770651644 OTLPICKZKIIURI-INIZCTEOSA-N 449.671 4.431 10 10 IICE CCCc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCOC[C@H]2C)n1 1868386902 LBPDYHHDVLDKPH-MRXNPFEDSA-N 442.519 4.173 10 10 IICE COc1nc(C)c(Br)c(C)c1C(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1891209294 YGQCMVZPOBZKJA-WMZOPIPTSA-N 444.373 4.388 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C23CCC3)c1O 2236048301 AOPIECZCEANEAA-CVEARBPZSA-N 441.366 4.089 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3ccc(OC)cc3)SC2=S)cc1 2314836742 JLQXZZVZEAANIF-AWEZNQCLSA-N 442.562 4.322 10 10 IICE CC(C)c1ccc(C=C2SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)cc1 2323809050 ORQZSCSYOWHNHK-GOSISDBHSA-N 427.547 4.413 10 10 IICE O=C1C(=Cc2ccc(O)c(O)c2)C(C(F)(F)F)=NN1c1ccc(Br)cc1 2332094501 MRLSWCQWAWPMKO-UHFFFAOYSA-N 427.176 4.209 10 10 IICE CC[C@@H](C)[C@H](CC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2380719996 FLIHZCQOBBKXOS-DOMZBBRYSA-N 443.382 4.409 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccc(C)c(C)c4)c3[N+](=O)[O-])CC2)cc1 40589948 DOIFRUFHCUIQDU-UHFFFAOYSA-N 434.500 4.080 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccccc3C)=NC2=O)ccc1OCCC(=O)O 210468718 MDLZLHUPSJAZLE-UYRXBGFRSA-N 426.494 4.330 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C[C@@H]2CCCC[C@H]21 727134564 ZYJSRSINQFTJAR-NNWRFLSQSA-N 427.589 4.471 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(OCC(F)(F)F)n2)cc1 739552778 VXXYVJOBQDLTCR-UHFFFAOYSA-N 435.368 4.293 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)N(CCSc2ccc(F)cc2)c2ccccc2)c1 742007721 QNENLLBICWBVDY-KPKJPENVSA-N 435.524 4.419 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc(C(=O)OCC)o3)n2)c1C 748091695 FRYODVPQGQOOTF-UHFFFAOYSA-N 437.543 4.209 10 10 IICE CCC1(CNC(=O)N[C@H](C)c2cc(OC)ccc2O)CCN(Cc2ccccc2)CC1 754126933 WFAWAGLWOKSPFJ-LJQANCHMSA-N 425.573 4.453 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCc2ccc(C)cc2OC[C@H]2CCOC2)cc1 755127269 OWYTZYLQEZNIEN-NRFANRHFSA-N 425.573 4.256 10 10 IICE COc1cccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)c1O 769508646 ZYGPQLPSPPLMKK-BEVDRBHNSA-N 442.943 4.144 10 10 IICE O=C(Nc1c[nH]nc1[C@H]1CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1)C1CCCC1 779619169 KKMRVVLDWIKNAJ-AWEZNQCLSA-N 447.923 4.185 10 10 IICE O=C(NCCCSc1nccs1)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F 782083574 QUPMMIACYUIQFF-UHFFFAOYSA-N 444.504 4.289 10 10 IICE CCOC(=O)[C@@H]1CC[C@@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c2ccccc21 802305767 TZVKODPRRBWZSJ-KAYWLYCHSA-N 447.623 4.490 10 10 IICE COCCn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCCC2)cc1 802469799 RBMNZWXQSFMAMN-UHFFFAOYSA-N 425.602 4.204 10 10 IICE CC(=O)N1c2ccc(S(=O)(=O)Nc3nc(-c4ccc(F)cc4)cs3)cc2C[C@H]1C 831877309 GHWBXSLMVFEWEQ-GFCCVEGCSA-N 431.514 4.048 10 10 IICE COc1cc(CCNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1Cl 1129286969 DAIMGZYOWQYXCU-UHFFFAOYSA-N 439.987 4.429 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Oc4cccc(F)c4)cn3)CC2)cc1F 1137423080 UEYFULODWKQHEH-UHFFFAOYSA-N 425.435 4.123 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(Br)ccc1Cl 1137816950 WPDUMHMIOCZTLL-UHFFFAOYSA-N 447.112 4.277 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(C(=O)Nc3ccccc3O)CC2)c1 1138022106 MLQUSQRGOJDGBL-UHFFFAOYSA-N 445.519 4.103 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3c4ccccc4OC[C@H]3CO)cc2Cl)C1 1235833712 MESCJMAJPCOMKN-JTUHZDRVSA-N 443.975 4.118 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(Br)c(OC(C)C)c3)C2)cc1 1278861753 NGSZOPCTNLSTQB-MRXNPFEDSA-N 433.346 4.254 10 10 IICE Cc1cc(-c2nnc(N3CC=CCC3)n2CCC(=O)NC(C)(C)C)c(C)n1-c1ccccc1 1289359303 MLLFZDXDWQBYLI-UHFFFAOYSA-N 446.599 4.424 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](CN(CC)CC)C2)n1Cc1ccc2c(c1)CCCN2C 1291501779 VZOPDHDKTPLZRP-RBBKRZOGSA-N 438.664 4.390 10 10 IICE O=C(NCc1c(O)cccc1O)c1cc(Br)ccc1OCc1ccccc1 1304050328 LEIYYPIEISIMRK-UHFFFAOYSA-N 428.282 4.369 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cccs1 1315045330 SVEAOSMZBMTQQE-UHFFFAOYSA-N 448.596 4.187 10 10 IICE COC[C@H]1CCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C1 1315916836 HZIILRVZBZMHCU-INIZCTEOSA-N 435.644 4.042 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc(C)c1Cl 1350933518 OHPCMFVGUHZORB-IRXDYDNUSA-N 434.939 4.405 10 10 IICE O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1442381441 RGXAKMAEGKVTEG-UHFFFAOYSA-N 445.928 4.346 10 10 IICE COc1ccc(C(=O)N[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)c2ccccc2)cc1 1445898439 APSAZICWKSRKOR-RUZDIDTESA-N 444.531 4.067 10 10 IICE Cc1ccc(C(=O)Nc2cccc(N3CCNC3=O)c2C)cc1-n1c(C)cc(C=O)c1C 1448479970 CZEOGOCMFDMVRG-UHFFFAOYSA-N 430.508 4.305 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1451926210 ZJOJMUITPQUAGU-UHFFFAOYSA-N 436.508 4.014 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H](C)Oc3ccc(C)cc3Br)C2)cc1 1461077951 QZSXTVJMVBKMEL-DLBZAZTESA-N 447.373 4.176 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)cc1 1464295557 HWJYXZJHFHKWOY-UHFFFAOYSA-N 432.446 4.373 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C(CNCc3cc(Cl)cc(Br)c3O)[C@@H]2C1 1474260357 UFPFZCRTHPQHTK-KBPBESRZSA-N 431.758 4.011 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)[C@@]12CCCO2 1478409308 OFQKKKDRBIHQSM-GCUYEVCFSA-N 435.996 4.102 10 10 IICE CC(C)(C)[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(F)c1 1479343209 CZELWOJFTOOVHT-QFIPXVFZSA-N 440.563 4.114 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCS1 1499724745 FFTGVZHLLGTJLV-CVEARBPZSA-N 439.676 4.490 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@]1(O)CCC[C@@H]1C 1509131980 JPEJGNCQKIECBG-NBGIEHNGSA-N 425.621 4.264 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)C1(C)C 1516378930 IPRJRIISCBITQC-NHCUHLMSSA-N 429.584 4.439 10 10 IICE CCOC(=O)c1c(NC(=O)c2cn3c(n2)COCC3)sc(C)c1-c1ccc(C)cc1 1531341662 CNSOZWDOQSVTLB-UHFFFAOYSA-N 425.510 4.188 10 10 IICE CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1534242773 WVWNKSRDDZWPBZ-IFRKUXIOSA-N 425.598 4.011 10 10 IICE COc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)c(F)c2)cc1 1536924877 MXPXTHPKZGTWEM-UHFFFAOYSA-N 433.527 4.183 10 10 IICE CC(C)(C)c1ccnc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1539344121 TVFHFLAACRFBEF-NTCAYCPXSA-N 444.557 4.143 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H](O)c2ccc(C(F)(F)F)cc2)cc1 1542490756 XRUYKFAKUXYRMR-NHCUHLMSSA-N 436.474 4.013 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1547446919 KQMDEFOELNOSBE-OFVILXPXSA-N 441.620 4.072 10 10 IICE CO[C@H](C)c1nc(Cn2c(-c3ccc(C)o3)nnc2N(C)Cc2ccccc2O)cs1 1554587772 ZNSXSMXLUAVMOM-OAHLLOKOSA-N 439.541 4.401 10 10 IICE CCCC[C@H]1NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1=O 1559416942 CBJWOGNGOCIVBK-GOSISDBHSA-N 446.345 4.150 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](CO)Cc2ccccc2Br)cc1 1567579609 ZEYCKZIFDVEYRD-GOSISDBHSA-N 441.369 4.438 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3[C@@H](C)CN(C(=O)C(C)(C)C)C[C@H]3C)c2C)cc1 1569583313 KRMGSKGKTNMYFG-HDICACEKSA-N 425.573 4.210 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]3C)ccc21 1597789346 VAMHUDNNUOTQCW-RTBURBONSA-N 443.588 4.374 10 10 IICE CCOCc1nnc(N(C)[C@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1616668161 DMGUMFCDJZZYNU-UGKGYDQZSA-N 443.661 4.431 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(C(F)(F)F)c1O 1618427398 MTCDKWDHZCFNHU-UHFFFAOYSA-N 438.446 4.413 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1cc(Br)cs1 1623929524 ZTIXUPZIPOLMRY-UHFFFAOYSA-N 446.750 4.004 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccnc1SCc1ccc(Br)cc1 1626838371 ZFTMCFRZZDAUKZ-UHFFFAOYSA-N 445.338 4.478 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1627073485 PEXMUQVEFWIGMA-QFIPXVFZSA-N 430.426 4.225 10 10 IICE COC(=O)c1ccc(OCCNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1628780783 MLJRWTBENSTPDG-UHFFFAOYSA-N 426.900 4.343 10 10 IICE C[C@@H]1C[C@H](CCNC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)CC(C)(C)C1 1634872283 ZPYXFKYGZVQOSZ-QUCCMNQESA-N 428.621 4.040 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1637549963 WCVSJCFISOWTNU-UHFFFAOYSA-N 439.506 4.447 10 10 IICE Cc1noc(C[C@@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ccccc2)n1 1638508273 UYEVBQGUFRMDCJ-XMMPIXPASA-N 442.519 4.241 10 10 IICE O=[N+]([O-])c1ccc(NCc2ccc(N3CCOCC3)c(F)c2)nc1-c1ccc(F)cc1 1650651613 QYDOAIWECCCSJP-UHFFFAOYSA-N 426.423 4.384 10 10 IICE Cc1cc(C(=O)CSCc2cccc(C(N)=O)n2)c(C)n1-c1ccc(OC(F)F)cc1 1651918086 XNNMSGYJBAHMIU-UHFFFAOYSA-N 445.491 4.306 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](c3nccc(C(F)(F)F)n3)C2)c1 1652946534 RSQRGXVOFIRNJF-KRWDZBQOSA-N 442.441 4.345 10 10 IICE CCOc1ccc(N2CCN([C@H](C)C(=O)Nc3c(C(C)=O)oc4ccccc34)CC2)cc1 1652964489 MESVABROWZAWRU-QGZVFWFLSA-N 435.524 4.183 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3CCCOc4cc(Cl)ccc43)CC2)cc1 1670973266 SJFINCSDKOQQEO-NRFANRHFSA-N 429.948 4.484 10 10 IICE CC(C)COc1ccc(C(C)(C)NC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1675580118 HWCBJFHSQZUVRZ-UHFFFAOYSA-N 438.616 4.208 10 10 IICE CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)NCc1cccc(Cl)c1O 1681018441 GUCJLIUPDYHVTB-PIGZYNQJSA-N 427.726 4.384 10 10 IICE Cc1ccccc1-c1nc(CNC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)no1 1682730215 FTXRBFGRNXOGLP-UHFFFAOYSA-N 429.524 4.494 10 10 IICE COc1ccc([C@@H](NC(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)c2ccco2)cc1 1683222023 ZIZAJHPJQPMSPS-HOYKHHGWSA-N 435.524 4.212 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2 1685720181 RCTNDQWSHSJVDB-IHPCNDPISA-N 431.577 4.492 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 1687190258 NAIDSLNFIKPOSP-MXVIHJGJSA-N 430.593 4.264 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1693937242 PAACTXLEEUCOLQ-FNZWTVRRSA-N 448.615 4.374 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1694324398 OFOBAZJGAQBPPT-IEBWSBKVSA-N 440.636 4.102 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCC(OC(C)C)CC2)cc1 1710026983 VAELYEDTEYQTBA-OAQYLSRUSA-N 441.620 4.070 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1723317649 CTGUNSWSQLPDKZ-NRFANRHFSA-N 429.584 4.125 10 10 IICE Cc1csc(CCCCn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)n1 1725049278 IUUMPDCQDGBEIA-UHFFFAOYSA-N 448.596 4.394 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@H](C)CCSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1743546107 HBBZPRFFDMIWAU-ZWKOTPCHSA-N 449.640 4.393 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)CC1 1750538048 UOVHBVVIQBIRIX-UHFFFAOYSA-N 432.572 4.035 10 10 IICE CCN(c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1764788738 RIAQOCFLCFMQFX-QHCPKHFHSA-N 441.620 4.011 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCCO1 1769559858 CHZUXLXSNISJGC-UGKGYDQZSA-N 437.588 4.393 10 10 IICE COc1ccc(OCCCC(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCCCC2)cc1 1865937184 DVZDIRIUGVRMJI-RUZDIDTESA-N 439.600 4.264 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCC(C)C)C(=O)N(Cc3ccncc3)C2=O)cc1 1873166483 APSUJVYIFJTYBY-UHFFFAOYSA-N 428.536 4.015 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C(F)F)c(C=O)c2I)c(O)c1 2079059856 BDVNUMOAERVWKR-CQSZACIVSA-N 434.224 4.497 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3c(O)cccc3Br)C(C)(C)[C@H]21 2119291554 SSGOBJDBHJYKLG-DQYPLSBCSA-N 425.367 4.278 10 10 IICE CC[C@H](NC[C@]1(O)CCCN(Cc2ccccc2)C1)c1cc(Br)ccc1O 2157531046 ZVSVLZSCVKYJEN-RBBKRZOGSA-N 433.390 4.223 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2N(C(=O)OC(C)(C)C)CCC2(C)C)c1O 2236044616 OYCAWOADOHPUFV-INIZCTEOSA-N 443.382 4.289 10 10 IICE COCCCN1C(=O)C(=Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C(C(=O)OC)=C1C 2294082227 VCCZUVOUSMLDJI-UHFFFAOYSA-N 442.943 4.457 10 10 IICE Cn1cc(C=C2SC(=S)N(NC(=O)c3ccccc3Cl)C2=O)c2ccccc21 2297468567 KLRBDTKKXWMEAU-UHFFFAOYSA-N 427.938 4.378 10 10 IICE CCN(CC)c1ccc(CN(C(=O)C=Cc2ccc(C)cc2)[C@H]2CCS(=O)(=O)C2)cc1 2314508704 XDSDLUFSFZETIT-DEOSSOPVSA-N 440.609 4.070 10 10 IICE COc1ccc(C=C2SC(=S)N(c3cccc(C)c3C)C2=O)c(C(=O)O)c1OC 2314929687 QCJKVSBFKNDGQG-UHFFFAOYSA-N 429.519 4.425 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccc(C(C)=O)cc3)C2=O)c(C(=O)O)c1OC 2314929943 UZKWNWNWGFPDQD-UHFFFAOYSA-N 443.502 4.010 10 10 IICE Nc1ccc(CCOCc2ccc(I)c(Br)c2)cc1 2349800271 CEMKISMVRWGLGA-UHFFFAOYSA-N 432.099 4.395 10 10 IICE Cc1ccc(CNC[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2352949632 HJJIJSAJOLZSMO-LBPRGKRZSA-N 441.288 4.256 10 10 IICE CC[C@@H](N[C@@H]1CCO[C@@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2354149075 LLAUWAQHBZMPJF-BFYDXBDKSA-N 443.382 4.268 10 10 IICE CCc1ccc(NC2=NC(=O)/C(=C\c3ccc(OCCC(=O)O)c(OC)c3)S2)cc1 16912246 NVOUTMATGSWMIL-CPNJWEJPSA-N 426.494 4.194 10 10 IICE CCN1C(=O)/C(=C\c2c(Oc3ccc(Cl)cc3)nc3ccccn3c2=O)SC1=S 102863512 KLRLOFSMFMNKOI-RVDMUPIBSA-N 443.937 4.361 10 10 IICE Cc1sc(NS(=O)(=O)c2cccc3ncccc23)nc1-c1cccc([N+](=O)[O-])c1 727248698 UNLPEAJRKAOVCV-UHFFFAOYSA-N 426.479 4.376 10 10 IICE CN(Cc1ccccc1)C(=O)N1CCC(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CC1 727303048 OYANKXPNNUZRTJ-UHFFFAOYSA-N 448.611 4.208 10 10 IICE CCC(C)(CC)NC(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 733111306 RJPILMYRUXMQRR-UVTDQMKNSA-N 441.416 4.345 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N3CCSCC3)cc2)C[C@@H](c2ccc(F)cc2)O1 743554342 BJFZJEFKHPBMCJ-JTSKRJEESA-N 429.561 4.051 10 10 IICE Cc1nn(C)c(C)c1[C@@H](NC(=O)NCc1ccc(N2CCC(C)CC2)cc1)C(F)(F)F 757894881 UFZGDKHJSVRBKP-HXUWFJFHSA-N 437.510 4.376 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cc4c5c(c3)CCC(=O)N5CCC4)n2)s1 758384302 MZGFZWBQQAHEIJ-UHFFFAOYSA-N 445.591 4.206 10 10 IICE O=C(NCc1ccn(C2CCCC2)n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 770107092 IFFFMKLRPVZLJQ-QGZVFWFLSA-N 433.503 4.068 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N[C@H](c3ccccc3)[C@H]3CCOC3)cc2F)C[C@@H](C)O1 771940103 NRFLNFLACQWJJG-WXFMPLRXSA-N 441.547 4.016 10 10 IICE Cc1cc(Br)c(O)c(CN[C@H](C)C(=O)Nc2cccc(N3CCCC3)c2)c1 781632504 YDVVXJFZYYXQJC-OAHLLOKOSA-N 432.362 4.180 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCC[C@@H]1c1ccc(Br)s1 784517357 MNNXFMUXWAIJFS-QGZVFWFLSA-N 436.419 4.372 10 10 IICE Cc1cc(C(=O)NCC(=O)Nc2cccc(F)c2)c(C)n1-c1ccccc1Br 1136492735 JLVVDEICRDSUSE-UHFFFAOYSA-N 444.304 4.364 10 10 IICE CCCOc1cn(-c2ccccc2)nc1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1137658810 XDDYPCXDDNOVEX-UHFFFAOYSA-N 434.540 4.022 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)cc1 1147953973 ZOOFKKAVJDHYHJ-QHCPKHFHSA-N 444.453 4.015 10 10 IICE CCOc1ccccc1[C@@H](CC(=O)N1Cc2cccc(O)c2C1)NC(=O)OC(C)(C)C 1152574498 WJWGTTUMSAUZRJ-LJQANCHMSA-N 426.513 4.289 10 10 IICE Cc1cc(C(=O)NCc2cc(C(F)F)on2)c(C)n1-c1ccc(Br)cn1 1155548394 XPLUOEZLNZZUDC-UHFFFAOYSA-N 425.233 4.107 10 10 IICE CNC(=O)COc1cccc(CNC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)c1 1157065370 LHLZPEBRQPUZTP-UHFFFAOYSA-N 433.552 4.272 10 10 IICE Cc1c([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3ccccc3)c2C)c(=O)c1Br 1189035022 VDRHDQSJBQLGKK-UHFFFAOYSA-N 444.285 4.118 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(-c2cccc(Cl)c2F)no1 1290324739 WZCYCFREAPEMJJ-UHFFFAOYSA-N 429.879 4.243 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@H](C)CNC(=O)OC(C)(C)C)cc1 1293125569 MXIMCYPTSYCGCP-GOSISDBHSA-N 441.572 4.455 10 10 IICE C[C@@H](NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1)c1ccccc1O 1302530259 IMOIPBBCWIOFOS-QGZVFWFLSA-N 436.533 4.025 10 10 IICE Cc1ccc(CN2CCO[C@@H](CNC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)cc1 1302576795 XYOGPPXYPGQZBL-VWLOTQADSA-N 431.580 4.342 10 10 IICE CCOC(=O)c1sc2nc(CN3CCCCc4cc(OC)ccc43)nc(N)c2c1C 1307591530 OTDZCUANUVGOKY-UHFFFAOYSA-N 426.542 4.110 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3cnc(C(F)(F)F)nc3)cc2Cl)C1 1312585699 JEOAKVSIGMSSKV-ZDUSSCGKSA-N 441.885 4.385 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC/C=C\CNC(=O)OC(C)(C)C)cc1 1312794534 GGTIGOYBWWNXMG-SREVYHEPSA-N 442.560 4.138 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C 1312805412 IKLNBBJEOOLDQX-NBGIEHNGSA-N 440.632 4.381 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)CCCc2ccccn2)cc1F 1314661679 WDIGAIQKASPOOS-UHFFFAOYSA-N 447.562 4.001 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@@H]1CCCO[C@H]1C(C)(C)C 1314753220 MTNLFPNAAHEYDB-XUZZJYLKSA-N 449.599 4.447 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4csc(C)n4)n3CC(C)C)CC2)cc1 1315513508 VJSBOUDIKOBZSB-UHFFFAOYSA-N 440.617 4.015 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)sc2c1CCCC2 1349327929 XHUZJDGCUJSDTG-GFCCVEGCSA-N 448.491 4.073 10 10 IICE Cc1ccc(Cn2ncc3c(C(=O)NCc4ccc(N(C)C)c(F)c4)cc(C)nc32)cc1 1351737482 CKGQSWFTNXBNAY-UHFFFAOYSA-N 431.515 4.232 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCN(C3CCC3)C[C@H](C)C2)nnc1C(C)(C)C 1361097458 BOYNPRWEZPUNGO-IBGZPJMESA-N 438.664 4.309 10 10 IICE Cc1c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cccc1N(C)C 1435689416 OGRVFIUARAAHIT-CPNJWEJPSA-N 443.569 4.430 10 10 IICE CN1CCN(c2ccc(CNC(=O)Cc3csc(-c4ccccc4Cl)n3)cc2)CC1 1438886737 MIFXFRVOBZPLIQ-UHFFFAOYSA-N 441.000 4.074 10 10 IICE COc1ccc(CCCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1OC 1457100258 OUQKPGPCUNYIRG-SFHVURJKSA-N 448.510 4.413 10 10 IICE COC(=O)c1cc(OCC(=O)N2CCC(CCc3ccc(C)cc3)CC2)ccc1N(C)C 1459238473 NPWDXAUAOGXDHT-UHFFFAOYSA-N 438.568 4.098 10 10 IICE Cc1cc(CC(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1466619210 SJLDUTCVHKPNQZ-OAHLLOKOSA-N 427.898 4.385 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCCC1=CCN(C(=O)OC(C)(C)C)CC1 1470057958 WKLQTFQFFZMUPB-UHFFFAOYSA-N 442.604 4.386 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1513380456 RZZQRSWPUKESHA-UHFFFAOYSA-N 438.620 4.081 10 10 IICE Cc1ccc(-c2nc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)cs2)o1 1526002573 FOMATWXWXOUKBD-HUUCEWRRSA-N 429.517 4.394 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1542181462 XORMWACIWZPCAC-UHFFFAOYSA-N 434.588 4.067 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CCCOC(C)C)CC2)cc1F 1554960828 QLJPXZLZKULTNM-UHFFFAOYSA-N 447.599 4.156 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1csc([C@H](C)NC(=O)OC(C)(C)C)n1 1597781666 UBGWILCNDDSLMK-HNNXBMFYSA-N 432.590 4.457 10 10 IICE CC(C)CCn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1606975117 QHZGNIRXFXQNRL-UHFFFAOYSA-N 447.587 4.208 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCC(CN(C)C(C)C)CC1 1611963439 QLTBJXYOWUSCBE-UHFFFAOYSA-N 426.653 4.381 10 10 IICE C[C@@H]1CN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)CCCO1 1612961436 YMXCSVULKWKKSU-MRXNPFEDSA-N 447.605 4.262 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@](C)(O)c1cc(C)oc1C 1613921226 PEDADPQJLYFLQG-RUZDIDTESA-N 437.588 4.195 10 10 IICE CCc1cnccc1[C@@H](C)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1624023004 MZUSZPTWQHNCFS-VCRXTVNUSA-N 443.569 4.252 10 10 IICE COc1ccccc1CCNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1628324815 TVWYMPPFECQNOT-UHFFFAOYSA-N 428.330 4.233 10 10 IICE Cc1cc(C(=O)Nc2cc3c(cc2O)n(C)c(=O)n3C)c(C)n1-c1ccc(C(C)C)cc1 1629054700 QQQIAYMFVMLTPV-UHFFFAOYSA-N 432.524 4.366 10 10 IICE O=C(COc1ccccc1C(F)(F)F)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1631425686 MJQZTISVIWINLY-INIZCTEOSA-N 442.865 4.224 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(Cc2nc(C3CCC3)no2)CC1 1636263030 LOWUUCLNDFIECH-SFHVURJKSA-N 439.604 4.307 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)c(C)n1-c1ccccc1Br 1640925394 GYKCCLFEGKAPBQ-INIZCTEOSA-N 446.389 4.233 10 10 IICE C[C@H](Sc1nc2ccccc2s1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1642155450 SVJMFFHHYLADJV-HNNXBMFYSA-N 427.595 4.054 10 10 IICE COc1ccc(N2CCCN(CC3CCN(C(=O)OCc4ccccc4)CC3)CC2)cc1 1644376393 ZCCNKEUVVYJFFK-UHFFFAOYSA-N 437.584 4.256 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3c(O)cnc4ccc(Cl)cc34)cc2F)C[C@@H](C)O1 1648474286 HLVJWTWIWMTZEX-OKILXGFUSA-N 443.906 4.277 10 10 IICE Cc1ncc(I)c(NCCc2cc(C)n(-c3ccccc3)c2C)n1 1652101297 CSHYYZGXDOZRQE-UHFFFAOYSA-N 432.309 4.452 10 10 IICE Cc1cc(CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCC2)c(C)n1-c1ccccc1 1670900537 PUBXNMZNZXAMBX-UHFFFAOYSA-N 426.561 4.341 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccc1 1674922564 BKEQPPJSCMENCQ-LJQANCHMSA-N 440.588 4.287 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(C(F)(F)F)cc3C)CC2)c(OC)c1 1680139732 MBYOGLVMZRSYGJ-UHFFFAOYSA-N 437.462 4.063 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)CC(C)(C)O1 1693813815 JYQGOZICDYWUFF-GOSISDBHSA-N 425.621 4.301 10 10 IICE C=CCSCCn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1705950123 SBLMWBQCILANPY-OAQYLSRUSA-N 427.618 4.285 10 10 IICE COc1cccc(-c2nnc(N(C)C[C@H]3CCOC3)n2CCCSc2nccs2)c1 1711903612 XRAWQQHKHBABOY-MRXNPFEDSA-N 445.614 4.065 10 10 IICE CC(C)[C@H](Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1723124174 TUOKDODVQVFQCI-SFHVURJKSA-N 429.565 4.047 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H]3C)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1724198258 NFEVNJMKBBSFME-GOSISDBHSA-N 434.588 4.210 10 10 IICE CCC(CC)(Cn1c(Cc2csc(C)n2)nnc1N(C)Cc1ccccc1O)OC 1743974217 JCTGNDYKVUZVID-UHFFFAOYSA-N 429.590 4.181 10 10 IICE CCS[C@@H]1CCCCN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1747498985 JCQGBRAJYUZEAI-IFMALSPDSA-N 443.661 4.317 10 10 IICE CC[C@@H](C)NC(=O)CCn1c2c(c3ccccc31)CCN1C(=O)c3ccccc3N(C)[C@H]21 1860344776 FRQWZLINBHMOCN-NSYGIPOTSA-N 430.552 4.093 10 10 IICE CC(C)(C)OC(=O)N1CC([C@@H](F)CNCc2cc(Cl)cc(Br)c2O)C1 2050103268 FHNCPAIGDWJJGH-AWEZNQCLSA-N 437.737 4.103 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C(F)(F)F)c(C(=O)OC)c1Br 2079848594 KECRTPWXKDRYQH-JTQLQIEISA-N 437.212 4.165 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCCC[C@@H]1CNCc1cc(Br)cc(F)c1O 2087520723 PYBXVZOEWQIBMI-WBMJQRKESA-N 431.346 4.467 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)C2NCc1cc(Br)cc(F)c1O 2103918148 OQXNTXOFSKYWKG-HBBFGDNQSA-N 429.330 4.029 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@H]3C[C@H]2CN3C(=O)OC(C)(C)C)c1O 2236053986 CTQOXWYHNRVLET-XEZPLFJOSA-N 441.366 4.041 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2(C)C)c1O 2236055251 OVLBVEFVJKAFDC-ZDUSSCGKSA-N 443.382 4.289 10 10 IICE CC(=C1SC(=S)N(c2ccccc2C(N)=O)C1=O)c1ccc(Br)cc1 2314539115 LFVRURQHSUDUEJ-UHFFFAOYSA-N 433.352 4.344 10 10 IICE Cc1cc(C)c([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@@H]3C=CC[C@H]32)c(C)c1 20691298 UMFXZUOSQDYRFL-DNRQZRRGSA-N 438.593 4.459 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC(C)(C)C)N2CCN(c3ccc(F)cc3)CC2)cc1 22665585 LLRILCHBSARCNO-XMMPIXPASA-N 440.607 4.307 10 10 IICE COc1ccc(/C=C2\SC(=O)N(CCC(=O)Nc3ccccc3C(=O)O)C2=S)cc1 33682875 LCTZZVOYYTULBB-ATVHPVEESA-N 442.518 4.259 10 10 IICE O=C1/C(=C\c2cn(-c3ccccc3)nc2-c2ccncc2)SC(=S)N1C[C@@H]1CCCO1 33808705 MZXDEUDHFSWEKN-XAJRUKRBSA-N 448.573 4.315 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(O)cc1 101651330 MIRGMJHQJKSMSS-LDADJPATSA-N 428.282 4.422 10 10 IICE Cc1ccc(NC(=O)N(C)C)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 437906786 IDYPALHNUWTSTK-UHFFFAOYSA-N 447.583 4.448 10 10 IICE CC(C)(c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)cc1)C(F)(F)F 764795857 BPSNMXRYSQCXSU-SFHVURJKSA-N 447.501 4.158 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc([C@H]3CCCOC3)c2)c1 766447744 NOJUBAYYANYDNX-QHCPKHFHSA-N 443.547 4.325 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3nc(-c4sccc4C)ns3)CC2)cc1F 771267176 APIOEIPAAHMQGV-UHFFFAOYSA-N 433.534 4.077 10 10 IICE CCn1c(CNC(=O)N(C)Cc2ccc(N(C)C)cc2)nc2cc(Br)ccc21 790758481 DUAGJBARYLMQLZ-UHFFFAOYSA-N 444.377 4.226 10 10 IICE COc1ccc(SC)c(OC)c1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1125090359 QZYHCTORRXUVQB-UHFFFAOYSA-N 433.485 4.453 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)CC=CC1 1126658272 RBSBOWDNGOKLGZ-MRXNPFEDSA-N 436.499 4.051 10 10 IICE CSc1ncc(C(=O)NCc2ccc(N3CCSCC3)cc2)n1-c1ccc(F)cc1 1136281381 COHOUMZIUZZXQJ-UHFFFAOYSA-N 442.585 4.217 10 10 IICE O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cc2cc(O)c(O)cc2s1 1136639780 ZGFBHTMJCYAZTO-CYBMUJFWSA-N 433.327 4.084 10 10 IICE Cc1ccc2c(c1)C(=O)N(CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1)C2=O 1137816749 QJVFQHBAJARKKV-SFHVURJKSA-N 428.488 4.087 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(CCCCN2Cc2ccc(N3CCOCC3)cc2)C1 1138496052 NZIZMVAQYIQVDZ-RUZDIDTESA-N 429.605 4.279 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2csc(Nc3cc(F)cc(F)c3)n2)N(C)C)cc1 1158716296 ABZONOJTPUNPOO-HXUWFJFHSA-N 445.539 4.264 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cccc(C)c3Br)C2)cc1 1226402772 NKEYTBFWQRPNNG-INIZCTEOSA-N 432.362 4.092 10 10 IICE CCN1CCN(C(=O)Cc2ccc(NC(=O)c3ccc(-n4c(C)ccc4C)cc3)cc2)CC1 1265679161 LHFYEMNGSKSODD-UHFFFAOYSA-N 444.579 4.053 10 10 IICE C/C(=C\C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccccc1OC(F)F 1275224265 AHDHSEDNABVBFZ-GXDHUFHOSA-N 438.421 4.123 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1COCc2ccccc21 1276417833 GFZBXIRBKUQTNV-LVSMMTLPSA-N 444.603 4.117 10 10 IICE C[C@H]1CN(c2nnc(CCCc3ccccc3)n2CCCSc2nccs2)CCO1 1291275682 WVKDODWDKARNHS-SFHVURJKSA-N 443.642 4.317 10 10 IICE CC[C@](NC(=O)c1cc(C)n(-c2ccccn2)c1C)(C(=O)OC)c1ccc(Cl)cc1 1297721452 DHFHGCDTJFPXQN-HSZRJFAPSA-N 425.916 4.351 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1 1299479811 ZTFNYESOVDMXAL-HFZDXXHNSA-N 443.591 4.150 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 1299721968 XRMVNFQUASEENR-GOSISDBHSA-N 444.318 4.168 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC1(C)CCOCC1 1305383421 OZAOGYSMRMSFCU-HXUWFJFHSA-N 441.620 4.081 10 10 IICE CCc1nnc(N(C)CC(=O)Nc2c(C)cccc2C)n1CCCSc1nccs1 1306070837 HXZLRBLJYQOVGC-UHFFFAOYSA-N 444.630 4.171 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)Nc4ccccc4S3(=O)=O)c2C)c1 1307308933 DNAVZQXRVDKXKM-UHFFFAOYSA-N 437.521 4.130 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)sc2c1CC[C@@H](C)C2 1349305236 VCMQORUTIANCHC-JCCCHCCOSA-N 446.613 4.415 10 10 IICE CC[C@@H](C)NC(=O)c1ccc(CNC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cc1 1353815828 ISEUWCRPDYVOCK-QGZVFWFLSA-N 435.568 4.363 10 10 IICE Cc1cc(Cn2c(N(C)Cc3ccccc3O)nnc2[C@@]2(OC(C)C)CCOC2)cs1 1361083425 DDYKCOODLRAZFM-HSZRJFAPSA-N 442.585 4.079 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Oc2ccccc2Cl)nc1 1451916828 LIHWBLSFGHJHBQ-UHFFFAOYSA-N 440.883 4.438 10 10 IICE COc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)c(F)c2)cc1 1453986208 WDWDCORFQKLWCX-UHFFFAOYSA-N 434.511 4.392 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)C)C(=O)[C@H]2C)c(C)n1-c1ccccc1Br 1467323711 LFYCPMOIELZTHJ-QGZVFWFLSA-N 446.389 4.186 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(Br)cc(Br)c1 1467839807 FGUNJYSOFWYEBJ-UHFFFAOYSA-N 434.124 4.333 10 10 IICE COC(=O)C1CC2(C1)C[C@@H](NC(=O)c1cc(C)n(-c3ccc(OC)cc3)c1C)CCS2 1472273699 MKEKVYJLVFNVGM-JZGPVCMCSA-N 442.581 4.050 10 10 IICE COC(=O)c1ccc(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)cc1 1473903443 UJGAWAJARYKFOU-UHFFFAOYSA-N 434.492 4.136 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1=O 1478690516 ICTWOZUQBYZMGC-FDDCHVKYSA-N 440.563 4.175 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@H]1C(=O)Nc2ccc(Br)cc21 1525113826 QDLQTHAURSLDEA-LJQANCHMSA-N 442.357 4.134 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)cc1 1530325377 XQUYLVXLHYGXGF-QGZVFWFLSA-N 443.510 4.289 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)cc1 1538161335 VKATZUXVVBZTTI-JOCHJYFZSA-N 441.572 4.246 10 10 IICE C[C@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)[C@@H]1CCCO1 1538920457 TWFAVMJSGSCPST-CJNGLKHVSA-N 429.318 4.303 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCCCC2)nc1 1554175282 UPJJMKSOOFKSKD-UHFFFAOYSA-N 434.588 4.351 10 10 IICE Cc1ccc(C[C@@H](CO)NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)cc1 1556206518 UIXJOSJWCJXZBC-IBGZPJMESA-N 441.369 4.498 10 10 IICE COC1CCN(c2ccc(CN[C@H](CNC(=O)OC(C)(C)C)C3CCCC3)cc2)CC1 1559795645 KWBLBWNPBLFQCO-HSZRJFAPSA-N 431.621 4.475 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Cl)cc1Br 1566850032 VLRGSZOWMVXZOV-UHFFFAOYSA-N 447.112 4.277 10 10 IICE COc1cc(/C=C\C(=O)Nc2ccc3nc(N(C)C)ccc3c2)cc(Br)c1O 1583555731 JCRZENSEJBJRBB-WTKPLQERSA-N 442.313 4.429 10 10 IICE COc1nsc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1Br 1585261206 HVGQVZZGKSTTSD-UHFFFAOYSA-N 448.342 4.064 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc([C@@H]4CCC(=O)N4)cc3)cc2Cl)C1 1586083176 XALSSKDIJHIARK-IERDGZPVSA-N 425.960 4.457 10 10 IICE Cc1cc(S(=O)(=O)Nc2ccc(C(=O)N[C@@H](C)c3ccccc3O)cc2)ccc1F 1587446874 AKQPMDOJUMKPCX-HNNXBMFYSA-N 428.485 4.132 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)N(C)C)cc1 1616858096 HIRGCEKWSQEMAF-NRFANRHFSA-N 426.561 4.132 10 10 IICE Cc1cc(C(=O)N[C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c(C)n1-c1ccc(Br)cn1 1620754532 WMAXIBSACNLEDX-KFKAGJAMSA-N 432.362 4.185 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1ccc2ccccc2c1 1623929153 VITKEZICKPNYHX-HNNXBMFYSA-N 427.884 4.168 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(C[C@H]2C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1627209349 CQFSVAKDYDFCAQ-OFVILXPXSA-N 427.589 4.330 10 10 IICE O=C([C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631219169 OOCHJTWGKBWZOU-HRAATJIYSA-N 449.334 4.400 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC(=O)NCc3cc(Cl)cc(Cl)c3O)C[C@H]1C2 1638183084 BYMJYVDQYGBEDJ-NILFDRSVSA-N 444.359 4.286 10 10 IICE Cc1cc(C(=O)NCc2nc(CN(C)C)cs2)c(C)n1-c1ccc(Br)cc1 1638529966 CDLDOMFKTHJWQH-UHFFFAOYSA-N 447.402 4.305 10 10 IICE COc1ccc(C(=O)CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1[N+](=O)[O-] 1643419694 OJJJCEWBQYPGTP-UHFFFAOYSA-N 441.871 4.277 10 10 IICE COC1CCN(c2ccc(CN(C)Cc3cc4c(cc3OC(F)F)OCO4)cc2)CC1 1653428421 XZXRZYBVAJJIFI-UHFFFAOYSA-N 434.483 4.264 10 10 IICE COc1ccc2c(c1)OC(C)(C)CN(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)C2 1673745774 WLDQFROKHNQQPY-GOSISDBHSA-N 425.573 4.383 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCc2c(ccc(Cl)c2Cl)C1 1674712142 JFPRGEGPMHIQKH-UHFFFAOYSA-N 434.367 4.222 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(CCN4CCCC[C@H]4C)CC3)C2)cc1 1686854725 AOHGBOVRAXUWTD-FYYLOGMGSA-N 442.648 4.208 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@@H](COC)C2)cc1 1695619113 GLIKMEGGELVILJ-OAQYLSRUSA-N 434.588 4.016 10 10 IICE Cc1cccc(-c2nnc(N3CC[C@@H](OCC(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1724492929 JMQLSHZCUMNEHU-HSZRJFAPSA-N 448.615 4.323 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)NC(=O)OC(C)(C)C 1743567105 NBYBFXCPFMADEF-MRXNPFEDSA-N 431.581 4.437 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC(C(F)(F)F)CC2)cc1F 1747573236 XSDRXWWGASYNDU-UHFFFAOYSA-N 448.468 4.372 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCCCOC(C)C)CC2)cc1F 1748849757 XFFDUXNZRISLQU-UHFFFAOYSA-N 433.572 4.081 10 10 IICE C[C@@H]1COCCN1c1nnc(-c2ccccc2Cl)n1CCCSc1nccs1 1752411058 JWBKJTSQFJKNHF-CQSZACIVSA-N 436.006 4.463 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)N[C@H](C)CC)sc(C)c1-c1ccc(OCC)cc1 1860762536 JITQOSPGGAHLPZ-CYBMUJFWSA-N 432.542 4.152 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCc3cccs3)C(=O)N(C(C)C)C2=O)cc1 1873168582 AKUXFONUUAEYDY-UHFFFAOYSA-N 433.577 4.476 10 10 IICE CC(C)(C)OC(=O)N1CCC(CC(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)CC1 1891044155 RSWGHYYJOKZXIR-UNMCSNQZSA-N 427.589 4.329 10 10 IICE Oc1ccc(F)cc1Cn1nc(C2CC2)c(C(F)(F)F)c1I 2079834572 MLRRVDBFBVBIMY-UHFFFAOYSA-N 426.151 4.277 10 10 IICE Cc1cc(O)c([C@H](C(C)C)n2nc(C(F)(F)F)c(C(N)=O)c2Br)cc1C 2080033759 LWFCUQUSVRWZSK-ZDUSSCGKSA-N 434.256 4.331 10 10 IICE CC1=NN2C(=N)C(=Cc3cccc(OCCOc4cc(C)cc(C)c4)c3)C(=O)N=C2S1 2297310364 HSWYAQOQJVNFFQ-UHFFFAOYSA-N 434.521 4.400 10 10 IICE COc1ccc(-n2c(C)cc(C=C3C(=O)NC(=S)N(c4ccccc4F)C3=O)c2C)cc1 2297462933 GUBXMYPVOOVIDY-UHFFFAOYSA-N 449.507 4.073 10 10 IICE Cc1ccc(S(=O)(=O)Nc2cc(-n3nnc4ccccc43)c(O)c3ccccc23)cc1 39771589 SSFHEJQRBQUXAA-UHFFFAOYSA-N 430.489 4.389 10 10 IICE COc1ccc(N2CCN(c3nccc4ccc(C(=O)N5CCC(C)CC5)cc34)CC2)cc1 65001958 AJSPEBMCMMYBHQ-UHFFFAOYSA-N 444.579 4.442 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(NC(=O)C(C)C)cc4)CCC3)CC2)cc1 65029579 WKQGCNOFRMBJBU-UHFFFAOYSA-N 435.568 4.060 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3ccc(F)cc3)=NN2C(=O)COc2ccccc2C=O)cc1 72413297 FIHKZNRICDHTTD-DEOSSOPVSA-N 445.494 4.461 10 10 IICE CSC1=NSC2=NC(=O)/C(=C/c3ccc(OCc4ccccc4F)cc3)C(=N)N12 104372039 TZYMUYHRLVNMIO-JJJWLNEWSA-N 426.498 4.344 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3F)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526202232 ADPXIHWMVJHKNH-QFIPXVFZSA-N 437.423 4.311 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc(F)c(Cl)c2)cs1 727249624 DTOHIYSMHRBQOS-UHFFFAOYSA-N 443.865 4.320 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3ccc(Br)s3)cc2F)C[C@@H](C)O1 733922255 TWDWMCGBPURCNY-CHWSQXEVSA-N 441.366 4.122 10 10 IICE COc1ccc(NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1N1CCOC1=O 743230898 CULOFRJOXQAZDK-UHFFFAOYSA-N 448.523 4.424 10 10 IICE C[C@@H](C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)N1CCC(c2ccccn2)CC1 754352503 WYNIRQVTWYHUTF-KRWDZBQOSA-N 439.515 4.064 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)[C@H](OC3CCOCC3)c3ccccc3)ccc21 759844067 SQIPSSDMVCLUMO-AREMUKBSSA-N 441.483 4.337 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)CCO1 802691247 DEWVGWYGDLZUAD-FGZHOGPDSA-N 435.572 4.147 10 10 IICE CCOC(=O)c1sc([C@H](C)NC(=O)NCc2cc(Cl)cc(Cl)c2O)nc1C 805198794 SFEZAUBPIXNHNO-VIFPVBQESA-N 432.329 4.201 10 10 IICE Cc1cc(C(=O)N2CCC3(CCN(C)CC3)C2)c(C)n1-c1ccccc1Br 819926372 OLANVTDKIHNYSG-UHFFFAOYSA-N 430.390 4.415 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H]1CCc2ccccc2C1 914439559 KXGGBKPWFBSCSH-WFVLPUPGSA-N 442.631 4.403 10 10 IICE COc1ccc(N2CCCN(C(=O)C(F)(F)c3ccccc3Br)CC2)cc1 1125250912 ICTQRQDSOZRVSJ-UHFFFAOYSA-N 439.300 4.288 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(O)nc2ccccc12 1141815235 AMYOUYJXXAQHLC-UHFFFAOYSA-N 445.441 4.034 10 10 IICE O=c1c(Cl)c(NCc2ccc3cccnc3c2O)cnn1-c1ccc(C(F)(F)F)cn1 1163538599 KAVNBTQTBCGTOX-UHFFFAOYSA-N 447.804 4.166 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccc(Cl)s3)C2=O)c(C)n1-c1ccccc1 1188736337 LOTRCOIIYLPWNU-JOCHJYFZSA-N 441.940 4.459 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3ccc([N+](=O)[O-])cn3)c2C)cc1 1189014513 ROACYLYCFHEQLU-UHFFFAOYSA-N 425.466 4.159 10 10 IICE C[C@@H](NC(=O)NC[C@@](O)(c1ccccc1Cl)C(F)(F)F)c1ccc(N(C)C)cc1 1234554787 FIQRFJQMVVAHHN-BFUOFWGJSA-N 429.870 4.216 10 10 IICE COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1272047741 MDJSYWXFBZIGGU-HXUWFJFHSA-N 442.865 4.244 10 10 IICE CC(C)(C)OC(=O)NCCc1ccc2c(c1)CCCN2C(=O)/C=C\c1cncc(F)c1 1289668721 XKHVNABGBIZDMK-CLFYSBASSA-N 425.504 4.281 10 10 IICE Cc1nnc(N2C[C@@H](C(F)(F)F)O[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1290755497 PNHVJLPWJRNWPD-UZLBHIALSA-N 437.510 4.027 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(-c2ccc(F)cc2)c1 1297228129 AQGSBTREWYZSJD-UHFFFAOYSA-N 438.503 4.014 10 10 IICE CCOC(=O)c1c(NC(=O)CN(Cc2ccc(N(C)C)cc2)C2CC2)sc2c1CCC2 1307423427 FDCPXJSPUAUCOX-UHFFFAOYSA-N 441.597 4.083 10 10 IICE CCN1CCCC[C@H]1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1313909885 TXCONBDBKXAVFV-FQEVSTJZSA-N 425.602 4.147 10 10 IICE C[C@@H]1[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1350627949 DPWICQYLFDLOOO-GDBMZVCRSA-N 434.492 4.046 10 10 IICE CCOc1ncc(C)cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1436507423 ACOYIHCLYPCCIX-GZTJUZNOSA-N 445.541 4.158 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cn2c(-c3ccccc3)nc3ccccc32)N(C)C)cc1 1439962736 WVDOTKPSAVUKAQ-VWLOTQADSA-N 441.579 4.188 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1 1458276642 LNLHDZXZXSJJHL-OQFOIZHKSA-N 435.402 4.126 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1 1463775125 GKOGMBUFTPWEGY-GGAORHGYSA-N 427.976 4.364 10 10 IICE CC[C@@H](Nc1ccccc1)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1472518660 XNQLFJUCZVHRFP-FGZHOGPDSA-N 440.588 4.325 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)cn2C)n1C[C@@H]1CC1(C)C 1503487459 LBCLFKBCFUNGGE-HNNXBMFYSA-N 444.377 4.434 10 10 IICE CCC(CC)N1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@H](C)C3)CC1=O 1515518092 DAPOLPNJUDKJLS-LSDHHAIUSA-N 434.602 4.414 10 10 IICE COc1ccc2c(c1)CCN2C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1518985287 CWHWLXDSVDEBHX-XDHOZWIPSA-N 442.537 4.015 10 10 IICE COC(=O)[C@@H](C)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1525189281 ZDHFLJDIQWPIHJ-SFHVURJKSA-N 433.552 4.323 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@H]1C(=O)Nc2c(Br)cccc21 1531706976 YPBDNUIOWCTWIP-GOSISDBHSA-N 442.357 4.134 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)C(=O)c1ccc(Br)s1 1534009069 LDIYNCVQZWHFEJ-UHFFFAOYSA-N 440.274 4.107 10 10 IICE Cc1cc(C(=O)NCCCN2C(=O)c3ccccc3C2=O)c(C)n1-c1cccc(Cl)c1 1556514885 CHTFQCZWGBXDCK-UHFFFAOYSA-N 435.911 4.164 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc(Cl)cc(Br)c1O 1558975498 RLMLVNUPHBESTN-UHFFFAOYSA-N 435.499 4.206 10 10 IICE Cc1cc(CCNC(=O)NCc2ccc(N3CCCNC3=O)cc2)c(C)n1-c1ccccc1 1565140691 GQXFZZCPIKIHKX-UHFFFAOYSA-N 445.567 4.056 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H](c2nccn2C)C(F)(F)F)cc1 1565491875 UOMIVJNTRTWVHC-GOSISDBHSA-N 435.450 4.095 10 10 IICE Cc1cc(C(=O)NCc2ccc3cccnc3c2O)nn1-c1cccc(C(F)(F)F)c1 1570533999 ZVBKMHMUFJAHOA-UHFFFAOYSA-N 426.398 4.383 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)CC2(C)OCCO2)c(C)n1-c1cccc(Br)c1 1586802688 MUDDAPRQSZMIGY-AWEZNQCLSA-N 435.362 4.376 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(Oc4ccccc4)cc3)CC2)c(OC)c1 1587487301 ZADDTMOBCCYNEI-UHFFFAOYSA-N 448.519 4.224 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)cc1 1594572608 ACADRDQHXUIXGI-MHZLTWQESA-N 430.548 4.421 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(C(F)(F)F)c1 1616600046 RGFQBRPMAOIOCE-OAQYLSRUSA-N 447.501 4.217 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H]1Cc2ccc(C)cc2S1 1626511092 HUCLTXPDKMYOCF-HSZRJFAPSA-N 426.582 4.400 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@]23CCCN(C(=O)OC(C)(C)C)C3)cc1F 1627604671 NOXGBSHFNVAXAS-UUOWRZLLSA-N 433.568 4.325 10 10 IICE Cc1cc(CN(CC(C)C)C(=O)c2ccc(N=NC(N)=O)cc2)nc(N2CCCCC2)n1 1631962108 ITUXRBHGVFLFDU-UHFFFAOYSA-N 437.548 4.236 10 10 IICE COc1ccc([C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)c2ccc(OC)cc2OC)cc1 1633647805 VZZVVOCYZIKGQP-QFIPXVFZSA-N 448.479 4.394 10 10 IICE CCOC(=O)c1c(NC(=O)CN2[C@H]3CC[C@H]2[C@H](C)[C@@H](O)C3)sc(C)c1-c1ccccc1 1644016030 YEYPQQIHVLCXHA-QZHFEQFPSA-N 442.581 4.072 10 10 IICE CC[C@@]1(C(C)C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)C1=O 1652651336 QTIUUJZTOQJIIX-QHCPKHFHSA-N 447.482 4.235 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](C)c3nc(C(F)(F)F)cs3)C2)cc1 1680588818 LXHYTQNMIHSKTR-CHWSQXEVSA-N 428.480 4.057 10 10 IICE COC(=O)c1oc(CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1C 1681828660 WOVZVGZAGCUENA-AWEZNQCLSA-N 433.936 4.264 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCc1cc(-c2ccc(F)cc2F)on1 1686826237 DSDJXXAIPLKXPT-HNNXBMFYSA-N 428.483 4.425 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CCO[C@H](C(C)(C)C)C1 1693006387 XRXYPMSIICXSON-YADHBBJMSA-N 441.620 4.194 10 10 IICE CCC[C@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1695156001 POFPMTVVCQDSQA-DLBZAZTESA-N 437.635 4.164 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H]2CSC)n1Cc1ccc(N2CCOCC2)c(F)c1 1726984536 RETWBBZROAQTJE-MJGOQNOKSA-N 447.624 4.147 10 10 IICE CC[C@H](C)c1nnc(N(C)CCCC(=O)NC)n1Cc1ccc(N2CCC(C)CC2)cc1 1743583809 VWZZSYLOZQSEAI-FQEVSTJZSA-N 440.636 4.039 10 10 IICE COC[C@@H]1CCCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1749476362 RCVUZWITRAILNS-DENIHFKCSA-N 445.583 4.026 10 10 IICE CC[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)CCO1 1763459185 BHDUYZIJRGBMAI-JOCHJYFZSA-N 425.621 4.475 10 10 IICE CC[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1765122397 DBBSWEVHLKPKFX-FQEVSTJZSA-N 425.621 4.378 10 10 IICE CNc1cc(C(=O)O)c(Nc2ccccc2)c(F)c1NS(=O)(=O)c1ccc(OC)cc1 1857996919 OGRSYOSRFYURHI-UHFFFAOYSA-N 445.472 4.119 10 10 IICE CCOC(=O)N1CCC(N2C(=O)/C(=C\c3ccc(N(CC)CC)cc3)SC2=S)CC1 1858591667 USEYZLREIOHVHA-XDJHFCHBSA-N 447.626 4.355 10 10 IICE CC1=NN(c2ccccn2)C(=O)/C1=C/c1cc(Br)cc(Br)c1O 1865672817 MJHTWZBNMIOZLU-KPKJPENVSA-N 437.091 4.118 10 10 IICE CCN1CCc2cc([C@H](N)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999537489 ZMMOJRZVZPEBPT-GGAORHGYSA-N 425.573 4.179 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C2(C)CC2)c(I)c1N 2079951703 WXFIFIYFRAKKTN-MRXNPFEDSA-N 425.314 4.344 10 10 IICE O=C(NN1C(=O)C(=Cc2cccc(F)c2)SC1=S)c1ccccc1Br 2296048075 XZFWNQDHYHKFMF-UHFFFAOYSA-N 437.315 4.134 10 10 IICE COc1cc(C=C2C(=O)N(c3ccc(Br)cc3)N=C2C)cc(OC)c1OC 2297296558 DJJORHKATGMRML-UHFFFAOYSA-N 431.286 4.281 10 10 IICE Cc1[nH]c2ccccc2c1C=C1C(=O)NC(=S)N(c2cccc(C(F)(F)F)c2)C1=O 2297360912 ZFOOMFXBWKABDE-UHFFFAOYSA-N 429.423 4.326 10 10 IICE CCOc1cc(C=C2SC(=S)N([C@@H](C)C(=O)Nc3ccccc3)C2=O)ccc1O 2314836819 KPEQJKPFYQBLRI-ZDUSSCGKSA-N 428.535 4.019 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]3CC[C@H]23)c(O)c1Br 2352675942 LDKJXXRSNRLQQI-BZUAXINKSA-N 425.367 4.341 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3ccc(OC(=O)c4ccccc4F)c(Cl)c3)C(=N)N2O1 20236736 FNNHDCALAQPBCL-LGAXMMIFSA-N 425.803 4.149 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(NC(=O)c3ccccc3)C2=O)ccc1OC(C)C 40939846 QKYFFPZIYJVSOJ-UYRXBGFRSA-N 442.562 4.419 10 10 IICE CC(=O)N(C(=O)NCCCOc1ccc(Br)cc1Cl)c1ccc(N)cc1 217298819 KRXLWJFBIFFEGC-UHFFFAOYSA-N 440.725 4.216 10 10 IICE CC(C)N(Cc1cccc(F)c1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769046785 BXRLXTVHBGZROT-UHFFFAOYSA-N 438.591 4.478 10 10 IICE COCCOc1ccc(Br)cc1NC(=O)NCc1ccc(N2CCCC2)cc1 778289407 LLJXHSJRLMQNEU-UHFFFAOYSA-N 448.361 4.396 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 915619330 LENGCTKKNPVFDS-SFHVURJKSA-N 434.506 4.432 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(Cl)s3)cs2)cc1 917869543 ZEXBYMMVDDRXNC-UHFFFAOYSA-N 449.000 4.119 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(C)c1 1125769346 DJUWVRUHFMKJQQ-LDADJPATSA-N 430.526 4.373 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC(C)(C)c3cn(-c4ccccc4)nn3)ccc21 1126957180 DSOOJKBYNSJEPN-UHFFFAOYSA-N 431.540 4.150 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c(C)nn(-c4ccc(F)cc4)c3Cl)C2)cc1 1130185302 DLZHGCRTLHQZSE-INIZCTEOSA-N 442.922 4.238 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3sc(-c4ccn(C)n4)nc3C)c2C)c1 1132264405 PYCXJCFIKYRMPR-UHFFFAOYSA-N 433.581 4.427 10 10 IICE Cc1cnc(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)c(C)c1 1133376575 RQPMCRYCUUZMOR-YVLHZVERSA-N 431.608 4.058 10 10 IICE Cc1cc(C(=O)NCc2csc(N(C)C)n2)c(C)n1-c1ccc(Br)cc1 1148699111 ZNKDHTLVOZMTHP-UHFFFAOYSA-N 433.375 4.309 10 10 IICE Oc1ccccc1CN(Cc1cc2c(cc1Br)OCCCO2)C[C@@H]1CCCO1 1167983966 PTFHDFNWWMJJLF-SFHVURJKSA-N 448.357 4.497 10 10 IICE COc1ccc(N(CC(=O)Nc2nc(CN3CCC(C)CC3)cs2)C(C)C)cc1F 1168097381 VMSYZHJDPYDHMG-UHFFFAOYSA-N 434.581 4.376 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)c(C)n1-c1ccc(Cl)cc1 1264400828 XEQQSPOWKXIYFF-JOCHJYFZSA-N 439.943 4.190 10 10 IICE Cc1nc(Cl)ccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1270983868 YNBCUWYEBBDZNU-XNTDXEJSSA-N 435.933 4.413 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)CCCc1ccccn1 1289424318 UQFCHWVEHGMWRW-DEOSSOPVSA-N 448.615 4.406 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)c1C 1290916813 WQMUNWRKUHZGQO-UHFFFAOYSA-N 430.596 4.080 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccc(-c4ccc(C=O)cc4)cc3)c2)CC1 1293756466 VFBJEUBVBAIHKL-UHFFFAOYSA-N 427.504 4.120 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCS[C@@H](C(C)C)C2)cc1 1295420522 RJHCABHIFFUTDZ-RBBKRZOGSA-N 443.661 4.254 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1 1300279588 IFBCOBPLVZLMKM-VCSGRIEYSA-N 445.604 4.158 10 10 IICE CCOC(=O)c1csc(CCNC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)n1 1320624015 AJMHAVCRGGDLDS-UHFFFAOYSA-N 431.945 4.353 10 10 IICE COc1cccc(NC(=O)NCc2cc(Br)ccc2O)c1Br 1322779506 IXABAFVXZNMBRR-UHFFFAOYSA-N 430.096 4.248 10 10 IICE CCOc1ccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1355668720 IFOUXULUIIYHFM-UYRXBGFRSA-N 444.553 4.132 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@H](C2CCCC2)C1 1436907638 CSCAOKJUXZJIHS-NFBGKYEXSA-N 432.586 4.456 10 10 IICE Cc1cc(CNC(=O)[C@H]2CCCN(C(=O)COc3ccccc3)C2)c(C)n1-c1ccccc1 1438307314 YSCSZHNEUCNNSN-QFIPXVFZSA-N 445.563 4.028 10 10 IICE C[C@H]1CC(F)(F)CCN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1438485998 PIHSLWGZALFUMJ-GQVHDAKQSA-N 428.501 4.063 10 10 IICE CCOC(=O)[C@@]1(COC)CCCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1448188424 HLBFHWCWXVGYGX-DEOSSOPVSA-N 446.975 4.108 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](CC(=O)N(C)C)c3ccccc3)c2C)c1 1470208387 LNTNSZPBAVXNEV-XMMPIXPASA-N 432.568 4.421 10 10 IICE COc1ccc(N2CCN([C@@H](C)C(=O)Nc3cc(Cl)ccc3Cl)CC2)c(OC)c1 1473732818 PUTZCKVNEMHXAX-AWEZNQCLSA-N 438.355 4.160 10 10 IICE C[C@@H]1CN(c2nnc(C3CCC3)n2CCCSc2nccs2)C[C@@H](C(F)(F)F)O1 1494323964 TWIVINWSITTWGV-OCCSQVGLSA-N 447.552 4.341 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1500047901 VCKRZRDKNKULIE-HXUWFJFHSA-N 434.588 4.158 10 10 IICE CCn1cnnc1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C 1502237560 ATIYRCNKBFKSMC-UHFFFAOYSA-N 432.576 4.105 10 10 IICE CCOCc1nnc(N(C)CC2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1503019319 CHIFYUYRGRTTSU-UHFFFAOYSA-N 429.634 4.043 10 10 IICE CN(CCCn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)CC(F)(F)F 1517299323 XWORIYOXQISTFS-UHFFFAOYSA-N 439.526 4.237 10 10 IICE CC[C@H]1[C@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCN1C(=O)OC(C)(C)C 1525593829 MYNSMEMDIMMRGC-CTNGQTDRSA-N 448.519 4.436 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCN(C(=O)c4ccccc4)C3)cc2Cl)C1 1539911870 DCVYQPPDRAWRJA-GHTZIAJQSA-N 439.987 4.355 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Cl)ccc2O)NC(=O)OC(C)(C)C)cc1 1544269034 OXAZYKSJZIRLEF-GOSISDBHSA-N 433.936 4.107 10 10 IICE Cn1cccc1-c1nnc(N2CCSC(C)(C)C2)n1CCCSc1nccs1 1554350477 MFOAXDINRGINBT-UHFFFAOYSA-N 434.660 4.254 10 10 IICE COC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1556507293 OZBCUNDBEGWXGZ-HXUWFJFHSA-N 432.520 4.419 10 10 IICE COc1cc(N2CCN(c3ccnc(-c4cccc(Cl)c4)n3)CC2)cc(OC)c1OC 1559160906 HQQGBRIALIISFT-UHFFFAOYSA-N 440.931 4.149 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)OC(C)(C)C)C2 1564946553 RNYWVHDFGMHURP-OSZJIOELSA-N 444.620 4.079 10 10 IICE O=C(NCc1cccc(Br)c1O)C(F)(F)c1ccc(Br)cc1 1568606026 WEIPLCLJURQISM-UHFFFAOYSA-N 435.062 4.325 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(Cl)cc3Br)C2)cc1 1584444277 LPIBKNUKKDEUAK-CQSZACIVSA-N 437.765 4.296 10 10 IICE C[C@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CCC(F)(F)CC1 1586220694 AHPDOEPFKQNRHK-LBPRGKRZSA-N 442.418 4.314 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1(NC(=O)OC(C)(C)C)CCCC1 1588193231 PLPIZEQLPVXSRA-UHFFFAOYSA-N 441.366 4.341 10 10 IICE CC(C)c1nnc(N2CCN(Cc3cccs3)CC2)n1CCCSc1nccs1 1602871636 FGEZCBHJVUEWDT-UHFFFAOYSA-N 448.687 4.424 10 10 IICE C[C@H]1CCC[C@@]1(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1612751331 JYOUEHZEILKANV-ZHZLYBIUSA-N 442.604 4.090 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCC(C)(C)COC 1614011779 GTEQAKPUQZBYHW-UHFFFAOYSA-N 429.609 4.019 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@@H]2CSC)cc1 1615382707 DJMOIXCKIFNAFU-NHCUHLMSSA-N 429.634 4.356 10 10 IICE CC1CCN(C(=O)OC[C@@H]2CCCCN2C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1627096715 MGXBLOCJTWJCJZ-INIZCTEOSA-N 432.542 4.176 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCc2cc(Cl)c3c(c2)OCCO3)c1 1629074018 SOFVSIBTZQDWDK-UHFFFAOYSA-N 438.911 4.304 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3sc(-c4ccc(OC)cc4)nc3C)CC2)cc1 1630992331 LBRMENRWCLVSEO-UHFFFAOYSA-N 437.565 4.488 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)cc1 1631612831 ZONMZRQMFIESEX-OAQYLSRUSA-N 445.947 4.455 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cnn(C2CCC2)c1 1635925395 ULSALUUFOMRZDR-YBEGLDIGSA-N 432.596 4.290 10 10 IICE COC(=O)c1cnc(NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(Cl)c1 1639876488 JWGOEJXPYKHXIW-SFHVURJKSA-N 448.951 4.266 10 10 IICE CSc1ccccc1[C@@H](C)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1642857391 SBQKOLOUTVAOFN-OAHLLOKOSA-N 430.529 4.473 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4F)C3=O)c2C)cc1 1643679328 RWNZUTNVDFCTQL-RUZDIDTESA-N 433.483 4.192 10 10 IICE CCCN(Cc1ccccc1O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C 1644713251 FOGYZXGSMZLSHP-GMAHTHKFSA-N 428.573 4.101 10 10 IICE COCCO[C@]12CCC[C@@]1(NC(=O)c1cc(C)n(-c3ccc(Cl)cc3)c1C)CCO2 1648510632 OGPUHCZIKQJSCD-DHIUTWEWSA-N 432.948 4.180 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H](Cc3ccccc3)c3nc(O)n[nH]3)c2C)c1 1648699518 DTAZOSWDNOPRJL-JOCHJYFZSA-N 429.524 4.248 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1CN1CCC(O)CC1 1650779941 WOFFZXGBMZREQJ-UHFFFAOYSA-N 445.519 4.395 10 10 IICE C[C@H]1C[C@@H](C(C)(C)C)CCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1654615478 PGDJBVVVRTVVRG-PXCRPINLSA-N 433.612 4.202 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1O 1659474649 BRPDEPOILBBIDK-HNNXBMFYSA-N 446.897 4.261 10 10 IICE C[C@@H](NC(=O)NCc1ccc(CNC(=O)OC(C)(C)C)cc1F)c1ccc(N(C)C)cc1 1680281022 TVKWVFZZEHEACF-MRXNPFEDSA-N 444.551 4.477 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3=O)c2C)c1 1684599997 NMXSKEVPDCUWAI-VWLOTQADSA-N 444.579 4.345 10 10 IICE C#C[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1nnc(C)s1 1705479456 LVZAWCMUSGHNTD-MRXNPFEDSA-N 445.596 4.213 10 10 IICE C=CC1CCN(c2nnc(C(=O)NC(CC)CC)n2Cc2ccc(N(C)C)cc2C)CC1 1705775962 SFCTYWFXEZCBLD-UHFFFAOYSA-N 438.620 4.022 10 10 IICE C=CCCCCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1705804366 YRIPJBKXGUMTMK-UHFFFAOYSA-N 432.572 4.169 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1C 1706057312 FFVCKKWUKPKJTK-MJGOQNOKSA-N 434.588 4.114 10 10 IICE C[C@@H](C#N)CN(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1706080068 XOEYICANCGBVMO-YRISNDGFSA-N 442.583 4.046 10 10 IICE CCOCc1nnc(N(C)[C@@H]2CC[C@@H](SCC)C2)n1Cc1ccc2c(c1)CCCN2C 1710641438 XGKTYCPHLYJSLC-NHCUHLMSSA-N 443.661 4.356 10 10 IICE C[C@H]1[C@@H](C)SCCN1c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1726777057 ZOOZDFCAINRSKD-RRFJBIMHSA-N 425.649 4.099 10 10 IICE CCCCN(CC)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1728050959 ODAMBCWOYSBKAS-FQEVSTJZSA-N 429.634 4.010 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@H]3CCC[C@H]32)cc1 1728379295 QEYIQKFSKOTVBI-IFMALSPDSA-N 438.620 4.080 10 10 IICE CCN1CCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@@H]1C 1728615535 ZENNXTVYTGOREE-HNNXBMFYSA-N 432.619 4.016 10 10 IICE COc1ccc(N2CCN(c3nnc([C@@H]4CCCOC4)n3CCCC(C)C)CC2)cc1F 1730180917 WJKVIVXGFSNXLS-LJQANCHMSA-N 445.583 4.083 10 10 IICE C[C@@H](CN(C)C(=O)OC(C)(C)C)Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O 1741820934 LQWRVFMBBVAQBE-KRWDZBQOSA-N 443.592 4.391 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@H](C)[C@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1761678491 GMTMMMVWCNEJRF-IEBWSBKVSA-N 439.629 4.454 10 10 IICE CC[C@@H](C)N(C)CCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1763902193 FDQMXEIIEKAFHN-HXUWFJFHSA-N 440.636 4.001 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCCC(=O)NC 1765325995 SMDFIBQFEKIOHS-XFFZJAGNSA-N 434.588 4.281 10 10 IICE COC(=O)c1c(NC(=O)CCC(=O)N2CCCCC2)sc2c1CC[C@H](C(C)(C)C)C2 1866187648 CPDVGBDIAHGLGZ-HNNXBMFYSA-N 434.602 4.417 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4cc(Cl)ccc4Cl)[nH]n3)CC2)cc1 1873831340 GGPPSMPBAULMTC-UHFFFAOYSA-N 431.323 4.355 10 10 IICE Oc1c(F)cc(Br)cc1CN[C@H]1CN(Cc2ccccc2)C[C@@H]1C(F)F 1878709863 JUIBLRAMYVIULV-RDJZCZTQSA-N 429.280 4.149 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1ccc(O)c(O)c1 1952824460 BNFPPMNSVJBPMO-GBXCKJPGSA-N 445.471 4.495 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2CC2)c(C(=O)O)c1I 2078992701 RUCNDXJBPCBTJV-GFCCVEGCSA-N 426.254 4.077 10 10 IICE CCc1nn(Cc2cc(Cl)ccc2O)c(I)c1C(F)(F)F 2079684193 QLZILKZCXMZECB-UHFFFAOYSA-N 430.595 4.476 10 10 IICE C[C@H](C(=O)N1CCCC[C@H]1c1cccnc1)N1C(=O)C(=Cc2cccs2)SC1=S 2296551059 MZIJFTQMUGABSG-PBHICJAKSA-N 443.619 4.487 10 10 IICE COc1ccc(C2=NN(Cc3ccc(F)cc3)C(=O)C2=Cc2ccc3c(c2)OCCO3)cc1 2332127230 AIWJPGAHAFRZCS-UHFFFAOYSA-N 444.462 4.436 10 10 IICE Cc1ccc(CNC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2352639265 WGSHWVUHGUEZGH-AWEZNQCLSA-N 429.355 4.019 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](C(C)C)N(C)C(=O)OC(C)(C)C)c(O)c1Br 2381131735 ROVQNZWAZJQZJE-MRXNPFEDSA-N 443.382 4.313 10 10 IICE COc1cc(/C=C2/C(=O)N(c3ccc(C)c(Cl)c3)C(=O)N=C2O)c([N+](=O)[O-])cc1OC 33315616 XCRFHBBTLDWGKW-AWNIVKPZSA-N 445.815 4.081 10 10 IICE COc1ccc(-c2nc3c(s2)[C@H](NC(=O)NCc2cccc(OC)c2O)CCC3)cc1 745811949 IJQDSAGXWVLUMK-GOSISDBHSA-N 439.537 4.410 10 10 IICE C[C@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)c1csc(Cc2ccc(N)cc2)n1 751935726 CIYWKLGYNZOQAF-QGZVFWFLSA-N 449.576 4.300 10 10 IICE C[C@H](N[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Br)cc1O 757637833 MVSXXJLIKHZLHP-BLLLJJGKSA-N 431.309 4.218 10 10 IICE CCN(CC)c1ccc(CNC(=O)N[C@@H](c2c(C)nn(C)c2C)C(F)(F)F)cc1F 757886209 NMDHLTSVCDLXJB-SFHVURJKSA-N 429.462 4.125 10 10 IICE CCOC(=O)c1csc(C2CCN(C(=O)N[C@H](C)c3ccc(N(C)C)cc3)CC2)n1 759150318 RZGHPTPABPQQNC-OAHLLOKOSA-N 430.574 4.036 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(N3CCOC[C@H]3C)cc2)C1 766709627 JHVJVXXTIRASND-HXUWFJFHSA-N 446.595 4.272 10 10 IICE COc1ccc(O)c(CNC(=O)C(C)(C)[C@H](O)c2ccc(OCc3ccccc3)cc2)c1 778914899 OECDNRWJYABQOH-XMMPIXPASA-N 435.520 4.356 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)c1ccc(F)c(F)c1 791250586 SOWGNFILKRDURT-UHFFFAOYSA-N 446.494 4.316 10 10 IICE CC(C)C(=O)Nc1ccc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1 916672343 GVTPICHXLHWLOJ-IRXDYDNUSA-N 442.535 4.356 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1ccc(I)cc1 1124623664 WGJYRRORMACWLI-UHFFFAOYSA-N 434.321 4.093 10 10 IICE COc1ccc([C@H]2[C@H](C(=O)NCc3cc(C)n(-c4ccccc4)c3C)CCC(=O)N2C)cc1 1132267858 PIUKULANNAUEEL-RSXGOPAZSA-N 445.563 4.329 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](C(=O)Nc2cn[nH]c2)c2ccccc2)c1C 1137630448 YOHRVWMGIMRCOE-QHCPKHFHSA-N 427.508 4.235 10 10 IICE CC(C)[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)[C@H](C)NC(=O)OC(C)(C)C 1141803452 JFQFMLYTMALZFE-PXNSSMCTSA-N 435.634 4.041 10 10 IICE CCOC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cn1 1150272103 PVZYSIAAELLFGT-UHFFFAOYSA-N 443.301 4.076 10 10 IICE CC(=O)c1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1F 1189682292 AEKRHUQFOZAVQG-AWEZNQCLSA-N 438.952 4.397 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](Oc4ccncc4)C3)cc2Cl)C1 1235834887 RYYLGQDLUOJUEN-FXAWDEMLSA-N 428.964 4.334 10 10 IICE CO[C@H]1CCC[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1 1289511111 ZDKCBWPUYXFZQC-ZFWWWQNUSA-N 429.318 4.303 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OCCOC)C1 1294593413 LPJHYCQNBUXNRV-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(C(=O)c2ccccc2)c[nH]1 1297229016 YIGCEBSNKXABLY-UHFFFAOYSA-N 447.535 4.248 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1ccnc2ccccc12 1312983066 IDZDTWVXQRPTQC-UHFFFAOYSA-N 428.330 4.477 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)Cc2cscn2)cc1 1313677595 VMNMCWGWHGSTFD-UHFFFAOYSA-N 435.601 4.271 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@]2(C(=O)O)CCCN(Cc3ccccc3)C2)c1C 1346271835 AOJKYXAHQXZVHG-HHHXNRCGSA-N 445.563 4.252 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 1353229140 QZSXEFUMGMYLSJ-UHFFFAOYSA-N 433.512 4.019 10 10 IICE Cc1cc(CC(=O)N2CCN([C@H](C)C(F)(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 1444962202 WIESZICCYSWHEL-MRXNPFEDSA-N 427.898 4.385 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1c[nH]nc1I 1446808197 WBWJWINXFZNEDY-CYBMUJFWSA-N 447.276 4.124 10 10 IICE Cc1cc(C)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1O 1447380022 OFACZNIKDUZNJG-ZDLGFXPLSA-N 430.526 4.378 10 10 IICE Cc1cc(C(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)c(C)n1-c1ccc(C(C)C)cc1 1449710195 XTBLLJBARAMOJB-DEOSSOPVSA-N 428.598 4.258 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)Cc1ccc(Cl)cc1 1459384143 DLNWWUIKJPWPKM-ROUUACIJSA-N 447.982 4.231 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCN(C(=O)c3ccc(F)cc3)CC2)c1 1464025418 GBTVGOTYAZSUKD-UHFFFAOYSA-N 439.918 4.485 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H](c1ccc(F)c(F)c1)c1nccn1C 1470556389 TYTCGLMVFBYHGM-KSFYIVLOSA-N 441.526 4.093 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)[C@H]1Oc1ccccc1 1478472884 VUQRCDDFVZUICF-ISJGIBHGSA-N 437.584 4.443 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 1478841169 QKLVXJAFTHALAZ-LPHOPBHVSA-N 437.510 4.254 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@@]3(C)Cc3ccc(Cl)s3)cc2)CC1 1479185785 UBVBXJWIJWHHQO-QHCPKHFHSA-N 447.048 4.460 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(Cn3cccn3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1495436316 MIFDYTHYPNXIBJ-GOSISDBHSA-N 439.583 4.158 10 10 IICE CCCCN(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N2CCSCC2)cc1 1514433087 MYZHDOGHGPTETK-UHFFFAOYSA-N 436.629 4.102 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC(=O)N2CCc3ccccc32)cc1 1529217557 NXOSSCCJWBQDQX-UHFFFAOYSA-N 427.508 4.487 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2c(c1)OC(F)(F)O2 1531504172 PSGFFZCXGZXPLV-ZDUSSCGKSA-N 426.366 4.008 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1 1539309043 YHMUZPZBVDCFOG-QHCPKHFHSA-N 425.573 4.442 10 10 IICE Cc1ccc(C(=O)CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1C 1545632762 VIKQCYKCFQDVGH-OAQYLSRUSA-N 428.960 4.406 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)c(C)n1-c1cccc(Br)c1 1556147059 MRNYJANDSDJODL-OAQYLSRUSA-N 442.357 4.409 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccc(NC(=O)c2cccc(Br)c2)c1 1557084587 GPGZYUAWXVHFPC-UHFFFAOYSA-N 441.281 4.043 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccccc1OCc1cccc(Br)c1 1558175057 ZFGXREGSGNAJFI-UHFFFAOYSA-N 428.282 4.369 10 10 IICE C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1558723630 SOKOUFJDRXRONB-UQBPGWFLSA-N 446.595 4.330 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(N3C(=O)NC(C)(C)C3=O)c2)c1 1568222431 LOZAXSXOVGGLOT-UHFFFAOYSA-N 430.508 4.490 10 10 IICE Cc1cc(-c2nnc(N(C)C3CC3)n2CCCNC(=O)C(C)C)c(C)n1-c1ccccc1 1611933764 NSTUNGLUPMSBGA-UHFFFAOYSA-N 434.588 4.114 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(N3CCc4ccccc4C3)cc2)N(C)C)cc1 1618635203 GXSUNWCIRHQQHK-HHHXNRCGSA-N 442.607 4.348 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)N(C)C)cc1 1618643664 MHPFJOAUSOMWDQ-QFIPXVFZSA-N 438.959 4.206 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](O)c3cc(Cl)c4c(c3)OCCO4)c2C)c1 1622371028 OZXXJHKPVHYKHE-OAQYLSRUSA-N 440.927 4.291 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2ccc(C(F)(F)F)cc2)CCCC1 1625673699 DAOVGMRACDLDKL-QFIPXVFZSA-N 446.469 4.397 10 10 IICE CCOC(=O)[C@@]1(COC)CCCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1 1625851560 RWBGPQUYYKDMEB-QHCPKHFHSA-N 432.948 4.179 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2ccnc(NC(=O)C3CC3)c2)cc1 1628565026 DFWIXEFLSRGNQZ-UHFFFAOYSA-N 444.535 4.352 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc2ccccc2cc1NS(C)(=O)=O 1628951423 XJMXAPZNXAPXSR-UHFFFAOYSA-N 437.565 4.084 10 10 IICE Cc1ccc(C(=O)Nc2nc(-c3c[nH]c(C(N)=O)c3)cs2)cc1-n1c(C)cc(C=O)c1C 1632511622 FBABLGAWTDFHAB-UHFFFAOYSA-N 447.520 4.018 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2N(C(=O)OCc3ccccc3)CC2(C)C)cc1F 1633263430 IJITZHIZMWKFSX-QFIPXVFZSA-N 441.547 4.335 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2cccc(F)c2)c(C)n1-c1ccc(Br)cc1 1637718371 SHCAHOUCDXGZJN-HXUWFJFHSA-N 445.332 4.329 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NC(=O)c3cc4cc(O)c(O)cc4s3)C(C)(C)[C@H]21 1642991215 LHNJYZCVAYIFOT-VMDGZTHMSA-N 446.569 4.466 10 10 IICE Cc1cc(C(=O)N2CCC([C@H](O)c3ccnn3C)CC2)c(C)n1-c1cccc(Cl)c1 1646322037 RUHLVBWJFFBIQI-QFIPXVFZSA-N 426.948 4.067 10 10 IICE C/C(=C\c1ccccc1)CN(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1654137022 QOQNHBZIPDUKMI-WKTZDBDBSA-N 439.575 4.091 10 10 IICE CCCC1(CCC)CCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1660030772 DEMSGDXPBOBXBA-BGYRXZFFSA-N 433.612 4.490 10 10 IICE Cc1cc(CCNC(=O)N2CCOC[C@H]2C[C@H](O)c2ccccc2)c(C)n1-c1ccccc1 1674924261 NNIMZJGLGGYLTM-FTJBHMTQSA-N 447.579 4.171 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3)C2)cc1 1680824971 RQSNRJGPOWDTGB-HZPDHXFCSA-N 449.382 4.159 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 1682101670 UJKOQNJHYRMJJR-IHPCNDPISA-N 432.609 4.127 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@H](c4ccc(F)cc4Cl)C3)C2)cc1 1683339858 IATWEZAYSQLTSM-ZHRRBRCNSA-N 447.938 4.097 10 10 IICE CC[C@@]1(C)CC[C@@H](Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)O1 1708829371 MMZCWANFULJXCU-DHLKQENFSA-N 441.620 4.222 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC3CCC(OC)CC3)CC2)cc1F 1730180999 YGNNZLSESFQYDC-UHFFFAOYSA-N 445.583 4.081 10 10 IICE Cc1noc(C)c1CN(C)c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1742879248 FRXXWAYAULBDLI-MRXNPFEDSA-N 448.618 4.052 10 10 IICE CCc1nnc(N(C)Cc2nc(C(F)(F)F)cs2)n1Cc1ccc(N(C)C)cc1C 1744553031 ROMYHBWCENVLII-UHFFFAOYSA-N 438.523 4.375 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](CN3CCCCC3)C2)n1CCCSc1nccs1 1750730875 HKCRIADKNMZMSO-LJQANCHMSA-N 448.706 4.428 10 10 IICE C[C@@H]1C[C@H]1n1c(C2CCN(C(=O)OC(C)(C)C)CC2)nnc1N(C)Cc1ccccc1O 1752055768 SELWITIFXAPDHU-VQIMIIECSA-N 441.576 4.316 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)cc1C 1752742328 KCFLZYSPNDDUIG-WIYYLYMNSA-N 435.620 4.332 10 10 IICE CCC[C@@H](Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O)OC 1765581790 SOSZNXYVCAVEFD-QKNQBKEWSA-N 430.593 4.354 10 10 IICE CCc1sc(NC(=O)/C=C\C(=O)O)c(C(=O)OC)c1-c1ccc(Br)cc1 1865984324 ZOGDTWJWVGFMSB-HJWRWDBZSA-N 438.299 4.106 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCC4)nc(-c4ccc(C)cc4)n3)CC2)cc1 1867962804 SYDOIPVEZXQKPM-UHFFFAOYSA-N 429.568 4.387 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2(NCc3c(O)cccc3Br)CC2)C1 1967775690 NFOJSPCGQSSVSQ-AWEZNQCLSA-N 425.367 4.424 10 10 IICE COC(=O)c1c(C2CCC2)nn([C@H](c2ccc(OC)cc2O)C2CC2)c1Br 2080012212 LYZSADUARUFPJB-SFHVURJKSA-N 435.318 4.413 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@H](F)CNCc2cccc(Br)c2O)CC1 2106960650 ZQKNEIVJQYSQIG-MRXNPFEDSA-N 431.346 4.230 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)c1O 2236048568 FCVBNEDONOQGJK-CJNGLKHVSA-N 443.382 4.336 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c1O 2236056773 XIWOKXYAUMSXSK-ZIAGYGMSSA-N 443.382 4.146 10 10 IICE COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)C1=Cc1ccc([N+](=O)[O-])cc1 2294033981 FHUHNSYNOYEQFB-UHFFFAOYSA-N 428.828 4.134 10 10 IICE CC(C)(C)OC(=O)N[C@H]1[C@H]2C[C@@H](CN(c3ccc(OCc4ccccc4)cc3)C2)[C@H]1CO 2314471478 MJGDTIYRNXXENL-JVODISISSA-N 438.568 4.224 10 10 IICE Cc1ccc(CNC(=O)[C@@](C)(NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2352643599 QIESEFUIYNRSTP-IBGZPJMESA-N 429.355 4.019 10 10 IICE Cc1ccccc1C1=NN2C(=N)/C(=C\c3ccc(Br)cc3)C(=O)N=C2S1 3853262 LHOLAXIUBXKJCT-GDXBMZNVSA-N 425.311 4.425 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cc(Cl)cc(Cl)c4)c3N)CC2)cc1 40700890 JQPUFSVZSYBQKA-UHFFFAOYSA-N 445.354 4.444 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1cccn1-c1ccccc1 59249995 AQRIXVWVZDUFJJ-WJDWOHSUSA-N 426.259 4.451 10 10 IICE CCc1ccccc1N1C(=O)NC(=O)/C(=C/c2c[nH]c3ccc(Br)cc23)C1=O 103666377 APTZZSGCTNCJHI-SXGWCWSVSA-N 438.281 4.159 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1 304087407 WPYOZXGHSNSZSG-OALUTQOASA-N 434.458 4.218 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(Br)cc3)n2)cc1 392052681 QDHLKDFDNAJSKC-UHFFFAOYSA-N 425.329 4.382 10 10 IICE O=C(O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cccc(C(=O)O)c1O 687753324 KPVULTLEEJNGMR-NRFANRHFSA-N 447.443 4.145 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(OC)c(C)c3C)n2)cc1OC 735406930 HHOJMJVSNQSJGG-UHFFFAOYSA-N 434.539 4.254 10 10 IICE O=C(C[C@H]1CCOc2ccccc21)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 735431022 OTWJPPHOCJREDX-MRXNPFEDSA-N 434.458 4.115 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 742805149 HBVKOQXVDHCBHP-ZDUSSCGKSA-N 430.411 4.076 10 10 IICE CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c2ccccc21 802305776 TZVKODPRRBWZSJ-SXOMAYOGSA-N 447.623 4.490 10 10 IICE C[C@H](CC(=O)Nc1ccc(NC(=O)C2CC2)cc1)NCc1cc(Br)ccc1O 809712812 FPXKPFSOJDDWHE-CYBMUJFWSA-N 446.345 4.010 10 10 IICE CC(C)N(Cc1c(O)ccc2ccc(O)c(CN(C(C)C)[C@@H]3CCOC3)c12)[C@H]1CCOC1 812291641 PDUSBVVHWXLVGW-OYRHEFFESA-N 442.600 4.250 10 10 IICE O=C1/C(=C/c2ccc(-c3cccs3)cc2F)SC(=S)N1CCN1CCOCC1 917643239 WQGVYFGVIJTPIN-AQTBWJFISA-N 434.583 4.088 10 10 IICE CCOC(=O)[C@@H](C[C@H]1CCCO1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1133413102 RVTWIUCOSVZBJW-DENIHFKCSA-N 438.528 4.399 10 10 IICE COc1ccc(Cl)c(-c2cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)on2)c1 1134686824 XLSBVQBBIPTUGB-OAQYLSRUSA-N 442.947 4.102 10 10 IICE Cc1ccc(C(=O)N2CCC(Oc3ccc(F)nc3)CC2)cc1-n1c(C)cc(C=O)c1C 1154276638 YKRKEFDSFIVGJX-UHFFFAOYSA-N 435.499 4.433 10 10 IICE O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)NCc1c(O)cccc1F 1156169983 ANNKDYPILTZMEU-UHFFFAOYSA-N 430.505 4.297 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3nnc(-c4cccc(OC)c4)n3)c2C)cc1 1164620664 JHVMMHXLMCDNGW-UHFFFAOYSA-N 431.496 4.038 10 10 IICE Cc1cc(-n2c(C)cc(C(=O)CSc3nc(N)cc(N)n3)c2C)ccc1Br 1164637533 KCWWFKCQESMWPN-UHFFFAOYSA-N 446.374 4.094 10 10 IICE CCN(C[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)c1cc2ccccc2o1 1190528850 NBRSWAAEHZGUIW-OFNKIYASSA-N 437.584 4.007 10 10 IICE Cc1ccc(CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccc3c(c2)OCCO3)s1 1191722414 JDLGDUJYXHWXSO-FQEVSTJZSA-N 426.494 4.476 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC4(CCCCC4)CC3)cc2F)C[C@@H](C)O1 1193430686 OIWYYDPVTGTIRF-OYRHEFFESA-N 445.623 4.492 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@](C)(OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291532056 LIOHNQQZZKPESL-YADARESESA-N 443.661 4.398 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ccc(N2CCSCC2)cc1)C(C)(C)C 1291626289 GKCHFZNMICAHRZ-IBGZPJMESA-N 435.634 4.186 10 10 IICE Cc1cc(C(=O)N[C@@H](CC(N)=O)C2CCCCC2)c(C)n1-c1ccccc1Br 1294351674 FYNDGLNLBVNIKT-IBGZPJMESA-N 446.389 4.411 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)c(C)n1-c1cccc(Cl)c1 1295255020 YSGOLWKXJKWBAT-KRWDZBQOSA-N 427.854 4.031 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1ccc(C(N)=O)[nH]1 1306449141 CXLJCVKJGRBTNH-INIZCTEOSA-N 430.430 4.039 10 10 IICE Cc1ccccc1CCN(C)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307794650 PPLQHKOJGGRPMI-GOSISDBHSA-N 426.516 4.272 10 10 IICE COc1cc(CC2CN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)cc(OC)c1 1313132583 IVHVJXPUYBPVLZ-UHFFFAOYSA-N 433.552 4.495 10 10 IICE Cc1ccc2nc([C@@H]3CCCN3C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)[nH]c2c1 1313419935 WDXBYNBJFAENLF-GOTSBHOMSA-N 434.588 4.087 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc(C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1314612076 ZJVAWZKZJMTPSG-GOSISDBHSA-N 449.640 4.393 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1 1316376714 JBVXEQAASGUFGN-GOSISDBHSA-N 449.628 4.474 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc(Cc3ccccn3)n2C[C@H]2CCCCO2)cc1 1321327383 XEMBIPFMJCUWOD-XMMPIXPASA-N 448.615 4.316 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(c4cccc(Cl)c4)CCCC3)CC2)cc1 1442465697 DSOWQSJYNDCXNY-UHFFFAOYSA-N 442.003 4.099 10 10 IICE Cc1cc(C(=O)Nc2nnc([C@@H]3CCCO3)s2)c(C)n1-c1ccc(Br)cn1 1454994552 YELJHKSLILPILJ-AWEZNQCLSA-N 448.346 4.207 10 10 IICE COc1ccc(N2CC[C@H](CNc3ccc(F)cc3S(=O)(=O)C(F)(F)F)C2)cc1 1458443347 RWFQTLBGTVCIRN-CYBMUJFWSA-N 432.439 4.066 10 10 IICE CC[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(OC)cc1 1459864063 LLLLLNWRTDPNLG-HSZRJFAPSA-N 428.488 4.150 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@H]1CC(=O)NCc1ccc2cccnc2c1O 1469249145 MHLQBBZRIAFMDX-HXUWFJFHSA-N 433.508 4.439 10 10 IICE COc1cc(N2CCC[C@H](Nc3cccc(Br)c3)C2)c([N+](=O)[O-])cc1OC 1472774267 CAOJZLAQUZZFSY-HNNXBMFYSA-N 436.306 4.455 10 10 IICE COC1CCN(c2ccc(CN[C@H](C)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1473367139 ODVZJXKKMNTHQF-TZIWHRDSSA-N 431.621 4.427 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC[C@@H](C3CCC3)C2)n1Cc1ccc(N(C)C)cc1C 1495930516 CGZQKIKYICQYKO-GCJKJVERSA-N 425.621 4.467 10 10 IICE CC[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 1499765949 NFRYFZGSSZXRNJ-QFBILLFUSA-N 443.592 4.188 10 10 IICE CSC(C)(C)Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1519706455 MKDPODCVWMMKAE-UHFFFAOYSA-N 431.650 4.190 10 10 IICE CCO[C@H]1C[C@](NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1522685942 GXNLMAQVNGILEL-RDPSFJRHSA-N 446.975 4.153 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)cc2)cc1 1545813534 JHTVQPCNXGCOAF-AOYPEHQESA-N 433.527 4.150 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cc1 1557355483 GTKFQXNPONUJJZ-JOCHJYFZSA-N 447.620 4.454 10 10 IICE C[C@H]1CN(C(=O)CSc2ncc(-c3ccccc3)n2CC(F)(F)F)CC(C)(C)O1 1559366196 MSFZHZJWJOWAIV-AWEZNQCLSA-N 427.492 4.230 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(CS(=O)(=O)c2ccc(C)cc2)cc1 1568735824 KKMQGRCOZFDXLR-UHFFFAOYSA-N 444.549 4.090 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(OCc4ccccc4)ccc3O)C2)cc1 1570563525 SBSJDQSCTHZHRX-HXUWFJFHSA-N 432.520 4.236 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(C)c(Br)ccc4[nH]3)CC2)cc1 1594798808 CHGDLVZTJAPDLT-UHFFFAOYSA-N 428.330 4.210 10 10 IICE Cc1nc(N)c2c(C)c(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)sc2n1 1595385257 MASQEDYWFYTOIQ-UHFFFAOYSA-N 435.553 4.392 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 1597088748 AGFCALLOSKGZTO-TZIWHRDSSA-N 446.588 4.327 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)cc1C 1617528402 SHOAKQGAWBEFBU-AZUAARDMSA-N 431.650 4.173 10 10 IICE CN(CC1CCOCC1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1618140812 YXBAUKUEUIDXIY-QGZVFWFLSA-N 437.635 4.021 10 10 IICE O=C(Nc1ccc(F)c(Cl)c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1624049194 MPZIOBCTCXEKJD-UHFFFAOYSA-N 426.878 4.299 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc(CNC(=O)OC(C)(C)C)n(C)c2C)cc1 1624541103 JBQJRKRGWNHNBT-UHFFFAOYSA-N 442.604 4.477 10 10 IICE CC1(C)CN([C@H](CNC(=O)c2ccc(N=NC(N)=O)cc2)c2ccc(Cl)cc2)CCO1 1628668711 BQGJXEQYWFFUNE-LJQANCHMSA-N 443.935 4.084 10 10 IICE Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CCCN3C)C2)c(C)n1-c1cccc(Br)c1 1629819312 QQUMNWKVVCNNRU-LAUBAEHRSA-N 430.390 4.413 10 10 IICE CN(Cc1ccccc1O)C(=O)c1cnc(CC2CCN(C(=O)OC(C)(C)C)CC2)s1 1629954768 CBOJALFHTMDXCD-UHFFFAOYSA-N 445.585 4.311 10 10 IICE Cc1ccc(C(=O)NCc2ccc(CN3CCCC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1630729974 DFXVIKJPEZMPKS-UHFFFAOYSA-N 443.547 4.267 10 10 IICE COc1ccc(Br)c2[nH]c(C(=O)NCc3ccc4c(c3)CCCN4C)cc12 1631322060 AXEVUWAZBARBJP-UHFFFAOYSA-N 428.330 4.251 10 10 IICE COc1cccc([C@H](O)CN(Cc2ccccc2)C(=O)c2ccc(N=NC(N)=O)cc2)c1 1633382317 PJRFXCCWZGUALV-JOCHJYFZSA-N 432.480 4.234 10 10 IICE Cc1ccc(C(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1634312686 VPKJCSBWKSYVKZ-JOCHJYFZSA-N 443.547 4.340 10 10 IICE Cc1cc(C(=O)NC[C@H](O)COc2ccccc2)c(C)n1-c1cccc(Br)c1 1635828027 XUSVRJWHOJUJPK-IBGZPJMESA-N 443.341 4.026 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)COCc4nccn4C)n3)c2C)cc1 1641097491 NLJNLYCZTYHOBF-UHFFFAOYSA-N 435.553 4.415 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(C)c3ccc(C(C)(C)C)cc3)cc2F)C[C@H](C)O1 1641568791 FPCTURMQGCKEEK-OALUTQOASA-N 441.591 4.489 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN(Cc1ccccc1O)C[C@@H]1CCCO1 1642199963 PWXKBYYDNPIHPE-HNNXBMFYSA-N 427.419 4.362 10 10 IICE Cn1cc(C(=O)N2C[C@H](CCNC(=O)OC(C)(C)C)c3ccccc32)c(-c2cccnc2)n1 1645385697 XKRSLUAHLPXQLX-SFHVURJKSA-N 447.539 4.141 10 10 IICE COc1cc(OC)c(NC(=O)CCN(Cc2ccc(N(C)C)cc2)C2CC2)cc1Cl 1653191407 XYEOGXOAGSMHNS-UHFFFAOYSA-N 431.964 4.416 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@H]2[C@@H](C)CO)sc(C)c1-c1ccccc1 1654194445 PRSBUNHKDVZAPZ-LPHOPBHVSA-N 444.597 4.322 10 10 IICE COC(=O)[C@@H](c1cccc(Cl)c1Cl)N1CCN(c2ccc(OC)c(F)c2)CC1 1657763464 HZTLIZIPVCERCN-LJQANCHMSA-N 427.303 4.177 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC(=O)NCc3c(O)ccc4c3CCCC4)CC[C@H]2C1 1673507665 CTWRNXUEHDBFKV-IPMKNSEASA-N 443.588 4.106 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC2(CC1)CCN2C(=O)OC(C)(C)C 1683254544 PZEKGMLMLWFQAW-LJQANCHMSA-N 444.620 4.177 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)[C@H](C)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1707275079 WQIWPFKECCZWSD-LJQANCHMSA-N 434.588 4.066 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1scnc1C 1710646838 LEHWIHVKFJSYFD-UHFFFAOYSA-N 440.617 4.059 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc2c(c1)CCCN2C 1712515683 CUUZBXJKGZFPPH-XUVXKRRUSA-N 441.620 4.058 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCO[C@@](C)(CC)C2)cc1 1728378675 CVHCDIVPHMFDEY-VWLOTQADSA-N 436.604 4.183 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1C[C@@](C)(O)c1cccs1 1729420520 SNZKQEIGURBBMV-HSZRJFAPSA-N 426.586 4.322 10 10 IICE COc1ncccc1Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1730348463 ACQBOWJOVAAXPL-UHFFFAOYSA-N 434.588 4.264 10 10 IICE CCN(CC)[C@@H](Cn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O)c1ccco1 1764929239 UGAYXZTUPNKVEG-NRFANRHFSA-N 448.571 4.302 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1C[C@H](c1cccs1)N(C)C 1767112327 XXHGVNASXJZRSB-LJQANCHMSA-N 434.569 4.047 10 10 IICE Cc1c(Cl)cccc1NC(=O)COc1cccnc1NC(=O)Oc1ccc(N)cc1 1858681568 GRBOSMGLBMZPNH-UHFFFAOYSA-N 426.860 4.254 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)[C@H](C)C(=O)N4)cs2)cc1 1859574336 XNYOCNVWIYVTCF-LBPRGKRZSA-N 429.523 4.065 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)C3CCN(C(=O)C4CCCCC4)CC3)cccc21 1860585887 DOGJRDUMTGCXJR-UHFFFAOYSA-N 444.531 4.219 10 10 IICE CCN1CCc2cc([C@H](NC)[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044754979 RSVJHOMFXVIURK-UPVQGACJSA-N 439.600 4.440 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3C[C@H]2CN(Cc2ccccc2)C3)cc1Br 2160692395 ZVUAZQYJZMHLJL-PXNSSMCTSA-N 427.342 4.258 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccco2)SC1=S)Nc1ccc(Br)cc1 2296885259 LQKUEPCTPIUZMP-UHFFFAOYSA-N 437.340 4.272 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3ccc(N(C)C)cc3)SC2=S)N(C)C)cc1 2323879880 NFVZGIWLHBONSY-HXUWFJFHSA-N 441.622 4.265 10 10 IICE CC[C@@H](NC[C@H]1[C@@H]2C[C@H]1CN2C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2333093372 YZEGDZOJHWIRRX-DXEWXGHRSA-N 425.367 4.451 10 10 IICE CCOc1ccc(N2C(=O)N=C(O)/C(=C/c3cc(Cl)c(OC)c(OC)c3)C2=O)cc1 59861313 XUJUIJCNGKJPNB-DHDCSXOGSA-N 430.844 4.263 10 10 IICE CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C/c1cc(C)n(-c2ccc(C)cc2C)c1C 101673688 YGEKZOILJUTKIO-PXLXIMEGSA-N 436.552 4.420 10 10 IICE CCNC(=O)N(C)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 477642786 YCVBCCSBTNOXST-UHFFFAOYSA-N 447.583 4.212 10 10 IICE COC(=O)c1csc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1C 618129561 GMIDSTBMSUEOFW-UHFFFAOYSA-N 425.554 4.203 10 10 IICE COc1ccc(-n2cnnc2SCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cn1 728794185 IOLZLNSVZWVCAC-UHFFFAOYSA-N 437.500 4.193 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)c1 782081737 KAHKWMWMBQVZQK-LBPRGKRZSA-N 437.418 4.125 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)OCCCc3nc(-c4ccncc4)no3)c2C)cc1 913235503 YGNNNSGSDDNYHO-UHFFFAOYSA-N 432.480 4.337 10 10 IICE COc1cc(C)c(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1OC 916669541 CMXRUSGXTWAUAO-HZPDHXFCSA-N 431.508 4.087 10 10 IICE Cc1cc(=O)oc2cc(OCC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)ccc12 1131781764 NLTXCLVHKRXPOC-UHFFFAOYSA-N 430.504 4.247 10 10 IICE CCc1ncc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)s1 1134750567 FBVWOJNBGJVVIP-UHFFFAOYSA-N 428.315 4.430 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCNC(=O)C[C@H]3c3ccccc3)c2C)c1 1234325203 BDYNDIKJJIYOSI-DEOSSOPVSA-N 430.552 4.175 10 10 IICE CC1(C)CC[C@H](CNC(=O)NCc2cccc(Cl)c2O)N(C(=O)OC(C)(C)C)C1 1234515292 LEMMAKWRFDFRCG-OAHLLOKOSA-N 425.957 4.271 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2ccc(NC(=O)C(F)(F)F)nc2)c1C 1299112712 IBRCRYURTXOVRP-UHFFFAOYSA-N 430.430 4.228 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)CC[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)n1 1304750012 OETURABISCCLCB-SJLPKXTDSA-N 439.583 4.018 10 10 IICE COc1cc([N+](=O)[O-])ccc1OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 1307297894 QJDOZEGRGMHHCF-UHFFFAOYSA-N 438.436 4.044 10 10 IICE COc1ccc(N2CCN(C(=O)NC/C=C/c3ccc(Br)cc3)CC2)cc1F 1312754317 FACXPHFZKBZYQN-NSCUHMNNSA-N 448.336 4.142 10 10 IICE COc1cccc([C@@H]2C[C@H](C)CN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1312833146 FVOITCZUQASGTN-AOMKIAJQSA-N 445.510 4.103 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N(Cc1ccccn1)C1CC1 1351596545 MBFQDYPGSKPKQP-UYRXBGFRSA-N 441.553 4.003 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](c3ccncc3)C3CCCCC3)cc2F)CC1 1360093368 CSSZUCRKWAOGPC-VWLOTQADSA-N 438.591 4.343 10 10 IICE C[C@H]1c2ccc(C(=O)N(C)Cc3ccc(N(C)C)cc3)n2CCN1C(=O)OC(C)(C)C 1440661731 GZDOYWUIOYXBJB-KRWDZBQOSA-N 426.561 4.138 10 10 IICE O=C(Cc1csc(CCC(F)(F)F)n1)N(Cc1ccccc1O)C[C@H]1CCCO1 1446569055 RSXMNABICRDDFL-MRXNPFEDSA-N 428.476 4.094 10 10 IICE Cc1nccc(N[C@@H]2COCC[C@@H]2NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)n1 1457080265 MMQRLZPIIFTAEE-BJKOFHAPSA-N 447.583 4.315 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)C[C@@H](O)COc2ccccc2C(F)(F)F)c1O 1473161701 ZPMCTWXNQKLDRI-OAHLLOKOSA-N 431.838 4.139 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@H]1CCCSC1 1503488374 UYKMOLJHFGVOPJ-OAHLLOKOSA-N 429.977 4.479 10 10 IICE CCOCc1nnc(N2CCC[C@](C)(OC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1516543198 MGOCDKKVLIWQAI-VWLOTQADSA-N 441.620 4.105 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(c4c(F)cccc4F)CCC3)cc2F)C[C@@H](C)O1 1516811678 FKXIPEIBIUBYRX-IYBDPMFKSA-N 432.486 4.456 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)c2cccc(Br)n2)CCCC1 1523970001 PEURVILVIBROSY-UHFFFAOYSA-N 428.330 4.349 10 10 IICE CN(C)c1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1526093975 QZAMAEXDZCGKBV-AQTBWJFISA-N 429.542 4.122 10 10 IICE Cc1c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc(C(F)(F)F)c1F 1527864969 ZUIDDMXXBDSKCT-UHFFFAOYSA-N 432.364 4.198 10 10 IICE CC(C)(C)OC(=O)[C@@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(C)(C)C 1545632273 HCXXDDGSIPWTBN-IEBWSBKVSA-N 438.996 4.130 10 10 IICE COc1ccc(N2CCC(NC(=O)C[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1546187830 AVTUHUUZDRPCCV-IBGZPJMESA-N 447.620 4.357 10 10 IICE O=C(Cc1ccc(Br)c([N+](=O)[O-])c1)NCc1cc(Cl)cc(Cl)c1O 1556884995 QKFGITUJRNPHTP-UHFFFAOYSA-N 434.073 4.229 10 10 IICE C[C@H](NC(=O)[C@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1)c1ccccc1O 1557967498 FHUIIVVPBBHHIT-SCLBCKFNSA-N 449.320 4.166 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccc(NC(=O)c2cccc(Br)c2)c1 1558174673 RRCANGVFXSOZKN-UHFFFAOYSA-N 441.281 4.043 10 10 IICE CCc1c(C(=O)NCc2c(O)ccc3ccccc23)nnn1-c1ccc(OC(C)C)cc1 1558554056 ISBVUIVPJKMVRY-UHFFFAOYSA-N 430.508 4.406 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1noc2ccc(Br)cc12 1585263726 GZFDOCXAJMHCCM-CQSZACIVSA-N 430.346 4.255 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCC[C@@H](O)C1 1603303953 XFEZSQKBLOCHCJ-FYYLOGMGSA-N 425.621 4.264 10 10 IICE CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)N2C(=O)c1cc2cc(O)c(O)cc2s1 1622558688 IJSVLASWNNVBEJ-GOOCMWNKSA-N 432.542 4.363 10 10 IICE CC(C)[C@H](NC(=O)OC(C)(C)C)C(C)(C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1624538112 WWGQWGTWRQGZHV-NRFANRHFSA-N 447.620 4.057 10 10 IICE Cc1c(Br)ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c1N 1627205353 ODYYVSSZCKYMFI-GOSISDBHSA-N 446.389 4.227 10 10 IICE CC(C)Cc1ncc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)s1 1628495584 MXXVALCCJOCDSV-SFHVURJKSA-N 446.617 4.403 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cc(Br)c(N)c([N+](=O)[O-])c3)c2)CC1 1629641045 QDEPSBXMWIMQQQ-UHFFFAOYSA-N 433.306 4.428 10 10 IICE CCOC(=O)NCCC(=O)N[C@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1641203075 USLOGYOFYRYNHD-SFHVURJKSA-N 437.462 4.434 10 10 IICE C[C@@H]1CSCCN1c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N(C)C)c(F)c1 1649569549 MLZBWKRRMLIZFX-CQSZACIVSA-N 446.983 4.189 10 10 IICE Cc1cc(Br)cc(C)c1N1CCC[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1 1651005856 OGCUIQJJIRFPPL-CQSZACIVSA-N 437.309 4.015 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)N(C)C)cc1 1653421825 SQKFDUVRESIUEU-LEWJYISDSA-N 448.652 4.143 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] 1675595458 UUXSYLCLWGRAJD-UHFFFAOYSA-N 447.333 4.299 10 10 IICE Cc1cc(CCNC(=O)NCCNc2ncccc2C(F)(F)F)c(C)n1-c1ccccc1 1687216550 AITIFJSKAHRZRL-UHFFFAOYSA-N 445.489 4.462 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCCCC2)n1Cc1ccc2c(c1)CCCN2C 1694340500 MEHPAAJHMFKXKE-UHFFFAOYSA-N 438.620 4.008 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCOCC3(CC3)C2)cc1 1695623722 FNXPROIXYWLSFJ-UHFFFAOYSA-N 425.621 4.378 10 10 IICE Cc1cc(-c2nnc(N3CCNC(=O)CC3)n2CCCC(C)C)c(C)n1-c1ccccc1 1707274272 FYFNTCTXKVGFNI-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN3CCCC[C@@H]3C2)cc1 1710026695 NKGUJPGNRKWBNZ-HSZRJFAPSA-N 438.664 4.436 10 10 IICE C[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@H](C2CC2)O1 1726704935 RSAHTCRNPACPKX-IIBYNOLFSA-N 429.584 4.124 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@@H]1CCCCC1(F)F 1747754614 UEVGDWKNVYEKAG-IBGZPJMESA-N 427.499 4.431 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnccn1 1749663259 XRHAKAAWJHBCDS-UHFFFAOYSA-N 445.571 4.206 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C2CCC2)nnc1N1CCC(C(=O)C(F)(F)F)CC1 1751432231 BIAPHAVYCCMDSC-UHFFFAOYSA-N 449.521 4.316 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@H]1CCCCO1 1767770644 VGYOPZQDEIMMIH-JOCHJYFZSA-N 427.593 4.010 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3Cc3nc(C)cs3)CC2)cc1 1768703667 SLWMVKRBLGOSIB-UHFFFAOYSA-N 440.617 4.114 10 10 IICE COC[C@@H]1CCCCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1770892274 PBXHMQHYDAJPOU-OAQYLSRUSA-N 425.621 4.160 10 10 IICE Cc1cc(C)c2[nH]cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c(=O)c2c1 1866079468 YVPBBZCFUJIGIB-XMMPIXPASA-N 446.595 4.168 10 10 IICE C[C@H](NC(=O)C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1O 2017516786 MLSVRBFCYPBXOB-HKUYNNGSSA-N 428.529 4.070 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2CC2)c(C(=O)OC)c1I 2078992378 NRELWNCXZNLEAD-CYBMUJFWSA-N 440.281 4.165 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1csc(=NCc2cc(Br)ccc2O)[nH]1 2082941383 FZTHKJHVDIBWHL-SNVBAGLBSA-N 428.352 4.231 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1C[C@](F)(CNCc2cc(Br)cc(F)c2O)C1 2115597486 VJLBJUHDOJKPCJ-MXXVBZNESA-N 435.309 4.026 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccc(OCc2ccc(F)cc2)cc1 2313557338 AONZLDNVYTYTSN-UHFFFAOYSA-N 434.398 4.210 10 10 IICE COc1ccc(C2=NN(Cc3ccc(C)cc3)C(=O)C2=Cc2ccc(O)c([N+](=O)[O-])c2)cc1 2332144889 WZVMWQCEZZRWEX-UHFFFAOYSA-N 443.459 4.448 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CNCc2ccc(Br)cc2O)C[C@@H]2CCC[C@@H]21 2335106061 QSXSPZMCFWKJFC-JQFCIGGWSA-N 425.367 4.422 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(C(=O)NCc4ccccc4)CC3)c2C)cc1 22007669 GHLQFKGPRJHVNZ-UHFFFAOYSA-N 445.563 4.271 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CCCN(c3nccnc3Sc3ccccc3)C2)cc1 33168873 UVKDVJJWDGYVHF-FQEVSTJZSA-N 447.608 4.227 10 10 IICE COc1ccc(CNC(=O)[C@H]2Cc3ccccc3CN2Cc2cc(Cl)ccc2O)cc1 36217827 CFXGIXJFTWXUCK-HSZRJFAPSA-N 436.939 4.298 10 10 IICE COC(=O)c1ccccc1N1C(=O)C(O)=C(c2ccc(F)cc2)[C@@H]1c1ccc(O)c(O)c1 526480945 PCLCJRJDOPXMRP-NRFANRHFSA-N 435.407 4.081 10 10 IICE O=S(=O)(Nc1ccc(O)cc1Cl)c1ccc(Br)cc1Br 710360560 XSLRUSSFNHLNDN-UHFFFAOYSA-N 441.528 4.371 10 10 IICE Cc1cc(CCNC(=O)C[C@@H](c2ccccc2)N2CCOC2=O)c(C)n1-c1ccccc1 728265328 KEIBIJAANIRLLZ-DEOSSOPVSA-N 431.536 4.336 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCC(N4c5ccccc5C[C@@H]4C)CC3)CC2)cc1 728751099 IDTKHEMAOPYWJJ-FQEVSTJZSA-N 448.611 4.289 10 10 IICE O=C1/C(=C/c2cnn3ccccc23)SC(=S)N1C1CCN(Cc2ccccc2)CC1 729688385 WTCUNRUYKDNLHP-STZFKDTASA-N 434.590 4.200 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 745448177 UDUYIGOOLCDRJJ-UHFFFAOYSA-N 448.489 4.153 10 10 IICE C[C@@H](N[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cc([N+](=O)[O-])ccc1O 756646239 KAQUSHFCIPJBOL-ZYHUDNBSSA-N 430.814 4.297 10 10 IICE CC[C@H](C)n1ncc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 790676575 KONFNNCYYIDJON-KKSFZXQISA-N 443.592 4.224 10 10 IICE COc1ccc(Cl)cc1CNC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1 793563076 YOJZXAKUMWKIHX-UHFFFAOYSA-N 430.932 4.032 10 10 IICE Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799934422 YEHDJOQGVVUWMT-CVEARBPZSA-N 432.012 4.357 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)cc(OC)c1OC(C)=O 814275775 KFDGCFLBLAOJQX-WQRHYEAKSA-N 429.519 4.343 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1125187357 DNQDZMIAFPQBFM-GASCZTMLSA-N 447.482 4.077 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cccc(CS(C)(=O)=O)c2C)CCCC1 1126234014 HGHTWIQPKKMUAY-UHFFFAOYSA-N 440.565 4.020 10 10 IICE COC(=O)COc1cccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1128490148 POSMHLGDUSAWEO-INIZCTEOSA-N 430.932 4.058 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCc3ccn(-c4ccc(F)cc4)n3)c2C)cc1 1137000026 FEYRVXRUIWYVQC-UHFFFAOYSA-N 432.499 4.400 10 10 IICE Cc1ccc([C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C2CC2)cc1 1141272775 DUGGFZZKJYBBQA-OAQYLSRUSA-N 442.562 4.444 10 10 IICE Cc1ccc([C@@](O)(CC(=O)Nc2c(-c3ccccn3)nc3ccccn23)C(F)(F)F)o1 1160564025 VLULUKFWPCVYFH-FQEVSTJZSA-N 430.386 4.076 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H](c3ccccc3)[C@@H](O)c3ccccc3)C2)cc1 1230858822 NSKIGOZBKYKNIK-SDUSCBPUSA-N 431.536 4.048 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn2ccnc12 1274215292 SMCIPVKFHJISRM-BOPFTXTBSA-N 440.525 4.012 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)c1 1292166397 MMWCVZVKYAXDNW-HSZRJFAPSA-N 445.563 4.241 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H](NC(=O)OC(C)(C)C)c1cccc(Cl)c1 1293953275 HNEQCAXHTQZBFK-HXUWFJFHSA-N 445.947 4.397 10 10 IICE O=C(Cc1cccc(Br)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294860672 WOJFJUKRPCSTQX-SFHVURJKSA-N 437.765 4.131 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])c2)CC1 1296012889 JLDPPBXLXNWBBI-UHFFFAOYSA-N 436.434 4.396 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CC(=O)N(CCC(F)(F)F)C2)cc1 1298055807 BJUFGCOKGQSSLF-UHFFFAOYSA-N 433.434 4.362 10 10 IICE CC(C)(C)c1nnc(NC(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)s1 1307530528 YKLRYHJUOXSNTD-UHFFFAOYSA-N 444.582 4.314 10 10 IICE Cc1cccnc1[C@@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 1307568329 JIKUTGRGIPJFFY-HXOBKFHXSA-N 441.531 4.479 10 10 IICE Cc1cccc(CN(C)C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1350006429 NAFAYTMCOVNNRF-UYRXBGFRSA-N 428.554 4.384 10 10 IICE Cc1cccc(CN(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1C 1436480761 XTSXZPIKXRZUSZ-UHFFFAOYSA-N 428.444 4.259 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1 1442341493 HWZKXZKOKTWQFD-RUZDIDTESA-N 429.564 4.142 10 10 IICE Cc1cc(C(=O)N2NC(=O)CC23CCCCC3)c(C)n1-c1ccccc1Br 1449103981 HKIDAOQRNWRPSR-UHFFFAOYSA-N 430.346 4.437 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](c2ccc(F)cc2)c2ncc[nH]2)cc1 1453498691 ARNOIQKADWCWGN-DEOSSOPVSA-N 430.483 4.217 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cnnn1-c1c(Cl)cccc1Cl 1464257919 GAIOAAARZHKCBJ-UHFFFAOYSA-N 448.379 4.057 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)/C=C/CN(C)CC(F)(F)F)cc1 1464956764 MOMCLIOJHGSHGA-AATRIKPKSA-N 435.490 4.345 10 10 IICE Cc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1465444464 CQKYMYHTAWZQQI-OAQYLSRUSA-N 439.556 4.296 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(O)(Cc2cccc(F)c2)CC1 1467310922 UQGMDOPQHGJZQU-UHFFFAOYSA-N 434.511 4.256 10 10 IICE C[C@H](NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)c1ccccc1O 1471195080 BCTJGOJKFOQWJU-LBPRGKRZSA-N 436.942 4.399 10 10 IICE COc1ccc(N(CCC(C)C)CC(=O)Nc2cc(Cl)ccc2-n2cncn2)cc1 1473445732 VFRWTGBMHXBWSI-UHFFFAOYSA-N 427.936 4.421 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@@H]2CC2(O)CCCCC2)N(C)C)cc1 1479535649 YAYXILPNKVZPDX-DHIUTWEWSA-N 430.637 4.005 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N2CCC[C@@H](C)C2)cc1 1501830551 NOFKQDYJEKNAGK-LJQANCHMSA-N 447.587 4.056 10 10 IICE CCC[C@@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1514389483 MTTBQELRNIOELL-XMMPIXPASA-N 448.615 4.164 10 10 IICE CC(C)C[C@H](C(=O)NCc1ccc(N2CCS(=O)(=O)CC2)cc1)c1ccc(Cl)cc1 1531600625 UAXXBHKUIPTXAG-QFIPXVFZSA-N 449.016 4.021 10 10 IICE Cc1ccc(C(=O)Nc2cccc(OCCn3cncn3)c2)cc1-n1c(C)cc(C=O)c1C 1543096786 NCGUPHMLZCWSHU-UHFFFAOYSA-N 443.507 4.138 10 10 IICE COCCN(c1nnc(-c2ccccn2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@H](C)C1 1555537009 WWBHATSPRIHELP-WMZHIEFXSA-N 448.615 4.404 10 10 IICE CCOC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(C(=O)OC)cc3)c2C)cc1 1559333968 OURKNCWHUVYSLN-UHFFFAOYSA-N 435.476 4.319 10 10 IICE COc1cc([N+](=O)[O-])cn(CC(=O)c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)c1=O 1559449010 YGVCXKVWKXGQOE-UHFFFAOYSA-N 449.385 4.074 10 10 IICE CCc1ccc(C)nc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1587210526 RTQBABMQJAEHLP-ATVHPVEESA-N 429.542 4.322 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CCC23CCC3)c(C)n1-c1ccccn1 1589518321 OAHMELSUAXTDDM-UHFFFAOYSA-N 438.572 4.495 10 10 IICE COc1ccc(Cl)cc1NCCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1598292738 UTBOEMCKIGXNJU-OAQYLSRUSA-N 445.991 4.424 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H](C(=O)OC)C2)n1Cc1ccc(N(CC)CC)cc1 1613266705 BRVKITWUIREUNZ-ICSRJNTNSA-N 427.593 4.076 10 10 IICE O=C(Cc1ccc(F)cc1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1616567203 RITBRTFPMCVREM-UHFFFAOYSA-N 425.261 4.479 10 10 IICE CN(C)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CC[C@@H](C(C)(C)C)C2)cc1F 1617667996 YNMQUFTYWNKREQ-HXUWFJFHSA-N 436.579 4.390 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)c2C)cc1 1626413966 ZRKDMSZJDGVMGA-UHFFFAOYSA-N 441.572 4.480 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 1628204371 VLCFTJGHDGRMGE-QFIPXVFZSA-N 425.479 4.218 10 10 IICE O=C(CCCOc1ccc2c(c1)CCC2)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257336 WJQJLAJUPGKRFU-JOCHJYFZSA-N 442.987 4.474 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CC(C)C)C(=O)Nc3nccs3)c2C)cc1 1632029777 CTRNZFWBBAMVNU-HXUWFJFHSA-N 440.569 4.342 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)c(Br)cc3F)CC2)cc1F 1635889868 HKJHBUQJVQKLQC-UHFFFAOYSA-N 445.691 4.352 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC2CCN(Cc3ccc(Br)cc3)CC2)cc1 1636100333 UFJKUZKEHFLBEU-UHFFFAOYSA-N 444.333 4.006 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(F)c(I)c1 1639735026 NGGOZOMXXZERPW-UHFFFAOYSA-N 438.284 4.351 10 10 IICE CC(C)N(Cc1ccco1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1706559730 MDDPPJQBKWQNOI-UHFFFAOYSA-N 443.602 4.326 10 10 IICE CO[C@]1(C)CCCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)cc2C)CC1 1711603505 XJRWYMPZRQIIJO-AREMUKBSSA-N 448.615 4.082 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CC3)n2CCNC(=O)C(C)(C)C)c(C)n1-c1ccccc1 1751409469 DFAHNUAYYWQHCJ-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765063935 MIZWCHRYOFRMCQ-NFBKMPQASA-N 439.648 4.358 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Cl)nc2)n1C[C@H]1OCCC1(C)C 1767111918 KFHPBOFMQDOENW-GOSISDBHSA-N 427.936 4.151 10 10 IICE COCCO[C@H](C)c1nnc(N(C)[C@H]2CCC[C@@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1769957221 WYPQZRKUYLCFFA-GGPKGHCWSA-N 447.599 4.270 10 10 IICE COc1ccc(N2CCN(C(=O)C3CN(C(c4ccccc4)c4ccccc4)C3)CC2)cc1 1873831368 IFHGVWCOZGIFLV-UHFFFAOYSA-N 441.575 4.065 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](NCc1cccc(Br)c1O)C2 1878851825 UBSWLOMBQYRMCI-QCEMKRCNSA-N 429.330 4.123 10 10 IICE CCN1CCc2cc([C@H](N)[C@@H](CN(C)Cc3ccccc3)NC(=O)OC(C)(C)C)ccc21 2044751775 FEDWSEHPXJLNJL-VWNXMTODSA-N 438.616 4.094 10 10 IICE COc1ccc(O)c(Cn2nc(C3(C)CC3)c(C3(C)CC3)c2I)c1 2079763947 WLVWDLPRTYKNNY-UHFFFAOYSA-N 438.309 4.353 10 10 IICE COc1ccc(-n2c(C)cc(C=C3C(=N)N4N=C(c5ccco5)SC4=NC3=O)c2C)cc1 2297357777 BVRSXVUJSRJPBH-UHFFFAOYSA-N 445.504 4.363 10 10 IICE O=C1C[C@H](N2C(=O)C(=Cc3ccc(F)cc3)SC2=S)C(=O)N1c1ccc(Cl)cc1 2297464235 JTXFAFAIAQZWRA-HNNXBMFYSA-N 446.912 4.012 10 10 IICE CCOc1cc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)ccc1OC(C)C 2314764971 QKYFFPZIYJVSOJ-UHFFFAOYSA-N 442.562 4.419 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccc(O)cc3)SC2=S)cc1 15047368 CFUFYCWUFDHDMC-CYUIRQCWSA-N 428.535 4.019 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)cc(Cl)c1OC(=O)c1cccs1 20236661 RKHYRZMQYWYPGP-PABRXHDTSA-N 443.868 4.080 10 10 IICE O=C(NCC(=O)N(Cc1ccco1)Cc1ccccc1O)c1ccc(Cl)cc1Cl 98076241 MLPISKZMPCPVIB-UHFFFAOYSA-N 433.291 4.251 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)c(OC)c1 526331154 ZVTJVYSOHTZLFY-HSZRJFAPSA-N 433.460 4.481 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(N(C)C)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526362317 BMNVTDYQSNLULF-QHCPKHFHSA-N 432.476 4.230 10 10 IICE CC1CCN(c2ccc(CNC(=O)NCC[C@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 731049531 AJNINYWLLONDDV-NRFANRHFSA-N 444.620 4.369 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NCCCCOCc3ccccc3)cc2F)C[C@@H](C)O1 747861298 ICSVRVACGVEXAU-WOJBJXKFSA-N 443.563 4.236 10 10 IICE CC(C)c1nn(-c2ccccc2)cc1CNC(=O)NCc1cccc(Br)c1O 765534514 LIRFJHPHWOBXGH-UHFFFAOYSA-N 443.345 4.463 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@H]1CCCC(F)(F)C1 769338374 QZTPPCARACPWEJ-GVIGZQTCSA-N 430.567 4.424 10 10 IICE COCCc1nc(C)c([C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 773146337 QBLARNRTBDDXKY-GOSISDBHSA-N 428.646 4.023 10 10 IICE CCOc1cc2c(cc1/C=C/C(=O)N1CCCN(c3ccc(OC)cc3)CC1)O[C@H](C)C2 917821402 GQJBHNUVLXYAOB-SSGOSMAHSA-N 436.552 4.169 10 10 IICE C[C@@H]1C[C@@H]1c1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)o1 1125177844 QMKUOTXABLEKQY-BIVOIICOSA-N 444.553 4.450 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)cc1 1125509569 AAQPTQOECISFFT-UHFFFAOYSA-N 439.918 4.485 10 10 IICE Cc1oc(Br)cc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126657940 MUSATTVGADKHRI-LBPRGKRZSA-N 429.261 4.351 10 10 IICE Cc1c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)nnn1CCOc1ccc(F)cc1 1132048534 YIIYWQNVSOSWHE-UHFFFAOYSA-N 447.514 4.142 10 10 IICE CC(C)(C)CCC1(O)CC(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)C1 1136285169 SNIQJOICOCRTBR-UHFFFAOYSA-N 442.522 4.126 10 10 IICE Cc1cc(Br)c(F)c(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1 1136961600 SPANJQIRORQNLU-UHFFFAOYSA-N 435.337 4.035 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)cc1 1137982944 LGVSWVAFSLYPFB-QFIPXVFZSA-N 444.453 4.318 10 10 IICE Cc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc1Cl 1142197726 SADACAKWLHYBNL-UHFFFAOYSA-N 428.920 4.341 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)[C@@H]1CCN(c2ccccc2Cl)C1=O 1146376784 MLUNPQNHBWTSQE-HSZRJFAPSA-N 449.938 4.438 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1c[nH]nc1-c1c(F)cccc1F 1149893311 XMXSBISDGQTMFD-UHFFFAOYSA-N 436.256 4.485 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1 1155676301 IVPCURMLWZEXNE-FQEVSTJZSA-N 425.529 4.036 10 10 IICE C[C@@H](NC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1)c1ccccc1O 1171722741 CNEIKJJOFMXHNJ-HIFRSBDPSA-N 449.320 4.023 10 10 IICE CC(C)c1nnc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1264270409 QUDULZCSZSDUEF-UKTHLTGXSA-N 436.559 4.031 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(-c2cccc(Cl)c2F)no1 1264687889 OFDMRWFZGLEHAC-UHFFFAOYSA-N 433.842 4.040 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C[C@H](c2nccn2C)C(F)(F)F)cc1 1290757152 LHUOFHSCAOALOA-LJQANCHMSA-N 434.462 4.344 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCCN(C3CCCCC3)C2=O)cc1-n1c(C)cc(C=O)c1C 1296453772 LZUUPXJFSXRIJF-QHCPKHFHSA-N 435.568 4.269 10 10 IICE CN(C[C@H]1CCCOC1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1298560350 YCJBUUZSFNOHPP-SJORKVTESA-N 437.635 4.021 10 10 IICE CCn1nc(C)c(CN(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1C 1302086201 WPVCVPMBNMSCAA-UHFFFAOYSA-N 444.377 4.357 10 10 IICE Cc1ncc(CN(C)c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)s1 1304690354 VQWFQNATFRKGIB-UHFFFAOYSA-N 442.658 4.404 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)C1 1314418442 JPDQIFRWQDUBOY-JOCHJYFZSA-N 448.615 4.488 10 10 IICE COc1ccc(N2CCC(NC(=O)c3c(C)ccc(Br)c3OC)CC2)cc1 1358164632 BZWJWKXBNKTWJA-UHFFFAOYSA-N 433.346 4.174 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@](C)(Cc3ccccc3)C(C)C)cc2F)CC1 1359920165 JWJOMOFGLVGLGL-AREMUKBSSA-N 425.592 4.489 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(CN2C(=O)c3ccccc3C2=O)c(C)o1 1442341581 IZWSOJUXUYHOFE-UHFFFAOYSA-N 445.519 4.113 10 10 IICE CC(C)[C@H]1CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)CCS1 1444994831 WHQXJVGLWGIKMY-ZFOVBUMHSA-N 438.615 4.017 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3C[C@H](C(C)(C)C)c4ccccc43)CC2)cc1 1448666624 DXWJXQJNBAJXPA-DSTYWPJMSA-N 447.579 4.077 10 10 IICE C[C@H](NC(=O)c1ccc(Cn2cc(Br)cn2)s1)c1ccc(N(C)C)cc1 1459179255 UDLCIYKLUVRAMK-ZDUSSCGKSA-N 433.375 4.312 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CC(C)(C)Oc4ccc(F)cc43)CC2)cc1F 1470707178 QXQCGVLOBIXUIW-LJQANCHMSA-N 431.483 4.107 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)[C@H](O)Cc3ccccc3)cc2Cl)C1 1478529239 XPHAYMKMEHQDFU-PMAPCBKXSA-N 429.992 4.368 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@H](O)c2cc(F)ccc2F)CC1 1478840795 HRMZTFNKQHDNJA-XDHUDOTRSA-N 445.554 4.425 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H](n2ccc(C(F)(F)F)n2)C1 1478841168 QKLVXJAFTHALAZ-APWZRJJASA-N 437.510 4.254 10 10 IICE CC(C)Cc1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1509202592 VRRAFMKLHPUDPN-IBGZPJMESA-N 429.584 4.127 10 10 IICE CCCc1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)ccc1Cl 1523443281 XSCNCKZWEBCOKL-UHFFFAOYSA-N 429.992 4.243 10 10 IICE CN(C)CCOc1ccc(/C=C\C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)cc1 1530325188 QRURWYSINGMSOE-ZROIWOOFSA-N 449.517 4.297 10 10 IICE COc1cc(N2CCN(C(=O)c3c(C)ccc4cc(C)ccc34)CC2)cc(OC)c1OC 1538077240 UGSNPBBCKZMRLF-UHFFFAOYSA-N 434.536 4.445 10 10 IICE Cc1cc(C(=O)NCC2(N(C)C)CCCCC2)c(C)n1-c1ccc(Br)cn1 1538449235 QNNSRAZSZPSTGW-UHFFFAOYSA-N 433.394 4.246 10 10 IICE Cc1ccccc1CN1CCCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CC1 1543610712 FCWFIBPPZGTFDN-UHFFFAOYSA-N 443.591 4.492 10 10 IICE COc1ccc(N2CCN(C(=O)CC3(CNC(=O)OC(C)(C)C)CCCCC3)CC2)cc1 1545556368 GJZXOAZMJFPEGJ-UHFFFAOYSA-N 445.604 4.209 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccccc3C(=O)c3ccc(OC)cc3)CC2)cc1 1545931866 ZIUPNZXRSHOJEZ-UHFFFAOYSA-N 444.531 4.287 10 10 IICE CCCCCN(c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1546968023 ORJNGIUPIGKXGO-HSZRJFAPSA-N 441.620 4.420 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCS[C@H](C)C2)cc1 1547447980 JINLRNPPGNRYTC-LJQANCHMSA-N 436.629 4.100 10 10 IICE CN(CCC(F)F)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1554255156 PBZWTTSCIZIVKM-UHFFFAOYSA-N 449.590 4.215 10 10 IICE COC(=O)[C@H](Cc1ccccc1O)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1557590909 FMAIJBKNGKTXCW-QHCPKHFHSA-N 434.536 4.437 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(c2nccc3sccc23)CC1 1564946833 WSSXUQIUYNSUMA-SFHVURJKSA-N 437.613 4.134 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(Cc2ccccc2)s1 1566356309 BHLAAPBQFXIUDV-IBGZPJMESA-N 441.984 4.487 10 10 IICE Cc1ccc(S(=O)(=O)C2(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CCCC2)cc1 1584095479 NMZBRRUCOOGSIY-HXUWFJFHSA-N 442.625 4.203 10 10 IICE Cc1cc(Br)cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1C 1584514892 GIJNBDOQSHNRJO-UHFFFAOYSA-N 439.300 4.111 10 10 IICE CC(C)[C@@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(=O)OC(C)(C)C 1584899254 UHVFHUGOSZLFDA-HXUWFJFHSA-N 441.616 4.138 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccc(OCC(C)C)cc3)CC2)cc1F 1595481487 CYVVQFMJTOJMSQ-UHFFFAOYSA-N 428.548 4.496 10 10 IICE Cc1c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)nnn1Cc1ccc(F)cc1F 1596482084 JFYTZBYEIVIMCN-UHFFFAOYSA-N 435.478 4.251 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc(S(C)(=O)=O)ccc1F 1597567011 FQTVUPXHOHWZJQ-INIZCTEOSA-N 427.497 4.338 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@@H]4CCC[C@H](C3)C4O)nnc2C(C)(C)C)cc1 1615381815 FXHJNMNTXIWGFU-RLAPIPATSA-N 425.621 4.067 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CC[C@@H](C)C3)CC2)cc1F 1619302478 RGQIXFOWHNIJRC-MSOLQXFVSA-N 429.584 4.486 10 10 IICE Oc1cccc(Br)c1CN[C@@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1621069554 DGBYKTACPPLKJT-NVXWUHKLSA-N 429.280 4.307 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCSc1ncnc2[nH]cnc12 1623923671 BNKCMZRSSKHRGV-INIZCTEOSA-N 433.537 4.331 10 10 IICE COc1ccc([C@@H](OC)[C@@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1624050442 GSNGPOILLIJVOV-DWXRJYCRSA-N 434.536 4.350 10 10 IICE CCn1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C(C)C)n1 1628491787 XOMCGCAZGJXSCZ-FQEVSTJZSA-N 443.592 4.088 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1C 1629484291 ZJEYLFDCMDJHIS-UHFFFAOYSA-N 439.506 4.447 10 10 IICE CCc1csc([C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1630684008 MCSDTEIGIHXXGW-YUSFRKCESA-N 449.598 4.313 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1ccc(C(N)=O)cn1 1638241581 QUGMAWQTABCUKX-SFHVURJKSA-N 442.441 4.106 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)CNC(=O)C(C)(C)C 1648493600 JJUJKDPKEDLDHA-SFHVURJKSA-N 435.490 4.460 10 10 IICE Cc1cc(C)c(O)c(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1648549358 YEZANBAHWJKRKR-BOPFTXTBSA-N 430.526 4.378 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@]3(C)c3ccccc3)cc2F)C[C@@H](C)O1 1654648210 YCGFDNLXASHZIY-BVFVYWQFSA-N 439.575 4.067 10 10 IICE COC(=O)/C=C\c1ccc(N2CCCC[C@H]2CN(C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1 1655862184 MNGDUSRTASHDHT-LUJNMSEFSA-N 433.505 4.007 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H]3c3ccc(OC)c(OC)c3)C2)cc1 1673822496 DYAUCKOHKXOETL-PGRDOPGGSA-N 439.556 4.085 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N(Cc3ccccc3)CC3(O)CCCC3)C2)cc1 1682187987 CKHYPEUWHLPLBB-QFIPXVFZSA-N 437.584 4.038 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)[C@H]2CCOC2)cc1 1695625111 PDZNOPRAEBLCRG-NRFANRHFSA-N 425.602 4.050 10 10 IICE CCOCc1nnc(N2CCC[C@@H](OC(C)(C)C)C2)n1Cc1ccc2c(c1)CCCN2C 1696315632 UDQZLFKJOUIRCT-OAQYLSRUSA-N 441.620 4.029 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@H](c1ccco1)N(C)C 1767112711 AUWZHAXQPMDOKE-LJQANCHMSA-N 437.569 4.168 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)[C@@H](C)C(=O)N4)cs2)cc1 1859574335 XNYOCNVWIYVTCF-GFCCVEGCSA-N 429.523 4.065 10 10 IICE O=C(CNCc1ccccc1C(F)(F)F)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1860717742 SNWZEIJBGGBOOQ-UHFFFAOYSA-N 438.405 4.209 10 10 IICE COCCN1C(=O)C(Nc2ccccc2F)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420523 OWIHLAJKBAAIDE-UHFFFAOYSA-N 433.483 4.072 10 10 IICE Cc1cc(O)c([C@H](C(C)C)n2nc(C3CC3)c(CN)c2I)cc1C 2079978633 DRMQNILHJZYLJW-SFHVURJKSA-N 439.341 4.392 10 10 IICE CC(C)(C)OC(=O)NC(C)(C)c1csc(=NCc2c(O)cccc2Br)[nH]1 2267701776 YRGDBPULMVHXEN-UHFFFAOYSA-N 442.379 4.405 10 10 IICE CCCCN1C(=O)C(=C2SC(=S)N(CCCCCC(=O)OC)C2=O)c2ccccc21 2314754381 QSSXYXLUTCEKGO-UHFFFAOYSA-N 446.594 4.138 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C23CCC3)c(O)c1Br 2352684826 TZYIHFRBIRRTGM-HUUCEWRRSA-N 425.367 4.389 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)(C)F)c(O)c1Br 2380788212 ZMGWUILZXXEMOF-HNNXBMFYSA-N 447.345 4.063 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCCC1 13639850 JKOMCCPTKZDSGT-XLNZFTOWSA-N 440.565 4.489 10 10 IICE CCCOC(=O)CCN1C(=O)/C(=C/c2ccc(OC)c(Br)c2)SC1=S 40885088 JJDBCJYYMPJFRV-UVTDQMKNSA-N 444.372 4.002 10 10 IICE COc1ccc(N2CCCN(C(=O)Nc3ccccc3N3C[C@H](C)O[C@H](C)C3)CC2)cc1 195547121 BXGMNFONZMIIKH-BGYRXZFFSA-N 438.572 4.053 10 10 IICE CO[C@H](C)c1noc(CN(C)CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 747967825 QUTLMVZIIAJDQR-OAHLLOKOSA-N 448.470 4.101 10 10 IICE CC[C@H](NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)c1nnc2n1CCCCC2 749541479 CQVFRGQVEXZKTM-QFIPXVFZSA-N 434.588 4.405 10 10 IICE COc1ccc(Br)cc1[C@@H](NCc1ccc(N2CCCCC2)cc1)C(=O)O 756377926 AWJCMCJEERKYMZ-HXUWFJFHSA-N 433.346 4.364 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)[C@@H](OC3CCOCC3)c3ccccc3)ccc21 759844741 SQIPSSDMVCLUMO-SANMLTNESA-N 441.483 4.337 10 10 IICE CN1CC[C@@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)[C@H]1c1ccc(Cl)cc1 760305223 CRZOPVFKDSELBZ-FGZHOGPDSA-N 445.032 4.138 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1 771411076 YFNSQDQAYVFTTA-LJQANCHMSA-N 425.598 4.410 10 10 IICE C[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)[C@@H]1C[C@H]1c1ccccc1 802300087 CAPNROUHEZIHFR-OIBXWCBGSA-N 431.559 4.224 10 10 IICE CCO[C@@H]1C[C@@]2(NC(=O)N(Cc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)C2=O)C1(C)C 804188244 KYDYUXSWMCHPFH-YWBKXGLFSA-N 433.980 4.202 10 10 IICE Cc1ccc([C@@H](NC(=O)NCc2cc(Br)ccc2O)c2ccccn2)cc1 807190215 FILRJUDAROYYIR-HXUWFJFHSA-N 426.314 4.447 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(OCC(F)(F)F)c3)cc2F)C[C@H](C)O1 1125188238 OGKULHIKMHNGOS-GJZGRUSLSA-N 440.437 4.310 10 10 IICE COc1ccc(N2CCCN(C(=O)C(F)(F)c3ccc(Br)cc3)CC2)cc1 1125322741 LBEJDMJVJOLNAL-UHFFFAOYSA-N 439.300 4.288 10 10 IICE CCOc1ccc(CN2CCN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CC2)cc1 1135844441 ZUIZAEPZUYXLGD-UHFFFAOYSA-N 447.579 4.459 10 10 IICE COc1cc(N(C)C(=O)c2ccccc2CCNC(=O)OC(C)(C)C)cc(OC)c1OC 1136781270 KQZPFTOQHYTDAR-UHFFFAOYSA-N 444.528 4.056 10 10 IICE Cc1cc(Br)cc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1C 1136985133 WOEBVKHCDUYXKE-UHFFFAOYSA-N 435.337 4.096 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccccc3C(=O)c3ccc(C)cc3)C2)cc1 1142799109 YWTCRWJPMKAQCV-HXUWFJFHSA-N 428.532 4.491 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3CCCCCC[C@H]3NC(=O)OC(C)(C)C)C2)cc1 1146949800 HWMIFRLXFCVCBZ-VLCRHTCISA-N 445.604 4.254 10 10 IICE CC(C)Oc1cc(Br)cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1148706502 XSALZJITNFFTCW-UHFFFAOYSA-N 447.373 4.127 10 10 IICE CCOc1cc(NC2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)ncn1 1153792736 NSGLRXYQZBSLRX-UHFFFAOYSA-N 433.556 4.308 10 10 IICE CCn1c(SCC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)nnc1-c1cccs1 1162108795 UPXRHQFFAAONPD-MRXNPFEDSA-N 443.642 4.240 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2c2ncc(Br)cn2)c(C)n1-c1ccccn1 1178505614 VYNZBNAPIFOZHR-QGZVFWFLSA-N 426.318 4.019 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3ccc(COc4ccc(F)cc4)cc3)C2)cc1 1252308149 NEAOLVAMYUEKMD-JOCHJYFZSA-N 449.526 4.491 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)SCc1nc(O)c2ccccc2n1 1264442597 LIFRSFUUGIDEIH-KRWDZBQOSA-N 438.597 4.460 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H](c1cccnc1)C1CC1 1266792309 JXPZCIITWPINHY-VOMPUTFMSA-N 441.553 4.080 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCCN1CCN(Cc2ccccc2)CC1 1290416096 MMQYPTPOPDPCLL-UHFFFAOYSA-N 436.625 4.093 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCOCC2)cc1 1291735381 BNWPRCSSHQWOSY-FQEVSTJZSA-N 436.604 4.041 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(C)OC(C)(C)C1 1301818319 KWZWJDYROHMKRL-UHFFFAOYSA-N 437.588 4.393 10 10 IICE COc1cc(Br)c(N)c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1302267918 RNGHFCAMEVFCAI-UHFFFAOYSA-N 428.330 4.377 10 10 IICE C[C@H](NC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1)c1ccccc1O 1302532586 KCYQZMUGQAREAF-ZDUSSCGKSA-N 448.903 4.477 10 10 IICE Cc1ccc(Br)cc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1357836176 PHJAHFGXZFHOQY-HOTGVXAUSA-N 449.364 4.369 10 10 IICE C[C@H](NC(=O)Cc1c(Cl)cccc1Br)c1ccc(N2CCOCC2)cc1 1434913561 ZMMBUJCFIQWBTA-AWEZNQCLSA-N 437.765 4.359 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc([C@@H]3CCCCN3C(=O)OC(C)(C)C)n2C)cc1 1440648908 UGJSLXUPSUPBPG-NRFANRHFSA-N 440.588 4.483 10 10 IICE O=C(c1ccc(S(=O)(=O)CC2CC2)cc1)N(Cc1ccco1)Cc1ccccc1O 1445638543 KDMCHBQOAIYPMF-UHFFFAOYSA-N 425.506 4.012 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1450410432 MGCIEVVMQGCNAB-WMZOPIPTSA-N 429.521 4.101 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)CCCC1 1456493422 PTWQHQQOPNFVCV-QGZVFWFLSA-N 441.572 4.044 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCOC23CCN(C(=O)OC(C)(C)C)CC3)cc1 1457151501 YUOGAAUWYBJYET-UHFFFAOYSA-N 439.556 4.294 10 10 IICE CC(C)(C)OC(=O)Nc1cnn2c1N(C(=O)/C=C\c1cnc(C(C)(C)C)s1)CCC2 1462909442 AJQCYVLAHLZETQ-HJWRWDBZSA-N 431.562 4.434 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)COc2ccc3oc4c(c3c2)CCCC4)N(C)C)cc1 1463287980 ZTPVLCBMTITKAK-QHCPKHFHSA-N 435.568 4.176 10 10 IICE Cc1cc(C(=O)N2C[C@]3(C)CN(C)C[C@]3(C)C2)c(C)n1-c1ccc(Br)cc1 1470674214 LFJOHHUCGIJSLK-SZPZYZBQSA-N 430.390 4.270 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CCN1C1CCCCCC1 1471114444 FRRXDNLHORRCTF-LJQANCHMSA-N 438.410 4.483 10 10 IICE CN(C)c1ccc(CN(c2ncnc3ccc(I)cc23)C2CC2)cc1 1472664497 WCHFZRNVZJEROA-UHFFFAOYSA-N 444.320 4.469 10 10 IICE O=[N+]([O-])c1cnc(N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(Br)c1 1472710978 JWSCZNXEJNSCCB-NSHDSACASA-N 443.248 4.435 10 10 IICE CCN(CC)[C@@H](C)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1501799855 ZINJVAKAPIADCT-FQEVSTJZSA-N 435.620 4.240 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(C)o3)nnc2N2CCN(CC)[C@H](C)C2)cc1 1501834139 IQWONDAXQJQJBR-LJQANCHMSA-N 436.604 4.271 10 10 IICE C[C@@H]1Cc2ccccc2CN1C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1514830812 WQKCPMFDMQNNGR-OOWUWCJESA-N 440.565 4.390 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCCO[C@@H](C)C2)cc1 1515525588 AQYAKYDEDSIOHE-IBGZPJMESA-N 439.629 4.440 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2c(F)cc(F)c(F)c2F)C1 1525421020 NWOKRWUGFSATNG-UHFFFAOYSA-N 433.449 4.281 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(I)cc2OC)cc1 1525919246 WXPIDYYETSVZGH-UHFFFAOYSA-N 438.309 4.076 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C/c3ccccc3C(F)(F)F)cc2F)CC1 1528701162 FTPWTHLHZOGUTH-CSKARUKUSA-N 435.465 4.316 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@H](C)Cc3ccc(F)c(Br)c3)C2)cc1 1532104282 ALOBGNMDAMFTLK-ZBFHGGJFSA-N 435.337 4.171 10 10 IICE COc1ccc(N2CCN(C(=O)C3(Sc4ccccc4)CCCC3)CC2)c(OC)c1 1534588569 UZSIRCDMZZAYDG-UHFFFAOYSA-N 426.582 4.458 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2CCN([C@H]3CCSC3)CC2)cc1 1540800058 DIWZNASGAKETDY-QFIPXVFZSA-N 427.614 4.092 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)c1 1543454936 LRCSYQQCKQEYPX-HSZRJFAPSA-N 431.492 4.276 10 10 IICE CC[C@H]1CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CCS1 1546735431 CJQHVPVVKUWXHD-HNNXBMFYSA-N 432.644 4.311 10 10 IICE COCCCCCn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1555458845 VROCOGDFFRGDGW-UHFFFAOYSA-N 448.365 4.194 10 10 IICE CCc1ccc([C@@H]2CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1564895735 SLKXARYRKVOELR-HXUWFJFHSA-N 429.511 4.063 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1Br 1566304222 XKFOVUJSSGIJTD-SFHVURJKSA-N 449.345 4.379 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(NC(=O)NC(C)(C)C)ccc3Cl)C2)cc1 1584230499 RTIKVBMMJIPWQR-MRXNPFEDSA-N 444.963 4.277 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CSCc3ccc(Br)cc3)C2)cc1 1585665115 MBSMZVYDILVVQF-QGZVFWFLSA-N 449.414 4.334 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CN3C(=O)[C@@H](C)Oc4ccccc43)cc2Cl)C1 1586081383 DIXMAVCGVKABBS-IAGOWNOFSA-N 441.959 4.007 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc([C@@H](C)OCCOC)n1Cc1ccc(N(C)C)cc1C 1614108832 LCKAFKCJSWFHFJ-YFVAEKQCSA-N 429.609 4.050 10 10 IICE CCN(C)c1ccc(CN2CCN(CCCc3nc(-c4cccs4)no3)CC2)cc1 1616066199 DJMDDAHRCTYKAG-UHFFFAOYSA-N 425.602 4.005 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@@]1(C)C[C@H](NC(=O)OC(C)(C)C)CCO1 1624553759 DJDAMVDVGGXMIW-CJFMBICVSA-N 445.604 4.098 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4cccc(C(F)(F)F)c4nc3O)CC2)cc1 1626479395 JGYPJLCPGLVOMF-UHFFFAOYSA-N 445.441 4.367 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cccc(F)c2I)cc1F 1627604692 OFKLUXVAFWBNSJ-UHFFFAOYSA-N 444.263 4.346 10 10 IICE Cc1cc(C(=O)NCCN(C)CC(F)(F)F)c(C)n1-c1ccccc1Br 1628775431 FYJRBAQCNYOBCQ-UHFFFAOYSA-N 432.284 4.081 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3nccn3)cc2)c(C)n1-c1ccc(Br)cn1 1631346302 ANMQKZZZZHHOSU-UHFFFAOYSA-N 437.301 4.085 10 10 IICE C[C@H](NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1)c1ccccc1O 1632249817 CNEIKJJOFMXHNJ-DZGCQCFKSA-N 449.320 4.023 10 10 IICE Cc1ccc(C(=O)NC[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1632272830 MTNQDEHHZURGJD-XGAFWQRZSA-N 439.556 4.248 10 10 IICE CO[C@](C)(CNC(=O)N(C)Cc1ccc(N2CCCC2)cc1)COCc1ccccc1 1636813531 ALEIPCJQHWLPKI-RUZDIDTESA-N 425.573 4.050 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1638244243 SHPGRGJHUGXXNR-CQSZACIVSA-N 434.462 4.040 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)CC1(CNC(=O)OC(C)(C)C)CCCCC1 1640260160 SWJIIHUDMJXLOK-UHFFFAOYSA-N 425.566 4.359 10 10 IICE CN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccccc1Br 1659548296 OTFGEIPWWQYTSX-UHFFFAOYSA-N 449.304 4.299 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](C)CCCCNC(=O)OC(C)(C)C 1673244409 NHNQGGRBXDIVBO-RTBURBONSA-N 434.625 4.375 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCCc1ccc(OCC(F)(F)F)nc1 1680374547 WFJABYBGYHUCJY-UHFFFAOYSA-N 425.451 4.283 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 1682100435 BMVYMRHBNONHBF-CNNODRBYSA-N 427.614 4.202 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H](O)c3ccc(Cl)c(Cl)c3)C2)cc1 1683944843 LJDVXOWCFWZJMN-MGPUTAFESA-N 438.355 4.004 10 10 IICE Cc1cc(CCNC(=O)NCc2cccc3c2OC(F)(F)O3)c(C)n1-c1ccccc1 1684204082 NMCWIXOJVYNNJQ-UHFFFAOYSA-N 427.451 4.458 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@@H]2CC[C@H](C(F)(F)F)O2)cc1 1685139799 INEFRTHOFGEPSX-PKOBYXMFSA-N 425.451 4.167 10 10 IICE CN1CC[C@@H](CNC(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1685956536 ZRINDWOVWHMQIJ-DJJJIMSYSA-N 426.319 4.330 10 10 IICE CCC[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1695146502 HTYXVORKANZKPD-OAQYLSRUSA-N 443.661 4.182 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)cc2C)C1 1696546762 VQZLVIZDGPQDNJ-KSEOMHKRSA-N 443.661 4.315 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@H](C(F)(F)F)C2)n1CCCSc1nccs1 1727028745 QCKTWSSCEKFFEP-STQMWFEESA-N 435.541 4.198 10 10 IICE Cn1ccc(Nc2nnc(COc3ccc(F)cc3)n2CCCSc2nccs2)n1 1729586984 ZDBDOSPGVXKAJW-UHFFFAOYSA-N 445.549 4.112 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(Cl)s1 1750124546 SGXNOFPNWVBIGP-KXBFYZLASA-N 448.976 4.107 10 10 IICE Cc1noc(C)c1[C@@H](C)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1762646606 UVSQCNYHKCHOTG-INIZCTEOSA-N 432.528 4.014 10 10 IICE CCc1nnc(N(CCOC)[C@@H]2CC[C@@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1762915395 BBAADGQUFSQKBN-DENIHFKCSA-N 443.661 4.083 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(=O)c2cc(Cl)ccc2[nH]1 1866498466 MSGFCRHKISALKW-UHFFFAOYSA-N 428.831 4.209 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCC4)nc(-c4ccc(F)cc4)n3)CC2)cc1 1867983198 KKNKEMMJLHBFLW-UHFFFAOYSA-N 433.531 4.218 10 10 IICE CN[C@H](c1ccc2c(c1)CCN2C)[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 1999536560 LRRFWMDPESTKLS-JTHBVZDNSA-N 425.573 4.050 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@@H](NCc1c(O)cccc1Br)C2 2232271574 SWAPBEOEILJYBN-PYTWLRIVSA-N 425.367 4.326 10 10 IICE Cc1cc(C=C2NC(=O)N(Cc3ccccc3F)C2=O)c(C)n1-c1ccc(N(C)C)cc1 2294034270 UARIJRRZOBTIAI-UHFFFAOYSA-N 432.499 4.392 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(=O)oc5ccc(C)cc5c4s3)CC2)cc1 8599210 ILSRYZIYGJWZNV-UHFFFAOYSA-N 434.517 4.287 10 10 IICE O=C(NC[C@H]1CCCO1)c1cccc2c1N[C@@H](c1cc([N+](=O)[O-])ccc1O)[C@H]1CC=C[C@H]21 14475977 WAVNCFHPGJQZAM-KLQLHJPASA-N 435.480 4.036 10 10 IICE CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C\c1ccc(-c2ccc3c(c2)COC3=O)o1 27527783 ZDHXDELNGINRKE-JAIQZWGSSA-N 428.400 4.121 10 10 IICE COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C/c1cccc(Br)c1 33332146 OTDOCSPQISGAHM-WOJGMQOQSA-N 428.282 4.335 10 10 IICE CCOc1cc(/C=C2/SC(N3CCN(c4cccc(Cl)c4)CC3)=NC2=O)ccc1O 33332406 TZRQZLBSCCZMIY-DEDYPNTBSA-N 443.956 4.237 10 10 IICE Cc1cc(/C=C2\NC(=O)N(Cc3ccccc3F)C2=O)c(C)n1-c1ccc2c(c1)OCO2 96569949 WMMNNKNNLIODNG-JMIUGGIZSA-N 433.439 4.055 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCC[C@H]2c2noc(C3CC3)n2)C1 683445054 ZUUDECYROWJLND-QHCPKHFHSA-N 447.583 4.422 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCC(=O)N[C@H](C)c3ccc(F)cc3)ccc21 728639970 USDXHPHTWYUVPS-MRXNPFEDSA-N 426.488 4.078 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@H](CN2CCCCCC2)C1 728744678 CDORSKIZUUKIKO-JOCHJYFZSA-N 430.662 4.037 10 10 IICE CC(C)C(=O)Nc1ccc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 768860010 SBDGHUMPIAWRIF-UHFFFAOYSA-N 449.599 4.135 10 10 IICE O=C1CCc2cc(NCc3cc(Cl)cc([N+](=O)[O-])c3O)ccc2N1CC(F)(F)F 780566465 FBAVLDYWESEAES-UHFFFAOYSA-N 429.782 4.407 10 10 IICE Oc1c(Br)cc(Br)cc1CN1CC[C@@H](Cc2ccncc2)C1 783598219 QZOSHICCWPPELF-ZDUSSCGKSA-N 426.152 4.377 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccnc(-c3ccccc3)c2N)cc1 798284658 JVMZMAVVFZWOAQ-QFIPXVFZSA-N 430.552 4.218 10 10 IICE COc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(C)c(OC)c1 800573058 CBHGJXWUOVKTMD-GASCZTMLSA-N 431.508 4.087 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NC[C@H]3CC[C@H](c4ccccc4)O3)cc2F)C[C@H](C)O1 808237805 GTIOCAXBTKJDAW-HVDAFXPBSA-N 441.547 4.159 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c2cccc(OC)c2)cc1 1125235077 JPHDNBLNJSFTIM-JOCHJYFZSA-N 441.572 4.424 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCC(=O)Nc2ccc(Br)cc2)cc1 1125243507 DRYGXVNFBOQLNK-UHFFFAOYSA-N 426.314 4.225 10 10 IICE Cc1ccc(C(=O)N2CCC(NC(=O)c3ccccc3)CC2)cc1-n1c(C)cc(C=O)c1C 1135862024 BRFIOLDWFURUFI-UHFFFAOYSA-N 443.547 4.250 10 10 IICE Cc1cc(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1136379362 XVBGXLIVROBBEI-BZUAXINKSA-N 447.421 4.348 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CCCN(C(=O)NC4CCCC4)C3)c2C)c1 1151152839 FYIKCWFIDGWDQO-NRFANRHFSA-N 436.600 4.383 10 10 IICE Cc1cc(C(=O)N2c3ccccc3C[C@H]2CO)c(C)n1-c1ccccc1Br 1166037220 YBECVCIPENFBKL-KRWDZBQOSA-N 425.326 4.420 10 10 IICE COc1cc2c(c(OC)c1)N(CC(=O)Nc1nc(-c3ccc(F)c(F)c3)cs1)CCC2 1195180069 QNZCAZOHKIKHNO-UHFFFAOYSA-N 445.491 4.497 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)Cn4nnnc4C(C)C)n3)c2C)cc1 1264176005 IZHNHJVYPACKCA-UHFFFAOYSA-N 435.557 4.275 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)C(F)(F)c1ncccc1Br 1265740125 NLGRNKBEIORKBR-UHFFFAOYSA-N 444.239 4.284 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cccc(C(F)(F)F)c4)CC3)CC2)c(OC)c1 1287477961 JKHGGFMTCRZULX-UHFFFAOYSA-N 434.458 4.103 10 10 IICE CCC1(CC)CN([C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CCS1 1307662244 QXXCFFHSKXTOCG-INIZCTEOSA-N 436.577 4.397 10 10 IICE Cc1cc(C(=O)NC[C@H]2CCC3(CCOCC3)O2)c(C)n1-c1cccc(Br)c1 1472174567 YKBQROMQMHFQDM-LJQANCHMSA-N 447.373 4.315 10 10 IICE CCS[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1473396387 BEKFZUXAONKKLM-ITEAAPOESA-N 436.577 4.443 10 10 IICE CC[C@H]1CN(c2nnc([C@@H](C)CC)n2Cc2ccc(N3CCOCC3)c(F)c2)CCS1 1499659346 MYZHFYUYBPAKBP-HKUYNNGSSA-N 447.624 4.147 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1nccs1 1503488555 FXBVVYFKCVZZJR-VQIMIIECSA-N 427.574 4.044 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc4cccc(Cl)c4o3)CC2)cc1 1524982028 GOWMBEGBLUZHOJ-UHFFFAOYSA-N 427.932 4.037 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1 1525761401 BFMRSRMBZVLTGZ-INIZCTEOSA-N 448.032 4.376 10 10 IICE Cc1cc(CC(=O)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)c(C)n1-c1ccccc1 1527656719 RPZYGVXPISWDOP-FQEVSTJZSA-N 448.586 4.405 10 10 IICE Cc1cc(CCNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccc(F)c2)c(C)n1-c1ccccc1 1534550730 ZQFYOTLGVKRGGL-UKILVPOCSA-N 433.527 4.112 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2c(F)cccc21 1538193107 NZCCEOXXDFBVNA-LSCADSNKSA-N 444.528 4.360 10 10 IICE CC(C)(C)OC(=O)COc1cccc(C(=O)Nc2c(-c3ccccn3)nc3ccccn23)c1 1543447604 QJTMXPOFYZACOG-UHFFFAOYSA-N 444.491 4.369 10 10 IICE CCN(CCC1CC1)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1547571611 RCHBUZCZHUJZSK-UHFFFAOYSA-N 439.583 4.020 10 10 IICE COCCN(c1nnc(CC2CC2)n1Cc1ccc(N(C)C)cc1C)[C@@H]1CC[C@H](C)C1 1555540534 OJRVEXWMIFROEW-FDDCHVKYSA-N 425.621 4.295 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4cc(Br)ccc4o3)C2)cc1 1585665001 JWSHNXFZQCSGOW-AWEZNQCLSA-N 429.314 4.460 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnc(OC4CCCCC4)c(Cl)c3)C2)cc1 1587112643 IWFFFSGKFGJAPK-KRWDZBQOSA-N 429.948 4.464 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(Br)c(C(F)(F)F)c3)C2)cc1 1587114519 SISVSDQWACOATD-ZDUSSCGKSA-N 443.263 4.485 10 10 IICE CC(=O)N1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)C)[C@@H](C)C1 1596165783 IXUDQZRFBNXHFW-IBGZPJMESA-N 434.588 4.066 10 10 IICE O=C(N(Cc1ccccc1O)C[C@H]1CCCO1)C(F)(F)c1cccc(Br)c1 1597090023 MWOLUIVVVBPWNA-QGZVFWFLSA-N 440.284 4.454 10 10 IICE CC[C@]1(C)CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1613691440 KDSBHWFIRPPRPA-RUZDIDTESA-N 425.621 4.285 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnn(C)c2)n1CC1CCC(C(F)(F)F)CC1 1617939201 ABPQFULTWUMVFV-UHFFFAOYSA-N 448.493 4.389 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)c1 1618315143 NCBTYLSFOUPEAA-NRFANRHFSA-N 429.520 4.032 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2cc(Br)ccc2F)N(C)C)cc1 1618641468 AYMVEKZXHKNXNQ-FQEVSTJZSA-N 436.369 4.006 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4c(Br)c(F)ccc4[nH]3)C2)cc1 1627163390 UEKGHQCCONBGOP-ZDUSSCGKSA-N 446.320 4.334 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)CC(C)C 1628251652 ZPYMQQSFYTZGGD-MRXNPFEDSA-N 435.362 4.422 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CC(C)C)NC(=O)NCc1ccc(C)cc1 1631265824 OAONEOKRJRCRRS-DEOSSOPVSA-N 438.616 4.324 10 10 IICE O=C(CCOc1ccc(F)c(Cl)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1631425494 HIFAFBMPTCCNMG-INIZCTEOSA-N 441.330 4.388 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(Cl)nc(N2CCCC2)c1 1631426033 VTKSODZGEXTWGM-GOSISDBHSA-N 449.382 4.089 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccn1 1642107462 SPAAEVRCYIYERZ-VQIMIIECSA-N 426.561 4.112 10 10 IICE Cc1cc(=O)n(CC(=O)c2cc(C)n(-c3ccc(OC(F)(F)F)cc3)c2C)cc1[N+](=O)[O-] 1651870656 UUXXUNDDVBTEHE-UHFFFAOYSA-N 449.385 4.254 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCCc2cn(C)c3cc(Cl)ccc23)N(C)C)cc1 1671688214 RBZDAPWQEUDZOW-HSZRJFAPSA-N 442.007 4.042 10 10 IICE C[C@H](CN(C)C(=O)OC(C)(C)C)NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1 1674724501 ZNXUEJAEWIGSQF-GOSISDBHSA-N 444.576 4.313 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)C2)cc1 1686855009 OBFWCQXFTYTHQS-LJQANCHMSA-N 426.517 4.050 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H]2CSC)n1Cc1ccc(N2CCOCC2)cc1 1708505227 URVXMRFAANDJJE-RXVVDRJESA-N 429.634 4.008 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(C)CN(C)C1=O 1728045257 JMWNTZXAHLPHTP-AREMUKBSSA-N 448.615 4.457 10 10 IICE CC[C@@H](C)[C@@](C)(O)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743513369 BUVKWQLSHCCEKZ-QNIAMRLHSA-N 441.620 4.163 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)[C@@H]2CCSC2)cc1 1746094656 XPOKAXXITLIUKH-JOCHJYFZSA-N 436.629 4.100 10 10 IICE CCOCc1nnc(N2CCO[C@@](C)(CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1747221985 XHGODKIVAOLEHP-VWLOTQADSA-N 441.620 4.105 10 10 IICE CSCC[C@@H](C)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1750303499 JMDRLJLWQLFCGV-SJLPKXTDSA-N 435.613 4.003 10 10 IICE Cc1noc([C@H]2CCCN(c3nnc(C(C)C)n3CCCSc3nccs3)C2)n1 1751965096 UFIZKUFITVSBFA-HNNXBMFYSA-N 433.607 4.116 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@H](C(C)C)C2)cc1 1766609178 VOLSOVBTBGKTFD-NRFANRHFSA-N 440.636 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CC[C@H](C)[C@H](OC)C2)cc1 1766613609 HYTIWIBWFQWSCE-GBXCKJPGSA-N 448.615 4.020 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1767995828 WPXQOBCJIGZBHU-FPOVZHCZSA-N 425.621 4.475 10 10 IICE COCCN(c1nnc(C2CCC2)n1Cc1ccc(N(C)C)c(F)c1)[C@@H]1CC[C@H](C)C1 1771090781 KCCWFKUXQOCGJI-FXAWDEMLSA-N 429.584 4.440 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)sc2c1CCCC2 1859478982 RTLOHYYMOMQCJZ-RDJZCZTQSA-N 440.565 4.352 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ccc3c[nH]nc3c2)sc(C)c1-c1ccccc1 1860747343 FUVVYTVHYAEXRU-UHFFFAOYSA-N 448.504 4.354 10 10 IICE COc1ccc(O)c([C@@]2(NC(=O)OCC3c4ccccc4-c4ccccc43)C[C@H]2C(=O)O)c1 1952766998 YXLUWCVAESRSFO-NVQXNPDNSA-N 445.471 4.239 10 10 IICE CC(C)(C)OC(=O)NCCCN(CCCC(=O)Nc1ccc(N)cc1)Cc1ccccc1 2044603825 AFBMCTVZHGCQEU-UHFFFAOYSA-N 440.588 4.405 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C(C)(C)C)c(C(=O)OC)c1Br 2080048499 TXEIJBFPXBJXPO-ZDUSSCGKSA-N 425.323 4.443 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc3c(c2)OCO3)SC1=S)Nc1ccccc1Cl 2296881578 PLRPMSASYKDRMR-UHFFFAOYSA-N 446.937 4.299 10 10 IICE Cc1ccc(Sc2ccc(C=C3C(=N)N4N=C(N5CCCC5)SC4=NC3=O)o2)cc1 2297352870 PBEJTPRRTYCLOA-UHFFFAOYSA-N 437.550 4.412 10 10 IICE COc1cc(C=C2SC(=S)N(CCCOC(C)C)C2=O)cc(Br)c1O 2323791654 OUWRJIOGYSZCPF-UHFFFAOYSA-N 446.388 4.180 10 10 IICE Cc1ccc(CNC(=O)C(C)(C)[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2352619891 KUHABIVISGRXJG-GFCCVEGCSA-N 429.355 4.019 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3ccc(I)o3)SC2=S)cc1 6645246 NGKULIIBGXIOEZ-XYOKQWHBSA-N 443.287 4.299 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccc(OC)cc3)=NC2=O)ccc1OCCC(=O)O 16920065 QVJKIQUHAGEADC-CPNJWEJPSA-N 442.493 4.030 10 10 IICE COc1ccc(N2CCN(C(=O)COc3ccc(OCc4ccccc4)cc3)CC2)cc1 21585259 HNRDNHPPGNZUNG-UHFFFAOYSA-N 432.520 4.002 10 10 IICE CCOC(=O)CCCCCN1C(=O)/C(=C\c2ccc(OC)c(OCC)c2)SC1=S 206722210 NCUDEBQWZZKRSQ-NBVRZTHBSA-N 437.583 4.419 10 10 IICE Cc1cc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)nn1-c1ccccc1 726567202 NAOXDHDDKMFMLA-UHFFFAOYSA-N 426.467 4.181 10 10 IICE CC/C(=C/C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1ccccc1 728818523 SJVDGOLKNSPUIJ-UZYVYHOESA-N 445.542 4.052 10 10 IICE C[C@@H](NC1CCN(C(=O)c2ccccc2)CC1)c1ccc(N2CCOCC2)cc1Cl 765367242 ABSNVGWWAABONP-GOSISDBHSA-N 427.976 4.132 10 10 IICE COc1ccc([C@@H]2CCCN2C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1 769041401 JCTYQNAHGVOYEO-SANMLTNESA-N 448.611 4.274 10 10 IICE CCOC(=O)C[C@H]1C[C@H](OC)CN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 775971942 AYJJWAMWIKVEFD-UXHICEINSA-N 438.528 4.351 10 10 IICE Cc1cc(F)cc([C@@]2(F)CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)C2)c1 799893759 WPDRHOYESYZKIP-HOYKHHGWSA-N 429.511 4.312 10 10 IICE Cc1cc(-c2nnc(N3CC[C@]4(CCOC4)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802695028 PDUMUQRFGAFBLB-NVQXNPDNSA-N 447.583 4.148 10 10 IICE Cn1ccnc1SCc1cccc(C(=O)NCc2cc(Br)ccc2O)c1 804739917 YRCMFTXATRVSBL-UHFFFAOYSA-N 432.343 4.111 10 10 IICE C[C@@H](NC(=O)N1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CC1)c1ccc(N(C)C)cc1 814383478 UOYHHCSUYQLFNA-RLLQIKCJSA-N 430.593 4.102 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(O)cc(C(F)(F)F)c1 857473234 UVJDBJYGTGXTFG-MRXNPFEDSA-N 428.838 4.164 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OC)c(OC)cc2NC(=O)[C@@H]2C[C@@H]2C)cc1 918625371 YXQWEWPEGLMGFN-QFBILLFUSA-N 439.556 4.075 10 10 IICE COCCOc1ccccc1COC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1126787208 PLQOIUJPUOLBBI-UHFFFAOYSA-N 436.552 4.176 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3ccncc3)nc3ccccc23)N(C)C)cc1 1134681793 ILAWTERUUFTUGY-AREMUKBSSA-N 439.563 4.396 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H](Cc1ccccc1)c1ccccc1 1138054112 XNJMKRZRIDMISD-GOTSBHOMSA-N 447.531 4.105 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2 1140198514 GSJOGPUZRKGMPF-UHFFFAOYSA-N 431.529 4.101 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@](C)(O)c3ccc(F)c(Br)c3)cc2)CC1 1144772775 KMFQILNPEZXJIF-JOCHJYFZSA-N 449.364 4.348 10 10 IICE Cc1cc(=O)oc2cc(N(C)C(=O)/C=C\[C@H]3CCCN(C(=O)OC(C)(C)C)C3)ccc12 1157108366 XZEUSJMIDHOQGP-SDMNGIDPSA-N 426.513 4.268 10 10 IICE CCN(Cc1c(CO)cnc(C)c1O)C(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1161767833 XXIPJFZJZPMLEC-UHFFFAOYSA-N 427.932 4.311 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](c3ccccn3)c3ccccc3OC)C2)cc1 1225526594 QAHYXGKXMVZRLF-UQBPGWFLSA-N 446.551 4.014 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)cc1 1228489461 ZWDAOWQRJNZGOT-VSKRKVRLSA-N 427.593 4.068 10 10 IICE Cc1cn(C2CCOCC2)nc1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1270438746 BOTBSXQXBCOZCN-MRXNPFEDSA-N 430.980 4.363 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCC[C@@H]1CC1(Cl)Cl 1280372612 DILBBNLLWBBQCY-NASPGAHYSA-N 449.450 4.430 10 10 IICE Cc1ccc(C(=O)C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cc1 1289508045 GPZDKUJMNYRJCY-UHFFFAOYSA-N 435.281 4.289 10 10 IICE COCOc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1297218848 XUVRPUYOZIUELB-UHFFFAOYSA-N 430.302 4.487 10 10 IICE CO[C@@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CC1(C)C 1300810009 LNYPDUBTBPSGMH-QGZVFWFLSA-N 429.615 4.445 10 10 IICE CC(C)c1ncc(OCc2ccccc2)c(C(=O)N2CCOc3cc(N(C)C)ccc32)n1 1360848498 WOFPYGNIUZLLAV-UHFFFAOYSA-N 432.524 4.284 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)c2C)c1 1438308400 ATSNEXYEZRQBDE-UHFFFAOYSA-N 429.480 4.426 10 10 IICE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1438900056 KDEYVPCVXVQIKW-ICFOKQHNSA-N 433.474 4.057 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3C[C@@H](C(C)(C)C)c4ccccc43)CC2)cc1 1448666660 DXWJXQJNBAJXPA-YAOQVBECSA-N 447.579 4.077 10 10 IICE COc1ccc(N2CCN([C@@H]3CCN(c4ccc(Cl)cc4Cl)C3=O)CC2)cc1F 1459746627 GLUPWUTZMPXGCW-LJQANCHMSA-N 438.330 4.069 10 10 IICE Cc1cc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cnc1F 1463207767 KFIGOBRVRJNLIV-UHFFFAOYSA-N 426.249 4.254 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@H]1Oc1ccccc1 1469859082 ISRUMJWBVPUXRU-ZHALLVOQSA-N 425.312 4.123 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc2ccccc2cc1OC(F)F 1470447544 JAUKDMJVSPKSCU-UHFFFAOYSA-N 426.463 4.332 10 10 IICE CCCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@@H]1C[C@@H](OCC)C12CCCC2 1470771083 AFHZARUDPARBPH-UEVCKROQSA-N 429.605 4.433 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1 1501186216 GJVZARAYNHWBHT-UHFFFAOYSA-N 434.588 4.115 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2ccccn2)n1Cc1ccc(N(C)C)c(F)c1 1505236588 YDWDBIONWOXFAU-INIZCTEOSA-N 428.581 4.171 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)n1CCCSc1nccs1 1509156664 JSGSVFGNSBZCBB-ZIAGYGMSSA-N 449.568 4.272 10 10 IICE CC(C)Cc1nnc(N2C[C@@H](C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1509163165 YLAUXEMEBITYLY-LJQANCHMSA-N 443.661 4.082 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3sc(SC4CCCC4)nc3C)C2)cc1 1532105302 KFWVOLOCVYBBSY-MRXNPFEDSA-N 431.627 4.432 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C3(Cc4ccc(OC(F)(F)F)cc4)CC3)C2)cc1 1532105394 LWQMHNRDQPONLK-QGZVFWFLSA-N 434.458 4.312 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1 1543651076 AERADRFJODGDPX-RUZDIDTESA-N 429.564 4.230 10 10 IICE C[C@@H]1CCCN([C@H](C)Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)C1 1544077505 IDQGBPPHCNJOJP-WOJBJXKFSA-N 425.621 4.473 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2cccc(Br)c2)c(C)n1-c1ccc(F)cc1 1546098437 FMYDDDJVRKPRHA-HXUWFJFHSA-N 431.305 4.459 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1557063805 ZXNOYRBMILHLGT-HNAYVOBHSA-N 448.394 4.468 10 10 IICE CC(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1557640873 VZFWLSAAUIVBJD-SHQCIBLASA-N 449.639 4.058 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1586060943 LFJOBYREEKSNMS-HXUWFJFHSA-N 432.952 4.007 10 10 IICE Cc1ccc([C@@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCOCC2)cc1 1596952921 JEGOERXEPPIGLP-AREMUKBSSA-N 445.563 4.018 10 10 IICE CC(C)c1ccccc1N(C)CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1618309581 YXGFHNYXUWYUSU-OALUTQOASA-N 427.564 4.315 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCN3CCN(c4ccc(F)cc4)CC3)c2C)c1 1624339468 FJEHGUUFGWAUHX-UHFFFAOYSA-N 434.559 4.094 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1626155591 YQSPLDBQAFHTCZ-HUUCEWRRSA-N 445.560 4.088 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC2(c3cccc(Br)c3)CCOCC2)cc1 1627377570 NLJILJAVLLAAKD-UHFFFAOYSA-N 431.290 4.047 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](C)[C@H]3CN(Cc4ccccc4)CCO3)c2C)c1 1628542984 QIXOBCHMSRQGIU-QFQXNSOFSA-N 431.580 4.422 10 10 IICE Cc1ccc(-c2nc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cs2)o1 1630256996 KKZFKBSMCZSTGT-INIZCTEOSA-N 431.945 4.465 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1c(Br)sc(C)c1C 1632701525 GDZNMTTZHQTENP-UHFFFAOYSA-N 446.750 4.302 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2cnc(Br)s2)CCCC1 1636459224 SSLBFWVXFSPRNP-UHFFFAOYSA-N 434.359 4.064 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 1639587736 DBMLJDDUEOJIHC-UHFFFAOYSA-N 437.496 4.135 10 10 IICE O=C(Nc1cc(-c2cccs2)on1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1648899921 AZFDOPFVCSWSOU-UHFFFAOYSA-N 447.519 4.223 10 10 IICE COC(=O)c1cnc(CSC2=NC(=O)/C(=C/c3csc4ccccc34)S2)cn1 1652014164 QJKVCHZHWIQOFO-SOFYXZRVSA-N 427.532 4.382 10 10 IICE CCC1(NC(=O)OC(C)(C)C)CCN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC1 1686826765 OTBZWVXHPSVQBG-LJQANCHMSA-N 446.636 4.471 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H](c1cccnc1)C(C)C 1694635492 XZSMECKQOIRCRO-DEOSSOPVSA-N 448.615 4.148 10 10 IICE CCc1nnc(N2CCN(Cc3ccsc3)CC2)n1Cc1ccc(N(CC)CC)cc1 1709149265 XDMQWHRNBWRMBK-UHFFFAOYSA-N 438.645 4.119 10 10 IICE CSCCCCn1c(C2CCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1712812122 ITIGICBTTPXUBS-UHFFFAOYSA-N 429.634 4.162 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CC[C@H](C(C)(C)C)C2)cc1F 1729330509 RMHDQLGTXAOQNY-FQEVSTJZSA-N 436.579 4.390 10 10 IICE CCN(CC(C)C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1746016997 JMBUGUZKMZGOOD-UHFFFAOYSA-N 448.615 4.079 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCC[C@](C)(OC)CC2)cc1 1746092325 IZGZSJYHLCDJAT-OFVILXPXSA-N 441.620 4.072 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](c3cnn(C)c3)C2)n1CCCSc1nccs1 1763598535 OVFXRIFWYBULSF-HOTGVXAUSA-N 431.635 4.158 10 10 IICE CCc1nnc(N(C)[C@@H]2CCC[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764699984 BOFUGYCNHOIZTO-AUSIDOKSSA-N 425.621 4.112 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)C[C@@H]2CCCCO2)cc1 1764935683 UVCOBRZOIPJZAZ-QHCPKHFHSA-N 434.588 4.240 10 10 IICE CCOCc1nnc(N2CCC(OC3CCCC3)CC2)n1Cc1ccc(N(C)C)cc1C 1766326996 SHLDVDJTBADSEG-UHFFFAOYSA-N 441.620 4.165 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1770784530 QASWUFPAUUCOKK-HKUYNNGSSA-N 443.592 4.279 10 10 IICE CCC(CC)C(=O)N1CCC(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)CC1 1860586046 RGOOSSIEKMLEKF-UHFFFAOYSA-N 432.520 4.075 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C(C)(C)C)C2)sc2c1CC[C@H](C(C)(C)C)C2 1865922463 LGPIJZLURBEONH-KBPBESRZSA-N 434.602 4.271 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)/C=C/c2cccc(Br)c2)c2nccn2C)cc1 1866124451 FLVKGEXYKGEDHA-JYNAJPCDSA-N 439.357 4.168 10 10 IICE CC(C)(C)OC(=O)NCC1(CO)CCN(c2ccc(OCc3ccccc3)cc2)CC1 2299506537 GFSHUUGVHLFOSS-UHFFFAOYSA-N 426.557 4.369 10 10 IICE COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)Nc1ccc(Cl)c(F)c1 2313682541 FRDSOXNSKUYFIK-UHFFFAOYSA-N 431.851 4.140 10 10 IICE O=C(COc1cccc(/C=C2\SC(=S)NC2=O)c1)Nc1ccccc1C(F)(F)F 15056033 MPBUULUCOSWGBE-DHDCSXOGSA-N 438.452 4.212 10 10 IICE O=C(NN1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S)c1ccc(O)cc1 16929779 NCSZWSYNENTXIX-AUWJEWJLSA-N 425.318 4.245 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccc(C)cc1C 20236239 DDVLFBJXEWYUKK-SEOKDCOXSA-N 447.491 4.220 10 10 IICE COc1ccc(N2CCN(C(=O)CCn3c(-c4ccccc4)cc(C(C)=O)c3C)CC2)cc1 20761332 CIHFGFPNKQDUCG-UHFFFAOYSA-N 445.563 4.414 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N(CCCC)C1=O 33467323 MQDJSJVRPLNCSJ-PEZBUJJGSA-N 430.599 4.298 10 10 IICE CC1=NN(c2ccc(S(N)(=O)=O)cc2)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2)o1 100147499 IVMBWAIEMYEVTA-XDHOZWIPSA-N 441.896 4.054 10 10 IICE COc1ccc(N2CCC(NC(=O)/C=C/c3c(C)nn(-c4ccccc4)c3C)CC2)cc1 110353920 WNEVDRIALYHBCA-BUHFOSPRSA-N 430.552 4.296 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)c2C)cc1 110413013 HOCPFLZYYPRDQH-WOJBJXKFSA-N 439.600 4.064 10 10 IICE CCCN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1cc(C)ccc1OC 586247084 JCHPTMCUBCUVKV-UHFFFAOYSA-N 449.528 4.384 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N(C)C)CC2)c(C)n1-c1cccc(C(F)(F)F)c1 727237129 CPDRLSMNQNFOHA-UHFFFAOYSA-N 435.490 4.096 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@@H](O)COCc1ccccc1 731106711 CLSMAKOBVCTIOB-JOCHJYFZSA-N 426.557 4.042 10 10 IICE CCOc1ccc(O)c(CN[C@@H](c2cccc(S(C)(=O)=O)c2)c2cc(F)ccc2F)c1 742384768 MWAGJPMHIJNBKW-QHCPKHFHSA-N 447.503 4.352 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](C)[C@@H]2c2cccc(F)c2)c1 747460870 CMHLLRVKSCUDRX-BXKMTCNYSA-N 426.532 4.149 10 10 IICE C[C@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(N2CCCCCC2)cc1 767158336 WZHJKRKGVAAUIN-WDDWZANVSA-N 446.639 4.317 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc(-c2csnn2)cc1 768879907 ZSTSEJUZLNBTJH-UHFFFAOYSA-N 448.596 4.059 10 10 IICE Cc1cc(CCNC(=O)NCc2ccc(NC(=O)N(C)C)cc2)c(C)n1-c1ccccc1 793495889 BSNNESKJDKATBY-UHFFFAOYSA-N 433.556 4.230 10 10 IICE O=C1N/C(=C\c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C(=O)N1c1cccc(Cl)c1 794709752 CKXLFKNCMYPHSV-BOPFTXTBSA-N 426.860 4.336 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCCc2nnc(-c3ccccc3)o2)C1 806109463 DVUHNLOXTDOSGM-UHFFFAOYSA-N 444.535 4.244 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]3C)ccc21 1137902015 SIZRQLYKOXXJMJ-IAGOWNOFSA-N 443.588 4.374 10 10 IICE COc1ccc2c(c1)c(C(=O)NCc1ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c1)c(C)n2C 1141901993 VQJXEHJAHXZMTB-HOTGVXAUSA-N 439.531 4.178 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(N(C)C)c2ccccc2n1 1149901185 WTEKXEJULYFBMY-UHFFFAOYSA-N 428.330 4.431 10 10 IICE COC(=O)[C@@H](Cc1cc2ccccc2o1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1154569877 BQHVUACTSQQXAJ-HSZRJFAPSA-N 446.503 4.363 10 10 IICE Cc1cccc([C@@H]2CCCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1C 1251105125 REOWKBISCHBCFC-VWLOTQADSA-N 448.611 4.442 10 10 IICE COc1ccc(N2CCN(C(=O)NCCc3ccc(Cl)c(Cl)c3)CC2)c(OC)c1 1255277715 YAINJPPMLPHANX-UHFFFAOYSA-N 438.355 4.085 10 10 IICE CCN(C)c1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1Cc1ccc(N(C)C)c(F)c1 1295124881 AANQLBOBDVGYLV-IBGZPJMESA-N 446.571 4.060 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@@H]3CCOC3)n2CC(F)(F)F)c(C)n1-c1ccccc1 1304192562 ZSYYBJOIZYWXIY-KRWDZBQOSA-N 433.478 4.388 10 10 IICE COC(C)(C)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1315138107 CQDQVKOHPRHAPE-OAQYLSRUSA-N 427.593 4.181 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1cnn(-c2cccc(F)c2)c1C(F)(F)F 1436139434 XUFAENCNGBDMHI-UHFFFAOYSA-N 425.729 4.472 10 10 IICE O=C(CCc1nc(-c2cc(Br)cs2)no1)NCc1cccc(Cl)c1O 1457035364 AXEBHQSQCGJYIA-UHFFFAOYSA-N 442.722 4.169 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)cc2)CC1 1462809903 SVYABARCZGEYIH-NHCUHLMSSA-N 446.378 4.115 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC3(c4ccc(Br)cc4)CC3)C2)cc1 1470592452 DIRUFYLOHNWDNI-MRXNPFEDSA-N 444.373 4.273 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@]3(C)Cc3cc(F)c(F)c(F)c3)C2)cc1 1470771342 DGUQNTVDNGKDCS-XDHUDOTRSA-N 447.501 4.498 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3C[C@H]3c3ccc(Br)cc3)C2)cc1 1478547936 DYXKKDZUAUIUKL-GQWLDOHISA-N 444.373 4.139 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCc2c[nH]c3cc(F)c(Cl)cc23)cc1 1479068316 ZLDVYUOWRQZHRK-UHFFFAOYSA-N 432.927 4.289 10 10 IICE C[C@H]1SCCN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)[C@@H]1C 1494691640 XQTGYATYFURPOP-HZPDHXFCSA-N 446.671 4.233 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCCCC2)n1Cc1ccc(N(CC)CC)cc1 1496984410 MBPNXROASFRPET-UHFFFAOYSA-N 440.636 4.471 10 10 IICE CCc1nnc(N(C)Cc2ccc(Br)o2)n1Cc1ccc(N(C)C)c(F)c1 1513788533 VISOEXFKFNLGBW-UHFFFAOYSA-N 436.329 4.086 10 10 IICE CO[C@H]1CCCN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)C1 1518598305 SOBJHUWMNQXQQB-IBGZPJMESA-N 443.642 4.317 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cn(CCc4ccccc4)nn3)cc2Cl)C1 1524252733 CIGSQJZKNIHTBB-SFHVURJKSA-N 437.975 4.341 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](SCc3ccccc3)C(C)C)CC2)c(OC)c1 1530968697 WZIQQLCUGOEPNV-QHCPKHFHSA-N 428.598 4.310 10 10 IICE COC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccccc1F 1533844524 ZKHZGKFCESQXAT-JOCHJYFZSA-N 428.891 4.460 10 10 IICE COc1cc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3c3ccccc3)CC2)cc(OC)c1OC 1536626561 OZJRXCXTHBYOJF-FGZHOGPDSA-N 438.568 4.335 10 10 IICE CCC(CC)Oc1ccc(C(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)cc1 1538077320 UQPBBOJAXLUFEV-UHFFFAOYSA-N 442.556 4.242 10 10 IICE Cc1nc([C@@H]2CCCN(c3nnc(C)n3Cc3ccc(N(C)C)c(F)c3)C2)sc1C 1542046425 AQQKFIUXHFMSFW-GOSISDBHSA-N 428.581 4.297 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)cc2[N+](=O)[O-])C1 1544164453 JFGJMQOOLZAWSQ-QZTJIDSGSA-N 436.556 4.390 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)cc1 1547443889 GBYRNPPRTAYFBN-WZOHSFFVSA-N 441.620 4.069 10 10 IICE Cc1csc(NCCNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 1556944819 CTDPWZNKBPWQEV-UHFFFAOYSA-N 433.375 4.463 10 10 IICE COc1cc(CC2CN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)cc(OC)c1 1566151408 PSRKNNZOIVEJCA-UHFFFAOYSA-N 432.520 4.239 10 10 IICE Cc1cc(C(=O)Nc2c(C(N)=O)n[nH]c2C(C)C)c(C)n1-c1ccc(Br)cc1 1570306857 QUWMVULDNPVDSI-UHFFFAOYSA-N 444.333 4.054 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)c2)CC1 1585587396 PUZIHJORNNXVCL-UHFFFAOYSA-N 438.572 4.452 10 10 IICE CC(=O)N1CCN(c2ccc(NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)cc2)CC1 1587860379 ZTNXGFHELJAHRI-UHFFFAOYSA-N 434.515 4.154 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H](O)Cc2cccc(C(F)(F)F)c2)cc1 1595385434 PFYKFKPCOHMHIA-JOCHJYFZSA-N 446.469 4.497 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cnn1-c1cccc(F)c1 1596732935 LFPVRRWZZXRACP-UHFFFAOYSA-N 436.531 4.325 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NCc3cccc(Cl)c3O)c2)c1 1606860473 MJPCBPDLWRZFNO-UHFFFAOYSA-N 444.940 4.393 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C)C3)n2CCCCCCO)c(C)n1-c1ccccc1 1611935745 HJTNAVFDWLXRIH-FQEVSTJZSA-N 437.588 4.130 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C 1617756162 GSIOEDYSNPRMPQ-LJQANCHMSA-N 425.529 4.036 10 10 IICE Cc1cc(C(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)c(C)n1-c1ccc(F)cc1 1626059806 GWMSUKSURUZTGL-XMMPIXPASA-N 439.506 4.176 10 10 IICE Cc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c(OCC(=O)N(C)C)c1 1626542993 HTERMSGBAFVMKQ-UHFFFAOYSA-N 447.535 4.243 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)c1C 1628457212 QHFZBVCFSHFJSH-UHFFFAOYSA-N 444.623 4.292 10 10 IICE Cc1ccc(-c2nc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cs2)o1 1630256997 KKZFKBSMCZSTGT-MRXNPFEDSA-N 431.945 4.465 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CC[C@H](c2nccs2)C1 1633225742 LAPGXFXDNSEFPA-JMRXEAOASA-N 449.648 4.202 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ncc(Br)s2)CCCC1 1644163455 DIJDXQRKQPNHMZ-UHFFFAOYSA-N 434.359 4.064 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1 1644638943 DFGWRRPBYCVKSV-XMMPIXPASA-N 429.564 4.296 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)C[C@H](O)COCc2ccccc2)c1 1648694423 RUWNBMDXOODZIA-NRFANRHFSA-N 426.944 4.397 10 10 IICE CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@H](C)c1ccccc1O 1648889711 INVKSLZVFOCVGU-SJKOYZFVSA-N 441.380 4.428 10 10 IICE Cc1cc(CNC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1Br 1683200349 WKGFTTKRDYDOHN-GOSISDBHSA-N 433.346 4.354 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCC1(C)CCN(C(=O)OC(C)(C)C)CC1 1685854601 RIBJBTXTKVOOPW-UHFFFAOYSA-N 444.620 4.465 10 10 IICE COC(=O)C(C)(C)[C@H]1CCCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)C1 1687218075 ZJFBMCBSVJAEGG-NRFANRHFSA-N 425.573 4.257 10 10 IICE CC(C)c1nnc(N2CC(C)(C)OC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1691718881 GXWZKXFJBMSFPE-UHFFFAOYSA-N 443.661 4.397 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC(C)(C)O1 1693814061 YYSKVWDLYFLJJS-JKSUJKDBSA-N 437.635 4.162 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](COC)OC)C(C)C 1695536145 QBKOOQSDMPQELF-NRFANRHFSA-N 425.577 4.249 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCOC[C@H](C3CCC3)C2)cc1F 1696609500 DMLOOFFEZFVCQU-HXUWFJFHSA-N 443.611 4.373 10 10 IICE Cc1ccoc1Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H](C)CC(N)=O 1707021045 ZYSGURCAUATDGW-QGZVFWFLSA-N 446.555 4.002 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1712614796 VVZIJYALQHNBJU-UHFFFAOYSA-N 435.572 4.172 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C)C1 1731034605 NDDZITLFQALNMN-ROUUACIJSA-N 425.602 4.329 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](Oc3ccccn3)C2)n1CCCSc1nccs1 1752722408 WSIPRVYLMHXRQL-IRXDYDNUSA-N 444.630 4.483 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCSC1 1761842079 BFWFTHIXBGVRFX-RTBURBONSA-N 429.634 4.270 10 10 IICE CCC(CC)(Cn1c(C2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1764029589 WBFVPAFCKWBSLK-UHFFFAOYSA-N 427.593 4.086 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCO[C@@](C)(C(C)(C)C)C2)cc1F 1766909878 VQQNPINRESJPDH-XMMPIXPASA-N 440.567 4.168 10 10 IICE Oc1cccc(Br)c1CN[C@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878709114 DGBYKTACPPLKJT-RDJZCZTQSA-N 429.280 4.307 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@@H]1CNCc1cc(Br)ccc1O 2095170795 NHDOLHNJFGKCCG-MRXNPFEDSA-N 425.367 4.424 10 10 IICE COCCNCc1ccc(N(C)[C@@H]2CC[C@H]2OCc2ccccc2)cc1Br 2156444829 KJLPZILIZROKMM-FGZHOGPDSA-N 433.390 4.369 10 10 IICE Cc1cc2c(n1-c1ccc(Br)cc1I)CCC[C@@H]2N 2231671417 ZQTXRZANIQHZKC-ZDUSSCGKSA-N 431.115 4.489 10 10 IICE CN1CCc2cc([C@@H](N)C3(COCc4ccccc4)CN(C(=O)OC(C)(C)C)C3)ccc21 2256692697 VZEUITMXDOHRCM-HSZRJFAPSA-N 437.584 4.133 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3ccc(CC(=O)O)cc3)C2=O)cc1OC 2314532837 MYIKLVLXCOZMHV-UHFFFAOYSA-N 429.519 4.127 10 10 IICE CC(C)OC(=O)c1cccc(N2C(=O)C(=Cc3ccc4c(c3)OCO4)SC2=S)c1 2321718197 XMNDBNOJMWCTRF-UHFFFAOYSA-N 427.503 4.386 10 10 IICE CCOC(=O)N1CCC2(CC1)N=C(c1ccccc1)C[C@H](c1cccc(OCC)c1O)N2 65298346 ONRWXFXQLDGKPZ-OAQYLSRUSA-N 437.540 4.263 10 10 IICE biogenic CC(C)c1nnc(NC(=O)CSc2ncc(-c3ccccc3)n2CC(F)(F)F)o1 109623935 WVNCLPHDNOTWEE-UHFFFAOYSA-N 425.436 4.350 10 10 IICE Cc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)SC1=S 205691328 CHDPSOBNONBHAR-SFQUDFHCSA-N 427.507 4.133 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(O[C@H]3CCOC3)cc2)C1 435874150 ZHUAWUBCCOGHIK-NRFANRHFSA-N 433.552 4.214 10 10 IICE CCc1[nH]nc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1Br 444287409 KAACENGMAIWXOZ-UHFFFAOYSA-N 444.377 4.095 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cccs3)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526379978 JLUDEMRIWBERBY-FQEVSTJZSA-N 425.462 4.234 10 10 IICE C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(Cc2ccc(N)cc2)n1)c1cc2ccccc2o1 751930725 IALGOKHDTSXFNP-LSDHHAIUSA-N 449.532 4.485 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1ccc(Cl)c(Br)c1 762503187 JTSSTJNXQUKFLL-UHFFFAOYSA-N 430.736 4.422 10 10 IICE COCc1c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)oc2ccccc12 768533465 QMQPRANKANBPOZ-UHFFFAOYSA-N 433.552 4.041 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H]1c1ccccc1I 779519417 DBVMGCBOBRKJOJ-YHWKNFMLSA-N 435.261 4.079 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4cccc(C(F)(F)F)c4)n3C)CC2)cc1 809877221 CMJFSFMUGMTQCO-UHFFFAOYSA-N 431.462 4.226 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(I)c(F)c1 1124622545 IRRWZIPPHKPZSU-UHFFFAOYSA-N 438.284 4.303 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)C[C@@H]2CCC3(CCOCC3)CO2)cc1 1125963829 MMHLQDSSIHBMMR-IBGZPJMESA-N 428.495 4.009 10 10 IICE Cc1ccccc1-c1nc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cs1 1129661608 QBHDGDGVFRSXCP-UHFFFAOYSA-N 429.492 4.163 10 10 IICE C[C@@H]1C[C@H](NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCS1 1134491330 CFMCQMAODFCIJV-VVKGIKJRSA-N 426.654 4.130 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)cc([N+](=O)[O-])c1N 1136335236 SMRBKMDTQMRZDE-UHFFFAOYSA-N 435.322 4.056 10 10 IICE COc1ccccc1[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCSc1nccs1 1136661669 MNWNYGJUVZUPQR-INIZCTEOSA-N 437.587 4.016 10 10 IICE COc1cc(CN2CCN(C(=O)c3cc(C)n(-c4ccccc4C)c3C)CC2)cc(OC)c1 1137248829 YAPSMPQRZCGBLZ-UHFFFAOYSA-N 447.579 4.378 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2CN2CCCCC2)c(C)n1-c1ccc(Br)cn1 1143500775 ZDAVKVMBGPFMHB-LJQANCHMSA-N 445.405 4.342 10 10 IICE Cc1cc(CC(=O)N2CCCN(C(=O)CCc3ccccc3)CC2)c(C)n1-c1ccccc1 1149101690 AQZQQLFNUXQMMW-UHFFFAOYSA-N 443.591 4.330 10 10 IICE Cc1onc(-c2cccs2)c1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150352866 BFESGEIWDMLBGR-INIZCTEOSA-N 431.945 4.465 10 10 IICE O=C(c1ccc(Cn2cc(Cl)cn2)s1)N(Cc1ccccc1O)C[C@H]1CCCO1 1151902346 BDCANZOTFDQJON-QGZVFWFLSA-N 431.945 4.173 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)CCCC1 1176055496 PBSMUTDJTHYMRQ-QFIPXVFZSA-N 446.469 4.397 10 10 IICE COc1ccc(N(CCc2ccccc2)CCS(=O)(=O)c2cccc(OC)c2)cc1 1191890764 BNOYJCGFXUEORX-UHFFFAOYSA-N 425.550 4.227 10 10 IICE CCn1c([C@@H]2CCCN2C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)nc2ccccc21 1256231660 AJCIXVMDDAGZTP-ZEQRLZLVSA-N 448.615 4.272 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N1CCCCC1 1295092288 JOLQCWFVUAJFFQ-UHFFFAOYSA-N 434.588 4.211 10 10 IICE CC(C)(C)OC(=O)NCCCSCCC(=O)NCc1ccc(N2CCCCC2)cc1 1299788339 KDJDFMRYXBMANG-UHFFFAOYSA-N 435.634 4.331 10 10 IICE C[C@@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1301350746 XVMOYOGOJHQSNQ-INIZCTEOSA-N 436.474 4.041 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@@H]1CCN(c2ccccc2F)C1=O 1307464573 IKNMAFPFEFWHRM-JOCHJYFZSA-N 439.531 4.409 10 10 IICE Brc1cc(CN[C@@H]2CCCC[C@H]2N2CCOCC2)ccc1N1CCCCC1 1308305580 QHLAPKMYKOVWDF-IFMALSPDSA-N 436.438 4.172 10 10 IICE CC(C)Cc1nnc(N2CCC(OCC3CC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1359817345 BWMIDBKSFFMAQV-UHFFFAOYSA-N 429.584 4.125 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H](C[C@@H]1CCCO1)C(F)(F)F 1435064453 KORVTTIJIUDRKW-IRXDYDNUSA-N 436.421 4.121 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(Cl)cc4)[nH]n3)cc2F)C[C@H](C)O1 1441780479 GJUXSPJYNJFYFQ-GJZGRUSLSA-N 442.922 4.413 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3CO)c2C)c1 1446281718 JHBUXRGPMJQOTM-OZXSUGGESA-N 431.580 4.015 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(Br)c(Br)[nH]1 1451671298 QQXMAUOJGOPWPS-LLVKDONJSA-N 443.183 4.275 10 10 IICE Cc1cc(C(=O)N(Cc2ccccc2)C[C@H](C)O)c(C)n1-c1ccc(Br)cn1 1465357555 VBWYEONTUBUQCO-INIZCTEOSA-N 442.357 4.275 10 10 IICE COc1ccc(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1S(C)(=O)=O 1469047316 ZUVNZKBJJYRBIP-UHFFFAOYSA-N 432.929 4.412 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc(OCc3cn4ccccc4n3)c2)cc1 1469803997 CGGLFHVFARZYFM-UHFFFAOYSA-N 444.535 4.130 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4c(cccc4C(F)(F)F)C3)C2)cc1 1470594083 RGQQYEHKRCQXLI-INIZCTEOSA-N 433.474 4.308 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@@]2(C)Cc2cccc(Br)c2)cc1 1473807093 IJQBCSXEPINLBP-QHCPKHFHSA-N 444.417 4.229 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1501844230 MHLBPLVWUDYUAF-QHCPKHFHSA-N 448.615 4.021 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1 1505051258 BDAFHPVOPMXLML-LJQANCHMSA-N 437.588 4.252 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H]3CCC[C@H](C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1510600393 CPYJQRFFOZODOI-AVRDEDQJSA-N 448.615 4.456 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H]1N(C(=O)OCc2ccccc2)CC1(C)C 1540488568 VVJOOSCNKFMEHG-QHCPKHFHSA-N 435.568 4.292 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N2CCC(C)CC2)cc1 1556366683 ARWXGBJGWNXRRL-UHFFFAOYSA-N 444.597 4.255 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(CN(CC)CC)o1 1556426416 LVILIJIKTXVYAM-UHFFFAOYSA-N 429.561 4.124 10 10 IICE Cc1ccc(C(=O)N2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1-n1c(C)cc(C=O)c1C 1556849302 ZMANPHDMHOHZNN-MHZLTWQESA-N 448.538 4.421 10 10 IICE COc1ccc(N2CCN(C(=O)CSc3ccccc3Br)CC2)cc1F 1566347750 SZUMOJSDZRRRBG-UHFFFAOYSA-N 439.350 4.038 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3sccc3-n3c(C)ccc3C)C2)cc1F 1567996471 WINVSMYNEUJMPY-MRXNPFEDSA-N 427.501 4.226 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NCc3ccc4cccnc4c3O)cc2C1 1570533508 FMXVIYURHFTAPP-UHFFFAOYSA-N 433.508 4.164 10 10 IICE O=C(c1cccc(O)c1O)N1CCN(Cc2ccc(-c3ccccc3Cl)s2)CC1 1623340963 KWZHSFXPOTWEOC-UHFFFAOYSA-N 428.941 4.438 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@]1(c2ccc(OCC)cc2)CC1(Cl)Cl 1623574595 SLPVHUFCPRQXGE-HXUWFJFHSA-N 429.340 4.408 10 10 IICE Cc1ccccc1NC(=O)[C@H]1CSCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1627692512 UCUVKAGNKYPZCN-HSZRJFAPSA-N 447.560 4.369 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)c1 1631189307 BJTQEIHLNPTLLX-XMMPIXPASA-N 429.520 4.000 10 10 IICE C[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)[C@@H]1CCNC(=O)OC(C)(C)C 1632029246 NPSOXDNFEHJWOK-UKRRQHHQSA-N 434.558 4.468 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1C[C@H](OC(C)(C)C)[C@@H]1n1cccn1 1635334220 CSQDULSPRQJWFO-XPWALMASSA-N 439.604 4.212 10 10 IICE COC(=O)CN(CC(=O)N[C@H](c1ccccc1)C1CCCC1)Cc1cc(Cl)ccc1O 1642071994 OQRLQHQTDDMBCJ-XMMPIXPASA-N 444.959 4.068 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@H](c3ccc(F)cc3)C3CCCCC3)nc12 1644158103 LSDIHYOSUAMKPW-NRFANRHFSA-N 426.492 4.162 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)Nc2ccc(F)cc2)c(OC)c1 1652958263 SVTYWPRFROXTLD-UHFFFAOYSA-N 437.471 4.170 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](C)Cc3ccccc3C(F)(F)F)C2)cc1 1680731171 ATZXYBQAMZPMTR-SJORKVTESA-N 435.490 4.471 10 10 IICE CCN(Cc1cccc(Br)c1)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1687022419 ANEUSUABPGANIP-SFHVURJKSA-N 432.362 4.268 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1695627682 ZMGJUDNCIXVJJA-FPOVZHCZSA-N 441.620 4.070 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2CCOC(C)C)c(C)n1-c1ccccc1 1724197348 DGFDHBGZZDDQBK-UHFFFAOYSA-N 434.544 4.402 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCSC1 1726877429 MXBKTLDHZHZEPW-AZUAARDMSA-N 429.634 4.018 10 10 IICE CNC(=O)[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(C)C 1729618659 BTOPMLKWTKMHFX-SFHVURJKSA-N 436.604 4.217 10 10 IICE CN(CCc1cccs1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1747900297 ZJJKMIJMEMEUOU-UHFFFAOYSA-N 445.643 4.058 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2nccs2)cc1 1764937293 PGMPFKBVTZVLOY-UHFFFAOYSA-N 447.612 4.251 10 10 IICE COc1ccc2c(c1)c(/C=C1/SC(=S)N(Cc3ccc(C(=O)O)cc3)C1=O)cn2C 1858590830 KYNIWCFTELQZKJ-DJKKODMXSA-N 438.530 4.287 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCC(C)C)C(=O)N(Cc3ccccn3)C2=O)cc1 1873167189 VQYPYPMSGSOPLN-UHFFFAOYSA-N 428.536 4.015 10 10 IICE C[C@H](O)c1ccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)cc1Br 2093155240 JQDJRIRQYLPNAV-HNNXBMFYSA-N 425.317 4.460 10 10 IICE COc1ccc(Br)c(CNCc2csc(NC(=O)OC(C)(C)C)n2)c1O 2227730005 SYAVJUYZZSZWHL-UHFFFAOYSA-N 444.351 4.257 10 10 IICE O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)C1=Cc1cccn1-c1ccc(O)cc1 2293205563 GLXLATPCGNXTGM-UHFFFAOYSA-N 442.258 4.156 10 10 IICE CC1=CC2=NC(=O)C(=Cc3ccc(OCc4ccc5c(c4)OCO5)c(Cl)c3)C(=N)N2O1 2297347855 YUAZCLROLNSJQA-UHFFFAOYSA-N 437.839 4.098 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@H](NCc3cc(Cl)cc(Br)c3O)[C@H]1C2 2308464584 WLEIWTXHUROHFJ-VCTAVGKDSA-N 431.758 4.296 10 10 IICE CCCOC(=O)CCCN1C(=O)C(=Cc2cccc(Br)c2)SC1=S 2314759329 BMTNZUGSDGJILS-UHFFFAOYSA-N 428.373 4.384 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@H](Cc1ccc(Br)cc1)NC(=O)OC(C)(C)C 2362991588 WDVFQZWRAOGCFV-HNNXBMFYSA-N 440.342 4.044 10 10 IICE CC[C@@H](C)[C@@H](CC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2380720001 FLIHZCQOBBKXOS-IUODEOHRSA-N 443.382 4.409 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](C)CCCNC(=O)OC(C)(C)C)c(O)c1Br 2380760085 UNRFNLACKRIDSB-CQSZACIVSA-N 443.382 4.363 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CC[C@@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2380760980 BYGBITGEVJTZOK-HIFRSBDPSA-N 441.366 4.210 10 10 IICE COc1ccc(OC)c(/C=C2/C(=O)N(c3ccc(Br)cc3C)C(=O)N=C2O)c1 1206330 HLIOUGOKGMJULA-XNTDXEJSSA-N 445.269 4.281 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S)Nc1nccs1 15040945 VOOOLFHHUDHORD-GDNBJRDFSA-N 428.564 4.245 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1ccccc1C 20236499 BGEFEPNUCZFUAP-DEOMXOCUSA-N 447.491 4.302 10 10 IICE NCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@@H]32)cc1Br 705883921 UDGKUCKUXPJMKO-RJSMDTJLSA-N 426.402 4.255 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)C1 742140969 ZHNANXHWODLCJF-IBGZPJMESA-N 435.490 4.357 10 10 IICE C[C@@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1cccnc1 742754944 SETJLVSRAOBJON-LAUBAEHRSA-N 426.561 4.023 10 10 IICE C[C@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccc(S(C)(=O)=O)cc1 745389175 HYENKXISHYYFDK-KRWDZBQOSA-N 430.570 4.401 10 10 IICE Cc1ccc(/C=C\C(=O)N(C[C@@H](C)NC(=O)/C=C/c2ccc(C)nc2)c2ccccc2)cn1 754259199 GXCPMOHRTRBMEO-KHZFLXNBSA-N 440.547 4.358 10 10 IICE COc1ccc(S(=O)(=O)Nc2cccc(CN[C@@H](C)c3cc(OC)ccc3O)c2)cc1 756581166 AAXAHAGBEQMJHU-INIZCTEOSA-N 442.537 4.061 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3cncc(Br)c3=O)c2C)c1 760438322 NQDQHUHRASAKMN-UHFFFAOYSA-N 432.343 4.018 10 10 IICE CC(C)Oc1cccc([C@H](O)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 768039395 YUPMDQWZORDKIO-AREMUKBSSA-N 449.595 4.045 10 10 IICE COC(=O)c1ccncc1C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)c(Cl)c2)c1C 771368734 CVXLCBQHZOMZNI-UHFFFAOYSA-N 444.846 4.108 10 10 IICE Cc1cc(Br)c(O)c(CN2CCOC[C@H]2c2noc(-c3ccccc3)n2)c1 781921045 RDOHRBIGQLSXLW-KRWDZBQOSA-N 430.302 4.087 10 10 IICE COc1cc(S(=O)(=O)Nc2nc(-c3ccc(OC)c(Cl)c3)cs2)ccc1F 786874427 PXPALCXQBHRFAJ-UHFFFAOYSA-N 428.894 4.421 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2C[C@H](C[C@H]3COCC(=O)N3)c3ccccc32)c1 813633878 VWYXRXRRPZBMGT-SFTDATJTSA-N 443.547 4.052 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCc2ccc(Cn3ccccc3=O)cc2)cc1 919916475 MWKAWAFDBLROMQ-UHFFFAOYSA-N 432.568 4.084 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(C)nc3c2cnn3Cc2cccs2)cc1 1130745230 QTHTWJNPTXPROL-UHFFFAOYSA-N 449.580 4.067 10 10 IICE Cc1nc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1-c1cnn(C)c1 1141321601 NEAGEDVMRIUVAC-UHFFFAOYSA-N 427.508 4.192 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc([N+](=O)[O-])c1Cl 1148444174 OPLRISIUPYBJPG-GFCCVEGCSA-N 425.819 4.248 10 10 IICE CCC[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1192858453 LFLSOUIPUGYPHD-SELNLUPBSA-N 427.564 4.187 10 10 IICE COc1cc(N2CCN(CCCOc3cccc4ccccc34)CC2)cc(OC)c1OC 1193187981 IKNXXMFOQPLKJC-UHFFFAOYSA-N 436.552 4.457 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Cl)cc(F)cc3Br)CC2)cc1 1266268220 CIGGNQBNPDWXJU-UHFFFAOYSA-N 427.701 4.213 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1-n1c(C)cc(C=O)c1C 1296900446 KLIZKUALYLAXID-QHCPKHFHSA-N 444.535 4.251 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC(c2ccc(F)cc2)C1 1298405203 RMWZQOYRRPUKOF-ODLFYWEKSA-N 444.528 4.182 10 10 IICE Cc1cc(C(=O)N[C@@H](CO)c2ccc(Br)cc2)c(C)n1-c1ccc(F)cc1 1298666671 YWPOFKLWTUGAFG-FQEVSTJZSA-N 431.305 4.459 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC3(OC)CCCC3)CC2)cc1F 1300247464 LFCPLBIFXSDXIL-UHFFFAOYSA-N 445.583 4.009 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCNC(=O)C(C)(C)C 1305380288 DXTHTEIUPNDLNJ-IBGZPJMESA-N 440.636 4.191 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@]2(C(=O)O)CCCN(Cc3ccccc3)C2)c1C 1346271839 AOJKYXAHQXZVHG-MHZLTWQESA-N 445.563 4.252 10 10 IICE CC[C@H](C)NC(=O)c1ccc(CNC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)cc1 1353815827 ISEUWCRPDYVOCK-KRWDZBQOSA-N 435.568 4.363 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CC=CCC3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1361045691 GANXYPUWDPGRED-NRFANRHFSA-N 446.599 4.233 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2(c3ccc(Br)cc3)CCC2)cc1 1437386663 SQUAAMREWQZUJB-UHFFFAOYSA-N 431.374 4.474 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(C)n1[C@@H]1CCCOC1 1444988621 QEAYRVACQCUTOH-UYAOXDASSA-N 447.526 4.457 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1ccc(S(=O)(=O)Cc2ccccc2)cc1 1456308780 GBGQDFZDGFVUDS-UHFFFAOYSA-N 431.513 4.449 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3C[C@@H](OC)C(C)C)CC2)cc1F 1504296796 RSAOCSGMPUXOGH-JOCHJYFZSA-N 445.583 4.081 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCCN(C(C)C)CC2)cc1 1515527028 ORMOWNGZIIUIIQ-UHFFFAOYSA-N 449.647 4.099 10 10 IICE CNC(=O)c1cc(Cl)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1525362964 HSTZNWUMKTYUMO-UHFFFAOYSA-N 438.959 4.060 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 1539581739 IVPLTFATGSNZNC-KRWDZBQOSA-N 445.466 4.403 10 10 IICE O=C(NC1(c2ccccc2)CCC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1543496249 LELHSGZXHIMNMJ-UHFFFAOYSA-N 428.535 4.064 10 10 IICE Cc1cc(CC(=O)NCc2ccc(OC3CCN(C)CC3)cc2)c(C)n1-c1ccccc1 1544381482 XIEYANJPBUQESJ-UHFFFAOYSA-N 431.580 4.426 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCCCSc2nccs2)[C@@H]1c1ccc(Cl)c(Cl)c1 1565620349 PEXVCLXQMYFFPR-WBMJQRKESA-N 444.409 4.268 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1 1565702125 UWNGXTANLUQRDX-OAQYLSRUSA-N 427.545 4.186 10 10 IICE O=C(Cc1csc(COc2ccccc2)n1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1566687196 WEVTZPPVIXHVEF-NRFANRHFSA-N 438.549 4.178 10 10 IICE CNC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C)Cc1ccc(F)cc1C 1570690703 ZRNGIFNWRYQFKV-OAQYLSRUSA-N 435.543 4.185 10 10 IICE COC[C@@]1(C(=O)OC(C)(C)C)CCN(C(=O)c2cc(C)n(-c3cccc(C)c3)c2C)C1 1587045581 ZATPXNLZPVJLGH-RUZDIDTESA-N 426.557 4.223 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(-c4noc(CC(C)(C)C)n4)cc3)C2)cc1 1587114546 SSIYIYNHDZJKEV-LJQANCHMSA-N 434.540 4.343 10 10 IICE Cc1cc(C(=O)CN2C(=O)NC3(CCCCCCC3)C2=O)c(C)n1-c1ccc(Cl)cn1 1613104340 CZWBIYLZXWZAFI-UHFFFAOYSA-N 442.947 4.360 10 10 IICE Cc1cc(C(=O)Cn2cnc(C(C)C)cc2=O)c(C)n1-c1ccc(Br)cc1 1613676795 GFMKSCRWODFOPM-UHFFFAOYSA-N 428.330 4.420 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1614226814 AOKLKCQKVMPLFV-SIKLNZKXSA-N 436.604 4.182 10 10 IICE COc1cc(N2CCN(CCOc3cc(Cl)cc(Cl)c3)CC2)cc(OC)c1OC 1617063770 LEVHBIPCCHAEQB-UHFFFAOYSA-N 441.355 4.220 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](CO)Cc2cc(F)c(F)c(F)c2)c1C 1618295497 QEZHHIGWHVOXPJ-SFHVURJKSA-N 430.470 4.401 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(NC2=NCCC2)cc1 1618427319 JSKVDDVICVKCAE-UHFFFAOYSA-N 436.556 4.293 10 10 IICE CC(=O)N1CC[C@@H](C)c2ccc(S(=O)(=O)Oc3ccc4c(c3)c(C)c(C)n4C)cc21 1622251930 KKVYABCNEISEDB-CQSZACIVSA-N 426.538 4.423 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(C(F)(F)F)c(F)c3C)CC2)c(OC)c1 1623763750 CLLKDRDXQILHAQ-UHFFFAOYSA-N 426.410 4.133 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H]3CC(=O)N(c4cc(Cl)cc(Cl)c4)C3)ccc21 1625848141 WPKYCBZZADPFJW-INIZCTEOSA-N 432.351 4.045 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(Cl)ccc3-n3cnnn3)cc2Cl)C1 1626168560 AKIFSDCFJKJPJA-AWEZNQCLSA-N 445.354 4.135 10 10 IICE CN(c1ccc(CNC(=O)c2cc(Br)c(C=O)n2C)cc1)C1CCCCC1 1627005943 JAVJCBLKMXXRJE-UHFFFAOYSA-N 432.362 4.299 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1628468857 MTKCJZMMJMDLCA-LJQANCHMSA-N 433.593 4.017 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(CC(=O)N4CCOCC4)cc3)c2C)c1 1630073241 OEIQTUABJSKYAG-UHFFFAOYSA-N 445.563 4.365 10 10 IICE Cc1ccc(C(=O)NC[C@@H](CO)Cc2ccc(F)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1635611879 JBMRLBRPPWSOPV-IBGZPJMESA-N 440.490 4.074 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@@H]2CCC[C@]2(NC(=O)OC(C)(C)C)C1 1636262268 DQAVIAPZQBJNLS-KHOMTPLRSA-N 444.620 4.081 10 10 IICE CCC(CC)(CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(=O)OC(C)(C)C 1636338620 IKKTWCBMOFVGMP-LJQANCHMSA-N 434.577 4.231 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1csc(-c2ccc(Cl)cc2)n1 1638529275 KCYIEMZDQLSJDU-UHFFFAOYSA-N 444.940 4.304 10 10 IICE CCCCC[C@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1647827418 BWSMVALBNIMFIK-VWPQPMDRSA-N 433.612 4.490 10 10 IICE COC(=O)[C@@H](C[C@@H]1CCCOC1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1648733925 CHCVEOPQKDLIMY-WMZHIEFXSA-N 426.557 4.306 10 10 IICE COC(=O)[C@H](C[C@H]1CCCOC1)NC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1648733926 CHCVEOPQKDLIMY-XXBNENTESA-N 426.557 4.306 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 1651540324 NBHJBWRGZKWLPR-SANMLTNESA-N 429.520 4.361 10 10 IICE CCn1ncc2c(=O)n(CC(=O)c3cc(C)n(-c4cc(Cl)cc(Cl)c4)c3C)cnc21 1656525744 NPEPXNGIYHCEOM-UHFFFAOYSA-N 444.322 4.210 10 10 IICE CN(CCOCCNC(=O)N(Cc1ccccc1O)C1CCCCC1)C(=O)OC(C)(C)C 1682840349 GENLUGDKKVQSRC-UHFFFAOYSA-N 449.592 4.120 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Cc2c(F)cccc2F)CC1 1684142444 ZOGGFDDXRHLJEM-UHFFFAOYSA-N 443.538 4.090 10 10 IICE CC(C)Cc1nnc(N2CCC[C@@H](C[C@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1692175140 GLLTUQQXNOMDND-PZJWPPBQSA-N 443.611 4.373 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1694324400 OFOBAZJGAQBPPT-MJGOQNOKSA-N 440.636 4.102 10 10 IICE COC1(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CCCC1 1711634650 KZUUHXLORITYFM-TZIWHRDSSA-N 442.604 4.498 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCC[C@@H](C)C2)n1Cc1ccc2c(c1)CCCN2C 1712550439 LWWYMMMVQQIVAZ-WOJBJXKFSA-N 441.620 4.059 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2CCOCC(F)F)c(C)n1-c1ccccc1 1724197196 FSEWGOMAKWAZNC-UHFFFAOYSA-N 447.555 4.188 10 10 IICE CCn1cc(CN(C)c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)cc2C)cn1 1728528813 GBTKLJSIGPBSNB-UHFFFAOYSA-N 433.560 4.122 10 10 IICE CCOCC(C)(C)Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1728969556 QDPWZAXODPMJDH-UHFFFAOYSA-N 443.636 4.364 10 10 IICE Cc1cc(-c2nnc(N3CCCC3)n2CCN(C)CC(F)(F)F)c(C)n1-c1ccccc1 1742118491 GZDYWWWSTDZZKZ-UHFFFAOYSA-N 446.521 4.447 10 10 IICE Cc1ccc(-c2nnc(N(C)CC3CCOCC3)n2CCCSc2nccs2)o1 1742183145 OYEXMCYRBMJERR-UHFFFAOYSA-N 433.603 4.348 10 10 IICE CC(C)Cc1nnc(Nc2cnn([C@H]3CC3(F)F)c2)n1Cc1ccc(N(C)C)c(F)c1 1750764878 WSNFVFHCGJMEKF-SFHVURJKSA-N 433.482 4.250 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2C[C@H]2CC=CCC2)c(C)n1-c1ccccc1 1751414142 DITIDHWSVKNBFL-RXVVDRJESA-N 446.599 4.409 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@@H](NCc1ccc(Br)cc1O)C2 1878876073 ZAPHLZQKQDAQHM-QBYUYEEZSA-N 429.330 4.123 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010406569 WFFNKBFNXXTYDA-MOPGFXCFSA-N 431.537 4.178 10 10 IICE O=[N+]([O-])[C@H]1CCc2c(c(S(=O)(=O)O)cc(O)c2N=Nc2c(O)ccc3ccccc23)C1 2296565798 FEHJAXFOIHYSTA-LBPRGKRZSA-N 443.437 4.047 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NC=C2C(=O)N(c3ccc(C)cc3C)N=C2C)cc1 2297451644 RSFZMSLAKLJFGQ-UHFFFAOYSA-N 440.569 4.052 10 10 IICE COc1ccc2c(c1)c(C=C1SC(=S)N([C@H](C(=O)O)c3ccccc3)C1=O)cn2C 2323865426 AJXGYZVXGAWROS-IBGZPJMESA-N 438.530 4.214 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1)N2)N1CCOCC1 14460316 RUTXHTQTSSBPOE-JQVVWYNYSA-N 430.957 4.187 10 10 IICE COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/c1ccc(C(=O)O)cc1 33294124 HXZNUYJTKWTFOV-LICLKQGHSA-N 431.366 4.281 10 10 IICE CC1=NN(c2ccccc2)C(=O)/C1=C(/Br)[C@H]1C(=O)N(c2ccccc2)N=C1C 109649250 RMYWIKONPQRBGB-SISFKGJESA-N 437.297 4.097 10 10 IICE CCCCC[C@H](N)c1cc(I)cc(I)c1O 396909125 HWPWKXXWDDHLTM-NSHDSACASA-N 445.082 4.182 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc(C(=O)N(C)C)cc3)no2)C1 574745755 PASTVELVWSRGOC-UHFFFAOYSA-N 443.551 4.208 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCO3)n2C[C@@H]2CCOC2)c(C)n1-c1ccccc1 752841957 FGFGDXVJBSXVGY-RBBKRZOGSA-N 435.572 4.004 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccccn3)cs2)cc1Br 759646117 DUDQDIGUHGZXQZ-UHFFFAOYSA-N 440.344 4.167 10 10 IICE Cc1ccccc1C1(CNC(=O)NCc2cc(Br)ccc2O)CCOCC1 804983842 VZNQXDVQMFAJDV-UHFFFAOYSA-N 433.346 4.011 10 10 IICE CC(=O)C(=O)COC(=O)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 808493714 DHQGWHDWFCKTCP-UHFFFAOYSA-N 444.559 4.270 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)o1 1083900220 BMYRYLMEACLYCS-DEDYPNTBSA-N 445.431 4.392 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4c(Br)cncc4s3)C2)cc1 1129993094 HPMXRWGHGSOJIT-ZDUSSCGKSA-N 446.370 4.324 10 10 IICE Cc1ccc(Br)c2cc(C(=O)NCc3ccc(N4CCOCC4)c(F)c3)[nH]c12 1136311507 RUNAUHOKGWCGII-UHFFFAOYSA-N 446.320 4.145 10 10 IICE CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438453 LCUHNWIHTRYPEJ-XLIONFOSSA-N 445.947 4.303 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1ccc(Cl)cc1 1142370528 CSMPMQBQWOWSNF-AXHZCLLHSA-N 444.019 4.390 10 10 IICE CC(C)COc1ccc(CC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1150347123 FRZYABYZEPZFMI-OAQYLSRUSA-N 430.976 4.404 10 10 IICE CSC1(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CCCCC1 1155562578 USSQXZXJCNFYCG-UHFFFAOYSA-N 440.612 4.050 10 10 IICE CSc1ccc([C@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1155884826 BHMDAUMSKVKAGW-ZDUSSCGKSA-N 448.591 4.467 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)CCOc1ccc(Cl)cc1Br 1157102627 NNHGIZVYZDUEAI-UHFFFAOYSA-N 433.726 4.379 10 10 IICE Cc1ccccc1CN1CCCN(C(=O)CN2CCCc3cc(OC(F)F)ccc32)CC1 1191655369 NCYJOLDOUSSDMG-UHFFFAOYSA-N 443.538 4.084 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1226235791 OPBHBGLYWKGETD-HKUYNNGSSA-N 440.975 4.181 10 10 IICE CC(C)(C)OC(=O)CN1CCC(NC(=O)N(Cc2ccccc2O)C2CCCCC2)CC1 1235059426 BRHBVHSAHBBLID-UHFFFAOYSA-N 445.604 4.043 10 10 IICE C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751309 ZTGBSDAVGMOQOZ-FUHIMQAGSA-N 429.511 4.278 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 1251981487 NAXXQWVJTBJMSM-DUXKGJEZSA-N 432.609 4.127 10 10 IICE CCOC(=O)C1(CC(F)F)CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC1 1251989585 PNLKTNNWHNNFTA-KRWDZBQOSA-N 439.547 4.002 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@]3(C)Cc3ccccc3F)C2)cc1 1252115917 NTLDIAZLYQKMND-KBMIEXCESA-N 425.548 4.467 10 10 IICE Cc1ccc(CC[C@@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1265461061 PXYYNTGDUFTBSD-RMENWYJGSA-N 446.569 4.456 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1299438927 RGRYONXDUILWFO-PZJWPPBQSA-N 425.573 4.446 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C(C)C)c(C)n1-c1ccccn1 1301111499 RJNYDEBSDYJSAX-FQEVSTJZSA-N 426.561 4.207 10 10 IICE CC[C@H](NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1cc(C)ccc1C 1313154139 PTOWJHPUSGHGKC-NRFANRHFSA-N 441.572 4.312 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCCc2ccnn2-c2ccccc2)cc1 1313308618 OQASIOBEIBCNCR-UHFFFAOYSA-N 443.551 4.486 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCc2ccccc21 1348739061 HSNIOXCAADUMON-RGEXLXHISA-N 426.538 4.396 10 10 IICE C[C@H](Oc1ccccn1)C(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 1350241321 XOXJLCPZNGPJOC-AWEZNQCLSA-N 432.388 4.136 10 10 IICE CC(C)(C)c1nnc(N2CC[C@H](C3CCOCC3)C2)n1CCCSc1nccs1 1359504148 MFPALPZCMMKTQZ-KRWDZBQOSA-N 435.663 4.467 10 10 IICE Cn1cc(CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc21 1445883276 MTZFQNJIZAABGO-HXUWFJFHSA-N 425.960 4.251 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1c2ccccc2CN1C(=O)OC(C)(C)C 1447566095 WPUZYLJLQYMKHE-HNAYVOBHSA-N 426.513 4.027 10 10 IICE COc1cc(OC)c(C[C@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c(OC)c1 1478667701 QCFCTPLVPBTZCA-KRWDZBQOSA-N 441.572 4.084 10 10 IICE Cc1nnc(N(CCC(F)(F)F)CC2CC2)n1Cc1ccc(N2CCSCC2)cc1 1511806433 KYWKOPVEFULBPX-UHFFFAOYSA-N 439.551 4.357 10 10 IICE CCN(CC)c1ccc(Cn2c(CN3CCCC3=O)nnc2N2CCCCCCC2)cc1 1515527375 LCQRHBXUXAADJZ-UHFFFAOYSA-N 438.620 4.066 10 10 IICE C[C@H](NC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1)c1ccc(N(C)C)cc1 1523638142 AFDPHMUCDZUEIZ-AQNXPRMDSA-N 437.584 4.412 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc(OC(F)F)cc(OC(F)F)c3)C2)cc1 1529403524 AKEKVNSGBRABSL-ZDUSSCGKSA-N 442.409 4.154 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CC[C@@H](C)C2 1529700773 HNFRANQGGQSXCD-KGLIPLIRSA-N 444.528 4.180 10 10 IICE CCN(CC(=O)Nc1cccc(OC)c1)C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1533261759 GGMKCEPWYHLVEF-UHFFFAOYSA-N 449.551 4.025 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C1CCC(F)CC1 1533764860 VKHILAYGQFFYIZ-PAWGLSAJSA-N 438.565 4.450 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1Br 1534308303 BEMAVFNRBWDDQB-GJZGRUSLSA-N 435.337 4.440 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1-c1cnn(C)c1 1539583105 YFGJBIDEULBTEA-LJQANCHMSA-N 440.494 4.396 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCC(=O)N2)nnc1N(CC(C)C)C1CCCC1 1542227177 VIOHQOFUUXQZTR-JOCHJYFZSA-N 438.620 4.057 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc4ccc(C)nc34)CC2)c(OC)c1 1543631546 DQZMWCGROUPPNN-UHFFFAOYSA-N 425.916 4.176 10 10 IICE CCOC(=O)[C@@]1(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CCc2ccccc21 1543916968 JBRPFUIAOGFUOV-AREMUKBSSA-N 430.504 4.041 10 10 IICE C[C@@H](c1cccc(O)c1)N(C)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1545505026 QUWZBKXAJLRWRO-YQNUULROSA-N 444.553 4.342 10 10 IICE O=C(c1nc(Br)sc1Cl)N(Cc1ccccc1O)C[C@@H]1CCCO1 1546034240 RIXNTWIBGXWEOA-NSHDSACASA-N 431.739 4.086 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1546838539 GCRHKAFZBHCXPY-RUZDIDTESA-N 434.588 4.128 10 10 IICE COc1ccc2c(CC(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)coc2c1C 1566356912 RKCHCFIQVNOAPE-IBGZPJMESA-N 442.943 4.432 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)Cc1nc(C2CCCCC2)cs1 1566849036 HGHFQCWTKXQMFK-UHFFFAOYSA-N 436.961 4.294 10 10 IICE Cc1cc(CC(=O)NC[C@H](O)c2cccc(Br)c2)c(C)n1-c1ccccc1 1568062836 XFXMCTAUWHQPDV-NRFANRHFSA-N 427.342 4.249 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCO[C@@H](c3cnn(C)c3)C2)c(C)n1-c1ccc(Cl)cc1 1569688110 HCUQDGFARROOET-IFMALSPDSA-N 426.948 4.060 10 10 IICE COc1ccc([C@@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(OC)c1 1623506872 LHDUHCAWOFDFSZ-GOSISDBHSA-N 435.568 4.302 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn(CCN(C)C)c2-c2ccccc2)cc1F 1627604853 UDWWIBHGFNKIKG-UHFFFAOYSA-N 437.563 4.027 10 10 IICE CCc1nc2ccccc2n1CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1627615701 JRJYFDCHVUXSPE-UHFFFAOYSA-N 442.510 4.375 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2c(C)n(C)n(C3CCCCC3)c2=O)c1 1631855393 FIDDGVMODTZRKY-UHFFFAOYSA-N 434.540 4.473 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@]3(C)c3cccc(Br)c3)CC2)cc1 1632158203 VFYRSUYJTDIXFU-JTHBVZDNSA-N 443.385 4.474 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1(Cc2ccc(Cl)cc2)CCC1 1635996765 LYVFKTBLJWKJPD-UHFFFAOYSA-N 449.929 4.419 10 10 IICE Cc1cc(C(=O)Nc2cccc3c2CCNC3=O)c(C)n1-c1ccc(Br)cc1 1639114742 BQVOBXWTTYSILV-UHFFFAOYSA-N 438.325 4.395 10 10 IICE C[C@@H]1Cc2cnccc2N1C(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1643138318 KGZVITROXRMBPB-VVBXCHJUSA-N 429.592 4.102 10 10 IICE COc1ccc(N(CC(=O)Nc2ccccc2I)CC2CC2)cc1 1654494841 DOQUOLAXWUSSSD-UHFFFAOYSA-N 436.293 4.155 10 10 IICE COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1F 1657960820 HVQCMJQZQRCUHU-GJZGRUSLSA-N 446.478 4.288 10 10 IICE Cc1ccc(-n2cnc3c2CCN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C3)cc1 1682100885 GWJBUNZBCITVQQ-FQEVSTJZSA-N 431.584 4.254 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NCc1c(Cl)oc2ccccc12 1683195773 NWOGZCQQPQHVAP-UHFFFAOYSA-N 435.858 4.200 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@H]2[C@@H](CCN2C(=O)OC(C)(C)C)C1 1683424810 JATPSODJXDOUTC-VCOUNFBDSA-N 444.620 4.033 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3C[C@H]3c3cccc(C(F)(F)F)c3)CC2)cc1F 1687464272 AOYPFQSYQVIKRK-PKOBYXMFSA-N 437.437 4.241 10 10 IICE CCc1nnc(N(Cc2cccs2)C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1694657136 VBVQNHDFOYQZBQ-UHFFFAOYSA-N 443.592 4.341 10 10 IICE C[C@H]1C[C@H](C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1707964510 DGASJKBBOSTHCK-PMACEKPBSA-N 425.621 4.234 10 10 IICE CCOCCCCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1729134011 QLJYIGHRQVNCHS-UHFFFAOYSA-N 429.609 4.118 10 10 IICE CC1=CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCNC(=O)C(C)C)C1 1751710350 GVDDRMOXDXWDJL-UHFFFAOYSA-N 446.599 4.281 10 10 IICE C[C@H]1C[C@H]1n1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1752054206 XPNIQPYALJPLMY-RYQLBKOJSA-N 427.549 4.273 10 10 IICE CC1CCC(N2CCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)c(F)c3)CC2)CC1 1752078762 NPXKKLKUZOCIDJ-UHFFFAOYSA-N 442.627 4.356 10 10 IICE CC[C@H](C)c1nnc(N(C)[C@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)cc1C 1752611801 IKCXEEQTJKINCC-JTSKRJEESA-N 435.620 4.462 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccoc3)n2CC(=O)NC(C)C)c(C)n1-c1ccccc1 1761675821 XIJGOMJAPANGFS-UHFFFAOYSA-N 446.555 4.107 10 10 IICE CCC[C@@H](C)N(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1765531958 RLLXPIOHFKLBIN-LJQANCHMSA-N 439.629 4.440 10 10 IICE CCOC[C@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1768007069 LZRCHKNEPJCDSM-NRFANRHFSA-N 425.621 4.160 10 10 IICE O=C(N[C@H](CCc1ccc(O)c(O)c1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1951401638 HULJLWREOFVPTF-OAQYLSRUSA-N 433.460 4.022 10 10 IICE CN(CCN=[N+]=[N-])C(=O)c1cc(I)cc(NC(=O)OC(C)(C)C)c1 2010391831 VPPZFMPVYMAJRO-UHFFFAOYSA-N 445.261 4.021 10 10 IICE Oc1ccc(C(F)(F)F)cc1Cn1ncc(I)c1C(F)(F)F 2079124625 KQZNMTUYLAAWTR-UHFFFAOYSA-N 436.093 4.279 10 10 IICE Cc1ccc(CN(C)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)c(O)c1Br 2307572713 ZTJJXBLCYXURBI-GOSISDBHSA-N 433.346 4.306 10 10 IICE CC1=NN(c2ccc(C)cc2)C(=O)C1=CNc1c(C)nn(-c2ccc([N+](=O)[O-])cc2)c1C 2313547872 FECPUPPQWYPURN-UHFFFAOYSA-N 430.468 4.424 10 10 IICE CCN(CC)c1ccc(C=C2SC(=S)N([C@H](Cc3ccccc3)C(=O)O)C2=O)cc1 2318683849 JMCXFZSDAPCEIW-LJQANCHMSA-N 440.590 4.430 10 10 IICE Cc1ccc(CN[C@H]2CN(Cc3ccccc3)CC(F)(F)C2)c(O)c1Br 2352680657 OSQALAPQKZEPOQ-QGZVFWFLSA-N 425.317 4.463 10 10 IICE CCCCCN1C(=O)/C(=C\c2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 33351481 QJVPNVNJVMYJAU-SFQUDFHCSA-N 444.626 4.462 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3SCc3cscn3)CC2)cc1 248133902 MELZYYXYOLMVII-UHFFFAOYSA-N 425.579 4.406 10 10 IICE COC(=O)c1cccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526469024 LFJJZNJXYZSBAS-OAQYLSRUSA-N 435.407 4.081 10 10 IICE CCN(C)C(=O)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 553817472 WKPOCCRNXRZGTK-UHFFFAOYSA-N 432.568 4.138 10 10 IICE CC[C@@H](C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C)c1c(C)noc1C 726008947 ORMDMHVWHPHJJO-GOSISDBHSA-N 438.480 4.347 10 10 IICE COc1cc(Cl)cc(CN2CCC[C@H](c3n[nH]cc3NC(=O)c3ccccc3)C2)c1O 761215770 USLDFJJRWVAJRW-INIZCTEOSA-N 440.931 4.409 10 10 IICE C[C@@H](NC(=O)N(C)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 776240918 YFJBYUQJCNDLRE-ZEDDUWKQSA-N 430.593 4.386 10 10 IICE Cn1nccc1C1=CCN([C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CC1 794739379 NPWNGDMCOUZARY-HSZRJFAPSA-N 440.507 4.257 10 10 IICE CCN1C(=O)/C(=C\c2cc(Br)ccc2OCc2ccc(F)cc2)NC1=S 1084452273 KGRNRFRAZSQXIF-MHWRWJLKSA-N 435.318 4.245 10 10 IICE COC(=O)c1ccc(CNC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)cc1OC 1127164703 DOOLSNIYTVLOEM-UHFFFAOYSA-N 426.900 4.473 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnn(-c4ccc(F)cc4)c3C(C)C)C2)cc1 1129991768 XMPCCTMWOLSZJB-GOSISDBHSA-N 436.531 4.400 10 10 IICE COc1ccc(N2CCN(CCNC(=O)C3(C4CCCCC4)CCCCC3)CC2)cc1 1142565569 DPVKODMEOPKSNV-UHFFFAOYSA-N 427.633 4.464 10 10 IICE COC(=O)[C@H](Cc1cc2ccccc2o1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1154569889 BQHVUACTSQQXAJ-QHCPKHFHSA-N 446.503 4.363 10 10 IICE Cc1cc(C(=O)[C@H](C)SCCN2CCOCC2)c(C)n1-c1ccc(OC(F)F)cc1 1165462468 AGHULVWQPCFZHS-KRWDZBQOSA-N 438.540 4.332 10 10 IICE Cc1cc(C(=O)N2c3ccccc3C[C@@H]2CO)c(C)n1-c1ccccc1Br 1166037221 YBECVCIPENFBKL-QGZVFWFLSA-N 425.326 4.420 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 1230200885 NLGFZIVUIAJBNE-WOJBJXKFSA-N 446.636 4.328 10 10 IICE CN(CCc1ccccc1C(=O)N1CCc2c1cccc2[N+](=O)[O-])C(=O)OC(C)(C)C 1265387796 KSWZVDGEOVCHPH-UHFFFAOYSA-N 425.485 4.207 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1293571603 OGTQKFVYZJVWQH-XXBNENTESA-N 434.588 4.238 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1299769591 DWQDESBXUGGXKS-PMACEKPBSA-N 447.620 4.215 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCO[C@@H](c2ccco2)C1 1304238516 SSQUSGOPJLOXID-JOCHJYFZSA-N 437.588 4.460 10 10 IICE O=C(CN(Cc1ccccc1O)C[C@H]1CCCO1)NCC1(c2ccccc2)CCCCC1 1307568696 ZYSWVWIFOIYCRN-XMMPIXPASA-N 436.596 4.392 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NCc2cc(Cl)cc(Br)c2O)C2(CC2)C1 1308977910 CUSBCKRNGZAOAR-CQSZACIVSA-N 431.758 4.297 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC1CC(C)(C)C1 1360169448 FXENCTWKOUIURI-UHFFFAOYSA-N 438.620 4.089 10 10 IICE Cc1ccc(C(=O)NCc2cccc(OCCN(C)C)c2)cc1-n1c(C)cc(C=O)c1C 1464919128 BJAKWDJMWWZHJA-UHFFFAOYSA-N 433.552 4.085 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCCC[C@@H]1C(=O)NCc1cccc(Br)c1O 1467765315 WVWHJGNLBUZSCW-GOEBONIOSA-N 441.366 4.245 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C1 1478841266 SDJQHIWXJJLMPD-SIKLNZKXSA-N 446.636 4.279 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1CCOC1CCCCCC1 1503487313 KWABCBHJYANCSS-UHFFFAOYSA-N 435.572 4.345 10 10 IICE C[C@@H]1CCN(c2nnc(-c3cnn(C)c3)n2CCCSc2nccs2)CC1(C)C 1512302969 KUVHWJFXDYNTCI-OAHLLOKOSA-N 431.635 4.190 10 10 IICE C[C@H]1CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C[C@@H](C)S1 1512434242 YDWJPJCGTFFWHN-GASCZTMLSA-N 432.644 4.309 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1)OC 1513441112 LHRXKBPHUCOKRA-OAQYLSRUSA-N 437.588 4.393 10 10 IICE CCN(c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1515393969 MQPHBXHJMMGZQQ-UHFFFAOYSA-N 440.979 4.113 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn(-c3ccccc3)c2Br)cc1 1516599991 QTYPRJKQARMRHF-UHFFFAOYSA-N 427.346 4.411 10 10 IICE CC(C)(C)c1nc(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)co1 1521122518 QRMCVVJKXXQUBL-YBEGLDIGSA-N 448.541 4.446 10 10 IICE COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1535135588 DFZRZBIXVFSUAL-RUZDIDTESA-N 445.563 4.332 10 10 IICE CCCc1c(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1cccc(C)c1 1535558183 KUOYJSOCGONWLE-HXUWFJFHSA-N 432.568 4.461 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1CCN(C(=O)OCc2ccccc2)CC1 1536549450 GQIQSJCDFZSKJX-FQEVSTJZSA-N 437.584 4.157 10 10 IICE Cc1cc(CC(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)c(C)n1-c1ccccc1 1538843207 FTMCVICHHJYYEA-RLWLMLJZSA-N 431.580 4.042 10 10 IICE C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)c2ccc(N=NC(N)=O)cc2)c1 1542090695 LDNHWSSFPZLSAH-AWEZNQCLSA-N 440.479 4.053 10 10 IICE Cc1nnc(N2CCO[C@H](c3ccc(Cl)cc3)C2)n1CCCSc1nccs1 1543344609 ZWELCGPENCFJTB-KRWDZBQOSA-N 436.006 4.457 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1COC(=O)c1cccc(NC(=O)c2cc(O)cs2)c1 1544925885 UQMXDKFLVNMNKS-MRXNPFEDSA-N 446.525 4.262 10 10 IICE CC[C@@H]1CCC[C@H]1Cn1c([C@H]2OCC[C@H]2COC)nnc1N(C)Cc1ccccc1O 1546643691 OPPXERJRZLANTB-RQIDZSJNSA-N 428.577 4.170 10 10 IICE CCOc1ccc(Nc2ncccc2C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cc1 1557133726 VHAPAQYPLOCYBW-LJQANCHMSA-N 446.551 4.489 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3c(F)cc(Br)cc3C2)c([N+](=O)[O-])c1 1559136853 FQSMQTQMWIBSLL-HYXAFXHYSA-N 435.249 4.245 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(O)CCc4ccccc43)cc2Cl)C1 1564650254 UUMRDNMIDZXSGN-BXKMTCNYSA-N 427.976 4.210 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccc(CC(=O)NCc3c(O)ccc4c3CCCC4)cc21 1566360063 XMHSPOMDJYHOJD-UHFFFAOYSA-N 436.552 4.428 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1567467834 SWRCXXUGSOBIHT-RDJZCZTQSA-N 426.513 4.074 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc(Br)cnc1OCC1CC1 1585264563 UFDRTLAKNNXXAC-OAHLLOKOSA-N 446.389 4.368 10 10 IICE Cc1cc(CCNC(=O)[C@H]2C[C@@H](NC(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1595949767 GQAVNWWRPUEHHI-PSWAGMNNSA-N 445.563 4.458 10 10 IICE Cc1cc(CNC(=O)OC(C)(C)C)oc1C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1597088774 AMZHQKXIFMUXNW-SFHVURJKSA-N 444.528 4.140 10 10 IICE CC(=O)c1ccc(OC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1Cl 1617235328 JOQPPUYQOQDYFD-UHFFFAOYSA-N 449.802 4.445 10 10 IICE COc1cc(OC)cc(C2(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)CCCC2)c1 1618642769 IKSXGQKCJVMWCE-XMMPIXPASA-N 439.600 4.001 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 1618643044 JIMLURCBGJAESA-AABGKKOBSA-N 435.490 4.174 10 10 IICE Cc1ccc(-n2nc(C(=O)NCc3cccc(Br)c3O)c3c2CCC3)c(C)c1 1634724739 ICNZQMMKJDGRTK-UHFFFAOYSA-N 440.341 4.376 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](C)[C@@H](C)C(=O)Nc3ncccc3O)c2C)c1 1636133451 ZSZNMGRRWRUQDA-MSOLQXFVSA-N 434.540 4.205 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)Nc2cn[nH]c2)c2ccccc2)c(C)n1-c1ccc(F)cc1 1636602729 LTDQSROLYMECFR-QFIPXVFZSA-N 431.471 4.066 10 10 IICE COc1ccccc1CN1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 1637410746 SGFVDBMWXMJECS-UHFFFAOYSA-N 446.595 4.173 10 10 IICE Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)NCc2cc(Cl)ccc2O)cc1 1639965864 SAMMDTSIGWKKPD-UHFFFAOYSA-N 436.942 4.146 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)[C@@H]1CCCC(=O)N1C 1641202396 FGMJBGHTYXRGQF-QUCCMNQESA-N 433.474 4.309 10 10 IICE COc1ccc([C@H]2COCCN2C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1650824591 UBWDYKZCNJQXAG-RUZDIDTESA-N 432.520 4.437 10 10 IICE CCCn1nccc1NC(=O)CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1 1651739505 KHLBAANTEVSHMF-GOSISDBHSA-N 425.558 4.066 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NCc1csc(NC(=O)OC(C)(C)C)n1 1676631745 CTQFDTYEZLIKIZ-UHFFFAOYSA-N 445.589 4.432 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(C(=O)CC(C)(C)C)CC3)cc2Cl)C1 1680563465 XTBONQSELBLXKC-SFHVURJKSA-N 449.039 4.366 10 10 IICE COC(=O)c1cnc([C@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)s1 1683476098 UPGNISYTSYAAOS-HNNXBMFYSA-N 442.541 4.062 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CCCO[C@H]3c3ccc(Cl)cc3)C2)cc1 1683504110 LABHBTSWHPBDLD-ZQMYSKGWSA-N 443.975 4.394 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCCC[C@@H]3c3ccc(F)cc3F)cc2)CC1 1684874779 VJQXLLRVAXHOFY-HSZRJFAPSA-N 428.527 4.153 10 10 IICE CC[C@H](C)N(C)CCn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C 1694198683 AHMOSMWJCBCVSQ-FQEVSTJZSA-N 442.652 4.031 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)cc1C 1695070435 AWYYEOGDDJXLBD-NBGIEHNGSA-N 443.636 4.366 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N1CCSC(C)(C)C1 1707304764 FFMNLXURFDPEOR-UHFFFAOYSA-N 436.629 4.018 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CC[C@@H](F)C1 1708396090 AYCMAIBEICBLSX-CEWLAPEOSA-N 429.584 4.403 10 10 IICE CCC[C@@H](Cn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1709516079 MARSUMQWAQYXSI-GMAHTHKFSA-N 441.620 4.224 10 10 IICE CCOCc1nnc(N2CCc3c(cccc3OC)C2)n1CCCSc1nccs1 1729035552 XDYMNCDYNJCSBS-UHFFFAOYSA-N 445.614 4.025 10 10 IICE CCCC1(Cn2c([C@H]3OCC[C@H]3COC)nnc2N(C)Cc2ccccc2O)CCC1 1745315820 LRPBKKTYDQRPFX-FPOVZHCZSA-N 428.577 4.315 10 10 IICE COCCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)C1 1771267077 AFBJXHJLZBNHGM-IBGZPJMESA-N 437.588 4.252 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)cc1OC 1858588800 CDUAKOGWCGQYPS-VXLYETTFSA-N 429.519 4.224 10 10 IICE Cc1ccc(-c2ccc(=O)n([C@H](C)C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)n2)cc1 1890691288 QSGCPYORGZBYEU-IZIIKQMZSA-N 442.563 4.085 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C2CC2)c(C(=O)O)c1I 2079986413 OHXPYPGBPCUASY-CYBMUJFWSA-N 440.281 4.385 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3CCOc3cccc(C)c3)C2=O)cc1 2296398152 WUWYGDIQZHKYMH-UHFFFAOYSA-N 443.503 4.104 10 10 IICE CC[C@H](Oc1ccc(C=C2SC(=S)N(c3ccccc3OC)C2=O)cc1)C(=O)O 2314929134 HVDWUPDZFIWKIG-INIZCTEOSA-N 429.519 4.343 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380744195 CHMKBWVVMUAZKS-HNNXBMFYSA-N 441.366 4.259 10 10 IICE CC[C@@H]1SC(=S)N(CCC(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)C1=O 11635816 ZSOSSUATLANPBQ-AWEZNQCLSA-N 440.015 4.355 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1)N2 14549959 ZMAAHQOQRSBLTG-QUZFRVLNSA-N 428.529 4.110 10 10 IICE COc1cc(/C=C2/SC(Nc3ccc(Cl)cc3)=NC2=O)ccc1OCCC(=O)O 16912301 JJTSKPCBLANGML-GZTJUZNOSA-N 432.885 4.285 10 10 IICE CCN(CC)c1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1 27475085 OHYBOMZCZSGJCB-RGEXLXHISA-N 425.579 4.387 10 10 IICE COc1cccc2c1OCC(/C=C1/SC(=S)N(Cc3ccc4c(c3)OCO4)C1=O)=C2 33514401 GSCGWWNOVUPFTR-DJKKODMXSA-N 439.514 4.144 10 10 IICE CCOC(=O)CCCN1C(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 40374686 KANRGDUJTWFWSH-SFQUDFHCSA-N 446.506 4.399 10 10 IICE COc1ccc(O)c([C@@H](C)Nc2nc(CN3CCOCC3)nc3sc(C)c(C)c23)c1 301201282 PMVMLHAWZBBROZ-CQSZACIVSA-N 428.558 4.028 10 10 IICE CO[C@@H](C)CN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(C)C 740804261 WUXGZOZKADPANK-HNDQUVLASA-N 426.629 4.001 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(-c4cscn4)c3)cc2F)C[C@@H](C)O1 742557371 UXHPLPRANOGLOQ-IYBDPMFKSA-N 425.529 4.493 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2 743808123 LXLSBHQUKYWGML-IRXDYDNUSA-N 432.314 4.078 10 10 IICE O=C(Nc1ccc(N=Nc2ccccc2)cc1)C(=O)N1CCC(C(=O)N2CCCCC2)CC1 749681278 YYRJLWPBMBUKMI-UHFFFAOYSA-N 447.539 4.292 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(CC(=O)c3cc(C)n(-c4cccc(SC)c4)c3C)[C@@H]2C1 755053495 KNCVVRKXWGDWFE-CKUXNOBLSA-N 428.598 4.267 10 10 IICE C[C@H](N[C@H](C)c1cc(Br)c(F)cc1O)c1cccc(NS(C)(=O)=O)c1 756494464 MCTJVXPEBGEFJP-WDEREUQCSA-N 431.327 4.077 10 10 IICE COc1cc(C)cc(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c1C 786132682 WRONXUXJJSRKOI-UHFFFAOYSA-N 437.462 4.489 10 10 IICE CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(Oc2cnccn2)CC1 802021395 SOMLYHHIHDPSLS-UHFFFAOYSA-N 443.555 4.210 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3csc(Cc4ccc(Cl)cc4)n3)C2)cc1 1130826645 GALZCSPLRMMBMZ-KRWDZBQOSA-N 427.957 4.405 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N(CC(F)F)C1CCC1 1133832627 PNAMGCYFNLCHTI-XNTDXEJSSA-N 428.501 4.063 10 10 IICE C[C@@H](NC(=O)c1cc(Cl)cc(Br)c1N)c1ccc(N2CCOCC2)cc1 1136443019 MZGMOODKPWLSGN-GFCCVEGCSA-N 438.753 4.012 10 10 IICE C[C@@H]1CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)[C@@H]2CCCC[C@H]12 1137788980 WVFVVGZFZYEHRD-NWNHOZFLSA-N 432.586 4.454 10 10 IICE C[C@H](NC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 1142503844 GMRQHIXSNOPYSL-FXAWDEMLSA-N 433.593 4.030 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](O)COc1cccc(C(F)(F)F)c1 1150135900 INYONBQDNMGTBE-MRXNPFEDSA-N 438.471 4.344 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCO[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 1155165478 MSKSPFRMPFFSMB-KRWDZBQOSA-N 449.347 4.278 10 10 IICE CC(C)(C)OC(=O)N1CCC(C2(NC(=O)c3cc4cc(O)c(O)cc4s3)CC2)CC1 1159011376 DZTFFBWDEKWTRN-UHFFFAOYSA-N 432.542 4.222 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)c2ccc(F)cc2O1 1164340075 ZELOVTODZVSHQG-QHCPKHFHSA-N 436.483 4.431 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2C(=O)NC(C)(C)C)c(C)n1-c1ccc(Br)cc1 1178489905 IQFKHQOQQADXAC-IBGZPJMESA-N 446.389 4.376 10 10 IICE CC(=O)c1ccc2c(c1)CN(C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 1222589682 FVVUIJOSIZNKOE-LJQANCHMSA-N 429.467 4.185 10 10 IICE CC[C@@H](CNC(=O)N(CC)Cc1cc(Br)ccc1O)C(=O)OC(C)(C)C 1251167329 YBSYIWCSANNGSH-ZDUSSCGKSA-N 429.355 4.054 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 1251189819 HKEIGBARQWYSNU-JOCHJYFZSA-N 431.939 4.391 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCOC(C)(C)[C@H]1C 1289422701 CIEHNTKHTGULHX-GOSISDBHSA-N 439.629 4.357 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN(C(=O)CCC2CCCCC2)CC1 1312883415 CTQPEELZZARAPJ-NRFANRHFSA-N 442.648 4.206 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1C[C@H](C1CC1)N(C)C 1314737204 PAYIOWXBFMMORO-HSZRJFAPSA-N 438.664 4.444 10 10 IICE CCCn1c(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)cc2ccccc21 1350976356 MMYZETFNDZMPNC-UHFFFAOYSA-N 434.584 4.002 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCCOc3ccc(Cl)c(C)c3)cc2F)CC1 1359920383 SMCFHFYNTBPYEO-UHFFFAOYSA-N 447.982 4.405 10 10 IICE COc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1Cl 1439153167 KSZJUCXLTHMJBU-UHFFFAOYSA-N 425.960 4.386 10 10 IICE CCOc1ccc(N2CCN(C(=O)COc3ccccc3Cc3ccccc3)CC2)cc1 1446418312 WFYZDRUVBLZRMG-UHFFFAOYSA-N 430.548 4.404 10 10 IICE CC[C@@H](Cc1ccccc1)N(C)CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1459638660 FLNORJBOCHKHAO-IBGZPJMESA-N 426.516 4.354 10 10 IICE COC(=O)[C@@]1(NCc2ccc(N(C)C)c(C)c2)CCc2cc(Br)ccc2C1 1460452774 VFMRKPMAVUGVDG-JOCHJYFZSA-N 431.374 4.014 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1470556537 XEOJDQNUNXYUOK-MXKPZRPRSA-N 444.620 4.079 10 10 IICE COC[C@@]1(C(=O)OC(C)(C)C)CCN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)C1 1471024668 WZOPJMVVUQYBSY-RUZDIDTESA-N 426.557 4.223 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H](C)OC)CC1(C)C 1517763666 KTFRXUQRHVGQSO-XMSQKQJNSA-N 437.588 4.249 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Cl)ccc3OC(C)C)cc2F)CC1 1521011157 WYWXOCREALBDRJ-UHFFFAOYSA-N 433.955 4.338 10 10 IICE COc1cccc(C(F)F)c1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1527245934 OOZMJNMHRPNVNZ-UHFFFAOYSA-N 444.400 4.418 10 10 IICE CCc1ccc(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1530186781 KODIQQGASWTRIS-HMMYKYKNSA-N 442.581 4.338 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CCc2ncc(-c3ccc(F)cc3F)o2)cc1 1531375448 YSIMMNVWQBNVNY-UHFFFAOYSA-N 429.467 4.156 10 10 IICE Cc1cc(I)cc(C(=O)NCc2ccc(N(C)C)c(F)c2)c1C 1535618732 HZNFEBVRMPRRAP-UHFFFAOYSA-N 426.273 4.043 10 10 IICE Cc1cc(CSc2ccccc2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)on1 1537484546 XOAJPFFSOWQGSE-JOCHJYFZSA-N 438.597 4.374 10 10 IICE CC[C@H]1C(=O)NCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC=C(C)C 1546576040 UPDZIZPZYYVNDQ-QHCPKHFHSA-N 446.599 4.424 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC[C@H](Cc3ccccc3)c3ccccn3)C2)cc1 1564962601 MQLXFARWWGEMCZ-GOTSBHOMSA-N 444.579 4.242 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](NC(=O)c1cccc(O)c1O)CC(C)(C)O2 1569885366 QIYOSAGJWDOAEL-MRXNPFEDSA-N 428.485 4.477 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)c3ccccc3)CC2)c(C)n1-c1ccc(Cl)cc1 1587088018 KYMBLVXWNAMTSS-UHFFFAOYSA-N 435.955 4.275 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2[C@@H]3CCCC[C@H]3CCN2C(=O)OC(C)(C)C)c1 1595806529 NUSRYVNNJOUKOL-OAZVVGOESA-N 432.561 4.394 10 10 IICE CC1(C)CCC[C@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)O1 1618441747 JNHAGZLVLTWESE-IZCBMXNHSA-N 438.640 4.193 10 10 IICE O=C(Cc1nc(-c2ccccc2)cs1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634805 JDNISQPLNNIEDS-IBGZPJMESA-N 441.984 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)cc1 1624269713 CRLZIHUAZNAUNE-NRFANRHFSA-N 443.591 4.430 10 10 IICE Cc1ccc(C(=O)NCc2cccc(NC(=O)N(C)C)c2)cc1-n1c(C)cc(C=O)c1C 1627938233 USGNTDYKGKNFTC-UHFFFAOYSA-N 432.524 4.239 10 10 IICE COc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OCC(C)C 1630257071 MPWRZWXVELNNKS-FQEVSTJZSA-N 446.975 4.483 10 10 IICE Cc1cc(N2CCC[C@H](NC(=O)N[C@H](C)c3ccccc3O)C2=O)ccc1Br 1634029521 FEXYMAFLOXVWTA-KDOFPFPSSA-N 446.345 4.019 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CCc2nc(-c3ccccc3)ncc2C1 1636267045 LSFNJKJWGONTOO-XXBNENTESA-N 443.595 4.306 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(N(C)C(=O)OC(C)(C)C)s2)N(C)C)cc1 1637004957 XBYAKRXROHHOAV-SFHVURJKSA-N 446.617 4.218 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)CCNC3=O)c(C)n1-c1ccccc1Br 1641279610 JBARDYBPZQSQHR-UHFFFAOYSA-N 438.325 4.395 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 1642997904 QZPOTHSWDZLBPG-XOBRGWDASA-N 431.989 4.265 10 10 IICE CC(=O)c1cc(F)cc(CN2CCc3nc[nH]c3[C@@H]2c2ccc(Br)cc2)c1O 1644596702 NWCYEEYCFBSVMA-FQEVSTJZSA-N 444.304 4.367 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccccn2)c1C)c1ccccc1OC(F)(F)F 1645512071 AGKZPJDJVVKXSR-LJQANCHMSA-N 447.413 4.032 10 10 IICE COc1cc(N2CCC[C@@H]([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c([N+](=O)[O-])cc1OC 1655512816 YVEGKZPWBBOWOQ-IAGOWNOFSA-N 449.548 4.476 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCCn3ccc4cc(Cl)ccc43)C2)cc1 1682166600 VQQOMTASWZKHLQ-KRWDZBQOSA-N 426.948 4.129 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](c3ccccc3)[C@H](O)c3ccccc3)C2)cc1 1682188250 KYSGJFSUJHQGMW-RFLWCCGPSA-N 445.563 4.296 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@@H]3C[C@H](O)c3ccco3)c2C)c1 1683302824 BXOKALVVUDPAFK-GOTSBHOMSA-N 437.540 4.030 10 10 IICE CC(C)CN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1692403635 ULRHEVWXPFEDOV-UHFFFAOYSA-N 425.621 4.285 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)(C)C)n2C[C@@H]2C[C@H]2C)c(C)n1-c1ccccc1 1692987737 LOVZHOSTJXWENJ-XLIONFOSSA-N 448.615 4.360 10 10 IICE CCC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C)OC 1695112816 MBIMWRBKWWZBHV-SIKLNZKXSA-N 437.588 4.393 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@@H]1C 1695437114 ULMQWUCTKAVWKX-MJGOQNOKSA-N 434.588 4.114 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCCN3CCCCC3)CC2)cc1 1697470114 BURNAAQUFIWGIP-UHFFFAOYSA-N 440.636 4.003 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@H]2[C@H]2CCCO2)cc1F 1711006457 JMFZUDNMKRKCJD-LEWJYISDSA-N 429.584 4.268 10 10 IICE CN(c1nnc(C(C)(C)C)n1CCCSc1nccs1)[C@H]1CCCc2c1cnn2C 1711023472 CPWCMWKVMQPJGM-INIZCTEOSA-N 445.662 4.462 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@@H]1CCCO[C@@H]1C(C)(C)C 1711095222 FKGNUNGEHHRSNL-RDPSFJRHSA-N 449.599 4.447 10 10 IICE CC[C@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1727662488 KODVZNQCVFBDQO-JTSKRJEESA-N 434.588 4.066 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1CCCOC1CCCCC1 1729420110 HHRZRVZPACONJA-UHFFFAOYSA-N 435.572 4.345 10 10 IICE CN(Cc1ccco1)c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1729425837 NNSQVGIMOKWLGT-UHFFFAOYSA-N 426.571 4.132 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)CC(F)(F)F 1751431824 NHZWYTUEBATDOZ-UHFFFAOYSA-N 438.885 4.415 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N1CCO[C@H](C(C)C)C1 1751432823 NLMVVSJKDPIVMT-QHCPKHFHSA-N 425.621 4.295 10 10 IICE COc1ccc(N2CCN(C(=O)c3nc(Cc4cccc(C)c4)n4ccccc34)CC2)cc1 1858349717 NXGAGVZPRRXVKZ-UHFFFAOYSA-N 440.547 4.205 10 10 IICE CCCCn1cc(OCC=C(C)C)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870610516 JVTXCCSADKPKDB-UHFFFAOYSA-N 439.600 4.324 10 10 IICE Cc1ccc([C@@H](C)NC[C@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c(O)c1 2084722862 TVSUZTCQYAVNNU-IRLDBZIGSA-N 439.600 4.473 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNCc1ccc(Br)cc1O)C2 2126081555 GEXNCRFTBSLZLQ-LXZKKBNFSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@H](NCc1ccc(Br)cc1O)C2 2232283477 VYKHRTFLUYPQQU-KKBVYLPWSA-N 425.367 4.326 10 10 IICE Cc1cccn2c(=O)c(C=C3SC(=S)N(C)C3=O)c(N[C@@H](C)c3ccccc3)nc12 2296715406 ZMLFJDIBEMEMGQ-AWEZNQCLSA-N 436.562 4.007 10 10 IICE CCCOc1c(Br)cc(Br)cc1C=C1SC(=S)NC1=O 2297306791 QWNLQEMXPNYNLI-UHFFFAOYSA-N 437.178 4.489 10 10 IICE N=C1C(=Cc2ccc(Sc3ccccc3)o2)C(=O)N=C2SC(c3cccnc3)=NN12 2297467639 LLFOPMOZVLBQPE-UHFFFAOYSA-N 431.502 4.493 10 10 IICE Cc1ccccc1C1=NN2C(=N)C(=Cc3cccc(Br)c3)C(=O)N=C2S1 2297499916 QEJUIGCTPYMWER-UHFFFAOYSA-N 425.311 4.425 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccccc3O)SC2=S)cc1 15047429 UQCZMVXREWAXJQ-CYUIRQCWSA-N 428.535 4.019 10 10 IICE COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)/C1=C/c1ccccc1OCc1ccccc1 33923068 GHEWFEXLRFYMMF-FNNTWHHHSA-N 433.504 4.117 10 10 IICE CCOc1cc(/C=C2\SC(Nc3ccccc3OC)=NC2=O)ccc1OCCC(=O)O 210469171 UVIGUUVEIITYMD-UYRXBGFRSA-N 442.493 4.030 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3cc(OC)ccc3OC)[C@H]2c2ccc(O)c(O)c2)cc1 526218042 HAECRRYHZJSJCZ-HSZRJFAPSA-N 449.459 4.181 10 10 IICE COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(-c2cc(C)c(F)cc2F)cs1 749009755 IJIHZNVMORILTN-UHFFFAOYSA-N 442.465 4.194 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCC(c3ccccn3)CC2)c([N+](=O)[O-])c1Br 754070755 RFXWZECQNQSIIJ-UHFFFAOYSA-N 437.250 4.053 10 10 IICE CN1[C@H]2CC[C@H]1CC(N1CCN(Cc3c(O)ccc4cc(Br)ccc34)CC1)C2 755782256 IHIXXEKWCBXJQG-OALUTQOASA-N 444.417 4.051 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2ccc(C)s2)cs1 761341566 GCAWCZLWCXDDLT-UHFFFAOYSA-N 449.579 4.338 10 10 IICE Cc1cccnc1-c1noc(CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 761574145 FVIWQIYMJAVPMH-KAMYIIQDSA-N 428.564 4.336 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CN[C@H]3CCCOc4cc5c(cc43)CCCC5)cc2)C1 768508477 NULXNXYZXFPHRP-DHLKQENFSA-N 433.596 4.271 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 772558068 NFHHLOJBPZCMFS-OXQOHEQNSA-N 433.346 4.464 10 10 IICE O=C1CCc2cc(NCc3ccc(N4CCOCC4)c(F)c3)ccc2N1CC(F)(F)F 780565528 NBIYOLSTXVGVSM-UHFFFAOYSA-N 437.437 4.116 10 10 IICE C[C@@H]1C[C@@]2(CCO1)CN(C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)C[C@@H](C)O2 797440060 LVEQXRLWKVDEBX-FHAGJXEFSA-N 429.605 4.324 10 10 IICE COC[C@@]1(C(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCCCN1C(=O)OC(C)(C)C 1136025789 ZPRNGMZNAHCAFG-RUZDIDTESA-N 445.604 4.051 10 10 IICE Cc1cc(C(=O)NCCN2C(=O)COc3ccccc32)c(C)n1-c1cccc(C(C)C)c1 1136493790 NERZTDSYTOKUQN-UHFFFAOYSA-N 431.536 4.373 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cc(N(C)C)nc3ccccc23)cc1 1142712762 GSLLWYNDPRUDQK-OAQYLSRUSA-N 432.568 4.188 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1cn(C)c2ccccc12 1231150118 VWNRLVKVECNCSG-UHFFFAOYSA-N 430.346 4.421 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N1C2CCC1(CNC(=O)OC(C)(C)C)CC2 1254030395 QCWQPEYDXGQGKY-UHFFFAOYSA-N 442.604 4.360 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(C(=O)N[C@H](C)C(C)C)CC3)c2C)c1 1254073539 IZSOXIZWNMSYSW-HXUWFJFHSA-N 438.616 4.485 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1c2ccc(Br)cc2nn1C 1264443068 VWUOFOKFWUQBCX-UHFFFAOYSA-N 429.362 4.453 10 10 IICE COc1cccc(CN(CCN(C)C)C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1 1269137223 NMOQOBSNYZRLKV-UHFFFAOYSA-N 449.595 4.128 10 10 IICE C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1274765375 MQMPXBDBOFXMGM-XKVRUSJASA-N 442.537 4.055 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cn(-c3ccc(Cl)c(Cl)c3)cn2)cc1 1278288170 GOUXOAXVBVAOPA-UHFFFAOYSA-N 433.339 4.396 10 10 IICE CC[C@H](C)NC(=O)c1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1290971844 RKEPQRWUMAANRR-SFHVURJKSA-N 445.563 4.294 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@H](CCNC(=O)OC(C)(C)C)C1 1304264660 SMDQJTRMCWQPSC-IBGZPJMESA-N 439.556 4.284 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](c1ccc(F)cc1F)c1nccn1C 1313392078 HAFYFCXMWDNAAG-OAQYLSRUSA-N 427.499 4.085 10 10 IICE CN(Cc1ccccc1F)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1355299489 MIBCUMFMGFCYEL-PDGQHHTCSA-N 432.517 4.215 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(-c3cn[nH]c3)cc2)NC(=O)OC(C)(C)C)cc1 1444503216 JRTCMVGDDXAYHY-QFIPXVFZSA-N 449.555 4.139 10 10 IICE Cc1cc(C(=O)NCc2nc3c(s2)COCC3)c(C)n1-c1ccccc1Br 1456082592 IJBDCAHWAVCKFK-UHFFFAOYSA-N 446.370 4.316 10 10 IICE CC1CCN(c2ccc(CNC(=O)CCCC(=O)c3ccc4c(c3)OCCO4)cc2)CC1 1464962326 OICIQSSFOGEVEB-UHFFFAOYSA-N 436.552 4.364 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1CCCN1C1CCCCC1 1469979749 VTGPDZRFQOUWEZ-IBGZPJMESA-N 438.410 4.483 10 10 IICE COC(=O)c1c(C)[nH]c(C(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)c1C 1473901993 GXMPKSUBDXVWOF-UHFFFAOYSA-N 436.508 4.325 10 10 IICE CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1478471041 MRQSYWQFTLIMOB-AEFFLSMTSA-N 442.526 4.036 10 10 IICE Cc1csc([C@@H](C)Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1492638986 KXFSWCZFMOKGDA-YJBOKZPZSA-N 427.574 4.083 10 10 IICE Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1520854175 BVKCCLRSPXJIRL-HSZRJFAPSA-N 433.577 4.485 10 10 IICE Cc1ccccc1-c1nc(C)c(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)s1 1524851226 IIIRNHHMBHYTIQ-UHFFFAOYSA-N 443.519 4.472 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(OCCC(C)C)c1 1526003593 QUUIRYXWFBGEMG-UHFFFAOYSA-N 430.520 4.026 10 10 IICE CC(C)=CCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1541254469 AQTOWEYFTPEQRL-HSZRJFAPSA-N 439.604 4.349 10 10 IICE Cc1cc(C(=O)N(Cc2ccncc2)C2CC2)c(C)n1-c1ccc(Br)cn1 1543439011 RJELEPSIVSZBPZ-UHFFFAOYSA-N 425.330 4.451 10 10 IICE CNC(=O)C[C@@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 1543571765 KHHSTICTDFNHOS-FDCFBWIESA-N 442.563 4.042 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC[C@H]1C 1544303444 XRLMFNMYHDXRLQ-WOJBJXKFSA-N 439.648 4.315 10 10 IICE COc1cc(N2CCN(Cc3ccc(N4CCCCC4)c(C)c3)CC2)cc(OC)c1OC 1559732294 BXONAOZJSCUTPO-UHFFFAOYSA-N 439.600 4.333 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@H](C)c3cccc(C(=O)c4ccccc4)c3)C2)cc1 1585988130 KAONAAVOYQSLAT-AUSIDOKSSA-N 428.532 4.425 10 10 IICE Cc1ccc(CN2C[C@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1 1587461049 JBVQCKINWOSFMD-XMMPIXPASA-N 429.564 4.110 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1csc(Cc2cccc(F)c2)n1 1596359197 QWBIJORSARUEJT-UHFFFAOYSA-N 427.570 4.356 10 10 IICE COc1cc(OCC(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)ccc1[N+](=O)[O-] 1597567817 YCIGLKIVERKXRE-QGZVFWFLSA-N 436.464 4.478 10 10 IICE CC[C@@H](C)c1nnc(N2CCSC3(CCOCC3)C2)n1Cc1ccc(N(C)C)cc1C 1613361582 PVEVCHYYXVOPRL-GOSISDBHSA-N 443.661 4.317 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1613387157 TXBSASNKOQIXHF-GHTZIAJQSA-N 429.634 4.213 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCN(C(=O)OC(C)(C)C)C2)n1CC1CC1 1617941424 XXFHHWGSRTZQHI-IBGZPJMESA-N 441.576 4.145 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(Cc3ccccc3)[C@H](C)c3ccccc3)nc12 1618159061 ARPPMNRDODJVEL-GOSISDBHSA-N 430.508 4.375 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1 1628857860 PDVLNONUDPKHID-FQEVSTJZSA-N 427.976 4.193 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)/C(F)=C/c1ccc(F)c(C(F)(F)F)c1 1630486418 LSNWZKILDOHBGD-YVLHZVERSA-N 443.368 4.452 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1nnn(-c2ccccc2Br)c1C 1631158851 CAZNZIZKFBYIFD-UHFFFAOYSA-N 429.318 4.096 10 10 IICE COc1ccc(F)cc1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1634691630 OCARERYMWHYJFM-UHFFFAOYSA-N 432.293 4.329 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CC(c2cc(C)ccc2C)=NO1 1635676538 FTZLVXMLZSIPPE-HXUWFJFHSA-N 431.330 4.313 10 10 IICE CC1(C)[C@H](c2cccc(F)c2)CCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635997160 ZUOFRJQQEKVMQW-IBGZPJMESA-N 447.501 4.418 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)c2ccccc2)c(C)n1-c1cccc(Br)c1 1636138094 KSQAJMIAJGNDCV-GOSISDBHSA-N 427.342 4.363 10 10 IICE O=C(CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)NC(=O)NC1CCCCC1 1642024915 ICNCXUFOHOXFQB-YFHOEESVSA-N 449.551 4.136 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCC(C)(C)C(=O)OC(C)(C)C 1683332778 PDPNXCONVUEEGA-UHFFFAOYSA-N 443.382 4.444 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CC[C@@H]2CCO[C@@H](C)C2)cs1 1693373654 BGXBOMPHIXZDBN-FUHWJXTLSA-N 441.601 4.181 10 10 IICE C[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1693670931 FCNQKMMDACZBHK-GOSISDBHSA-N 429.584 4.226 10 10 IICE CCC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1695156002 POFPMTVVCQDSQA-IAGOWNOFSA-N 437.635 4.164 10 10 IICE CCOCc1nnc(N2CCC(OC(C)(C)C)CC2)n1Cc1ccc(N(C)C)cc1C 1696295395 PHGJHAIODUCAQK-UHFFFAOYSA-N 429.609 4.021 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C1CCC1 1696508521 GWFJQWCVZBPVAQ-PMERELPUSA-N 425.602 4.110 10 10 IICE CCC(CC)[C@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)N1CCOCC1 1708692304 AHJOJAIWLSAVNN-QFIPXVFZSA-N 441.620 4.025 10 10 IICE CC[C@@H](C)[C@@H](Cn1c(CC2CC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1726860228 OZPZAMIVQLPHDI-AUSIDOKSSA-N 441.620 4.017 10 10 IICE COCC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC1 1730566693 LZPHSNHCHRGJRL-UHFFFAOYSA-N 443.661 4.040 10 10 IICE CC(C)N(Cc1ccco1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1741613469 NASZWKSHFFLPMW-UHFFFAOYSA-N 437.588 4.469 10 10 IICE CCS[C@H]1CC[C@@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768371526 GGBKULSAFHRICP-LVCYWYKZSA-N 447.624 4.493 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1CCCCNC(=O)OC(C)(C)C 1768681400 IQLIMKGWVRXJLJ-UHFFFAOYSA-N 429.565 4.193 10 10 IICE O=C(COc1ccc(Br)cc1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866134888 OGYBBHLYUCJPCE-UHFFFAOYSA-N 436.261 4.242 10 10 IICE Cc1cccc2c(C(=O)N[C@@H](c3ccc(N(C)C)cc3)c3nccn3C)c3c(nc12)CCC3 1866269574 RNCUGGKBGFENLD-VWLOTQADSA-N 439.563 4.351 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cc(Br)ccc3O)C[C@]2(C)C1 2116288601 RZYDYKIOKRTMIS-DKICVRJWSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1CCC([C@H](F)CNCc2cc(Br)cc(F)c2O)CC1 2163265487 VZFPMGZYOBAHGC-MRXNPFEDSA-N 449.336 4.369 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3CCOc3ccccc3)C2=O)cc1Cl 2296398150 WSTKILZJXWILGY-UHFFFAOYSA-N 449.894 4.195 10 10 IICE COc1cc(C=C2SC(=S)N(Cc3ccccc3)C2=O)cc(OC)c1OC(C)=O 2313507420 LLMSYQWWSQYPQM-UHFFFAOYSA-N 429.519 4.031 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)C2=Cc2cccc(OC)c2O)cc1 2332099683 UKTZLBRFFDQDJR-UHFFFAOYSA-N 432.451 4.379 10 10 IICE O=C(O)/C=C/c1ccc(N2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)c([N+](=O)[O-])c1 13037222 AOYZUEDNKNVGCK-XBXARRHUSA-N 435.402 4.034 10 10 IICE O=C(O)C[C@H](C(=O)O)N1C(=O)/C(=C/c2c3ccccc3cc3ccccc23)SC1=S 15034707 NRVRHHJXLDQJFI-RMFUMNGISA-N 437.498 4.122 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)ccc1OCCCC(=O)O 206230824 JFPAUCZVNCQLCF-AQTBWJFISA-N 429.519 4.345 10 10 IICE COC(=O)Cc1ccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@H]2c2ccc(O)c(O)c2)cc1 526625459 MQIZCNHVSOLJMO-XMMPIXPASA-N 445.471 4.179 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(I)c(Br)c2)c1 721351994 TXNPMJCWDPCSLW-UHFFFAOYSA-N 445.098 4.372 10 10 IICE CSc1ccc(N2C[C@H](C(=O)Nc3c(-c4ccccn4)nc4ccccn34)CC2=O)cc1 751302677 OVVHKSRTOHHQNS-MRXNPFEDSA-N 443.532 4.110 10 10 IICE COc1ccc([C@H](C)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1NC(C)=O 765128643 WXTWTIZXSBCMOE-ULQDDVLXSA-N 429.536 4.257 10 10 IICE C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 776417910 QTYJZDJNQSLRQT-ZBEGNZNMSA-N 446.381 4.173 10 10 IICE COc1ccc(N2CCC(NC(=O)Cc3c(F)ccc(Br)c3F)CC2)cc1 799929335 UBLXMEUXUKXSQJ-UHFFFAOYSA-N 439.300 4.064 10 10 IICE Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)NCc2cc(Br)ccc2O)c1 804736258 ONIJGPRXISUYOF-LJQANCHMSA-N 445.357 4.083 10 10 IICE C/C=C\COc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1 1125256953 QWQJJVLGGJERGF-DHJFXDNESA-N 426.532 4.253 10 10 IICE CN1CCN(c2ccc(CNC(=O)C[C@H](Cc3ccccc3)c3ccccc3)cc2)CC1 1132898867 HHRGUFHLLHJMRR-SANMLTNESA-N 427.592 4.471 10 10 IICE CC(C)[C@H](C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(Cl)c1 1133626385 JEZLMPADPKXSIY-QFIPXVFZSA-N 427.976 4.098 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cccc(CN4CCOCC4)c3)c2C)c1 1136293143 IBXYWAWNGIEVLQ-UHFFFAOYSA-N 431.580 4.473 10 10 IICE Cc1ccc(NC(=O)CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c(Cl)c1 1136432248 JQVDJNZEHZMAJO-UHFFFAOYSA-N 437.927 4.166 10 10 IICE C[C@H](NC(=O)c1ccc(Nc2nccs2)cc1F)c1ccc(N2CCOCC2)cc1 1136442704 AESIRCVWFXHUBY-HNNXBMFYSA-N 426.517 4.353 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)[C@@H]1OCCc2sccc21 1139584610 HMPOBPCYIYTEJI-HJPURHCSSA-N 444.597 4.387 10 10 IICE CCOc1cccc(N2CCN(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2)n1 1234325714 FOHJAFLQDFUNJQ-UHFFFAOYSA-N 447.583 4.228 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)COc2ccc(Oc3ccccc3)cc2)N(C)C)cc1 1289600228 NMVSFLMLEWWWAP-RUZDIDTESA-N 433.552 4.343 10 10 IICE CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)Cc1ccc(O)c(O)c1 1290693723 MZNRGHVKYXZYDW-UHFFFAOYSA-N 427.522 4.338 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@@H]2C2CCC2)cc1 1295411587 VHXLIOANHSAFAS-JOCHJYFZSA-N 438.620 4.080 10 10 IICE CN(C)c1ccc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)cc1 1295589709 AQVUEJRAQMPTHH-UHFFFAOYSA-N 428.580 4.370 10 10 IICE CC[C@H]1CCCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1306331043 SMMHZWYWMWNQNB-PMACEKPBSA-N 429.609 4.051 10 10 IICE COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1307628193 CSZXFRZWWNUSDR-HOTGVXAUSA-N 428.488 4.148 10 10 IICE COC(=O)c1ccc2c(c1)CN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)CC2 1313101420 VXBQAQSBTJFVEH-UHFFFAOYSA-N 431.536 4.191 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](c1ccc(F)cc1F)c1nccn1C 1313392076 HAFYFCXMWDNAAG-NRFANRHFSA-N 427.499 4.085 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(-c2csnn2)cc1 1354768075 SDNLVEHUGPIGTP-INIZCTEOSA-N 430.480 4.205 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1-c1ccccc1C 1355123447 KELZIYGVNPJPMJ-UHFFFAOYSA-N 436.531 4.039 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3cnnc3)cc2)c(C)n1-c1ccc(Br)cn1 1447642177 FFZSVLZPKYCNTR-UHFFFAOYSA-N 437.301 4.085 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)cc3O)cc2F)C[C@@H](C)O1 1464309615 OAMFWOLFFYKMKV-BETUJISGSA-N 426.410 4.094 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@@H]2c2nc3ccccc3[nH]2)N(C)C)cc1 1471548526 VQIGBOXHOMQADV-PKTZIBPZSA-N 434.588 4.168 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](C)C[C@H]2[C@@H](C)O)sc(C)c1-c1ccccc1 1473390023 BAJCDVAAZALRIE-FCEWJHQRSA-N 444.597 4.320 10 10 IICE CCOC(=O)[C@H](Cc1cccc(Cl)c1)NCc1ccc(N2CCC(OC)CC2)cc1 1473700922 WPPFOBMDRBUZFM-QHCPKHFHSA-N 430.976 4.219 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC2(c3ccc(C(F)(F)F)cc3)CC2)N(C)C)cc1 1479535550 WKDMIHLVEJCPPQ-HXUWFJFHSA-N 434.506 4.363 10 10 IICE CCc1nnc(Cn2c([C@@H](C)CC)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1513772372 ZCFWJQKPHURITA-KRWDZBQOSA-N 439.633 4.490 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nn1-c1ccc(F)cc1 1531503834 NBELZIZIQUWFPM-KRWDZBQOSA-N 444.457 4.320 10 10 IICE CC(C)(C)OC(=O)NCC[C@H]1Cc2ccccc2N(C(=O)/C=C\c2cncc(F)c2)C1 1536029520 UTQVQFPZWTZRMQ-GIFJBRJJSA-N 425.504 4.354 10 10 IICE CCN(CC)c1nc2sc(C(=O)N[C@@H]3CCN(c4ccc(OC)cc4)C3)cc2s1 1538746901 MULMMNFMBUNGPW-CQSZACIVSA-N 430.599 4.221 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3cccc(Cl)c3F)no2)N(C)C)cc1 1539236318 RRMDTTVGVXDWBF-IBGZPJMESA-N 430.911 4.233 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cccnc2OCC(F)(F)F)c1 1540840082 RUSVMQKCSXKDHG-UHFFFAOYSA-N 431.414 4.173 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)NCCCSc2nccs2)C1 1542956089 JUKRMLIBFSLQLY-UHFFFAOYSA-N 433.599 4.349 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2sc(Br)cc2s1 1543817578 MKQFUXCDFIYHPS-UHFFFAOYSA-N 437.384 4.492 10 10 IICE CCOCCC1(Cn2c(-c3cnccn3)nnc2N(C)Cc2ccccc2O)CCCC1 1548229781 WZVQJABYSAWMIU-UHFFFAOYSA-N 436.560 4.064 10 10 IICE CSCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CC1 1555924287 JHTCPUQQHOOSIR-UHFFFAOYSA-N 425.602 4.067 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc2cc(Br)ccc2c1 1557640657 RUAOKGADAGECDF-UHFFFAOYSA-N 439.353 4.493 10 10 IICE C[C@@H]1CN(CCOc2ccc(CCNC(=O)NCc3cc(Cl)ccc3O)cc2)C[C@@H]1C 1564464802 VBYFKYGHDWYAPF-HDICACEKSA-N 445.991 4.054 10 10 IICE COCCN(CCNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)C(=O)OC(C)(C)C 1567210801 ZVAKXWYDPVPWMD-UHFFFAOYSA-N 449.979 4.361 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)CC(C)(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1583941900 BWYYMLTULHAMHC-UHFFFAOYSA-N 429.992 4.397 10 10 IICE Cc1cc(C2(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)CCOCC2)on1 1586081681 HAIXSUZNFZQBAT-INIZCTEOSA-N 431.964 4.237 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccc([C@H]4CCC(=O)N4)cc3)cc2Cl)C1 1586083174 XALSSKDIJHIARK-HRAATJIYSA-N 425.960 4.457 10 10 IICE CCC[C@@H](C(=O)OCC)n1ccc(NC(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)n1 1586986690 IIWGSJCFSJWSGT-NRFANRHFSA-N 440.544 4.258 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc([N+](=O)[O-])cc(Br)c3C)CC2)cc1 1596733471 SBDOAYXLAVIPTH-UHFFFAOYSA-N 448.317 4.027 10 10 IICE Cc1cc(C(=O)NC[C@@H](Cc2ccc(F)cc2)C(N)=O)c(C)n1-c1cccc(C(C)C)c1 1597713460 QNNRYAUZHRHZQV-OAQYLSRUSA-N 435.543 4.431 10 10 IICE C[C@H]1CN(c2ccnc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)c2)C[C@@H](C)O1 1597950537 MBDKOKMTAOZMQK-BGYRXZFFSA-N 436.600 4.394 10 10 IICE CC(C)Cc1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1603454070 MNROZGYLTQIONS-UHFFFAOYSA-N 429.584 4.127 10 10 IICE Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)CC(=O)c1cc(C)n(-c2ccc(Cl)cn2)c1C 1613321681 BWDPWEOINSGIQJ-UHFFFAOYSA-N 447.900 4.016 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](CC(N)=O)C1 1614272849 QWNNBSMWRFDDII-OWLMGLOSSA-N 446.599 4.411 10 10 IICE CCN(CC)C(=O)c1ccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1 1624310841 KFJPXCDEOUNNCS-UHFFFAOYSA-N 431.536 4.319 10 10 IICE CCc1cc(N2CCC[C@@H](NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)ncn1 1627388514 IWYFTZHOYKUSCK-HXUWFJFHSA-N 437.975 4.499 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N 1631166736 JWTQNUSUWQTGOV-UHFFFAOYSA-N 446.660 4.100 10 10 IICE C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1631531143 IZYVOMFEMWXBEZ-QZTJIDSGSA-N 442.519 4.177 10 10 IICE CNS(=O)(=O)c1ccc(O)c(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)c1 1638362272 NJZSQPPCLNWENN-UHFFFAOYSA-N 441.553 4.084 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cn1c(C2CCCCC2)nc2ccccc21 1638529327 MAZDBTNOZBJWTI-UHFFFAOYSA-N 449.551 4.382 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@]1(C)c1cccc(Br)c1 1638529336 MDOUNEARQBISGH-PGRDOPGGSA-N 446.341 4.024 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2nc3cccc(Cl)c3n2C)cc1 1638864887 ZFJJADIZSCUTCI-UHFFFAOYSA-N 434.927 4.306 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1CN1CCOCC1 1641993322 DNPKWLVDLCPRCV-UHFFFAOYSA-N 431.492 4.270 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@]2(C[C@@H]2C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1641997640 SYMUQFFZCPOOAC-VLIAUNLRSA-N 429.344 4.352 10 10 IICE CC[C@H]1CN(Cc2ccc(N3CCC(OC)CC3)cc2)CC[C@H]1NC(=O)OC(C)(C)C 1645160969 VSDYSHHQFKUDKK-NZQKXSOJSA-N 431.621 4.427 10 10 IICE CC(=O)c1cc(Cl)cc(CN(C)C[C@H](O)COc2cc(Cl)cc(Cl)c2)c1O 1659784905 ARCRCIILCICRIF-INIZCTEOSA-N 432.731 4.427 10 10 IICE COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1682097276 OXEZSLOFYXLIPZ-RDPSFJRHSA-N 439.600 4.391 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@H](CNc4ccc(Cl)cc4)C3)C2)cc1 1683787773 QDUMHRAUTDJTHV-WIYYLYMNSA-N 442.991 4.461 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC(C)(C)c2cccc(Cl)c2F)N(C)C)cc1 1686220174 HEWWIVSRNJFWJV-HXUWFJFHSA-N 434.987 4.425 10 10 IICE CC(C)c1nnc(N2CCN(C3CCC3)C[C@H](C)C2)n1CCCSc1nccs1 1763061306 YXSFQOFMHICNMH-KRWDZBQOSA-N 434.679 4.351 10 10 IICE COc1ccc(N2CCN(c3ccc(NC(=O)c4c(F)cccc4Cl)cn3)CC2)cc1 1858426082 CTWQMOHYWOMQAW-UHFFFAOYSA-N 440.906 4.462 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(Cc5ccc(F)cc5)[nH]c4c3)CC2)cc1 1872798105 JTZZHUZEFPNGSF-UHFFFAOYSA-N 444.510 4.264 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)[C@@H](N)c1ccc2c(c1)CCN2C 1999536023 DYEJLPLEZLFGKA-PDIWNELESA-N 425.573 4.177 10 10 IICE COc1ccc(-c2ccc(C=C3SC(=S)N([C@H](CCSC)C(=O)O)C3=O)o2)cc1 2041068686 FYNGJVBBJCJCFI-OAHLLOKOSA-N 449.575 4.363 10 10 IICE Cn1nc(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)cc1Br 2174636824 RTDKNYJMVOYJNN-UHFFFAOYSA-N 435.366 4.160 10 10 IICE [N-]=[N+]=N[C@@H]1CCC[C@H]1NC(=O)c1ccc(I)c(Br)c1 2225802092 XNTAVXYXBZRHTD-GHMZBOCLSA-N 435.063 4.015 10 10 IICE COc1ccc(Br)c(CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1O 2236046505 VEQIDBNQFZYINT-CQSZACIVSA-N 443.382 4.290 10 10 IICE CC[C@H](C)N1C(=O)C(=C2C(=O)N(CC)c3ccc(Br)cc32)SC1=S 2296711310 LWLCPRBMYDXTQZ-VIFPVBQESA-N 425.373 4.186 10 10 IICE COc1ccc2c(C=C3SC(=S)N(c4ccccc4OC)C3=O)c(C(=O)O)[nH]c2c1 2297580080 MCROBIWWFDHODX-UHFFFAOYSA-N 440.502 4.289 10 10 IICE Cc1ccc(CN[C@@H]2[C@H]3C[C@@H]4CN(C(=O)OC(C)(C)C)[C@H]2[C@H]4C3)c(O)c1Br 2381130153 VBWTXXFYVQJNAG-FZMWSMFESA-N 437.378 4.197 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccccc3OC)SC2=S)cc1 15047467 RZZZXNNEWGAARH-QIQQCEGHSA-N 442.562 4.322 10 10 IICE CN(C)c1ccc([C@H](CNS(=O)(=O)CCc2ccccc2)N2CCc3ccccc32)cc1 15780719 YAOCWYMZVBCYRS-SANMLTNESA-N 449.620 4.019 10 10 IICE O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C/C=C\c1ccccc1[N+](=O)[O-] 208363327 NRKQNNHRFUAPPK-HSKOSKGKSA-N 438.484 4.083 10 10 IICE O=C1CCc2cc(-c3csc(NS(=O)(=O)c4cccc5ncccc45)n3)ccc2N1 727247413 URQASBJLWKEJJB-UHFFFAOYSA-N 436.518 4.044 10 10 IICE COc1ccccc1S(=O)(=O)Nc1nc(-c2sccc2Br)cs1 727248027 ADECIVDYHMKYHT-UHFFFAOYSA-N 431.358 4.444 10 10 IICE CNC(=O)c1cncc(/C=C/C(=O)N2CCCc3cc(OCc4ccccc4)ccc32)c1 734342858 QNDKSKWTRCNFIG-FMIVXFBMSA-N 427.504 4.013 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccc(OC4CCCCC4)cc3)cc2)C1 735432378 KUYCNIINGMZGPA-NRFANRHFSA-N 435.568 4.030 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(C)c(S(=O)(=O)NC3CC3)c2C)c1 796427633 DZPRSIUDURIYAX-UHFFFAOYSA-N 439.375 4.133 10 10 IICE Cc1cc(C(=O)N[C@H](CO)c2nc(-c3ccccc3)no2)c(C)n1-c1cccc(Cl)c1 804122259 AZXRKYDPKVDXCS-HXUWFJFHSA-N 436.899 4.261 10 10 IICE Cc1ccccc1[C@H](O)C1CCN(C(=O)NCc2ccc(N3CCSCC3)cc2)CC1 804968422 DDQNKDYRCQWIPO-XMMPIXPASA-N 439.625 4.203 10 10 IICE O=S(=O)(Nc1nc(-c2cccnc2)cs1)c1cc(Br)cc2cccnc12 808526912 YBAJMYGWZZLJKM-UHFFFAOYSA-N 447.339 4.317 10 10 IICE COc1cc(Br)c(CNCc2cc(Br)ccc2O)c(OC)c1 809712704 CGJSTCRPYKVESR-UHFFFAOYSA-N 431.124 4.224 10 10 IICE Cc1cc(C(=O)COC(=O)[C@H]2CCNC(=O)CC2)c(C)n1-c1cc(Cl)cc(Cl)c1 815422619 NRGIKRFDCSHVHR-CQSZACIVSA-N 437.323 4.043 10 10 IICE O=C(O)/C=C\c1ccc(N2CCc3[nH]c4ccc(Br)cc4c3C2)c([N+](=O)[O-])c1 917054554 QOFOELOAMUABTG-KXFIGUGUSA-N 442.269 4.499 10 10 IICE COc1c(N)c(C(=O)NCCCSc2nccs2)cc(Cl)c1Br 1136661655 LZDKFSIUSVLXIJ-UHFFFAOYSA-N 436.784 4.062 10 10 IICE COc1ccc(CN2CC[C@@H]2C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1139138612 KODKOLMCIZJOPF-MHECFPHRSA-N 442.003 4.476 10 10 IICE CCCN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)c1cc2cc(O)c(O)cc2s1 1141374337 CBXXCNPQSASHHY-UHFFFAOYSA-N 438.427 4.221 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(Br)c(CO)c2)c1 1144131196 INYTUEHBESDSJY-UHFFFAOYSA-N 427.298 4.414 10 10 IICE Cc1cc(CC(=O)Nc2ccc(Cl)c(CN(C)CCO)c2)c(C)n1-c1ccccc1 1155260311 JESHUPDBFDDHIF-UHFFFAOYSA-N 425.960 4.353 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1OC 1184094566 AIKFXXHYWRFRAG-JOCHJYFZSA-N 441.572 4.376 10 10 IICE CC[C@@H]1c2ccc(OC)c(OC)c2CCN1C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1230859274 VMLXEXHQXCTIQI-HTAPYJJXSA-N 439.556 4.010 10 10 IICE COc1ccc([C@H](NC(=O)NCc2cccc(Br)c2O)c2ccco2)cc1 1251936167 MCPSCCUHKWCQQA-SFHVURJKSA-N 431.286 4.345 10 10 IICE C[C@@H]1CCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1291163722 LGDVRCMMYLGOQH-IEBWSBKVSA-N 429.584 4.298 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(Cn3cccn3)CC2)n1Cc1ccc(N(C)C)cc1C 1291501056 ITHZGPWRLIHMDF-LJQANCHMSA-N 435.620 4.327 10 10 IICE CCOCc1nnc(N2CCC[C@@H]2c2csc(C)n2)n1Cc1ccc(N(C)C)cc1C 1297254349 NHGNXLVRDPNSNO-OAQYLSRUSA-N 440.617 4.344 10 10 IICE Cc1cc(-c2nnc(N3CCC(C(N)=O)CC3)n2CCC(C)C)c(C)n1-c1ccccc1 1304195066 ITVFXETUYDRIAK-UHFFFAOYSA-N 434.588 4.100 10 10 IICE CC(=O)N1CCN(Cc2ccc(NCc3ccc(OCc4ccccc4)cc3O)cc2)CC1 1308641498 LPBIHNPXJYAUKF-UHFFFAOYSA-N 445.563 4.247 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCSC[C@H]2C)cc1 1313678187 BSXOEHGWIGNKDX-QUCCMNQESA-N 429.634 4.008 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2cnccn2)cc1 1313679192 LRCRHGZAERUILI-UHFFFAOYSA-N 447.612 4.251 10 10 IICE COc1ccc(N2CCC(NC(=O)CCc3cccc(F)c3Br)CC2)cc1 1352538761 WTHLCHXBUDBGPE-UHFFFAOYSA-N 435.337 4.315 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 1355015548 OIBWOUZGOWGXGN-GCJKJVERSA-N 431.939 4.161 10 10 IICE Cc1ccccc1CCNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1435457358 AHTULSFGHDBLGX-RGEXLXHISA-N 428.554 4.084 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1NC(=O)OC(C)(C)C 1438888457 UZQHQWMTXAVJQD-UHFFFAOYSA-N 438.572 4.024 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(O[C@H]2CC2(F)F)cc1 1445879852 FFKLCKXKMARQTH-PXNSSMCTSA-N 436.886 4.226 10 10 IICE CCOc1ccccc1[C@@](N)(C(=O)NCc1cc(Cl)cc(Cl)c1O)C(F)(F)F 1457854218 JFOLSDQHXNJUBS-QGZVFWFLSA-N 437.245 4.130 10 10 IICE Cc1ccc2c(c1)CN(C(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)CC2 1461455134 GKOPPRMTYMRQBS-MOSHPQCFSA-N 440.565 4.310 10 10 IICE CC(C)(C)OC(=O)N1Cc2ccccc2[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 1464077584 ZTDIDUBAROQGBX-QHCPKHFHSA-N 435.568 4.438 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC[C@@H](C)N(C)C(=O)OC(C)(C)C)c1 1465025436 YOSJIBSRQUBXTH-MRXNPFEDSA-N 427.545 4.282 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(N3CCC(N(C)C)CC3)cn2)c1 1465801874 KLUSMOJAWWHFBQ-UHFFFAOYSA-N 445.567 4.084 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCC[C@H]1CCCN1C(=O)OC(C)(C)C 1478656186 HHJWNKLQKKIZMD-CTNGQTDRSA-N 446.636 4.471 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1Nc1cnn([C@@H]2CC2(F)F)c1 1510676418 XPWGMECZWKMWLJ-LJQANCHMSA-N 429.519 4.420 10 10 IICE O=C(/C=C\c1ccc(Cl)nc1)N(CCCn1ccnc1)c1ccc(Br)cn1 1526309351 KFWQNBFLIQTFFF-CLTKARDFSA-N 446.736 4.226 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccn2ccnc2c1 1527606345 LPJXZOKUJHCDAK-NTCAYCPXSA-N 428.564 4.016 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Br)C(=O)NCc1ccc(N(C)C)c(F)c1 1535619250 LMMPPPKSCAXYNH-NSHDSACASA-N 429.717 4.391 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cccc(C(=O)N(C)c3ccccc3)c2)N(C)C)cc1 1537482255 BYGUPNDSNHMNDG-RUZDIDTESA-N 444.579 4.062 10 10 IICE C[C@@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1ccccc1O 1545681761 ALOBGCXGWCZOEX-KRWDZBQOSA-N 430.504 4.183 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1Cc1nc(C(C)(C)C)cs1 1554174435 DEFXVNJTZGUQBX-UHFFFAOYSA-N 434.569 4.484 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@@H](C1CCCCC1)N(C)C 1554174901 DLFZNXLVXOMNNA-QHCPKHFHSA-N 448.615 4.116 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cccc(OC(F)(F)F)c1 1566356516 HDWDDTZYUKRLQS-INIZCTEOSA-N 428.838 4.339 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C 1584446978 XYEXMVAMLGSXJA-UHFFFAOYSA-N 427.545 4.282 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C3)ccc21 1584862114 ICJKEGXIMYNWAV-UZLBHIALSA-N 428.573 4.344 10 10 IICE O=C(c1ccc(Cn2cc(Cl)cn2)cc1)N(Cc1ccccc1O)C[C@H]1CCCO1 1597089864 JEGVSLBNWSCUSF-OAQYLSRUSA-N 425.916 4.112 10 10 IICE CN(c1ccc(CNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1)C1CCCCC1 1597950477 LGSBIRIGPQBXIG-RUZDIDTESA-N 433.596 4.305 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@@](C)(CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1613347438 FMBIWGXWQWNQHI-DVECYGJZSA-N 443.661 4.398 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3sc(-c4ccc(OC)cc4F)nc3C)C2)cc1 1617262939 PEAYIOWLXGYBLX-OAHLLOKOSA-N 441.528 4.284 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(-c2cnn(C)c2)n1CCCC(F)(F)F 1617893846 SVKTYPXDRMWGJP-UHFFFAOYSA-N 447.509 4.258 10 10 IICE Cc1ccc(-n2ncc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2C)cc1 1622635182 SEBIBXWDKPMJSU-FQEVSTJZSA-N 438.959 4.243 10 10 IICE CCN1CCN(Cc2ccc(NC(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)cc2)CC1 1624454269 LTNWDEFHNYLPHL-UHFFFAOYSA-N 448.611 4.294 10 10 IICE CN(c1ccc(CNC(=O)[C@@]2(C)CN(C(=O)OC(C)(C)C)CCO2)cc1)C1CCCCC1 1625905470 UNKIZQAWFIRDFY-RUZDIDTESA-N 445.604 4.098 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(CCN(C)C)CC(=O)OC(C)(C)C)c2C)c1 1626212576 TYEVJCRRSHABIM-UHFFFAOYSA-N 427.589 4.056 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N(C)Cc1ccccc1N1CCOCC1 1627771536 TUBNCCCZICEQJX-UHFFFAOYSA-N 431.536 4.015 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]3OCCC[C@@H]3C2)sc(C)c1-c1ccccc1 1642219373 XGGFHMWPFJWIEC-RTBURBONSA-N 442.581 4.340 10 10 IICE COC(=O)[C@H](c1cccc(Cl)c1Cl)N1CCN(c2ccc(OC)cc2OC)CC1 1644225428 KZYCLTDOEZZLQR-FQEVSTJZSA-N 439.339 4.047 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3nc(-c4ccc(C)cc4)cs3)CC2)cc1F 1644919561 RPDOOXNOORTIAW-UHFFFAOYSA-N 440.544 4.027 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CCCC12CCN(C(=O)c1ccc(N=NC(N)=O)cc1)CC2 1648910836 DGSOOGOWXDHXNP-QGZVFWFLSA-N 443.548 4.396 10 10 IICE CCN(CC)CC[C@H](NC(=O)N1CCCN(c2ccc(OC)cc2)CC1)c1ccccc1 1676793688 HOEWWVXCTVNQIR-VWLOTQADSA-N 438.616 4.390 10 10 IICE O=C(NCc1ccc(Br)c(F)c1F)NCc1c(O)ccc2c1CCCC2 1683189274 PWWYGGFJBBMUKD-UHFFFAOYSA-N 425.273 4.311 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1c2ccccc2CC[C@H]1n1ccnc1 1686826708 NQLFMVYLFOQLTO-QTLGCAHFSA-N 431.584 4.417 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@@H](c1cccs1)N(C)C 1696700490 FIUKNEZSLKNKSE-ICSRJNTNSA-N 441.601 4.226 10 10 IICE COCCN(CC(C)C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1698046382 ACIYIANSKURIHN-UHFFFAOYSA-N 440.567 4.011 10 10 IICE CC(C)Cc1nnc(N2CCS[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1706433416 VGFCBOXDOFFYHR-GOSISDBHSA-N 431.675 4.020 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2nccs2)n1Cc1ccc(N2CCSCC2)cc1 1708403377 PAPYMUNRBBNUKC-KRWDZBQOSA-N 442.658 4.486 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1708574680 NMLUTBMGKHHKBR-DWXRJYCRSA-N 448.615 4.313 10 10 IICE CC[C@H](C)c1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1743804290 ZQFWQVPHZZQPLH-SFHVURJKSA-N 429.634 4.008 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1744807405 KEEGFXRQDNKCIG-BHVFFLMSSA-N 441.620 4.050 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CCS1 1745008925 FMFAKHSKVLTUTN-INIZCTEOSA-N 432.644 4.311 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CC[C@H]3CCO[C@H](C)C3)CC2)cc1 1748847993 OKIJYSOEEQOFJL-RTWAWAEBSA-N 441.620 4.332 10 10 IICE Cc1nc(C)c(CCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1751757896 WVNAAFIOGMRZOX-IBGZPJMESA-N 427.574 4.178 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1ccc(Cl)s1 1764888897 CIJDYOVLJFTCCS-UHFFFAOYSA-N 431.993 4.329 10 10 IICE COC(=O)C1CCC(CNC(=O)c2ccc3[nH]c(-c4ccc(N(C)C)cc4)nc3c2)CC1 1872740993 YKJHKIUSKAXPMH-UHFFFAOYSA-N 434.540 4.005 10 10 IICE O=C(N[C@H](CCCc1ccc(O)c(O)c1)C(=O)O)OCC1c2ccccc2-c2ccccc21 1951401372 FEZZJUCNBMRPRX-JOCHJYFZSA-N 447.487 4.412 10 10 IICE O=C1OC(c2ccc(Cl)cc2Cl)=NC1=Cc1ccc(N2CCOCC2)c([N+](=O)[O-])c1 2053515549 ZRTSFEMZPMDRGH-UHFFFAOYSA-N 448.262 4.083 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(NCc2ccc(Br)cc2O)C[C@H]2CC[C@H]1C2 2131759692 DWQDBJVIBOAAGT-ZQGRQUNCSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@H](N)c3occc3Br)cc2)CC1 2286068313 MPVCUEASAMDXHM-KRWDZBQOSA-N 436.350 4.147 10 10 IICE Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C2=O)c1 2294131053 WMHIAEFTBISXOX-UHFFFAOYSA-N 431.404 4.138 10 10 IICE CS(=O)(=O)Oc1ccc(Cl)cc1C=C1SC(=S)N(Cc2ccccc2)C1=O 2297500050 HAJWXDGQIANWNQ-UHFFFAOYSA-N 439.967 4.080 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(OC)cc2OC)SC1=S 2314768285 KFTFUHRZKNHMCQ-LJQANCHMSA-N 443.546 4.209 10 10 IICE Cc1ccc(CNC(=O)[C@@H](CCC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380720705 HROMNNXSVNCKHL-OAHLLOKOSA-N 443.382 4.409 10 10 IICE Cc1ccc(-c2nn(-c3ccccc3)cc2/C=C2\SC(=S)N(CC(=O)O)C2=O)c(C)c1 13363023 OPHISYNINYJLRB-ODLFYWEKSA-N 449.557 4.442 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478076 OSCRUMCLLZLPJU-CKJXQJPGSA-N 427.526 4.498 10 10 IICE Cc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccc(O)cc3O)SC2=S)cc1 15039377 PLEGDTAHYFGHES-WQRHYEAKSA-N 428.535 4.026 10 10 IICE CC[C@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C\c2cccc(OC)c2)SC1=S 34990613 URULGDFWBHEZNU-BYFYWULKSA-N 432.611 4.468 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccccc2)SC1=S)Nc1nc2ccc(F)cc2s1 208740158 YWLSKNVSHBVKON-OVCLIPMQSA-N 429.523 4.275 10 10 IICE COc1ccc(N2CCN(CCNCc3ccc(Oc4cccnc4)c(C)c3)CC2)cc1 732817693 FCTVRZIRGPPZKQ-UHFFFAOYSA-N 432.568 4.103 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc(OCC3CC3)cc2)c(C)n1-c1ccccc1 733663719 SZWDSUOZYNPRHS-UHFFFAOYSA-N 431.536 4.180 10 10 IICE Cc1cc(C(=O)COC(=O)Cc2cc(F)cc3c2OCOC3)c(C)n1-c1ccc(F)cc1 753877424 YKTKLLCBELOFEY-UHFFFAOYSA-N 441.430 4.207 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H](c1cc(F)ccc1F)C(F)F 788755449 LAUJELOHFXFNOS-SFHVURJKSA-N 427.467 4.324 10 10 IICE CCNC(=O)C[C@H]1CCCCN1Cc1c(O)ccc2c(=O)c(-c3ccccc3)c(C)oc12 789519579 LWCKCSXPILBCQR-LJQANCHMSA-N 434.536 4.355 10 10 IICE Cc1ccc([C@H](NC(=O)NCc2cc(Br)ccc2O)c2ccccn2)cc1 807190214 FILRJUDAROYYIR-FQEVSTJZSA-N 426.314 4.447 10 10 IICE CCOc1ccc(O)c(CN2CCC(O)(Cc3ccc(OC(F)(F)F)cc3)CC2)c1 809758891 WRZJXEWPGYEBCV-UHFFFAOYSA-N 425.447 4.259 10 10 IICE COc1ccc([C@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1F 918195402 REKMTYJDRBGHFZ-JYJNAYRXSA-N 433.499 4.147 10 10 IICE CC[C@H](C)Oc1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 1132805973 ATTNCCWGNNGRJA-ZDUSSCGKSA-N 445.431 4.195 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1136388745 BIAYTDSKCBKJHE-FQEVSTJZSA-N 425.573 4.400 10 10 IICE Cc1c(CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)oc2ccccc12 1136784823 FXKSRNZRUYIROS-UHFFFAOYSA-N 442.518 4.239 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](C)CS(=O)(=O)c3ccc(C)cc3)c2C)cc1 1154721934 BVUMPLXLYYKXJX-QGZVFWFLSA-N 440.565 4.003 10 10 IICE Cc1cc(C(=O)CSCCN2CCOCC2)c(C)n1-c1cccc(Br)c1 1188555998 CHGFEQWZPLLHQL-UHFFFAOYSA-N 437.403 4.105 10 10 IICE O=C(CN(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)NC(=O)Nc1ccccc1 1191580683 AHLOXDQMBWRRHE-YFHOEESVSA-N 443.503 4.326 10 10 IICE C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1254716901 WFXQFKWWMTUZJI-KRWDZBQOSA-N 434.506 4.360 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](c1ccc(Br)cc1)N1CCCC1 1265457778 VLYYLGJBUBZFLM-OAQYLSRUSA-N 444.373 4.078 10 10 IICE CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1289600218 NKHKFBZYQBUTBX-FQEVSTJZSA-N 430.574 4.194 10 10 IICE O=C(NCC1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1)OCc1ccccc1 1297101301 QXBJBIDMSTUIBE-UHFFFAOYSA-N 440.521 4.091 10 10 IICE Cc1cc(CC(=O)N[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1299438916 RGRYONXDUILWFO-CTNGQTDRSA-N 425.573 4.446 10 10 IICE CO[C@H]1CCN(c2nnc(Cc3ccccc3C)n2CCCSc2nccs2)C1 1302400196 RVUNLXLZBUTCMP-SFHVURJKSA-N 429.615 4.041 10 10 IICE C[C@H]1CSCCN1c1nnc(Cc2ccsc2)n1Cc1ccc(N(C)C)c(F)c1 1305237573 FCBXLTVUXORQHQ-HNNXBMFYSA-N 431.606 4.126 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCC[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1 1312313021 CWABLUFSEGLBDH-FYYLOGMGSA-N 438.616 4.074 10 10 IICE CCO[C@@H]1CCCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)C1 1314279403 XQPZYHVLPXTRAV-XMMPIXPASA-N 448.615 4.164 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1N(C)C 1356496220 NPMCJHSDKWJWGP-UYRXBGFRSA-N 443.569 4.430 10 10 IICE CC(C)OCCCCn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1360382158 HNPWKEHSWZOLDM-UHFFFAOYSA-N 443.636 4.254 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnn3cccc(OC)c23)cc1 1443630161 GCVJQYHKCHCDGC-UHFFFAOYSA-N 430.508 4.265 10 10 IICE COc1ccc(Cl)cc1[C@@H](O)CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1449493563 ZXWCMBXUQJWHAB-NRFANRHFSA-N 426.900 4.032 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccccc2Sc2ccc(S(C)(=O)=O)cc2)c1 1453651692 PGOPVXYMFAYLIR-UHFFFAOYSA-N 427.547 4.185 10 10 IICE C[C@H](CCc1ccccc1)NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1463622101 VGWMCAHEOQKNEV-OAHLLOKOSA-N 430.551 4.006 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4c(F)c(Br)ccc4[nH]3)C2)cc1 1469280931 UXSBNVFVKDYOSY-ZDUSSCGKSA-N 446.320 4.334 10 10 IICE CC1(C)[C@@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H]1c1ccccc1 1470384995 IAQZUDJOCYPOSQ-PMACEKPBSA-N 442.562 4.177 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@H](c3ccc(F)cc3)C2(C)C)N(C)C)cc1 1471547021 GWDIYSYYHKPRPR-DHIUTWEWSA-N 426.580 4.472 10 10 IICE Cc1nc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(-c2ccccc2)s1 1535345801 OYKVFUPWMIGGJP-UHFFFAOYSA-N 429.492 4.163 10 10 IICE COc1cccc(Oc2ccc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)nc2)c1 1535558684 PIDNYKZLMKBANL-SFHVURJKSA-N 433.508 4.210 10 10 IICE Cc1ccc(Oc2ccc(OCC(=O)NCc3ccc(N4CCN(C)CC4)cc3)cc2)cc1 1536924710 LNWQNYRFRGHBIB-UHFFFAOYSA-N 445.563 4.234 10 10 IICE c1ccc(CCCc2nnc(N3CCCOCC3)n2CCCSc2nccs2)cc1 1539573332 GSJUIEKGXVLNSS-UHFFFAOYSA-N 443.642 4.319 10 10 IICE CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1544010912 AMQQMGZRWSOPDT-GCJKJVERSA-N 437.584 4.372 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)c1cc(C)oc1C 1555760221 ITFAMNDVOCCUCR-RUZDIDTESA-N 449.555 4.468 10 10 IICE O=C(c1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)N1Cc2cccc(O)c2C1 1558035474 IBXPVXBBPZUCJI-UHFFFAOYSA-N 435.320 4.430 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC[C@@H](C3CC3)N2C(=O)OC(C)(C)C)cc1F 1565688491 ZEFRDFIWZSNEMB-PZJWPPBQSA-N 433.568 4.466 10 10 IICE O=C(C[C@H](c1ccccc1)c1ncc[nH]1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1584356354 JPHWJSNHTYVKNM-OAQYLSRUSA-N 440.494 4.318 10 10 IICE Cc1cc(C)c(C(=O)Nc2c(Cl)ccc3nonc23)cc1I 1586677665 ZUOKKLZFXPXFCN-UHFFFAOYSA-N 427.629 4.350 10 10 IICE Cc1nc(CCC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cs1 1616567925 YZTIYOTVXDYEJF-UHFFFAOYSA-N 442.342 4.495 10 10 IICE CCOC(=O)C[C@H]1CCN(C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)c2ccccc21 1616616653 UWSQDSZUMHPDKP-SJLPKXTDSA-N 428.529 4.074 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@@H](c1ccsc1)N(C)C 1617940857 SFNMABKPWOKCHT-FPOVZHCZSA-N 441.601 4.226 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)C1 1618821886 YNEKWWDOFLABLA-IBGZPJMESA-N 449.517 4.286 10 10 IICE COc1ccc(N2CCN(c3nnc(Cc4ccsc4)n3CCC(C)C)CC2)cc1F 1619302130 IZXJCBGZCYVABH-UHFFFAOYSA-N 443.592 4.451 10 10 IICE CS[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CO)CC1 1620192407 YQQVZVBUSXGKPE-SFHVURJKSA-N 439.629 4.313 10 10 IICE Cc1cc(C(=O)N[C@H]2CN(C)Cc3ccccc32)c(C)n1-c1ccc(Br)cn1 1624624145 RHTOPLIEBPQHDD-FQEVSTJZSA-N 439.357 4.168 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1Cc2c(F)cc(C)cc2N1C(=O)OC(C)(C)C 1627029013 TYFUYUSSRGRQDZ-GOSISDBHSA-N 449.519 4.308 10 10 IICE CCN1CC[C@@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)[C@H](C)C1 1629674019 MCKAGEHXDMCUDP-AUUYWEPGSA-N 433.394 4.054 10 10 IICE CCN(CC)C[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C1 1634592936 UOTCWWDMERILPI-KRWDZBQOSA-N 433.394 4.056 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1 1636234143 RYHZGCYLNPVRFB-VQTJNVASSA-N 430.593 4.122 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3C(=O)c3ccc(F)cc3)C2)cc1 1639684119 ULEBCFQOYVISCM-SFHVURJKSA-N 432.495 4.322 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccccc2C(=O)Nc2cccc(C)c2)c(OC)c1 1642345534 FDIXXLALNVXQMZ-UHFFFAOYSA-N 433.508 4.339 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@H](C)c3cccc(C(F)(F)F)c3)nc12 1653360802 VJTZRELGLXIVKY-CYBMUJFWSA-N 436.434 4.214 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3ccc(C(F)(F)F)cc3C2)N(C)C)cc1 1687807091 NXBNAZMYVUGJMN-NRFANRHFSA-N 434.506 4.142 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC[C@H](COC)C2)cc1 1695619112 GLIKMEGGELVILJ-NRFANRHFSA-N 434.588 4.016 10 10 IICE CCOC[C@H]1CCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C1 1696380578 YRCSSCGDSQFDIJ-NRFANRHFSA-N 434.588 4.097 10 10 IICE CN(CCOC(C)(C)C)c1nnc(CC2CC2)n1Cc1ccc(N2CCSCC2)cc1 1696831318 PSRPXZUOVQOYSU-UHFFFAOYSA-N 443.661 4.083 10 10 IICE CCC1CCN(c2nnc(Cn3nc(C)cc3C)n2CCCSc2nccs2)CC1 1709306289 NKFJJUKMDGDCCM-UHFFFAOYSA-N 445.662 4.405 10 10 IICE CCC(=O)N[C@H]1CCCN(c2nnc(C3CCCC3)n2CCCSc2nccs2)C1 1726786011 YKRCXJJEFQMUGU-KRWDZBQOSA-N 448.662 4.070 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@H](C)CCSC)n1Cc1ccc(N2CCOCC2)cc1 1726866029 MJCYPZJGQXNDPR-RTBURBONSA-N 431.650 4.254 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1CC1CCC(C(F)(F)F)CC1 1747749894 FPAVGMXAIBIFCB-UHFFFAOYSA-N 446.477 4.446 10 10 IICE Cc1noc(C)c1[C@H](C)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccccc1O 1762646607 UVSQCNYHKCHOTG-MRXNPFEDSA-N 432.528 4.014 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1C[C@@H](c1cccs1)N(C)C 1767112326 XXHGVNASXJZRSB-IBGZPJMESA-N 434.569 4.047 10 10 IICE COC[C@@H]1CCCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C1 1769400146 BWQHYDAQJBQVND-QGZVFWFLSA-N 446.646 4.175 10 10 IICE COc1ccc2c(c1)c(/C=C1/SC(=S)N(c3ccc(CC(=O)O)cc3)C1=O)cn2C 1860073408 CHIPBYGAUXPJIZ-VXLYETTFSA-N 438.530 4.220 10 10 IICE CCOc1cc(N2CCOCC2)c(OCC)cc1NN=NCCOc1ccc(OC)cc1 1860490982 GAWRNNZQOWOEGL-UHFFFAOYSA-N 444.532 4.187 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(Br)c2O)C[C@@H]1C1CC1 1895874234 LOVLOYDXEQUZJQ-NVXWUHKLSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)NCC1(NCc2ccccc2O)CCN(Cc2ccccc2)CC1 2014107341 PYRJFXORLPMZSP-UHFFFAOYSA-N 425.573 4.041 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCCCN2C(=O)OC(C)(C)C)c1O 2227747880 GTISOMUYMSCSMO-ZDUSSCGKSA-N 429.355 4.043 10 10 IICE COc1ccc(Br)c(CNC2(CNC(=O)OC(C)(C)C)CCCCC2)c1O 2236051616 VSQZOBUTEQADAZ-UHFFFAOYSA-N 443.382 4.481 10 10 IICE CS(=O)(=O)Oc1ccc(C=C2SC(=S)N(Cc3ccccc3)C2=O)cc1Cl 2297364561 YOZNTNKZCSCEKG-UHFFFAOYSA-N 439.967 4.080 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCOc3ccc(OC)cc3)C2=O)ccc1O 2323719119 NNDBTIUIOBABGZ-UHFFFAOYSA-N 431.535 4.080 10 10 IICE Cc1ccc(CN(C)C(=O)CC2CC(NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381130402 YKZUJFYISKUXOY-UHFFFAOYSA-N 441.366 4.115 10 10 IICE CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C(\C)Nc1ccc(Cn2cnnc2)cc1 19643307 WWVYESAKTYFLEW-CJLVFECKSA-N 445.483 4.123 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(N(C)C)cc3)[C@H]2c2ccc(O)c(O)c2)c1 526365666 CWIPNLOZHVRRBD-QHCPKHFHSA-N 432.476 4.230 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)N(Cc1ccco1)Cc1ccccc1O)CC2 759090998 USWLTDPPAYKKEJ-OAHLLOKOSA-N 445.441 4.436 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCC2CCS(=O)(=O)CC2)cc1 769101248 CASVAQFDWPJSLS-UHFFFAOYSA-N 428.558 4.113 10 10 IICE C[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@@H](c2ccco2)C1 769932961 RPIWGUJAGYMDSO-WMLDXEAASA-N 446.550 4.461 10 10 IICE C[C@H](NS(=O)(=O)Cc1ccc(Cl)cc1Cl)c1ccc(N2CCOCC2)cc1 779613142 GFPCQBYRKWJIMK-AWEZNQCLSA-N 429.369 4.011 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NC1CC(F)(c2cccc(Cl)c2)C1 796633877 JHXKLTFDIGNBBY-UHFFFAOYSA-N 449.929 4.267 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1cc(Cl)ccc1Br 811822517 BOXBNYUGRDDVTF-UHFFFAOYSA-N 430.736 4.422 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)NCc3cc(-c4ccccc4)no3)cc2F)C[C@@H](C)O1 918214619 GRHYXFBQDKGUPL-IAGOWNOFSA-N 438.503 4.094 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)cc1 1125235842 VOJXMDYDGCVMFO-SFHVURJKSA-N 425.520 4.041 10 10 IICE Cc1cccc(N2N=C(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CCC2=O)c1 1132011718 VGVRFZLYLUSDBJ-UHFFFAOYSA-N 428.536 4.244 10 10 IICE Cc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(C)n1-c1ccc(Br)cn1 1141367159 PPNXIUMTPJWTKQ-UHFFFAOYSA-N 441.285 4.363 10 10 IICE COCCNc1nnc(SCC(=O)c2cc(C)n(-c3ccc4c(c3)CCC4)c2C)s1 1164509318 BBKGWAUWWQFVOK-UHFFFAOYSA-N 442.610 4.468 10 10 IICE CCOc1ccc(N(CC)C[C@H](O)c2ccc3c(c2)CN(C(=O)C(F)(F)F)CC3)cc1 1167982674 FVHDDONAXGRGGW-NRFANRHFSA-N 436.474 4.092 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN([C@H](C)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 1185519301 XXFMDZHQSHCPCE-AGHZKPIHSA-N 429.904 4.318 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3cc(C)c([N+](=O)[O-])cc3F)c2C)cc1 1189173778 MZWOLEOOOPEECH-UHFFFAOYSA-N 440.427 4.498 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCc2c(Cl)cc(Cl)cc2C1 1253512057 QJPNZNRTYKJNHY-UHFFFAOYSA-N 434.367 4.222 10 10 IICE CCC[C@@H](C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)c1cccc(Cl)c1 1296398521 AKKRECNATBDSCW-HSZRJFAPSA-N 427.976 4.209 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1C 1296870059 AAFHPEJWPBVBDC-HSZRJFAPSA-N 429.564 4.366 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1302699919 DTOUQSNWCBGEKH-YLJYHZDGSA-N 433.597 4.105 10 10 IICE CC(C)N1CCC[C@@H](Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)C1 1303305522 SEGBAESUZIWYFG-OAQYLSRUSA-N 425.621 4.473 10 10 IICE CCc1nnc(N2C[C@H](C)O[C@H](c3ccccc3)C2)n1CCCSc1nccs1 1306112508 KYZGQSQHYTWILK-WMZOPIPTSA-N 429.615 4.446 10 10 IICE COc1cc2c(c(OC)c1)N(Cc1nc(Cc3cccc(Br)c3)no1)CCC2 1307843350 XDSIXWBCQIQIER-UHFFFAOYSA-N 444.329 4.393 10 10 IICE CCCOc1ccc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 1354755151 OHKJRYQSDGFJEM-MRXNPFEDSA-N 434.483 4.484 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1356166351 SAJSXLHOGSMJCR-BBVWWWHTSA-N 435.612 4.249 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C1 1359884175 MKFNNCGDXCPYNA-HXUWFJFHSA-N 436.579 4.390 10 10 IICE CCN(CC)c1ccc(CNC(=O)C2(NC(=O)NCc3ccccc3)CCCC2)cc1F 1443769628 IIAFPNKGRPIODO-UHFFFAOYSA-N 440.563 4.100 10 10 IICE CCOc1cc(NC2CCN(C(=O)c3sccc3-n3c(C)ccc3C)CC2)ncn1 1447415561 IWCYKMCWOZIKOU-UHFFFAOYSA-N 425.558 4.061 10 10 IICE COc1ccc(Cl)c(N2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1478841146 PZSGZBFBKZGCAV-SFHVURJKSA-N 445.007 4.186 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1499338260 UEVBQEIDTTVEOR-FXAWDEMLSA-N 429.584 4.224 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3cccc(OCC=C(C)C)c3)cc2F)CC1 1521015368 GCXDMTTWYYKIRN-UHFFFAOYSA-N 439.575 4.172 10 10 IICE CC1(c2nccc(NC(=O)CCCN3C(=O)/C(=C/c4cccs4)SC3=S)n2)CC1 1525404614 HJEASDULFCDZAK-OWBHPGMISA-N 444.607 4.210 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(I)c(F)cc1F 1545504720 CTYGABZHHROYTH-UHFFFAOYSA-N 431.220 4.327 10 10 IICE CC[C@H](C)c1nnc(N2CCCO[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1545509614 LBTMJTKQVGVRLR-RBUKOAKNSA-N 429.634 4.008 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2ccc(F)cc2F)NC(=O)OC(C)(C)C)cc1 1586619305 HAMYABFSCDAITQ-NRFANRHFSA-N 447.526 4.346 10 10 IICE COc1ccc(N(C)Cc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)c(OC)c1 1616475398 HWSYHYMDEITDEP-UHFFFAOYSA-N 425.485 4.444 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](O)c1ccc(Cl)c(Cl)c1 1622635232 UQTSUKNYGHJHRF-DNVCBOLYSA-N 443.758 4.167 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1ccc(Cl)cc1 1627092122 VSFDEYYFJZXXKR-CABCVRRESA-N 440.931 4.241 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCN1C(=O)c2ccccc2C1=O 1631530935 BAVXCUWLZOCKMO-SFHVURJKSA-N 428.488 4.168 10 10 IICE CC(=O)c1ccc(CCNC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1632441562 IGQOOVMVBPHWNW-LJQANCHMSA-N 431.483 4.001 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](O)[C@H]2CCc2ccccc2)cc1 1640093223 ULOOCKNTPAGRNZ-SXOMAYOGSA-N 444.575 4.434 10 10 IICE COC(=O)COc1ccc(N(C)Cc2ccc(I)c(Cl)c2)cc1 1645253955 CTLORBHDQLYFAZ-UHFFFAOYSA-N 445.684 4.133 10 10 IICE CCC[C@H](Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1649640992 JFFFFXSWURZEER-JOCHJYFZSA-N 443.636 4.407 10 10 IICE COc1ccc(N(C)CCN(C)[C@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cc1 1654947038 HHWFTOHBWZPFNV-QFIPXVFZSA-N 449.517 4.273 10 10 IICE CC(C)OC(=O)CNC(=O)[C@H](C)SCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 1656631936 CKJYMZSEPLJKJJ-INIZCTEOSA-N 442.541 4.230 10 10 IICE CCN(C)c1ccc(CN2CCC[C@H]([C@@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)C2)cc1 1659302694 ACYYTNDEBNPPOF-XJUOHMSHSA-N 431.621 4.427 10 10 IICE CC[C@@H]1[C@@H](NC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CCN1C(=O)OC(C)(C)C 1682101506 RZINZFCEPBYZBT-JRGCBEDISA-N 432.609 4.079 10 10 IICE COc1ccc([C@@H](O)C2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1686827112 WGMDTXYAGWXPFW-KBMIEXCESA-N 439.600 4.156 10 10 IICE COc1ccccc1N1CCN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)CC1 1687217695 VDVYTCWBCYZKGZ-UHFFFAOYSA-N 432.568 4.177 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CCN(C(=O)OC(C)(C)C)C1CC1 1692080384 YAJJEAPZKDFRFN-UHFFFAOYSA-N 443.592 4.218 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ncccc1C 1698014405 RQMKEHFDKKVGNP-UHFFFAOYSA-N 430.556 4.187 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C)[C@H](C)C3)n2CCCSc2nccs2)n1 1726061245 YSVMSUGWFBSQMF-JKSUJKDBSA-N 445.662 4.261 10 10 IICE COC[C@@H]1CCCN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)C1 1730559845 JWBUCMSXNJQHEY-QGZVFWFLSA-N 449.671 4.432 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1761051201 GYMLSUXEZOYYMN-NRFANRHFSA-N 436.579 4.390 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)[C@@H](C)C(=O)N4)c(C)s2)cc1 1859574029 JXKPPWDPPJXMEX-GFCCVEGCSA-N 443.550 4.374 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1cccc(Br)c1)C(=O)NCCCCN=[N+]=[N-] 1963732894 SQDQEMCUPLBBDG-HNNXBMFYSA-N 440.342 4.092 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@]2(CNCc2cc(Cl)cc(Br)c2O)C1 2031662756 MHPDQRTYMSPUIP-XIKOKIGWSA-N 431.758 4.155 10 10 IICE Cc1ccc([C@@H](C(C)C)n2nc(C(F)F)c(CO)c2I)c(O)c1 2079061958 HNRLJINTLCJOPL-CQSZACIVSA-N 436.240 4.177 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1cc(Br)cc(F)c1O)C2 2103433040 CJPHNMFTRRMRMM-QDMKHBRRSA-N 429.330 4.314 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@H]4C[C@@H](C3)N(Cc3ccccc3)C4)ccc(N)c2C1 2131205563 KJZVCLCPUPUZKO-SFTDATJTSA-N 448.611 4.273 10 10 IICE COc1ccc(N2C(=O)C(=Cc3ccccc3OCc3ccccc3)C(=O)NC2=S)cc1 2294259249 XHKXUIKHBVOPDK-UHFFFAOYSA-N 444.512 4.106 10 10 IICE CCc1nnc(NC(=O)CCCN2C(=O)C(=Cc3ccc(C)cc3)SC2=S)s1 2296882078 IBAQQIODESNDJO-UHFFFAOYSA-N 432.596 4.029 10 10 IICE CCCCC(CCCC)NC=C1C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O 2313466183 SKCALVCPKXMROU-UHFFFAOYSA-N 436.350 4.254 10 10 IICE O=C(O)CN1C(=O)C(=Cc2ccc3noc(-c4ccc(Cl)cc4)c3c2)SC1=S 2314593524 OKJBNIWFOGVMPG-UHFFFAOYSA-N 430.894 4.434 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)C[C@@H]21 2333002383 FHHSXHYOHXYJCL-TXKWRHDYSA-N 429.330 4.075 10 10 IICE Cc1ccc(CNC(=O)C(C)(C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2352635324 DTJFMNUMUHZLTI-UHFFFAOYSA-N 429.355 4.020 10 10 IICE Cc1ccc(CNC(=O)CN(C(=O)OC(C)(C)C)C2CCCC2)c(O)c1Br 2380745385 IUIRMNLGUQBHMI-UHFFFAOYSA-N 441.366 4.259 10 10 IICE COc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c(OC)c1 8608798 QJPOTJWKELWNSI-VWLOTQADSA-N 445.563 4.304 10 10 IICE COc1ccccc1CN/C(C)=C1/C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 19635854 OKNUBXCIONKMHP-HAVVHWLPSA-N 442.475 4.418 10 10 IICE CC1=NN2C(=N)/C(=C\c3cccc(OCCOc4cc(C)cc(C)c4)c3)C(=O)N=C2S1 27549483 HSWYAQOQJVNFFQ-UYEFZWAPSA-N 434.521 4.400 10 10 IICE COc1cc(OC)c([N+](=O)[O-])cc1/C=C1/C=C(c2ccc(Br)cc2)OC1=O 33410648 HZCZCLHOWIXPPV-QPEQYQDCSA-N 432.226 4.356 10 10 IICE CCCCN1C(=O)/C(=C2\SC(=S)N(CCCC(=O)OCCC)C2=O)c2ccccc21 40938968 DDBSWMLMQMBGJX-HNENSFHCSA-N 446.594 4.138 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(NC(=O)c3ccc(Cl)cc3)C2=O)ccc1OC 40940310 AKUGDHXIDRGTEF-BOPFTXTBSA-N 448.953 4.294 10 10 IICE CC(=O)N1c2ccccc2N(S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccc(N(C)C)cc1 59354189 PMVWVPRMMXDIRT-XMMPIXPASA-N 435.549 4.322 10 10 IICE Cc1cc(C(=O)Cn2cnc3ccc(Br)cc3c2=O)c(C)n1-c1ccccc1 196510497 UQZVSTSSABKMAO-UHFFFAOYSA-N 436.309 4.449 10 10 IICE CCCOc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OCC 206885538 CUCMUGPAXRCPQP-XMHGGMMESA-N 442.562 4.420 10 10 IICE Cc1ccc(C(=O)N(C)C)cc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435561447 URMRHKVSKXHMFD-UHFFFAOYSA-N 432.568 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cc(-c3ccccc3)no2)C1 443946113 QDUTUCCNBSXDNH-UHFFFAOYSA-N 428.536 4.379 10 10 IICE Cc1c(Cl)cc(F)c(NC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1F 761913980 AIXQIOWKAROODL-UHFFFAOYSA-N 427.854 4.349 10 10 IICE CN(c1ccc(CNC(=O)N2CCC[C@@H]([C@H](O)C(F)(F)F)C2)cc1)C1CCCCC1 764766190 GKILAWNXGOVSPJ-XLIONFOSSA-N 427.511 4.300 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCc2noc(Cc3ccccc3)n2)C1 769665138 PZQHQEHIHQDWCM-UHFFFAOYSA-N 444.535 4.125 10 10 IICE CCN1CC[C@H](NC(=O)N[C@H](C)c2cc(OC)ccc2O)[C@H]1c1ccc(Cl)c(F)c1 773808788 GQDYPCGOVVGHCT-YIILKADPSA-N 435.927 4.389 10 10 IICE CC1=C(c2ccco2)CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)CC1 801582992 HULDCCAWMQBGJH-UHFFFAOYSA-N 444.534 4.167 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(ccc(NC(=O)/C=C\c3ccc(O)c(O)c3)c2F)C1 803585869 RBKOUAFGRXLKFH-UITAMQMPSA-N 428.460 4.182 10 10 IICE CC[C@H](NCc1cccc(N2CCCS2(=O)=O)c1)c1cc(Cl)cc(Cl)c1O 806159304 FYEHEEALZRGYOU-SFHVURJKSA-N 429.369 4.480 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnn(-c4cccc(Cl)c4)c3)cc2F)C[C@@H](C)O1 917707826 BTGCLGFPPRCLHJ-IYBDPMFKSA-N 442.922 4.208 10 10 IICE COc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)c([N+](=O)[O-])cc1F 1125893832 XVMABTIJYKRULY-UHFFFAOYSA-N 429.370 4.013 10 10 IICE CCOc1ccc(-c2nc(CC(=O)N[C@H]3CCN(c4ccc(OC)cc4)C3)cs2)cc1 1130826558 COGXQVLLSOGXQL-SFHVURJKSA-N 437.565 4.155 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1 1152396197 VAYXAICBSXGNSH-RDPSFJRHSA-N 443.547 4.429 10 10 IICE COC(=O)[C@H]1C[C@@H]2C[C@H](NC(=O)c3cc(C)n(-c4ccc(Br)cc4)c3C)[C@@H]2C1 1157645163 IMRLSEAOTMAZQP-ITKAJJHTSA-N 445.357 4.174 10 10 IICE CN1CCCc2cc(CNc3ncnc4cc(I)sc34)ccc21 1162284307 AJUFUNMMWPEXBU-UHFFFAOYSA-N 436.322 4.290 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)Cc2ccccc2)c(C)n1-c1ccc(Br)cn1 1295272204 WNOFKDVJGIPBOK-HNNXBMFYSA-N 440.341 4.182 10 10 IICE CCOC(C)(C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1296447809 BOVUZGBBZWLDOL-UHFFFAOYSA-N 434.588 4.392 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC(C)(C)c3ccc(C(C)C)cc3)CC2)cc1 1300752621 MTCLPPMKEFBZAH-CCEZHUSRSA-N 449.595 4.075 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1ccccn1 1316021753 KOZUOPZEMUQUEU-UHFFFAOYSA-N 444.583 4.463 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(C(F)(F)F)cc1O 1442927751 YWNJEZDKQJQQKE-UHFFFAOYSA-N 430.373 4.411 10 10 IICE CC[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(F)cc1F 1459842327 HNHMBRYZNYZXDN-JOCHJYFZSA-N 434.442 4.420 10 10 IICE COC(=O)COc1ccc(N(C)C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1466809363 NVXLPRUJOUXRBX-UHFFFAOYSA-N 434.492 4.043 10 10 IICE COc1ccc(CNC(=O)N[C@@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)c(O)c1 1470371270 DOBNXSZFLSOVSY-FQEVSTJZSA-N 443.544 4.246 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(OCc4ccccc4)cc3)C2)cc1 1470772297 JIAMHYUHCDBGDH-QFIPXVFZSA-N 431.536 4.352 10 10 IICE CCCCN1CCCC[C@@H]1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1500541003 YXAPPDACOKYVLZ-HSZRJFAPSA-N 448.615 4.261 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC[C@@H](COC)C2)cc1 1501839034 NTYCRNMTKFAWDE-OAQYLSRUSA-N 436.604 4.041 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@H]1C 1512653750 TZTCARKOYMTSCL-KOSHJBKYSA-N 439.629 4.455 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CCC2=CCCCC2)CCOC1 1516140993 HDGAYHIXDAAEOY-DEOSSOPVSA-N 426.561 4.163 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N3CCN(C(C)(C)C)CC3)ccc21 1517413217 XFGZGDLZNQTHEQ-UHFFFAOYSA-N 438.664 4.218 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3sc(NC(=O)c4ccco4)cc3C)C2)cc1 1529709302 WPWROZLJHVQHNN-INIZCTEOSA-N 439.537 4.167 10 10 IICE CC(=O)Nc1ccccc1C(F)(F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1534011283 XQLFMXYXLQHWQS-UHFFFAOYSA-N 434.398 4.151 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1534309493 SRXSSSSEQOWCGU-CSKARUKUSA-N 449.526 4.329 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@@H]1CCOC2(CCCC2)C1 1544589702 CHIUXJQBIXONCZ-CLEQQJOVSA-N 448.585 4.025 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N[C@H](c1ccccc1)c1ccc(Br)cc1F 1544812684 VWMZCWXZYUKBNA-OAQYLSRUSA-N 430.273 4.448 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](CC)Cc1ccccc1Br 1557115333 SOKQTFPYRYIFSH-MRXNPFEDSA-N 448.357 4.315 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCSC[C@H]3c3ccc(Cl)cc3)cc2)CC1 1565271851 YMIYHQCLIWNAJH-QFIPXVFZSA-N 445.032 4.092 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCC(=O)OCc3ccc(Cl)cc3)c2C)cc1 1566805893 CCTWNHFVRGBZQC-UHFFFAOYSA-N 426.900 4.229 10 10 IICE O=C(CCc1cccc(OC2CCCC2)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1583378912 JWJYWFNUKKGFMX-UHFFFAOYSA-N 444.522 4.372 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)/C=C\c1ccc(I)o1 1584095979 RXQGLDMEFIVJMM-QQBNSCQMSA-N 438.309 4.019 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc(Br)cc(Br)c1O 1585787714 NYUREIBNXQHQKP-UHFFFAOYSA-N 442.151 4.222 10 10 IICE CC(=O)Nc1ccccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1587637637 UBCQYGLUXOODTM-PDGQHHTCSA-N 443.525 4.014 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCN(CC(F)(F)F)C1 1613169725 GZFPONHMOGSWGN-HOTGVXAUSA-N 425.499 4.018 10 10 IICE CCC(CC)(Cn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1613496900 GFTYHDLKOVVMLA-UHFFFAOYSA-N 447.599 4.156 10 10 IICE Cc1ccc(CCC2CCN(C(=O)CN[C@@H](C)c3ccc(N4CCOCC4)cc3)CC2)cc1 1616856074 ARQMWDFLTNPVKV-QHCPKHFHSA-N 449.639 4.354 10 10 IICE COCCCCn1c(CC2CCCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1619823791 JNLVDCSGKWXKPX-UHFFFAOYSA-N 441.620 4.163 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)c1cc(-n3c(C)ccc3C)ccc1Cl)C[C@H]2O 1624208442 KGGIHIWYVRJXHY-HXUWFJFHSA-N 440.927 4.454 10 10 IICE C[C@@H](NC(=O)Cc1c[nH]c2ccc(Br)cc12)c1ccc(N2CCOCC2)cc1 1626978295 MAQDGVKWZVOJKT-OAHLLOKOSA-N 442.357 4.187 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2cccc(F)c2)c(C)n1-c1ccccc1Br 1628609985 JWGODKQVOGFYPP-GOSISDBHSA-N 445.332 4.329 10 10 IICE CCCN(CC)c1ccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cn1 1630551066 YXQMKLYQKDJAAS-QZTJIDSGSA-N 428.552 4.001 10 10 IICE Cc1cc(C(=O)N2CCN(C3CCN(C(C)C)CC3)CC2)c(C)n1-c1cccc(Cl)c1 1630947929 GNTYMEYTKPLJFU-UHFFFAOYSA-N 443.035 4.378 10 10 IICE Cc1cc(C(=O)N2CCC(C)(C)NC(C)(C)C2)c(C)n1-c1ccc(Br)cn1 1648914876 QHJFXPRWOMHHOO-UHFFFAOYSA-N 433.394 4.244 10 10 IICE COc1ccc(N2CCN(CCNc3ccc(-c4ccc(Cl)s4)nn3)CC2)cc1 1651443540 APBMEJIQHHACJB-UHFFFAOYSA-N 429.977 4.101 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCN([C@H](C)CC)CC2)sc(C)c1-c1ccccc1 1654461745 XDBSYKKOABLDEP-QGZVFWFLSA-N 443.613 4.255 10 10 IICE Cc1cc(C(=O)COc2ccccc2S(N)(=O)=O)c(C)n1-c1ccc(C(C)(C)C)cc1 1656365960 ZYAOONYCTDQAKP-UHFFFAOYSA-N 440.565 4.301 10 10 IICE C[C@@H](NCC(=O)NCC1(c2ccccc2)CCCCC1)c1ccc(N2CCOCC2)cc1 1658065983 AAKADAMUZFLSTI-JOCHJYFZSA-N 435.612 4.192 10 10 IICE CCN(C)c1ccc(CN2CCC([C@H]3OCCC[C@@H]3NC(=O)OC(C)(C)C)CC2)cc1 1658889619 MZUNTTUQAPHTGC-XZOQPEGZSA-N 431.621 4.427 10 10 IICE CCOC(=O)C1=C(CN(C)c2ccc(OCC)cc2)NC(=O)N[C@@H]1c1ccc(Cl)cc1 1660054202 AHGFTAIJIBQTFE-OAQYLSRUSA-N 443.931 4.046 10 10 IICE CC(C)[C@@H]1OCCC[C@H]1Cn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1706361956 MBGFZHFQDFRNEC-URXFXBBRSA-N 435.572 4.057 10 10 IICE CCOC(C)(C)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1710391725 RVMUHFURBPITQU-UHFFFAOYSA-N 427.593 4.086 10 10 IICE CCN(CC1CCC1)c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1728465463 BGEFOZQQMINHJL-UHFFFAOYSA-N 439.583 4.020 10 10 IICE Cn1cc(C2CCN(c3nnc(C(C)(C)C)n3CCCSc3nccs3)CC2)cn1 1729573726 DXTADSKNYLDVQA-UHFFFAOYSA-N 445.662 4.332 10 10 IICE Cc1noc(C)c1CN(C)c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1742879247 FRXXWAYAULBDLI-INIZCTEOSA-N 448.618 4.052 10 10 IICE CCCC1(Cn2c(CNC(=O)c3cccs3)nnc2N(C)Cc2ccccc2O)CC1 1745317284 WRIYGDILPJKVEF-UHFFFAOYSA-N 439.585 4.192 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@H](OC)C(C)(C)C2)cc1 1746089792 HLKGEMIWVKJSEX-QFIPXVFZSA-N 434.588 4.096 10 10 IICE Cc1ccc(CN(C)c2nnc(Cc3cccnc3)n2Cc2ccc(N(C)C)c(F)c2)o1 1751509970 IAESKWAUSUHTKQ-UHFFFAOYSA-N 434.519 4.055 10 10 IICE CSCCCN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc2c(c1)CCCN2C 1770588300 XPBIDAGPHIIGGW-UHFFFAOYSA-N 436.629 4.269 10 10 IICE Cc1nnc(N2CCO[C@H](CCc3ccccc3)C2)n1CCCSc1nccs1 1772848483 BNUCLQGBIYQZOH-LJQANCHMSA-N 429.615 4.063 10 10 IICE CCCc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1-c1ccccn1 1862321935 ICFJSSLAYOJOBO-UHFFFAOYSA-N 436.471 4.248 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])N2CCCCC2)cc1 1865972420 WRJAYGRMKBNCCD-OAQYLSRUSA-N 430.936 4.271 10 10 IICE CC(C)(C)OC(=O)NC1(C[C@H](N)c2ccccc2O)CCN(Cc2ccccc2)CC1 1942393369 PPEYEEYNRRLMIU-NRFANRHFSA-N 425.573 4.342 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]2(CNCc2cc(Cl)cc(Br)c2O)C1 2031662753 MHPDQRTYMSPUIP-KPZWWZAWSA-N 431.758 4.155 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@@H](NCc1ccc(Br)cc1O)C2 2232283480 VYKHRTFLUYPQQU-STECZYCISA-N 425.367 4.326 10 10 IICE CC1=NN2C(=N)C(=Cc3ccc(OCCOc4cc(C)ccc4C)cc3)C(=O)N=C2S1 2293175759 DVYWBTZKBKBNRQ-UHFFFAOYSA-N 434.521 4.400 10 10 IICE O=C1/C(=C\c2ccc(O)cc2)C(=O)N(c2cccc([N+](=O)[O-])c2)C(=S)N1c1ccccc1 15223583 CTHBFHUXUCOKKX-DEDYPNTBSA-N 445.456 4.049 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)ccc1OCCC(=O)O 16919805 CJXGECXMPBMGFF-CPNJWEJPSA-N 443.546 4.340 10 10 IICE COc1cccc(C(=O)Oc2ccc(/C=C3/C(=N)N4OC(C)=CC4=NC3=O)cc2Cl)c1 20236721 WPHJPIWKQQGFNJ-LEJACGOASA-N 437.839 4.018 10 10 IICE C[C@@H](C(=O)NCc1ccc(N(C)C)cc1)C1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 35561955 ZVOQIRRCYORLHY-GOSISDBHSA-N 432.568 4.039 10 10 IICE COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C/c1ccc(Br)cc1 59566340 WACCQTDADAICJE-WOJGMQOQSA-N 428.282 4.335 10 10 IICE Cc1ccc(C(=O)N2CCc3sc(C(=O)NCc4ccc(N(C)C)cc4)cc3C2)cc1 65201415 VTMLNUHMISZFEC-UHFFFAOYSA-N 433.577 4.251 10 10 IICE CCOc1ccc(/C=C\C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 213810961 UATJYPTURFIHBN-YHYXMXQVSA-N 434.458 4.270 10 10 IICE COc1cc(N(C)CC(=O)N[C@H](Cc2ccccc2)c2ccccc2)cc(OC)c1OC 303843845 CDEHKRUGPUJDME-JOCHJYFZSA-N 434.536 4.249 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](CNCc2cc(Br)ccc2O)C1 717030498 CFGSTKGHRLGIFC-CYBMUJFWSA-N 435.309 4.137 10 10 IICE Cc1cccc(C(C)C)c1NC(=O)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726725609 CRZXRQGPOZMGNJ-UHFFFAOYSA-N 445.510 4.444 10 10 IICE CC(=O)c1cc(CN2CCOCC2)c(O)c(CN2CC[C@H](c3ccc(Cl)cc3)C2)c1 732187215 PRKXLFUPGUWSMV-IBGZPJMESA-N 428.960 4.070 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cnc4ccsc4c3)n2)cc1OC 752189999 FPAOEGPGMSXWMY-UHFFFAOYSA-N 433.536 4.238 10 10 IICE C[C@@H]1CN(c2ccc(CN[C@H](C)c3ccc(N4CCOCC4)cc3Cl)cn2)C[C@@H](C)O1 764945577 IVPHLIQTOTZZBB-GUDVDZBRSA-N 445.007 4.036 10 10 IICE Fc1cccc(F)c1-c1n[nH]cc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768669860 IWGCWAXSWLISMN-UHFFFAOYSA-N 437.538 4.177 10 10 IICE CCOc1cccc(CCNC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 771240759 QOCXBFHFZPPKIK-UHFFFAOYSA-N 433.499 4.197 10 10 IICE COCCN(C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@H]1C[C@H]2CC[C@H]1C2 774831181 DGFGNWNKZIIOML-FIKGOQFSSA-N 437.531 4.103 10 10 IICE Cc1nc(NC(=O)OC(C)(C)C)sc1C(=O)NCc1cc(Br)ccc1O 804737111 IKDZNIPALLBVPJ-UHFFFAOYSA-N 442.335 4.197 10 10 IICE COc1cc(Br)cc(CN2CCC[C@@H](c3n[nH]c(-c4ccccc4)n3)C2)c1O 809753170 ZMNSOCSFNGISDP-OAHLLOKOSA-N 443.345 4.328 10 10 IICE Cc1ccc(Sc2ccc(/C=C3/C(=O)NC(=O)N(c4ccc5c(c4)OCO5)C3=O)o2)cc1 1084537482 NBCNIKIHTZLBHZ-BOPFTXTBSA-N 448.456 4.134 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)C2)cc1 1130186029 ZBGDZINIHHSWMY-GOSISDBHSA-N 439.556 4.323 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)CCSc3ccc(Br)cc3)C2)cc1 1130826823 KLLLVCLDDOKKCT-MRXNPFEDSA-N 435.387 4.335 10 10 IICE C[C@@H]1CCC(F)(F)CN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1135067273 PIZQRZUVQKSJBL-DYTQJMLRSA-N 428.501 4.063 10 10 IICE COCCOc1ccccc1N1CCN(C(=O)c2cc(C)ccc2-n2c(C)ccc2C)CC1 1149481727 DMTXDBYKHRPHIB-UHFFFAOYSA-N 447.579 4.390 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CC[C@@](C(N)=O)(c3ccccc3)C2)cc1 1161868213 AHXAJSMJKYALAA-SANMLTNESA-N 441.535 4.437 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@]2(CCN(C(=O)OC(C)(C)C)C2)CO1 1190436683 HEFSEUQKNACFTL-DHLKQENFSA-N 431.621 4.379 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)c(F)c1 1192880860 KBCAEAOWRZVADU-PNCHPQGNSA-N 445.554 4.244 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccsc2)cc1F 1298055568 FJCUVEKLHURDEV-SFHVURJKSA-N 429.565 4.123 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CCSC3)CC2)cc1 1315516102 YROXEHJFEGXMQM-GOSISDBHSA-N 429.634 4.054 10 10 IICE COCCN(Cc1ccco1)c1nnc(C2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1316097384 HXHVBNUMMORROW-UHFFFAOYSA-N 441.551 4.435 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1353182224 HKYZPSBFDDNITJ-UHFFFAOYSA-N 439.581 4.306 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCC2(F)F)C2CC2)cc1 1353229846 VOQJXAQQYYPVPD-LJQANCHMSA-N 437.531 4.136 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(F)c3OC(F)(F)F)cc2F)C[C@@H](C)O1 1354659620 XAAZAXYHFJUZQN-CHWSQXEVSA-N 444.400 4.407 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(OC(F)F)cc1F 1355708927 WQKZCTHVXRNOKO-UHFFFAOYSA-N 448.363 4.213 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCOC[C@H](C2CCC2)C1 1361097575 DHXYPADMRFJSBE-JOCHJYFZSA-N 425.621 4.152 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1c(C)noc1C 1361097861 JOVIVNPDHWIFKD-QFIPXVFZSA-N 438.576 4.184 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCc3ncn(C)c3Br)c2C)c1 1456432451 ZZXVVVJURJQFLC-UHFFFAOYSA-N 429.362 4.179 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl 1463056944 RQWTYEOUVGVTOE-WOJBJXKFSA-N 447.963 4.112 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Cl)c(Br)cc2F)N(C)C)cc1 1463284164 QWMSQNMYDYNSCN-SFHVURJKSA-N 442.760 4.340 10 10 IICE Cc1ccc(C(=O)Nc2ccc(F)cc2CS(C)(=O)=O)cc1-n1c(C)cc(C=O)c1C 1465835646 CGZBRXGFFFSLOE-UHFFFAOYSA-N 442.512 4.151 10 10 IICE Cc1cc(C(=O)NCCN2CCCC(C)(C)C2)c(C)n1-c1ccc(Br)cn1 1467537492 GBEXKLWHVZLLQT-UHFFFAOYSA-N 433.394 4.103 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H]2CC[C@H](NC(=O)OC(C)(C)C)CC2)c1 1470691191 XIHDAXBEAURMKP-MEMLXQNLSA-N 439.556 4.472 10 10 IICE Cc1ccc(C(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1-n1c(C)cc(C=O)c1C 1471140504 ZJZHBDKBVRJINE-UHFFFAOYSA-N 437.490 4.456 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC[C@]3(Cc4ccccc4)C=CCCC3)cc2)CC1 1479104262 GZIFMIVDRLHGRR-HHHXNRCGSA-N 432.612 4.207 10 10 IICE CCCCN(CC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1500438345 LFOIOZOIFPVXFA-QFIPXVFZSA-N 445.583 4.170 10 10 IICE Cc1csc([C@H](C)Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)n1 1511449031 RZDREABGJFVFCL-DNVCBOLYSA-N 427.574 4.430 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1511989850 SMLCNIYPHXXNQS-WOJBJXKFSA-N 439.648 4.315 10 10 IICE CCc1nnc(N2CC[C@@H](CN(CC)CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1513853087 LFFIOGQJNGFWSV-QHCPKHFHSA-N 438.664 4.293 10 10 IICE C[C@@H](NC(=O)C(F)(F)c1ccccc1Br)c1ccc(N2CCOCC2)cc1 1528554960 PZRKZEDKOKMSSN-CQSZACIVSA-N 439.300 4.255 10 10 IICE CN1CCN(c2ccc(CNC(=O)COc3ccc(-c4ccccc4)cc3Cl)cc2)CC1 1533684707 SRZGJTFQQGWOBM-UHFFFAOYSA-N 449.982 4.454 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1 1538151976 ANUCBKOAAZNGNW-OAQYLSRUSA-N 432.612 4.045 10 10 IICE CC(C)(C)OC(=O)c1ccc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc1 1539582259 PRIVALAUKFTDDH-INIZCTEOSA-N 447.482 4.037 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3c(C)cc(C)c(Br)c3C)CC2)cc1 1544745208 NDTJVVODCGKZOA-UHFFFAOYSA-N 431.374 4.274 10 10 IICE CC[C@@H](C)c1nnc(N2CCCO[C@H](C)C2)n1Cc1ccc(N2CCSCC2)cc1 1545509615 LBTMJTKQVGVRLR-RTBURBONSA-N 429.634 4.008 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3CCOC3CCCCCC3)CC2)cc1 1554959575 PKYZPFRUJFZLIX-UHFFFAOYSA-N 427.593 4.051 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)c1ccc(=O)n(CCOc2ccccc2Cl)c1 1558554089 JDEPDUJBOHBGML-UHFFFAOYSA-N 448.906 4.370 10 10 IICE CN(Cc1cscc1Br)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1565452363 ASYAXTPMEZHTKX-SFHVURJKSA-N 439.423 4.021 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)CCc2cccc(OC(C)(C)C)n2)cc1 1583918282 HJYFKTNLLIZXRA-HSZRJFAPSA-N 439.600 4.465 10 10 IICE Cc1ccc(C(=O)N2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c(O)c1O 1587496917 SLOPRFBLXWXYEA-UHFFFAOYSA-N 438.474 4.232 10 10 IICE Cc1cc(CNC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1587886816 VSHOKXXRDVALFR-QFIPXVFZSA-N 431.536 4.369 10 10 IICE COC(=O)c1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)s1 1588098501 CRBULPNNSNDVBM-UHFFFAOYSA-N 434.315 4.352 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1 1588187601 UHDHHJROODAQDQ-UHFFFAOYSA-N 443.547 4.326 10 10 IICE CC(=O)Nc1cccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1618299064 CJDFPXHEMHVOGI-UHFFFAOYSA-N 427.302 4.462 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)N(C)C)cc1 1618643059 JIMLURCBGJAESA-UFYCRDLUSA-N 435.490 4.174 10 10 IICE CN1CCCc2cc(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c3c(F)cccc3F)ccc21 1626940738 NSDJJZHZZOAOPJ-OAQYLSRUSA-N 445.510 4.229 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@H](CO)C2CC2)c(C)n1-c1cccc(Br)c1 1628157143 STZDBQNVBUXYGH-NHCUHLMSSA-N 431.374 4.384 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c(C)n1-c1ccc(Br)cc1 1631252490 NCIJTUAULGLMRJ-DYESRHJHSA-N 430.390 4.413 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cccc(CN4CCOCC4)c3)cc2Cl)C1 1635127377 XDASCTFCGXZISL-LJQANCHMSA-N 442.003 4.339 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(C)c(NC(=O)NC(C)(C)C)c3)C2)cc1 1638644779 BBBLYOQOKLJREB-GOSISDBHSA-N 438.572 4.180 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F 1639341617 WVNPISSHGGFOLB-WMZHIEFXSA-N 429.555 4.266 10 10 IICE CC(C)NC(=O)c1ccccc1NC(=O)CN(C)c1ccc(OCc2ccccc2)cc1 1642741721 XMUKIXYAJGUCEU-UHFFFAOYSA-N 431.536 4.479 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@H](C)C(=O)Nc1ccc(-c2cnc[nH]2)cc1 1644710538 NVXKWPGXQVVQGM-CQSZACIVSA-N 443.345 4.394 10 10 IICE COc1ccc(N(CCOc2ccc(S(C)(=O)=O)cc2)Cc2ccccc2)cc1OC 1648668041 JOZXILHIBGSIQH-UHFFFAOYSA-N 441.549 4.193 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 1683253590 IUOJCNDCBOIENS-VGOFRKELSA-N 447.526 4.377 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1694959569 YUTIKQKKMVFTRN-QFIPXVFZSA-N 434.588 4.158 10 10 IICE CCC[C@@H](C)CN(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1709475078 BOVHUOVRHZMIEB-TZIWHRDSSA-N 443.661 4.256 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCC[C@H](C(F)F)C2)cc1 1710026327 DISTWABMHLOANR-RBUKOAKNSA-N 433.547 4.158 10 10 IICE CN(C)c1ccc(Cn2c(N3CCc4ccc(Cl)nc4C3)nnc2C(C)(C)C)cc1F 1711005638 FAKXZBJFXTZFCR-UHFFFAOYSA-N 442.970 4.440 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)CC2CCOCC2)cc1 1728384466 UKICAPIHEIOKOE-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CN(CCCCCO)c1nnc(C2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1729516781 LLQKIQPLLKRONG-UHFFFAOYSA-N 443.661 4.136 10 10 IICE CC(C)NC(=O)c1nnc(N(C)[C@H]2CCC[C@@H](C)C2)n1CCCSc1nccs1 1743021873 MGVAVKFOEYITFQ-CVEARBPZSA-N 436.651 4.070 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC(OCC4CC4)CC3)nnc2C(C)(C)C)cc1F 1768496629 OTRAEFWOHVFDBP-UHFFFAOYSA-N 429.584 4.224 10 10 IICE CCCN(C)c1nnc(-c2nnc(O)c3ccccc23)n1CCCSc1nccs1 1772871257 MZUGZJPAAUTEPF-UHFFFAOYSA-N 441.586 4.079 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCCCOC(C)C)C(=O)N(CC(C)C)C2=O)cc1 1873165497 LLHOYNUDYZMXPR-UHFFFAOYSA-N 437.584 4.235 10 10 IICE CN1CCCc2cc([C@@H](N)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999536839 POLFJUGGVPLYBW-FYYLOGMGSA-N 425.573 4.179 10 10 IICE C[C@H](c1ccccc1O)N(C)C(=O)C[C@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2060156131 CVELSKQIHZRWGZ-UYAOXDASSA-N 442.556 4.412 10 10 IICE COC(=O)c1c(C(F)(F)F)nn([C@@H](c2ccc(OC)cc2O)C2CC2)c1Br 2079853527 FIKPAPCVWNVRCD-CYBMUJFWSA-N 449.223 4.165 10 10 IICE CC[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCc1cc(Br)cc(F)c1O 2107376163 CTCAWJLJENADGW-WBMJQRKESA-N 431.346 4.419 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CC[C@@H](C1)[C@@H](NCc1cccc(Br)c1O)C2 2226145383 WLDXECUAWLHECW-QRTARXTBSA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CNc2cccc(I)c2)c1O 2227749344 SYZMGEWQHJSRKA-UHFFFAOYSA-N 434.071 4.380 10 10 IICE O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)C1=Cc1cccn1-c1ccc(F)cc1 2294216510 RNZDGABZLXWWHG-UHFFFAOYSA-N 425.872 4.101 10 10 IICE O=C1C(=Cc2cc3cc4c(cc3nc2O)OCCO4)SC(=S)N1c1cccc(F)c1 2296595944 ZRVPWRXGCNSVHF-UHFFFAOYSA-N 440.477 4.257 10 10 IICE Cc1ccc(C2=NC(=Cc3ccc(N(C)C)cc3)C(=O)O2)cc1I 2297459210 KLMWEVZGIKFYFH-UHFFFAOYSA-N 432.261 4.010 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=C(C)NCc2cccs2)cc1 2313682925 NXVDMVFJPHQGQH-UHFFFAOYSA-N 448.504 4.480 10 10 IICE CCOC(=O)CCCCCN1C(=O)C(=Cc2ccc(OC)c(OCC)c2)SC1=S 2314755011 NCUDEBQWZZKRSQ-UHFFFAOYSA-N 437.583 4.419 10 10 IICE COc1cc(C=C2C(=O)N(Cc3cccc(F)c3)N=C2C(F)(F)F)cc(OC)c1OC 2332114950 HGFJPVLLUQXUDT-UHFFFAOYSA-N 438.377 4.196 10 10 IICE COc1cc(C=C2C(=O)N(Cc3ccc(F)cc3)N=C2c2ccccc2)cc(OC)c1O 2332147682 RCCFQMUZLVLUPU-UHFFFAOYSA-N 432.451 4.379 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)SC1=S 40374678 SOBREBGSORRNOP-LFIBNONCSA-N 432.479 4.009 10 10 IICE CCN(CC)c1ccc(C=c2sc3nc(-c4cccc5ccccc45)nn3c2=O)cc1 254834823 LKTVLPWSWKEIJK-UHFFFAOYSA-N 426.545 4.365 10 10 IICE Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC(CNC(=O)OC(C)(C)C)CNC(=O)OC(C)(C)C 389237368 WRGNDMBIFXSAOK-WBVHZDCISA-N 449.592 4.257 10 10 IICE COc1cccc([C@H]2CN(C(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)CCO2)c1 444273296 MTUXHIDROFCMFW-AREMUKBSSA-N 447.579 4.017 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@H]([C@H]2CCCN2C(=O)OC(C)(C)C)C1 734687107 IEIHYGDUVKYWHY-RBBKRZOGSA-N 444.620 4.382 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C(C)C)nc4c3cnn4C(C)C)CC2)cc1F 753739688 UVRNQRAWFUPGRP-UHFFFAOYSA-N 439.535 4.246 10 10 IICE C[C@@H](CCCC(F)(F)F)NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 755313540 RXLJJNPCEDAWKI-KRWDZBQOSA-N 426.527 4.139 10 10 IICE CCOc1ccc(-c2csc(NS(=O)(=O)c3ccccc3Cn3ccnc3)n2)cc1 759486185 ZSEAIWWNALUTMI-UHFFFAOYSA-N 440.550 4.254 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3ccccc3NC(=O)c3ccccc3)c2)CC1 771637688 SYDDVQKBHCOVSN-UHFFFAOYSA-N 428.536 4.333 10 10 IICE O=C(NCCCSc1nccs1)N[C@H]1CCOc2c(Br)cccc21 800710900 BKBWNXOWFJXWPW-ZDUSSCGKSA-N 428.377 4.211 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2coc(C3CCCC3)n2)NC(=O)OC(C)(C)C)cc1 802553051 XHNVVHFTJUZGHY-LJQANCHMSA-N 442.560 4.394 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCOC3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802682730 OLCZDXBWJNLNCZ-GGAORHGYSA-N 449.599 4.394 10 10 IICE Oc1ccc2c(n1)CCC[C@H]2NCc1cc(Br)cc(Br)c1O 809729450 SUHJJRLKRFYZQE-CYBMUJFWSA-N 428.124 4.185 10 10 IICE Cc1cc(C(=O)COC(=O)[C@H]2CCCN(C(=O)C(C)(C)C)C2)c(C)n1-c1ccc(F)cc1 920721557 XWWHGKZTKIXVSR-SFHVURJKSA-N 442.531 4.244 10 10 IICE COc1ccc(N2CCN(CCCNc3nc(C(F)F)nc4ccc(F)cc34)CC2)cc1 1156263129 NTSADRORRPNRJU-UHFFFAOYSA-N 445.489 4.339 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1ccc(OC)cc1 1159345634 OKEPKLXQGFEIFF-OAQYLSRUSA-N 426.900 4.400 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC[C@H]3CCN(c4ccccc4Cl)C3)C2)cc1 1230300647 HRDMBQVYQJKXEI-RTBURBONSA-N 442.991 4.001 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cn(-c2cccc(C(F)(F)F)c2)nn1 1276283597 JJRIFLBPFMOYKW-HNNXBMFYSA-N 431.462 4.022 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCCN(C(C)C)CC2)cc1 1295414700 KDIHCNVQQKNCAI-UHFFFAOYSA-N 435.620 4.088 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O 1295594409 JUPRNRXSLDVRNR-QZTJIDSGSA-N 428.488 4.167 10 10 IICE CCc1nnc(N2C[C@H](c3ccsc3)O[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1306109599 GIIDRSFOUFCXMZ-FOIQADDNSA-N 429.565 4.122 10 10 IICE CCO[C@]1(c2nnc(N3CCC[C@H]3CC)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1314128319 JPNHUQYCKFVBQT-PXDATVDWSA-N 441.620 4.204 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)(C)C 1316261791 CMNKDXMLJZXOGT-UHFFFAOYSA-N 439.604 4.498 10 10 IICE COc1cc2oc(=O)cc(C)c2cc1CCC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1349948286 AVZJEBNZCWRPIT-UHFFFAOYSA-N 434.536 4.300 10 10 IICE CCc1ccccc1CNC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1360913886 LSNQIQKYPXLXQN-CPNJWEJPSA-N 428.554 4.296 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccncc1Cl 1439875390 SMIBHUJPHATHNT-UHFFFAOYSA-N 428.677 4.460 10 10 IICE O=C(Cc1cccnc1)Nc1ccc(C(=O)NCc2cc(Cl)cc(Cl)c2O)cc1 1450722014 PCJQTDOBXSUNIR-UHFFFAOYSA-N 430.291 4.205 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccnc2c1CCN2C(=O)OC(C)(C)C 1451666531 JPEPCJDAPLPSSY-KRWDZBQOSA-N 438.572 4.115 10 10 IICE CC/C(=C/C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OC)cc1 1458015197 CXYNCPGJYHFCJK-NKFKGCMQSA-N 433.596 4.337 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CSc3ccc(Br)cc3)C2)cc1 1461076106 HDQLQNQIWMTKFM-HNNXBMFYSA-N 435.387 4.193 10 10 IICE CC(C)(C)c1ccc([C@@H](O)CCC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1468817128 ZLVZDWINXHIBSD-QFIPXVFZSA-N 446.538 4.229 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](Cc3nccs3)C2)c(C)n1-c1ccc(Br)cn1 1472315351 YADMEMYQKZHXJK-HNNXBMFYSA-N 445.386 4.413 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4F)C3=O)c2C)cc1C 1472984700 PQUQDVHBKACXMC-AREMUKBSSA-N 447.510 4.500 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2c(O)ccc3c2CCCC3)C(C)(C)C1 1479075458 LOUOMCRIEQIWQQ-HXUWFJFHSA-N 431.577 4.106 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCC[C@H]2c2cnn(C)c2)cc1F 1503393292 IVUDDMAQMZQVNM-FQEVSTJZSA-N 439.583 4.195 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3cccc(-c4nnnn4C(C)C)c3)ccc21 1534125204 YBRYOYPEDKAIIK-UHFFFAOYSA-N 432.528 4.391 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1F 1540539920 HDBWBGVGWAGPTI-UHFFFAOYSA-N 432.293 4.329 10 10 IICE O=C(CCC(=O)c1ccc(Cl)cc1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632747 UTQBQQXVXXZRII-IBGZPJMESA-N 435.351 4.443 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(C(=O)c3ccc(O)cc3)CC2)cc1 1588172995 JNDYVAKOBCLZID-UHFFFAOYSA-N 444.531 4.276 10 10 IICE COc1ccc(N(C)CC(=O)Nc2ccc(I)cc2C)cc1Cl 1616056372 QMTIGWNACBFSGF-UHFFFAOYSA-N 444.700 4.337 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(C(F)(F)F)cc2N2CCCC2)N(C)C)cc1 1616858906 UWUBMMPVGFNPCS-JOCHJYFZSA-N 448.533 4.404 10 10 IICE O=C(NCc1cc(Cl)ccc1O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 1628667134 PEHFHAFRZVVBBG-UHFFFAOYSA-N 428.876 4.424 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cc1cccc(NS(C)(=O)=O)c1 1632696891 AEWRHBLIHNUIIP-GOSISDBHSA-N 438.549 4.096 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(C)[C@@H]3c3cccc(Cl)c3)cc2)CC1 1633110906 LJWJXIRLRPKYPA-LADGPHEKSA-N 439.987 4.412 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)c2ccc(F)cc2Cl)CCCC1 1641678081 DMVZHOJRVUWZNW-UHFFFAOYSA-N 428.891 4.320 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1642611270 KNVXXBZWIKEEIL-ROKPMTFOSA-N 439.575 4.283 10 10 IICE CN(C)c1ncnc(Cl)c1CN1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 1657293617 NPJUHAOONPWHFH-UHFFFAOYSA-N 431.968 4.174 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)OCc2ccccc2)c1O 1658628106 YFHOOXSPGMTOAY-KLDKWKSESA-N 427.928 4.496 10 10 IICE C[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CC(C)(C)O1 1693814051 YYSKVWDLYFLJJS-CVEARBPZSA-N 437.635 4.162 10 10 IICE CN(C[C@@H]1CCCOC1)c1nnc(-c2ccccc2)n1CCCSc1nccs1 1711153695 VQYRKCUULMFZGY-KRWDZBQOSA-N 429.615 4.447 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CC=C(C(F)(F)F)CC1 1724235311 JIRGVCVWIMQXSZ-UHFFFAOYSA-N 444.505 4.405 10 10 IICE Cc1ccc(CN(C)c2nnc(-c3cnn(C)c3)n2Cc2ccc(N(C)C)cc2C)s1 1761773762 WEAPGMCWZCQBHE-UHFFFAOYSA-N 435.601 4.108 10 10 IICE CC[C@H](C)N(C)CCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1763902192 FDQMXEIIEKAFHN-FQEVSTJZSA-N 440.636 4.001 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1 1766529239 QDYPTBDKZBXQTJ-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)CCc2cccs2)cc1 1766613665 ITEXEJNPIWUZGV-HXUWFJFHSA-N 439.629 4.417 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CCCN(C)C(C)C)CC2)cc1 1768705104 VNLZKSBNNZMMJQ-UHFFFAOYSA-N 440.636 4.001 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(OC)C1CC1 1771066085 LLYGJOCHOTYIJO-VWLOTQADSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](NC(=O)[C@H](C)C3CCCC3)c3ccccc3)CC2)cc1 1868891446 UJSFSJADNYVSHJ-CJFMBICVSA-N 449.595 4.028 10 10 IICE CCN1C(=O)C(=C2SC(N3CCC(Cc4ccccc4)CC3)=NC2=O)c2ccccc21 2053497067 VBIQQIFNSKPYNX-UHFFFAOYSA-N 431.561 4.348 10 10 IICE COc1ccc(Br)c(CNC[C@H]2CCCCN2C(=O)OC(C)(C)C)c1O 2227747879 GTISOMUYMSCSMO-CYBMUJFWSA-N 429.355 4.043 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1cccc(C(=O)O)c1 2295923782 XOURRFJGUCGWGM-UHFFFAOYSA-N 446.937 4.268 10 10 IICE CCOc1cc(C=C2C(=N)N3N=C(Cc4ccc(Cl)cc4)SC3=NC2=O)ccc1O 2296145261 ZJQMVGPTTUBDLL-UHFFFAOYSA-N 440.912 4.306 10 10 IICE CCOc1ccc(C=C2SC(N3CCN(c4ccccc4F)CC3)=NC2=O)cc1OC 2296673549 MEQUTMWCGHUUBE-UHFFFAOYSA-N 441.528 4.026 10 10 IICE CC(C)c1ccc(N2C(=O)C(=Cc3cc4c5c(c3)CCCN5CCC4)C(=O)NC2=S)cc1 2296943276 YPXJMQPHNDETAU-UHFFFAOYSA-N 445.588 4.340 10 10 IICE C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)C(=CC=Cc2ccccc2)SC1=S 2314837626 UZXSDVFZPWHSEK-AWEZNQCLSA-N 439.518 4.379 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14471399 MGYCDGRZADLPHE-ZOCZFRKYSA-N 427.888 4.451 10 10 IICE O=C(NN1C(=O)/C(=C\C2=Cc3ccccc3OC2)SC1=S)c1ccc(Cl)cc1 103040638 YPPLXSSCYGNEOO-LICLKQGHSA-N 428.922 4.205 10 10 IICE CCCN1C(=O)/C(=C/c2c(Oc3ccccc3C)nc3ccccn3c2=O)SC1=S 213174664 QDIXGQWWRKUDPX-LGMDPLHJSA-N 437.546 4.406 10 10 IICE CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 746425554 WBVZMXAIXJTJAC-AREMUKBSSA-N 429.564 4.289 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@@H]([C@@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1 749705988 LOAZBJQFADQUOK-CTNGQTDRSA-N 430.593 4.074 10 10 IICE COC[C@H](NC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1 752957790 KTFCIERGJYONOG-FQEVSTJZSA-N 437.462 4.083 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 753102585 GHADIBRGLJUUAE-NRFANRHFSA-N 430.556 4.161 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CCC(c2ccccn2)CC1 754098467 CSHVKDPIPSZWJW-UHFFFAOYSA-N 448.489 4.026 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C 764545995 CSQHYQUKZVOMPY-WIYYLYMNSA-N 432.609 4.318 10 10 IICE CSc1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)ccn1 766752512 ZXBPQXGBQRLIMW-KAMYIIQDSA-N 435.621 4.485 10 10 IICE COc1cc(OC)c(S(=O)(=O)Nc2nc(-c3cc4ccccc4o3)cs2)c(OC)c1 777667726 PLGQFUMGIREZFL-UHFFFAOYSA-N 446.506 4.383 10 10 IICE O=C(NCc1ccc(N2CC=CC2)cc1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1 781809003 RBHBZICXCYLWOA-NRFANRHFSA-N 431.458 4.365 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NC3CCN(C(=O)c4cc(Cl)c[nH]4)CC3)c2C)c1 804646784 PUTLUJQUJOOPRK-UHFFFAOYSA-N 438.959 4.419 10 10 IICE Cc1sc2ncnc(SCC(=O)NCc3cc(Br)ccc3O)c2c1C 804737082 DOCAGIFGOLKQRP-UHFFFAOYSA-N 438.372 4.185 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc(OC(F)F)c(Br)c1 1126440006 GJEWPTBENUGNMJ-UHFFFAOYSA-N 427.245 4.156 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3CCCCCC[C@@H]3NC(=O)OC(C)(C)C)CC2)cc1 1127275895 NMMIJXSJXPLKDO-YADHBBJMSA-N 445.604 4.208 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)C1(c2cc(F)cc(F)c2)CCCC1 1129549774 UXTNFVMUHPNJHM-UHFFFAOYSA-N 436.449 4.208 10 10 IICE O=C(COc1ccsc1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1134542213 MJLBSSIWFQVRGV-UHFFFAOYSA-N 429.299 4.238 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N=[S@](C)(=O)c2ccccc2F)C1 1135036816 KBDTUIRWFMDMBO-SSEXGKCCSA-N 427.545 4.230 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@](C)(O)c2ccccc2Cl)CCCC1 1138064497 IOQVXWCLHLWMNB-XMMPIXPASA-N 426.944 4.206 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3C2)c(C)n1-c1ccccn1 1161275545 FUJZTHRTOQFUFQ-VAMGGRTRSA-N 438.572 4.255 10 10 IICE Cc1cc(C)cc(N2CC[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)C2=O)c1 1163900729 CCIMRLHYVMVCBF-OAQYLSRUSA-N 447.501 4.313 10 10 IICE Cc1cc(NC(=O)C2CC2)sc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294859768 OFWPWSCBDNEKPE-QGZVFWFLSA-N 447.988 4.158 10 10 IICE CC(C)[C@H](Cc1ccc(F)cc1)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1307636469 IIXFIZCDBRAEFV-DEOSSOPVSA-N 444.506 4.397 10 10 IICE CCc1ccc(N2C[C@H](C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)CC2=O)cc1 1354389918 XOPXLDKKBLJJIG-JOCHJYFZSA-N 445.563 4.490 10 10 IICE CCOC(=O)c1cnn(-c2ccc(C(=O)NCc3ccc(N(CC)CC)cc3)cc2)c1C 1355014775 FJAFPYFTEUWRDX-UHFFFAOYSA-N 434.540 4.134 10 10 IICE COC(=O)[C@H]1CN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)c2ccc(F)cc2O1 1437264348 AXSGDMXEANIDBO-OAQYLSRUSA-N 442.874 4.467 10 10 IICE Cc1cc(CNC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccc1 1438301132 ITLZUGFLZZDCMM-AREMUKBSSA-N 449.526 4.461 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(Br)cc2Cl)N(C)C)cc1 1439959928 ICHCZNBIKQMIPB-LJQANCHMSA-N 438.797 4.130 10 10 IICE COc1cc(N2CCC([C@@H]3N(C(=O)OC(C)(C)C)CC3(C)C)CC2)c([N+](=O)[O-])cc1OC 1458378584 XUJHRFZNXGVJIW-FQEVSTJZSA-N 449.548 4.474 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccccc4)C3)cc2Cl)C1 1459588882 SZLLSOJMJUYCHF-IEBWSBKVSA-N 425.960 4.246 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1CCc2ccc(O)cc21 1470248146 FBEDUQLMJDRIBU-YPOUMIDOSA-N 444.603 4.239 10 10 IICE CC[C@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1499762555 IWDSUZQVQBWQLJ-RDPSFJRHSA-N 448.615 4.162 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C(N)=O)C1 1508742755 WVYDCYYOFGGLHU-NRFANRHFSA-N 446.599 4.411 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1515524524 FNSLJUAZQODTDC-IBGZPJMESA-N 434.588 4.238 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccn(-c2cccc(Br)c2)n1 1529277722 IODZHNPGLIJVIX-MRXNPFEDSA-N 441.373 4.370 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(Br)c(C)cc3C)cc2F)CC1 1530377759 ZXIZNSGQZCQIEA-UHFFFAOYSA-N 448.380 4.277 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3Cl)cc2)CC1 1537840071 UUQLKTHVFPXGKN-PMACEKPBSA-N 446.378 4.115 10 10 IICE C[C@H](NC(=O)CCOc1cccc(I)c1)c1ccc(N(C)C)cc1 1538976552 QXKMHPCTXPWRLS-AWEZNQCLSA-N 438.309 4.004 10 10 IICE CCO[C@@H]1C[C@@](NC(=O)OC(C)(C)C)(C(=O)NCc2ccc(N(CC)CC)cc2)C1(C)C 1542089497 QETINRLZZMUMLH-CJFMBICVSA-N 447.620 4.248 10 10 IICE Cc1nc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)sc1Br 1545040835 ICDDZGDWDWNBGU-NSHDSACASA-N 446.317 4.214 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C(C)C)c(C)n1-c1cccc(Br)c1 1559350015 UHOHOKPMWCYCSW-UHFFFAOYSA-N 434.363 4.399 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H](C)c1ccc(OC)cc1OC 1565096602 QOACXFLLSSFDOO-ZDUSSCGKSA-N 437.334 4.465 10 10 IICE Cc1cc(F)c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(F)c1 1565881827 JCMGBDLZDPODGI-LJQANCHMSA-N 433.499 4.335 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cccc(F)c1F 1595778600 DVMHNEHBHSSRLG-YBEGLDIGSA-N 436.480 4.012 10 10 IICE Cc1cc(CC(=O)N2CCC(CN=S(C)(C)=O)CC2)c(C)n1-c1ccc(Cl)cc1 1596930247 YEENQOCXCGLWII-UHFFFAOYSA-N 436.021 4.256 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C\c1ccsc1C(F)(F)F 1597567597 SWBRMFMBBBOIKI-DJWKRKHSSA-N 433.835 4.341 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(F)c(Cl)c([N+](=O)[O-])c2Cl)N(C)C)cc1 1603554720 JWMOUGSMLJPOPO-OAHLLOKOSA-N 443.306 4.139 10 10 IICE O=C(NCc1cccc(Cl)c1O)c1cc(Br)cc(Br)c1O 1606860403 KOHOSNZXUBHBIY-UHFFFAOYSA-N 435.499 4.206 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)CCO1 1614439273 VVMOJFGIKYWPIJ-UGKGYDQZSA-N 437.588 4.393 10 10 IICE CCO[C@@H](CCn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1616101337 RRGOCAZBNQZYAX-IRLDBZIGSA-N 428.577 4.109 10 10 IICE COC[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1 1619573301 FXBJFVHBEONTFK-SFHVURJKSA-N 447.587 4.005 10 10 IICE Brc1cc(CN2CCN(Cc3ccncc3)CC2)ccc1N1CCCCC1 1621238214 VBWSQPRRSCUOQP-UHFFFAOYSA-N 429.406 4.152 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(S(=O)(=O)NC(C)C)cc2)c1 1628210471 WEASTPXIBAQTAE-UHFFFAOYSA-N 425.554 4.342 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1628468856 MTKCJZMMJMDLCA-IBGZPJMESA-N 433.593 4.017 10 10 IICE C[C@@H]1c2ccc(C(=O)NCc3ccc(N4CCCC4)cc3)n2CCN1C(=O)OC(C)(C)C 1629758970 ZLCSITKRKGJYDO-GOSISDBHSA-N 438.572 4.330 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCC(CN(CCO)C(C)C)CC2)c1 1630701971 ZALBKGZVRVSAEA-UHFFFAOYSA-N 432.008 4.302 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@@H](C(F)(F)F)OC[C@H]3C)cc2Cl)C1 1634719743 FKBVBJRTRDPBOM-LBTNJELSSA-N 433.902 4.438 10 10 IICE CCc1ccccc1N1C[C@@H](C(=O)N(CC)Cc2cc(Br)ccc2O)CC1=O 1635673542 RAHHWBXUQBGSQG-KRWDZBQOSA-N 445.357 4.119 10 10 IICE O=C(/C=C\c1ccc(I)o1)NCc1cc(Cl)cc(Cl)c1O 1637134482 NRCCIITWEGKJBO-RQOWECAXSA-N 438.048 4.226 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCC(F)(F)[C@H]2O)c(C)n1-c1ccc(Br)cc1 1637899898 SIHMQXMXHYFPNO-SJORKVTESA-N 427.289 4.135 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@H]2Cc3ccc(Br)cc3[C@H]21 1640087523 HRTVVBYMQNSMHF-NUEKZKHPSA-N 437.131 4.119 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2CC(=O)NCC1(c2ccccc2)CCOCC1 1653957499 XZPZKJUFFYYGKI-JOCHJYFZSA-N 436.596 4.195 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1 1683424675 HURGXATVXNYJFB-IBGZPJMESA-N 444.620 4.035 10 10 IICE FC(F)(F)[C@@H]1CCCN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)C1 1712858039 PPDYURFPMHLYLO-ZIAGYGMSSA-N 447.552 4.200 10 10 IICE COc1ccc(-c2nnc(N3CCC[C@H](OC)C3)n2CCCSc2nccs2)cc1 1730080553 ADAKVEARZHVJJC-SFHVURJKSA-N 445.614 4.208 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@@H]3CCO[C@H](C)C3)CC2)cc1 1748847135 HFQYBIYTMROXDR-WOJBJXKFSA-N 441.620 4.116 10 10 IICE CO[C@@H]1CN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)cc2C)CC[C@@H]1C 1770652606 NGHFUVWKRMFHAM-HTAPYJJXSA-N 439.629 4.214 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(Br)cc2)N2CCCCC2)cc1 1858074369 HZDPCBHPXPPYPA-NRFANRHFSA-N 430.390 4.472 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c(Br)c1 1912028116 PQKZBZCJRNUYDE-KDURUIRLSA-N 427.342 4.400 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNCc1cc(Br)cc(F)c1O)CC(F)(F)F 2117334166 ACCWBESMMHHCSJ-LLVKDONJSA-N 445.251 4.229 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](NCc3cc(Br)ccc3O)C(C)(C)[C@@H]21 2119292862 HDTZMWICRWJDEE-HYVNUMGLSA-N 425.367 4.278 10 10 IICE COc1ccc(Br)c(CN[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)c1O 2236051561 VGZHYVJWLITALZ-ILZDJORESA-N 431.374 4.164 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2C[C@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380747857 YBGNRYJHLWHYJR-DOMZBBRYSA-N 441.366 4.115 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2380759034 KXVMNGCQPJKEJU-OAHLLOKOSA-N 443.382 4.361 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(CCC(=O)Nc3ccc(C)cc3)C2=O)ccc1O 15037462 ZRCQIGWXCLDWPN-UYRXBGFRSA-N 442.562 4.329 10 10 IICE CN(C)c1ccc(C2(c3ccc(N(C)C)cc3)O[S@](=O)c3cc(N(C)C)ccc32)cc1 15772723 PIZBWYWSPMVORZ-WJOKGBTCSA-N 435.593 4.229 10 10 IICE CCCCCCN1C(=O)/C(=C\c2c(NCC)nc3ccc(C)cn3c2=O)SC1=S 33474135 BRRSVZVOAHLCGW-FOWTUZBSSA-N 430.599 4.216 10 10 IICE CCCOC(=O)CN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S 35078283 CCNXGOZYLLWWTJ-CPNJWEJPSA-N 427.547 4.420 10 10 IICE CCCOC(=O)CCCN1C(=O)/C(=C/c2ccc(OCC)c(OCC)c2)SC1=S 40938944 OHVXIRRSQZOIEU-JXAWBTAJSA-N 437.583 4.419 10 10 IICE CCc1nc(N2CCC(C(=O)NCc3ccc(N(C)C)cc3)CC2)c2c(C)scc2n1 65301460 HDDFSQRDFYSXQQ-UHFFFAOYSA-N 437.613 4.161 10 10 IICE O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C/C=C/c1ccccc1[N+](=O)[O-] 208363368 NRKQNNHRFUAPPK-YVUBOPQPSA-N 438.484 4.083 10 10 IICE COc1cc(CN(C)C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc(OC)c1 745906025 VCFQKESSIYCUBR-QGZVFWFLSA-N 449.498 4.116 10 10 IICE C[C@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1cc(Br)cc(F)c1O 756494783 NSRURCFVHVEQPH-MNOVXSKESA-N 431.327 4.077 10 10 IICE CS(=O)(=O)c1csc(C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1 767848149 LLRVWCZAYVUCHH-UHFFFAOYSA-N 443.506 4.363 10 10 IICE COc1cccc(O)c1CN1CCC(N(CC(F)(F)F)C(=O)c2ccccc2F)CC1 769466062 HHIPUFFTKRQTTA-UHFFFAOYSA-N 440.437 4.209 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc(-c2ncco2)cc1 777610635 XTGXXXHCZNKFFI-UHFFFAOYSA-N 431.540 4.195 10 10 IICE Cc1cc(=O)oc2cc(OCc3ccc(C(=O)NCc4ccc(O)c(O)c4)cc3)ccc12 778917085 VUYIVNRNIWGQPB-UHFFFAOYSA-N 431.444 4.022 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3CCN(C4C[C@@H]5CC[C@H](C4)N5C)CC3)c2C)c1 779339258 ALEBKJRBIUQEIL-XMGLRAKGSA-N 448.655 4.136 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1c[nH]c2cccc(OC)c12 779400779 VMWWALGMYCMORL-UHFFFAOYSA-N 446.345 4.419 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CCCN(C(=O)NCc3ccc(N4CCCC4)cc3)C2)C1 804966641 CPKFMPUTDKMXEP-VWLOTQADSA-N 442.604 4.219 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3ccc(OC(F)(F)F)cc3)cc2F)C[C@@H](C)O1 917711457 GNYUKIJJWHAHRR-HUUCEWRRSA-N 440.437 4.197 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cccc(C(=O)N(C)C)c3)n2)c1C 917872415 KWWJUOHCWQFOIC-UHFFFAOYSA-N 446.598 4.141 10 10 IICE CCN1CCN(c2cccc(NC(=O)c3cccc4nc(O)n(CC(C)(C)C)c34)c2)CC1 1128206320 IAJLEJBNIPYQMU-UHFFFAOYSA-N 435.572 4.182 10 10 IICE CC[C@](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)(C(=O)OC)c1ccccc1 1128910178 BIZNSUIZODWSSJ-AREMUKBSSA-N 434.536 4.123 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](O)c1ccc(OC(F)(F)F)cc1 1140764053 YHDVCZMBVZMAQR-NRFANRHFSA-N 446.425 4.269 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)CC(=O)c1ccc(Cl)cc1 1152400867 GEEZNRFWVHRILE-ZDUSSCGKSA-N 438.307 4.110 10 10 IICE Cc1cc(CC(=O)N(C)C2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1160259293 NGSIRIYMBWBKRL-UHFFFAOYSA-N 431.964 4.368 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(N3CCCCC3)nc2)Cc2ccco2)cc1F 1167681110 REIOMEGKPSVWPV-UHFFFAOYSA-N 438.503 4.458 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2COc3c(F)cc(F)cc3C2)c(C)n1-c1ccccc1 1253814150 NNQBYUSAIGUXQQ-FQEVSTJZSA-N 425.479 4.218 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)C)n2CC2(C(N)=O)CCCC2)c(C)n1-c1ccccc1 1289353628 SOJNGOKKECXCIX-UHFFFAOYSA-N 448.615 4.491 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3c(Cl)cc(Cl)cc3Cl)cc2)CC1 1296400514 RXHFDTKAYLROIO-UHFFFAOYSA-N 440.758 4.245 10 10 IICE Cc1cc(CC(=O)N[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1305563136 YZUNPQBEQUDYIL-KDURUIRLSA-N 431.964 4.462 10 10 IICE CCCN(CCc1cccs1)CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1307661560 VYSCNEZYDIGBKA-RTBURBONSA-N 447.620 4.072 10 10 IICE CCC(CC)(C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C(=O)OC(C)(C)C 1355129296 FEVKNJJVZJWQEO-CALCHBBNSA-N 436.568 4.204 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](CC(C)C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1361049276 YKRXPLZAEMUFHO-NRFANRHFSA-N 448.615 4.313 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N(C)CCC1CCOCC1 1361098444 UYLCEVHZXWBUNM-HSZRJFAPSA-N 441.620 4.195 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@H](CNC(=O)OC(C)(C)C)C1 1442173966 JXURGBHLGZGUOS-LJQANCHMSA-N 439.556 4.284 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3nc(COc4ccccc4)n[nH]3)c2C)c1 1447964859 JDCCGFFDPCIUMW-UHFFFAOYSA-N 429.524 4.338 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC[C@@H]1CCCCO1 1495756368 YIBMIHLOEODNJZ-ICSRJNTNSA-N 445.583 4.225 10 10 IICE CC[C@@]1(C)CN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1497630408 AVSJFHMPBLNCTE-UZLBHIALSA-N 437.635 4.164 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1514324371 YCPHXDZWFWEJGR-FPOVZHCZSA-N 443.661 4.398 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cc([N+](=O)[O-])ccc1OC(F)F 1534008895 KKOBGBHZCRLPOS-UHFFFAOYSA-N 438.342 4.224 10 10 IICE O=C(CCSc1cccc(Cl)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1535346469 WOBOOQWBOSIZRX-UHFFFAOYSA-N 426.916 4.253 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)CC(=O)Nc3cccc(Cl)c3)c2C)cc1 1540545726 YDWMJNWXJCJUBN-UHFFFAOYSA-N 425.916 4.467 10 10 IICE Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3cccc(O)c3O)cc2)cc1 1540949779 ARGGRZJYNQJDHJ-UHFFFAOYSA-N 434.492 4.134 10 10 IICE Cc1occc1CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1542084209 LOEDMUXZTXCRAC-OAQYLSRUSA-N 427.524 4.311 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2csc(N3CCCCC3)n2)cc1 1542490745 XNEDQVOGNSJXBA-FQEVSTJZSA-N 428.602 4.021 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H]2C(C)C)n1Cc1ccc(N(C)C)c(F)c1 1545902165 IQPAWKACUQAONH-FQEVSTJZSA-N 444.599 4.075 10 10 IICE C[C@H](NC(=O)c1cccc2c1OCCN(C(=O)OC(C)(C)C)C2)c1ccc(N(C)C)cc1 1556260603 OGBRAHLKJZATRG-KRWDZBQOSA-N 439.556 4.373 10 10 IICE O=C(CSc1ccccc1C(=O)NCc1cccc(O)c1O)NC1CCCCCCC1 1558159447 GVCKZJJGUBBANS-UHFFFAOYSA-N 442.581 4.349 10 10 IICE CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1583919368 PWSNLYWZXKTIOW-ZJSXRUAMSA-N 439.556 4.437 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1587552584 VQZVSZYPUAOSPB-PXNSSMCTSA-N 431.577 4.006 10 10 IICE COc1ccc(CN2CCCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2=O)cc1 1611036080 LQPUIFGLXNHGGS-UHFFFAOYSA-N 445.563 4.286 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)CC2)c(OC)c1 1623759545 HMKHVMMSBFZAMG-OALUTQOASA-N 435.351 4.463 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cncc3nc(C(F)(F)F)[nH]c23)cc1 1624286811 OYGYVEIZWSBHTN-UHFFFAOYSA-N 443.429 4.478 10 10 IICE CCOc1ccccc1OCCCC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257501 YNFYYLNCIGGZAG-FQEVSTJZSA-N 446.975 4.384 10 10 IICE Cc1cc(C)c(CCNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c(C)c1 1632414349 IRVOKLMLHJIZLY-UHFFFAOYSA-N 444.578 4.152 10 10 IICE COC(=O)[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccc(C)c(C)c1 1633608634 YEEIRJFXYUCYRB-XMMPIXPASA-N 432.520 4.476 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCCC4(CCCCC4)CC3)cc2)CC1 1638479370 PHEZRTBCMZHECY-UHFFFAOYSA-N 426.605 4.034 10 10 IICE Cc1cc(C(=O)N[C@@H](Cc2ccncc2)C(=O)OC(C)(C)C)c(C)n1-c1ccc(F)cc1 1640068757 YKZDHCPFPMGOFT-QFIPXVFZSA-N 437.515 4.311 10 10 IICE O=C(NCc1cccc(Br)c1O)[C@@H]1[C@@H]2Cc3ccc(Br)cc3[C@H]21 1640087522 HRTVVBYMQNSMHF-FVQBIDKESA-N 437.131 4.119 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccnc(Oc2ccc(F)cc2F)c1 1641203763 KACSBCHLHRYEKS-UHFFFAOYSA-N 439.462 4.043 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)c(C)n1-c1cccc(Br)c1 1641854347 RQEOEXABIHKFJV-MRXNPFEDSA-N 446.389 4.233 10 10 IICE COc1ccc(N(CC(=O)N(C)CC(=O)Nc2ccc(C)cc2)Cc2ccccc2)cc1 1642218706 AITNBEWNDOPNBA-UHFFFAOYSA-N 431.536 4.107 10 10 IICE Cc1cc(C(=O)Cn2c(O)nnc2-c2ccccn2)c(C)n1-c1ccc(F)c(Cl)c1 1643912085 GQNAFKCXYXYFAJ-UHFFFAOYSA-N 425.851 4.129 10 10 IICE Cc1ccc(C)c([C@H](C)NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1653167433 XGXDSYCWBSTXHH-AQNXPRMDSA-N 427.564 4.023 10 10 IICE C[C@H]1[C@H](C(F)(F)F)CCN1[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1653473469 FLKODDRFLSGDND-XEKQOVJPSA-N 430.426 4.062 10 10 IICE CSc1ccccc1OC[C@@H](O)CN(C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(C)C 1671844316 NVAVRWLXDBQZCH-RXVVDRJESA-N 445.629 4.395 10 10 IICE Cc1ccc(C2=NO[C@H](CNC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1681765449 KEHBUDRUKTUORW-DEOSSOPVSA-N 430.552 4.437 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](c3ccc(F)c(Cl)c3)C3CC3)CC2)c(OC)c1 1682460329 HRIHBODALBEPPR-JOCHJYFZSA-N 447.938 4.479 10 10 IICE CCOCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC1 1696420655 FXDYFTLHXYVPTD-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CN(Cc1ccsc1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1696717955 NDDGXKKKOIKOMH-UHFFFAOYSA-N 443.592 4.298 10 10 IICE COCC(C)(C)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1697725759 VSUQHGXLOJRAQA-UHFFFAOYSA-N 434.588 4.249 10 10 IICE COC[C@H]1CCCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1697850406 GHDOYXSYYVIGQV-INIZCTEOSA-N 433.603 4.348 10 10 IICE CCCN1CC[C@H](Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)C1 1709770613 IHMVSUHURGFOAB-IBGZPJMESA-N 425.602 4.004 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@@H](C)N(CC)C[C@@H]2C)cc1 1710026141 YVEMDGRQSZPIIO-RTWAWAEBSA-N 447.631 4.154 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(C)CN(C)C1=O 1728027993 WHPVQMSRLWYWQW-VWLOTQADSA-N 434.588 4.067 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC(C)C 1744013317 CNPXXZTVRPZHSR-UHFFFAOYSA-N 426.609 4.089 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(-c3cnccn3)n2CCCSc2nccs2)C1 1760946721 RRQXMCCYEDUWCN-INIZCTEOSA-N 429.619 4.246 10 10 IICE CC[C@H](C)CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)c(F)c1 1763854762 LLGGWDKDMHFBBI-AVRDEDQJSA-N 445.583 4.026 10 10 IICE CCC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1)OC 1763855852 FFIWEZBXDKFAOF-NRFANRHFSA-N 437.588 4.393 10 10 IICE CCCCCn1c([C@@H]2CCCCO2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1764012731 YNHKFCQWOMODKP-NRFANRHFSA-N 431.556 4.184 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3C[C@](C)(O)C(C)C)CC2)cc1 1768705065 UDJTVZHBLDPYQC-VWLOTQADSA-N 441.620 4.068 10 10 IICE CCCC[C@@H](NC(=O)/C=C/c1ccc(C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1861943404 CZMJHMDKPJWUNK-XAJMEMKASA-N 449.595 4.041 10 10 IICE COc1ccccc1-c1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n(C)n1 1871333259 NBMJVXIRUKOUHW-UHFFFAOYSA-N 437.455 4.123 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3ccc(Oc4ccc(C)cc4)cc3)CC2)cc1 1892003050 SUBQJLPNNYZFHJ-UHFFFAOYSA-N 438.549 4.307 10 10 IICE COc1ccc(Br)c(CNC[C@@](C)(NC(=O)OC(C)(C)C)C2CCC2)c1O 2236045043 PZEPUFJHHJUCNE-HXUWFJFHSA-N 443.382 4.336 10 10 IICE COc1ccc(Br)c(CNCC[C@@H](C)CCNC(=O)OC(C)(C)C)c1O 2268662980 JNGCERAKZSXZNP-CYBMUJFWSA-N 431.371 4.194 10 10 IICE O=C1C(=CNCCc2ccccn2)C(c2ccccc2)=NN1c1nc2ccccc2s1 2297451493 LJKYOFFTERVUPE-UHFFFAOYSA-N 425.517 4.158 10 10 IICE Cc1ccccc1NC1=NC(=O)/C(=C\c2ccc(OCCO)cc2Br)S1 11294051 YTEQOAFJFGJVPZ-LICLKQGHSA-N 433.327 4.211 10 10 IICE CCCCCN1C(=O)/C(=C\c2c(C)c(C#N)c(=O)n(CC)c2N(CC)CC)SC1=S 33475936 VRNOPFWTJFMIGD-QGOAFFKASA-N 446.642 4.286 10 10 IICE COc1ccc(N2CCC(NC(=O)NCc3cccc(NC(=O)c4ccco4)c3)CC2)cc1 110466889 MVMKNTZFEVNNNV-UHFFFAOYSA-N 448.523 4.009 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@@H](COCc3ccccc3)C2)C1 435826126 KZBLLVSGBWZZJB-HSZRJFAPSA-N 445.607 4.473 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@@H](NCc1cc(Br)ccc1O)C2 701066265 PGQOLTTUXKNVKO-VDGAXYAQSA-N 445.357 4.434 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cc(C)ccc3OC)cs2)c(C)c1 727245782 NLZSQHDAQLJOAR-UHFFFAOYSA-N 432.523 4.023 10 10 IICE CC1CCN(c2ccc(CNC(=O)C(=O)Nc3cccc(OCC(F)(F)F)c3)cc2)CC1 731132229 VNGBIFYIQKRZCS-UHFFFAOYSA-N 449.473 4.119 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)N3CCCC[C@@H]3c3cccn3C)cc2F)C[C@@H](C)O1 746758649 NPFJWTCVPMGSSN-PMAPCBKXSA-N 428.552 4.215 10 10 IICE CC(=O)NCCN(Cc1ccc(Br)s1)Cc1cc(Cl)cc(C)c1O 800543811 MAMPGVBCYZVTSN-UHFFFAOYSA-N 431.783 4.316 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H]3CCc4cc(Br)ccc43)CC2)cc1 919917232 WIWBSYMMZQKQBL-OAQYLSRUSA-N 444.373 4.367 10 10 IICE Cc1nc(-c2ccc3c(c2)CCN3C(=O)/C=C\c2cc3cnn(C(C)C)c3[nH]c2=O)cs1 1115831071 IKIAURFUBXELJJ-ALCCZGGFSA-N 445.548 4.340 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2nc(CNC(=O)OC(C)(C)C)sc2C)cc1 1125235434 OFZKTYQGEVLBMI-UHFFFAOYSA-N 432.590 4.252 10 10 IICE O=C(CCOc1ccc(Cl)c(F)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127184305 QBERAKZIAJQLAJ-UHFFFAOYSA-N 445.966 4.096 10 10 IICE COC(=O)c1c(F)ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)c1F 1129524761 WUKKOEJGLOBGBQ-UHFFFAOYSA-N 428.435 4.232 10 10 IICE CCc1sc(C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)cc1Br 1131804227 IRRMBBSYUKHESM-UHFFFAOYSA-N 439.375 4.053 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)C[C@@H]2CCN(Cc3ccccc3)C2)cc1 1137008546 BKCDMFPZMHEWQA-VWLOTQADSA-N 443.591 4.430 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnc(CCC(F)(F)F)s1 1150353721 GGCNZRUNTBONHE-CQSZACIVSA-N 447.910 4.391 10 10 IICE Cc1cc(C(=O)NCc2ccc(CN3CCNC3=O)cc2)c(C)n1-c1ccc(Cl)cc1 1151859706 LKXMVSPLUROPIP-UHFFFAOYSA-N 436.943 4.203 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 1152401003 IGZZCPPCMWFXJL-NSHDSACASA-N 446.714 4.322 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](c3ccnn3C)C2)c(C)n1-c1ccc(Br)cn1 1155481019 AAVDVYNSFOFOGN-INIZCTEOSA-N 442.361 4.005 10 10 IICE CCN(CCOc1ccc(/C=C/C(=O)OC)cc1)Cc1cc(Br)ccc1O 1167512754 QFHKDIQDEJQSNH-IZZDOVSWSA-N 434.330 4.242 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC[C@H]2CCCCN(Cc3ccccc3)C2)cc1 1229653572 QCMNMOWOJBMTOM-HSZRJFAPSA-N 438.616 4.075 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)cc1 1266053354 MTNQZFXBWCPKCV-JOCHJYFZSA-N 429.442 4.243 10 10 IICE Cc1cc(CC(=O)N2C[C@@H](C(N)=O)[C@H](c3ccccc3)C2)c(C)n1-c1ccc(Cl)cc1 1299397820 MPVCSMIUQAXVML-XZOQPEGZSA-N 435.955 4.018 10 10 IICE CCOC(=O)c1c(NC(=O)c2cnc3n2CCOC3)sc(C)c1-c1ccc(C)cc1 1350796224 CGLPHKUZWFHBOI-UHFFFAOYSA-N 425.510 4.188 10 10 IICE COc1ccc2cccc(CC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)c2c1 1355129598 HIHGBVGODWYNQF-QZTJIDSGSA-N 436.527 4.460 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCOC[C@]2(C)C2CC2)sc(C)c1-c1ccccc1 1460912007 XKGADQZVORKJNN-XMMPIXPASA-N 442.581 4.340 10 10 IICE O=C(CN(C(=O)c1ccccc1)c1ccccc1)NCc1ccc(N2CCSCC2)cc1 1464258177 HAWJKTFPFZXZII-UHFFFAOYSA-N 445.588 4.203 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3cccc(S(=O)(=O)N(C)C)c3C)c2C)c1 1468961529 FYCZDQAYVRVTMK-UHFFFAOYSA-N 425.554 4.214 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cc(NC(=O)OC(C)(C)C)ccn1 1471378448 MLUJJYNDOMACBF-UHFFFAOYSA-N 427.549 4.226 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccc4oc(O)nc4c3)cc2Cl)C1 1478527814 IDKMENRTNCUJQU-CQSZACIVSA-N 428.920 4.423 10 10 IICE Cc1ccc(CN2CC[C@@H](NC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 1478566407 MUJZDGCMQHEZNM-RUZDIDTESA-N 444.579 4.311 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1500703278 PGOGJBOILWVEPQ-OAQYLSRUSA-N 438.664 4.174 10 10 IICE CCCN1CCC(Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)CC1 1500950827 MVEHLGGGZQBGSD-UHFFFAOYSA-N 425.621 4.475 10 10 IICE O=C(CCCc1c(F)cccc1F)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1518327375 YGFZUXIQDVGDKT-UHFFFAOYSA-N 427.539 4.136 10 10 IICE Cc1cc(CC(=O)Oc2cccc(NC(=O)c3cnn(C)c3)c2)c(C)n1-c1ccccc1 1529868792 IAMWAEIPKZKIFB-UHFFFAOYSA-N 428.492 4.228 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)cc2Cl)C1 1538420798 DWFKGZLCOUWYQZ-CYBMUJFWSA-N 432.864 4.323 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F 1540518312 JTBXQTQUXRLRJC-HXUWFJFHSA-N 437.487 4.161 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@H](Oc1ccccc1Br)c1ccccc1 1558174372 KXNGFJLHGITECU-HXUWFJFHSA-N 428.282 4.297 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3nc(-c4ccc([N+](=O)[O-])cc4)oc3=O)c2C)cc1 1559388817 AGSASEVBDRTPRU-UHFFFAOYSA-N 432.436 4.010 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(C(=O)OC(C)(C)C)nn3C)cc2Cl)C1 1586083268 YIXPAAYFRVICHI-HNNXBMFYSA-N 446.979 4.195 10 10 IICE COc1cc(/C=C\C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc(Br)c1O 1587548056 WNIVNHHIPKPRDI-YFHOEESVSA-N 445.357 4.435 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](COC)OC 1614160768 QFZMROXCEWXYKI-RBBKRZOGSA-N 437.588 4.393 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)[C@@H]1C[C@H]1C(F)(F)F 1616573073 QSJWUWQKVNNINH-GHMZBOCLSA-N 425.208 4.296 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](C)c1cccc(N2CCOC2=O)c1 1617877506 CQYPBKZWYKYEOD-KRWDZBQOSA-N 431.492 4.354 10 10 IICE Cc1cc(CN2CCC([C@H]3C[C@@H](NC(=O)OC(C)(C)C)CCO3)CC2)ccc1N(C)C 1618529679 UCRYJYZYIDIZMX-JTHBVZDNSA-N 431.621 4.345 10 10 IICE CO[C@H](C)C(=O)Nc1cccc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1625747115 CAPLZJFLRITHHI-GOSISDBHSA-N 433.508 4.061 10 10 IICE CCOC(=O)[C@@]1(COC)CCCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)C1 1625851065 CQLNBTKUBISVIL-VWLOTQADSA-N 426.557 4.143 10 10 IICE Nc1ccc(C(F)(F)F)cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1625991530 SOJODBIWHVZGKD-UHFFFAOYSA-N 447.379 4.073 10 10 IICE CCN(CC)[C@H](C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccccc1 1631425695 MODSQJGVPGKGML-GGAORHGYSA-N 429.992 4.209 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(Sc2ccccc2)n1 1633789162 DHJOVIOOHZNRFH-UHFFFAOYSA-N 433.577 4.432 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(CCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1635017366 OTISUSRAQJUKSU-QFIPXVFZSA-N 432.542 4.176 10 10 IICE Cc1cc(C(=O)Nc2cc(Br)cn(C)c2=O)c(C)n1-c1cccc(Cl)c1 1635120025 HIHYRCAYLUUHIO-UHFFFAOYSA-N 434.721 4.461 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](c3ccccc3)[C@H](O)c3ccccc3)C2)cc1 1636853917 NSKIGOZBKYKNIK-GVXSCFBNSA-N 431.536 4.048 10 10 IICE COC(=O)/C=C\c1ccc(N2CCCN(Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 1642008921 PGRJGDSWNTWZJX-POHAHGRESA-N 429.904 4.147 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)[C@@H]2C1 1652207366 MHMNGRXJPCFSGS-PMACEKPBSA-N 437.496 4.351 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NCc3ccc(N4CCOCC4)cc3)C(C)(C)[C@H]21 1655916517 WOWRKDJJBTWOGA-FSSWDIPSSA-N 429.605 4.037 10 10 IICE C[C@H](NC(=O)NC[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2)c1ccc(N(C)C)cc1 1671851951 NLNUMFFPERVXKA-WPSZSDGUSA-N 430.593 4.293 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](COC)c1cccc(Br)c1 1675426920 GWSZZKOKTGSGND-FQEVSTJZSA-N 434.378 4.434 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)C2CC2)cc1 1675780048 JQVHXNNIPPQTQO-IPJJNNNSSA-N 442.604 4.215 10 10 IICE CC(C)CCN(c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)cc1)C1CC1 1692341651 RLLVEKNVNGTHGH-UHFFFAOYSA-N 425.621 4.376 10 10 IICE Cc1nnc(N2CCO[C@H](c3ccccc3Cl)C2)n1CCCSc1nccs1 1693513166 DJEFTCLAFGGUSB-KRWDZBQOSA-N 436.006 4.457 10 10 IICE CC[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 1694970041 VVWZXDNURJMLHT-XLIONFOSSA-N 429.584 4.268 10 10 IICE CCCCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1695223069 ORTDPXMUMAYIIX-QFIPXVFZSA-N 427.593 4.183 10 10 IICE CO[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC[C@@H]1C 1712065606 CQLLAPVVQRDAAH-RXVVDRJESA-N 443.661 4.038 10 10 IICE Cc1ccc(-c2nnc(N3CCN(CC(C)C)CC3)n2Cc2ccc(N(C)C)cc2C)o1 1724320189 NVTUQBHEFKKPFD-UHFFFAOYSA-N 436.604 4.047 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CCC(F)(F)CC2)cc1 1728384549 WZXXRVFCMFDHCX-UHFFFAOYSA-N 440.542 4.394 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1730849882 AQXDHKAEEYZVDY-LEWJYISDSA-N 443.636 4.297 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)C[C@@H]2CCCOC2)cc1 1746089595 DALPKUJCZNRNMC-NRFANRHFSA-N 434.588 4.097 10 10 IICE CCOC(C)(C)Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1765760068 MCOIPSZIZNUPSY-UHFFFAOYSA-N 443.636 4.407 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CC[C@H](C)[C@@H](OC)C2)cc1 1766615070 VTRPWHKPWRGEKQ-RDPSFJRHSA-N 448.615 4.020 10 10 IICE CCCCN1C(=O)C(NCCCOC(C)C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165511 LWHOROZDNADLLD-UHFFFAOYSA-N 437.584 4.379 10 10 IICE CCN(Cc1ccc(N)cc1)c1ncc(I)cc1Br 2133385691 VBUPCFLIQKMCBW-UHFFFAOYSA-N 432.103 4.057 10 10 IICE COc1cccc(OCCn2cc(C=C3C(=N)N4OC(C)=CC4=NC3=O)c3ccccc32)c1 2297347468 UFADHPBXNGWCRY-UHFFFAOYSA-N 442.475 4.179 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)c(C)n1-c1cccc(F)c1 2297470584 OHDHXBBINAYSEH-UHFFFAOYSA-N 435.406 4.415 10 10 IICE COC(=O)c1cccc(-c2ccc(C=C3C(=O)N(C)C(=O)N(c4ccccc4)C3=O)o2)c1C 2313560613 ZSPJTUSDBVPZNT-UHFFFAOYSA-N 444.443 4.050 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccc(C)cc3C)C2=O)c(C(=O)O)c1OC 2314929883 TZPCPBGYMYVJAS-UHFFFAOYSA-N 429.519 4.425 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccccc4C(F)(F)F)c3N)CC2)cc1 40701722 RJXPROKBCDJJMQ-UHFFFAOYSA-N 444.461 4.156 10 10 IICE CCOC(=O)c1cccc(N2C(=O)/C(=C\c3ccc(O)c(OCC)c3)SC2=S)c1 206263303 LAXHLUCSENTDCD-WOJGMQOQSA-N 429.519 4.373 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCCO[C@H](c3ccccc3)C2)C1 683443277 JGYOQJJZMMJFJR-SANMLTNESA-N 431.580 4.398 10 10 IICE Cc1ccc(NC(=O)C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1OC(F)F 734221613 NRBINTHNLTVQJL-UHFFFAOYSA-N 441.478 4.301 10 10 IICE COCCc1cc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n(C)n1 768343802 MDYOHFBMEFHADA-UHFFFAOYSA-N 431.334 4.031 10 10 IICE COc1cc(F)c([C@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1OC 773148563 YDITZCOKIKFMRA-SFHVURJKSA-N 427.564 4.226 10 10 IICE CC[C@H](NCc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1)c1cc(Br)ccc1O 775486763 FFJHRCUVBGAWRU-KHYOSLBOSA-N 434.378 4.404 10 10 IICE O=S(=O)(Cc1ccc(Cl)cc1Cl)NCc1ccc(N2CCSCC2)cc1 779616334 QAOHRDBSAMHPPR-UHFFFAOYSA-N 431.410 4.166 10 10 IICE COc1cc(Br)ccc1[C@@H](C)NC(=O)NCCCSc1nccs1 786788635 HUNSWJRMLJRAAA-LLVKDONJSA-N 430.393 4.457 10 10 IICE Cn1ccnc1[C@@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(Cl)cc1 806342989 QVVLMAUVHBVYAT-KRWDZBQOSA-N 449.736 4.130 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](C)c3ncc(Br)cn3)c2C)cc1 817273504 UVNBQXZJSYJLKP-ZDUSSCGKSA-N 429.318 4.146 10 10 IICE Cc1ccc(NC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1OCC1CCCCC1 1136897239 OLJHUSLCQWQFLP-UHFFFAOYSA-N 432.542 4.284 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2c[nH]c3nccc(Cl)c23)cc1 1142712941 KVLWKNCGXPUHSC-IBGZPJMESA-N 426.948 4.033 10 10 IICE Cc1cc(C(=O)N2c3ccccc3C[C@H]2CO)c(C)n1-c1cccc(Br)c1 1146793598 GZCWCCPTHXJWCK-IBGZPJMESA-N 425.326 4.420 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2nc(C3CC3)cs2)NC(=O)OC(C)(C)C)cc1 1147508971 YEJSDDFEVIRYIV-KRWDZBQOSA-N 430.574 4.082 10 10 IICE CO[C@@H](CNC(=O)OC(C)(C)C)CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1152400869 GEOAINDMBZVSLU-GHTZIAJQSA-N 442.556 4.412 10 10 IICE CCOC(=O)c1c(NC(=O)CN(Cc2ccc(N(C)C)cc2)C(C)C)sc2c1CCC2 1167108624 TXYPNLVAEVELFQ-UHFFFAOYSA-N 443.613 4.329 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@@H]1CCCOC1 1178048388 UBTYZNMEEMIXKD-APWZRJJASA-N 435.362 4.028 10 10 IICE C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229782682 YNIOKQHIGZMLJF-VGSWGCGISA-N 429.511 4.279 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC(C)(C)c3ccccc3Br)C2)cc1 1230599998 FGXKLKZRFABCRS-INIZCTEOSA-N 446.389 4.313 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@]12CCN(C(=O)OC(C)(C)C)C2 1251990018 RARNKIXCJVUDPM-DFBJGRDBSA-N 444.620 4.177 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@H](C)[C@@H]3C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290415572 TWQRSDLQFQDRKU-GJZGRUSLSA-N 428.581 4.122 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC3(CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1305501325 USQWMSYXKKWWAQ-GOSISDBHSA-N 429.584 4.442 10 10 IICE C[C@@H](NCCC(=O)NC(c1ccccc1)c1ccccc1)c1ccc(N2CCOCC2)cc1 1307643722 VORFTQTYVFEMCT-JOCHJYFZSA-N 443.591 4.470 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCO2)n1Cc1ccsc1Br 1314752865 DOVXBHOXAJZDAK-MRXNPFEDSA-N 449.374 4.344 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1CCCCCN1CCCCC1 1314752977 IQVRHULUYXKYAK-QFIPXVFZSA-N 441.620 4.170 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@@H](C)C2 1355244938 IFVIKCLDGHWCMW-CABCVRRESA-N 444.553 4.018 10 10 IICE COc1ccc(Oc2ccc(C(=O)N3CCCN(c4ccc(OC)cc4)CC3)nc2)cc1 1355456658 IOVDLFYGSPMROT-UHFFFAOYSA-N 433.508 4.244 10 10 IICE COc1ccc2c(c1)CC[C@@H](C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 1361062926 IJLHOTCGBFUEFH-MOPGFXCFSA-N 430.495 4.187 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NC[C@H]1OCc2ccccc21 1440132751 DPVADRRLWXKEKJ-LVSMMTLPSA-N 444.603 4.117 10 10 IICE C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CCN1CC(=O)NCc1ccc(N(C)C)cc1 1459786601 MHNYRIZIFMZDGK-PIKZIKFNSA-N 427.592 4.448 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cnc(CNC(=O)OC(C)(C)C)s2)cc1 1463773670 FGCDWMKURRCZSM-UHFFFAOYSA-N 432.590 4.286 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)cc1F 1464540885 HROSECJKSKCVGK-OAQYLSRUSA-N 427.520 4.042 10 10 IICE CCN1CC[C@H](Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)C1 1502276255 ODUPFQREZNDYPY-QFIPXVFZSA-N 438.664 4.445 10 10 IICE COCC1(C)CCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CC1 1518774593 STURADVBVGTCHB-UHFFFAOYSA-N 448.615 4.324 10 10 IICE CCOc1ccc([C@@]2(C(=O)N[C@@H]3CCN(c4ccc(OC)cc4)C3)CC2(Cl)Cl)cc1 1531740750 JQDBVZIBQMJIQL-VGOFRKELSA-N 449.378 4.304 10 10 IICE Cc1cnc([C@@H](C)CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)s1 1538119370 RGQFPBVIGUWHQQ-PFSWGADMSA-N 449.598 4.102 10 10 IICE Cc1cc(C(=O)NCCCN2CCC(C)CC2)c(C)n1-c1ccc(Br)cn1 1539075013 CPMPMEQRKOGTDG-UHFFFAOYSA-N 433.394 4.103 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)c(C)n1-c1ccc(Br)cn1 1544308745 QCBKZJOGNOQFDJ-UHFFFAOYSA-N 445.336 4.387 10 10 IICE CC(C)(C)OC(=O)C1(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CCCCCC1 1544630051 IPXWAKVTAVIPLZ-UHFFFAOYSA-N 448.579 4.085 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1Cc1cccc(C(F)(F)F)n1 1554175711 UGORIPFOPZKKHY-GOSISDBHSA-N 447.461 4.324 10 10 IICE CSCCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1555934055 OANOMLGEELPTOZ-FQEVSTJZSA-N 429.634 4.162 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CCOCC1 1584368010 WVRCUMJFZQVELO-IBGZPJMESA-N 435.362 4.028 10 10 IICE CCOc1cccc(N2CCN(C(=O)c3cc(C)n(-c4cc(C)cc(C)c4)c3C)CC2)n1 1585381691 UZLZZHIUUGUGPJ-UHFFFAOYSA-N 432.568 4.467 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnc(-c4c(F)cccc4F)s3)C2)cc1 1598364888 YJBAHEDTBCNZIX-CQSZACIVSA-N 429.492 4.353 10 10 IICE Cc1cc(CCNc2ncnc3c2c(Br)nn3C)c(C)n1-c1ccccc1 1612691802 WSUQLODGSJYXCX-UHFFFAOYSA-N 425.334 4.188 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)C1 1612775998 GMYAMWUAROGJAY-FQEVSTJZSA-N 448.615 4.116 10 10 IICE Cc1cc(CC(=O)N2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1625068480 PGFNVUXOPRBQLF-REWPJTCUSA-N 437.584 4.495 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 1626339827 XNLFZHNRSXVBKG-JOCHJYFZSA-N 444.579 4.034 10 10 IICE CC(=O)c1cncc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)c1 1627271895 LFFQZFNUAINCJX-UHFFFAOYSA-N 436.269 4.009 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(C(F)(F)F)cc2N)c1 1627440559 PEJASFIAMFFOCR-UHFFFAOYSA-N 442.441 4.032 10 10 IICE Cc1cc(OCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc(C)c1Cl 1630257491 YGZOTSZYHXCECB-GOSISDBHSA-N 437.367 4.475 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCC(=O)c2sc(C(C)C)nc2C)CCCC1 1633590027 WQKJCONIHRCVNC-UHFFFAOYSA-N 439.581 4.416 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(Cl)cc(Br)c3O)CC2)cc1 1638271274 NVPOTSGRKZJMFN-UHFFFAOYSA-N 439.737 4.216 10 10 IICE C[C@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@H](C(F)(F)F)[C@H]1C 1653473468 FLKODDRFLSGDND-VPZZIHKRSA-N 430.426 4.062 10 10 IICE Cc1cc(Br)c(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)s1 1674529710 HVLIKFITYUHAIG-HNNXBMFYSA-N 439.375 4.415 10 10 IICE Cc1ccc(C[C@H](CO)NC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1680563107 PBOGSWBFGODMSY-WIYYLYMNSA-N 429.992 4.288 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCO[C@H](c4ccnn4C)C3)cc2Cl)C1 1681828607 VOAAPUXDQINLRH-CDMIOBSGSA-N 445.995 4.029 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](CO)c3c(F)cccc3F)cc2Cl)C1 1686268965 JBEYGSJAFUSBGE-KUHUBIRLSA-N 437.918 4.387 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(-c2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1709471664 DKNIIIFHEBVFHX-HXUWFJFHSA-N 434.588 4.097 10 10 IICE CC[C@H](C)[C@@](C)(O)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1726833897 SLBMAGONLZKPLT-DFBJGRDBSA-N 441.620 4.068 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@](C)(OC)C1CC1 1727000468 DIHMKNRIGIOOPT-MZNJEOGPSA-N 445.583 4.081 10 10 IICE COC[C@@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1730479534 JCVHGLRQFCEWOJ-AZUAARDMSA-N 443.592 4.279 10 10 IICE CC[C@H](C)c1nnc(N2CCC([C@@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)cc1C 1743642802 YPHSGCUTBQODJQ-PGRDOPGGSA-N 425.621 4.467 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCOC1 1768137519 CLXVCCWRRGXJNC-OAQYLSRUSA-N 437.588 4.252 10 10 IICE CCc1ccc(-c2ccc(C=C3SC(=S)N([C@@H](CCC(=O)O)C(=O)O)C3=O)o2)cc1 2040480456 QLZUQKHPLKDSDM-HNNXBMFYSA-N 445.518 4.028 10 10 IICE Cc1ccc([C@H](C2CCC2)n2nc(C(C)C)c(CN)c2I)c(O)c1 2078984403 SNCMKMWGBRBPLH-SFHVURJKSA-N 439.341 4.473 10 10 IICE COCCNCc1ccc(N(Cc2ccccc2)[C@@H](C)C(C)(C)O)cc1Br 2169926487 LVFWZSPIVRSHHB-KRWDZBQOSA-N 435.406 4.351 10 10 IICE C[C@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S 2314836468 FPIQREHFMBXADA-LLVKDONJSA-N 447.925 4.477 10 10 IICE COc1ccc([C@@H](CN2C(=O)C(=Cc3ccc(F)c(F)c3)SC2=S)N(C)C)cc1 2323879829 JSUDTCJEPHCMEG-GOSISDBHSA-N 434.533 4.478 10 10 IICE O=C(COc1ccc(/C=C2\SC(=S)NC2=O)cc1)Nc1cccc(C(F)(F)F)c1 15055972 RKMLUZZOENPHGQ-NVNXTCNLSA-N 438.452 4.212 10 10 IICE COCCNC(=O)c1cccc2c1N[C@H](c1cc(Br)ccc1O)[C@H]1CC=C[C@@H]21 20696389 NBWONPMIJBUYLO-HTZUNMPGSA-N 443.341 4.357 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(C3CC3)[C@@H](C)c3cccc(C(F)(F)F)c3)nc12 72018890 AHJLIFQAUBJMNX-ZDUSSCGKSA-N 448.445 4.356 10 10 IICE CCOC(=O)c1ccc(N/C=C2\SC(=S)N(CCOc3ccccc3)C2=O)cc1 102781434 XDWYSIRWWXNRDX-JXAWBTAJSA-N 428.535 4.056 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc4c(c3)OCCO4)no2)C1 558298672 QBCBWJWWWWJZQM-UHFFFAOYSA-N 430.508 4.277 10 10 IICE CC(C)(C)c1nc2ccc(S(=O)(=O)Nc3cccc(N4CCOCC4)c3)cc2s1 743254156 LGWQCCMNTBWZFQ-UHFFFAOYSA-N 431.583 4.231 10 10 IICE C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1cc(Br)c(F)cc1O 756760955 KULQZSMYSRHRNT-VFZGTOFNSA-N 433.115 4.441 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCN(C(=O)OC(C)(C)C)C[C@H]3C)ccc21 762600663 ZTIGQYXIFSFFLC-IERDGZPVSA-N 443.588 4.280 10 10 IICE c1cc(COc2ccc(CNCc3ccc(N4CCN(CC5CC5)CC4)cc3)cc2)ccn1 768669073 CABFNLUBJUAWEB-UHFFFAOYSA-N 442.607 4.482 10 10 IICE COc1cc(C)c(S(=O)(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1C(C)C 788598730 JLZWDHOOCRSWBW-SFHVURJKSA-N 432.586 4.003 10 10 IICE C[C@H](NCc1ccc2c(c1)CCN2Cc1ccccc1)c1cccc(NS(C)(=O)=O)c1 796282999 ONLYSIVLYINEHI-IBGZPJMESA-N 435.593 4.472 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C[C@H]2CCC(F)(F)C2)NC(=O)OC(C)(C)C)cc1 797892394 FVRHONHYFNXXSD-CRAIPNDOSA-N 425.520 4.260 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccccc1C(=O)N1CCCCC1 806146231 LOWWAUYNLAHKRK-UHFFFAOYSA-N 432.318 4.103 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccccc3Cl)cs2)cc1 917845032 MIDNDZXUUSQTPD-UHFFFAOYSA-N 442.971 4.058 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@@H]1COc2ccc(Cl)cc2C1 1126582294 LAJRYRNFKJVWSP-RDJZCZTQSA-N 436.886 4.278 10 10 IICE Cc1ccccc1-c1noc(C)c1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549636 QRALZMUKBBFYJD-UHFFFAOYSA-N 427.451 4.003 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3n[nH]c4cnc(Br)cc34)ccc21 1132517703 CGHSXEMOFWCUMW-UHFFFAOYSA-N 442.317 4.191 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1 1136408788 ADAVWAMDPVCNCO-NBGIEHNGSA-N 429.564 4.401 10 10 IICE CN(C)c1ccc(CN(C)c2nc(C(F)(F)F)ccc2I)cc1 1161993584 DNLDITKKKUDASO-UHFFFAOYSA-N 435.231 4.407 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3c(C(F)(F)F)cnn3C)cc2Cl)C1 1227209699 VRACATYDFRGPDF-ZDUSSCGKSA-N 443.901 4.328 10 10 IICE C[C@H](c1nc2ccccc2s1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229773227 SQUWEDOKFGGYOS-CQSZACIVSA-N 446.523 4.314 10 10 IICE COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)CC2 1230199250 ALBMXJIVKNPPQX-QZTJIDSGSA-N 425.573 4.338 10 10 IICE C[C@H](NC(=O)c1cnc(-c2c(F)cccc2F)s1)c1ccc(N2CCOCC2)cc1 1264822482 SGMAOXOFSVALBD-AWEZNQCLSA-N 429.492 4.416 10 10 IICE COCCCCn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1301572911 WVPQYZNTSFZSAN-UHFFFAOYSA-N 429.609 4.019 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1C[C@@H](C)[C@@H](F)C1 1304238169 LJIQXHGMHPDFCM-BEFAXECRSA-N 428.943 4.210 10 10 IICE CN(Cc1cccc(F)c1)C(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1348571549 AKEOMCBAZDCTSH-LDADJPATSA-N 432.517 4.215 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cnn(-c4ccccc4)c3C(F)F)CC2)cc1 1351111962 XTTNRIWMABJSMH-UHFFFAOYSA-N 426.467 4.171 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1 1360273111 CJIUUBWDIIGBPT-UHFFFAOYSA-N 429.499 4.378 10 10 IICE Cn1cc(CCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc21 1361062934 ILWCSPFOPLQFHV-SFHVURJKSA-N 427.495 4.498 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@H](c2ccnn2C)C1 1361098079 NHDGUVWZVKPGCE-NRFANRHFSA-N 449.647 4.407 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc2cc(Br)sc2[nH]1 1444668632 YBXOIRMDZJNCQO-UHFFFAOYSA-N 448.386 4.131 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3=Cc4ccccc4O[C@H]3C(F)(F)F)CC2)cc1 1446418867 KGCXUKUNMHZSOJ-OAQYLSRUSA-N 432.442 4.141 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)C1CCOCC1 1447025279 HSSYDHBJIPGRSJ-QHCPKHFHSA-N 426.557 4.306 10 10 IICE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1463780026 UVCZNOYWFJODQY-ICFOKQHNSA-N 434.458 4.484 10 10 IICE CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C 1465195868 SRDHUOUZFYWKNP-MRXNPFEDSA-N 434.964 4.425 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1ccc(NS(=O)(=O)C(F)(F)F)c(C)c1 1467496837 BTKALTQPONNVMK-UHFFFAOYSA-N 444.475 4.405 10 10 IICE COCc1nc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)sc1C(=O)OC 1467957064 RXECHIUWLDWAQR-UHFFFAOYSA-N 427.526 4.353 10 10 IICE COc1ccc(C(=O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)CC2)cc1 1470556398 UEVTVAMYUSQSEZ-IBGZPJMESA-N 437.584 4.305 10 10 IICE Cc1csc([C@H](C)Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1492638983 KXFSWCZFMOKGDA-CRAIPNDOSA-N 427.574 4.083 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CCS1 1514154999 HERUBHKBSRTDCA-LEWJYISDSA-N 429.634 4.274 10 10 IICE COc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c2ccccc2n1 1516256908 QZACRDBQBTXNRC-UHFFFAOYSA-N 445.441 4.029 10 10 IICE C[C@@H](NC(=O)c1ccccc1CNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1526966953 BSQFYMLOWRDPCK-GOSISDBHSA-N 439.556 4.039 10 10 IICE COc1ccc(-c2cc(C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)no2)cc1 1528583666 PEMAZPLNMATGNL-UHFFFAOYSA-N 443.450 4.350 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(O[C@@H]2CC2(F)F)cc1 1533330052 VDGMJPCEOMXEEY-DNVCBOLYSA-N 438.421 4.473 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)CCCN3C(=O)c4ccccc4C3=O)c2C)c1 1535136370 MFZNFSYKJDAIIX-UHFFFAOYSA-N 429.520 4.095 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C(=C/c3ccc(F)cc3)c3cccs3)cc2)CC1 1536924334 GAYNIDHDDMESQB-HAVVHWLPSA-N 435.568 4.496 10 10 IICE C[C@@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)CCC1=O 1539360776 HAKPITNIENXGDH-CHWSQXEVSA-N 427.302 4.103 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@H](N(C)C(=O)OC(C)(C)C)C1 1542646400 OBWBISFWVQZQDJ-FQEVSTJZSA-N 439.556 4.378 10 10 IICE CNC(=O)C[C@@H](C)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 1543571767 KHHSTICTDFNHOS-KAKMCVKYSA-N 442.563 4.042 10 10 IICE COCC1=CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCCCO)CC1 1555317041 RMOUONQVPZJBQK-UHFFFAOYSA-N 449.599 4.298 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CCSCc1nc(O)c2ccccc2n1 1557063201 IEZLEYMXWXUCFQ-KRWDZBQOSA-N 438.597 4.081 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3OCc3c(C)noc3C)C2)cc1 1557133798 YCSNHZNLLUECDP-IBGZPJMESA-N 435.524 4.135 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@](CO)(c3ccccc3)C2)c(C)n1-c1ccccc1 1565162284 RGBWIVZNABQCDV-HHHXNRCGSA-N 431.580 4.372 10 10 IICE CSC[C@H]1CCCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)C1 1569556316 SNTKHNINDXFRAA-VUVCFOEZSA-N 438.615 4.019 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](C(=O)OC(C)(C)C)C(C)C)CCCC1 1584899104 QJHPKZVGOFNJNH-HXUWFJFHSA-N 428.573 4.259 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(Br)cc3C(F)(F)F)C2)cc1 1587114505 RYLIVDHESHQZJB-ZDUSSCGKSA-N 443.263 4.485 10 10 IICE COC(=O)CC1(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CCCCC1 1587323552 CWYQZACYYMNFBG-UHFFFAOYSA-N 448.361 4.247 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(CN3CCCCC3)o2)cc1 1598290953 ITIAJSJMSUHFHO-QFIPXVFZSA-N 425.573 4.153 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@]1(C)C[C@H](NC(=O)OC(C)(C)C)CCO1 1624553762 DJDAMVDVGGXMIW-NLFFAJNJSA-N 445.604 4.098 10 10 IICE CN(C)c1ncc(Br)c(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n1 1627006580 RLNBQIRBCHITEW-UHFFFAOYSA-N 446.393 4.004 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-c2ccc(C=O)cc2)cc1 1632701872 PNMAHQBUOICMRP-UHFFFAOYSA-N 437.879 4.341 10 10 IICE Cc1ccc(N2C(=O)CC[C@@H](C(=O)NCc3cc(O)ccc3O)[C@H]2c2cccs2)cc1 1637122607 JNYPYYYKBVQJED-XXBNENTESA-N 436.533 4.268 10 10 IICE CN1C(=O)C[C@@H](C(=O)NCc2ccc3cccnc3c2O)[C@@H]1c1ccc(Cl)c(Cl)c1 1638573407 VVBWRMNTPIIMRY-QRWLVFNGSA-N 444.318 4.083 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1 1640552402 CFNRZURZCLZPIQ-LJQANCHMSA-N 429.973 4.444 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Cn2c(-c3cccc([N+](=O)[O-])c3)noc2=O)c1C 1641076504 OSCOAZAJFBYJCD-UHFFFAOYSA-N 432.436 4.010 10 10 IICE CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N1Cc2cccc(O)c2C1 1650672864 OZELDAWBTSGMEP-QGZVFWFLSA-N 439.364 4.093 10 10 IICE Cc1ccc(N(C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1Cl 1652848060 YTQHDCBXJCWXHV-IRXDYDNUSA-N 433.955 4.154 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@@H](C(=O)N(C)c3ccccc3)C2)c(C)n1-c1ccccc1 1674924975 XFTBHADFLVRKML-HSZRJFAPSA-N 444.579 4.331 10 10 IICE C[C@@H]1[C@H](NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)CCCN1C(=O)OC(C)(C)C 1683457386 YCTADVQFEYAVFF-WIYYLYMNSA-N 430.593 4.216 10 10 IICE Cc1cc(CNC(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1 1684479043 QQVMPDUWRAKAHG-SFHVURJKSA-N 439.581 4.400 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)NCc2cc(Cl)ccc2O)CC1 1685758788 UOOBUJYYZRCTSL-HNNXBMFYSA-N 425.957 4.272 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)C[C@H]2CCCCO2)cc1 1695624203 JRGUYNZNSWAJKM-XMMPIXPASA-N 448.615 4.164 10 10 IICE CCN(CCn1c(C)nnc1N(C)Cc1ccc(N2CCCC2)cc1)CCC(F)(F)F 1695742881 GSIBCSSQKUNVAP-UHFFFAOYSA-N 438.542 4.097 10 10 IICE C#C[C@H](C)N(C)c1nnc(Cc2c(F)cccc2F)n1CCCSc1nccs1 1705496332 DSVWYXIJUJRFSM-AWEZNQCLSA-N 433.553 4.244 10 10 IICE CC(C)(C)Cc1nnc(N2CCCC2(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1706137688 URZKULVCAMSCLC-UHFFFAOYSA-N 429.584 4.270 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](C)C1 1728197327 AMDUXJIJFDONFR-SFHVURJKSA-N 434.588 4.115 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCCC2)n1Cc1nnc(C(C)(C)C)s1 1729420530 SQKVIIKBNKRNQQ-UHFFFAOYSA-N 426.590 4.475 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CC[C@@H]1CCO[C@H](C)C1 1742940762 GVULNBWHYYLLDW-NHCUHLMSSA-N 441.620 4.080 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CC1 1748469086 OANCWIFHOMIAAY-FQEVSTJZSA-N 432.619 4.308 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N(C[C@H]1CCOC1)C1CC1 1751432565 JRQUWNOGBHXOFZ-LJQANCHMSA-N 425.621 4.295 10 10 IICE Cc1ccc(-c2nnc(N3C[C@@H](C)OC(C)(C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1751481812 OJPVUIOAMXIFTH-MRXNPFEDSA-N 427.524 4.104 10 10 IICE CO[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1771334494 XCYIRZBJLPMZMX-QFIPXVFZSA-N 425.621 4.376 10 10 IICE CCOC(=O)N1CCC(N2C(=O)/C(=C\c3cccc(OC(C)C)c3)SC2=S)CC1 1858591546 SLQGPZWNWAKSGK-QGOAFFKASA-N 434.583 4.296 10 10 IICE CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(Cc2ccc(N)cc2)cc1 1866114037 HPTMVCYMLPTLHG-VWLOTQADSA-N 426.520 4.027 10 10 IICE COc1ccc(N2CCN(Cc3cc(=O)c(OCC=C(C)C)cn3CC(C)C)CC2)cc1 1870610585 MTNFCVACZCWISE-UHFFFAOYSA-N 439.600 4.180 10 10 IICE Cc1cc(O)c([C@@H](C2CC2)n2nc(C(F)F)c(CO)c2I)cc1C 2079845139 QLXWYERGHXNKCP-OAHLLOKOSA-N 448.251 4.239 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C(C)C)c(C(=O)O)c2I)cc1C 2079957478 PJMVITUKVKAGGF-NSHDSACASA-N 428.270 4.241 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C3CCC3)c(CN)c2I)cc1C 2079998627 RZBYJFKBDIBOPB-LBPRGKRZSA-N 425.314 4.146 10 10 IICE C[C@@H](O)c1ccc(N2CCN(Cc3ccccc3)CC(F)(F)C2)c(Br)c1 2093157020 YSHWLNPFWZBYOH-OAHLLOKOSA-N 425.317 4.460 10 10 IICE Cc1ccc(CN[C@@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)c(O)c1Br 2352691467 GASRIXIQHDPCBS-FOIQADDNSA-N 425.367 4.485 10 10 IICE COc1ccc([N+](=O)[O-])cc1-n1c(C)cc(/C=C2\NC(=O)N(c3ccccc3)C2=O)c1C 1106133 OHAVXDVESAJDJO-UNOMPAQXSA-N 432.436 4.108 10 10 IICE CCOc1ccc(NC2=NC(=O)/C(=C\c3ccc(I)o3)S2)cc1 6388365 DSIHTVGCDDZZCL-UKTHLTGXSA-N 440.262 4.365 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459460 WYXNXVSMICNEOM-RNHFSVANSA-N 435.568 4.299 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C/c3ccccc3O)SC2=S)cc1 15040051 CPVYOZBUJVCWIE-RGEXLXHISA-N 442.562 4.411 10 10 IICE CCN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1cc(C)c(C)cc1OC 586215422 YDNCMMAUPHKCIF-UHFFFAOYSA-N 449.528 4.303 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H]1c1ccc(I)cc1 779525628 MJUMVVBSWTYHLF-WJXUGBSRSA-N 435.261 4.079 10 10 IICE CN(C)c1ccc(CNC(=O)Nc2ccc3c(c2)CCC(=O)N3CC(F)(F)F)cc1F 782080221 AKQJJWJRXQUYMU-UHFFFAOYSA-N 438.425 4.055 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCOC3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802683043 CTECZVJJODPXAS-IFMALSPDSA-N 435.572 4.004 10 10 IICE COc1ccccc1[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccco1 806993646 DUQLBFRFGFQDPX-IBGZPJMESA-N 431.286 4.345 10 10 IICE C[C@H]1CN(c2ccc(CNS(=O)(=O)Cc3ccc4ccccc4c3)cc2F)C[C@H](C)O1 809808975 DLDIEFCYSQOTRA-ROUUACIJSA-N 442.556 4.212 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(Br)cncc3s2)cc1 1130745424 VYSFCGHMSHXDJW-UHFFFAOYSA-N 434.359 4.276 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H]2CS(=O)(=O)Cc3ccccc32)c1 1131318119 WUXHDIXFDFXNHJ-OAQYLSRUSA-N 428.941 4.147 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1135744382 AUDJIRGTFOMDOB-NQIIRXRSSA-N 445.604 4.396 10 10 IICE C[C@@H](NC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1)c1ccc(N(C)C)cc1 1138364148 SQCRCSVPWIAQCM-MRXNPFEDSA-N 449.642 4.306 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1 1142235626 SUFREXDFJYUVBR-SFHVURJKSA-N 439.556 4.039 10 10 IICE C[C@@H](NC(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 1142503846 GMRQHIXSNOPYSL-XLIONFOSSA-N 433.593 4.030 10 10 IICE CCN(Cc1cc(Br)ccc1O)Cc1cc(OC)ncc1Br 1167512416 MMPBEFLTPKDQAQ-UHFFFAOYSA-N 430.140 4.343 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4ccncc4)n3CCC=C(C)C)CC2)cc1 1300247945 SMJHOFCHTJAELK-UHFFFAOYSA-N 446.599 4.346 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CC[C@H](CO)O1 1306795336 HTGDTSGIKSBTMA-FCHUYYIVSA-N 437.588 4.129 10 10 IICE COc1ccc(N(CC(=O)N2CCN(c3ccccc3F)CC2)Cc2cccs2)cc1 1307529395 NLLRPQYKLFZZMN-UHFFFAOYSA-N 439.556 4.251 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(C(=O)OC(C)(C)C)c3)cc2F)C[C@@H](C)O1 1350934100 YFCFHZHHWZQHDP-CALCHBBNSA-N 442.531 4.325 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(-c4ccccc4Cl)on3)cc2F)CC1 1352959093 AGBUUFQFKJXUGV-UHFFFAOYSA-N 442.922 4.206 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C(F)(F)c3cc(F)cc(F)c3)cc2F)C[C@@H](C)O1 1355131080 SNUTUQWVXYGQOU-BETUJISGSA-N 428.401 4.126 10 10 IICE O=C(C[C@H]1CCC[C@H](C(F)(F)F)O1)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1360045351 CAISPXVGBLTRKW-IAGOWNOFSA-N 436.421 4.263 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc([C@@H](C)NC(=O)OC(C)(C)C)cc3)CC2)cc1 1435578451 RPQYYAOGJBYJNR-GOSISDBHSA-N 439.556 4.243 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](CNC(=O)c3sccc3-n3c(C)ccc3C)C2)c1 1446085335 HUAKYNIGSHOERL-SFHVURJKSA-N 439.581 4.429 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)n(-c2ccccc2Cl)n1 1446815457 LDWKNJWAWJHXPI-UHFFFAOYSA-N 448.306 4.009 10 10 IICE CC[C@]1(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)CCNC1=O 1457573266 INPXRWGGUHVIGS-AVRDEDQJSA-N 433.474 4.214 10 10 IICE COC1CCN(c2ccc(CN3CC[C@H]4CC[C@@]43CNC(=O)OC(C)(C)C)cc2)CC1 1460905317 INZVTHWFDJGMJJ-CJFMBICVSA-N 429.605 4.181 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(C/C=C\c3ccccc3)CC2)cc1 1465018432 XWPVKRDPSXDMEU-TWGQIWQCSA-N 441.575 4.307 10 10 IICE Cc1cc(N(C)C)cc(C)c1CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1465950797 BPNCAZNTJUOETO-HXUWFJFHSA-N 429.992 4.052 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1ccccc1C(F)(F)F 1466398447 NHALJZNOOJFPTM-LBPRGKRZSA-N 445.821 4.034 10 10 IICE CN(Cc1ccccc1CNC(=O)c1ccc(N=NC(N)=O)cc1)C(=O)OC(C)(C)C 1469789284 AKBLZDNEOLIIKK-UHFFFAOYSA-N 425.489 4.146 10 10 IICE C[C@H](NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)c1ccc(-n2cccn2)c(F)c1 1470299247 BBVRZKPAARVVSV-PXNSSMCTSA-N 438.503 4.169 10 10 IICE COc1cnc([C@H]2CCCN2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)nc1O 1472257826 CIOQNXCELZMGDO-LJQANCHMSA-N 440.931 4.158 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC(Cl)=C(Cl)C2)cc1F 1503393229 MHLOXNHKUGVAPZ-UHFFFAOYSA-N 447.345 4.493 10 10 IICE CON(C)c1nnc(-c2cc(C)nc3ccccc23)n1CCCSc1nccs1 1505089724 HRMRZHKSRJFYBJ-UHFFFAOYSA-N 426.571 4.438 10 10 IICE Cc1cccc(-c2nnc(N(C)CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)n1 1511073891 LHRGGSKOPGCTDH-UHFFFAOYSA-N 434.588 4.016 10 10 IICE CNC(=O)c1cc(Cl)ccc1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1525363580 MKKOMRHKTBMWPF-UHFFFAOYSA-N 425.916 4.180 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(Cl)cc4Cl)n3)CC2)cc1 1534016710 FBJRZNOCYPSCSK-UHFFFAOYSA-N 445.350 4.459 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)ccc1NC(=O)OC(C)(C)C 1539234801 GPMLMUBNXAXHPL-QFIPXVFZSA-N 440.588 4.441 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCN(C(=O)c4ccccc4)C3)cc2Cl)C1 1539911873 DCVYQPPDRAWRJA-WIYYLYMNSA-N 439.987 4.355 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(C)cc(C)c3Br)CC2)c(OC)c1 1543631419 BLIGHPPRDNDNOZ-UHFFFAOYSA-N 433.346 4.046 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1[C@H]1CCCOC1 1545632313 IBZPYNFKHJPPPQ-SFTDATJTSA-N 445.991 4.210 10 10 IICE CCN(CC)c1nnc(-c2ccc3c(c2)OCCO3)n1CCCSc1nccs1 1547456507 GLVHRVYJVWMOEN-UHFFFAOYSA-N 431.587 4.201 10 10 IICE O=C(c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F)N1Cc2cccc(O)c2C1 1558036354 YJZZWUIHUMZMOL-UHFFFAOYSA-N 443.212 4.455 10 10 IICE CCN(CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1)c1ccc(OC)cc1 1559621260 OUNPVJACBKRFRB-UHFFFAOYSA-N 437.462 4.016 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)c2ccc(F)cc2OC(F)F)cc1 1564496439 QRWHOAWAWHZXOH-AWEZNQCLSA-N 425.451 4.275 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)[C@@H](c2ccccc2)C1 1570154902 ZZKHKVVMUCBGLF-LJQANCHMSA-N 437.500 4.283 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)C1 1597088746 AGFCALLOSKGZTO-PZJWPPBQSA-N 446.588 4.327 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2C)c1 1613326503 HTIHHZXCXFJYKC-UHFFFAOYSA-N 426.494 4.276 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)C1 1614954109 VMCDGXMMLNBGIB-GOSISDBHSA-N 434.588 4.115 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1615770686 AZXIILMVDXODRP-OALUTQOASA-N 442.627 4.183 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@H](CC(=O)NCc3ccc(F)cc3)C2)c1O 1618867031 WAWMGFLGGNBOAQ-QGZVFWFLSA-N 432.923 4.306 10 10 IICE Cc1ccc(C(=O)Nc2ccc(CN3CCOC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1625230583 UFMIUCSUNORQHF-UHFFFAOYSA-N 431.492 4.420 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(COc3cccc(C(C)=O)c3)on2)cc1F 1627604179 BOAORUNCQZTBPG-UHFFFAOYSA-N 439.487 4.372 10 10 IICE Cc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc(O)c2ccccc12 1630280800 RCLORYJRDPJDSD-OAHLLOKOSA-N 427.451 4.249 10 10 IICE CCc1csc([C@H](C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1630684006 MCSDTEIGIHXXGW-KPENOIPVSA-N 449.598 4.313 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C[C@H](C)C3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1 1632612021 QXSPTOZDAYMJOD-AZUAARDMSA-N 445.604 4.063 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C1CCN(C(=O)c2cccnc2)CC1 1632697190 HNIDSMRXLUULJW-HXUWFJFHSA-N 443.547 4.429 10 10 IICE CC[C@H]1CN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)C[C@@H](CC)O1 1643170983 LPACSVXVMFRGDC-VCOITCSOSA-N 438.640 4.146 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@H](CC(C)C)C(N)=O 1648494026 RHXMBSYXTPTVAD-MOPGFXCFSA-N 435.490 4.446 10 10 IICE Cc1ccccc1NS(=O)(=O)c1cc(C(=O)N2Cc3cccc(O)c3C2)ccc1Cl 1650674468 DQAULESRXYGAAZ-UHFFFAOYSA-N 442.924 4.311 10 10 IICE COc1ccc(N(CC(=O)N2CCCN(Cc3ccc(C)cc3)CC2)C(C)C)cc1F 1652880586 IDYXMOHKZFSENZ-UHFFFAOYSA-N 427.564 4.092 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)N(C)C)cc1 1653421828 SQKFDUVRESIUEU-SFTDATJTSA-N 448.652 4.143 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H]2CCCn3nccc32)sc(C)c1-c1ccccc1 1654610985 RNMFCUINYVVROV-KRWDZBQOSA-N 438.553 4.160 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC2(CCCN(C(=O)OC(C)(C)C)C2)C1 1673743935 IVCPSXBHCRVKRC-LJQANCHMSA-N 444.620 4.035 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(c3nc4ccccc4o3)CC2)N(C)C)cc1 1676653528 QEHFHODAXWBHCG-QFIPXVFZSA-N 435.572 4.086 10 10 IICE O=C1C[C@H](NC(=O)N(Cc2ccccc2O)C2CCCCC2)CN1c1c(F)cccc1F 1679599969 XTAUNWXJJKGQST-KRWDZBQOSA-N 443.494 4.320 10 10 IICE C[C@]1(c2ccccc2)CCCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1681849755 IIRCSSJHQIISJI-VWLOTQADSA-N 443.538 4.455 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC(=O)NC 1693898954 RFUIVPXGYHCRHE-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCCC1 1696412096 ZHIARVYPSNHUFB-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1727216114 FRKGOBUENHIRPT-KRWDZBQOSA-N 444.599 4.076 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)(C)CC1 1728258516 VSLMLEVFNBJDCO-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCSc1cc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)ccn1 1729252863 CCVFQJDCCOVPQU-HXUWFJFHSA-N 439.585 4.417 10 10 IICE CCC(CC)c1cc(Cn2c([C@@H]3CCOC3)nnc2N(C)Cc2ccccc2O)on1 1762176618 DTOBCTAFDBRKOT-GOSISDBHSA-N 425.533 4.064 10 10 IICE C[C@H]1C[C@@H]1Cn1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1762764802 KCLHHVIXOUAWLN-UHOSZYNNSA-N 441.576 4.348 10 10 IICE CCO[C@]1(c2nnc(N3CC[C@@H](C)[C@@H]3C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1765869135 KAXMEVVTLGWWNV-OHUGHZGNSA-N 441.620 4.059 10 10 IICE CCCc1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1Cc1ccc(C)cc1 1862307152 PAPNNAKWZYYEIC-UHFFFAOYSA-N 432.568 4.163 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NCc3ccccc3F)C(=O)N(C3CC3)C2=O)cc1 1873167127 SXCNLEQSYIWPRE-UHFFFAOYSA-N 429.495 4.265 10 10 IICE Oc1c(Br)cccc1CN[C@H]1CN(Cc2ccccc2)C[C@H]1C(F)(F)F 1878710429 OFHSUPFPGZKEII-WBVHZDCISA-N 429.280 4.307 10 10 IICE O=C(O)CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1ccc(O)c(O)c1O 1951735635 POYHNMNPVQPXNE-HXUWFJFHSA-N 449.459 4.248 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010404792 VJMOMDRUCRPOLA-RBUKOAKNSA-N 431.537 4.036 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C(C)C)c(CO)c2I)c(O)c1 2080001299 GRASLDGZNDCWEP-QGZVFWFLSA-N 444.313 4.063 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1O 2227749815 VSLZOYAVJQHLSN-OLZOCXBDSA-N 429.355 4.041 10 10 IICE COc1ccc(Br)c(CNCC2(CNC(=O)OC(C)(C)C)CCCC2)c1O 2236054043 DJLSPTLDSKIEEO-UHFFFAOYSA-N 443.382 4.338 10 10 IICE COc1ccc(Br)c(CN[C@H]2CN(C(=O)OC(C)(C)C)CC23CCC3)c1O 2279123038 RGIYJCUYYYKTRE-INIZCTEOSA-N 441.366 4.043 10 10 IICE O=C(CN1CCN(Cc2c(O)ccc3ccccc23)CC1)Nc1ccccc1C(F)(F)F 20633800 YAALBGUEZANZDK-UHFFFAOYSA-N 443.469 4.321 10 10 IICE COc1cccc(-n2c(C)cc(/C=C3\C(=N)N4C(SC)=NSC4=NC3=O)c2C)c1 96459432 UGBPAYNABKEIDX-BGQXKEBWSA-N 425.539 4.042 10 10 IICE O=C(Oc1ccc(/C=C2/SC(=S)N(C[C@@H]3CCCO3)C2=O)cc1)c1cccs1 102630330 PPJKERXDELZNHS-VUVCFOEZSA-N 431.560 4.348 10 10 IICE Cc1ccn(-c2ccccc2CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n1 435905127 CNMSGHFCUYXVMH-UHFFFAOYSA-N 441.579 4.218 10 10 IICE Cc1cc(N)c(O)c([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1 687810203 DIFVQTVPZZCHBJ-QFIPXVFZSA-N 432.476 4.337 10 10 IICE C[C@H](N[C@@H](C)c1cc(Br)cc(F)c1O)c1cccc(NS(C)(=O)=O)c1 756494785 NSRURCFVHVEQPH-QWRGUYRKSA-N 431.327 4.077 10 10 IICE Cc1nc(C2CC2)oc1C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 759698236 GMJLCSSJBMEPHK-UHFFFAOYSA-N 436.464 4.079 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 764537219 LIPOVBLEQPEDRV-UTKZUKDTSA-N 430.593 4.072 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nc2ccccc2s1 768727645 BKRWAFYAKVDNLQ-GOSISDBHSA-N 449.624 4.389 10 10 IICE Cc1cc(-c2csc(NC(=O)c3nn(C)cc3[N+](=O)[O-])n2)c(C)n1-c1ccc(F)cc1 772906202 IOUGIBDUMGYEOZ-UHFFFAOYSA-N 440.460 4.251 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)cc1 777807077 BQLGYLKFMBUEKU-OAQYLSRUSA-N 436.600 4.241 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H]2CCC3(CCOCC3)[C@H]2O)cc1 802244424 URBGUTCRFCHHNR-MBSDFSHPSA-N 436.556 4.466 10 10 IICE O=C(NCc1cc(Br)ccc1O)N[C@H](c1cccc(F)c1)c1ccccn1 807047648 GVCSCLNQMVZNTO-LJQANCHMSA-N 430.277 4.278 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cc(F)ccc3-c3ccoc3)CC2)cc1 1124515410 DPGJAUJSGYMDQH-UHFFFAOYSA-N 437.515 4.036 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3ccc(Br)c(C)c3)C2)cc1 1129993554 WHZSZDWCSKNAEG-SFHVURJKSA-N 431.374 4.341 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1 1138047186 IQHBXZKAIZMKSR-SIBVEZHUSA-N 429.564 4.086 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1139896741 AKSBBGMTPJDBGX-QGZVFWFLSA-N 427.545 4.282 10 10 IICE CN(C)c1ccc2c(c1)OCCN2CC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 1168858337 AHQVNVCKOJBAQQ-UHFFFAOYSA-N 433.474 4.161 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCO[C@@H](CC)C2)sc(C)c1-c1ccccc1 1169675432 ICTFQLRJPSJTHY-SFHVURJKSA-N 430.570 4.340 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccccc3Cc3ccccc3)CC2)cc1F 1192108106 QTYXHEWYQACLDB-UHFFFAOYSA-N 433.527 4.186 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1COc2cccc(Br)c2C1 1254585015 NJYIFFKOUPWJOE-QGZVFWFLSA-N 444.373 4.194 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC(NCc3ccc(Br)cc3O)CC2)C1 1257753822 FLAZAWCMHSRFBH-UHFFFAOYSA-N 425.367 4.424 10 10 IICE Cc1nnc(N2C[C@@H](C)O[C@@H](C(F)(F)F)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1290755495 PNHVJLPWJRNWPD-OXQOHEQNSA-N 437.510 4.027 10 10 IICE Cc1cc(C(=O)NCC(=O)Nc2cccc(F)c2)c(C)n1-c1ccc(Br)cc1 1292422049 DOWSZQKRFOTWOJ-UHFFFAOYSA-N 444.304 4.364 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1F 1293225331 QQTRDHRGHPYYJA-HNAYVOBHSA-N 437.556 4.049 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N(C)[C@H]3CCN(c4ccccc4F)C3=O)c2C)cc1 1293281875 FWHVJTLEOOINSB-QHCPKHFHSA-N 435.499 4.119 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC(F)(F)F)n1Cc1ccc(N2CCSCC2)cc1 1305378585 XWTHROKVEKROHB-OAHLLOKOSA-N 427.540 4.392 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@H]2CC[C@@H](C(=O)OC(C)(C)C)C2)cc1 1359897450 URKFZWWQJVCXCT-DLBZAZTESA-N 428.495 4.402 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1 1442173965 JXURGBHLGZGUOS-IBGZPJMESA-N 439.556 4.284 10 10 IICE C[C@@H](NC(=O)CCCCCCNC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1442415977 XXVYKKKMWSZXKE-LJQANCHMSA-N 433.593 4.176 10 10 IICE Cc1ccc(C(=O)N[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1450061691 YWQBWHXVQSSENF-SJORKVTESA-N 427.545 4.247 10 10 IICE COC(=O)c1cc(Br)c(CN(Cc2ccc(N(C)C)cc2)C2CC2)cc1OC 1459345685 CRSOPTCSJZWBCK-UHFFFAOYSA-N 447.373 4.475 10 10 IICE COc1ccc(N2CCN(C[C@H]3CC[C@H](CNC(=O)OC(C)(C)C)CC3)CC2)cc1F 1459750371 TXDVZXPTHHELFU-WGSAOQKQSA-N 435.584 4.287 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2nc3ccc(Br)cn3c2F)cc1 1463778532 QRANSRYKVBKGCV-UHFFFAOYSA-N 433.325 4.354 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3csc(C)n3)nnc2N2C[C@@H](C)[C@@H](F)C2)cc1 1501844059 HCKUABMKFATIKH-IERDGZPVSA-N 442.608 4.323 10 10 IICE CO[C@@H]1CCN(c2nnc(COc3cccc(C)c3)n2CCCSc2nccs2)C1 1505104823 GBLVLCACDCBFGX-GOSISDBHSA-N 445.614 4.030 10 10 IICE Cc1ccc(C(C)(C)NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1515146220 JIFLJWFGTNZXDU-PDGQHHTCSA-N 443.569 4.172 10 10 IICE CN1CCCc2cc(Cn3c([C@@H]4CCCCO4)nnc3N(C)CCC(F)(F)F)ccc21 1517411788 LNQODRHFVHSYKZ-IBGZPJMESA-N 437.510 4.339 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Br)cc3cccnc23)cc1 1527594657 CXOJDQBOOYLONB-UHFFFAOYSA-N 428.330 4.214 10 10 IICE Cc1ccnc(Oc2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cc2)c1 1528262082 USMLXAPBYNPEGT-UHFFFAOYSA-N 439.462 4.227 10 10 IICE CCCCc1ccc(N2C[C@@H](C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)CC2=O)cc1 1528554585 JCTPEIHGIMGNJY-OFNKIYASSA-N 449.595 4.096 10 10 IICE COC(=O)Nc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(Cl)c1 1534308611 FFXUDJYSFYZNCI-KBPBESRZSA-N 449.910 4.201 10 10 IICE COc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(OCC(C)C)c1 1534308868 IJWHVHVFYFFFFG-HDICACEKSA-N 444.547 4.413 10 10 IICE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1534309763 YFAJAZNSZAIHHI-QINSGFPZSA-N 438.421 4.281 10 10 IICE Cc1cc(CC(=O)NC[C@H]2CCCN2CC(F)(F)F)c(C)n1-c1ccc(Cl)cc1 1534401535 XMONDONWTBSCMI-LJQANCHMSA-N 427.898 4.433 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C(\C)c3ccccc3OC(F)F)cc2F)CC1 1537535702 TXBSGSNPCMRMGN-SAPNQHFASA-N 447.501 4.289 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H](O)c1ccc(C(F)(F)F)cc1 1542704302 YARNDSDUWYPORT-SFHVURJKSA-N 444.400 4.125 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(Cc2ccc(Cl)cc2)C(=O)C1 1544030166 FDPQQLXTJRKDRU-UHFFFAOYSA-N 449.938 4.045 10 10 IICE COc1ccc(-c2nc(NC(=O)c3cc(C)ccc3-n3c(C)ccc3C)n[nH]2)cc1OC 1544405595 FNRUCNKQNMZHLZ-UHFFFAOYSA-N 431.496 4.457 10 10 IICE CCCN(CC)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1547111590 UMYXYJLIWGAGQC-QHCPKHFHSA-N 441.620 4.013 10 10 IICE CN(C)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)CC2CCC2)cc1F 1552822952 MFORYLGGOWAXFJ-UHFFFAOYSA-N 428.943 4.483 10 10 IICE CCOC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1ccc(OC)c(F)c1 1585305697 INZXBABOJFEZRX-XMMPIXPASA-N 438.499 4.205 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)CCS1 1614227792 RNFLJNIGDBYJOX-HNNXBMFYSA-N 434.660 4.254 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnn(CC)c1 1617127355 WVGZXHGNGONDOV-UHFFFAOYSA-N 447.587 4.090 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCc3cccc4c3OC(F)(F)O4)ccc21 1618137012 KPVQJDZYWBLASG-UHFFFAOYSA-N 430.451 4.199 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@H]2CCc3ccccc3C2)NC(=O)OC(C)(C)C)cc1 1618253113 KRWUBGGFLGBRJP-JTHBVZDNSA-N 437.584 4.240 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cc(O)cc(Br)c2)cc1 1627204527 BVSOXRCWWMPGRK-FQEVSTJZSA-N 433.346 4.042 10 10 IICE Cc1cc(Cl)c(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] 1631612180 JSDVPYHKOSMQCD-SFHVURJKSA-N 431.920 4.444 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc(C2CCN(C(=O)OC(C)(C)C)CC2)no1 1633340184 CYMFGPAUDYCTDQ-UHFFFAOYSA-N 442.560 4.094 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCC(=O)c1ccc(F)cc1F 1634384463 CSGFEMFNGZKCOR-UHFFFAOYSA-N 446.494 4.316 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCCCCCNC(=O)OC(C)(C)C)CC2)cc1 1636702206 HMDRDGKLMSMXIM-UHFFFAOYSA-N 433.593 4.209 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)cc1 1637337949 OWUGVNBGKGENIM-SANMLTNESA-N 430.548 4.249 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3OC[C@@H]2F)c(C)n1-c1ccc(Br)cn1 1638067475 WAERJSMBVVCTOQ-PXNSSMCTSA-N 444.304 4.453 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)Cc2ccc3c(c2)OC(F)(F)O3)cc1 1639285024 IKFPQCWTZVFUQM-UHFFFAOYSA-N 440.446 4.429 10 10 IICE C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1641200312 HIORYVYCVFGBRQ-NRFANRHFSA-N 444.575 4.322 10 10 IICE Cc1cc(CCNC(=O)[C@H](NC(=O)OC(C)(C)C)C2CCC2)c(C)n1-c1ccccc1 1643017824 QCVJUJOVNVURHB-JOCHJYFZSA-N 425.573 4.446 10 10 IICE COC1(OC)CC2(CN(C(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)[C@H]2C(C)C)C1 1643979332 GLYOJQQEBURIQQ-DEOSSOPVSA-N 438.568 4.085 10 10 IICE CCOC(=O)c1ccc(NC(=O)CN(Cc2ccco2)c2ccc(OC)c(F)c2)cc1 1644790621 WTIDHVGRMMSCRP-UHFFFAOYSA-N 426.444 4.249 10 10 IICE CC[C@@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cccc([N+](=O)[O-])c1 1658034752 SHUPURIHGJZUFB-HXUWFJFHSA-N 443.459 4.050 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N(C)[C@H](CO)Cc3ccccc3)cc2Cl)C1 1680562489 KXUYRMGZTOHVOO-NQIIRXRSSA-N 429.992 4.321 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCC3(c4cccc(Cl)c4)CCC3)cc2)CC1 1687351830 JQHWVZQDMIYWNQ-UHFFFAOYSA-N 426.992 4.013 10 10 IICE CCC(C)(C)Cn1c(C2CCN(c3ncccn3)CC2)nnc1N(C)Cc1ccccc1O 1693904892 PWIPZYDKFJZXJN-UHFFFAOYSA-N 449.603 4.230 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCOCC2)cc1 1694078095 OEXHTPSKMFLVCH-MRXNPFEDSA-N 425.499 4.065 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](C)[C@H]1C 1695437113 ULMQWUCTKAVWKX-IEBWSBKVSA-N 434.588 4.114 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCC2(C)C)CCOC1 1746657522 DYDWMTGOFZLJHI-YADARESESA-N 428.577 4.099 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCSC(C)(C)C2)cc1 1764942863 VCRVQXMIBAWGPZ-HXUWFJFHSA-N 429.634 4.356 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(COc4cccc([N+](=O)[O-])c4)c3)CC2)cc1 1872848399 BHMASMGQTKQTDG-UHFFFAOYSA-N 447.491 4.145 10 10 IICE CCN1CCc2cc([C@H](N)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044753860 FKTVGWBYPOPDTO-HSZRJFAPSA-N 438.616 4.096 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H](NCc2cc(Cl)cc(Br)c2O)C1 2219144598 QULYZCLDFMSRKE-QWHCGFSZSA-N 437.737 4.245 10 10 IICE CCOc1ccc(N2C(=O)C(=C[C@H]3C(=O)N(c4ccccc4)N=C3C)SC2=S)cc1 2297498099 NMGBCVZMTCOMBW-GOSISDBHSA-N 437.546 4.373 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3ccc(C)cc3C)nc3ccccn3c2=O)SC1=S 2314506453 DBHKQIVQOYYGLN-UHFFFAOYSA-N 437.546 4.325 10 10 IICE COc1cc(C=C2SC(=S)N(NC(=O)c3ccccc3C)C2=O)ccc1OC(C)C 2314768769 NUCKUWUEYFQYCF-UHFFFAOYSA-N 442.562 4.337 10 10 IICE CCOc1ccc(N2C(=O)C(=Cc3ccc(OCCC(=O)O)cc3)SC2=S)cc1 2314930299 APPYEQOQTZNMLF-UHFFFAOYSA-N 429.519 4.345 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(NC(C)=O)cc3)C2=O)ccc1OC 2321743443 DRJSVSXGGOQLRR-UHFFFAOYSA-N 428.535 4.458 10 10 IICE Cc1ccc(CNC[C@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352942069 ZEOCYMFCYJKSPB-UKRRQHHQSA-N 427.383 4.446 10 10 IICE COc1ccc(N2CCN(C(=O)c3oc4ccccc4c3NC(=O)C(C)(C)C)CC2)cc1 15727971 MMSKNJSXECXTOY-UHFFFAOYSA-N 435.524 4.388 10 10 IICE O=C(O)CCCN1C(=O)/C(=C/c2ccc(OCCc3ccccc3)cc2)SC1=S 40938458 PPUWMZWPBKUJHX-CYVLTUHYSA-N 427.547 4.374 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)/C=C\c3c(Cl)nc4sccn34)cc2F)C[C@@H](C)O1 96256150 KAVYDEKLLYAIHM-YOQOKRQFSA-N 448.951 4.132 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccccc3SC[C@H]3CCCO3)CC2)cc1 108428593 UUVKONUEEPKTIQ-OAQYLSRUSA-N 426.582 4.319 10 10 IICE O=C1N=C(Nc2cc(C(=O)O)cc(C(=O)O)c2)S/C1=C/C(Cl)=C\c1ccccc1 208341563 AWPYOZVRHVRVIY-CCGPYJSLSA-N 428.853 4.288 10 10 IICE COc1ccc(CCCNC(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1OC 303378678 LZFULTBUFCAEJO-UHFFFAOYSA-N 425.573 4.372 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)c1OC 526175740 HPNUDNUISNJTJA-NRFANRHFSA-N 437.423 4.311 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)c(Br)c1 705850454 WVHSIMNWRXTZQZ-VMBXEPDQSA-N 427.386 4.288 10 10 IICE CC(=O)N[C@H](CC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)c1c(F)cccc1F 727366215 DFPLAFURRXTBSQ-HSZRJFAPSA-N 439.506 4.299 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1 728837700 XFKKPGQGTJOJQV-FQEVSTJZSA-N 449.473 4.075 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 731058400 XIHOMBDYXPIMMJ-UHFFFAOYSA-N 431.495 4.016 10 10 IICE C/C=C/c1ccc(OCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 742805566 LRBLALASPCGZPH-YWPBOTNQSA-N 446.494 4.494 10 10 IICE Cc1nccn1-c1ccc([C@@H](C)NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1 754925999 MFIRQXCKOMKUDM-WZONZLPQSA-N 434.540 4.338 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC23CCOCC3)sc(C)c1-c1ccccc1 769892889 KCQXGHQIYULYRH-UHFFFAOYSA-N 428.554 4.094 10 10 IICE C[C@@H](NCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccc(N2CCOCC2)cc1 775256510 YTAFNZGOXHPLHV-OAHLLOKOSA-N 432.446 4.443 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C3CCN(C(=O)c4ccoc4)CC3)cc2Cl)C1 800048387 ZXBUFVKPNHGXNM-KRWDZBQOSA-N 443.975 4.338 10 10 IICE Cc1cc(C[C@@H](C)NC(=O)NCc2cc(Br)ccc2O)n(-c2ccccc2)n1 805224516 XEWJVBGENNSJEZ-CQSZACIVSA-N 443.345 4.079 10 10 IICE CN1CCC[C@H](CNC(=O)NCc2cc(Br)ccc2O)[C@@H]1c1cccs1 806856022 CODZVUABTJDBFM-FZKQIMNGSA-N 438.391 4.099 10 10 IICE O=C1/C(=C/c2ccc(I)o2)SC(=S)N1[C@H]1C[C@H]2CC[C@H]1C2 917643802 KOXGNURCFBKZNN-BIVUFULYSA-N 431.320 4.274 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)cnn1-c1ccc(C)cc1 1125187229 LGJBIZWXRXXHHW-UHFFFAOYSA-N 436.531 4.039 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(CC(=O)NC2CCCC2)CC1 1142201716 ITRLINMISZPKKW-UHFFFAOYSA-N 435.568 4.208 10 10 IICE C[C@H]1Cc2cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)ccc2O1 1147508201 UVYYVIPKLKBMLQ-KKSFZXQISA-N 439.556 4.072 10 10 IICE CC(C)N(CC(=O)N1c2ccccc2NC(=O)C12CCCC2)Cc1ccc(N(C)C)cc1 1167107923 KZSQBCOULFCLJA-UHFFFAOYSA-N 434.584 4.261 10 10 IICE CC(C)(C)c1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1286995884 RZUXVTYQTSHZBN-LJQANCHMSA-N 443.611 4.472 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3cccn3)nc2)c(C)n1-c1ccc(Br)cn1 1290578116 PWRMEDWGCWLDQA-UHFFFAOYSA-N 437.301 4.085 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)c1 1292247724 IMZCLTOYJQZWPO-GOSISDBHSA-N 437.490 4.441 10 10 IICE CCCCCn1c(Cc2ccncc2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1294143463 PTGUOIOSPBPHPX-UHFFFAOYSA-N 434.588 4.179 10 10 IICE COCCOC1(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CCOCC1 1298085733 JAFQXNNPNNCTLL-UHFFFAOYSA-N 428.573 4.160 10 10 IICE CC(C)c1cnc(S[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1C 1307309419 NZZXAGPKGWGYTI-AWEZNQCLSA-N 433.533 4.438 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]1c1ncc(Br)cn1 1312885480 QAPVOTGWTDIZNX-KXBFYZLASA-N 446.393 4.091 10 10 IICE CC(C)(C)n1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cn1 1353506075 ZBGLEJQAUDGUFM-YBEGLDIGSA-N 432.546 4.007 10 10 IICE COc1cc(F)cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1356120335 XNWOBIJMVWHROY-IUXPMGMMSA-N 434.489 4.203 10 10 IICE CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1359816811 MZYNXPKUFVLZQW-JLTOFOAXSA-N 434.005 4.106 10 10 IICE CCCCN(C)c1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 1435072725 CJIWRONJKZVOQQ-UHFFFAOYSA-N 426.580 4.134 10 10 IICE O=C(N[C@H](Cc1ccccc1)C1CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1443979033 OOYDYKDMZJAGSI-LJQANCHMSA-N 442.562 4.006 10 10 IICE O=C(C[C@@H]1OCc2cc(Cl)ccc21)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445885445 RCLWHCGWAWLJDT-NQIIRXRSSA-N 435.351 4.441 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)c3ccccc3)cc2Cl)C1 1459572366 CPYQRUOSPUWBDF-WZONZLPQSA-N 439.987 4.497 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)[C@@H]1Oc1ccccc1 1469859079 ISRUMJWBVPUXRU-LMMKCTJWSA-N 425.312 4.123 10 10 IICE O=C(NCc1cc(Br)ccc1Br)NCc1c(O)cccc1F 1478468600 WPCLHGAOHDHXAQ-UHFFFAOYSA-N 432.087 4.056 10 10 IICE Cc1cc(CNC(=O)NCc2ccnc(N3CCSCC3)c2)c(C)n1-c1ccccc1 1479056840 KSIJXNRQGYXHOI-UHFFFAOYSA-N 435.597 4.042 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(-n4c(C)ccc4C)cc3)cc2F)CC1 1528693474 POPYYHWENFVYHD-UHFFFAOYSA-N 434.559 4.305 10 10 IICE C[C@H](NC(=O)c1cnc(C2CCN(C(=O)OC(C)(C)C)CC2)o1)c1ccc(N(C)C)cc1 1538976509 PXVSVOHABDJYAX-INIZCTEOSA-N 442.560 4.346 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCCn2c(C)nc3ccccc32)cc1 1541108634 RTFYPSNNWOAAOK-UHFFFAOYSA-N 428.536 4.314 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1541792182 OMFDRWVAIWTQTO-SJLPKXTDSA-N 427.524 4.216 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(N4CCCCC4)cc3)cc2F)C[C@@H](C)O1 1542113497 ZTBNTLNLDNJJJV-RTBURBONSA-N 425.548 4.360 10 10 IICE CCN(CC)C(=O)c1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1543570119 JMCWKVWXSUQWTC-UHFFFAOYSA-N 445.563 4.248 10 10 IICE Cc1ccc2nc(CNC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)cn2c1 1556549042 VLKJBGJJCBFHLK-UHFFFAOYSA-N 438.329 4.138 10 10 IICE COCCOc1ccc(SCC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1559400787 FLFNEUGHEIQABN-UHFFFAOYSA-N 447.512 4.218 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(N2CCc3cc(F)ccc32)CC1 1564946562 RVFGHIOSWLNLBU-IBGZPJMESA-N 438.591 4.368 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@]3(C)CC3(Br)Br)cc2)CC1 1565663551 HERWCXOQDFWVRN-QGZVFWFLSA-N 444.211 4.435 10 10 IICE Cc1cc(C(=O)NCc2cc(F)ccc2CS(C)(=O)=O)c(C)n1-c1cccc(Cl)c1 1566198107 UDFWHZZICBUSRN-UHFFFAOYSA-N 448.947 4.361 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)c2c[nH]cc2-c2cc(Cl)c3c(c2)OCCO3)c1 1566374413 IIARSUVWEOERAH-GFCCVEGCSA-N 428.872 4.312 10 10 IICE O=C(NC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1cccc(O)c1O 1596059118 XUCIJBMSAHXUKQ-SFHVURJKSA-N 428.941 4.342 10 10 IICE O=[N+]([O-])c1cnc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C(F)(F)F)c1 1611944688 AECAXYVMNBEILG-ZDUSSCGKSA-N 430.814 4.444 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1 1615380188 ZCPFOTLSEFJRKN-QFIPXVFZSA-N 436.604 4.419 10 10 IICE CN(Cc1ccccc1)Cc1cccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1616858905 UVYFWVHSGDOVAZ-MHZLTWQESA-N 444.623 4.417 10 10 IICE CCCCN(Cc1ccccc1O)C[C@@H](O)COc1cc(F)cc(Br)c1 1617539083 RYLZMOYSWMYTNR-GOSISDBHSA-N 426.326 4.336 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H](Cc2cc3ccccc3o2)NC(=O)OC(C)(C)C)cc1 1623316037 NNQANYZEFTUENH-OAQYLSRUSA-N 437.540 4.251 10 10 IICE Cc1cc(CC(=O)N2CCC(C(=O)NCc3ccc(F)cc3)CC2)c(C)n1-c1ccccc1 1625974884 SISPAJUPXRMWBT-UHFFFAOYSA-N 447.554 4.331 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCC(=O)c1c(C)cc(C)cc1C 1630481214 PDZALJCANMPYHF-UHFFFAOYSA-N 425.525 4.262 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCCCn1cnc2c(N)ncnc21 1631531400 QJVQYNLBFVXBCL-SFHVURJKSA-N 444.539 4.074 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC(=O)NCc1c(O)ccc2c1CCCC2 1635351100 MJHIXPKPLWGYDN-SFHVURJKSA-N 431.577 4.250 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 1636058618 KBKWBYGKDGQXRK-SQNIBIBYSA-N 437.577 4.452 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2)cc1 1637577836 JAXIJTYOZYTJDN-UHFFFAOYSA-N 444.579 4.379 10 10 IICE COc1ccc(N(CCN(Cc2ccccc2)S(C)(=O)=O)Cc2cccs2)cc1 1644788776 BJBYNKOGCWCWNI-UHFFFAOYSA-N 430.595 4.225 10 10 IICE COc1ccc(N2CCCN(Cc3cc4c(cc3Br)OCCCO4)CC2)cc1 1657023764 PKUNNKKPLLKYIW-UHFFFAOYSA-N 447.373 4.331 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCSc2c(C)[nH]c3ccccc23)cc1 1687890136 BTIBSCGLAXBUQS-UHFFFAOYSA-N 426.586 4.355 10 10 IICE Cc1cccc(-c2nnc(N(C)C[C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)n1 1693186148 RXRVBZLWQGTDGM-QFIPXVFZSA-N 434.588 4.077 10 10 IICE CC1CCN(CCCCn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)CC1 1693736371 WCTBDWBAMDXNCX-UHFFFAOYSA-N 448.615 4.118 10 10 IICE CCC(CC)c1cc(Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)on1 1694290757 KTLVWNNCELSAAM-LJQANCHMSA-N 439.560 4.454 10 10 IICE C#CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@@H]1C 1705605380 JAYXKQLRZXVZSZ-UGKGYDQZSA-N 431.584 4.485 10 10 IICE CCCN(CC1CC1)c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1709726447 DFOBTKGVTRVVFL-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CCC[C@H](C)NC(=O)[C@@H]1CCCN(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1727941836 JZCGTAGMKGHXNC-SIKLNZKXSA-N 440.636 4.002 10 10 IICE CC(C)c1nnc(N(C)Cc2cccs2)n1Cc1ccc(N2CCOCC2)c(F)c1 1741334661 DMLYNZJACSNTLA-UHFFFAOYSA-N 429.565 4.123 10 10 IICE C[C@@H](CN1CCCC1)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1741868420 OBLBRMUQCGLIHW-KRWDZBQOSA-N 440.979 4.067 10 10 IICE CO[C@H](C)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1748383264 ZDZHKNZZJSLLME-QGZVFWFLSA-N 440.979 4.265 10 10 IICE CCS(=O)(=O)c1ccc(O)c(N=c2cc(C(C)(C)C)[nH]c(-c3ccc(C)cc3)n2)c1 1859832781 MEFHAZFWMVOROH-UHFFFAOYSA-N 425.554 4.414 10 10 IICE CCCc1nc(N2CCN(c3ccc(OC)cc3)CC2)cc(N2CCOc3ccccc32)n1 1867977287 ZSJLUVLKOBCETN-UHFFFAOYSA-N 445.567 4.295 10 10 IICE O=C(NN1C(=O)C(=Cc2cccnc2)SC1=S)C(c1ccccc1)c1ccccc1 2053498275 KNKQXJMGZSYPGW-UHFFFAOYSA-N 431.542 4.146 10 10 IICE COc1ccc(Br)c(CN[C@@]23CCC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1O 2236055669 QZKKRALGJBZQLQ-RNODOKPDSA-N 441.366 4.043 10 10 IICE COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)C1=Cc1cc(C)n(-c2cccc(C)c2)c1C 2294037587 VTXUGKVHJBBVRP-JOCHJYFZSA-N 434.536 4.254 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(OC)c(OC)c2)SC1=S 2314769619 SWSJNZFXYVLICN-LJQANCHMSA-N 443.546 4.209 10 10 IICE Cc1ccc(CNC[C@H](NC(=O)OC(C)(C)C)C(F)(F)F)c(O)c1Br 2327797230 SNOZHGBBFUYMCI-NSHDSACASA-N 427.261 4.008 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@]2(C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2381138365 UVMHZOQLHNYODJ-FQEVSTJZSA-N 441.366 4.211 10 10 IICE Nc1ccc(-n2nnc(S(=O)(=O)c3ccccc3Cl)c2-c2ccc(F)cc2)cc1 11730775 DQAVPIIQENSVHK-UHFFFAOYSA-N 428.876 4.142 10 10 IICE Cc1nc(C)c(C(=O)N(Cc2ccco2)C2CCN(c3ccc4c(c3)OCO4)CC2)s1 19559961 DTRPIZWLCNTGOA-UHFFFAOYSA-N 439.537 4.393 10 10 IICE CCCCCN1C(=O)/C(=C2/SC(=S)N(C)C2=O)c2cc(Br)ccc21 33898526 CTSWTHUZMRWWGW-BUHFOSPRSA-N 425.373 4.187 10 10 IICE CCN(CC)CN1C(=O)/C(=C2/SC(=S)N(c3ccccc3C)C2=O)c2ccccc21 34806917 ONVUYJCLTWPOMR-FMQUCBEESA-N 437.590 4.417 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)c3ccc(Cl)s3)c3ccco3)CC2)cc1 49486411 WTGSJDJRTHNDQS-SFHVURJKSA-N 445.972 4.296 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cccc(OCc4c(C)noc4C)c3)CC2)cc1 108429817 AUBAFKRRZLHRJO-UHFFFAOYSA-N 435.524 4.232 10 10 IICE COC(=O)CCN1C(=O)/C(=C\c2ccc(OCc3ccccc3C)cc2)SC1=S 206835976 TYASPIUKMDPMBK-CPNJWEJPSA-N 427.547 4.338 10 10 IICE COc1ccc(C(=O)N2CCC(NCc3ccc(N4CCCCC4)cc3)CC2)c(OC)c1 237484951 NWQLXAJMMJNKAW-UHFFFAOYSA-N 437.584 4.089 10 10 IICE COc1ccc(OC)c(N2C(=O)C(O)=C(c3cccc(C)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526230163 VYRIEFZHCKRIFH-QHCPKHFHSA-N 433.460 4.481 10 10 IICE O=C(OCc1ccccc1)N1C[C@H]2CC[C@H]1[C@H](NCc1cc(Br)ccc1O)C2 701066264 PGQOLTTUXKNVKO-DBVUQKKJSA-N 445.357 4.434 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCCCc3nc(-c4ccncc4)no3)ccc21 728639329 PEILASRWHVCOKL-UHFFFAOYSA-N 434.496 4.139 10 10 IICE Cc1cc(C)n(Cc2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)cc2)n1 750874977 PONOHWVIZUMAHW-SANMLTNESA-N 446.595 4.436 10 10 IICE CC[C@@H](NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)c(Cl)c1O 775513507 KHQGAXSAXXDWKE-ABSDTBQOSA-N 448.394 4.339 10 10 IICE CC(C)(C)OC(=O)c1ccccc1NC(=O)C(=O)N(CC1CCCC1)c1ccc(N)cc1 784110863 HLAXHSJXPAGVHN-UHFFFAOYSA-N 437.540 4.386 10 10 IICE COC(=O)c1cc(S(=O)(=O)N(Cc2ccccc2O)C2CCCC2)c(F)cc1Cl 795851161 BOPSCBOHGNHQHS-UHFFFAOYSA-N 441.908 4.105 10 10 IICE COc1ccc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)cc1N1CCCC1=O 916679801 FFEXXCNDEFLXNZ-UHFFFAOYSA-N 435.480 4.355 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])n2)c1C 918191934 LXLJEGAMGLZSNZ-UHFFFAOYSA-N 438.506 4.487 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1 1124549527 LTIAYNGVPZBELH-XMMPIXPASA-N 435.568 4.437 10 10 IICE COc1ccc(N2CCC(NC(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CC2)cc1 1125815831 BLOLPBWWFVAKEH-NRFANRHFSA-N 447.620 4.356 10 10 IICE Cc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)nn1-c1ccccc1Br 1136436555 AYUFMRXCXFEUHW-UHFFFAOYSA-N 439.357 4.256 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cc1 1136442882 IRTREAXGGQJULA-FQEVSTJZSA-N 445.563 4.163 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)cnc1Br 1142713204 RJBGYGBIMXACBH-IBGZPJMESA-N 432.362 4.040 10 10 IICE Cc1cc(C(=O)NCc2ccc3nonc3c2)c(C)n1-c1cccc(Br)c1 1158677007 LKCLQKRTDFXGPV-UHFFFAOYSA-N 425.286 4.323 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@](C)(NC(=O)OC(C)(C)C)c2ccccc2)cc1 1164596920 FKTVOIJKJCBJLI-VWLOTQADSA-N 441.572 4.030 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1179029032 HLCUJAINWCRBFI-UHFFFAOYSA-N 429.442 4.492 10 10 IICE CN(C)c1ccc([C@H](CNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)N(C)C)cc1 1187832691 KZWCVKWCBXPEOU-SFHVURJKSA-N 430.478 4.338 10 10 IICE CCC[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1192858452 LFLSOUIPUGYPHD-PWHSHALESA-N 427.564 4.187 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](CC(N)=O)c2ccccc2Cl)c(C)n1-c1ccccc1 1253808602 VBMGOAITARZAQE-QFIPXVFZSA-N 438.959 4.206 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)Cc3ccc(C4CCCCC4)cc3)cc2)C1 1264736809 DBJCVNUKIGEEIB-XMMPIXPASA-N 433.596 4.295 10 10 IICE CC1CCN(c2ccc(Cn3c(C(=O)NC(C)C)nnc3N3CCCCCC3)cc2)CC1 1291145444 IPALXIGEKUPQCX-UHFFFAOYSA-N 438.620 4.081 10 10 IICE CCc1nnc(N2CCCC[C@H](SC)C2)n1Cc1ccc(N2CCSCC2)cc1 1293061314 ZNHIIPFJLLGPMS-FQEVSTJZSA-N 431.675 4.164 10 10 IICE Cc1ccccc1-n1ncc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 1294859066 HKXMJHTXNMWYJR-HXUWFJFHSA-N 438.959 4.243 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(OCCN(C)C)c(OC)c3)ccc21 1299484042 LUOGWHYVQALMLH-UHFFFAOYSA-N 439.556 4.106 10 10 IICE COC(=O)c1cnc(Sc2ncc(C(F)(F)F)cc2I)s1 1307127840 PXAUUOMGZOYMOZ-UHFFFAOYSA-N 446.213 4.099 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 1312529777 WEWYHIPZQJGMDR-UXHICEINSA-N 430.593 4.264 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1314420468 PXXIUIVAXUIDDB-QGZVFWFLSA-N 444.630 4.232 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@H](C)C2 1354327551 YCBIJIHIKGVGHA-GJZGRUSLSA-N 432.586 4.168 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ncc(Cl)cc1Cl 1357519428 QVCJYFBNHIDVNX-UHFFFAOYSA-N 434.245 4.174 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(F)cc4)on3)cc2F)C[C@@H](C)O1 1357836552 XNTQCPVCIUQNRK-GASCZTMLSA-N 427.451 4.163 10 10 IICE CC(C)(NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)c1ccccc1F 1436523489 UOKSYOKNGWSVSW-UHFFFAOYSA-N 432.407 4.174 10 10 IICE Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)nc1 1441711488 CWHDHNXJPGVJAP-FQEVSTJZSA-N 444.535 4.101 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CCCN3C(=O)OCc3ccccc3)cc2)CC1 1443662157 IUBOBPBORCJBSS-XMMPIXPASA-N 435.568 4.340 10 10 IICE COc1ccccc1-c1csc([C@@H]2CCCN(C(=O)c3c(F)ccc(O)c3O)C2)n1 1457783233 SMMOTVNCISDHHA-CYBMUJFWSA-N 428.485 4.389 10 10 IICE COCCN(Cc1ccc(C)o1)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1465837877 UGYMIUIAKANJAN-UHFFFAOYSA-N 446.345 4.442 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@@H](CCc2ccccc2)C(F)F)N(C)C)cc1 1479535633 XWHSZCNFRKYYMI-VXKWHMMOSA-N 432.559 4.263 10 10 IICE Cc1csc(CN(C)c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)c1 1492647121 FMKFALDPCWJHDN-QGZVFWFLSA-N 429.565 4.042 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CCCSC3)CC2)cc1 1504292871 UQGRFRYDAPBHQJ-LJQANCHMSA-N 443.661 4.444 10 10 IICE COC(=O)[C@H](C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccccc1 1515268991 HCRBLJUCFORHBD-BCHFMIIMSA-N 447.579 4.074 10 10 IICE CCCCNS(=O)(=O)c1cccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 1531181709 CBENRHIETXOXGR-UHFFFAOYSA-N 425.554 4.425 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](c3ccccc3F)N3CCOCC3)c2C)c1 1534759925 OOTZXSPYCWPXJV-RUZDIDTESA-N 435.543 4.231 10 10 IICE CCc1ccc(-c2nc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cs2)cc1 1535346020 TTZFOXAOBBEDHK-UHFFFAOYSA-N 443.519 4.417 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCCOc2cccc(Br)c2)N(C)C)cc1 1537477780 KRKAPDIUTUAJIY-OAQYLSRUSA-N 448.405 4.093 10 10 IICE C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC(=O)N[C@H]4CCCC[C@H]43)c2C(=O)OC(C)(C)C)C1 1539725180 QIXLXCLMCHHDMI-WTTBNOFXSA-N 446.613 4.462 10 10 IICE CC(C)CN(c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCOCC2)cc1)C(C)C 1541545852 QRGKDFOBSULGEZ-UHFFFAOYSA-N 448.615 4.020 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccccc1C(F)(F)F 1546152292 ZRZPNJPVSMSCCI-UHFFFAOYSA-N 429.822 4.199 10 10 IICE COCCO[C@H](C)c1nnc(N2CC[C@@H](C(C)(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1555627578 GSSXESKSQQNARK-TZIWHRDSSA-N 443.636 4.297 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCC(CNC(=O)c4ccccn4)CC3)c2C)c1 1566536558 OQMVKCAWQYSZFX-UHFFFAOYSA-N 444.579 4.388 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 1568735950 OXTMBSIGZRTFAD-UZLBHIALSA-N 433.545 4.396 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3ccc(Cl)cc3)CC2)cc1 1584918383 IXRBIRVCGZNWNX-UHFFFAOYSA-N 435.955 4.451 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(OCCN3CCCC3)cc2)c1 1585898495 GZSQBBZTEDHGBE-UHFFFAOYSA-N 445.563 4.311 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(SC(F)(F)F)c3)CC2)c(OC)c1 1595996111 AXYAIRXKHHRINF-UHFFFAOYSA-N 426.460 4.278 10 10 IICE COC(=O)C1(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CCCCC1 1611461820 ASLHUHWHRJSSGW-UHFFFAOYSA-N 448.361 4.105 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCO[C@@H](C)C1)OC 1613613045 FSOORUCGQSBPSE-UGKGYDQZSA-N 437.588 4.393 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(-c3ccccc3C)nn2)cc1 1616620014 KIYFTVKYOSXGHZ-UHFFFAOYSA-N 441.535 4.497 10 10 IICE Cc1cc(C2CCN(CC(=O)NCc3ccc(N(C)C)cc3)CC2)ccc1Br 1617381688 JYUXDVAPUDUADS-UHFFFAOYSA-N 444.417 4.319 10 10 IICE CN1CCCc2cc(Cn3c(-c4ccccn4)nnc3N(C)CCOC(C)(C)C)ccc21 1618476588 XXQLOXFVEVLRNS-UHFFFAOYSA-N 434.588 4.022 10 10 IICE COc1ccc(N2CCCN(C(=O)c3cc(Cl)cc(Br)c3N)CC2)cc1 1625249335 UPMIITMALVYDMR-UHFFFAOYSA-N 438.753 4.046 10 10 IICE C[C@@H](NC(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1625882027 ADDXCZIESMGFPD-WIYYLYMNSA-N 447.620 4.372 10 10 IICE Cc1ccc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1626242616 FSJMBFKHNPGIAO-IBGZPJMESA-N 428.330 4.023 10 10 IICE CC1(CC(F)F)CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C1 1630922199 UXVMNVVZYJEYCU-JYRVWZFOSA-N 430.567 4.233 10 10 IICE Cc1ccc(C)c(S(=O)(=O)C2(C(=O)NCc3c(O)ccc4c3CCCC4)CCCC2)c1 1631439205 YESSRYFPVCPWPX-UHFFFAOYSA-N 441.593 4.291 10 10 IICE CCN(CC)C(=O)CCC1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)CC1 1633897754 HVLHTYDTDFQEGO-UHFFFAOYSA-N 437.584 4.407 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC(C)(C)CC3CCCCCC3)CC2)cc1 1634231130 NFBMYXQEUUHXOX-CCEZHUSRSA-N 441.616 4.155 10 10 IICE O=C(Cc1csc(COc2ccccc2)n1)NCc1cccc(Br)c1O 1634725359 VEMOXRFKJOQYJG-UHFFFAOYSA-N 433.327 4.049 10 10 IICE CCCCO[C@H]1C[C@@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(C)C 1644890699 MGJCBGAVEFQXIX-YADHBBJMSA-N 448.563 4.316 10 10 IICE CC(C)(C)OC(=O)NCC[C@H]1CN(C(=O)c2c[nH]nc2-c2cccnc2)c2ccccc21 1647736506 IVXJHAQRLDMPAL-KRWDZBQOSA-N 433.512 4.131 10 10 IICE Cc1ccccc1[C@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1 1653026504 DDUDTBPHMMFQKO-UYXZNNOOSA-N 439.575 4.105 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(C(C)C)CC2)cc1 1695626965 UUXPCZHQTKQZQH-UHFFFAOYSA-N 426.653 4.292 10 10 IICE CN1CCCc2cc(Cn3c(N(C)Cc4ncc(Cl)n4C)nnc3C(C)(C)C)ccc21 1696880672 BFKHFPQRKDVHGP-UHFFFAOYSA-N 442.011 4.030 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CCO1 1727326034 CFXDXVWNRROMPW-VWLOTQADSA-N 434.588 4.077 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1C[C@@H](C1CCCCC1)N(C)C 1729419646 XUNRMIQBPPTOLX-QFIPXVFZSA-N 434.588 4.193 10 10 IICE CO[C@H](CCn1c(C2CC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(F)(F)F 1729854468 NHKWTSUTQVQKGO-LJQANCHMSA-N 437.510 4.360 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC1CCOCC1 1749748720 JKNXWSHEWNGUMX-UHFFFAOYSA-N 437.588 4.252 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(O)cc3)C2=O)ccc1O[C@@H](C)C(=O)O 2314934240 GNLFRBDKGJGWCT-LBPRGKRZSA-N 445.518 4.049 10 10 IICE Cc1ccc(CNC(=O)[C@H](CNC(=O)OC(C)(C)C)CC(C)C)c(O)c1Br 2381132512 BRKJPPHCIIMTEN-HNNXBMFYSA-N 443.382 4.266 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2381144411 YOJRYAPXJNGBLE-CQSZACIVSA-N 441.366 4.117 10 10 IICE COC(=O)c1ccc([C@@H]2Oc3c(OC)cccc3[C@@H]3CC(c4ccccc4O)=NN32)cc1 20071056 JLBGWTJPMBEFJB-RDPSFJRHSA-N 430.460 4.430 10 10 IICE COC[C@H](C)NC(=O)CSc1ncc(-c2ccc(Br)cc2)n1CC(C)C 32881367 ZDJGQPTYWFTHOC-AWEZNQCLSA-N 440.407 4.212 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=S)N=C2O)c(C)n1C[C@@H]1CCCO1 59109254 ORMMPLXXTNUBSZ-FUDBJYBQSA-N 427.501 4.095 10 10 IICE Cc1cc(/C=C2\C(=N)N3N=C(c4ccncc4)SC3=NC2=O)c(C)n1-c1ccccc1 102470376 ZARCZSCSPYKQCZ-HRGNJQJKSA-N 426.505 4.157 10 10 IICE CCN(C)c1cccc(NC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2C)c1 109701235 VOZWKEVJISIWCB-UHFFFAOYSA-N 437.565 4.182 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 226840782 AWNWHHYDURMGII-ZOCZFRKYSA-N 443.525 4.204 10 10 IICE COc1ccc(Nc2nc(C(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cs2)cc1 743339702 VIRNMPLGWKGCIK-LJQANCHMSA-N 439.537 4.422 10 10 IICE O=C(CN(CC(=O)N1CCCC1)C[C@@H]1CCCO1)Nc1ccc(N=Nc2ccccc2)cc1 744423229 GFDNABJDXDLHLE-QHCPKHFHSA-N 449.555 4.144 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCSc2nccs2)C1 767922590 RVWYMWWWGVXFDG-UHFFFAOYSA-N 428.627 4.163 10 10 IICE O=C(N[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1)c1ccc2ccccc2c1 770306742 PTCTTYWGRPJYGS-VWLOTQADSA-N 429.564 4.071 10 10 IICE O=S(=O)(Nc1cccc(N2CCOCC2)c1)c1ccc2cc(Br)ccc2c1 775271795 RCZRNNQIUAEXBL-UHFFFAOYSA-N 447.354 4.240 10 10 IICE Cc1cc(Br)c(O)c(CNCc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1 781629754 ZOBRSGZRGIHEET-HOTGVXAUSA-N 447.373 4.002 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC12CCC(C(F)(F)F)(CC1)CC2 786998343 JWZCTPNWRIZQQF-UHFFFAOYSA-N 429.458 4.117 10 10 IICE O=S(=O)(/C=C\c1cccc(Br)c1)NCc1cc(Br)ccc1O 796191475 VFSOZFRFJUNNQA-SREVYHEPSA-N 447.148 4.008 10 10 IICE O=S(=O)(Cc1ccc(Cl)c(Cl)c1)NCc1cc(Br)ccc1O 796191559 XNOUXLPOHQFDPN-UHFFFAOYSA-N 425.131 4.081 10 10 IICE Cc1ccc(O[C@@H]2CCN(Cc3cc(Br)cc(Br)c3O)C2)nc1 858013597 UMLCNUNIUCDVLH-CQSZACIVSA-N 442.151 4.274 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2ccc(N3CCSCC3)cc2)cc1 917384047 RLQNSKMUPWZWOR-UHFFFAOYSA-N 441.597 4.195 10 10 IICE O=C1N=C(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)S/C1=C/c1ccc(Cl)cc1 1081155535 PMCAZKFEXLSJRC-QGOAFFKASA-N 446.359 4.422 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3C[C@H]3c3ccccc3OC(F)(F)F)C2)cc1 1129993183 KIWQYOGHZOZBRZ-XPGWFJOJSA-N 434.458 4.340 10 10 IICE CCOC(=O)C1(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCCC1 1136391320 RCSGYPDKNKAPBX-UHFFFAOYSA-N 433.346 4.462 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1 1140198405 CDIXASSULFRXPV-UHFFFAOYSA-N 437.536 4.200 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2C[C@@H]3CC[C@H](C2)S3)NC(=O)OC(C)(C)C)cc1 1147516895 ALGQCCLJIAXTNL-QZNYNHHHSA-N 433.618 4.109 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccc(Br)cc2)c1 1147961662 GWQGVCXRJODBJT-SFHVURJKSA-N 449.345 4.345 10 10 IICE O=C(N1Cc2cccc(O)c2C1)C1(Cc2ccc(F)cc2Br)CCOCC1 1152573577 LOLFOROYDYZLJC-UHFFFAOYSA-N 434.305 4.176 10 10 IICE COc1ccc([C@@H]2CN(C(=O)c3sccc3-n3c(C)ccc3C)CCO2)cc1OC 1159571005 YAZJMGAJBDDBLM-NRFANRHFSA-N 426.538 4.387 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 1183764913 ABEVNANZOWLDIU-JOCHJYFZSA-N 425.573 4.410 10 10 IICE COc1ccc(N(CC(=O)NC(=O)Nc2ccc(C)c(C)c2)Cc2ccco2)cc1F 1191591876 SPTWVLFNCSCWSN-UHFFFAOYSA-N 425.460 4.399 10 10 IICE C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751311 ZTGBSDAVGMOQOZ-MBOZVWFJSA-N 429.511 4.278 10 10 IICE C/C=C\[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCc1ccc(N(CC)CC)c(F)c1 1293225648 ZZORXZCJYQNRTJ-VGCSBSMUSA-N 433.568 4.347 10 10 IICE Cc1nccc2c(NC(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)cccc12 1303468450 FQXKKOACKSLRRO-UHFFFAOYSA-N 439.518 4.363 10 10 IICE CC(C)Cn1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(C(F)F)n1 1356036381 FTBGVMJEZBGYRT-GJZGRUSLSA-N 438.494 4.159 10 10 IICE CC(C)c1nnc(N(C)[C@H](C)c2ccco2)n1Cc1ccc(N2CCOCC2)c(F)c1 1359677184 XKKRKOFNSIWCNX-QGZVFWFLSA-N 427.524 4.216 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(C)C)nnc1N1CCN(CCC(C)(C)C)CC1 1361096059 UXOHHSGTURRHGP-UHFFFAOYSA-N 426.653 4.382 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)[C@@H]1Oc1ccccc1 1448160102 KMMPOMOFKUDSED-CAOCKLPOSA-N 432.520 4.261 10 10 IICE CCC1(CC)CCC(NC(=O)N2CCN(c3cc(OC)c(OC)c(OC)c3)CC2)CC1 1470027771 FHEASGQGDCPEKE-UHFFFAOYSA-N 433.593 4.293 10 10 IICE CCCN(C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)[C@H]1C[C@H](OCC)C12CCCC2 1470771081 AFHZARUDPARBPH-OIBXWCBGSA-N 429.605 4.433 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](c2cncc(Br)c2)C2CC2)cc1 1478626777 QORGQNQXELHDGL-FQEVSTJZSA-N 447.377 4.082 10 10 IICE Cc1ccc(C(C)(C)CNC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c(C)c1 1478721122 NLBUAJAUCBMWCN-UHFFFAOYSA-N 431.527 4.195 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@H](c3ccc(F)cc3)CC2)N(C)C)cc1 1479533622 HSXZHRTUIFXOEA-DVECYGJZSA-N 426.580 4.474 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc([N+](=O)[O-])c(Cl)c1 1524070240 SZPFTRPMVLILMM-CYBMUJFWSA-N 425.819 4.248 10 10 IICE CCc1c(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)nnn1-c1cccc(Cl)c1 1525762173 LXAIYFYBDFYVGJ-MRXNPFEDSA-N 425.964 4.219 10 10 IICE CC(C)(C)c1coc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1527051809 CGMRLKOZHSLANC-GXDHUFHOSA-N 433.530 4.341 10 10 IICE CCOc1cccnc1N1CCN(C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)CC1 1558319418 MUKMAIVHWRJRDT-UHFFFAOYSA-N 432.568 4.467 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CO[C@H](CCC(=O)OC(C)(C)C)C3)cc2)CC1 1565663585 IKDNHNFNRUCBAU-IFMALSPDSA-N 430.589 4.066 10 10 IICE CCCc1ccc(N2C[C@@H](C(=O)NCc3ccc(N(CC)CC)c(F)c3)CC2=O)cc1 1565687877 BDNYJRKEPKRYEH-FQEVSTJZSA-N 425.548 4.294 10 10 IICE Cc1sc(-c2ccco2)nc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1566357249 ZUKSXWWTYGYWPH-INIZCTEOSA-N 431.945 4.465 10 10 IICE COc1cc(CCO)ccc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1568381376 FHLVPCUWMLHZOW-UHFFFAOYSA-N 444.329 4.047 10 10 IICE CCN(CC)c1ccc(CNC(=O)COc2ccc(F)cc2Br)cc1F 1585698662 UWAXADMADUTSCC-UHFFFAOYSA-N 427.289 4.269 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)C2)nc1 1596578951 VFZHOGFSZBCQBY-OAQYLSRUSA-N 444.535 4.101 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC(CCCn3ccnc3)CC2)cc1 1597329786 KIOKEVJQONUORJ-UHFFFAOYSA-N 432.568 4.365 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCOCC2)cc1 1614362721 QCIZFHCQOGZWHF-FQEVSTJZSA-N 436.604 4.041 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CN(C(=O)OC(C)(C)C)CC3(C)C)ccc21 1617850964 DSCBPURYDAEZNJ-NRFANRHFSA-N 443.588 4.280 10 10 IICE COc1ccc([C@H](CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)N2CCCC2)cc1 1618057426 BHUUBEPLNVZCIH-SANMLTNESA-N 445.563 4.482 10 10 IICE Cc1csc(CNc2cccc(C(=O)N[C@@H](C)c3ccc(N4CCOCC4)cc3)c2)n1 1625882448 ITOSZPGWHPTFHX-SFHVURJKSA-N 436.581 4.391 10 10 IICE C[C@H](NC(=O)OC(C)(C)C)c1nc(C(=O)NCc2ccc3c(c2)CCCN3C)cs1 1626940908 PYUCCVSZVYEBEL-AWEZNQCLSA-N 430.574 4.041 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cn4ccc(Br)cc4n3)cc2)CC1 1627467482 JKCOCIPGRAFUNA-UHFFFAOYSA-N 427.346 4.263 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)c3c(F)ccc(O)c3O)CC2)CC1 1639099544 VSTKKNKHRJEESX-OAHLLOKOSA-N 436.524 4.126 10 10 IICE COC(=O)/C=C\c1ccc(N2CC[C@@]3(CCCCN3C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1 1643220486 WGHMAIFYRCQZIA-CRDZDMIISA-N 445.516 4.151 10 10 IICE Cc1oncc1C(=O)Nc1ccc(O)c(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1643369377 CVMDVYPBUWRQRY-UHFFFAOYSA-N 444.491 4.278 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3C[C@@H](NC(=O)OC(C)(C)C)C3)c2C)cc1 1648899606 NWPVPPFAGOYCQQ-HDICACEKSA-N 427.545 4.136 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](NC(=O)c3ccc(Cl)cc3)C2)c(C)n1-c1ccccn1 1652922573 NZGXEQXBLNFQLH-FQEVSTJZSA-N 436.943 4.177 10 10 IICE CC(=O)N1CCc2cc(S(=O)(=O)Oc3ccc4c(c3)c(C)c(C)n4C)c(Cl)cc21 1655691386 DSEJEKZUEAYANW-UHFFFAOYSA-N 432.929 4.125 10 10 IICE C[C@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)C(=O)N1c2ccccc2C[C@H]1C 1672776726 JHPUVMRBNPGXPA-MSOLQXFVSA-N 433.508 4.063 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C 1679890919 SNPNOIOEEITLBR-JXFKEZNVSA-N 446.389 4.207 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC(Oc4cccc(Cl)c4Cl)C3)C2)cc1 1683944945 NMRIOVQTJZTXFQ-CQSZACIVSA-N 436.339 4.054 10 10 IICE COc1ccc2ccccc2c1CCNC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1685196080 CDAXPZNKZCIXAQ-UHFFFAOYSA-N 433.552 4.069 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1691927412 OWHHSNWMNYQURJ-UXHICEINSA-N 429.584 4.298 10 10 IICE Cc1nc(Cc2nnc(N3C[C@@H](C)[C@@H](C)C3)n2CCCSc2nccs2)cs1 1693346875 HQZVSOUYLXLNLE-OKILXGFUSA-N 434.660 4.365 10 10 IICE C[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CCN(C2CCC2)C1 1693757694 UFSZSZFQYBBVBG-GOSISDBHSA-N 442.627 4.140 10 10 IICE CC(C)[C@H]1CCCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1706325808 PKYSONDEBLWOAJ-KRWDZBQOSA-N 448.662 4.025 10 10 IICE CC[C@H](C)c1nnc(N2CCO[C@@H]([C@H]3CCCO3)C2)n1Cc1ccc(N(CC)CC)cc1 1708559986 RCMLGSUGLCIBRR-WWPVKYPJSA-N 441.620 4.070 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCCC(F)(F)C1 1726354422 IEOIUMRWFYYGOE-HXUWFJFHSA-N 433.547 4.275 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@H](COC)C1 1727847393 IAKITSZILRBWSB-FLVSMNSFSA-N 435.572 4.170 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@H]1CCO[C@@H](C)C1 1747030684 ZLQQKBMCMQNJOX-SFTDATJTSA-N 441.620 4.256 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCc3nccs3)CC2)cc1 1748847795 MJMODLLULGLVFL-UHFFFAOYSA-N 440.617 4.000 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCSC1 1750707763 IGPTZCGBIKEVFU-NRFANRHFSA-N 443.661 4.093 10 10 IICE CN1CCCc2cc(Cn3c(-c4cccnc4)nnc3N(C)CCC(F)(F)F)ccc21 1769069309 QBQXHEXCMXTJRQ-UHFFFAOYSA-N 430.478 4.159 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)sc(C)c1-c1ccccc1 1860647037 UXXIJYNDGCEFSH-GOSISDBHSA-N 440.565 4.487 10 10 IICE O=C(CCNCc1cc(Cl)cc(Br)c1O)Nc1ccc(F)c(F)c1F 1860714987 HJCOIYDRDCRHSE-UHFFFAOYSA-N 437.643 4.344 10 10 IICE COC(=O)c1c(NC(=O)[C@@H](N)C(C)C)sc(C)c1-c1ccc(Br)cc1 1865915459 FZFIBNRULWWZKB-HNNXBMFYSA-N 425.348 4.194 10 10 IICE CC(C)CNCc1ccc(N(C)C[C@H](O)COCc2ccccc2)c(Br)c1 1916394359 MZEKMGZALNGMLR-FQEVSTJZSA-N 435.406 4.209 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(NCc3cc(Cl)cc(Br)c3O)C[C@H]2C1 2077033882 FOBLQYOWPCCBOA-KPZWWZAWSA-N 431.758 4.297 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@H]2CC[C@H]1[C@@H](NCc1cccc(Br)c1O)C2 2232282617 QFAWNNVFZYQQAK-CSFVBSKPSA-N 425.367 4.326 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccccc2Cl)SC1=S)Nc1ccccc1[N+](=O)[O-] 2296755631 UMOUXVNUFWRYDM-UHFFFAOYSA-N 447.925 4.478 10 10 IICE CC1=NN(c2ccccc2)C(=O)C1=Cc1c(C)nn(-c2ccc(Br)cc2)c1O 2297321274 GCSPYXIFPSQZEA-UHFFFAOYSA-N 437.297 4.455 10 10 IICE O=C(NN1C(=O)C(=Cc2ccccn2)SC1=S)C(c1ccccc1)c1ccccc1 2297448962 JPLFTWVNNAGOJC-UHFFFAOYSA-N 431.542 4.146 10 10 IICE CC(=O)Nc1cccc(N2C(=O)C(=Cc3c(C)nc4scc(C)n34)SC2=S)c1 2318756664 QPPZCQCBJWZVDA-UHFFFAOYSA-N 428.564 4.377 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)ccc1OC 2321630810 VCYQXJFQSAQUHE-UHFFFAOYSA-N 446.506 4.417 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2C[C@@H](C)CN2C(=O)OC(C)(C)C)c(O)c1Br 2381130885 GJARBRXKMMGLFG-IUODEOHRSA-N 441.366 4.067 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2381144410 YOJRYAPXJNGBLE-AWEZNQCLSA-N 441.366 4.117 10 10 IICE N=C1/C(=C\c2ccc(OCc3ccccc3F)cc2)C(=O)N=C2SC(N3CCCC3)=NN12 20356266 PBWQRBIKVFZALG-RBRHTRMMSA-N 449.511 4.077 10 10 IICE CC1CCN(c2ccc(-c3noc(CCC(=O)NCc4ccc(N(C)C)cc4)n3)cc2)CC1 33283507 CPYUVCTUESWCHV-UHFFFAOYSA-N 447.583 4.288 10 10 IICE Cc1cccc(C)c1OCCOc1ccccc1/C=C1/C(=O)NN(c2ccccc2)C1=O 33850277 JLWPSJUEKWCCRS-XLNRJJMWSA-N 428.488 4.223 10 10 IICE C/C(NCCCn1ccnc1)=C1\C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 100095550 HXDRKJHNSIWPDI-HEHNFIMWSA-N 442.548 4.198 10 10 IICE Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN(Cc1ccco1)Cc1ccccc1O 732202528 VDPKHBABDAYBCO-UHFFFAOYSA-N 444.535 4.106 10 10 IICE Cc1cc(CCNC(=O)NCCCC(=O)N2Cc3ccccc3C2)c(C)n1-c1ccccc1 732442192 OEVLQPONPMUREI-UHFFFAOYSA-N 444.579 4.258 10 10 IICE Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C)CC2 758435103 ZXDCPQFHPFJNMS-QGZVFWFLSA-N 434.506 4.412 10 10 IICE Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NCc1cccc(Br)c1O 765766867 DDGYIGFUAWJOQU-UHFFFAOYSA-N 425.348 4.439 10 10 IICE CCN1CC[C@H](NC(=O)N[C@@H](C)c2cc(OC)ccc2O)[C@@H]1c1cc(F)c(F)c(F)c1 782536457 PTAOQISLQYCXRD-OELQTJDKSA-N 437.462 4.014 10 10 IICE Cn1ccnc1CN1CCC[C@@H](NC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1=O 783033513 JPUBQHPYJIAFQI-HXUWFJFHSA-N 431.500 4.148 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)cc1)c1ccncc1 783595402 QXRCHPMNYYOCTC-UHFFFAOYSA-N 436.518 4.258 10 10 IICE O=C1N=C(SCC(=O)N2CCOC[C@H]2C2CC2)S/C1=C\c1csc2ccccc12 814772887 HTLVYLVTSRWXQP-RSFAQHHSSA-N 444.603 4.242 10 10 IICE CN(CC(=O)OCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)c1ccc(Cl)nn1 919114641 ITQAVAYGMIWHMI-UHFFFAOYSA-N 438.875 4.164 10 10 IICE O=C1/C(=C/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)SC(=S)N1c1cccc(Cl)c1 1084626761 VDRZOZGJLHDQPD-ACAGNQJTSA-N 437.842 4.268 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2c(C(F)F)nc3cnccn23)cc1 1124884022 BCCKBEVGALETNW-UHFFFAOYSA-N 425.439 4.169 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)Oc3ccc(Cl)c(C)c3)cc2F)CC1 1125976318 VOLMUNAPTXCOHW-KRWDZBQOSA-N 433.955 4.013 10 10 IICE C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129548963 HSNSXAOLJWDNMK-CYBMUJFWSA-N 426.916 4.252 10 10 IICE Cc1ccc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)cc1-n1c(C)cc(C=O)c1C 1135732680 BDQYYXVOZOFBPE-UHFFFAOYSA-N 445.563 4.324 10 10 IICE Cc1cc(C(=O)Nn2cc(Br)cn2)c(C)n1-c1ccc(Br)cc1 1137730107 AJRYOPDBPBQGLT-UHFFFAOYSA-N 438.123 4.200 10 10 IICE COc1ccc(C(=O)N2CCC[C@@H](C(=O)N[C@H](C)c3ccccc3O)C2)c2ccccc12 1151885930 NVYWFGLWPIOZAW-QZTJIDSGSA-N 432.520 4.284 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@](C)(C(F)F)C2)c(C)n1-c1ccc(Br)cn1 1167341456 HMPLPJNACBDIFV-BUXKBTBVSA-N 442.304 4.136 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc([C@H]4CC(=O)NC(=O)N4)cc3)c2C)c1 1167726716 WVIRNVHZVGOMGE-JOCHJYFZSA-N 430.508 4.234 10 10 IICE CN(Cc1ccccc1)c1nnc([C@H]2CCCOC2)n1CCCSc1nccs1 1298346205 USBQVCHGAOKWBV-SFHVURJKSA-N 429.615 4.447 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H]3CC[C@@H](c4cccc(Cl)c4)C3)cc2)CC1 1312848707 ULCLBLIYTGZYOI-IFMALSPDSA-N 426.992 4.227 10 10 IICE CC(=O)c1ccc(OC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1 1352394156 FXNQSLQETVFFRH-PDGQHHTCSA-N 429.494 4.225 10 10 IICE CC(=O)c1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1354539519 OCVDDVRHPORPOF-LDADJPATSA-N 428.510 4.258 10 10 IICE Cc1ccc(CN(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)s1 1361124737 HKJACGRXBMYWLG-GZTJUZNOSA-N 434.583 4.446 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H](C)Oc3cccc(Cl)c3Cl)CC2)c(OC)c1 1461979781 GCSDWNUUUNTAQZ-CQSZACIVSA-N 439.339 4.127 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)N(C)C)cc1 1463282555 OUIDUEGWYYYQHQ-NRFANRHFSA-N 435.572 4.133 10 10 IICE CCN1CCN(Cc2ccc(CNC(=O)c3sccc3-n3c(C)ccc3C)cc2)CC1 1464163849 ZTXABYRXSAHBRA-UHFFFAOYSA-N 436.625 4.223 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCN(C(=O)c2cccc(Cl)c2)CC1 1464640006 VFHUJHFFSIXCIV-UHFFFAOYSA-N 449.938 4.158 10 10 IICE CN1CCN(c2ccc(CNC(=O)NC3(c4cccc(Cl)c4)CCCC3)cc2)CC1 1471190213 GXGPADBGCWEOHO-UHFFFAOYSA-N 426.992 4.361 10 10 IICE CC1=C(C)CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)CC1 1510404800 RYMAWPKKDHDMIL-UHFFFAOYSA-N 426.615 4.449 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)cc1 1517165421 DNKDPJQLGVZSHX-QHCPKHFHSA-N 437.490 4.293 10 10 IICE C[C@@H](Cc1ccccc1Cl)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1526015314 MCJPXMCSIKWADY-IBGZPJMESA-N 426.004 4.367 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccc(C(=O)OC(C)(C)C)nc2)cc1 1528643952 SAFRPVJWQITKFK-UHFFFAOYSA-N 437.462 4.308 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cc2cc[nH]c2cn1 1530667774 QVPORHPJRMMKHG-XNTDXEJSSA-N 428.564 4.245 10 10 IICE CC1CCN(c2ccc(Cn3c(C(C)C)nnc3N(CCCCO)C3CC3)cc2)CC1 1544289391 RUKOYSJXKLLOMT-UHFFFAOYSA-N 425.621 4.427 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)Oc1ccc2c(c1)CCC2 1556426394 LCYUDSVXFCOZKK-SFHVURJKSA-N 438.568 4.331 10 10 IICE C[C@H](NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)c1ccc(N(C)C)cc1 1564598099 ZJOROIZZSGENDX-NBGIEHNGSA-N 444.579 4.041 10 10 IICE Cc1cc(CNC(=O)NCCNc2ccc(C(F)(F)F)cn2)c(C)n1-c1ccccc1 1565193323 VKYMODRRNPWGAP-UHFFFAOYSA-N 431.462 4.419 10 10 IICE O=C(CNc1cccc(C(F)(F)F)c1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1566356987 UEPUDPXQRZBURD-GOSISDBHSA-N 441.881 4.257 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C2CCCCCC2)cc1 1583621323 FVVMXNRDFNIPJM-QFIPXVFZSA-N 447.620 4.454 10 10 IICE CC(C)N1CCN(c2nnc(CC3CCCC3)n2CCCSc2nccs2)CC1 1608146109 JHMYHLOBQRIITA-UHFFFAOYSA-N 434.679 4.180 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1ccc(C)nc1 1613295604 KVAMYKMMWLQJLP-IBGZPJMESA-N 434.588 4.269 10 10 IICE CC[C@H](C)N(C)CCn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1613418246 SAMXWPGZQHHNIX-CZTZKLFOSA-N 443.636 4.269 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)c(C)n1-c1cccc(Cl)c1 1622292825 KHASHDVLJPAYBM-LJQANCHMSA-N 426.900 4.455 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(CN2CCCCC2)cc1 1622635309 XDVHRZMAOOSOBC-QHCPKHFHSA-N 442.003 4.426 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Br)cc(Br)c1N 1624480640 XELBYRYDPLVFOB-UHFFFAOYSA-N 441.167 4.132 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1csc(Nc2cc(F)cc(F)c2)n1 1624537835 SEJRRAVVQVQRSE-UHFFFAOYSA-N 444.507 4.274 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC1CCCCC1)C(=O)NCc1ccc(N2CCOCC2)cc1 1626693590 PLEQFPFGGIXNNV-QFIPXVFZSA-N 445.604 4.003 10 10 IICE O=C(Cc1cccc(I)c1)NCc1ccc(N2CCCCC2)cc1 1630698212 OMJVRUKTVPBVSM-UHFFFAOYSA-N 434.321 4.140 10 10 IICE CO[C@@H]1CCC[C@@H]([C@H](CO)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C1 1632687478 HZENRWFIWABNPR-BSIFCXSSSA-N 449.389 4.153 10 10 IICE Cc1cc(CC(=O)N2CCC(n3cc(N(C)C)cn3)CC2)c(C)n1-c1ccc(Cl)cc1 1637682643 MQCIXNIZYRKJOZ-UHFFFAOYSA-N 439.991 4.416 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1653421059 HTOCTOCBSHJTEY-RUZDIDTESA-N 432.568 4.005 10 10 IICE CCOC(=O)c1c[nH]nc1[C@H]1CCN(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)C1 1659613647 WXHJIOHJAFTDCG-KRWDZBQOSA-N 446.511 4.430 10 10 IICE COc1ccc(CN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)[C@H](C)C2CC2)cc1 1676653830 YPNLCJZIMCWFFT-KBMIEXCESA-N 438.616 4.374 10 10 IICE CCN(Cc1cccc(Br)c1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1687155597 RQHVYOZCYIYFLP-UHFFFAOYSA-N 446.389 4.142 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCCO2)nnc1N1CCO[C@@H](C(C)(C)C)C1 1693006385 XRXYPMSIICXSON-FGZHOGPDSA-N 441.620 4.194 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CCC[C@H](C(C)C)C1 1707305279 VWRWYTRWEXVBSZ-RBBKRZOGSA-N 425.621 4.467 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC(CC)(CC)OC 1708526699 CPDJAECRFKZVNI-SFHVURJKSA-N 447.599 4.471 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N2CCCC[C@H](SC)C2)cc1 1710026567 LBGLXKQAGOSMHW-UNMCSNQZSA-N 443.661 4.398 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1710767706 VBRSKSYYCNPOEZ-DENIHFKCSA-N 445.583 4.026 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)C[C@@H](C)c1nccs1 1761697342 CSBIKLLEDUGVFG-GOSISDBHSA-N 447.612 4.459 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCN2CCCC(C)(C)C2)n1 1761915922 DCAVWGBDELKSBJ-UHFFFAOYSA-N 434.588 4.113 10 10 IICE CCS[C@H]1CC[C@H](N(C)c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)C1 1768361486 NPBMWJADVSEJHY-SFTDATJTSA-N 431.675 4.298 10 10 IICE O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)C(C(F)(F)F)=NN1Cc1ccccc1Cl 1865677895 IYSLJURLHIFIKF-GHXNOFRVSA-N 425.750 4.298 10 10 IICE CC[C@H](C)N1C(=O)C(NCc2cccnc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164006 HTVYSTSWORQDRG-KRWDZBQOSA-N 428.536 4.157 10 10 IICE CCOCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(C2CCCC2)C1=O 1873169575 DAQQGZMCLNYJRZ-UHFFFAOYSA-N 435.568 4.133 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2cc(Br)cc(F)c2O)[C@H]2CCC[C@@H]21 1925970720 OAJJBPQYELWHOY-KBMXLJTQSA-N 429.330 4.171 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@H](N=[N+]=[N-])CC1 2010404981 WFFNKBFNXXTYDA-OALUTQOASA-N 431.537 4.178 10 10 IICE C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)OCc1ccccc1)c1ccccc1O 2017513992 AHWOLHJUAUVNJE-CSODHUTKSA-N 428.529 4.068 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@@H](N)c1ccc2c(c1)CCCN2C 2044759501 YYQLBADGRBIYMC-VWNXMTODSA-N 438.616 4.094 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N2CCC[C@H](N=[N+]=[N-])C2)C1 2060638820 BFPASTKVMLJIHM-CVDCTZTESA-N 443.548 4.132 10 10 IICE CN1CCc2cc([C@@H](O)c3ccc(I)c(Br)c3)ccc21 2163061073 DWSWPLKUQKYKHG-MRXNPFEDSA-N 444.110 4.128 10 10 IICE Cc1ccc([C@@H](C)NC2CN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C2)c(O)c1 2259425563 DQCLKLHLQKAOSV-QGZVFWFLSA-N 449.592 4.208 10 10 IICE CC[C@@H](C)N1C(=O)C(=Cc2c(NCC(C)C)nc3ccc(C)cn3c2=O)SC1=S 2296545976 DOVJPOZRRSIXKI-CQSZACIVSA-N 430.599 4.071 10 10 IICE CCC1=NN2C(=N)C(=Cc3cc(C)n(-c4ccc(OC)cc4OC)c3C)C(=O)N=C2S1 2297470567 JNTLGLFVOBDRKY-UHFFFAOYSA-N 437.525 4.141 10 10 IICE Cc1cc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)c(C)n1-c1cccc(F)c1 2313558951 NOGOQFQLWIJUIL-UHFFFAOYSA-N 437.471 4.204 10 10 IICE O=C1C(=Cc2cccc(O)c2)SC(=S)N1c1ccc(I)cc1 2321616800 BCPYRAFDCZBENH-UHFFFAOYSA-N 439.299 4.403 10 10 IICE Cc1ccc(CNC(=O)C[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2380753054 BOSWBKJTMGMKQU-DZGCQCFKSA-N 441.366 4.163 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381133481 PHKVCIOBXYZQHR-HXUWFJFHSA-N 441.366 4.117 10 10 IICE COc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c(OC)c1 8608797 QJPOTJWKELWNSI-RUZDIDTESA-N 445.563 4.304 10 10 IICE O=S(=O)(NCc1ccccc1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(O)cc1O)N2 13639986 QTLAHGOYFLVJGI-UMEGOILYSA-N 448.544 4.403 10 10 IICE COCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14471396 MGYCDGRZADLPHE-XFQAVAEZSA-N 427.888 4.451 10 10 IICE Cc1c(-c2ccc(Br)cc2)c(=O)oc2c(CN3CCCOC3)c(O)ccc12 94993443 PXISNPBEZQBRLY-UHFFFAOYSA-N 430.298 4.416 10 10 IICE Cc1ccccc1/C=C1/SC(=S)N(CCCC(=O)Nc2ccc(C(=O)O)cc2)C1=O 210720636 YCLBBQDITHZBOC-QGOAFFKASA-N 440.546 4.313 10 10 IICE Nc1ccc(NC(=O)Nc2ccc(I)c(Br)c2)cc1 388595666 BQMUDRJUNRPFQX-UHFFFAOYSA-N 432.059 4.280 10 10 IICE CCOC(=O)C1=C(C)N(C)C2=S=C(c3ccccc3)C(=O)N2[C@@H]1c1ccccc1Cl 584906374 LGZZEYHLGSWIMY-LJQANCHMSA-N 440.952 4.047 10 10 IICE O=C(Nc1ccc(C(=O)N2CCCC2)cc1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 586711787 CQTYWQHMVXYGQD-UHFFFAOYSA-N 439.471 4.342 10 10 IICE O=C(NCc1ccc(Cn2ccccc2=O)cc1)N(Cc1ccco1)Cc1ccccc1O 726238177 OINQNCWCLLUQGH-UHFFFAOYSA-N 443.503 4.107 10 10 IICE CN1CCCc2cc(CNC(=O)[C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)c3ccccc3)ccc21 727309229 FWZVIRPPCZYVFR-GPXOXTDOSA-N 431.580 4.159 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(=O)Nc2nc3c4c(ccc3s2)CCCC4)cc1 733856667 XQAIVZLUELCGQP-UHFFFAOYSA-N 436.581 4.276 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccnn2[C@H](C)CC(C)C)c(C)n1-c1ccccc1 746354868 YIZOGJBGFYYUND-LJQANCHMSA-N 435.572 4.195 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H](c1cccnc1)C1CC1 760012063 PHIDSDBOKZQBQP-XYSGSMRZSA-N 443.619 4.392 10 10 IICE Cn1ncc(Br)c1/C=C1/SC(=S)N(c2ccc(OC(F)F)cc2)C1=O 779202326 AFBXNZOITSFXTD-WUXMJOGZSA-N 446.298 4.190 10 10 IICE CCn1c(CNC(=O)N[C@H](C)c2ccc(N(C)C)cc2)nc2cc(Br)ccc21 790501932 KYMBRMVPOWUMIL-CQSZACIVSA-N 444.377 4.445 10 10 IICE C[C@@H](NC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(N2CCOCC2)cc1 792501135 JUDQKYLMHHYHCL-AUUYWEPGSA-N 425.426 4.326 10 10 IICE COCc1c(Br)cccc1NC(=O)NCc1cc(Br)ccc1O 806246868 BRPGATIXNHAGQJ-UHFFFAOYSA-N 444.123 4.385 10 10 IICE CCOC(=O)c1ccc2c(c1)nc(CN(Cc1ccccc1O)C[C@H]1CCCO1)n2CC 808736244 NYBJXGFORNHRCK-HXUWFJFHSA-N 437.540 4.120 10 10 IICE CCn1c([C@H]2OCC[C@H]2c2ccccc2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 812035278 GZMTVLLNEQXJSD-ZEQRLZLVSA-N 447.583 4.269 10 10 IICE O=C1COc2ccc(S(=O)(=O)Nc3nc(-c4ccc5ccccc5c4)cs3)cc2N1 818783506 HGSDSQKUOFZSKV-UHFFFAOYSA-N 437.502 4.095 10 10 IICE O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCc1ccc(N2CCOCC2)c(F)c1 917707558 NKFOAODOEJMIHW-SOFGYWHQSA-N 425.891 4.194 10 10 IICE COC(=O)CCCc1csc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)n1 1126915857 DXORTEYCCNVKME-UHFFFAOYSA-N 441.553 4.120 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnc(-c4ccc(F)c(F)c4)s3)C2)cc1 1130185527 KQQKGQUWTZFKBC-AWEZNQCLSA-N 429.492 4.353 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CSCc2coc(-c3ccccc3)n2)cc1 1130745307 UDRGVSBFTYHRFO-UHFFFAOYSA-N 425.554 4.178 10 10 IICE CCOc1cc(C(=O)OC)ccc1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1133677375 SCDRIBCAEWNVRD-UHFFFAOYSA-N 436.508 4.353 10 10 IICE Cc1cccc2sc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)c(Cl)c12 1133847130 FQDYOXYCEGMMFR-UHFFFAOYSA-N 441.984 4.495 10 10 IICE Cc1ccc(O[C@@H](C)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134682172 YYAJCTRUCYOVFA-JXFKEZNVSA-N 448.405 4.010 10 10 IICE O=C(Nc1cc(Br)ccc1N1CCOCC1)c1cc2cc(O)c(O)cc2s1 1135607347 GKSKGRABDCDYRH-UHFFFAOYSA-N 449.326 4.164 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](C)N3CCN(c4ccc(F)cc4)CC3)c2C)c1 1151153642 NBMZDQCFYUHOKC-JOCHJYFZSA-N 448.586 4.369 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(CC3CCC3)[C@@H](C)c3ccccc3)CC2)cc1 1167453924 OXRKDIKOXIQMBV-BKMJKUGQSA-N 437.628 4.041 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)C[C@H]1CCCC(=O)N1 1182481669 KAKPREPRZZEFGD-APWZRJJASA-N 433.474 4.357 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H](CCC(=O)OC(C)(C)C)C3)C2)cc1 1230301136 RCKLPNQPDNBQPJ-VQTJNVASSA-N 445.604 4.065 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1 1290224487 QPFGYYWGRGEBIM-UHFFFAOYSA-N 436.455 4.289 10 10 IICE CCOC[C@H]1CCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C1 1297416824 YCIUHXLMQIRJKU-JTHBVZDNSA-N 441.620 4.277 10 10 IICE CCc1nnc(N2C[C@@H](C)O[C@H](c3ccccc3)C2)n1CCCSc1nccs1 1306112505 KYZGQSQHYTWILK-AEFFLSMTSA-N 429.615 4.446 10 10 IICE CCCN(CCNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)C(=O)OC(C)(C)C 1312413054 MLUFKQZZUKAMMP-UHFFFAOYSA-N 432.609 4.465 10 10 IICE COCCN(Cc1ccco1)c1nnc(CC(C)C)n1Cc1ccc2c(c1)CCCN2C 1316098066 QAPJADXMAHNHCL-UHFFFAOYSA-N 437.588 4.153 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(-c2ccc(F)cc2)no1 1352891430 GDINDDOLXIADTI-UHFFFAOYSA-N 431.414 4.481 10 10 IICE CC(C)[C@H](C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)N1C[C@H](C)O[C@H](C)C1 1448454197 UFINYULIKBVNHO-CROMWVBPSA-N 436.040 4.326 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1449116515 FVZDMRMZZVEWKB-ORAYPTAESA-N 442.339 4.021 10 10 IICE Cc1cc(C(=O)NCC2(CCO)CCCCC2)c(C)n1-c1ccc(Br)cn1 1450835357 DDAPWZAXKBUMTN-UHFFFAOYSA-N 434.378 4.314 10 10 IICE CC[C@]1(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)CCNC1=O 1457573931 INPXRWGGUHVIGS-GCJKJVERSA-N 433.474 4.214 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3c(-c4ccccc4)oc(C)c3C)CC2)cc1 1464543154 PDDMSVMXRLMDFF-UHFFFAOYSA-N 433.552 4.124 10 10 IICE COc1ccc(CNC(=O)N[C@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)c(O)c1 1470371271 DOBNXSZFLSOVSY-HXUWFJFHSA-N 443.544 4.246 10 10 IICE CC[C@@]1(C)CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1497630405 AVSJFHMPBLNCTE-JXFKEZNVSA-N 437.635 4.164 10 10 IICE CCOCc1nnc(N2C[C@@H](C)O[C@H](CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1516498621 WKHREXKMGHIVDH-NFBKMPQASA-N 441.620 4.103 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3C[C@@H](OC(C)(C)C)[C@H]3n3cccn3)ccc21 1521747036 CZTBXYCJHDIWFR-MZYLBHOOSA-N 438.572 4.028 10 10 IICE CC1=C(C)C[C@](C)(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CC1 1527974239 SREWQODZXPKUEM-RUZDIDTESA-N 437.563 4.085 10 10 IICE COc1ccc(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)nc1Br 1535136328 LBHMYAZKWFZSKR-UHFFFAOYSA-N 428.330 4.499 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)/C=C\c3ccc4c(c3)NC(=O)CO4)cc2Cl)C1 1538422509 XKPPQNKOFSWZKO-HWYHOQROSA-N 439.943 4.237 10 10 IICE CC1(C)CN(c2nnc(Cc3ccsc3)n2CCCSc2nccs2)CCO1 1542011832 SVDHPTKATBABON-UHFFFAOYSA-N 435.644 4.185 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@@H](N2CCCCC2)C1 1542227196 VRZMHXXRRVDPTA-HSZRJFAPSA-N 438.664 4.354 10 10 IICE CCOC(=O)[C@@H](CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C)Cc1ccccc1 1542372206 FTDRILXMNYMSFC-OAQYLSRUSA-N 432.520 4.058 10 10 IICE CC[C@@]1(C)CCN(c2nnc([C@H]3OCC[C@H]3COC)n2Cc2ccc(N(C)C)cc2C)C1 1546081677 URQHYPNOQBGQPD-XTJBDQBJSA-N 441.620 4.051 10 10 IICE C[C@@H](O)c1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1F 1556525222 KLSABNFOJONMCE-HIPMGEKLSA-N 448.516 4.248 10 10 IICE C[C@H](NC(=O)c1cc(S(=O)(=O)N(C)c2ccccc2)ccc1Cl)c1ccccc1O 1557968083 SGVBTJMZFYVPRA-HNNXBMFYSA-N 444.940 4.362 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)/C=C\c3ccc(O)c(O)c3)CC2)CC1 1558641469 WGQFODLTUJWEDT-GXVATQTDSA-N 444.572 4.387 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CCC1 1566306199 CVPNFCPCZCRIEV-KRWDZBQOSA-N 441.366 4.197 10 10 IICE CC(F)(F)C(C)(C)CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1595321886 XGJDAJZGKLGKJI-UVTDQMKNSA-N 430.517 4.215 10 10 IICE CC(C)Cc1nnc(N(C)CC2CCCCC2)n1Cc1ccc(N2CCOCC2)cc1 1603332984 MDVGHGXEQPKIFE-UHFFFAOYSA-N 425.621 4.378 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@H]3C)n2CCCOC(F)F)c(C)n1-c1ccccc1 1611935921 KBNLKIIICPEQNP-QGZVFWFLSA-N 445.514 4.207 10 10 IICE COCCN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1617614971 GMUAXYKKOQFQCH-UHFFFAOYSA-N 448.519 4.233 10 10 IICE COc1cc2oc(=O)cc(C)c2cc1CCC(=O)NCc1ccc(N2CCCCC2)cc1 1627209876 JKKQVOVUUJELBL-UHFFFAOYSA-N 434.536 4.349 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 1632049251 JLWKWXAMWISXII-UHFFFAOYSA-N 448.523 4.424 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)O[C@@]3(CCOC3)C2)c(C)n1-c1ccccc1Br 1634918072 ZUWWJJJSVXSQIT-QFIPXVFZSA-N 447.373 4.267 10 10 IICE Cc1cc(C(=O)N2CC[C@H](N3CCC3)[C@H](F)C2)c(C)n1-c1ccc(Br)cc1 1635745754 QUJBNIZZSDETHY-UXHICEINSA-N 434.353 4.115 10 10 IICE CN(C)c1cc(C(F)(F)F)nc(N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)n1 1639551446 PBJHJPHBHWJWCY-GFCCVEGCSA-N 431.409 4.244 10 10 IICE C[C@@H](NCC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1ccccc1O 1644182907 ALCRECVLWFXDQP-HXUWFJFHSA-N 440.547 4.271 10 10 IICE CCC[C@H](C(=O)OCC)n1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)n1 1645133119 HXFGGZNTVUAFAH-OAQYLSRUSA-N 436.512 4.260 10 10 IICE CCN(C)c1ccc(CN[C@]2(C(=O)OC)CCc3cc(Br)ccc3C2)cc1 1659482151 YQALDLAPPGIISR-JOCHJYFZSA-N 431.374 4.096 10 10 IICE CCCNC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)C1 1672133023 MZVZDMPDCCRUOF-MJGOQNOKSA-N 435.012 4.024 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H](c2ccc(F)c(F)c2)c2nccn2C)C2CC2)cc1 1684618106 QLDVHFPUKDITMM-JOCHJYFZSA-N 439.510 4.228 10 10 IICE COc1cccc(CN(CC(C)C)C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c1 1685609145 KWMOYCGLLVRQCI-DEOSSOPVSA-N 426.605 4.232 10 10 IICE CCCO[C@H]1CCCN(c2nnc(CC3CC3)n2Cc2ccc(N(C)C)cc2C)CC1 1709882042 QKNQPONTGHCWCN-QHCPKHFHSA-N 425.621 4.439 10 10 IICE CO[C@@H](CCn1c(C2CC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(F)(F)F 1729854465 NHKWTSUTQVQKGO-IBGZPJMESA-N 437.510 4.360 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC[C@H](OC(C)(C)C)C1 1742141775 OGQYWXPYDDCQPL-FCHUYYIVSA-N 441.620 4.336 10 10 IICE CCCc1nc(C)c(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)o1 1765620718 YNMZMVZONAGKPE-IBGZPJMESA-N 425.533 4.159 10 10 IICE O=C1c2ccccc2C(=O)c2cc(NC(=O)C3CCN(C(=O)C4CCCCC4)CC3)ccc21 1860585892 FLAHHUAASMTHMF-UHFFFAOYSA-N 444.531 4.219 10 10 IICE Cn1nc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1CCc1ccccc1 1862326244 CSUDCEVRFQPJJP-UHFFFAOYSA-N 435.483 4.233 10 10 IICE C[C@@](CCc1ccc(O)c(O)c1)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 1951742443 YQNYAYQKEYMJMO-SANMLTNESA-N 447.487 4.412 10 10 IICE CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)CC(=O)N1CCCC[C@H](CN=[N+]=[N-])C1 2060639979 OBWAYDSYHKRMCR-WOJBJXKFSA-N 445.564 4.426 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(C)(C)C)c(N)c2I)c(O)c1 2079038241 XKOHDJIXVCBNAE-HNNXBMFYSA-N 425.314 4.381 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@H]1CCNCc1c(O)cccc1Br 2226204661 YQXQNWBPGBEMKL-LBPRGKRZSA-N 435.309 4.279 10 10 IICE CNCc1ccc(N(C)Cc2ccccc2I)c(Br)c1 2280346785 HUQWHQOSDCDJKZ-UHFFFAOYSA-N 445.142 4.410 10 10 IICE COC(=O)c1ccc(C=C2N=C(c3ccc(OC)cc3)N(c3ccc(F)cc3)C2=O)cc1 2297332287 FJRIFFNEUYUWCX-UHFFFAOYSA-N 430.435 4.455 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1[C@H]2C[C@@H](CN(c3ccc(OCc4ccccc4)cc3)C2)[C@@H]1CO 2314471479 MJGDTIYRNXXENL-NVXDSCFRSA-N 438.568 4.224 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccc(O)cc2)SC1=S)Nc1nccs1 2314837047 NNDDUHFTKJNETJ-UHFFFAOYSA-N 433.580 4.249 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352684935 CBAKFMWBWBHWMZ-IMJJTQAJSA-N 425.367 4.341 10 10 IICE N=C1/C(=C\c2ccc(-c3ccccc3Cl)o2)C(=O)N=C2SC(N3CCCC3)=NN12 20356230 HJDUXLSNUVNGGK-GQLQIFLCSA-N 425.901 4.272 10 10 IICE O=C(O)c1ccc(N2C(=O)/C(=C\c3ccc(O)c(Br)c3)SC2=S)cc1 32789492 VUHCRRBLOGHKEP-RIYZIHGNSA-N 436.308 4.259 10 10 IICE COc1cc(OC)c(/C=C2\C(=O)N(c3ccc(C)cc3)C(=O)N=C2O)cc1Br 33319791 NCAOIHINBQEIOR-ZSOIEALJSA-N 445.269 4.281 10 10 IICE CSCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(-c3ccccc3F)o2)SC1=S 40567389 LQGYHWGWEKPFSS-FBKCMUNRSA-N 437.539 4.493 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccccc3F)C(=S)N=C2O)c(C)n1C[C@H]1CCCO1 59109287 AGUWVFOZAQIISY-FEEIMYBTSA-N 427.501 4.095 10 10 IICE CS(=O)(=O)N(Cc1ccc(Cl)cc1)c1cccc2c1C(=O)c1ccccc1C2=O 586186190 QQFUDDYKKRDRLA-UHFFFAOYSA-N 425.893 4.082 10 10 IICE COc1ccc2c(CC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)coc2c1 726566304 NVSWHHKXCZFOIW-UHFFFAOYSA-N 430.451 4.371 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCO[C@H](C2CCCCC2)C1 758450008 QDLVLKFFELPORS-NRFANRHFSA-N 437.531 4.248 10 10 IICE COc1cc(N2CCN(C(=O)N[C@H](C)c3ccc(Cl)s3)CC2)cc(OC)c1OC 759217880 ZBHPXPQPCLRWQY-CYBMUJFWSA-N 439.965 4.020 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H]1CCOC2(CCSCC2)C1 771560223 NQPZJKBGHGWUHH-INIZCTEOSA-N 443.407 4.131 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)/C=C\c3ccc(O)c(O)c3)cc2C(F)(F)F)C[C@@H](C)O1 779515414 WBJSRKZMGCXADS-DACCUQLDSA-N 436.430 4.382 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC3CCN(c4ccccn4)CC3)cc2Cl)C1 799883546 HLUATPRLKYMGGZ-SFHVURJKSA-N 442.007 4.440 10 10 IICE CCCOc1nc2ccccc2cc1/C=C/C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1 1131031311 ZEHHZGUUWDGBSC-CDDKBXLESA-N 431.536 4.441 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc3c(Br)cccc3cn2)N(C)C)cc1 1134686648 QWGVYHISEIVJQJ-NRFANRHFSA-N 441.373 4.096 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccnc(Cl)c1 1134751352 YLHYDDUTQXGTGS-UHFFFAOYSA-N 428.677 4.460 10 10 IICE Cc1ccccc1CN1CCO[C@@H](CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)C1 1152109554 BXTRUOVPJCLEPI-DEOSSOPVSA-N 431.580 4.342 10 10 IICE C[C@H](NC(=O)c1cc(Br)cc(Br)c1O)c1ccc(N(C)C)cc1 1154669067 PMBAHYLZLFKGFR-JTQLQIEISA-N 442.151 4.474 10 10 IICE CC(C)(C)OC(=O)NCC[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2ccc(O)c(O)c2)C1 1156511726 LLNHVIYNJCOFJD-SXAWMYDMSA-N 438.524 4.231 10 10 IICE Cc1cc(=O)oc2cc(N(C)C(=O)c3ccnc4c3CCN4C(=O)OC(C)(C)C)ccc12 1157107420 BVUNTRGAHMIOSP-UHFFFAOYSA-N 435.480 4.071 10 10 IICE CN(C)c1ccc([C@H](CNc2ncc([N+](=O)[O-])cc2Cl)NC(=O)OC(C)(C)C)cc1 1163224263 GPUNGGQIFPFOSN-KRWDZBQOSA-N 435.912 4.387 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC(CC4CCCCC4)CC3)cc2)CC1 1251103167 BKSOZZQRSXAYNI-UHFFFAOYSA-N 440.632 4.280 10 10 IICE CC(C)(C)c1ccc(CNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)o1 1287887883 CEUDQPRDXLEAGD-UHFFFAOYSA-N 432.432 4.191 10 10 IICE CC[C@H]1CN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@@H](C)O1 1293606077 FMKNBPDTLBLQGF-KNQAVFIVSA-N 443.661 4.082 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N(C)C)cc1C 1302010793 AZOODHYTGUESCL-UXHICEINSA-N 443.636 4.297 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)c(F)c1 1305370329 OHVFMBCHDFQJFN-OXQOHEQNSA-N 439.583 4.292 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H]3C(C)C)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1361049367 BKEOSMDQLRRDJK-JOCHJYFZSA-N 434.588 4.066 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](C)CS(=O)(=O)c3ccc(F)cc3)c2C)c1 1438310423 GFHQDPJJWSGUKK-QGZVFWFLSA-N 442.556 4.268 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1 1444875333 ZCHOFDYEGXFKMN-UHFFFAOYSA-N 435.543 4.433 10 10 IICE Cc1csc(Nc2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cc2)n1 1451046738 IRGVIYRBPKLQNK-UHFFFAOYSA-N 444.507 4.240 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(CC(C)(C)C)CC(C)(C)C)cc2F)C[C@H](C)O1 1459889863 JFWGEBKBTBBCPG-OALUTQOASA-N 435.628 4.450 10 10 IICE Cc1cc(CNC(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1471036477 CZMKHQJJRURVLG-UZLBHIALSA-N 426.561 4.291 10 10 IICE CCOc1cccc(N2CCC(NC(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)n1 1472353441 LZDLATDHEWWYCE-UHFFFAOYSA-N 446.551 4.099 10 10 IICE CC(=O)c1cc(Cl)cc(CN(Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)c1O 1473587539 AGXVFMWORGMODO-WGSAOQKQSA-N 432.904 4.462 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(C)[C@H](CCc2ccccc2)C(F)F)N(C)C)cc1 1479535632 XWHSZCNFRKYYMI-FGZHOGPDSA-N 432.559 4.263 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1cccs1 1503014333 NUAHVWLEVCZUDZ-UHFFFAOYSA-N 425.602 4.355 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)CN(C)C(=O)OC(C)(C)C 1509138248 NLNFSQHHNWKBCI-GOSISDBHSA-N 445.608 4.322 10 10 IICE CC(=O)N(CCc1ccccc1)CC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1519550061 FKWSFCKHDMEQBZ-LJQANCHMSA-N 442.003 4.284 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)[C@H]4CCCCS4(=O)=O)n3)c2C)cc1 1523937284 QQNXKNGJYKUZLK-HXUWFJFHSA-N 443.594 4.432 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3CCc4cc(Br)ccc43)CC2)cc1 1528110255 LLPBIVWREXEKJA-OAQYLSRUSA-N 429.358 4.273 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)N(C)Cc3ccc(N4CCCC4)cc3)c2)n1 1539474443 KXYZWAVUXODWLH-UHFFFAOYSA-N 431.540 4.415 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1 1564946459 PXGNXEXABICUEY-AMGIVPHBSA-N 434.628 4.300 10 10 IICE Cc1cc(Cl)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1N 1565883934 DQASMTZMXODBMB-LJQANCHMSA-N 446.979 4.292 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1 1597561099 OLDZLGVNRIRFMY-SFHVURJKSA-N 438.549 4.046 10 10 IICE O=C(Nc1cc(Cl)ccc1O)C1CCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1611112586 UWKMJQATONDWRW-UHFFFAOYSA-N 446.912 4.162 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)COc3ccc(OCc4ccccc4)cc3)C2)cc1 1617255093 FQLGTLGNBUYSKA-NRFANRHFSA-N 432.520 4.048 10 10 IICE CCN1CCN(Cc2ccccc2CNC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 1624453774 DARNMQYTHXQUIT-UHFFFAOYSA-N 430.596 4.162 10 10 IICE CC(C)(C)OC(=O)N1[C@@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CC[C@@H]1C1CC1 1624892066 AIENTYJEKYJISO-NHCUHLMSSA-N 445.629 4.034 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)N3CCc4c(Br)cccc43)ccnc21 1626959464 CCYFLCNPHJOJQZ-UHFFFAOYSA-N 444.329 4.345 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1636058907 WIKOKFNYJRXUCG-INIZCTEOSA-N 425.566 4.167 10 10 IICE COCC(=O)N1CCc2c(NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)cccc21 1638221163 GLHQYHQBQDBGBO-UHFFFAOYSA-N 445.519 4.003 10 10 IICE Cc1cc(CC(=O)Nc2cnn(CC(=O)OC(C)(C)C)c2)c(C)n1-c1ccc(Cl)cc1 1640013703 MGEIXBRXNLIOSD-UHFFFAOYSA-N 442.947 4.467 10 10 IICE COc1ccc(N(CCc2ccccc2)Cc2ccc(S(=O)(=O)N(C)C)s2)cc1 1642153310 JWZAYYYREGTCHX-UHFFFAOYSA-N 430.595 4.256 10 10 IICE COc1cc(N2CCN(c3nc(C(F)F)nc4ccc(F)cc34)CC2)cc(OC)c1OC 1650950230 IYCZJCHGWFOIAG-UHFFFAOYSA-N 448.445 4.059 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc4cnc(Cl)cc4c3=O)c2C)cc1 1651917428 DINLRDUNZUDGJT-UHFFFAOYSA-N 436.899 4.134 10 10 IICE COc1ccc(N2CCN(CC(=O)N[C@@H](c3ccccc3)C3CCCCC3)CC2)cc1F 1657763843 UVRQTNUSAQMLKC-SANMLTNESA-N 439.575 4.394 10 10 IICE CN(Cc1csc(Br)c1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1685682373 ZXNJWFAOPBHCRT-QGZVFWFLSA-N 439.423 4.021 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCN([C@@H](C)c2ccc(F)cc2F)CC1 1686826599 LITZSCJRHDCQDL-OALUTQOASA-N 444.570 4.359 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N(C)CCC(F)(F)F)cc1 1695626319 RTQJRLQSSVIQHV-QGZVFWFLSA-N 425.499 4.065 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1709219770 HXWOYKAIMCMBPT-YLJYHZDGSA-N 434.588 4.066 10 10 IICE CC1CCN(CCCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)CC1 1726628175 GWGUDUZXHAQXBC-UHFFFAOYSA-N 434.588 4.194 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cccn(CC)c1=O 1726878816 TWJRPLJSVKNOOK-FQEVSTJZSA-N 448.615 4.258 10 10 IICE CCc1nnc(N2CCCC[C@@H](COC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1727592454 VSEJCWABUUAQHZ-JOCHJYFZSA-N 425.621 4.378 10 10 IICE CCOCCCCn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1729127721 MYCKCFBZUAYPGS-UHFFFAOYSA-N 448.365 4.194 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)n1 1751838512 IULOXGRFQZXBEV-UHFFFAOYSA-N 435.620 4.053 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CC2)nnc1N1CCC(C(=O)C(F)(F)F)CC1 1761698805 XXQHUULOPKXKDS-UHFFFAOYSA-N 449.521 4.001 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3CCc4c(c5cc(Cl)ccc5n4C)C3)CC2)cc1 1858153756 UEDKKKCJWBIPIB-KRWDZBQOSA-N 437.971 4.294 10 10 IICE CC(C)(C)C(=O)Nc1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccn1 1860500363 JSEUJXJGYKMXSN-UHFFFAOYSA-N 427.460 4.094 10 10 IICE O=C(NC1(C(=O)O)CC(c2ccc(O)c(O)c2)C1)OCC1c2ccccc2-c2ccccc21 1952495713 PUBRLENPKUNZBU-UHFFFAOYSA-N 445.471 4.337 10 10 IICE CC(C)(C)OC(=O)NC1(CC(=O)NCCCCN=[N+]=[N-])CCN(Cc2ccccc2)CC1 1963732382 MUOJIAZCSVDXHH-UHFFFAOYSA-N 444.580 4.143 10 10 IICE COc1ccc([C@@H](n2nc(C(F)(F)F)c(CO)c2Br)C2(C)CC2)c(O)c1 2079873047 JNYJSOKORSDFIG-CQSZACIVSA-N 435.240 4.260 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(CNCc2cc(Br)cc(F)c2O)cn1 2112870248 BBLYZUQDFPTCAC-UHFFFAOYSA-N 426.286 4.326 10 10 IICE CN(C[C@H](O)COCc1ccccc1)c1ccc(CNC2CCC2)c(Br)c1 2240042916 KYCKDTALSRNLIJ-NRFANRHFSA-N 433.390 4.105 10 10 IICE CCCC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)Nc1ccc(Cn2cnnc2)cc1 2313682099 VFAVIQRDUZUHKC-UHFFFAOYSA-N 430.512 4.224 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)NC(C)(C)C)cc3[C@@H]3C=CC[C@H]32)cc1O 14457160 ZOVVGTLONBBCFS-YVHKJVDXSA-N 428.554 4.304 10 10 IICE COc1cccc([C@H](c2c(NC(=O)c3ccco3)sc(C)c2C)N2CCOCC2)c1O 34967070 RTEWFSSOZIPJOO-HXUWFJFHSA-N 442.537 4.346 10 10 IICE CSC1=NSC2=NC(=O)/C(=C/c3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C(=N)N12 96475739 VDSPNBKSMOUVRQ-OTXQKAJQSA-N 427.467 4.103 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)c2C)cc1 110413016 HOCPFLZYYPRDQH-PMACEKPBSA-N 439.600 4.064 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\c3ccc(Oc4cccnc4)c(F)c3)CC2)cc1 206967641 DBAHBLXRJVAZOR-WZUFQYTHSA-N 433.483 4.384 10 10 IICE C[C@@]1(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)CCCc2ccccc21 303154302 UAYORQHQPPSVQY-HSZRJFAPSA-N 432.486 4.452 10 10 IICE CN1CCc2cc(CNCC3(N(Cc4ccccc4)Cc4ccccc4)COC3)ccc21 705676082 RIQYUVOBDXPEBJ-UHFFFAOYSA-N 427.592 4.240 10 10 IICE Cc1cc(C(=O)COC(=O)/C=C/c2cnccn2)c(C)n1-c1ccc(Br)cc1 740966224 RTJTWRIXNPZUDE-VMPITWQZSA-N 440.297 4.086 10 10 IICE CC(C)(C)OC(=O)N[C@@](C)(C(=O)NCc1cccc(Br)c1O)c1ccccc1 768300983 FNBLIRKXCBADNK-OAQYLSRUSA-N 449.345 4.211 10 10 IICE CN1CCC[C@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)[C@@H]1c1ccc(C(F)(F)F)cc1 779518653 LLMSEOAYRDHLTM-IYINOJLISA-N 434.458 4.329 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC[C@H](c3n[nH]cc3NC(=O)C3CCCC3)C2)c1O 779618356 DCFGGSBQEYXCIV-INIZCTEOSA-N 444.963 4.480 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)/C=C\c3ccccc3F)cc2)cc1 799913608 VQTNJWYFCZDHKR-PFONDFGASA-N 446.525 4.348 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ncc(Cc2ccc(F)cc2)s1 915320384 LDLWAZOMDWEOGW-UHFFFAOYSA-N 440.544 4.374 10 10 IICE O=C(CCc1cccc(C(F)(F)F)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129660303 NMILMUHYUOZKHT-UHFFFAOYSA-N 428.401 4.069 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cnc(Cc4ccc(F)cc4)s3)C2)cc1 1129991330 ONZZZMLQMNGSNT-QGZVFWFLSA-N 425.529 4.138 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2c3ccccc3C[C@H]2CNC(=O)C(F)(F)F)cc1 1130086574 DVJRGWNGCOOTCT-FQEVSTJZSA-N 441.453 4.344 10 10 IICE CNC(=O)c1cncc(/C=C\C(=O)N2C[C@H](C)Cc3cc(C(F)(F)F)cc(Cl)c32)c1 1133395342 ZDGGUFNTRWSPRC-VSQXVHSFSA-N 437.849 4.352 10 10 IICE COCc1nc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cs1 1134542016 DRYTZJKGJGACAR-UHFFFAOYSA-N 444.314 4.014 10 10 IICE O=C(NC[C@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1)Nc1cccc(F)c1 1142990826 CQJBHKJZVHBEJO-CYBMUJFWSA-N 443.500 4.126 10 10 IICE CCN(Cc1cc(Br)ccc1O)c1ncc([N+](=O)[O-])cc1Br 1162781180 NHHPULGMRMRYGW-UHFFFAOYSA-N 431.084 4.247 10 10 IICE C/C(=C\c1ccccc1)CN(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1230475259 FCJUKZVFUVDTHG-RELWKKBWSA-N 432.612 4.464 10 10 IICE CN(CCc1cccc2ccccc12)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1251751254 XYJCHMBKLWJDFZ-UHFFFAOYSA-N 439.506 4.339 10 10 IICE COc1ccc([C@H](NC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccc2)cc1 1256237092 QRNPUFLHZNFHQU-CLJLJLNGSA-N 446.595 4.453 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)CCCC1 1264933565 ZTMQXJWZUXMQEA-UHFFFAOYSA-N 441.572 4.044 10 10 IICE CN1CCN(c2ccc(CNC(=O)/C=C/c3cc(C(F)(F)F)ccc3Cl)cc2)CC1 1288335135 ZPQFBPMPMBZQMC-RUDMXATFSA-N 437.893 4.440 10 10 IICE COCCOc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)ccc1OC 1290452070 KGFHCGGMQIEVEN-UHFFFAOYSA-N 436.508 4.122 10 10 IICE Cc1ccc(C(=O)Nc2cccc(N3CCCNC3=O)c2)cc1-n1c(C)cc(C=O)c1C 1294212901 SUZBBZWUIMZKLZ-UHFFFAOYSA-N 430.508 4.387 10 10 IICE O=C(c1cc2ccc(C(F)(F)F)cc2nc1O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1295404982 CWEALXMGLSHXIM-KRWDZBQOSA-N 446.425 4.486 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c1 1295774441 JJOKMPMFSCMVCQ-QZTJIDSGSA-N 439.556 4.377 10 10 IICE COC(=O)/C=C/c1ccc(OCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)c(OC)c1 1307289046 JUAMQZNUCLVMSA-UXBLZVDNSA-N 438.455 4.085 10 10 IICE CCOC[C@H]1CCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C1 1314420220 KGJRYFHBJDRDRU-KRWDZBQOSA-N 446.646 4.175 10 10 IICE Cc1cc(-c2csc(NC(=O)c3cnc(N(C)C)cn3)n2)c(C)n1-c1ccc(F)cc1 1349820217 RAOFORWLEJOPBO-UHFFFAOYSA-N 436.516 4.465 10 10 IICE Cc1cc(CC(=O)N[C@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)c(C)n1-c1ccccc1 1356002502 RHWPFUXGITYSEJ-QHCPKHFHSA-N 443.469 4.172 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 1452947796 SSTIKYSUURWDMJ-MRXNPFEDSA-N 427.715 4.273 10 10 IICE C[C@@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cc(Cl)ccc1Cl 1469870602 ZRNJICKMCKAUFG-CQSZACIVSA-N 449.382 4.256 10 10 IICE Cc1cc(CNC(=O)NCC[C@H]2CCC3(CCOCC3)CO2)c(C)n1-c1ccccc1 1471037602 PLKBDTLAMYJESI-HSZRJFAPSA-N 425.573 4.259 10 10 IICE CN(CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1)c1ccc2c(c1)OCO2 1473284452 LAFFEYUCQGSRBH-UHFFFAOYSA-N 437.883 4.396 10 10 IICE Cc1ccc([C@@H]2CSCCN2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1479534810 OSBUMGIFCGIIOL-PKTZIBPZSA-N 426.630 4.163 10 10 IICE COC1CCC(Cn2c(Cc3csc(C)n3)nnc2N(C)Cc2ccccc2O)CC1 1504466396 QSDVFXGYHIAPTB-UHFFFAOYSA-N 441.601 4.181 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1509473137 MXKADDWCAKYTHY-DLBZAZTESA-N 437.635 4.020 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCO[C@H](c3ccco3)C2)cc1F 1517004141 XPKOXDSNESIYSD-NRFANRHFSA-N 441.551 4.291 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1nn(C)c(C(F)(F)F)c1Br 1526324642 RFKMOTJVXZEXNW-UHFFFAOYSA-N 447.299 4.318 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1527596329 VLXKGQNZWHDTEY-UHFFFAOYSA-N 435.568 4.132 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C(C)(C)Oc3ccc(Br)cc3)C2)cc1 1532105058 HCPDCVCEILHPDR-INIZCTEOSA-N 433.346 4.010 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](C)S(=O)(=O)c3ccc(F)cc3)c2C)c1 1534759196 LTWQERHXPZQEJV-GOSISDBHSA-N 428.529 4.020 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3ccc(OC)cc3OCCC(C)C)C2)cc1 1537109269 LQRKOFUWVODULN-LJQANCHMSA-N 426.557 4.385 10 10 IICE COC(=O)c1cc(Cl)cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1538587154 AOWSLVHVFRPCDR-UHFFFAOYSA-N 439.943 4.487 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2c(N(C)C)cccc2s1 1546151749 GCKHGSJYDANHCN-UHFFFAOYSA-N 432.929 4.142 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCO[C@H]1CCOC1 1547083860 OACMIZOEJNWCKQ-QFIPXVFZSA-N 437.588 4.394 10 10 IICE Cc1cc(CN(C)[C@@H](C(N)=O)c2cccc(Br)c2)ccc1N1CCCCC1 1559697286 YILBTEFULCQWIL-OAQYLSRUSA-N 430.390 4.406 10 10 IICE CCc1ccc(NC(=O)c2nnc(CN3CCCc4cc(OC)cc(OC)c43)s2)cc1 1559911440 HXZRAKCHVVFRMQ-UHFFFAOYSA-N 438.553 4.323 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](C)c3ccc(F)cc3OC(F)F)C2)cc1 1564497353 DZVUXKGQBVJCKQ-CABCVRRESA-N 437.462 4.322 10 10 IICE COc1ccccc1[C@H](CO)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1566786841 KJTKEOCXAOHTDM-IBGZPJMESA-N 443.341 4.329 10 10 IICE CC(C)CO[C@H]1CCN(c2nnc(CC(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1607706598 OXPLKHVUHQYGJG-QFIPXVFZSA-N 425.621 4.159 10 10 IICE Cc1nc(C2CCC2)sc1CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1622634584 BTKSSDRMLJDFAK-GOSISDBHSA-N 434.005 4.401 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C 1629969643 YZJFGJGXHSTLGZ-CZUORRHYSA-N 441.366 4.149 10 10 IICE C[C@H](C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cn(C)c2ccccc12 1630261864 DOIDJNKTUOMWTN-LPHOPBHVSA-N 425.960 4.422 10 10 IICE CCCN(CC)c1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 1630551067 YXQMKLYQKDJAAS-ROUUACIJSA-N 428.552 4.001 10 10 IICE CC(C)(C)c1ccc(C2(CNC(=O)c3cc(NS(C)(=O)=O)ccc3O)CCCC2)cc1 1631151541 AKSZUNIWNVKBBG-UHFFFAOYSA-N 444.597 4.303 10 10 IICE CNS(=O)(=O)c1ccc(CSc2ncc(-c3ccccc3)n2Cc2ccco2)cc1 1640819760 HATGAEOEMFVHJA-UHFFFAOYSA-N 439.562 4.392 10 10 IICE C[C@H](CCO)n1c(C(F)(F)F)nc2cc(NC(=O)/C=C/c3ccc(O)c(O)c3)ccc21 1641011075 JGMZNHXISYIZLY-QDBLGGKGSA-N 435.402 4.062 10 10 IICE CCCCOc1c(Cl)cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1OC 1641200436 JOEIRTUFJPFLRA-UHFFFAOYSA-N 446.975 4.419 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@H](c2ccncc2)C1 1641886586 RXRSVGNGIYESBW-CQUHBBLWSA-N 443.619 4.141 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(Br)ccc1C1CC1 1642155526 VPFILPCYCSGPRB-UHFFFAOYSA-N 429.358 4.218 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCO[C@H](c2ccc(OC(F)F)cc2)C1 1673744941 PXLMMLUAIKODQS-JTSKRJEESA-N 447.526 4.377 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N[C@@H]2CCc3cc(Br)ccc32)N(C)C)cc1 1675643258 DNEMQJGLHRGFGF-RTWAWAEBSA-N 445.405 4.105 10 10 IICE CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1676653844 YXJLYSUOJKDFGX-ICDZXHCJSA-N 438.616 4.165 10 10 IICE CC[C@]1(Cc2ccccc2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1681850262 UYPPHBZVUCBYHK-RUZDIDTESA-N 443.538 4.498 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3ccc(Cl)cc3OC(C)C)C2)cc1 1683339729 FDMQTYUIOVEBQX-QGZVFWFLSA-N 431.964 4.462 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)NCc1c(Cl)cccc1OC(F)F 1683436885 KWURDGTVBAXPPF-UHFFFAOYSA-N 439.890 4.120 10 10 IICE Cc1occc1CN(C)c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1692927525 OLSWMNBLALGMTL-QGZVFWFLSA-N 433.603 4.349 10 10 IICE C[C@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)CCCO1 1693824797 JPJUHOMTBWZJJI-SFHVURJKSA-N 443.642 4.317 10 10 IICE CCN(CC(C)C)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)cc1C 1709984509 MPZYWXYPDMLAFR-UHFFFAOYSA-N 445.615 4.422 10 10 IICE CCN(CC)[C@H](Cn1c(-c2cccnc2)nnc1N(C)Cc1ccccc1O)c1ccco1 1710019836 MMCUYLIXNMIBHM-OAQYLSRUSA-N 446.555 4.358 10 10 IICE CC(C)Cc1nnc(N2CC(C)(C)OC[C@@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1723283353 ATAOJURKNBPCBM-IBGZPJMESA-N 443.661 4.082 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCCC1CCOCC1 1741333568 PUTDUZXYBDRFPR-UHFFFAOYSA-N 441.620 4.081 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@H](SC)C(C)(C)C 1762192430 BLEWRFMWBDTNOP-IBGZPJMESA-N 447.649 4.316 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCCn2c(-c3ccc[nH]3)nnc2N(C)Cc2ccccc2O)C1 1762725860 WIQFTHKITZWUMI-BGYRXZFFSA-N 436.604 4.373 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N3CCC(CCCO)CC3)ccc21 1767520369 IKNTXMWCLJCLLW-UHFFFAOYSA-N 439.648 4.286 10 10 IICE CCOC(=O)c1c(NC(=O)CCCO)sc(C)c1-c1ccc(Br)cc1 1865944138 PIPKPQGETIEBCO-UHFFFAOYSA-N 426.332 4.374 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@@H]3CC(=O)N(c4cccc(Cl)c4)C3)cccc21 1874178986 FZMKSFWLDIQBJU-CQSZACIVSA-N 444.874 4.107 10 10 IICE COc1ccc([C@@H](n2nc(C3(C)CC3)c(C(N)=O)c2Br)C(C)(C)C)c(O)c1 2080041673 CTUUXABDPRUOBL-MRXNPFEDSA-N 436.350 4.146 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@H]1CNCc1cccc(Br)c1O 2095169620 AYJGGGPUDNJEBQ-HNNXBMFYSA-N 425.367 4.424 10 10 IICE CN1CCc2cc([C@H](N)c3cc(I)ccc3Br)ccc21 2163141459 UUOHCOBCAZWTCI-INIZCTEOSA-N 443.126 4.094 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N[C@@H]2CCC[C@@H]2N=[N+]=[N-])C1 2218743783 KHHDYAFQCVQOKV-MSYCTHLASA-N 443.548 4.178 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](C2CC(NCc3ccc(Br)cc3O)C2)C1 2265430161 ZTTILVOWPISMTL-HPUBIQBYSA-N 425.367 4.280 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c1 2294133711 BZFLILPDUCCHRS-UHFFFAOYSA-N 431.404 4.138 10 10 IICE O=C1NC(=O)N(c2ccccc2F)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12 2296474095 QBLFZFAXWOJNTL-UHFFFAOYSA-N 439.446 4.495 10 10 IICE Cc1ccc(CN(C)[C@@H]2CC[C@@H]2NC(=O)OCc2ccccc2)c(O)c1Br 2307568095 AERHTNWOLNVEEH-ZWKOTPCHSA-N 433.346 4.352 10 10 IICE CC(C)(C)OC(=O)N1CC(O)(C2CCN(c3ccc(OCc4ccccc4)cc3)CC2)C1 2314485054 WNGJALKJIOSFQX-UHFFFAOYSA-N 438.568 4.464 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)C(=Cc3c[nH]c4ccccc34)SC2=S)cc1 2314827623 IZLYESNUPVHYLP-UHFFFAOYSA-N 437.546 4.407 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@H](NCc1c(O)cccc1Br)C2 2333643772 NXRCYGUWHJYHKF-CKEIUWERSA-N 425.367 4.280 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475873 AWNWHHYDURMGII-CKJXQJPGSA-N 443.525 4.204 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478330 FZHFETZVPJXVCI-RPWDQDSNSA-N 427.526 4.498 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccc(O)cc2)SC1=S)Nc1cccc(C(F)(F)F)c1 15035710 XMDCAGROYQJBPX-NVNXTCNLSA-N 438.452 4.251 10 10 IICE COc1ccc(CCN2C(=O)c3ccccc3[C@@H](C(=O)O)[C@H]2c2ccccc2O)cc1OC 20583481 FJWBMPGQFPUEPT-DNQXCXABSA-N 447.487 4.017 10 10 IICE CC(C)N1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33489111 REWRRPMMKFGJGK-VBKFSLOCSA-N 428.583 4.049 10 10 IICE CC1=NN(c2ccc(C(=O)O)cc2)C(=O)/C1=C/c1ccc(-c2ccc3c(c2)COC3=O)o1 100589965 ZDHXDELNGINRKE-RGVLZGJSSA-N 428.400 4.121 10 10 IICE Cc1cc(C(=O)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)c(C)n1-c1ccc(F)cc1 195741495 YHWKXTQFNAWJDL-UHFFFAOYSA-N 446.438 4.248 10 10 IICE Cc1ccc(C)n1C1CCN(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1 726706395 JZNLFUYEGVBQKT-BGYRXZFFSA-N 442.579 4.404 10 10 IICE O=C1Nc2ccc(S(=O)(=O)Nc3nc(-c4ccc(F)cc4)cs3)c3cccc1c23 727242319 XFRUYFCSZCGENH-UHFFFAOYSA-N 425.466 4.469 10 10 IICE Cc1ccn(-c2ccccc2NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1 759523378 RUKKOLYNQIUBCO-ROUUACIJSA-N 437.519 4.255 10 10 IICE O=C(/C=C\c1nc2ccccc2s1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768532513 MIOPPDVJSMBPDO-QXMHVHEDSA-N 432.593 4.158 10 10 IICE Cc1cncc(/C=C\C(=O)N[C@H](C)CN(C(=O)/C=C/c2cncc(C)c2)c2ccccc2)c1 772126795 UPFJAMXEESRNNH-BQVYQLBSSA-N 440.547 4.358 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)cc1 777809024 FKDMCADLIHVUIP-FQEVSTJZSA-N 436.600 4.287 10 10 IICE C[C@H](NCc1ccc(N2CCSCC2)cc1)c1c[nH]ccc1=NC(=O)OC(C)(C)C 796691663 DGEVNGAVCWMMRM-KRWDZBQOSA-N 428.602 4.255 10 10 IICE Cc1cccc(C(=O)N2CCCC2)c1NC(=O)NCc1cc(Br)ccc1O 806188152 YTBNYYUQZYUAFP-UHFFFAOYSA-N 432.318 4.021 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCN(C(=O)NCc3ccc(N4CCCC4)cc3)CC[C@H]2C1 814364227 WVCDNKVMRQYHIG-OYRHEFFESA-N 442.604 4.075 10 10 IICE O[C@@H](CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)CN1CCc2ccccc2C1 920091595 JPLSALVPSCYZRY-RPWUZVMVSA-N 449.620 4.240 10 10 IICE Cc1ccc(I)c(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 1124833603 CBVSGOYVWMIQQN-UHFFFAOYSA-N 434.321 4.470 10 10 IICE Cc1cc(C)c(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(C)c1Br 1125256232 FNASNMVMQMJQMH-UHFFFAOYSA-N 449.364 4.209 10 10 IICE C/C=C/COc1cccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1125256952 QWQJJVLGGJERGF-DHAGBVFISA-N 426.532 4.253 10 10 IICE COc1cc(N2CCN(C(=O)c3c(Cl)oc4ccccc34)CC2)cc(OC)c1OC 1127836695 KVSHHPXSTVOFIR-UHFFFAOYSA-N 430.888 4.074 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCCOc3ccccc3Br)C2)cc1 1129990871 IRQSPVKOXUABOW-QGZVFWFLSA-N 447.373 4.259 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3COc4ccc(Br)cc43)cc2)CC1 1136705680 XCEDQJZUTXXJOR-FQEVSTJZSA-N 429.358 4.478 10 10 IICE CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438451 LCUHNWIHTRYPEJ-FXAWDEMLSA-N 445.947 4.303 10 10 IICE Cc1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)N2CCOc3cc(N(C)C)ccc32)cc1 1147887670 DMRFSKWADICPEG-NRFANRHFSA-N 425.529 4.052 10 10 IICE C[C@@H](NC(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1O)c1ccccc1O 1151885901 MLVGAGRAVZFWBL-CYBMUJFWSA-N 446.912 4.043 10 10 IICE CC(C)Cn1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ccccc21 1161174829 DYYZCMPUQZSZSR-UHFFFAOYSA-N 427.495 4.342 10 10 IICE COc1ccc(CNC(=O)N[C@@H]2CC3(CCC3)Oc3ccc(Br)cc32)c(O)c1 1255617225 XLWDYJXFGUHGAA-QGZVFWFLSA-N 447.329 4.409 10 10 IICE CCCCc1nc(C)c(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1 1264688857 BLXFTKRFLZHCFU-HZPDHXFCSA-N 433.593 4.406 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccn(-c2ccc(Br)cc2)n1 1276283877 NZOLWFCGFLSWHR-INIZCTEOSA-N 441.373 4.370 10 10 IICE CCc1ccc(C(=O)N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1290553497 LPTMRVRFCHNIIF-UHFFFAOYSA-N 443.547 4.067 10 10 IICE CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1296741961 UBYLQJDYOVQLEZ-MRXNPFEDSA-N 433.268 4.242 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](COCC)C1 1297551135 CQBWHLVCOHNOFF-OAQYLSRUSA-N 437.588 4.252 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1nnc2n1CC[C@H](C(F)(F)F)C2 1307208553 IXTSYWIUHPKBMQ-AWEZNQCLSA-N 445.401 4.154 10 10 IICE COc1ccc(N2CCN(c3nnc(C4CCCC4)n3CCOC(C)(C)C)CC2)cc1F 1315512824 OIFGOELQERZHDJ-UHFFFAOYSA-N 445.583 4.225 10 10 IICE CCc1ccccc1N1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1=O 1353487053 CSTNUTYNTYQOBC-QFIPXVFZSA-N 445.563 4.490 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](c1ccc(Br)cc1)N1CCCC1 1360274180 WFHIUHGLDBXEQB-OAQYLSRUSA-N 430.390 4.277 10 10 IICE CCOC(=O)[C@@H](CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)Cc1ccccc1 1464523338 UMSWHIGFLSPSQL-HSZRJFAPSA-N 446.547 4.367 10 10 IICE COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2ccccc2C)c1C 1466643206 RVSJKTLOECNBQO-HSZRJFAPSA-N 429.520 4.398 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)[C@H]2CCN(C(C)C)C2)sc(C)c1-c1ccccc1 1473544496 ABKMGUGFJHHPQN-IBGZPJMESA-N 443.613 4.253 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)sc2c1CCCC2 1515316857 IFBBIUPPFZRWLK-AWEZNQCLSA-N 444.528 4.323 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)[C@H]2CCOC2)cc1 1515525808 GCOXWXFLUKIQRV-FQEVSTJZSA-N 440.979 4.113 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2C[C@@H](C)O[C@H](C)C2)cc1 1515527016 OJYKDJQPRXSJDJ-WOJBJXKFSA-N 434.588 4.157 10 10 IICE CCOC(C)(C)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1516092647 LCLXZBZBRCLIDY-UHFFFAOYSA-N 448.615 4.316 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(S(C)(=O)=O)c(Cl)c2)CCCC1 1537134760 OPSKYAGIATVHQF-UHFFFAOYSA-N 446.956 4.224 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccnc2c1CCN2C(=O)OC(C)(C)C 1540488581 WASBRBONIYDWSJ-UHFFFAOYSA-N 436.556 4.252 10 10 IICE CCc1nnc(N(CC)[C@@H](C)C2CCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1546434298 UCYYLYATRGHUCB-IBGZPJMESA-N 425.621 4.112 10 10 IICE Cc1cc(CNC(=O)N2CCCN(C(=O)OCC(C)C)CC2)c(C)n1-c1ccccc1 1565194127 WLGVHAGAEOIANG-UHFFFAOYSA-N 426.561 4.104 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(C(F)(F)F)c1 1584507562 PINBLKDRCCNSRC-INIZCTEOSA-N 447.501 4.217 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)C(F)(F)F)C3(CCCCC3)C2)c(C)n1-c1ccccn1 1628124776 SKKZRBNGGAJQFI-UHFFFAOYSA-N 448.489 4.039 10 10 IICE Cc1cc(C(=O)N2CC(Oc3ccncc3)C2)c(C)n1-c1cccc(Br)c1 1628194927 VYPATBNVWAHVOJ-UHFFFAOYSA-N 426.314 4.155 10 10 IICE O=C(/C=C\c1ccccc1OCc1ccccc1)NCc1ccc(N2CCOCC2)cc1 1631070330 VCHHRINRHKTZJA-QINSGFPZSA-N 428.532 4.432 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CN(Cc4ccccc4)CC[C@@H]3CO)c2C)c1 1631430508 VBTAYWFAEMYNTC-SHQCIBLASA-N 445.607 4.324 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)c1 1631952244 YKEQSVSEJZKGJQ-JOCHJYFZSA-N 443.507 4.479 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cccc(I)c3)c2)CC1 1633402890 RGVBBQKVVOOYNZ-UHFFFAOYSA-N 449.336 4.074 10 10 IICE CCc1c(C(=O)N2CCN(c3ccc(OC)c(F)c3)CC2)cnn1-c1cccc(Cl)c1 1635889397 BIILWRBVTGCDNY-UHFFFAOYSA-N 442.922 4.198 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1638573035 GTLZWYQHESQYAE-LNYGYFNRSA-N 449.938 4.305 10 10 IICE COc1ccccc1-n1nnnc1SCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 1640728202 CQJOJDBAPFGPCM-UHFFFAOYSA-N 437.500 4.193 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)C[C@@H]4CCCS4(=O)=O)n3)c2C)cc1 1650661043 MLMMIOMQYLCXAE-SFHVURJKSA-N 443.594 4.432 10 10 IICE CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NCc2cc(O)ccc2O)CC1 1651225280 CVJGZTUHLFOFEE-UHFFFAOYSA-N 440.540 4.217 10 10 IICE O=C(CCNC(=O)NCc1c(O)ccc2c1CCCC2)Nc1cc(Cl)cc(Cl)c1 1673166394 AMBNSIGXRXCFQI-UHFFFAOYSA-N 436.339 4.406 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1CCC[C@H]1Cc1ccccc1Cl 1683014127 HEAMRBMTWCFOON-SFHVURJKSA-N 449.929 4.372 10 10 IICE COc1ccc([C@H](NC(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c2ccco2)cc1 1683222030 ZIZAJHPJQPMSPS-UUOWRZLLSA-N 435.524 4.212 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC(Cc2ccc(F)c(F)c2)CC1 1684142246 VCTKJDQZKAWNDS-UHFFFAOYSA-N 443.538 4.090 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1708047929 WEODXQZEFQAFLY-COPCDDAFSA-N 428.577 4.457 10 10 IICE CS[C@@H](Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O)C(C)(C)C 1731056167 PSOXMJHFAHTARL-FQEVSTJZSA-N 425.602 4.384 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C)[C@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1763596546 YCUFWUHTIUAJJM-CNNODRBYSA-N 443.661 4.254 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCC[C@H]1CC 1764083323 CVYXVNFRIWIEQG-QZTJIDSGSA-N 427.593 4.365 10 10 IICE CC[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1765156268 DCDZUPOXRCXHEW-IBGZPJMESA-N 425.621 4.069 10 10 IICE CCCCOCCCN1C(=O)C(NCCC)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873164953 ZZMGLNHGEAKLPY-UHFFFAOYSA-N 437.584 4.380 10 10 IICE O=C(N[C@H]1CC[C@H]1NCc1cc(Cl)cc(Br)c1O)OCc1ccccc1 1977132694 VMQZLKDBVLSBAX-SJORKVTESA-N 439.737 4.355 10 10 IICE C[C@@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(CN=[N+]=[N-])CC1 2010390312 BPELSOIYJUJUEI-APWZRJJASA-N 431.537 4.034 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C(C)(C)C)c(N)c1I 2079848211 DZNIZHCEIQXBBF-LBPRGKRZSA-N 429.302 4.081 10 10 IICE CCOC(=O)c1c(CC)nn([C@@H](C)c2cc(C)c(C)cc2O)c1I 2079950783 JVYPFEYEHXTGGG-LBPRGKRZSA-N 442.297 4.159 10 10 IICE CC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cc(Br)cc(F)c1O 2093491195 ABLBESCHLJYUHJ-WBMJQRKESA-N 431.346 4.419 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@@H]2CCN(Cc3ccccc3)[C@H]2C1 2188889731 ZLRPUUOQDZZVLW-CVDCTZTESA-N 426.402 4.412 10 10 IICE C[C@]1(CCOCc2ccccc2)CCN1c1cc2c(cc1Br)[C@@H](O)C(=O)N2 2197750974 BBKPWGXWFFOUMB-TZIWHRDSSA-N 431.330 4.010 10 10 IICE COc1ccccc1C=C1C(=O)NC(=O)N(c2ccc(OCc3ccc(C)cc3)cc2)C1=O 2297336506 ZBNPYGOHLACHTI-UHFFFAOYSA-N 442.471 4.249 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(N(C)c2ccccc2C(=O)O)=NC1=O)C(C)=O 2314927979 OGHYNCWWPLZQTP-SFHVURJKSA-N 438.505 4.238 10 10 IICE O=C(O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccccc2Br)SC1=S 2323865475 HDTCWNSAWCDJOD-OAHLLOKOSA-N 434.336 4.476 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)COc2cccc(C=O)c2)cc1 72413065 LEZABKDBRRQQIG-VWLOTQADSA-N 427.504 4.322 10 10 IICE CCOc1cccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@H]2c2ccc(O)c(O)c2)c1 526281983 IZHDPOBYVSUYEI-QHCPKHFHSA-N 443.459 4.430 10 10 IICE C[C@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1ccc(CN)c(Br)c1F)C2 705880029 GHFSWKDVXXLDDM-FGZHOGPDSA-N 432.381 4.395 10 10 IICE CN1CCCc2cc(NC(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)ccc21 726698716 DIJXWVPYYNQGHH-UHFFFAOYSA-N 430.499 4.461 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc(NC(C)=O)c(Cl)c3)n2)cc1 748091532 AMTILKVFQIZAEG-UHFFFAOYSA-N 437.930 4.231 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N1CCCC[C@H]1C(F)F 800209056 PXOKKWIEXJPLGL-UROBUVALSA-N 430.567 4.376 10 10 IICE COc1ccc(OC)c([C@H]2CCCN2C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 920869801 ALULNHDSLGXQEU-WZONZLPQSA-N 439.556 4.148 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccnn1CC1CCC1 1132811031 PERCTPCKHIFJFT-SFQUDFHCSA-N 444.557 4.052 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2Cc3ccc(Br)cc3C(=O)O2)cc1 1135732982 PBABHCOASAPSGZ-FQEVSTJZSA-N 445.357 4.035 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@@H](c2ccco2)C1 1136805023 QWGWJEYODVEBJT-GYZOOYGHSA-N 430.526 4.026 10 10 IICE COc1ccc(N(C)CC(=O)NC2(c3ccc4c(c3)OCCO4)CCCC2)cc1Cl 1167881549 OBIZTOMLQVMHMJ-UHFFFAOYSA-N 430.932 4.142 10 10 IICE COc1ccc(N(C)CCN(C)Cc2nc(-c3cc(Br)cs3)no2)cc1 1171729942 PQALKSIONNLZHJ-UHFFFAOYSA-N 437.363 4.137 10 10 IICE Cc1cc(C(=O)Nc2ccccc2C(=O)N2CCC[C@H](O)C2)c(C)n1-c1ccc(F)cc1 1177367463 LFYADSUYODTLDH-FQEVSTJZSA-N 435.499 4.082 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCOC[C@H]3C[C@H]3CCCO3)cc2Cl)C1 1235832008 BWRPTYACZCQAKC-MISYRCLQSA-N 435.996 4.056 10 10 IICE CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c1 1289599429 BCKIKKNFYAZVLA-JOCHJYFZSA-N 445.007 4.423 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1c[nH]c2ccc(Br)cc2c1=O 1299478283 LMJPCAPOOZYKQN-AWEZNQCLSA-N 442.357 4.026 10 10 IICE COc1cc(Br)cc(CNC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c1 1312886549 WYSWMJCJWPITDK-OAHLLOKOSA-N 434.378 4.263 10 10 IICE Cc1cc(CCNC(=O)N(C)CCc2nccc(C(F)(F)F)n2)c(C)n1-c1ccccc1 1313100451 LKXMFRVKGMLMIE-UHFFFAOYSA-N 445.489 4.330 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)CSc4nncn4C)n3)c2C)cc1 1351050054 AQWRKYHKHBBPDH-UHFFFAOYSA-N 438.582 4.385 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3csc(C4CCCC4)n3)cc2F)C[C@H](C)O1 1356036515 JFZMASWIGAZJEW-HOTGVXAUSA-N 431.577 4.412 10 10 IICE COc1cccc(C(=O)c2ccc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cc2)c1 1439962179 VXMAGJLHTOYJSY-VWLOTQADSA-N 445.563 4.025 10 10 IICE CCCCOc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC(C)CC3)cc2)cc1 1443666540 RTPPPJBPNKFEMA-UHFFFAOYSA-N 437.584 4.148 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C3)c2C)cc1 1447015594 XWWNPRQMNXZRKM-IEBWSBKVSA-N 441.572 4.478 10 10 IICE CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C1 1448004833 LPMOLWVXNDAYBN-MJGOQNOKSA-N 427.545 4.090 10 10 IICE COc1cccc(C(=O)CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c1 1455120896 NTBUCCREYAKMIA-UHFFFAOYSA-N 441.325 4.478 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cnn(-c4ccccc4)c3C(F)F)CC2)cc1 1455933629 QURNUMLCTGHLPU-UHFFFAOYSA-N 426.467 4.217 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC[C@]2(C)Cc2cccc(Br)c2)cc1 1473807092 IJQBCSXEPINLBP-HSZRJFAPSA-N 444.417 4.229 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2cccs2)cc1F 1503391344 AMOYKHJPYRKGHR-HXUWFJFHSA-N 429.565 4.471 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2C[C@@H](O)CC3(CCCC3)C2)nnc1C(C)(C)C 1510684883 YENZQRXOQIVAGQ-NRFANRHFSA-N 425.621 4.130 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3cccc(OCc4ccccc4C)c3)CC2)cc1 1519574774 HJZCIINHBBJZQR-UHFFFAOYSA-N 430.548 4.474 10 10 IICE C[C@H]1CN(C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c2ccccc2N(C)C1=O 1524109914 UAKKOLWTYSFHOQ-KRWDZBQOSA-N 449.551 4.239 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(C)(C)c3ccc(Br)cc3)C2)cc1 1529403974 LZFQHTFWVHGMKX-INIZCTEOSA-N 431.374 4.378 10 10 IICE Cc1ccc(C)c(C2=NO[C@H](C(=O)NC3CCN(c4ccc(OC(F)F)cc4)CC3)C2)c1 1530288204 TXVOECQNXINILW-QFIPXVFZSA-N 443.494 4.183 10 10 IICE C[C@@H](Cn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O)N1CCC[C@@H](C)C1 1544077503 IDQGBPPHCNJOJP-UXHICEINSA-N 425.621 4.473 10 10 IICE COc1ccc([C@@H](CO)N(C)C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1546240752 DKBFHHFPECPQLD-HSZRJFAPSA-N 426.944 4.491 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](O)c3cc(Cl)ccc3OC)ccc21 1556597785 VRLPYELRXSTWBL-OAQYLSRUSA-N 430.932 4.030 10 10 IICE CCCN(CC(=O)Nc1sc2c(c1C(=O)OC)CC[C@@H](C)C2)Cc1ccccc1O 1559571362 REEVSVCQFZUGHX-OAHLLOKOSA-N 430.570 4.216 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CN(C(=O)OC(C)(C)C)c3ccccc3)C2)cc1 1570562925 AEEAFFHBCWWOHN-IBGZPJMESA-N 439.556 4.079 10 10 IICE Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)N[C@@H](C)c2ccccc2O)C1 1587451547 ZGARSACFWWRVGZ-JKSUJKDBSA-N 445.357 4.193 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2Cl)c1 1611598257 JRDNCADRACXENB-UHFFFAOYSA-N 448.903 4.224 10 10 IICE CCc1nnc(N2CC=C(C(C)(C)C)CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1613954168 QTYNYSJDORTLJL-UHFFFAOYSA-N 437.632 4.280 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)c1C 1623202228 AAGGHCLKRRHWGA-ILBGXUMGSA-N 431.580 4.015 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1623946995 DMQRXXXBHFESBC-DVECYGJZSA-N 446.547 4.365 10 10 IICE O=C(Cc1ccc(OCCOc2ccccc2)cc1)NCc1ccc2cccnc2c1O 1627072873 GRQRZDZJTWALQQ-UHFFFAOYSA-N 428.488 4.257 10 10 IICE CCN1CCN(Cc2ccc(CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)cc2)CC1 1630032842 ZLKFTJZLXPCPIL-UHFFFAOYSA-N 444.623 4.091 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CC[C@@H](C2CC2)N1C(=O)OC(C)(C)C 1630181025 RENKSIZOFAYYHK-HSQYWUDLSA-N 429.605 4.286 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CNC(=O)NCc1ccc(F)cc1 1637244286 ZWDGEXBDALRFLG-GOSISDBHSA-N 435.499 4.121 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1cc([N+](=O)[O-])n[nH]1 1641202757 LLQGLPSEQKQBSR-HNNXBMFYSA-N 433.390 4.243 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(C4CC(=O)NC(=O)C4)cc3)c2C)c1 1641691484 NMHPYZYCRZBDRH-UHFFFAOYSA-N 429.520 4.483 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3cc(Br)c(F)cc3C2)c([N+](=O)[O-])c1 1643259543 BPULGSMYWMSRPN-HYXAFXHYSA-N 435.249 4.245 10 10 IICE CCCCO[C@@H]1C[C@H](N(C)CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(C)C 1644890696 MGJCBGAVEFQXIX-FCHUYYIVSA-N 448.563 4.316 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1c(Cl)ncnc1N(C)C 1651683198 OPXMAWFJRPFBAP-UHFFFAOYSA-N 431.949 4.143 10 10 IICE COC(=O)CCN(Cc1cccc(Br)c1)Cc1cc(F)cc(C(C)=O)c1O 1658236515 ILYAHQDATKWKAL-UHFFFAOYSA-N 438.293 4.062 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC4(CCCCC4)CC3)cc2F)C[C@H](C)O1 1659344717 SWNMIKRHYHDFLF-PMACEKPBSA-N 431.596 4.102 10 10 IICE CCOC(C)(C)Cn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1695995330 NJZFDVSAALUNNQ-UHFFFAOYSA-N 447.599 4.156 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1711600905 JJTACARIQATMDX-DEOSSOPVSA-N 443.661 4.083 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCCn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)C1 1726465422 RYRBERFWVYOULM-ZRCGQRJVSA-N 441.620 4.230 10 10 IICE COCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)C 1749605361 WACLUEFFTUEPMF-VWLOTQADSA-N 439.604 4.232 10 10 IICE CC(C)Cc1nnc(N2CCC(C(C)C)CC2)n1Cc1ccc(N2CCOCC2)cc1 1750722029 HWMCLGVYCTXQSE-UHFFFAOYSA-N 425.621 4.234 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763405219 UNVNDYCLMOPZMW-IVZQSRNASA-N 429.952 4.133 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1 1766611338 BTGAACGOLOORDK-QHCPKHFHSA-N 448.615 4.486 10 10 IICE CC(C)(NC(=O)OCc1ccccc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1866050620 XGTWEJTVTXLMQV-UHFFFAOYSA-N 442.471 4.106 10 10 IICE COC(=O)c1c(NC(=O)c2cc[nH]c(=N)c2)sc(C)c1-c1ccc(Br)cc1 1866098218 KJZOLOCTKMCYNA-UHFFFAOYSA-N 446.326 4.332 10 10 IICE CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(Oc2ccc(N)cc2)cc1 1866114367 SAZUKPIRAZXIFQ-DEOSSOPVSA-N 428.492 4.228 10 10 IICE CCCCOc1ccc(-c2cc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)no2)cc1 1871269967 QJGATRWLNQNWEU-UHFFFAOYSA-N 435.524 4.492 10 10 IICE COCCCN1C(=O)C(=Cc2cn(-c3ccccc3)nc2-c2ccncc2)SC1=S 2040582291 AGCZUNRYHIIYNM-UHFFFAOYSA-N 436.562 4.172 10 10 IICE CCc1nn([C@H](c2ccc(C)cc2O)C(C)(C)C)c(I)c1CN 2079140177 HVGXTGVHEQIUIV-MRXNPFEDSA-N 427.330 4.158 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2c(O)cccc2Br)[C@@H]2CCCC[C@H]21 2122811906 MBHJJSBQUZVEAQ-RRQGHBQHSA-N 425.367 4.422 10 10 IICE CN[C@H](c1ccc(N(C)C)cc1)c1cc(Br)ccc1I 2163079070 MBEONVAWRYCXLG-MRXNPFEDSA-N 445.142 4.429 10 10 IICE CN(Cc1ccc(I)cc1)c1ccc(CN)c(Br)c1 2265539795 NOAHENNGSUFKRK-UHFFFAOYSA-N 431.115 4.149 10 10 IICE CC(C)N1C(=O)C(=Cc2c(Sc3ccccc3)nc3ccccn3c2=O)SC1=S 2296705109 QJIXDXGWMHJEQN-UHFFFAOYSA-N 439.587 4.455 10 10 IICE CC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccc(C)cc3[N+](=O)[O-])o2)SC1=S 2296881830 BSNTVMXKBADNQE-ZDUSSCGKSA-N 432.479 4.228 10 10 IICE CN(C)c1ccc(C=C2SC(=O)N(CC(=O)Nc3ccccc3C(F)(F)F)C2=O)cc1 2297482207 FPYXVYPEPKROMH-UHFFFAOYSA-N 449.454 4.446 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)CC3(CC3)C2)c(O)c1Br 2352941706 UVUIAUHSRPDMQK-HNNXBMFYSA-N 425.367 4.342 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)cc1OC 14479317 RDMVAJCVARHDFH-JXQFQVJHSA-N 440.565 4.315 10 10 IICE CCCCCNc1nc2c(C)cccn2c(=O)c1/C=C1/SC(=S)N(C(C)C)C1=O 33489105 VCSGMURXJWRESV-FOWTUZBSSA-N 430.599 4.215 10 10 IICE CCOC(=O)c1[nH]c2ccccc2c1/C=C1\C(=O)N(c2ccccc2F)C(=S)N=C1O 33930047 HVYBTMRKXBNOHG-KAMYIIQDSA-N 437.452 4.155 10 10 IICE CCN(CC)CCCN[C@H](CC(=O)Nc1ccc(/N=N/c2ccccc2)cc1)C(=O)O 35355737 UQAQOSKGRVRIAS-CWHMERMBSA-N 425.533 4.205 10 10 IICE CC(=O)N1CC(C)(C)Oc2ccc(S(=O)(=O)Nc3nc(-c4ccccc4)cs3)cc21 71555556 CWIDMYNCRRJALE-UHFFFAOYSA-N 443.550 4.135 10 10 IICE CN(C)c1ccc([C@@H]2CC(c3ccc(Br)cc3)=NN2C2=NC(=O)CS2)cc1 72413107 QICDKMJJJSTZCW-SFHVURJKSA-N 443.370 4.296 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3c(C(=O)O)[nH]c4cc(OC)ccc34)SC2=S)cc1 102428073 WWMGNOSCABLJDA-LICLKQGHSA-N 440.502 4.289 10 10 IICE CCN1CCN(c2ccccc2NC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)CC1 104914973 UADFWJWCVAKSQK-UHFFFAOYSA-N 432.568 4.497 10 10 IICE CCc1ccc(Oc2nc3ccccn3c(=O)c2/C=C2\SC(=S)N(CC)C2=O)cc1 213147496 DGMZSSBENTUKJA-LGMDPLHJSA-N 437.546 4.270 10 10 IICE O=S(=O)(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2 250269691 ZMAAHQOQRSBLTG-USKVXJDGSA-N 428.529 4.110 10 10 IICE COC(=O)c1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(F)cc1F 435658110 WYXNWCNYHSLTSZ-UHFFFAOYSA-N 441.478 4.111 10 10 IICE CN1CC[C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)[C@@H]1c1ccc(Cl)cc1 760878944 OKCWKSSNGUYMTL-GIWBLDEGSA-N 443.975 4.182 10 10 IICE COc1ccc(Cl)c(N2C(=O)/C(=C\c3c(Br)cnn3C)SC2=S)c1 779221183 QFXWAZCEIFZAHF-AWNIVKPZSA-N 444.763 4.250 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3cccc(F)c3)cs2)c(F)cc1Cl 795551007 YXEVWYBWBVBZFN-UHFFFAOYSA-N 444.868 4.329 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H]2CC[C@H](C1)O2 802628204 LSLRGIIFRVUXQJ-SZPZYZBQSA-N 435.572 4.147 10 10 IICE CCC1(C(=O)NCc2cc(Br)ccc2O)CCN(C(=O)c2ccccc2)CC1 804738158 FFSAUEXFIAALMF-UHFFFAOYSA-N 445.357 4.104 10 10 IICE O=C(NCc1cccc(COCc2ccco2)c1)NCc1cc(Br)ccc1O 804910819 FDOXYZQIAIIBBV-UHFFFAOYSA-N 445.313 4.464 10 10 IICE C/C=C/c1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c(OC)c1 917710587 NPIVVJLPMFKDFY-FBLDJFESSA-N 442.531 4.176 10 10 IICE CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)cc1 917850510 KUDROCJKJRWCBY-UHFFFAOYSA-N 436.580 4.021 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H](C(=O)OC(C)(C)C)C(C)(C)C)cc2F)C[C@@H](C)O1 1125256294 HILCGJZRCDIEDY-GQIGUUNPSA-N 436.568 4.060 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2OCCN2CCCC[C@@H]2C)cc1 1130543899 GTLQHSVFICPKRD-NRFANRHFSA-N 439.600 4.157 10 10 IICE CC(=O)N[C@@H](CC(=O)NCc1cc(C)n(-c2ccccc2)c1C)c1ccc(F)cc1F 1132267532 IYTOYVWPQQJBHG-QHCPKHFHSA-N 425.479 4.256 10 10 IICE Cc1nc(COc2ccccc2C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cs1 1134881876 IYUCWNOZTOISAG-JOCHJYFZSA-N 438.597 4.129 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(Cl)ccc1I 1142727576 ABOZWZBKBOKXGS-UHFFFAOYSA-N 438.652 4.128 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CCC2)[C@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1149525912 ZTTAZSIGHDFMFA-QUCCMNQESA-N 432.362 4.329 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H]1CCN(c2ccccc2Cl)C1 1150348977 UCQURSOWARCORI-APWZRJJASA-N 448.394 4.306 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1156707153 BKWIEHQLTORRBR-QGZVFWFLSA-N 427.545 4.282 10 10 IICE Cc1cc(C(=O)N2CCCC[C@H]2COC(=O)N2CCC[C@@H](C)C2)c(C)n1-c1ccccn1 1157242974 LLERELPVUWFPTK-NQIIRXRSSA-N 438.572 4.352 10 10 IICE CCN(CC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)c1ccc(OC)cc1 1191840338 WXXIPBGHKJTUSM-UHFFFAOYSA-N 442.512 4.132 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H]3c3ccc(OC)cc3OC)C2)cc1 1230300849 KGICVSMWNHNACB-MBSDFSHPSA-N 439.556 4.085 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CC(=O)N(c4ccccc4F)C3)cc2Cl)C1 1270433303 TWMOHMSSKRLZAU-WMZOPIPTSA-N 443.950 4.385 10 10 IICE Cc1cccc(CN2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1290114942 FFNQHJXAOIMLGB-UHFFFAOYSA-N 429.564 4.481 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](CN(CC)CC)C2)n1Cc1ccc2c(c1)CCCN2C 1291501777 VZOPDHDKTPLZRP-IFMALSPDSA-N 438.664 4.390 10 10 IICE Cc1cc(C(=O)Cn2c(-c3ccccn3)noc2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 1307298822 NFFWSAZOUAWKTL-UHFFFAOYSA-N 443.290 4.496 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H](Cc3cccnc3)C3CCCC3)cc2F)C[C@@H](C)O1 1355131722 YLXWMEKPVBNGPH-DNVFCKCGSA-N 439.575 4.500 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Cl)c4ncccc34)cc2F)CC1 1360091432 QYVIIIWQFFIGQB-UHFFFAOYSA-N 426.923 4.099 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@@H]1OCc2ccccc21 1440132757 DPVADRRLWXKEKJ-SZLZGVTBSA-N 444.603 4.117 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)c1 1441694766 WDTJQDZTIAOXGR-HXUWFJFHSA-N 448.903 4.076 10 10 IICE CCOC(=O)C[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1457812475 ALEYLBZGQKWFNM-QFIPXVFZSA-N 434.536 4.339 10 10 IICE CCS(=O)(=O)c1cc(Cl)cc(CNC(=O)c2ccc(-n3c(C)ccc3C)cc2)c1 1460941205 YNNCTKLBWDUFIO-UHFFFAOYSA-N 430.957 4.471 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccc(OC)c(O)c1 1467265852 UIFVCXOJROZQRE-OAQYLSRUSA-N 442.899 4.106 10 10 IICE O=C(NCCOc1ccc(Cl)c(Cl)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1470339273 VTHZXRIJNSFXGA-KRWDZBQOSA-N 439.339 4.469 10 10 IICE COc1ccc(N2CCCN([C@H]3CCN(c4ccccc4C(F)(F)F)C3=O)CC2)cc1 1473114488 DHKITFUNSFVSKF-NRFANRHFSA-N 433.474 4.032 10 10 IICE COc1cc(N2CCN(C(=O)NC[C@]3(C)CC[C@H](C)C3(C)C)CC2)cc(OC)c1OC 1478942913 LUVXAARDFLIKSG-XDHUDOTRSA-N 433.593 4.006 10 10 IICE C[C@@H]1CCC[C@@](Cn2c(-c3cccn3C)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1493505644 BHGFGPJUSZQIMZ-KBMIEXCESA-N 436.604 4.136 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@@H]2CC)n1Cc1ccc(N(C)C)cc1C 1496812698 NFRWKILFSPMSDB-VGSWGCGISA-N 440.636 4.244 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCN1CCCCC1=O 1508911708 XJQBLFHMBOUAMV-UHFFFAOYSA-N 438.620 4.041 10 10 IICE CC[C@]1(C)CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1513591591 WTVACGRULNZZSP-XMMPIXPASA-N 429.584 4.270 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2CCN(C(=O)c3c(F)cccc3F)CC2)c1C 1542750138 ZWSZCJBKLMGQQF-UHFFFAOYSA-N 437.490 4.279 10 10 IICE COC(=O)C1(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)CCCCC1 1544837912 OTYKUICDLVSQGX-UHFFFAOYSA-N 433.346 4.462 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC1CCOCC1 1545332434 GWBQMDUKYUCTOH-FQEVSTJZSA-N 441.620 4.081 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2=O)c(C)n1-c1ccccn1 1546206049 ZMZHSFOJVMAAAV-IBGZPJMESA-N 443.334 4.331 10 10 IICE COCCO[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCCC1(F)F 1555615735 UBNMVPMGDGRSAM-AEFFLSMTSA-N 438.519 4.170 10 10 IICE Cc1ccccc1[C@H](CO)N(C)C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1558381633 OWJDBXVHRQPEQB-FQEVSTJZSA-N 442.357 4.366 10 10 IICE CN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CCC[C@H]1c1ccccc1 1564895271 CFJYGAXEUJMWKJ-UGKGYDQZSA-N 429.511 4.279 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N(Cc3cccc(Br)c3)C3CC3)C2)cc1 1565055602 GVVAUGAHZYTPFJ-GOSISDBHSA-N 444.373 4.411 10 10 IICE CC1CCN(c2ccc(CNC(=O)Cc3ccc(NC(=O)C(F)(F)F)cc3)cc2)CC1 1565664175 XJEZONGLOWQJSD-UHFFFAOYSA-N 433.474 4.283 10 10 IICE Cc1ccc(-c2nc(C)sc2CC(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1583475223 CMKMGTBMNXMPKE-UHFFFAOYSA-N 434.609 4.038 10 10 IICE O=C(CCCn1ccc2cc(Cl)ccc21)NCc1ccc(N2CCC(O)CC2)cc1 1585536073 PGURXCOFPZWZJD-UHFFFAOYSA-N 425.960 4.352 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](Cn2cccn2)c2ccccc2)cc1 1586609523 RQHLBWMKTJOJDX-RUZDIDTESA-N 426.520 4.203 10 10 IICE CC[C@@H](C)[C@H](C(=O)NCc1cc(C)n(-c2ccccc2)c1C)N1C(=O)c2ccccc2C1=O 1587885922 GQNFDEUFCOOZNZ-MZNJEOGPSA-N 443.547 4.421 10 10 IICE CC[C@@H](CNC(=O)c1ccc2c(c1)c(C)c(C)n2CCOC)N1CCc2ccccc2C1 1595542592 VHXMJTJLSOKEMO-DEOSSOPVSA-N 433.596 4.471 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)cn2C)n1Cc1ccoc1 1617938121 WXOXFBOYKIYPPG-UHFFFAOYSA-N 442.317 4.029 10 10 IICE COc1ccc(CNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H]2c2cccc(C)c2)c(O)c1 1626080179 ZPRRMKRUXSPLEP-LOSJGSFVSA-N 430.548 4.241 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCn4cnc(C(F)(F)F)c4C3)c2C)c1 1637577982 LWIFJVAKOVLWNH-UHFFFAOYSA-N 431.462 4.343 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3cccc(-c4ccccc4)c3)CC2)cc1 1640218288 YKLMSLFLDISCHF-PFONDFGASA-N 441.531 4.206 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1674929900 FEEROMAAXKDXQE-JOCHJYFZSA-N 440.588 4.335 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(CCc1cccc(F)c1)C1CCCC1 1682987144 YQVNRHKJMQBCHU-UHFFFAOYSA-N 439.575 4.484 10 10 IICE COC(=O)c1nc([C@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)sc1C 1683253111 CTBFDLXNKKXYDT-HNAYVOBHSA-N 444.601 4.090 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)[C@@H](C)c3ccccc3Br)C2)cc1 1683782790 VHPHQSVJMCFWLY-HOTGVXAUSA-N 432.362 4.439 10 10 IICE C[C@H](NC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)c1ccccc1O 1683807982 UAYUNLMWFCUNKW-LPHOPBHVSA-N 425.529 4.114 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCC[C@H](COC)C2)cc1 1710028029 OGHRGRYIXKGTOS-QHCPKHFHSA-N 448.615 4.021 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1727664232 OSYHCSCEQGVYHA-AUSIDOKSSA-N 439.648 4.457 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CC4)n3CCCC(F)(F)F)CC2)cc1 1730180905 WAYWIWYCMUTRJV-UHFFFAOYSA-N 437.510 4.298 10 10 IICE C[C@@H]1CCN(c2nnc(-c3cccc([N+](=O)[O-])c3)n2CCCSc2nccs2)C1 1743138442 SMAWDEVAIBRXDP-CQSZACIVSA-N 430.559 4.338 10 10 IICE CC(C)c1nnc(N(C)CC2CCCC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1760900156 ZDAWLAAUHPQEJW-UHFFFAOYSA-N 425.621 4.285 10 10 IICE CCN(c1nnc([C@H]2CCC(=O)N2)n1CCCSc1nccs1)C1CCCCC1 1764787640 GLJWLLQQFDRHJJ-MRXNPFEDSA-N 434.635 4.027 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC12CCC(NCc1c(O)cccc1Br)CC2 1965972621 OEKZQHYAGRYHBF-RNHGABITSA-N 425.367 4.470 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(CNCc2c(O)cccc2Br)CC12CCC2 1966052488 FHQYGLDZGAPKGS-HXUWFJFHSA-N 425.367 4.329 10 10 IICE CN(C)c1ccc([C@@H](N)c2ccc(I)c(Br)c2)cc1 2106792260 BBSGDUYXMVMTAL-OAHLLOKOSA-N 431.115 4.168 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)c1O 2236053530 WJZYURPZHKNGMZ-KBPBESRZSA-N 443.382 4.146 10 10 IICE CC1=CC2=NC(=O)C(=Cc3ccc(OCc4ccccc4[N+](=O)[O-])c(Cl)c3)C(=N)N2O1 2297347799 DZZRGWHGTHTCIL-UHFFFAOYSA-N 438.827 4.278 10 10 IICE O=C(O)c1cc(N2C(=O)C(=Cc3ccc(Br)cc3)SC2=S)ccc1O 2314926333 GQSZRVXOSXODDW-UHFFFAOYSA-N 436.308 4.259 10 10 IICE COc1cc(C=CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)ccc1OC(C)=O 2326991714 HQUGXWQOJLEDOH-UHFFFAOYSA-N 441.439 4.048 10 10 IICE Cc1ccc(CN[C@H]2CN(C(=O)OC(C)(C)C)C23CCCC3)c(O)c1Br 2352690671 GZJYXXZHXKCNSM-HNNXBMFYSA-N 425.367 4.485 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3CC[C@@H]([C@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2381136590 AHCNGDHBGVHAQJ-AIANPOQGSA-N 443.357 4.431 10 10 IICE COc1ccc(CN2C(=O)/C(=C/C3=Cc4cccc(OC)c4OC3)SC2=S)cc1 33515965 SANYXIKKCGVCDC-ODLFYWEKSA-N 425.531 4.424 10 10 IICE COc1ccc(N2C(=O)N=C(O)/C(=C/c3c(C)nn(Cc4ccccc4)c3C)C2=O)cc1 59858737 OFSMMTIAULCOPI-BKUYFWCQSA-N 430.464 4.064 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccccc3CN3CCC[C@@H]3C(N)=O)c2C)c1 110830669 MKLJTDBYGSLLJL-XMMPIXPASA-N 430.552 4.105 10 10 IICE CCOc1ccc(CCNC(=O)C(=O)N(c2ccccc2)c2ccc(N)cc2)cc1OCC 170388834 MFJFHEDQXUPGEI-UHFFFAOYSA-N 447.535 4.090 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 226741483 NUAVGBMVFGHSST-DBXWQHBBSA-N 427.526 4.498 10 10 IICE CO[C@H](C)CN(C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)C(C)C 740804263 WUXGZOZKADPANK-VQCBNXJZSA-N 426.629 4.001 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccn(-c3cccc(Cl)c3)n2)cc1 751403000 AYCOCOVWBNABTO-QFIPXVFZSA-N 438.959 4.413 10 10 IICE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1[C@@H]1COc2c1ccc(Cl)c2Cl 761250060 FDNUEGWUHSLJTB-CYBMUJFWSA-N 427.671 4.250 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc(N3CCCC3=O)ccc2F)C1 766431611 YCPRKYPZZXOCMH-UHFFFAOYSA-N 448.542 4.312 10 10 IICE CC(C)N1CC[C@H](NC(=O)NCCCSc2nccs2)[C@@H]1c1ccc(F)c(F)c1 779364766 RGYKUSCVFGUBFO-ROUUACIJSA-N 440.585 4.427 10 10 IICE Cc1cc(NC(=O)C(=O)N(c2ccc(N)cc2)C2CCCCC2)n(-c2ccccc2C)n1 784061875 GIQGJNUSNPTCAW-UHFFFAOYSA-N 431.540 4.376 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc(C(=O)N3CCCC3)n2Cc2ccccc2)cc1 802213562 DCGUCNCKNMJFSP-UHFFFAOYSA-N 446.599 4.045 10 10 IICE CCOC(=O)c1ccc(NCN2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 1084212142 LFZLCCNDTCXRGN-BOPFTXTBSA-N 443.506 4.042 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(Cl)c(I)c1 1126081023 ZNKPZAJONLKHQW-UHFFFAOYSA-N 428.701 4.249 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1oc(C2CC2)nc1C(F)F 1126581837 HFNNXSFVZVINPT-LBPRGKRZSA-N 427.398 4.490 10 10 IICE CC(C)Oc1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 1129085460 ULTGTZSRPDHYEI-UHFFFAOYSA-N 430.416 4.410 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@@H]3c3ccccc3OC(F)(F)F)C2)cc1 1129993181 KIWQYOGHZOZBRZ-CDHQVMDDSA-N 434.458 4.340 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3ccc(OC)c(Br)c3)C2)cc1 1130185434 HVQYBFJZTJCNMV-KRWDZBQOSA-N 447.373 4.042 10 10 IICE CCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1138534604 BZENOANPUQPJGW-MRXNPFEDSA-N 433.268 4.242 10 10 IICE CC[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@H](O)c1ccccc1F 1150196650 JOGSWPBUCJFACH-ATIYNZHBSA-N 437.559 4.175 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(Cc4ccccc4C)CCO3)c2C)cc1 1152111167 OPYHJNYUQKPTOQ-RUZDIDTESA-N 447.579 4.042 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN([C@H](CO)c2ccc(Cl)cc2)CC1 1152994871 ACMCRYRXZSKHLB-OAQYLSRUSA-N 444.000 4.300 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(CC3CCC3)[C@H](C)c3ccccc3)CC2)cc1 1167453923 OXRKDIKOXIQMBV-ATIYNZHBSA-N 437.628 4.041 10 10 IICE CCOC(=O)c1sc2nc(C)cc(C)c2c1NC(=O)CN(C)c1ccc(OC)cc1 1195819383 ZWWIHVUNACOOKI-UHFFFAOYSA-N 427.526 4.173 10 10 IICE Brc1cc(CN[C@@H](c2ccccc2)c2nc[nH]n2)ccc1N1CCCCC1 1205320821 SEHVZBSNXFDSEL-FQEVSTJZSA-N 426.362 4.437 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C1 1230196178 VRFREKDVNAHNMO-QKNQBKEWSA-N 446.636 4.327 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3ccc(C(F)(F)F)cc3N3CCCC3)C2)cc1 1278861855 PLZHKZXMDDKLGV-QGZVFWFLSA-N 433.474 4.323 10 10 IICE CC(C)CN(c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)c(F)c1)C(C)C 1287702311 BVXDENQAFSSQBY-UHFFFAOYSA-N 429.584 4.440 10 10 IICE CCc1csc([C@@H]2CCCN(c3nnc(CC)n3Cc3ccc(N(C)C)c(F)c3)C2)n1 1292672050 WJGULRXPDNWYLR-QGZVFWFLSA-N 442.608 4.497 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3cc(Cl)cc(Cl)c3)CC2)cc1F 1294824111 PWYDMZBUXVPOPR-UHFFFAOYSA-N 427.303 4.259 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC[C@@H](CN3CCC(C)CC3)C2)cc1 1295410245 KDFWBBATVYSCQZ-DEOSSOPVSA-N 438.664 4.429 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3CCOC(C)(C)C)CC2)cc1 1300247067 HOMKRTQKTIPBKR-UHFFFAOYSA-N 443.636 4.407 10 10 IICE Cc1cc(C(=O)N2CCC([C@H](O)c3ccnn3C)CC2)c(C)n1-c1ccc(Cl)cc1 1301302311 YOZOBYKVUTXVFV-QFIPXVFZSA-N 426.948 4.067 10 10 IICE CC(C)N1C(=O)C[C@H](C(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(Cl)c(F)c1 1305083785 CLRSOSKAUCVIGK-IFXJQAMLSA-N 439.314 4.453 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)c1ccc(C(N)=O)[nH]1 1306449145 CXLJCVKJGRBTNH-MRXNPFEDSA-N 430.430 4.039 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)c3ccccc3Br)CC2)cc1F 1445846502 PONUTDVVFGYBIR-UHFFFAOYSA-N 435.337 4.223 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@]2(c3ccccc3)C[C@@H](NC(=O)OC(C)(C)C)C2)c1 1465993651 VEJUQVXEWWEXAB-BXZDMCNWSA-N 440.540 4.203 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCC(=O)NC(C)(C)C 1495110673 GAJCLPDLIMHZFY-LJQANCHMSA-N 440.636 4.333 10 10 IICE CCC[C@@H]1C[C@H]1n1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H](C)CC(N)=O 1501353177 UTMUXVFGSZLWRA-DKZVUGQWSA-N 434.588 4.414 10 10 IICE CCOCc1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N2CCSCC2)cc1 1503082427 TVEXAFUIDWLBEO-LJQANCHMSA-N 429.634 4.043 10 10 IICE CC[C@H](C(=O)NCc1ccc(N(CC)CC)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1516598320 AFDPJVVIPZVEEB-HXUWFJFHSA-N 426.952 4.107 10 10 IICE Cc1ccc(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1I 1536549376 FKXBXTBPNANVKA-HNNXBMFYSA-N 436.337 4.335 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cc1 1538159851 HACQKXUPVBAMME-UHFFFAOYSA-N 441.535 4.151 10 10 IICE CC[C@H](CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)N1CCc2ccccc2C1 1540749014 PAQPOJUFTZZZAG-AREMUKBSSA-N 443.591 4.402 10 10 IICE Cc1c(NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n[nH]c1C1CC1 1542846670 JORJQFREMPJROO-GXDHUFHOSA-N 432.596 4.277 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCC[C@@H]1OC 1545503754 HOIGYZJDOHWWEQ-MZKRTTBSSA-N 441.620 4.332 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CC3=CCCCC3)CC2)cc1F 1554960979 UIAYIWPUIYLLDE-UHFFFAOYSA-N 427.568 4.451 10 10 IICE CCO[C@H]1C[C@](CO)(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)C1(C)C 1556221454 GLBCVLKFBBTPCA-SIKLNZKXSA-N 449.389 4.153 10 10 IICE Cc1ccc(C(=O)NCc2cnc(Br)s2)cc1-n1c(C)cc(C=O)c1C 1556583427 FQFYNURMZGVOQZ-UHFFFAOYSA-N 432.343 4.364 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 1557063148 GPUWBLBHXCMICB-HXUWFJFHSA-N 445.563 4.331 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 1557426960 FOSXJCIYPIFJTE-FRBHRHKVSA-N 438.524 4.020 10 10 IICE CC(=O)c1cc(Cl)cc(CN[C@@H]2CN(CC(F)(F)F)C[C@H]2c2ccccc2)c1O 1559905171 VITXQWYKQVVZTA-RBUKOAKNSA-N 426.866 4.368 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)c2C)cc1 1570315736 LLCYNLKAIVKYSE-PGRDOPGGSA-N 439.556 4.184 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3sc4c(c3C(=O)OC)CCOC4)ccc21 1584242571 UUVGFLCPTZMVBN-UHFFFAOYSA-N 442.537 4.078 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1585665058 LFJKYZUQBZJQFM-JQYIIUTOSA-N 435.612 4.186 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1595595875 MHUVRWVPJBKDPA-MRXNPFEDSA-N 433.335 4.247 10 10 IICE Cc1ccc(C(=O)N2CCC([C@@](C)(O)C(F)(F)F)CC2)cc1-n1c(C)cc(C=O)c1C 1611137702 RLAQGSPWGFAPMY-JOCHJYFZSA-N 436.474 4.381 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N1C[C@H](C)S[C@@H](C)C1 1611963144 IPRXRJGEFQVABF-WFXMLNOXSA-N 429.634 4.273 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H](C)N(C)C(=O)OC(C)(C)C 1612536437 AYGCMQPEWWZNFC-GOSISDBHSA-N 442.608 4.079 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCN(CC(F)(F)F)C1 1613169722 GZFPONHMOGSWGN-CVEARBPZSA-N 425.499 4.018 10 10 IICE CCS[C@H]1CCCCN(c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)C1 1617500109 MGWMDCYGCVZVHY-NRFANRHFSA-N 431.675 4.300 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)Cc2cc(C)n(-c3ccccc3)c2C)C1 1618821887 YNEKWWDOFLABLA-LJQANCHMSA-N 449.517 4.286 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)N(C)CCO3)c(C)n1-c1ccc(Br)cn1 1621691476 CLWFVYZKQLAWMX-UHFFFAOYSA-N 441.329 4.333 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)c(C)n1-c1ccc(Cl)cc1 1623391170 MSPILXHUHVJSIB-QGZVFWFLSA-N 427.854 4.031 10 10 IICE Cc1cc(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1631078858 XMVPVLZGCMYFSR-OAHLLOKOSA-N 447.421 4.492 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCOc1ccc(Cl)cc1 1632701786 NDPOUJJRLZHNIW-UHFFFAOYSA-N 426.296 4.060 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1635801549 LNPFDANXKNPGGA-NRFANRHFSA-N 442.604 4.218 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C(=O)OC(C)(C)C)C[C@@H](C)C3)ccc21 1638264779 FTCFLQRWFRPFPX-UZLBHIALSA-N 428.573 4.344 10 10 IICE Cc1cc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)c(C)n1-c1ccc(Cl)cc1 1638379587 HGSJCBXNIQYKHA-HSZRJFAPSA-N 437.971 4.244 10 10 IICE Cc1cc(F)ccc1C1CCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1638918541 XEZWMCPOOPVIGD-XMMPIXPASA-N 426.580 4.392 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C[C@H](C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1 1639814272 RACKZUJDPWATLA-PMACEKPBSA-N 447.620 4.263 10 10 IICE Cc1cc(C(=O)Nc2ccc(I)cc2F)c(C)n1-c1ccccn1 1641035362 KLIHYDYGXHKRBO-UHFFFAOYSA-N 435.240 4.485 10 10 IICE COc1ccc(N(Cc2nc(N)nc(Nc3ccccc3C)n2)Cc2ccco2)cc1F 1642029326 ISNNFQHPWNCWCJ-UHFFFAOYSA-N 434.475 4.453 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC2(CCN(C(=O)c3cc(O)cs3)CC2)Oc2ccccc21 1648318301 JFMKGSILPIJLJO-KRWDZBQOSA-N 444.553 4.477 10 10 IICE COCn1ccc(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)n1 1650694633 ATDCDEGYUXDWHH-UHFFFAOYSA-N 425.489 4.409 10 10 IICE CC[C@]1(C(C)C)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)C1=O 1652651330 QTIUUJZTOQJIIX-HSZRJFAPSA-N 447.482 4.235 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3ccc(Cl)c(F)c3)C[C@@H]2C)c([N+](=O)[O-])c1 1655537078 GUZSYHNVSRVPMY-PXYYCUNGSA-N 433.867 4.289 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)CN(C)Cc1ccccc1 1673260385 OIGFHDUKTOMOPX-MRXNPFEDSA-N 434.378 4.207 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCC1(Cc2cccc(Cl)c2)CC1 1673498711 WSLVQOGCNUJPSQ-UHFFFAOYSA-N 427.976 4.123 10 10 IICE Cc1cc(CCNC(=O)N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c(C)n1-c1ccccc1 1674925015 YMJJBWPSWOUDFP-AZGAKELHSA-N 435.543 4.146 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cc1 1684273264 SRDLXBCGNDUYEK-UHFFFAOYSA-N 438.616 4.075 10 10 IICE C[C@H]1CCCCN1CCC1CCN(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1 1685681397 FQHFHZZERUBVEM-SQJMNOBHSA-N 443.680 4.041 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCCC[C@@H]3c3c(C)n[nH]c3C)C2)cc1 1686854943 KXLRBGSKTPPEPL-DENIHFKCSA-N 425.577 4.188 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC=CCC1 1706586028 NPUKAIXWPAKVKP-FQEVSTJZSA-N 436.604 4.009 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCCCCC2)n1Cc1ccc2c(c1)CCCN2C 1712550575 COQQXHBMZJSJGM-HXUWFJFHSA-N 441.620 4.203 10 10 IICE Cc1cc(Cn2c(CC(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)cs1 1751425634 SSWDSAKCOHZFJF-UHFFFAOYSA-N 439.629 4.368 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)CC3CCCC3)n2CCCSc2nccs2)n1 1762422569 RMZUTLOREKCOLG-UHFFFAOYSA-N 445.662 4.405 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCSC1 1763497762 FDFMKKLGUHBNOW-PZJWPPBQSA-N 443.661 4.408 10 10 IICE CN(c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1)[C@H]1CCSC1 1768556827 KBLWHPDXXYHMJA-GJZGRUSLSA-N 425.649 4.100 10 10 IICE COc1ccc(-c2nnc(N3CC[C@H](C)C3)n2CCCSc2nccs2)cc1OC 1770036186 GEUXPDWXNPAEHF-HNNXBMFYSA-N 445.614 4.447 10 10 IICE COc1ccc(OC)c(/C=C2/SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)c1 1860086873 MLATWGWQWJGXGN-LDADJPATSA-N 425.535 4.024 10 10 IICE CN(Cc1ccccc1)C(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860343982 QWDWOBHSZTXUHZ-UHFFFAOYSA-N 448.526 4.233 10 10 IICE CN(C)c1ccc(C=CC(=O)N2CCN(Cc3csc(-c4ccccc4)n3)CC2)cc1 2042450583 OOPVSHBTSVFHKX-UHFFFAOYSA-N 432.593 4.234 10 10 IICE CC(C)(C)OC(=O)NC[C@@]1(CNCc2cc(Br)ccc2O)CC12CCC2 2097951449 NCFSZISUZJIHQJ-FQEVSTJZSA-N 425.367 4.329 10 10 IICE O=C1NC(=O)N(c2cccc(F)c2)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12 2296474069 BWCQTMLPZQOPFK-UHFFFAOYSA-N 439.446 4.495 10 10 IICE COc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(Br)cc3)C2=O)cc1 2296879838 FSOUXXDXFUISQG-UHFFFAOYSA-N 449.351 4.004 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OC 2297499001 LBOODZATKUSYRA-UHFFFAOYSA-N 442.562 4.420 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccc(Sc2nc3ccccc3[nH]2)o1 2313570727 DXOQQJKVIZFCNG-UHFFFAOYSA-N 448.435 4.113 10 10 IICE CC[C@H](C)[C@@H](CC(=O)NCc1ccc(C)c(Br)c1O)NC(=O)OC(C)(C)C 2380720003 FLIHZCQOBBKXOS-SWLSCSKDSA-N 443.382 4.409 10 10 IICE N=C1/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)C(=O)N=C2SC(c3ccco3)=NN12 3465637 RNGNUINCWXTCOY-VRENQZFPSA-N 433.405 4.115 10 10 IICE CCCCn1nc(C)c(/C=C/C(=O)N2CCCN(c3ccc(OC)cc3)CC2)c1Cl 108427485 JOUAUQNJBOXBNH-VAWYXSNFSA-N 430.980 4.406 10 10 IICE Cc1ccc2nc(NC(=O)CN3C(=O)/C(=C\c4ccccc4)SC3=S)sc2c1 208739385 NCVJZLXORQTLNK-MHWRWJLKSA-N 425.560 4.445 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(NC(=S)N(c2ccccc2)c2ccc(N)cc2)c1 242632154 CPACGYNXKPMPNN-UHFFFAOYSA-N 435.505 4.377 10 10 IICE Cc1cc(N2CCOCC2)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435614171 DLCJUARELPHKGE-UHFFFAOYSA-N 446.595 4.192 10 10 IICE OCc1ccc(N2C[C@H]3CC[C@H]2[C@@H]2CN(Cc4ccccc4)C[C@H]32)cc1Br 705846073 OZWMAGKEICDCIO-TUUKDFBESA-N 427.386 4.288 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3sc(C)nc3C)cs2)cc1Cl 749737509 HPQUDRUFTWVXLR-UHFFFAOYSA-N 443.959 4.124 10 10 IICE Cc1noc(C)c1[C@H](C)CC(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 754288946 PVLNWERSYYQJHG-CYBMUJFWSA-N 438.480 4.347 10 10 IICE COc1ccc(Br)cc1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768671297 YLVDRJRVMHVDOB-UHFFFAOYSA-N 444.417 4.280 10 10 IICE COc1cc2c(c(OC)c1OC)CCN(Cc1cc(C)cc(Br)c1O)CC2 781906718 AZCYMVOHRGJIRS-UHFFFAOYSA-N 436.346 4.090 10 10 IICE CCN1CCN(c2ccc(CNC(=O)N(CC)Cc3c[nH]c4ccccc34)cc2F)CC1 785871347 HTJSJLDZELPLAX-UHFFFAOYSA-N 437.563 4.181 10 10 IICE Cc1ccncc1CN(C)C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 794207863 XKZMBYGCRVHFAT-BOPFTXTBSA-N 431.608 4.092 10 10 IICE O=C(NCc1ccc(OCC(F)(F)F)cc1)NCc1cc(Br)ccc1O 804889190 HFKDNCPKCSQQNJ-UHFFFAOYSA-N 433.224 4.095 10 10 IICE COc1cc(O)c(CN[C@H](Cc2ccc(F)cc2)[C@@H]2COc3ccccc3O2)cc1OC 814178230 IJOODWMQWWWKJT-CLOONOSVSA-N 439.483 4.089 10 10 IICE CC1CC(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)(c2cccc(Cl)c2)C1 1133626525 NXVJBLJMEJQRPU-UHFFFAOYSA-N 439.987 4.026 10 10 IICE COCC[S@@](=O)Cc1cccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1146915536 QRHWTCRBAWLIFC-WJOKGBTCSA-N 438.549 4.054 10 10 IICE CCNc1ccc(C)cc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1147520513 YZTLZJDNGDLPTC-JOCHJYFZSA-N 440.588 4.489 10 10 IICE O=C(Nc1cc(-c2cccc(Cl)c2)nn1CCO)c1cc2cc(O)c(O)cc2s1 1160715885 COSCEMRYKKVDDA-UHFFFAOYSA-N 429.885 4.074 10 10 IICE COCCn1cc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)cn1 1182483531 WMHIUSBCWXQPJK-HXUWFJFHSA-N 446.473 4.455 10 10 IICE CCOC(=O)c1c(NC(=O)CS(=O)(=O)c2cccs2)sc(C)c1-c1ccccc1 1188979981 JROYVIWONGTZTE-UHFFFAOYSA-N 449.575 4.374 10 10 IICE COc1cc(NCCNC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc(OC)c1 1234326694 LRUTXTKLXFZYMK-UHFFFAOYSA-N 436.556 4.331 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H]3O[C@@H](c4ccccc4)C[C@H]32)N(C)C)cc1 1256237381 YPXYRROHZFJDDW-ZGFBMJKBSA-N 436.600 4.060 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C(C)=C\c3cccc(Cl)c3)CC2)cc1 1264273591 JLOWQBLZDRDHPH-ZPHPHTNESA-N 427.976 4.080 10 10 IICE COc1ccc(N2CCN(CCNC(=O)Cc3coc4cc(C)c(C(C)C)cc34)CC2)cc1 1292281727 IBQDSENHHXYOND-UHFFFAOYSA-N 449.595 4.354 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 1295589950 AYVPHYXMYOFJTH-UHFFFAOYSA-N 448.903 4.208 10 10 IICE CCN(Cc1c(CO)cnc(C)c1O)C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1299338047 WMSNVUHYJFCYEK-UHFFFAOYSA-N 427.932 4.311 10 10 IICE Cc1cc(-c2nnc(N3CCOC(C)(C)[C@H]3C)n2CC(C)(C)O)c(C)n1-c1ccccc1 1304195726 GAUZESJZGJRWSN-LJQANCHMSA-N 437.588 4.127 10 10 IICE CC[C@@H]1CCCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)C1 1306331047 SMMHZWYWMWNQNB-VQTJNVASSA-N 429.609 4.051 10 10 IICE Cc1ccc2nc([C@@H]3CCCN3C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)[nH]c2c1 1313419937 WDXBYNBJFAENLF-XZOQPEGZSA-N 434.588 4.087 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)C2)cc1 1452036461 YEULQFFEFHICSA-NIYFSFCBSA-N 438.568 4.052 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCCC2)[C@@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1468670390 ZNACLIPEPYIJGJ-INIZCTEOSA-N 429.344 4.495 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1(c2ccc(F)cc2)CCCC1 1470448876 BUOPIUBFERLWCM-UHFFFAOYSA-N 433.474 4.209 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1470774217 XYOUBAVFXSPTIY-SJORKVTESA-N 429.948 4.140 10 10 IICE CCCNC(=O)OC[C@H]1CCCCN1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1470969171 QSPHGHRHQXYQOG-HSZRJFAPSA-N 440.588 4.337 10 10 IICE CCOc1ccc(N(CC)CC(=O)Nc2ccccc2C(=O)NCc2ccccc2)cc1 1473262619 ZJZNPPRANVDXKH-UHFFFAOYSA-N 431.536 4.480 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)CC2)c(OC)c1 1534586981 KCFLDPQFGCASKO-UHFFFAOYSA-N 428.838 4.338 10 10 IICE C[C@H]1CCCN(c2cc(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)ccn2)C1 1539583081 XZSLUMUCIYMYRB-PKOBYXMFSA-N 444.526 4.318 10 10 IICE COc1ccccc1N1CC[C@@H](CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)C1 1542712216 AVSLXSGZNDJUPY-QFIPXVFZSA-N 445.563 4.100 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@](C)(O)[C@H](C)CC 1545503420 ABEHNBVKCHUIOX-DFIYOIEZSA-N 443.636 4.314 10 10 IICE COc1ccc(OC(F)F)c(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1545767119 LXHCCHMSAZVHPG-UHFFFAOYSA-N 442.462 4.376 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N(C)CC2CCOCC2)cc1 1547443959 IDXSGOFAIWGXBF-UHFFFAOYSA-N 448.615 4.406 10 10 IICE CCCN(Cc1ccccc1O)[C@@H](C(=O)OCC)c1nc(Br)sc1C 1559570447 VEAZHHREAYOMHJ-MRXNPFEDSA-N 427.364 4.436 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CC=C(c4ccc(F)cc4)CC3)CC2)c(OC)c1 1564440447 IPIOQVHTNFYZQO-NRFANRHFSA-N 439.531 4.311 10 10 IICE COC(=O)NCCCC(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 1610121911 DUCLFOBGSHPQIR-GOSISDBHSA-N 437.462 4.434 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(C)c(=O)c3ccccc23)cc1 1616620484 WEYWWCRSIVFKQW-UHFFFAOYSA-N 441.531 4.460 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@@H]2[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1625680340 VCUMCNUXCQZQIR-HKUYNNGSSA-N 432.362 4.281 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1csc([C@H](C)NC(=O)OC(C)(C)C)n1 1626722852 LGQDNDGINXCYQA-HOTGVXAUSA-N 446.617 4.464 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(N(C)C(=O)OC(C)(C)C)CC2)c1 1627443625 NHMBUMBTFMGXSY-UHFFFAOYSA-N 439.556 4.378 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2CCCN(c3ccccc3)C2=O)cc1 1627988549 FGWONVXESQZJMO-FQEVSTJZSA-N 433.474 4.087 10 10 IICE O=C(N[C@@H]1CCN(c2ccccc2Br)C1)c1cc2cc(O)c(O)cc2s1 1628174300 HTKQANVNGWOXJT-GFCCVEGCSA-N 433.327 4.084 10 10 IICE Cc1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c2cccnc12 1629287596 BJMGLHXOQNKLRU-UHFFFAOYSA-N 439.518 4.363 10 10 IICE COC(=O)C1(N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CCCCC1 1633415257 SODZOXGOYQFSFI-UHFFFAOYSA-N 448.361 4.200 10 10 IICE CCCCn1ncc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 1634161738 CMZYVSWZDYQNHB-NRFANRHFSA-N 443.592 4.053 10 10 IICE CC(C)C[C@@H]1CCCCCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1641822578 LMERFTOOMNSTKF-VWPQPMDRSA-N 433.612 4.346 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccccn12)c1cc(Br)cc(F)c1O 1641972163 MYCBWDIEQAJMJQ-UHFFFAOYSA-N 427.233 4.256 10 10 IICE C[C@@H]1Cc2cnccc2N1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1643138315 KGZVITROXRMBPB-GPLLRDDGSA-N 429.592 4.102 10 10 IICE CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 1653489151 NZLJQHGZWJSECU-CQSZACIVSA-N 434.886 4.261 10 10 IICE CC(C)CC[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)(C)C 1657953494 XIJFYLRCVIBQQI-PWHSHALESA-N 435.628 4.496 10 10 IICE CN(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)[C@@H]1CCCC[C@@H]1c1ccccc1 1676126818 XUYKQHRYPLNZET-JWQCQUIFSA-N 448.611 4.256 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CC2(CCOCC2)Oc2ccccc21 1682101721 VCOIIHLVTZMIKR-AUSIDOKSSA-N 437.584 4.364 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1C[C@H](C)O[C@@H](C2CC2)C1 1693004873 CRRLATDDECSAMT-PGRDOPGGSA-N 425.621 4.293 10 10 IICE Cc1noc(C)c1CCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1693527834 SREHHXNLTASXAI-UHFFFAOYSA-N 438.919 4.183 10 10 IICE CCN(c1nnc(-c2cnccn2)n1CCCSc1nccs1)[C@@H](C)C1CCC1 1695549729 RUJGHKMGDZJUCB-HNNXBMFYSA-N 429.619 4.389 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1C[C@@H](C)CC(C)(C)C1 1724235114 HWJAUVHUGNRNGS-RXVVDRJESA-N 425.621 4.467 10 10 IICE CC[C@H](C)c1nnc(N2CCC(C)=C(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726923146 JGZNQLQEBMPXOZ-KRWDZBQOSA-N 427.568 4.362 10 10 IICE CCOCCC1(Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CC1 1729121591 ZTHBWVOENNMRSL-UHFFFAOYSA-N 441.620 4.334 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1CCC1CC(OC(C)(C)C)C1 1729420313 MOCOEISVZVCRND-VEDCXYSMSA-N 442.604 4.498 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@]1(C)CCCO1 1747753506 HVWYADBYMDSUEJ-DRMXPCRNSA-N 428.577 4.108 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@]3(C)CCCS3)CC2)cc1F 1748848980 AKVQKPHEQWYIQT-QFIPXVFZSA-N 433.597 4.162 10 10 IICE CCC1(CC)CN(c2nnc(C)n2Cc2ccc(N3CCSCC3)cc2)CCS1 1764390364 QNKBKBRITFMPSJ-UHFFFAOYSA-N 431.675 4.300 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1766465169 BPSCWKMNMICPAI-LJQANCHMSA-N 429.584 4.442 10 10 IICE COc1ccc(-c2nnc(N3CC[C@@H](C)C3)n2CCCSc2nccs2)cc1OC 1770036187 GEUXPDWXNPAEHF-OAHLLOKOSA-N 445.614 4.447 10 10 IICE CCc1sc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)nc1-c1ccc(OC)cc1 1858034216 GGTNITPJNXHOAW-UHFFFAOYSA-N 431.539 4.140 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\c3c(C)nc4ccccn34)SC2=S)cc1OC 1858589788 JRUOZKNMBAIPIQ-CPNJWEJPSA-N 439.562 4.104 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2[C@H](NCc3cc(Cl)cc(Br)c3O)[C@@H]21 1965929878 QAPQKGRPJWILQN-VHDGCEQUSA-N 431.758 4.296 10 10 IICE C[C@@H](NC(=O)OC(C)(C)C)c1csc(=NCc2c(O)cccc2Br)[nH]1 2082941320 FMMSLRCLMJKVDI-SNVBAGLBSA-N 428.352 4.231 10 10 IICE CCn1cc(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c2ccccc21 2294095245 MGPKIZIOCYHJDC-UHFFFAOYSA-N 438.281 4.090 10 10 IICE CC1=NN(c2ccc(C)c(C)c2)C(=O)C1=CNC1=CC=C[C@H]2C(=O)c3ccccc3C(=O)[C@@H]12 2297511514 AAUDKFJWTSXTGY-ZJSXRUAMSA-N 437.499 4.265 10 10 IICE COc1cc(C=C2SC(=S)N([C@@H](C)[C@@H]3C[C@H]4CC[C@H]3C4)C2=O)cc([N+](=O)[O-])c1O 2323680402 DABHEVGAQJTHJY-IMIFBBOLSA-N 434.539 4.335 10 10 IICE Cc1ccc(CNC(=O)CCN(CC2CC2)C(=O)OC(C)(C)C)c(O)c1Br 2380755682 DJTQOOUWHFLFKQ-UHFFFAOYSA-N 441.366 4.117 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)c(O)c1Br 2381134720 HBMSECCTHUAQIU-DZGCQCFKSA-N 441.366 4.115 10 10 IICE COc1cc(/C=C2\C(=O)N(c3cccc(C(=O)O)c3)N=C2C)ccc1OC(=O)c1ccco1 16160886 LRORSTFUAHXCFD-WQRHYEAKSA-N 446.415 4.012 10 10 IICE CCOc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1cccc(C)c1 20235895 DHDWHGLADFKKNM-YUIYYNKLSA-N 447.491 4.302 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H](C)c3cccc(Br)c3)CC2)cc1 110462858 GFDPMWNBGVUCEZ-OAHLLOKOSA-N 432.362 4.487 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(F)c3)[C@H]2c2ccc(O)c(O)c2)cc1OC 526151029 ZYYUXCXGAOICSS-QFIPXVFZSA-N 437.423 4.311 10 10 IICE COc1ccc(-c2noc(CCCN3C(=O)/C(=C\c4cccs4)SC3=S)n2)cn1 731805329 BMYYWQOJGSSDBI-GXDHUFHOSA-N 444.563 4.036 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N[C@H]1CCc2c1ccc(Cl)c2Cl 733352228 ABXIMQBJZPNHSD-SFHVURJKSA-N 438.330 4.456 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@@H](C)C[C@@H]3c3ccco3)cc2F)C[C@@H](C)O1 743876196 VXSJTAZSHQILHT-CROMWVBPSA-N 443.563 4.122 10 10 IICE CCS[C@@H]1CC[C@H](N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 769060349 PNBBCIRWFUVVCP-XZOQPEGZSA-N 430.662 4.034 10 10 IICE COc1c(C)cc(C)cc1S(=O)(=O)Nc1nc(-c2ccc3c(c2)OCCO3)cs1 800925030 MEMHGKXBEJCNGP-UHFFFAOYSA-N 432.523 4.008 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 802609432 BPWNBHVLBAYHPB-UHFFFAOYSA-N 444.438 4.147 10 10 IICE CC1CCN(c2ccc(CNC(=O)NCc3nnc(CCc4ccccc4)o3)cc2)CC1 806766040 LXPLBZDNWQVPAF-UHFFFAOYSA-N 433.556 4.091 10 10 IICE C[C@H](N[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2)c1ccc(N2CCOCC2)c(F)c1 813878124 CAAAUZSXLZEDON-UWJYYQICSA-N 433.568 4.103 10 10 IICE CC(C)N(C)Cc1cc(O[C@@H]2CCN(Cc3cccc(Br)c3O)C2)ccn1 856558760 BITXNHMNQCFVLH-LJQANCHMSA-N 434.378 4.043 10 10 IICE COc1ccc(-c2nc(NS(=O)(=O)c3c(Cl)nc4ccccn34)sc2C)cc1 917845904 HKSWJIUCEJCLRB-UHFFFAOYSA-N 434.930 4.229 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C2(NC(=O)NCc3ccccc3)CCCC2)cc1 1135732894 KENBQCREFGBVIB-UHFFFAOYSA-N 436.600 4.303 10 10 IICE CCOC(=O)C1(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCCC1 1142202396 POAAFAMWWHREOM-UHFFFAOYSA-N 433.346 4.462 10 10 IICE Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1150593611 VTPQJPJFDSASMR-LJQANCHMSA-N 442.361 4.271 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc4c(Br)cncc4s3)C2)cc1 1278861004 DXSMLHNMJWYKFK-GFCCVEGCSA-N 432.343 4.076 10 10 IICE Cc1noc(C)c1CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1290928554 BSBHEVPFNJKNFH-NRFANRHFSA-N 442.539 4.014 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccccc2N2CCC(O)CC2)cc1 1291843670 DHOYVQQUBYXMHW-UHFFFAOYSA-N 431.536 4.049 10 10 IICE CCOCCN(CC)c1nnc(-c2ccc(Cl)nc2)n1Cc1ccc(N(C)C)cc1C 1297535741 VLYLASZFGUXVKS-UHFFFAOYSA-N 442.995 4.279 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)Nc3c(C)nn(-c4ccccc4)c3C)CC2)cc1 1319509822 ASZVLJGKTLVFSC-NRFANRHFSA-N 447.583 4.037 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1ccc(OC(F)F)c(Br)c1 1352633737 ZLLXWSCQWNUNGL-UHFFFAOYSA-N 427.245 4.139 10 10 IICE CC[C@@H](C)Oc1ccccc1/C=C/C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1360094106 QRAJBGFGTPHDGC-VSFZPWCASA-N 439.575 4.475 10 10 IICE Cc1ccc([C@@H](CN2CCOCC2)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1440683904 NEICPWAFGIGMJJ-RUZDIDTESA-N 435.543 4.345 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1 1446795805 BECUDPUAWNEXSR-NZQKXSOJSA-N 435.568 4.410 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@@H]2CCCC[C@H]2OC)sc(C)c1-c1ccccc1 1460343147 NPTKKQSVCALKHB-QZTJIDSGSA-N 430.570 4.386 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C2(c3cc(F)cc(Br)c3)CC2)cc1 1461336912 KYHCPAXISXDSGW-UHFFFAOYSA-N 435.337 4.223 10 10 IICE Cc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCOCC2)cc1-n1c(C)cc(C=O)c1C 1464036848 OORILBAVBZTQAE-AREMUKBSSA-N 445.563 4.018 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1cccc(Cl)c1 1464503664 OGSDPYBKLWQIJE-NPPFBWRTSA-N 429.992 4.461 10 10 IICE CC[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)[C@H](CC)CN1C(=O)OCc1ccccc1 1465267161 GQJQZJQBPZYXQQ-KHFNAADASA-N 438.524 4.149 10 10 IICE COC(=O)[C@@H](CC1CCCCC1)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1516034989 ZJCMRPAYEBQQEU-OAQYLSRUSA-N 426.557 4.157 10 10 IICE CCOCc1nnc(N2C[C@H](C)O[C@H](CC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1516498623 WKHREXKMGHIVDH-NZQKXSOJSA-N 441.620 4.103 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)sc2c1CCCC2 1525383530 XEJZZXSBFOYNAR-CQSZACIVSA-N 444.528 4.323 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1 1528925506 ZPQUOKBZEAAOKT-RDPSFJRHSA-N 437.584 4.300 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2c(Cl)cccc2Br)cc1 1530903845 DTPGDWJODGRIGA-UHFFFAOYSA-N 425.754 4.248 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)OCc1coc(C2CC2)n1 1531798593 AQPHLVAQRRUDTK-SXGWCWSVSA-N 432.498 4.026 10 10 IICE COc1ccc(Cn2nnc(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2C)cc1 1534543507 YBALYGWBTRRECV-UHFFFAOYSA-N 443.551 4.023 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(c3cccc(SC)c3)C2)cc1 1540459489 KAVZBBOZQHABFM-IBGZPJMESA-N 425.598 4.266 10 10 IICE CNc1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(Cl)c1 1541097348 NQUYIIXMIRSYTI-UHFFFAOYSA-N 427.854 4.167 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCN(C3CCC3)CC2)cc1 1547446924 KRSMHNKRTUUGOQ-UHFFFAOYSA-N 438.664 4.436 10 10 IICE Cc1cc(CC(=O)N[C@@H](CO)c2ccc(Br)cc2)c(C)n1-c1ccccc1 1556823814 KLVRAKFLHQQUFT-NRFANRHFSA-N 427.342 4.249 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)cc1)C1CCCCC1 1583701031 WWEWOTFQKJDPSW-GOSISDBHSA-N 441.522 4.403 10 10 IICE CC[C@H](Cc1ccc(F)cc1)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1586022965 WUXWOOCXBYXIJC-MRXNPFEDSA-N 446.434 4.260 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(NCCn2ccnc2)cc1 1588193866 YATFZMUBZBOWPT-UHFFFAOYSA-N 443.345 4.126 10 10 IICE CCc1cc(=O)oc2c(CN(CCCOC)C[C@@H]3CCCN4CCCC[C@@H]34)c(O)ccc12 1614472578 TYHDYQQWUXVKAV-REWPJTCUSA-N 442.600 4.164 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(NC(C)=O)CC1 1614516272 KSJHZUZVISEMIO-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@@H]1CCSC1 1617940616 ISDMHYUJQADGLI-ILZDJORESA-N 430.618 4.292 10 10 IICE COCCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1628079808 PZLOJZUEIPHNJE-HXUWFJFHSA-N 426.479 4.229 10 10 IICE Cc1cc(C(=O)CSc2nnc(-c3cccs3)n2C)c(C)n1-c1ccc(F)cn1 1643608732 ZBXJDIOTBAYKKW-UHFFFAOYSA-N 427.530 4.460 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 1682097845 XANSEWMLISOKAR-GLYQVZKVSA-N 427.564 4.429 10 10 IICE COc1cc(OC)c(C[C@@H](C)NC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c(OC)c1 1682491821 VTWLTNFDCULUDR-GOSISDBHSA-N 443.588 4.330 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H](c4ccc(F)c(F)c4)C3)C2)cc1 1683504315 PVGKZVFYHUKPMO-IEBWSBKVSA-N 429.511 4.389 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)Cc2ccccc21 1686950444 LPLDFHONFOEXCG-KRWDZBQOSA-N 431.920 4.211 10 10 IICE CC[C@]1(C)CN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CCO1 1694451345 DLNYXCFKJQRDIZ-HSZRJFAPSA-N 427.524 4.105 10 10 IICE C[C@@H](c1ccccc1)N(C)c1nnc([C@@H]2CCC(=O)N2)n1CCCSc1nccs1 1723754598 KIKDIHATMGVIPC-RDJZCZTQSA-N 442.614 4.066 10 10 IICE C[C@H]1CN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1726709430 IXKZMZIVRROOTD-GOSISDBHSA-N 436.579 4.390 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](C)S[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1726909346 QLPNOMXHRLRCDX-KURKYZTESA-N 447.624 4.146 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC=C(C)C1 1745777693 JRSDCRAHPHLKHQ-UHFFFAOYSA-N 446.599 4.425 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Cc3ccccn3)c3ccc(Cl)cc3)CC2)cc1 1858090561 UWVCVGOGOHGSFO-XMMPIXPASA-N 435.955 4.419 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@](F)(CNCc2cc(Br)cc(F)c2O)C1 2101316952 KXTBUELDRVLKFA-SFHVURJKSA-N 435.309 4.123 10 10 IICE Brc1cc(CNC2CC2)ccc1N1C[C@@H]2[C@H](CCN2Cc2ccccc2)C1 2188889730 ZLRPUUOQDZZVLW-AUSIDOKSSA-N 426.402 4.412 10 10 IICE COc1cc(C=C2C(=O)N(c3ccccc3)N=C2C)cc(Br)c1OC(C)=O 2296910975 SZCXHXXYFUNKMH-UHFFFAOYSA-N 429.270 4.189 10 10 IICE CCOc1cc(N(CC)CC)ccc1C=C1NC(=S)N(c2ccc(OC)cc2)C1=O 2297314704 KACRTWNPCGEAIX-UHFFFAOYSA-N 425.554 4.202 10 10 IICE Cc1cc(C(=O)NCCCN2CCN(c3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 25865387 WCVYRCFJXILAHT-UHFFFAOYSA-N 434.559 4.175 10 10 IICE CN(C)c1ccc(CNC(=O)CCc2nc(-c3ccc(N4CCCCC4)cc3)no2)cc1 33283662 WKAPGWROVGLNIB-UHFFFAOYSA-N 433.556 4.042 10 10 IICE CO[C@@H](C)c1noc(CN(C)C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 747933660 RUZGOEXCOXMFNB-AWEZNQCLSA-N 447.333 4.219 10 10 IICE C[C@H](NC(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1)c1ccc(N2CCOCC2)cc1 750625083 NKDJUGHNTKZWGJ-KJEZJMDVSA-N 441.475 4.033 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC4(CC3)C[C@@H]4C(=O)N3CCCCC3)c2C)cc1 771409909 PQNNJVLYUUMATC-XMMPIXPASA-N 449.595 4.358 10 10 IICE COc1c([N+](=O)[O-])ccc(CNCc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)c1O 775038509 TUMPNDMNPKSPKP-AWEZNQCLSA-N 431.489 4.185 10 10 IICE COc1ccc(C(=O)CCC(=O)NCc2ccc(N3CCSCC3)cc2)c(Cl)c1 779885340 UBZPULOBMLXKDX-UHFFFAOYSA-N 432.973 4.181 10 10 IICE C[C@H](Oc1ccccc1F)c1nnc(N(C)Cc2ccccc2O)n1C[C@H]1CCCO1 812298010 GBPSEBXIVBUGOS-FUHWJXTLSA-N 426.492 4.078 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3ccc(OC(F)(F)F)cc3)cc2F)C[C@@H](C)O1 917711451 GNYUKIJJWHAHRR-GASCZTMLSA-N 440.437 4.197 10 10 IICE Cc1cc(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)c(C)n1-c1ccc(F)cc1 919868946 AITZQXAYHAACLN-UHFFFAOYSA-N 429.495 4.373 10 10 IICE C[C@@H](NC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F)c1ccc(N2CCOCC2)cc1 1136443171 SQPBZMWNDAOCPB-QVKFZJNVSA-N 432.442 4.107 10 10 IICE C[C@@H](NC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F)c1ccc(N2CCOCC2)cc1 1136443172 SQPBZMWNDAOCPB-VFNWGFHPSA-N 432.442 4.107 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)c1 1136590703 BCDIOEACZQVZMT-LJQANCHMSA-N 439.581 4.144 10 10 IICE CCOC(=O)C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1cccc(Br)c1 1152058875 RGJDEWFDLNFHKI-MRXNPFEDSA-N 447.289 4.036 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCCNC(=O)[C@H]3Cc3ccccc3)c2C)c1 1159815511 GTOONVOUXOFLRR-RUZDIDTESA-N 429.564 4.284 10 10 IICE Cc1cc(C(=O)NC2(CO)CCCCCCC2)c(C)n1-c1ccc(Br)cn1 1174564034 ZTABXQAHIBTEAU-UHFFFAOYSA-N 434.378 4.457 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2cccc(OC(C)(C)C)n2)C1 1266851684 OSECDRWUOJZUNE-UHFFFAOYSA-N 434.584 4.297 10 10 IICE CC(C)Oc1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)ccc1[N+](=O)[O-] 1292044523 IXASFFYKHYWNED-UHFFFAOYSA-N 438.528 4.166 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CC[C@H]3CCCCO3)CC2)cc1F 1300248383 WSYDJRHUAGNMKS-LJQANCHMSA-N 445.583 4.009 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H]3C)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1304196580 SZPCNFBUXOAHTQ-SFHVURJKSA-N 434.588 4.114 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCc1nccnc1C 1305380261 DHYWBSYKGNRSMG-IBGZPJMESA-N 433.604 4.369 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(Cc4cccc(Cl)c4)CC3)CC2)c(OC)c1 1312838905 HQPUQHWZLCBZED-UHFFFAOYSA-N 443.975 4.212 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(CCc1ccccn1)Cc1cccnc1 1312884972 NTSBWHNTQSXJNK-NRFANRHFSA-N 431.584 4.237 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)OCCNC(=O)CCc2ccc(C)cc2)CCCC1 1359857369 WOZZOYUKKHXWPU-UHFFFAOYSA-N 448.563 4.129 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)[C@@H](O)c2ccc(Cl)c(Cl)c2)cc1 1442617180 PGVFHRWHJSQSFZ-RXVVDRJESA-N 437.367 4.301 10 10 IICE Cc1cc(C(=O)CSc2nnnn2CC(C)C)c(C)n1-c1ccc(OC(F)F)cc1 1472964260 WLTQTBSJNHYYKD-UHFFFAOYSA-N 435.500 4.313 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3cc(C)on3)n2CCCSc2nccs2)n1 1492500787 RWHRIPVYGPCWMY-UHFFFAOYSA-N 441.586 4.220 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc([N+](=O)[O-])cc1F 1518068583 JUADPSKLDPMTQO-SXGWCWSVSA-N 449.460 4.103 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)C[C@H]3CC(C)C)CC2)cc1 1535589903 QVZJNYDKAYBUMD-ZEQKJWHPSA-N 435.612 4.138 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)nn1C1CCOCC1 1538420593 BMWPFARQWIHPSP-MRXNPFEDSA-N 430.980 4.363 10 10 IICE C[C@@H](NC(=O)c1cnc(C2CCN(C(=O)OC(C)(C)C)CC2)o1)c1ccc(N(C)C)cc1 1538976510 PXVSVOHABDJYAX-MRXNPFEDSA-N 442.560 4.346 10 10 IICE CCCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1547126560 BRWPWOUUHXMRTE-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCSCC[C@H](C)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc2c(c1)CCCN2C 1552586855 INJSLTNPMVXETA-GHTZIAJQSA-N 443.661 4.181 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1Cc1ccc(Cl)s1 1554175343 MENFCURSNZFWCM-UHFFFAOYSA-N 425.945 4.369 10 10 IICE COC[C@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C1 1555344233 ZMMUYRWFKMNVOG-FQEVSTJZSA-N 443.661 4.040 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1557063804 ZXNOYRBMILHLGT-DNVCBOLYSA-N 448.394 4.468 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@H]2CCCC[C@@H]21 1557394441 IGTIOHAYCKOHMD-ZLNRFVROSA-N 436.552 4.409 10 10 IICE COC(=O)/C=C/c1ccc(N2CCc3ccc(F)c(Br)c3C2)c([N+](=O)[O-])c1 1559242709 VKGPJRJKHWZTBZ-XVNBXDOJSA-N 435.249 4.245 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccc(Nc2nccc(C(F)(F)F)n2)c1 1566007894 LUCFDGMKLZQXAR-UHFFFAOYSA-N 443.429 4.344 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1 1566240453 IVWMYVKNCANEGE-QGZVFWFLSA-N 428.492 4.371 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2ccnc(Cl)c2s1 1566848854 AHBMIUSEWWYHNG-UHFFFAOYSA-N 425.293 4.124 10 10 IICE Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(C)n1-c1ccc(Br)cn1 1567467207 DRVCQXKSSQISGV-GFCCVEGCSA-N 444.329 4.024 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@H]3N(C(=O)OC(C)(C)C)CCCC3(C)C)C2)cc1 1585665967 XXZIOLLFHCJZCG-GHTZIAJQSA-N 445.604 4.063 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cnn(C2CCCC2)c1 1598383654 OXWQXZYJESWHQQ-WQRHYEAKSA-N 444.557 4.367 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2csc([C@H]3CC[C@H](C)CC3)n2)N(C)C)cc1 1616867298 UKHAOGRZKBFSMR-SFGWALBWSA-N 428.646 4.464 10 10 IICE Cc1cc(CN2CCN(CC(=O)Nc3ccc(Cl)cc3)CC2)ccc1N1CCCCC1 1616880641 LRTVHPDVHABHFH-UHFFFAOYSA-N 441.019 4.395 10 10 IICE CC(=O)c1ccc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)o1 1618369528 WTKQWAZWCRBBNO-UHFFFAOYSA-N 425.242 4.207 10 10 IICE CO[C@H]1CN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)CC1(C)C 1619521818 GBANNSDIAVXUAA-KRWDZBQOSA-N 444.630 4.149 10 10 IICE O=C(Nc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1)c1cccc(O)c1O 1625608393 YZDUJIBUCNEIQT-UHFFFAOYSA-N 437.927 4.326 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCc1cccc(CN2CCO[C@H](C)C2)c1 1626547992 IITSFOYXBIKIDQ-HXUWFJFHSA-N 445.563 4.057 10 10 IICE Cc1ccc(C(=O)N[C@H](c2ccccc2)c2cnn(C)c2)cc1-n1c(C)cc(C=O)c1C 1632777934 AMURPJPEMSCPDD-RUZDIDTESA-N 426.520 4.468 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C3CCN(C)CC3)C2)c(C)n1-c1ccc(Br)cn1 1633430173 ROVBJAJYBTUISM-SFHVURJKSA-N 445.405 4.056 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@H]1C[C@H](OCC)C1(C)C 1641815484 BQMGZIYANCWYIT-VXKWHMMOSA-N 448.563 4.316 10 10 IICE COC[C@@]1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CCCCN1C(=O)OC(C)(C)C 1641997578 RPGPJKIVHNSFSY-HXUWFJFHSA-N 447.359 4.121 10 10 IICE COc1ccc(-c2n[nH]c(SCC(=O)c3cc(C)n(-c4ccc(F)cn4)c3C)n2)cc1 1656074209 BVISNIMVICNMCQ-UHFFFAOYSA-N 437.500 4.397 10 10 IICE C/C(=C/c1ccccc1OC(F)F)CNCc1ccc(N2CCC(C(N)=O)CC2)cc1 1663292493 PFFHVESPWSTKDL-VKAVYKQESA-N 429.511 4.183 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCCc1cn(-c2ccccc2)nc1C 1681798406 KQEAMRGNZUTUSB-FQEVSTJZSA-N 433.600 4.418 10 10 IICE Cc1ccc(C(C)(C)CN(C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)cc1 1681849759 ILPAOHGCEAMSQA-UHFFFAOYSA-N 431.527 4.229 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CCCN3CC(F)F)cc2Cl)C1 1682024378 RIWKYWTYJGVJDH-WBVHZDCISA-N 428.955 4.105 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCCOc2ccc(Cl)c(Cl)c2)N(C)C)cc1 1682759409 NUEVLLALFXIKLD-HXUWFJFHSA-N 439.387 4.040 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H](c1nc(-c2ccncc2)no1)C(C)C 1683421287 LIBDOERTDACGJX-DYESRHJHSA-N 436.560 4.134 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC(Oc4cccc(Cl)c4Cl)C3)C2)cc1 1683944944 NMRIOVQTJZTXFQ-AWEZNQCLSA-N 436.339 4.054 10 10 IICE COC1CCN(C2(Cn3c(C(C)C)nnc3N(C)Cc3ccccc3O)CCCC2)CC1 1697668184 FRDLTOBUWMJEQU-UHFFFAOYSA-N 441.620 4.167 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCCCS2)cs1 1725247975 AMRIAJJXTYDVJQ-GOSISDBHSA-N 429.615 4.262 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CC[C@H](COC)C2)cc1 1766614182 MGGIXAZIFFRTLY-NRFANRHFSA-N 439.629 4.298 10 10 IICE CCO[C@@]1(c2nnc(N(C)CC(C)(C)C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1767384805 LLDGAKJUTJODHE-VWLOTQADSA-N 443.636 4.307 10 10 IICE CSCC[C@H](C)N(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1771455143 VYWVTPNQSDSRCA-IBGZPJMESA-N 438.645 4.264 10 10 IICE Cc1sc(NS(=O)(=O)c2ccccc2)nc1-c1ccc2c(c1)C(C)(C)C(=O)N2C 1859573002 XIFKOGIZEKJCBK-UHFFFAOYSA-N 427.551 4.173 10 10 IICE CN(C)c1ccc(-c2nc3cc(C(=O)N4CCN(Cc5ccccc5)CC4)ccc3[nH]2)cc1 1873505778 DKZJKSAHUXYDMW-UHFFFAOYSA-N 439.563 4.254 10 10 IICE CC(C)[C@H]1[C@H](NCc2cc(Br)cc(F)c2O)CCN1C(=O)OC(C)(C)C 2126372079 OSSSSTGQLLVFOX-CVEARBPZSA-N 431.346 4.417 10 10 IICE CC[C@H](NCC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)c1cc(Br)ccc1O 2181158222 IWDQYPWCFUJMQM-WBVHZDCISA-N 443.382 4.221 10 10 IICE N=C1C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C(=O)N=C2SC(C(F)(F)F)=NN12 2293253055 LXHNPGGIZRPTPA-UHFFFAOYSA-N 435.343 4.036 10 10 IICE C[C@@H](C(=O)N1CCCC[C@@H]1c1cccnc1)N1C(=O)C(=Cc2cccs2)SC1=S 2296551061 MZIJFTQMUGABSG-WMLDXEAASA-N 443.619 4.487 10 10 IICE Cc1ccc(CN[C@H]2C[C@H]3[C@H](C2)C[C@H]3NC(=O)OC(C)(C)C)c(O)c1Br 2352682485 YEMKSQCQRHJOEU-LVQVYYBASA-N 425.367 4.245 10 10 IICE CC[C@H](NCCCOC1CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2362418896 AUJQYJWQMMJUFG-KRWDZBQOSA-N 443.382 4.221 10 10 IICE COc1cc(/C=C2/SC(Nc3ccc(C)c(C)c3)=NC2=O)ccc1OCCC(=O)O 16912238 VFHJXSRIMQAKIP-XDHOZWIPSA-N 426.494 4.248 10 10 IICE O=C(NC[C@@H]1CCCO1)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 20710270 HJGRQAURCQFWEW-PMECCGAFSA-N 435.480 4.036 10 10 IICE CCCCCCOc1ccc(/C=C2/SC(=S)N(CC(=O)OCC)C2=O)cc1OC 33691355 YSDHLCDTVJYXHS-QGOAFFKASA-N 437.583 4.419 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc(Cl)cc3)C(=O)N=C2O)c(C)n1C[C@@H]1CCCO1 59109242 AMHOPJQJJDVHJJ-FUDBJYBQSA-N 427.888 4.444 10 10 IICE Cc1ccc(N2C(=O)C[C@@H](N3C(=O)/C(=C\C=C/c4ccccc4)SC3=S)C2=O)cc1 100142542 DNRROVRYDPUHRR-PKQSYBHGSA-N 434.542 4.085 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)Cc2ccc(Br)o2)C1 443952625 XFMUTRZNJLYYEB-UHFFFAOYSA-N 444.373 4.422 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC3CCN(c4ccccc4OC)CC3)ccc21 486118774 KVJZMHYKXKKSLJ-UHFFFAOYSA-N 435.568 4.312 10 10 IICE O=C(/C=C\c1ccnc2ccccc12)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 735430769 HUGTXOZCPDUAAQ-VURMDHGXSA-N 441.453 4.420 10 10 IICE COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)NCc1ccc(N2CCSCC2)cc1 746214634 ABIAJMFFLBYMNT-QHCPKHFHSA-N 425.598 4.467 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)N1CCO[C@@H](c2cccs2)C1 761769993 CNDIKLLNOUQLOK-MAUKXSAKSA-N 437.512 4.101 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc(Br)cc(Br)c1 773271959 QHNQIKMQBVTADI-UHFFFAOYSA-N 440.135 4.301 10 10 IICE O=C(NCc1ccc(CN2CCCCC2)cc1)NCc1cc(Br)ccc1O 806339816 JPIUAOLPIPWVHT-UHFFFAOYSA-N 432.362 4.140 10 10 IICE CC(=O)c1cccc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1127657777 GBGBFLDWTNTIHS-XDHOZWIPSA-N 443.521 4.363 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@](C)(CNC(=O)OC(C)(C)C)CC(C)C)C2)cc1 1130185445 HXXASIJHWAEVCW-UQBPGWFLSA-N 447.620 4.215 10 10 IICE Cc1cc(C(=O)N2CCN(CC(C)C)C(=O)[C@@H]2C)c(C)n1-c1ccc(Br)cc1 1138561754 BANRTTUARPHYRD-KRWDZBQOSA-N 446.389 4.186 10 10 IICE COc1ccc(NC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)cc1N1CCOC1=O 1147882166 UIXPLLFOBKEEII-UHFFFAOYSA-N 433.464 4.124 10 10 IICE CC(C)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCN(Cc1ccc(N3CCOCC3)cc1)CC2 1176891997 OTBQDXWXIQPUEP-QHCPKHFHSA-N 443.632 4.381 10 10 IICE COC[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)[C@H]1CCCOC1 1178048390 UBTYZNMEEMIXKD-LPHOPBHVSA-N 435.362 4.028 10 10 IICE O=[N+]([O-])c1ccc(NCc2cc(F)c(N3CCOCC3)c(F)c2)c(Br)c1 1186662530 WGYLKVHHTNLLOH-UHFFFAOYSA-N 428.233 4.084 10 10 IICE Brc1ccc(OC[C@@H]2CCCN2Cc2ccc(N3CCOCC3)cc2)cc1 1198270696 OQRVEBLRSHQPPT-NRFANRHFSA-N 431.374 4.329 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC[C@@H]3c3ccc(OC)cc3OC)C2)cc1 1230300850 KGICVSMWNHNACB-WZONZLPQSA-N 439.556 4.085 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3CC(C)(C)Oc4ccc(F)cc43)C2)cc1 1252114237 BGALYQLJSYTHBD-IIBYNOLFSA-N 427.520 4.262 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(C(C)(C)C)n4ncnc4n3)cc2Cl)C1 1270433930 YICPMWOJWNOVIP-OAHLLOKOSA-N 440.979 4.242 10 10 IICE CCNC(=O)c1ccccc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1290791978 GGPOBYPWRUMCKT-UHFFFAOYSA-N 441.329 4.254 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C[C@@H](C)O1 1293579279 QJMDTQHDBHYUJE-DENIHFKCSA-N 434.588 4.075 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCSC[C@@H]2C)cc1 1295415174 OVZGINHWGVBANJ-GHTZIAJQSA-N 429.634 4.356 10 10 IICE COC[C@H](C)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1300978671 PVKLJIIEBZGSQE-LJQANCHMSA-N 439.629 4.450 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H](OC)C(C)C 1305503212 AFGJERCDMPCSLX-DENIHFKCSA-N 429.609 4.188 10 10 IICE COC(=O)/C=C/c1ccc(N2CCN(c3c(Cl)cccc3Cl)CC2)c([N+](=O)[O-])c1 1307089476 AJBVCCJGJNEUAU-SOFGYWHQSA-N 436.295 4.414 10 10 IICE Cc1cccc(CNC(=O)c2ccc(C(=O)N3CCOc4cc(N(C)C)ccc43)cc2)c1 1354372116 VHIZTFLNOJHGCT-UHFFFAOYSA-N 429.520 4.030 10 10 IICE CN(C)c1ccc(CN(C(=O)c2cc(I)ccc2F)C2CC2)cc1 1355436076 HVUDNZQXUDQLTD-UHFFFAOYSA-N 438.284 4.301 10 10 IICE CC(C)Oc1ncc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1356036584 KDCPBVAXQNDJGC-GASCZTMLSA-N 435.927 4.205 10 10 IICE O=C(NCCCSc1nccs1)[C@H](c1cccc(Br)c1)N1CCCC1 1443487252 GSOVWQKWGRADCF-INIZCTEOSA-N 440.432 4.341 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F 1443828627 ZFGJHMOHZYZEIC-HXUWFJFHSA-N 433.499 4.221 10 10 IICE CN(Cc1ccccc1O)C(=O)CCNC(=O)OCC1c2ccccc2-c2ccccc21 1445643605 DYZYITMPIJHJRW-UHFFFAOYSA-N 430.504 4.279 10 10 IICE CC(C)Cn1c(-c2ccc(Br)cc2)cnc1SCC(=O)Nc1cccnn1 1472946669 IOLMULYFVVEWPU-UHFFFAOYSA-N 446.374 4.489 10 10 IICE Cc1cc(I)cn(CC(=O)c2cc(C)n(-c3ccccc3)c2C)c1=O 1473014048 MQDPMUQWFLWDOM-UHFFFAOYSA-N 446.288 4.052 10 10 IICE COc1cccc(C[C@@H](C)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1516814605 KVYCIQFICGDKRJ-QRVBRYPASA-N 428.548 4.333 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@@H]1C(=O)Nc2ccc(Br)cc21 1525113825 QDLQTHAURSLDEA-IBGZPJMESA-N 442.357 4.134 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)CC(=O)Nc2ccccc2Cl)cc1 1540123411 ORFYOQXBGHCZOQ-UHFFFAOYSA-N 437.927 4.200 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1540440320 CTYVJZZFVADVDV-UTKZUKDTSA-N 434.367 4.237 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)[C@H]1c1ccc(OC)cc1 1540518306 JNPLLFNFUWERHM-UKILVPOCSA-N 437.584 4.110 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(Cn2cc(Br)cn2)cc1 1544093669 FQKGPZVKZKAXEU-UHFFFAOYSA-N 441.373 4.422 10 10 IICE Cc1c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)nnn1CCOc1ccc(F)cc1 1544559126 BOXZDPDYHPMLNQ-UHFFFAOYSA-N 447.514 4.393 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1cccc(Cl)c1Cl 1546152284 ZNHBLWBSZGGLLX-LLVKDONJSA-N 446.714 4.322 10 10 IICE CCN(C)C(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)CC1 1547310905 IZNWWXBMFQNFIP-LJQANCHMSA-N 448.615 4.457 10 10 IICE CSC[C@H]1CCCN1c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)cc1C 1555894980 AHTFVBQYPZJVKX-OAQYLSRUSA-N 436.629 4.403 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@](C)(CO)Cc3ccc(Cl)cc3)ccc21 1587649565 KGEXLFCSXQULSL-XMMPIXPASA-N 428.960 4.281 10 10 IICE CCCCn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@]1(OC(C)C)CCOC1 1614529350 ALCGKGBNRCEOEJ-VWLOTQADSA-N 441.620 4.355 10 10 IICE COC(=O)[C@@H](NC(=O)CN(Cc1ccc(C(C)C)cc1)c1ccc(OC)cc1)C(C)C 1616230762 LGUBTUODRDVYHY-DEOSSOPVSA-N 426.557 4.139 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Oc2cccc(F)c2)cn1 1618648166 NEYUYATUOQHAMM-UHFFFAOYSA-N 439.462 4.043 10 10 IICE CCN1CCN(Cc2ccccc2CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 1624454017 JVFANHHNMRBFCK-UHFFFAOYSA-N 448.586 4.301 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C[C@@H]1CCCO1)C(F)(F)F 1626510937 CVNDVUVSMCEUQE-ROUUACIJSA-N 444.494 4.123 10 10 IICE Cc1cc(C(=O)NCc2ncc(C(C)(C)C)o2)c(C)n1-c1ccc(Br)cn1 1629592065 PSZDDWRTXCIDDQ-UHFFFAOYSA-N 431.334 4.467 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 1631533742 DOUMPWUPSCPUDY-QGZVFWFLSA-N 433.785 4.277 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@]2(O)CCCC(C)(C)CC2)C1 1632013569 TWEYKSOSLAGUAI-SANMLTNESA-N 425.617 4.245 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](C3CCN(C)CC3)C2)c(C)n1-c1ccc(Br)cn1 1633430172 ROVBJAJYBTUISM-GOSISDBHSA-N 445.405 4.056 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cc(Cl)c(C)c(Cl)c3)CC2)cc1 1641947164 XHEBABJBYCVMDX-BQYQJAHWSA-N 448.350 4.154 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1642611268 KNVXXBZWIKEEIL-JXALWOEJSA-N 439.575 4.283 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H]3CCCCC[C@@H]3c3ccc(Cl)cc3)nc12 1653588182 HIBPNBXHDPYUOI-UYAOXDASSA-N 442.947 4.471 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N[C@@H]2CC(C)(C)Oc3ccc(F)cc32)N(C)C)cc1 1674160885 JWYGDMUDMREWSL-NHCUHLMSSA-N 428.552 4.096 10 10 IICE O=C(NCc1cccc(-c2nc(CC(F)(F)F)no2)c1)NCc1cc(Cl)ccc1O 1683035908 WRUKVMOUYMQPBJ-UHFFFAOYSA-N 440.809 4.200 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@@H]1CNC(=O)OC(C)(C)C 1686826511 JZGXWIVDUSRYAQ-GHTZIAJQSA-N 432.609 4.081 10 10 IICE CC[C@H](C)c1nnc(N2CCC(N3CCCCC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1708461869 IAZTXLFNQJFONK-IBGZPJMESA-N 442.627 4.500 10 10 IICE Cc1nnc(N(Cc2ccccc2)C[C@H]2CCCO2)n1CCCSc1nccs1 1726365844 YJSWKSVYWMQVQY-LJQANCHMSA-N 429.615 4.411 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@H]1CCC[C@@H](O)C1 1726984366 HUNVUVWCVXFHSY-TUNNFDKTSA-N 441.620 4.068 10 10 IICE CC(C)Cc1nnc(N(C)[C@@H](C)c2ccco2)n1Cc1ccc(N2CCOCC2)c(F)c1 1741430852 FRFPOKWXBLEMBF-SFHVURJKSA-N 441.551 4.291 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN(C)CC(F)(F)F)o1 1742181901 SYBNVIVOWXXHNQ-UHFFFAOYSA-N 437.466 4.073 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCC(Cl)=C(Cl)C1 1751432888 PFIOBTLNKZKVDU-LJQANCHMSA-N 436.387 4.452 10 10 IICE Cc1ccccc1-c1nnc(N(C)Cc2cnccn2)n1CCCSc1nccs1 1762048078 SGAAMXJJONSPRH-UHFFFAOYSA-N 437.598 4.319 10 10 IICE CCO[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H](SC)C(C)(C)C)CCOC1 1767394839 XBKWPSKKVAEBKX-CVDCTZTESA-N 448.633 4.050 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCC(C)C)sc(C)c1-c1ccc(OCC)cc1 1860762307 BIHCXCWVIOSNLK-UHFFFAOYSA-N 432.542 4.010 10 10 IICE CCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1-c1cc(C)ccc1OC 1862349648 QSSDAKQZWIQCBJ-UHFFFAOYSA-N 448.567 4.248 10 10 IICE Brc1cc(N2C[C@H]3C[C@@H](C2)N(Cc2ccccc2)C3)ccc1CNC1CC1 2187750497 MCLIKIQYRVKZTC-AVRDEDQJSA-N 426.402 4.412 10 10 IICE CCOc1cc(C=C2C(=N)N3N=C(SCc4ccccc4)SC3=NC2=O)ccc1O 2293993143 KWBHEQRVPLZDLG-UHFFFAOYSA-N 438.534 4.301 10 10 IICE O=C(CN1C(=O)C(=CC=Cc2ccccc2)SC1=S)Nc1ccc2oc(=O)ccc2c1 2296563751 MFYIMPWLTJAABX-UHFFFAOYSA-N 448.525 4.189 10 10 IICE O=C(O)[C@H](Cc1ccccc1)N1C(=O)C(=Cc2ccc(Cl)c([N+](=O)[O-])c2)SC1=S 2323866157 XBVMIXWHHXLJKN-HNNXBMFYSA-N 448.909 4.145 10 10 IICE CC[C@@H]1C[C@H](C(=O)NCc2ccc(C)c(Br)c2O)N(C(=O)OC(C)(C)C)C1 2380719410 CYGMNTQHDGKONJ-UKRRQHHQSA-N 441.366 4.115 10 10 IICE Cc1ccc(N2C(=O)N=C(O)/C(=C/c3cc4c(cc3Br)OCO4)C2=O)c(C)c1 59860097 RQFUJFWPLKHCKC-MLPAPPSSSA-N 443.253 4.301 10 10 IICE COCCN(Cc1nc(O)c2c(-c3ccco3)csc2n1)c1ccc(OC)c(OC)c1 751483836 SSRICMFFDQGVQS-UHFFFAOYSA-N 441.509 4.327 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(C(=O)c3cc(C)n(-c4cccc(Br)c4)c3C)[C@@H]2C1 755202211 KDLZZTUHKTXBRI-NRSPTQNISA-N 447.373 4.265 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H](c2c(C)nn(C)c2C)C(F)(F)F)cc1 757884829 DDRRCIVTBHDVGK-LJQANCHMSA-N 425.499 4.328 10 10 IICE Cc1cc(Br)c(O)c(CN[C@H](CCO)c2ccccc2Br)c1 781640249 XSUFJXPYROKYIT-MRXNPFEDSA-N 429.152 4.439 10 10 IICE Cc1cc(Br)c(O)c(CN2CCN(C(=O)c3cc4occc4s3)CC2)c1 781906978 AXMPNWRYGHBXIK-UHFFFAOYSA-N 435.343 4.229 10 10 IICE CO[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCOC2)CC[C@H]1C 802761099 KDTYFKKMUQJEKV-MEKIYTOJSA-N 449.599 4.250 10 10 IICE CC(C)C(=O)Nc1ccc(Cl)c(C(=O)NCc2cc(Br)ccc2O)c1 804734608 SREQETKQPSBUEL-UHFFFAOYSA-N 425.710 4.333 10 10 IICE Cc1ccc(/C=C\C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c(Br)c1 917707515 KNKHVOHOWCZWTL-ALCCZGGFSA-N 433.321 4.063 10 10 IICE COCCCS(=O)(=O)c1ccc(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 1127794855 FKUILWDIAAANLQ-UHFFFAOYSA-N 426.538 4.157 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3cc(Br)ccc3Cl)CC2)cc1F 1150241390 ZIHOPAVGAQUAHU-UHFFFAOYSA-N 441.728 4.142 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)C[C@H]1CCCC(=O)N1 1182481672 KAKPREPRZZEFGD-VQIMIIECSA-N 433.474 4.357 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCC[C@H]3c3ccc(Cl)cc3)CC2)cc1 1194348963 TUABJLGMUGNHJH-NOZRDPDXSA-N 444.019 4.059 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC(=O)c4ccccc4O3)cc2Cl)C1 1235835845 WZHBLCISQYKUEZ-WMZOPIPTSA-N 441.959 4.410 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC[C@]3(C)Cc3ccc(F)c(F)c3)cc2)CC1 1246382786 QSVUVBCPAQGPQT-RUZDIDTESA-N 442.554 4.023 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCO[C@@H](c4c(F)cccc4Cl)C3)C2)cc1 1252116127 PGAWNJPIWOKENS-IIBYNOLFSA-N 447.938 4.097 10 10 IICE Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NCc1ccc(N(C)C3CCCCC3)cc1)C2=O 1292256294 DRPJOTCOSSJWIV-GOSISDBHSA-N 433.552 4.065 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@@H]3CC(=O)NC(=O)N3)cc2)c(C)n1-c1cccc(Cl)c1 1301334828 ZRIJGXSDUMZAGS-FQEVSTJZSA-N 436.899 4.270 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)N(C)C1CCC(C)CC1 1307272512 LAKKCCAHBIOCLH-UHFFFAOYSA-N 429.586 4.470 10 10 IICE COc1cccc([C@H]2C[C@@H](C)CN2C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1312833151 FVOITCZUQASGTN-OPAMFIHVSA-N 445.510 4.103 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CCSCC(C)C)CC2)cc1F 1315513546 WPAAJYCOKRMZNM-UHFFFAOYSA-N 449.640 4.340 10 10 IICE CC[C@@H](C)NC(=O)c1ccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1355179946 ZMMAHVILYONJBC-GOSISDBHSA-N 447.579 4.373 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc(F)cc(Br)c3F)CC2)cc1 1358165261 KCRNOCIOXBUAMD-UHFFFAOYSA-N 425.273 4.135 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](C(F)F)CC2)c(C)n1-c1ccc(Br)cc1 1454619286 XEWMYFDHTYSXQR-QGZVFWFLSA-N 427.289 4.353 10 10 IICE COc1cc(N2CCN(Cc3ccc(C)cc3Br)CC2)cc(OC)c1OC 1459923763 XRXLNJOXVWIFNB-UHFFFAOYSA-N 435.362 4.106 10 10 IICE O=C(CCCc1cccc(C(F)(F)F)c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1460742456 WSMRNAGKRBPIOO-UHFFFAOYSA-N 442.428 4.459 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccc(F)cc2Cl)NC(=O)OC(C)(C)C)cc1 1465325356 PQHFAQGBYFWAAA-HXUWFJFHSA-N 449.954 4.470 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1(c2cccc(OC(F)(F)F)c2)CC1 1465395207 RNGLHLIIOZRMOF-UHFFFAOYSA-N 448.485 4.142 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ncc(Cc2ccccc2)o1 1465951932 SAHAYGWGJXXUFH-IBGZPJMESA-N 425.916 4.019 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)OC(C)(C)C)C2 1470556538 XEOJDQNUNXYUOK-RQIDZSJNSA-N 444.620 4.079 10 10 IICE Cc1ccc(C(=O)NCCc2ccc3c(c2)OCCCO3)cc1-n1c(C)cc(C=O)c1C 1471917393 ZECYIIFMDCTEDK-UHFFFAOYSA-N 432.520 4.349 10 10 IICE CC[C@H](C)c1nnc(N2CCC(Cn3cccn3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1495436317 MIFDYTHYPNXIBJ-SFHVURJKSA-N 439.583 4.158 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H]3CCC[C@@H]32)n1Cc1ccc(N(CC)CC)cc1 1496787477 HMRSQNUQJYQLKT-KNQAVFIVSA-N 438.620 4.080 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N2CC[C@H](CCOC)C2)cc1 1501840441 GSZGDGKUPLLBEF-GGAORHGYSA-N 441.620 4.277 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)[C@H]1C 1504891939 KPVXTDYVXIBIKG-MJGOQNOKSA-N 425.602 4.329 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCS[C@@H](C)[C@H]1C 1510684020 WGPYYSRARMUJGN-MOPGFXCFSA-N 436.629 4.017 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@]1(O)CCCC1(C)C 1517146012 DFFYTHHXJCZRKN-HSZRJFAPSA-N 426.586 4.214 10 10 IICE CC(C)CNC(=O)c1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1525974467 AKSMVUPRGNPQPP-UHFFFAOYSA-N 446.595 4.432 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@@]3(C)CCNC(=O)C3)n2)c(C)n1-c1ccc(F)cc1 1532706639 LEAFMXVZVYNUFK-QFIPXVFZSA-N 426.517 4.212 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cnn(-c4ccc(Cl)cc4Cl)c3)C2)cc1 1538747394 RFSPQTJBRYMCSE-INIZCTEOSA-N 431.323 4.196 10 10 IICE C[C@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)[C@H]1CCCO1 1538920459 TWFAVMJSGSCPST-CZUORRHYSA-N 429.318 4.303 10 10 IICE C[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)[C@H]1C 1544410405 HZRNANUHOYARKI-ROUUACIJSA-N 429.584 4.125 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N[C@@H](c1ccccc1)c1ccc(Br)cc1F 1544812683 VWMZCWXZYUKBNA-NRFANRHFSA-N 430.273 4.448 10 10 IICE CC(=O)c1ccc(C(F)(F)F)nc1NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1559142210 YKCBWLQCBJWVHG-UHFFFAOYSA-N 432.490 4.447 10 10 IICE COc1ccc(-n2cnnc2SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)cc1 1559351687 JRQUIIVVIZVQDI-UHFFFAOYSA-N 437.500 4.193 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCCc3c[nH]c4cc(F)c(Cl)cc34)C2)cc1 1565055638 HTDOSYWOPJETDA-HNNXBMFYSA-N 430.911 4.090 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NCc1cc(Cl)ccc1O 1583818351 ZXDBPHSXJDRSJE-UHFFFAOYSA-N 448.903 4.224 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCC[C@@H]1C[C@H]2C=C[C@H]1C2 1586171530 SYNROQSUJKADML-GUUVJTBBSA-N 432.636 4.448 10 10 IICE C[C@@]1(CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1(Cl)Cl 1587670836 AWVSQSFSBDDBEF-LJEUOOAZSA-N 449.450 4.430 10 10 IICE CO[C@@H](C(=O)NCc1ccc(N2CCSCC2)cc1)c1ccc(Br)s1 1596368468 JTJHPNZWFUBGRM-QGZVFWFLSA-N 441.416 4.068 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C)Cc1ccccc1OC 1623577258 WAOXCPFYDLYEEY-LJQANCHMSA-N 438.499 4.004 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Cl)cc2O)NC(=O)OC(C)(C)C)cc1 1634162020 GWYOWUNVOUUHGB-GOSISDBHSA-N 433.936 4.107 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccnc2[nH]c(CC3CC3)nc12 1635676968 SHZZIUCNXAUWIK-UHFFFAOYSA-N 429.318 4.041 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1642997861 QATJFTXCXSNPIN-UNMCSNQZSA-N 436.600 4.361 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC(Cc4c(F)cccc4F)CC3)C2)cc1 1683944428 DWHFABLTIHHBPV-GOSISDBHSA-N 429.511 4.216 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](CC(C)(C)C(N)=O)C3)cc2Cl)C1 1686268768 HEGFXPNSQULYAT-MJGOQNOKSA-N 449.039 4.400 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCS[C@H](C)[C@H]2C)cc1 1710028178 RPAPMTNYLUXFEF-DBXWQHBBSA-N 429.634 4.354 10 10 IICE COCCCN(C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1712376673 QQQGRZDUCKQUAE-UHFFFAOYSA-N 436.604 4.041 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](C[C@@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1723171232 CNTJPRCKAVXMOW-ICSRJNTNSA-N 429.584 4.298 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCC(F)(F)C2)cc1 1746090371 WGGJSKMNIYOQQD-UHFFFAOYSA-N 426.515 4.388 10 10 IICE CCOCc1nnc(N2CCC[C@@H](CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1766354980 SXTXYJKQIWHUSI-LJQANCHMSA-N 429.634 4.043 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2C[C@H](C)S[C@@H](C)C2)cc1 1766614402 LUQOXLWNWADWMP-IRFCIJBXSA-N 443.661 4.397 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)C3CCN(Cc4cccc(F)c4)CC3)cccc21 1861858429 RSWBSZGPWJPQPX-UHFFFAOYSA-N 442.490 4.452 10 10 IICE CCCn1nc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1CCc1ccccc1 1862310757 IAVQCMMLIHBXCT-UHFFFAOYSA-N 432.568 4.049 10 10 IICE CCN1C(=O)C(Nc2ccc3c(c2)OCO3)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422507 AYBLWFZZTQLOHC-UHFFFAOYSA-N 429.476 4.035 10 10 IICE C[C@H](C(=O)N1CCCC[C@H]1c1cccnc1)N1C(=O)C(=Cc2ccco2)SC1=S 2296303803 JOYYRXNCKHUNDT-PBHICJAKSA-N 427.551 4.018 10 10 IICE Cc1ccccc1C=C1SC(=S)N([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O 2314837110 OIWLZAGZEMUTRM-ZDUSSCGKSA-N 427.507 4.132 10 10 IICE COc1ccc(C=C2SC(=S)N(C[C@H](c3ccc(OC)cc3)N(C)C)C2=O)cc1 2323879832 JSYPOLDYKXQNNW-LJQANCHMSA-N 428.579 4.208 10 10 IICE Cc1ccc(CNC(=O)[C@](C)(CC(C)C)NC(=O)OC(C)(C)C)c(O)c1Br 2381136711 IRIXBLOYOOZFQP-FQEVSTJZSA-N 443.382 4.409 10 10 IICE CC(C)CCN(C)c1ccc(/C=C2\C(=O)NN(c3ccc(Br)cc3)C2=O)cc1 33397270 SWTCYYAFSFPXLQ-XSFVSMFZSA-N 442.357 4.393 10 10 IICE CCCN(CCC)c1nc2ccc(C)cn2c(=O)c1/C=C1/SC(=S)N(C(C)C)C1=O 33541063 DWFMNVOPWBFCIY-SFQUDFHCSA-N 444.626 4.239 10 10 IICE CCOc1cc(/C=C2/SC(=S)N([C@H](CC(=O)O)c3ccccc3)C2=O)ccc1O 35624425 FUYUHFVXJGBQGB-CLXYIWAZSA-N 429.519 4.208 10 10 IICE O=C(CCc1ccc2nc(-c3ccccc3)[nH]c2c1)NCc1ccc(N2CCOCC2)cc1 96363676 JJLWSSKHBOQZIM-UHFFFAOYSA-N 440.547 4.316 10 10 IICE COCc1nc2cc(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)ccc2o1 444275264 BTGMKLVWEAACQA-UHFFFAOYSA-N 432.524 4.334 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNCc1cc(Cl)cc(Br)c1O 723835779 DFASBHUPOPSYJJ-WCQYABFASA-N 433.774 4.401 10 10 IICE Cc1cc(C(=O)CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)c(C)n1-c1ccc(F)cc1 728914244 CXLCBSYRBQLWSX-SFHVURJKSA-N 439.575 4.386 10 10 IICE COc1ccc(NC(=O)CSc2ccccc2C(=O)N2CCSC[C@H]2C)cc1OC 737711178 PSNBMIDVYYHQPR-OAHLLOKOSA-N 446.594 4.012 10 10 IICE COCCc1nnc(-c2cccc(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)c2)o1 778555814 ARELDHDARVAVRX-UHFFFAOYSA-N 444.535 4.306 10 10 IICE COc1cccc([C@@H]2[C@@H](N[C@@H](C)c3ccc(N4CCOCC4)c(F)c3)CCN2C2CC2)c1 779176991 BLJGBVBQVBZQGP-ZNCVFPSASA-N 439.575 4.300 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)c1 781893991 BGJYTPUMSYYUFW-UHFFFAOYSA-N 447.329 4.043 10 10 IICE COCCn1c([C@@H]2Cc3ccccc3O2)nnc1N(C)Cc1ccc(N2CCCCC2)cc1 802396268 QFUOOXSZVMYGDK-DEOSSOPVSA-N 447.583 4.227 10 10 IICE C[C@H](NC(=O)NCc1cc(Br)ccc1O)c1nc2ccccc2n1C(F)F 804883900 LHMGWZPOIGWKMD-JTQLQIEISA-N 439.260 4.460 10 10 IICE CCOC(=O)c1ccc(N(CC2CC2)C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 1125412484 IYGFRBYVHHMYKC-LJQANCHMSA-N 428.529 4.220 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H]3CCCCCC[C@H]3NC(=O)OC(C)(C)C)CC2)cc1 1127275741 NMMIJXSJXPLKDO-FCHUYYIVSA-N 445.604 4.208 10 10 IICE Cc1onc(-c2cccc(Cl)c2)c1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129660805 XLQUQOAGHCMQDE-UHFFFAOYSA-N 447.869 4.348 10 10 IICE CC(C)[C@@H](CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1136187906 QGRMRJWGQWONPT-LJQANCHMSA-N 444.578 4.424 10 10 IICE CN(C)CC1CCN(c2ccc(NC(=O)c3cc4cc(O)c(O)cc4s3)cc2)CC1 1136868059 QSEHTCDWCPEFAA-UHFFFAOYSA-N 425.554 4.343 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NC[C@](O)(c1ccccc1)C(F)(F)F 1136985904 ANHDYUMHOUZLQF-QFIPXVFZSA-N 430.426 4.087 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cccc(C)c1F 1175569937 SBIYOTSUPBQRMP-ROUUACIJSA-N 431.527 4.030 10 10 IICE COC(=O)C[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@H]1C 1178063155 NBMABFXUPDJVPU-CZUORRHYSA-N 433.346 4.128 10 10 IICE NC(=O)C1CCN(c2cccc(Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)c2)CC1 1185451416 RRSSMSNAUFSXQI-UHFFFAOYSA-N 444.491 4.271 10 10 IICE COc1ccc([C@H](NC(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c2ccco2)cc1 1251937176 UQQLQSVJVNBYGR-QPPBQGQZSA-N 436.508 4.474 10 10 IICE Cc1cc(C)cc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1280360056 UXUYCMLTOGQQFV-UNOMPAQXSA-N 428.554 4.350 10 10 IICE CC(C)CSCCn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1287861154 ZDDRITZUYXZRQN-UHFFFAOYSA-N 431.650 4.264 10 10 IICE Nc1c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccc(Cl)c1Cl 1291639835 UMYTZTXJGVESCX-UHFFFAOYSA-N 448.272 4.361 10 10 IICE COc1ccccc1-c1nnc(N2CCC(F)(F)C2)n1CCCSc1nccs1 1300490271 BOEKIZGXRDVZIK-UHFFFAOYSA-N 437.541 4.438 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@@H]3CCN(c4ccccc4Cl)C3)CC2)cc1 1312993118 SMDQMCLQADVBJA-IBGZPJMESA-N 442.991 4.097 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc(Cl)c(F)cc1Br 1354658136 NYLDZUJMWKRXJV-UHFFFAOYSA-N 445.691 4.147 10 10 IICE COc1c(C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)cnn1C 1355166906 JMALCUDFOYIQKR-UHFFFAOYSA-N 425.489 4.351 10 10 IICE Cc1cccc(Oc2ccccc2C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 1358168037 LJZIEMBZNVRVOT-OAQYLSRUSA-N 443.547 4.419 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCCCCC[C@@H]1NC(=O)OC(C)(C)C 1360847929 CMVFTSVHKCCMCB-OALUTQOASA-N 431.577 4.342 10 10 IICE CC(C)(C)OC(=O)/C=C\c1cc(C(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)co1 1446571572 YMPGUBGYYXWXNX-PISNEZEASA-N 427.497 4.162 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@@H](C)c3cccc4ccccc34)CC2)c(OC)c1 1460653443 XQSBNCBPOVBTSZ-VQTJNVASSA-N 447.579 4.245 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H]4CC[C@]43CNC(=O)OC(C)(C)C)cc2)CC1 1460905320 INZVTHWFDJGMJJ-CPJSRVTESA-N 429.605 4.181 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1cccnc1 1460931473 BJYVBEGXVKOFHX-SFQUDFHCSA-N 445.635 4.219 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1466290173 SAUBAJLIGKACOI-YSIASYRMSA-N 434.577 4.229 10 10 IICE Cc1cc(C(=O)NN2CCc3ccccc3C2=O)c(C)n1-c1cccc(Br)c1 1466335209 ULPDOYVLXRMMDJ-UHFFFAOYSA-N 438.325 4.200 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(C(=O)N3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1467945318 MEHAENMEUCVVFC-LJQANCHMSA-N 428.964 4.158 10 10 IICE CN1CCN(c2ccc(CNC(=O)N(Cc3ccccc3Cl)CC3CC3)cc2)CC1 1471190179 FRESYCLCVQDEKF-UHFFFAOYSA-N 426.992 4.214 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C2CCC2)cc1 1473789709 QAWWHOQADYVXSA-WOJBJXKFSA-N 439.575 4.423 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C1 1478841265 SDJQHIWXJJLMPD-DENIHFKCSA-N 446.636 4.279 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](F)C1 1494773812 SRWGUOQISMPOOO-FBJLLXQBSA-N 425.552 4.308 10 10 IICE CC[C@@H](C)CN(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1496021346 ARGGEXPAECDPSM-CTNGQTDRSA-N 443.661 4.256 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ncc(Cl)n2C)n1CCCSc1nccs1 1509139418 HWMGPKHKHAOLKJ-UHFFFAOYSA-N 440.042 4.139 10 10 IICE CC[C@H](C)c1nnc(N2CCN(CC(F)(F)F)CC2)n1CCCSc1nccs1 1513041667 QXWQECDLKXEJIQ-AWEZNQCLSA-N 448.584 4.115 10 10 IICE CCC1CCC(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)(C(=O)OC)CC1 1515973430 TUFNJUXBFQJEMV-UHFFFAOYSA-N 426.557 4.157 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2sc(-c3ccc(OC)cc3F)nc2C)cc1 1538160081 JGWYBEXXBNKASB-UHFFFAOYSA-N 443.544 4.483 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)c1C 1540510914 OSDHURPXGVGSHX-UHFFFAOYSA-N 444.623 4.340 10 10 IICE Cc1cc(C(=O)NC[C@H]2COc3ccccc3O2)c(C)n1-c1cccc(Br)c1 1540683979 JEAQHRZXWLMALW-SFHVURJKSA-N 441.325 4.426 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c1 1542432081 RFZNNVHUWJFOIC-UHFFFAOYSA-N 447.560 4.348 10 10 IICE Cc1nnc(N(C)Cc2ccccc2O)n1CCC[C@H]1CCCN1C(=O)OC(C)(C)C 1543151238 ZZMWBKPZUGBRKA-IBGZPJMESA-N 429.565 4.108 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)CC(C)C 1543951294 HXDUJIBCPVROBR-MRXNPFEDSA-N 435.362 4.422 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C4CCN(C)CC4)C3)cc2Cl)C1 1564649502 FHGKOOJAGICNIB-WIYYLYMNSA-N 433.040 4.450 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 1564944995 DBYXZJRMAQXYBC-DBXWQHBBSA-N 432.609 4.079 10 10 IICE CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1584007620 FYHSZLHQHZMZCN-AVRDEDQJSA-N 437.584 4.372 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(F)(F)c1ncccc1Br 1584095786 QLOMADYHVZAYCK-ZDUSSCGKSA-N 426.305 4.058 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(Cc4ccccc4Br)CC3)C2)cc1 1584444128 GQOZVYLGFCPQJU-KRWDZBQOSA-N 443.385 4.423 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)cc1 1595882730 FNLANDAVNUXPRR-UHFFFAOYSA-N 431.536 4.049 10 10 IICE CC[C@@H](C)NC(=O)c1cccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1596301323 MKVAAZKZRJAVCV-GOSISDBHSA-N 445.563 4.294 10 10 IICE CC(C)c1nsc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 1597145980 XJRVTHBOQNHCIJ-XFXZXTDPSA-N 438.625 4.343 10 10 IICE CC1CCC(N(C)c2nnc(C(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1612727304 UNEFIBOIUOTQBR-UHFFFAOYSA-N 429.584 4.440 10 10 IICE CCOC(=O)[C@]1(COC)CCCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1 1625851559 RWBGPQUYYKDMEB-HSZRJFAPSA-N 432.948 4.179 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCn1ccc2cc(Cl)ccc21 1632701810 OERLWBMHQFLYSN-UHFFFAOYSA-N 435.307 4.246 10 10 IICE CSc1ccc(C(=O)c2ccccc2C(=O)NCc2cc(C)ccc2O)cc1[N+](=O)[O-] 1640797077 XWKNDUJCROIPLC-UHFFFAOYSA-N 436.489 4.492 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(c3ccccc3)[C@H](C)c3ccccc3)CC2)cc1 1645224772 ZLOJOPTUTULPLG-KCWPFWIISA-N 445.607 4.446 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1 1647791592 QJGHVNSDKYXBGI-IBGZPJMESA-N 426.925 4.030 10 10 IICE COCCN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)[C@H](C)c1ccccc1 1652382824 HVICDNHFOBFNEH-GOSISDBHSA-N 442.515 4.110 10 10 IICE O=C(CN(c1ccsc1)C1CCCCC1)NCc1ccc(N2CCOCC2)c(F)c1 1653473470 FMCNWQHZOGTRKF-UHFFFAOYSA-N 431.577 4.179 10 10 IICE CC/C=C/Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1709399083 DEWXTCBAZWADHY-SNAWJCMRSA-N 437.613 4.370 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CC=C(COC)CC2)cc1 1710025907 QZIXEQKYROPIMV-UHFFFAOYSA-N 446.599 4.326 10 10 IICE CCCN1CCCC[C@@H]1Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1728141617 FVSXXPSSBYZAFT-IRLDBZIGSA-N 427.593 4.126 10 10 IICE Cc1cccc(N(C)c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)c1 1742142230 VRVVHAJJHGIAFA-UHFFFAOYSA-N 442.614 4.229 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCOC2)n1Cc1cscc1C(F)(F)F 1747750111 LMZNXJISKMEDEX-AWEZNQCLSA-N 438.475 4.253 10 10 IICE CC[C@H]1CCN(c2nnc([C@H]3OCC[C@H]3COC)n2Cc2ccc(N(CC)CC)cc2)C1 1765204523 JMGOYNVUDWDVJT-RRPUWOKSSA-N 441.620 4.133 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCOCCC(C)C)CC2)cc1 1770258002 KJCGCDPRRRNZTK-UHFFFAOYSA-N 429.609 4.190 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3ccc(OC)c([N+](=O)[O-])c3)C2=O)ccc1O 1860084059 BQJDBHQCJKWUNU-RQZCQDPDSA-N 432.479 4.114 10 10 IICE Cc1cc(C)c2c(C)c(C(=O)N[C@@H](c3ccc(N(C)C)cc3)c3nccn3C)c(=O)oc2c1 1866294371 CZWPILFHIYCJOJ-QHCPKHFHSA-N 444.535 4.037 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1cccc(O)c1O 1952822968 FXBSRZPUOXDWSG-NFBKMPQASA-N 445.471 4.495 10 10 IICE CN(Cc1ccccc1)[C@@]1(CNCc2cc(Cl)cc(Br)c2O)CCOC1 2098953993 LBJLNEZORZGOKJ-HXUWFJFHSA-N 439.781 4.189 10 10 IICE COc1ccc(Br)c(CNCCCC(C)(C)NC(=O)OC(C)(C)C)c1O 2227753029 ZHJKJFXDNNDXTI-UHFFFAOYSA-N 431.371 4.336 10 10 IICE COc1cc(N/C(C)=C2/C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C)c(OC)cc1Cl 17097208 IDOVZWUOENJPTB-YBFXNURJSA-N 430.848 4.374 10 10 IICE CCOc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCCOc1ccccc1 20236380 GYIKMVOXMXXNQT-UTXXGPSKSA-N 447.491 4.384 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1cccc(Br)c1 35640521 AIEOBIGUSZIBSN-UVTDQMKNSA-N 437.340 4.272 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(Oc4ccccc4)cc3)CC2)cc1 38588455 JKRCPZPKGBWESK-UHFFFAOYSA-N 431.536 4.040 10 10 IICE O=C1/C(=C/c2cc(Br)ccc2O)SC(=S)N1c1ccc([N+](=O)[O-])cc1 59397798 AXYOCGMTLHWKBT-ZSOIEALJSA-N 437.296 4.469 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@H](C)c3cccc(NS(C)(=O)=O)c3)c2C)c1 108457308 NQLCARGUYVYFBR-QGZVFWFLSA-N 425.554 4.265 10 10 IICE Cc1noc(C)c1COc1cccc(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1 109179308 GQIDGJRUYDRLCS-QGZVFWFLSA-N 435.524 4.198 10 10 IICE CO[C@H](C)C(=O)Nc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 435537492 XHMPQYUMNXJRPM-GOSISDBHSA-N 448.567 4.020 10 10 IICE COc1cccc(N2CC[C@H](CNC(=O)N(Cc3ccco3)Cc3ccccc3O)C2)c1 726716600 NGQCTQPGHFOLFY-LJQANCHMSA-N 435.524 4.232 10 10 IICE CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cccc(N3CCCCCC3)c2)c1 747765977 LXEZVOPERQYDML-UHFFFAOYSA-N 435.977 4.223 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2ccccc2F)cs1 761340836 CKGLMEDMXIWVFR-UHFFFAOYSA-N 447.513 4.107 10 10 IICE CC(C)(C)OC(=O)N1CCc2cc(C(=O)NCc3cccc(Br)c3O)ccc21 765727893 QKWBDBSRSAWFON-UHFFFAOYSA-N 447.329 4.382 10 10 IICE Cc1ccc(C[C@@H](C)N(C)C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 769897845 SCKDRSPZMWSCAH-MRXNPFEDSA-N 444.578 4.266 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@@H](c2cnn(C)c2)C(F)(F)F)cc1 772789345 BTYTZVFTFIWNGF-IBGZPJMESA-N 435.450 4.095 10 10 IICE CCN1CC[C@H](NC(=O)N[C@H](C)c2cc(OC)ccc2O)[C@H]1c1cc(F)c(F)c(F)c1 782536454 PTAOQISLQYCXRD-CECALHEMSA-N 437.462 4.014 10 10 IICE C[C@@H](NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cc(Br)ccc1O 797101477 FEOVKYDIJMBKIY-LLVKDONJSA-N 426.742 4.092 10 10 IICE Cc1ccccc1[C@H](O)C1CCN(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CC1 804989067 LKFKYRGRALSQET-CJFMBICVSA-N 437.584 4.048 10 10 IICE CC(C)OCc1cc(NS(=O)(=O)c2ccccc2C(=O)c2ccccc2)ccc1O 811704517 HXRQGXZPOHLTEK-UHFFFAOYSA-N 425.506 4.349 10 10 IICE CC(C)N(C)Cc1cc(O[C@H]2CCN(Cc3ccc(Br)cc3O)C2)ccn1 856559014 OAQNWQXGENFFTA-FQEVSTJZSA-N 434.378 4.043 10 10 IICE O=C(NCc1ccc(N2CCCC2)cc1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 915721012 QRLKNNLFOQYKJC-UHFFFAOYSA-N 447.505 4.169 10 10 IICE Cc1cc(C(=O)NCCCN2CCCCCC2=O)c(C)n1-c1ccccc1Br 1135708174 QVHGVDPMGVKCPE-UHFFFAOYSA-N 446.389 4.379 10 10 IICE COc1cc(OC)cc(OCCCNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1150501318 FSRMNSXHPHXJLU-UHFFFAOYSA-N 436.508 4.123 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)s1 1157071480 JYQBVKJLGLQBOL-UONOGXRCSA-N 443.548 4.040 10 10 IICE Nc1cn(Cc2ccc(C(=O)NCc3c(O)ccc4ccccc34)cc2)nc1C(F)(F)F 1179036463 FFJMJDWPEMGDBX-UHFFFAOYSA-N 440.425 4.321 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H](OCC)C2)sc(C)c1-c1ccccc1 1191157307 WOBHXCJWJOJUNX-GOSISDBHSA-N 430.570 4.340 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)CCCCCCNC(=O)OC(C)(C)C)C2)cc1 1230859186 TTZVYTCFGYUGKS-IBGZPJMESA-N 448.608 4.000 10 10 IICE C[C@H](NC(=O)NCc1ccc(Br)c(Br)c1)c1ccccc1O 1251260214 ZDWFDVSSRZNBCN-JTQLQIEISA-N 428.124 4.478 10 10 IICE CC[C@H](C)c1ccccc1OCC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266259245 VVHZDJGGROHWGO-NRFANRHFSA-N 435.612 4.427 10 10 IICE CN(C)C(=O)N1CCN(C(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)C(C)(C)C1 1266695765 GVTBJEWWGXRRCU-UHFFFAOYSA-N 436.560 4.386 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)N(C)C)cc1 1289601769 DCOVOIGSGLZXMO-HBMCJLEFSA-N 430.390 4.038 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@](C)(O)c1ccc(F)c(Br)c1 1290373575 AWEGSEYHRYAYSQ-NRFANRHFSA-N 435.337 4.055 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2cccc(C(=O)N3CCC[C@H](O)C3)c2)c1 1295916674 ZSYDYPVTIYRFIH-QFIPXVFZSA-N 431.536 4.252 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC(OCc3ccc(Br)cc3)CC2)cc1 1305792511 LCFJPVPKFFRTSC-UHFFFAOYSA-N 445.317 4.433 10 10 IICE CSc1ccc([C@H](CNC(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)N(C)C)cc1 1312753594 OBIOXEALIBBONF-JPYJTQIMSA-N 428.646 4.316 10 10 IICE CN(C)c1ccc(Cn2c(-c3cnccn3)nnc2N2CC=C(C(C)(C)C)CC2)cc1F 1314661861 SULCFQIAQKWIMA-UHFFFAOYSA-N 435.551 4.171 10 10 IICE Cc1cc(S(=O)(=O)N(C)C)cc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1C 1351211213 USZZSWSHHRCRHC-UHFFFAOYSA-N 439.581 4.142 10 10 IICE Cc1cc(C(F)(F)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cnc1Cl 1355130405 LXVQNGHQUINXCW-OKILXGFUSA-N 441.881 4.204 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(Br)ccc1Br 1449114934 AOXWGSVOTKKDFV-UHFFFAOYSA-N 434.124 4.333 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NCc1ccc2cccnc2c1O 1451946593 DGMFZEOKKYDFQD-OAQYLSRUSA-N 433.508 4.091 10 10 IICE CC[C@H](Cc1cn(C)c2ccccc12)NC(=O)N1CCCN(c2ccc(OC)cc2)CC1 1479088037 SYASTXLOZGYHQA-OAQYLSRUSA-N 434.584 4.430 10 10 IICE CCOCc1nnc(N2CCc3cc(F)cc(C)c3C2)n1CCCSc1nccs1 1503070624 ZGMOYJOWEPNKCC-UHFFFAOYSA-N 447.605 4.464 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@](C)=O)CC1 1514566795 LAABZBGOAMYUNO-PMERELPUSA-N 425.602 4.110 10 10 IICE COc1ccc(N2CCC(NC(=O)c3coc(/C=C/C(=O)OC(C)(C)C)c3)CC2)cc1 1520520421 UHQXAOSUCGSTGS-MDZDMXLPSA-N 426.513 4.042 10 10 IICE COCc1ccc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1523384370 ZTOHSERZGOWRAX-XDHOZWIPSA-N 445.537 4.307 10 10 IICE Cc1cc(CCNC(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1543592927 BGWLQVDERLSSQV-UNMCSNQZSA-N 443.563 4.348 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 1544093263 AOOZHEDRWMAHCS-UHFFFAOYSA-N 431.536 4.323 10 10 IICE CCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@](=O)CC 1547533484 NUNXZNDUAVLRLF-WJOKGBTCSA-N 439.629 4.358 10 10 IICE C[C@@H]1CN(C2=NC(=O)/C(=C\c3cn(-c4ccccc4)nc3-c3ccncc3)S2)C[C@@H](C)O1 1554245691 ZMSDAPPANQSZRZ-XXXRSFMGSA-N 445.548 4.014 10 10 IICE CCSc1nc(C)c([C@H](CC)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)s1 1557824510 SPZIRAIEOXBCMS-KRWDZBQOSA-N 449.642 4.423 10 10 IICE COC(=O)[C@@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)c1ccc(OC)c(Cl)c1 1585300933 GXSJELHAWXXOBE-NRFANRHFSA-N 426.900 4.400 10 10 IICE Cc1cc(C(=O)NCCc2ccccc2S(C)(=O)=O)c(C)n1-c1cccc(Cl)c1 1595157585 RHPBDAZDPLGNQA-UHFFFAOYSA-N 430.957 4.124 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)N1CCN(C(=O)Cc2ccccc2Cl)CC1 1597743754 JLFCOADBJNPZAR-UHFFFAOYSA-N 441.984 4.336 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1598121718 WLDQBBJXRDCRRN-ZWKOTPCHSA-N 429.521 4.243 10 10 IICE CC(C)[C@@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)N1CCCC1 1598296397 PEFPDFDPOZFUGL-OAQYLSRUSA-N 439.629 4.393 10 10 IICE Cc1ccc(C(=O)NC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)cc1-n1c(C)cc(C=O)c1C 1616470643 HECNHPHMBCVYIN-SIKLNZKXSA-N 436.474 4.428 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H]2CCCCN2C(=O)OC(C)(C)C)c1 1626043604 DILNYYXEJCMVSZ-JOCHJYFZSA-N 439.556 4.426 10 10 IICE CN(c1ccc(CNC(=O)c2cccc(S(=O)(=O)C(F)F)c2)cc1)C1CCCCC1 1631386494 ORQDJGYVLQYBDI-UHFFFAOYSA-N 436.524 4.382 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Oc2cccc(Br)c2)ccn1 1632681983 YWHCLHHPJWUIHS-CYBMUJFWSA-N 443.297 4.409 10 10 IICE C[C@@H]1CCN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC12CCC2 1637328088 KSIHVIYOVSBLKZ-COYFKBPASA-N 432.586 4.456 10 10 IICE COCC[C@@H](Cc1cccc(Br)c1)C(=O)NCc1cc(Cl)ccc1O 1639964998 AMHHFFZVZCJFFG-AWEZNQCLSA-N 426.738 4.320 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CC3(CNC(=O)OC(C)(C)C)CCCCC3)C2)cc1 1641228240 PUEIHPMVBRVHEQ-IBGZPJMESA-N 445.604 4.255 10 10 IICE COC(=O)CN(CCCc1ccccc1Br)Cc1cc(Cl)ccc1O 1642071795 HPFYOZGXQHNLIL-UHFFFAOYSA-N 426.738 4.416 10 10 IICE CC(C)(C)OC(=O)Nc1cc(F)ccc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1642155489 UTBBSNIIMDASME-UHFFFAOYSA-N 443.519 4.064 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N[C@H](C)c2ccccc2O)sc2c1CC[C@H](C)C2 1655349815 UJTKOMOQWSCXNV-RRFJBIMHSA-N 430.570 4.433 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CC[C@@H](Sc4cccc(Cl)c4)C3)cc2)CC1 1675581002 YKYXNTGRPQSMHS-JOCHJYFZSA-N 445.032 4.168 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@H]1CC2(CCOCC2)Oc2ccccc21 1682101722 VCOIIHLVTZMIKR-CVDCTZTESA-N 437.584 4.364 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC3(C)CCC4(CC3)OCCO4)cc2Cl)C1 1686269160 LLNWHUALQFDZRL-QGZVFWFLSA-N 435.996 4.451 10 10 IICE CC(C)Cc1nnc(N2CCC(F)(F)CC2)n1Cc1ccc(N2CCSCC2)cc1 1692144261 RJERXWJPCQDJOI-UHFFFAOYSA-N 435.588 4.314 10 10 IICE C=C(Cl)Cn1c(Cn2nc(C)cc2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1705757948 DUJREDSELHTYDS-UHFFFAOYSA-N 439.995 4.129 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(=O)N(C)[C@@H](C)C1 1709570273 BPFHGNBDGAXYAH-IBGZPJMESA-N 434.588 4.210 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CCN(C(=O)OC(C)(C)C)C1CC1 1723144203 MBUGCANYDRCGDO-UHFFFAOYSA-N 429.565 4.143 10 10 IICE Cc1cc(-c2nnc(N3CCS[C@@H](C)C3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1751412295 PROLNSZSAUWOTR-KRWDZBQOSA-N 425.602 4.065 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CC2CC(C)(C)C2)CCOC1 1761278117 XFQNNLFEDFYPNZ-DEOSSOPVSA-N 428.577 4.097 10 10 IICE C[C@@H]1CCN(c2nnc(COc3ccccc3F)n2CCCSc2nccs2)C1 1763012807 ZFFHXYNQMAGXHT-OAHLLOKOSA-N 433.578 4.481 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCC[C@@H]1CC 1764083324 CVYXVNFRIWIEQG-ROUUACIJSA-N 427.593 4.365 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N([C@@H](C(=O)O)c4ccccc4)C3=O)n12 1858591235 FQVIZWQXRJIUGL-BWODNOAJSA-N 449.966 4.385 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)[C@H](C)C(=O)NC2CCCC2)sc2c1CC[C@@H](C)C2 1866236147 DFOXYRBDPSRGDV-QLFBSQMISA-N 434.602 4.319 10 10 IICE Cc1ccccc1Cn1cccc(C(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c1=O 1890682647 NXTJGIQZEISMPS-URXFXBBRSA-N 427.548 4.124 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(F)c(Br)cc3Cl)CC2)cc1 1891897599 JODXTQPEWGZOSW-UHFFFAOYSA-N 427.701 4.213 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCNCc1cc(Br)cc(F)c1O)C(F)(F)F 1913259755 DPPXMBXQVWIOOW-GFCCVEGCSA-N 445.251 4.229 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(NCc3cc(Cl)cc(Br)c3O)C[C@H]2C1 2077033884 FOBLQYOWPCCBOA-SGTLLEGYSA-N 431.758 4.297 10 10 IICE CCCCN1C(=O)C(=Cc2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 2296545985 DVXKSNGMCGXSIR-UHFFFAOYSA-N 430.599 4.072 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)cc(Cl)c1OC(=O)c1cccs1 2297347666 RKHYRZMQYWYPGP-UHFFFAOYSA-N 443.868 4.080 10 10 IICE O=C(NN1C(=O)C(=Cc2cccc(OCc3ccccc3)c2)SC1=S)c1cccnc1 2297456297 WDUVHTZGHXGWNJ-UHFFFAOYSA-N 447.541 4.207 10 10 IICE CN(C)c1ccc(C=C2S[C@]3(C(=O)Nc4ccccc43)N(c3ccc(O)cc3)C2=O)cc1 2297515788 JSOFTMXDNWGVIX-RUZDIDTESA-N 443.528 4.384 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2[C@@H](C)CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380747959 ZAJFUECQOTVGKR-BBRMVZONSA-N 441.366 4.115 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCC1 20681696 HCTRFWHLEDSEDK-PMAPCBKXSA-N 426.538 4.099 10 10 IICE O=C(COc1ccccc1/C=C1/SC(=S)NC1=O)Nc1ccccc1C(F)(F)F 210895246 RICPORNHGWYTAG-OQLLNIDSSA-N 438.452 4.212 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(O)c(OC)c1)N2 226676860 FRKPVXNEQIVIQP-TWFFJXMTSA-N 428.554 4.304 10 10 IICE COc1cc(Br)c(NC(=S)N(c2ccccc2)c2ccc(N)cc2)nn1 242956063 HHTGLLSTQMDCED-UHFFFAOYSA-N 430.331 4.365 10 10 IICE Oc1cc2c(cc1CNc1cc(Br)ccc1I)OCO2 380025874 IETMKVGDEHDSEC-UHFFFAOYSA-N 448.054 4.100 10 10 IICE COC(=O)c1cccc(N2C(=O)C(O)=C(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526470350 KDUOCCBXNZJHGU-QFIPXVFZSA-N 431.444 4.250 10 10 IICE COc1cccc2c1OCC[C@H]2NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 683441747 FVSCIDPQOQNJRH-OAQYLSRUSA-N 433.552 4.056 10 10 IICE CC(C)(C)OC(=O)NC1CCC(OCCNCc2ccc(Br)cc2O)CC1 691397500 ZERWSDJWBZGXCE-UHFFFAOYSA-N 443.382 4.097 10 10 IICE C[C@@]12CN(Cc3ccccc3)C[C@]1(C)CN(c1cc(Br)c(CN)cc1F)C2 705881853 OKOWHSWJOTYIFJ-SZPZYZBQSA-N 432.381 4.395 10 10 IICE CC[S@@](=O)CCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CC2 739581054 ZOMSEYJJUUKNKC-CSJUJRMBSA-N 447.604 4.286 10 10 IICE CC(C)CC[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 743774509 ADQSDCVKPIMJGZ-ZRNYNZGJSA-N 440.656 4.033 10 10 IICE O=C(CSc1ccc(C(F)(F)F)nn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 777561651 DHXRWUFQBQXTLX-UHFFFAOYSA-N 443.406 4.002 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 804734514 OYIXOCGBEGEHEY-KGLIPLIRSA-N 430.220 4.473 10 10 IICE O=C1/C(=C/c2ccc(F)c(-c3cccs3)c2)SC(=S)N1CCN1CCOCC1 917642810 RPKGWDDRPLMIFV-AQTBWJFISA-N 434.583 4.088 10 10 IICE C[C@H]1CN(c2ccc(CNS(=O)(=O)/C=C\c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 917918461 PFHANCNTECTUKM-YQYKAEFUSA-N 438.952 4.183 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc3ccc(Br)cc3c(=O)o2)cc1 1125167264 VINPRFXRULWZKE-UHFFFAOYSA-N 429.314 4.332 10 10 IICE COc1cc(CCc2cc(NC(=O)c3cc4cc(O)c(O)cc4s3)n[nH]2)cc(OC)c1 1147715405 BEYYNRFNJQMFHI-UHFFFAOYSA-N 439.493 4.090 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291492012 QBLSQGNXMDLEDH-ZCNNSNEGSA-N 425.621 4.283 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1 1299479815 ZTFNYESOVDMXAL-QFQXNSOFSA-N 443.591 4.150 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(CC2CCCC2)n1CC(F)(F)F 1314736539 HWAYLGHPWPSKLV-UHFFFAOYSA-N 437.510 4.046 10 10 IICE CN1CCCc2cc(Cn3c(Cc4ccsc4)nnc3N(C)CC(F)(F)F)ccc21 1314925278 VUSGYPLTBDSNML-UHFFFAOYSA-N 435.519 4.360 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cnnn3-c3cccc(F)c3)cc2Cl)C1 1436048833 SAJJQHUCGZICOQ-OAHLLOKOSA-N 427.911 4.226 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)Cc3ccc(Br)c(Cl)c3)C2)cc1 1436969301 DKFRQTYUDFTCPD-HNNXBMFYSA-N 437.765 4.296 10 10 IICE Cc1cc(C(=O)NCC[C@]2(O)C(=O)Nc3ccccc32)c(C)n1-c1cccc(C(C)C)c1 1455308504 HEWIWSZEELDCKM-AREMUKBSSA-N 431.536 4.177 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3cc(Br)ccc3Cl)C2)cc1 1461080765 ZEVQNAFMGWAOTA-CQSZACIVSA-N 437.765 4.296 10 10 IICE Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cc1-n1c(C)cc(C=O)c1C 1464036852 OORILBAVBZTQAE-SANMLTNESA-N 445.563 4.018 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)c1 1464184286 AMRLNVZXCJFDEV-UHFFFAOYSA-N 447.510 4.080 10 10 IICE Cc1cc(-c2nnc(N3CCC(C(N)=O)CC3)n2CCCC(C)C)c(C)n1-c1ccccc1 1510621144 HHJORJHRLUFPRX-UHFFFAOYSA-N 448.615 4.491 10 10 IICE CC(C)n1cc(Br)c(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1534009182 MFHKBEXMTXCVDL-UHFFFAOYSA-N 438.281 4.254 10 10 IICE CC(C)c1nnc(N2CCOC(C)(C)[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1541369292 GNONZTQCHGEBBP-GOSISDBHSA-N 429.634 4.007 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc4c(s3)CN(C(=O)OC(C)(C)C)CC4)ccc21 1544164676 NWPKUGXMZUEZCQ-UHFFFAOYSA-N 441.597 4.354 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1544529784 MHFZWMFWOKAVNO-LJQANCHMSA-N 429.542 4.204 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1545931856 ZBPIKTUWLZVUFL-UHFFFAOYSA-N 431.536 4.268 10 10 IICE CN(C)c1ccc([C@@H](CNc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])N(C)C)cc1 1559298581 ZTKXCJQOUYUBTF-OAHLLOKOSA-N 447.408 4.425 10 10 IICE COc1cc(Br)cc(CNC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c1 1565323834 CYQXTJFGECLICS-UHFFFAOYSA-N 432.362 4.400 10 10 IICE O=C(NCc1cccc(Br)c1O)c1cc2c(F)cc(Br)cc2[nH]1 1568605765 TXHYTHBDWFFYBR-UHFFFAOYSA-N 442.082 4.468 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(c2)CC(=O)N3C)c(C)n1-c1ccc(Br)cn1 1568621484 UPNGOSQYDXOTIC-UHFFFAOYSA-N 439.313 4.023 10 10 IICE COc1ccc(C)cc1C1(CNC(=O)c2cc3cc(O)c(O)cc3s2)CCOCC1 1583359774 VHUIATKGGQWLIP-UHFFFAOYSA-N 427.522 4.108 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCCC[C@H]1CC1CCC1 1585376069 IEQVWMYBEDIIKC-KRWDZBQOSA-N 434.583 4.439 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2CCN(CCc3ccccc3)CC2)cc1 1595423757 VBCHDNGNBFJTQT-UHFFFAOYSA-N 443.591 4.272 10 10 IICE CCCCN1C(=O)CC[C@@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(OC)cc1 1606860830 VSJQKGQDERAASK-KNQAVFIVSA-N 444.959 4.450 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C[C@H](C)O1 1614218463 LLLOQXYRVHGWTP-JKSUJKDBSA-N 433.603 4.489 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@H](CS(C)(=O)=O)c3ccccc3)cc2Cl)C1 1617899465 AAJJGWMUZNZYRP-YLJYHZDGSA-N 449.016 4.021 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@](C)(O)c1cccs1 1617939890 BCJPPAQPWFFCDC-QFIPXVFZSA-N 440.594 4.242 10 10 IICE COCC1(C)CCN(c2nnc(-c3ccc(C)o3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1619631874 VDLVADLMVCIPNJ-UHFFFAOYSA-N 441.551 4.353 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3(C(=O)OC(C)(C)C)CCCCC3)cc2F)C[C@@H](C)O1 1625090665 XEPCEIJKIRZVTQ-QZTJIDSGSA-N 448.579 4.348 10 10 IICE Cc1nc2ccc(O)cc2cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1626479189 DYXYHAAFMJDAMY-UHFFFAOYSA-N 427.451 4.249 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3csc(NC4(C)CCCC4)n3)CC2)cc1 1630992442 PXNDNXMQXIHHCV-UHFFFAOYSA-N 428.602 4.178 10 10 IICE Cc1cc(CC(=O)N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1631845511 RKBFMCXUWJMDRB-QFIPXVFZSA-N 434.515 4.198 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccccc3C(=O)c3ccc(F)cc3)CC2)cc1 1632154069 LZQHDGCOTBSBDH-UHFFFAOYSA-N 432.495 4.418 10 10 IICE Cc1ccc(N2C(=O)CC[C@H](C(=O)NCc3cccc(O)c3O)[C@@H]2c2cccs2)cc1 1633507383 HGAWLHSIBCPUFF-PGRDOPGGSA-N 436.533 4.268 10 10 IICE CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)C2(CCCCC2)C1 1633577339 KTCCAGJQVTTYEO-UHFFFAOYSA-N 429.521 4.245 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2c(F)cccc2Cl)CCCC1 1635719659 AOTULPIZYSODHW-OAQYLSRUSA-N 430.907 4.171 10 10 IICE C[C@@]1(Cc2cccs2)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635996507 CNXVQZJPCSWFTG-QFIPXVFZSA-N 435.540 4.170 10 10 IICE COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1 1636236969 BFDUKAPERBYEAK-IBGZPJMESA-N 428.838 4.315 10 10 IICE Cc1cc(C(=O)NC(C)(C)c2cn(C(C)C)nn2)c(C)n1-c1ccc(Br)cn1 1638299812 SFRRXACZWONHKL-UHFFFAOYSA-N 445.365 4.089 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)CCn3cc(Br)cn3)c2C)c1 1638440147 LYWDDLCTINJQBB-UHFFFAOYSA-N 429.362 4.442 10 10 IICE C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)NCc1c(O)cccc1F 1638862867 GIDXPYTYRYCCSA-HNNXBMFYSA-N 434.467 4.075 10 10 IICE COC(=O)[C@H]1Cc2ccc(O)cc2CN1C(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1640711991 VPHXKERSUGNRHW-XMMPIXPASA-N 432.520 4.157 10 10 IICE CCCCCN(Cc1ccc(Cl)cc1)Cc1cc(O)n2ncc(C(=O)OCC)c2n1 1642108947 BWLYJICGNRZQQQ-UHFFFAOYSA-N 430.936 4.457 10 10 IICE C[C@H](NC(=O)CCCOc1ccc(I)cc1)c1ccccc1O 1642828034 WZNSRXBGYRCPQX-ZDUSSCGKSA-N 425.266 4.033 10 10 IICE O=[N+]([O-])c1cc(Br)cnc1N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1655104475 ZKYJFCJGZRLXPT-AWEZNQCLSA-N 441.713 4.188 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCCOc4cc(Cl)ccc43)C2)cc1 1670974012 ZNHXSGBFTWIQKP-HRAATJIYSA-N 429.948 4.388 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NCc1ccc(-c2ccc(OCC(N)=O)cc2)cc1 1682958446 WMJCWERDFQXZQD-UHFFFAOYSA-N 447.535 4.045 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCS[C@@H](C(C)C)C1 1693005776 LOUQUJXORPGVRG-JOCHJYFZSA-N 436.629 4.341 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2cccnc2)nnc1N(C)CCc1cccs1 1693005973 OEVXVCADVVZSGA-UHFFFAOYSA-N 446.624 4.427 10 10 IICE CCC1(Cn2c([C@H]3OCC[C@H]3COC)nnc2N(C)Cc2ccccc2O)CCCC1 1694495534 TZPHFNBJNFNUDR-FPOVZHCZSA-N 428.577 4.315 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCO[C@H](C)C1 1708508435 GWGFASMKXLGIKS-HBMCJLEFSA-N 441.620 4.332 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCCC[C@H](SC)C2)cc1 1710026565 LBGLXKQAGOSMHW-IRLDBZIGSA-N 443.661 4.398 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1726461027 SDIBCTIBDXFTGF-RTBURBONSA-N 443.611 4.373 10 10 IICE CCc1nnc(N(CC)C[C@H]2COc3ccccc3O2)n1CCCSc1nccs1 1727519214 OINZRIPEQBJNPZ-INIZCTEOSA-N 445.614 4.146 10 10 IICE CCOCc1nnc(N2CCCC[C@H](SCC)C2)n1Cc1ccc2c(c1)CCCN2C 1729051412 CVQFPRJCAARTKV-NRFANRHFSA-N 443.661 4.357 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1730853580 BYILYPALTIPHDR-SFTDATJTSA-N 441.620 4.275 10 10 IICE Cc1cc(C)n(Cc2nnc(N(C)C3CCCCC3)n2Cc2ccc(N(C)C)cc2C)n1 1742675799 ABRAVOBSEZYECV-UHFFFAOYSA-N 435.620 4.331 10 10 IICE CC(C)NC(=O)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCC[C@H]1C 1761198004 FMYAEDMKXRHGON-CTNGQTDRSA-N 438.620 4.089 10 10 IICE CCN1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(F)(F)F)C[C@H]1C 1767114736 RPOOFPZQKFODKM-QGZVFWFLSA-N 446.521 4.445 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cn2cccc(Br)c2n1 1865764066 XWMGRJNTSWFZRW-UHFFFAOYSA-N 446.260 4.125 10 10 IICE CCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCc2ccc(OC)cc2)C1=O 1873170065 NAXFCWYVSFNTIC-UHFFFAOYSA-N 443.547 4.035 10 10 IICE CN1CCc2cc([C@@H](NC(=O)OCC3c4ccccc4-c4ccccc43)C(=O)O)ccc21 1951376361 XLJCOCUGCCIRGE-XMMPIXPASA-N 428.488 4.343 10 10 IICE COc1cccc(O)c1CNc1ccc(I)c(Br)c1 2104443102 URJVNBNLSLFMNG-UHFFFAOYSA-N 434.071 4.380 10 10 IICE CCC1(NC(=O)OC(C)(C)C)CC(NCc2c(Br)ccc(OC)c2O)C1 2227748644 PMXYGEXURGCGDV-UHFFFAOYSA-N 429.355 4.089 10 10 IICE O=C1N=C(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)SC1=Cc1ccccc1Cl 2296055608 DVVXKVIIEMGOKE-UHFFFAOYSA-N 428.901 4.041 10 10 IICE Cc1ccc(C=C2SC(=S)N(CN3CCN(c4cccc(Cl)c4)CC3)C2=O)o1 2296689768 IGCSRTXMIFJEFJ-UHFFFAOYSA-N 433.986 4.222 10 10 IICE CCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OCC 2297498992 FTGHVTVMQUERGB-UHFFFAOYSA-N 428.535 4.030 10 10 IICE Cc1ccc(CN[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)c(O)c1Br 2307565729 BBKUOOIGSSARRH-GOSISDBHSA-N 433.346 4.354 10 10 IICE CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(N(C)CCC(C)C)cc3)C2=O)cc1 2313548100 LPOWBKIGCZWCBP-UHFFFAOYSA-N 435.524 4.234 10 10 IICE CCOC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(O)c(OCC)c2)SC1=S 2314767758 ICCYCZDTPUKTLG-LJQANCHMSA-N 443.546 4.297 10 10 IICE CCOc1cc(C=C2SC(=S)N(CCc3nc4ccccc4[nH]3)C2=O)ccc1O 2321730198 YXALGHKYYJBZFA-UHFFFAOYSA-N 425.535 4.111 10 10 IICE Cc1ccc(CNC(=O)CC(C)(C)[C@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2380748715 HIMLSJHYZBJVCE-ZDUSSCGKSA-N 443.382 4.409 10 10 IICE COc1ccc(Cl)cc1C(=O)NC[C@H](c1ccc2c(c1)CCCN2C)N1CCCC1 16838210 TUZPWMPFLQSORD-JOCHJYFZSA-N 427.976 4.298 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc(Cc4cccc(Cl)c4)n3)CC2)cc1 106195936 FKTCKVLSGRHCMA-UHFFFAOYSA-N 441.984 4.287 10 10 IICE COc1ccc(N2CCC(NC(=O)c3ccc(NC(=O)c4ccco4)s3)CC2)cc1 110359318 GSFQZOYWZBVBJN-UHFFFAOYSA-N 425.510 4.001 10 10 IICE CN(C)c1ccc(CN2C[C@H](O)C[C@@H]2c2nc(-c3ccc(C(F)(F)F)cc3)no2)cc1 209367132 XBZOHASLKVUNOC-RTBURBONSA-N 432.446 4.129 10 10 IICE Cc1cc(Br)c(O)c(CN(CCO)Cc2cc(Br)cs2)c1 756120369 HUTZYQXADYZYBQ-UHFFFAOYSA-N 435.181 4.282 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H](C)C[C@@H](O)c2ccc(F)cc2)C1 768070185 FYXUMVVMJQHORV-IQGLISFBSA-N 437.559 4.175 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCO[C@H](c3ccccc3C(F)(F)F)C2)cc1F 781933178 LJCFKYDFFLDHSL-IBGZPJMESA-N 425.426 4.194 10 10 IICE C[C@@H]1[C@@H](NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C[C@H]1c1ccccc1 783657588 ZYSFGWYDPWDYLG-KWOQKUFVSA-N 431.559 4.224 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccc3c(c2)CCN(C(=O)OC(C)(C)C)CC3)c1 789815444 BNVXWGRISNFOHS-INIZCTEOSA-N 440.540 4.228 10 10 IICE COC(C)(C)c1nc(C)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)s1 810318538 DYNFISHNJACIBT-UHFFFAOYSA-N 439.528 4.333 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](c1ccccc1)N1CCSCC1 1137349514 WMDUYOZEFWHPAC-FQEVSTJZSA-N 449.414 4.293 10 10 IICE Cc1cc(C(=O)N[C@H](C2CC2)[C@@H](CO)C2CC2)c(C)n1-c1ccc(Br)cc1 1141274296 MWHUIDAMSZVQQV-LEWJYISDSA-N 431.374 4.384 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)c(C)n1-c1ccc(Br)cn1 1141695481 ZFFVUDVQPMERLK-GDBMZVCRSA-N 433.394 4.244 10 10 IICE C[C@@H]1Cc2cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)ccc2O1 1147508198 UVYYVIPKLKBMLQ-IIBYNOLFSA-N 439.556 4.072 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC(Cc4cc(F)cc(F)c4)CC3)C2)cc1 1230300337 DAHXCKIKLPBDCY-IBGZPJMESA-N 443.538 4.464 10 10 IICE COc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1C(F)(F)F 1264688847 BEFRZEDHCRRPMQ-ZIAGYGMSSA-N 440.437 4.397 10 10 IICE CC(C)(C)Cc1nnc(N2CCOC(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1287036823 JKYQIWOIWZLROX-UHFFFAOYSA-N 443.661 4.083 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2ccc(C)o2)n1CCCSc1nccs1 1295722554 LQHQFKINWMVTJR-MRXNPFEDSA-N 433.603 4.491 10 10 IICE CCCNS(=O)(=O)c1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1441026194 GUVQNFNXSDXVRU-UHFFFAOYSA-N 425.554 4.343 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)Sc3ccc(Br)cc3)C2)cc1 1461493869 IUDMEAXCXMYECP-ZBFHGGJFSA-N 435.387 4.333 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1 1469104235 OPULWNUXCUYDLU-AZUAARDMSA-N 440.563 4.191 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3c4ccccc4CC[C@H]3C(C)C)CC2)c(OC)c1 1469707161 GVXRMPNWMAQMTI-OFVILXPXSA-N 437.584 4.495 10 10 IICE CC1CCN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)CC1 1493909854 SRTWNDZRCXAZED-UHFFFAOYSA-N 428.943 4.483 10 10 IICE CN(Cc1cnccn1)c1nnc(CC2CCCC2)n1CCCSc1nccs1 1503504751 ZLAXWIFZYSBZGI-UHFFFAOYSA-N 429.619 4.076 10 10 IICE C[C@@H]1C[C@@H](Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CCO1 1512023209 WPFKHLWNTQCCOJ-CVEARBPZSA-N 427.936 4.151 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533327086 AXWGPEKVYVARQM-HZPDHXFCSA-N 441.519 4.019 10 10 IICE C[C@@H](Sc1ccc(F)cc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1535568205 AHILRGRBORYNHS-GOSISDBHSA-N 427.589 4.155 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CCC[C@H](C(F)F)C1 1542226816 KFGZYORLQALBDG-OALUTQOASA-N 433.547 4.076 10 10 IICE CCOC(=O)CCN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C1CC1 1542260218 QUNFJRARWCBWLL-UHFFFAOYSA-N 433.346 4.414 10 10 IICE CCC(C)(C)C1CCC(NC(=O)/C=C\C(=O)N2CCN(c3ccc(OC)cc3)CC2)CC1 1543158633 FAGWYTPYCCIXAS-PFONDFGASA-N 441.616 4.011 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCO[C@@H](c3nccs3)C2)cc1 1547443663 CNTYRXPHOFXLCS-HXUWFJFHSA-N 440.617 4.330 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](OC)CC[C@H]2C)sc(C)c1-c1ccccc1 1560063964 PQRXTGYETSFDBC-CRAIPNDOSA-N 430.570 4.338 10 10 IICE Cc1cccn2cc(CNC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)nc12 1565605307 TTWVPZOJUZXCNB-UHFFFAOYSA-N 438.329 4.138 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H]3c4sccc4OC(C)(C)[C@H]3O)c2C)cc1 1570224197 IOACOZDGAAUTTG-CTNGQTDRSA-N 426.538 4.167 10 10 IICE CCC[C@@H](C)N1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CC1=O 1616620602 WUXQDJDRTISGPL-TZIWHRDSSA-N 437.584 4.332 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC[C@@H](C)C1 1618785872 JVHQWKZVIJLITO-GOSISDBHSA-N 434.588 4.115 10 10 IICE FC1(F)CCN(c2nnc(Cc3ccccn3)n2CCCSc2nccs2)CC1 1620339777 DFVYEYLJUHCZIB-UHFFFAOYSA-N 436.557 4.138 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)c(C)c1 1620562219 ZNSDZUOEXTYTFI-HDICACEKSA-N 431.527 4.030 10 10 IICE COc1ccc(N2CCC(NC(=O)CCCCCCNC(=O)OC(C)(C)C)CC2)cc1 1627619020 BWANOWMOZXFTIG-UHFFFAOYSA-N 433.593 4.255 10 10 IICE CC[C@H]1CN([C@H](CC)C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CCO1 1633065800 CSDGIXOWIIYJOB-UKILVPOCSA-N 439.600 4.184 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(NC3=NCCC3)cc2)c1 1633079751 NKRUBRSDTBQVBL-UHFFFAOYSA-N 441.535 4.035 10 10 IICE Cc1cc(C(=O)N2C[C@H](C)O[C@]3(CCCOC3)C2)c(C)n1-c1ccc(Br)cc1 1634157254 ZXXXXYQCRSFQGX-KSFYIVLOSA-N 447.373 4.267 10 10 IICE C[C@H](NC(=O)c1csc(C2CCN(C(=O)OC(C)(C)C)CC2)n1)c1ccccc1O 1635803229 BMNBORNJCLJWPK-AWEZNQCLSA-N 431.558 4.454 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC(C)(C)CCCNC(=O)OC(C)(C)C 1636263645 SOGAMMATNBDZFP-SFHVURJKSA-N 434.625 4.375 10 10 IICE CCC1(CC)CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c2ccccc21 1638478606 CXVJOHOOBQZWPX-UHFFFAOYSA-N 434.584 4.176 10 10 IICE CCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)nc2ccsc2c1=O 1656137790 MMDAODZKCPUQLV-UHFFFAOYSA-N 442.541 4.395 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC3(CCC3)OC[C@H]2C)sc(C)c1-c1ccccc1 1659326288 QRZBJTREMUILGK-MRXNPFEDSA-N 442.581 4.482 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C 1679890923 SNPNOIOEEITLBR-OXQOHEQNSA-N 446.389 4.207 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 1685689936 ZTXSBBKTASSEMK-FQEVSTJZSA-N 444.620 4.465 10 10 IICE CC(C)(C)[C@H]1CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1706120540 AVGWJCKBNSAJAS-INIZCTEOSA-N 448.662 4.025 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCO[C@H](C(C)(C)C)C2)cc1 1710028390 VZCZRPHAFIDOIG-YADHBBJMSA-N 441.620 4.275 10 10 IICE Cc1cc(CN(C)c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)no1 1724199596 BKANDGFYBKCHHN-UHFFFAOYSA-N 434.544 4.056 10 10 IICE CC[C@@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)C 1727662490 KODVZNQCVFBDQO-VGOFRKELSA-N 434.588 4.066 10 10 IICE CCC[C@@H](C)NC(=O)[C@@H]1CCCN(c2nnc(C)n2Cc2ccc(N(CC)CC)cc2)C1 1727941831 JZCGTAGMKGHXNC-DENIHFKCSA-N 440.636 4.002 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1CC1CCC(F)(F)CC1 1768684617 VMSLTXOCCOBDBZ-UHFFFAOYSA-N 427.499 4.431 10 10 IICE O=C(Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(=O)c2ccc(Cl)cc2o1 1859707611 WAEKJRNYXFOJLN-UHFFFAOYSA-N 429.815 4.474 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(NCc3cc(Br)cc(F)c3O)C[C@H]2C1 1967824122 FIIOIFJZHLWZBW-ORAYPTAESA-N 429.330 4.173 10 10 IICE COc1ccc(Cn2nc(C(C)C)c(C3(C)CC3)c2I)c(O)c1 2079727624 ABKMENGAIIPICQ-UHFFFAOYSA-N 426.298 4.425 10 10 IICE CC(C)(C)OC(=O)NC[C@]1(NCc2cccc(Br)c2O)C[C@H]2CC[C@H]1C2 2131760044 HVBBSPORHRASOF-ZQGRQUNCSA-N 425.367 4.328 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3NCc1cc(Br)cc(F)c1O 2169561415 KVOAHMNXCUBTAE-AHQUFDAQSA-N 441.341 4.027 10 10 IICE CC[C@H](NC[C@@H]1C[C@H](OC)CN1C(=O)OC(C)(C)C)c1cc(Br)ccc1O 2172450426 XBLMRKUICOITMV-ZOBUZTSGSA-N 443.382 4.220 10 10 IICE Cc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)N(C)C(=O)N(c3ccccc3)C2=O)o1 2313560233 NLECJNRAPKMNMA-UHFFFAOYSA-N 431.404 4.172 10 10 IICE CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2381140493 LDVLOHYERBMHDP-MLGOLLRUSA-N 443.382 4.361 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1)N2)N1CCOCC1 14460315 RUTXHTQTSSBPOE-NNMXDRDESA-N 430.957 4.187 10 10 IICE COC(=O)c1ccc(/C=C2\C(=O)N(c3cccc(Cl)c3Cl)C(=S)N=C2O)cc1 33398359 MOPYNPRZFQCMHH-XFXZXTDPSA-N 435.288 4.452 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccccc3F)SC2=S)cc1 210718262 BTRRDBYQAJEANQ-QGOAFFKASA-N 430.526 4.454 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1 731479854 YVZLTHMGQALPSP-AWPPYJOESA-N 430.888 4.384 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(N2CCCC2=O)cc1 773147608 TZWMIOQJVMKRND-OAQYLSRUSA-N 432.612 4.196 10 10 IICE CCc1cc(C(=O)N(CC(=O)OC)Cc2cc(Cl)ccc2O)c2c(C(C)C)noc2n1 801182650 QIPCDNBMZHETFQ-UHFFFAOYSA-N 445.903 4.083 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 801937758 VWCNNWLCZDLWNU-HNNXBMFYSA-N 431.916 4.190 10 10 IICE CCN(C)Cc1cc(O[C@@H]2CCN(C(=O)c3sccc3-n3c(C)ccc3C)C2)ccn1 856638222 WUDGXLDFMUZZNM-OAQYLSRUSA-N 438.597 4.296 10 10 IICE COc1ccc(C)cc1-c1csc(NS(=O)(=O)c2c(Cl)nc3ccccn23)n1 917861575 VGHSNXNGFYPFOF-UHFFFAOYSA-N 434.930 4.229 10 10 IICE COc1ccc(N(C)C(=O)c2cccc3c2CCN(C(=O)OC(C)(C)C)C3)cc1OC 1125600441 KEOFURLKEONXAX-UHFFFAOYSA-N 426.513 4.274 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1126877278 JGKDUDKIEYZBOB-JOCHJYFZSA-N 429.564 4.305 10 10 IICE CC(C)(C)c1coc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 1134762450 KECBDDLCDYRCNV-GXDHUFHOSA-N 449.623 4.331 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H](NC(C)=O)c2cccc(Br)c2)cc1 1135946405 QUFBXAXZGJJFLQ-NRFANRHFSA-N 446.389 4.131 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(=O)c4ccc(Cl)cc4o3)cc2F)C[C@H](C)O1 1136310964 BTCWIYMKTVIYSJ-KBPBESRZSA-N 444.890 4.129 10 10 IICE CC(C)[C@H](C(=O)NCc1ccc(N2CCSCC2)cc1)[C@@H](C)NC(=O)OC(C)(C)C 1141803454 JFQFMLYTMALZFE-XLIONFOSSA-N 435.634 4.041 10 10 IICE Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)NCc1ccc(N3CCSCC3)cc1)O2 1141803940 PJAKPSADHKYXBG-RUZDIDTESA-N 440.609 4.271 10 10 IICE C[C@H](CC(=O)NCc1ccc2cccnc2c1O)C1CCN(C(=O)OC(C)(C)C)CC1 1142727985 JFANPVKMTHUJDY-MRXNPFEDSA-N 427.545 4.230 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(Br)ncc1Br 1150387442 ONMQCSKPNGBEQZ-UHFFFAOYSA-N 440.135 4.121 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)Oc1ccc(F)cc1 1153156291 HFUIKYVEUCYPCT-QHCPKHFHSA-N 438.499 4.200 10 10 IICE Cc1cc(C(=O)N2CCN(C3CC3)C[C@@H](C)C2)c(C)n1-c1ccccc1Br 1160000812 ISOWKXYVMBMWHN-OAHLLOKOSA-N 430.390 4.413 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H]3CC(C)(C)Oc4cc(F)ccc43)C2)cc1 1224641359 JWPFTWUCHMVLJN-KKSFZXQISA-N 427.520 4.262 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)NCCC2(CNC(=O)OC(C)(C)C)CC2)cc1 1230655655 VDCYCOJHYVQRMC-UHFFFAOYSA-N 432.609 4.369 10 10 IICE CCN(CC)CCCC1CCN(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1 1252114680 FSCIKUOWKPYZPI-JOCHJYFZSA-N 430.637 4.065 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1cnc2c(c1)CCCC2 1269008678 YYQOKPARVMDHSK-ODLFYWEKSA-N 441.553 4.330 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cnn(-c4ccc(F)cc4)n3)cc2Cl)C1 1270431270 IWDXYWYPYBQUCT-HNNXBMFYSA-N 427.911 4.226 10 10 IICE COc1cccc(SC)c1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1276306087 UDHWVJYCERFZSU-UHFFFAOYSA-N 448.456 4.353 10 10 IICE CC[C@H](C)CN(CC)c1nnc(CC2CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291748031 KHXYPYOFIXPIQL-SFHVURJKSA-N 429.584 4.127 10 10 IICE CC1CCN(c2ccc(CNC(=O)C[C@H](NC(=O)OC(C)(C)C)C(F)F)cc2)CC1 1293146440 UWYCBFRKESSQPG-SFHVURJKSA-N 425.520 4.088 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1293419471 YLQGKMRTHSCNIV-HXUWFJFHSA-N 434.588 4.210 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1Cc1ccc(Cl)nc1 1298364710 HPDLWGWMVCLFHC-UHFFFAOYSA-N 425.945 4.369 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H]3C)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1304196578 SZPCNFBUXOAHTQ-GOSISDBHSA-N 434.588 4.114 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(F)cc4)no3)cc2F)C[C@H](C)O1 1350931750 CHIYINKTZSEVFC-GJZGRUSLSA-N 427.451 4.163 10 10 IICE CCOc1ccc(C[C@H](C)C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1 1357834736 AQOZSLAVXZBTHV-IPMKNSEASA-N 428.548 4.333 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(C(F)(F)F)c(F)c3)cc2F)CC1 1359919781 BQTKSIHAJGISSZ-UHFFFAOYSA-N 427.417 4.056 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N[C@H]1CSc2ccccc21 1360898200 WMFORTDBMABYEU-GYKGCMEESA-N 444.578 4.380 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H](C)Oc3ccccc3Cc3ccccc3)C2)cc1 1437573446 BSYDATJRSIGJJH-OFNKIYASSA-N 430.548 4.448 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)CC1(CNC(=O)OC(C)(C)C)CCCCC1 1444693880 BODRIQYANOXJFE-UHFFFAOYSA-N 431.577 4.343 10 10 IICE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1c(O)ccc2c1CCCC2 1445898900 CFSHLGKTYCSEHG-OAQYLSRUSA-N 428.960 4.385 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccn(-c2ccc(Cl)cc2Cl)n1 1454002753 GXDHOUSZFSTDCL-UHFFFAOYSA-N 445.350 4.070 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2nccc3c(Br)cccc23)N(C)C)cc1 1463287057 XKAYTMSPEXDPRC-FQEVSTJZSA-N 441.373 4.096 10 10 IICE Cc1cc(C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)c(C)n1-c1ccc(Cl)cc1 1471208372 WQVYGOMERLJLNS-UHFFFAOYSA-N 445.991 4.283 10 10 IICE Cc1ccc(C[C@]2(C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1471369932 NRQLNNDGQWRBKJ-MHZLTWQESA-N 448.611 4.004 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cc3nccc(C(F)(F)F)n3n2)cc1 1524936423 CUSPKJAXZGESRQ-UHFFFAOYSA-N 443.429 4.250 10 10 IICE COc1ccc(N2CCN(C(=O)CCCCOc3ccc(Br)cc3)CC2)cc1 1534016317 ASLOSIVJMJPIQC-UHFFFAOYSA-N 447.373 4.356 10 10 IICE CO[C@@H]1CN(C(=O)OC(C)(C)C)[C@](C)(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1535142442 AZSYEQWJIPSQAO-OFVILXPXSA-N 441.572 4.125 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1-n1cccn1 1539582052 NUBASHUYTVFPIT-GOSISDBHSA-N 426.467 4.181 10 10 IICE COc1ccccc1N1C[C@@H](C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1=O 1544080453 NDJCPKOPXFINSF-NRFANRHFSA-N 431.536 4.080 10 10 IICE Cc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1NC(=O)NC(C)(C)C 1558722798 CPBKTLXOXMZERC-JOCHJYFZSA-N 439.604 4.014 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)c(C)n1-c1ccc(F)cc1 1584300668 LAEZZUKIQIJXHR-UHFFFAOYSA-N 425.548 4.488 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCCOc1ccccc1[N+](=O)[O-] 1613363878 GMEGTNAVYYUTFY-UHFFFAOYSA-N 427.482 4.421 10 10 IICE Cc1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)c(C)n1-c1ccc(Br)cn1 1626502660 FGETUIKNLPIWNS-UHFFFAOYSA-N 443.301 4.132 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1ccc2cccnc2c1O)C1CCCCCC1 1627072537 AHGMGKRBQMEHGK-FQEVSTJZSA-N 427.545 4.420 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 1628365359 FZTRZPAIBSYXPE-UHFFFAOYSA-N 441.528 4.235 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1 1635677196 ZOTHMNODZGCFLR-HZPDHXFCSA-N 447.373 4.431 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1637410023 GJJQLDXZDBMWMC-VGOFRKELSA-N 440.588 4.191 10 10 IICE CC(=O)c1cc(F)cc(CN2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1O 1643253122 BSYAMGQGBSEAFS-DHIUTWEWSA-N 440.515 4.261 10 10 IICE COc1ccccc1N(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C(C)C 1645987090 QOBFPCDJBHBFTA-UHFFFAOYSA-N 428.488 4.324 10 10 IICE COc1ccc2c(c1)C[C@@H](C(C)C)CN2CC(=O)NC1CCN(Cc2ccccc2C)CC1 1646307499 SWJPDWRKXABRHG-XMMPIXPASA-N 449.639 4.419 10 10 IICE Cc1cc(CCNC(=O)N2CCCSC[C@H]2c2cnn(C)c2)c(C)n1-c1ccccc1 1674930038 IXKZFZFTCMQWEI-QHCPKHFHSA-N 437.613 4.260 10 10 IICE COc1cccc(CN(C[C@H]2CCCO2)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c1 1683420918 AXXDXQUOYUCQLY-CJFMBICVSA-N 439.600 4.391 10 10 IICE CCN(c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C)C1CCCC1 1695574577 UAGFHTHPWFYYBK-REWPJTCUSA-N 441.620 4.194 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1C[C@H]1CCCCC1(F)F 1696701261 ZCUZQODYWZKSMP-GOSISDBHSA-N 427.499 4.431 10 10 IICE CC(C)[C@](C)(O)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706252019 RPBDFYSLXYNXDK-RCZVLFRGSA-N 441.620 4.163 10 10 IICE CC(C)[C@](C)(O)Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706252021 RPBDFYSLXYNXDK-WIOPSUGQSA-N 441.620 4.163 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1727044899 LOFLUQQAYPJWJQ-QGZVFWFLSA-N 432.576 4.012 10 10 IICE CCCCn1cc(Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)c(C)n1 1728070292 PNPGISJLODQBIT-UHFFFAOYSA-N 431.544 4.035 10 10 IICE COCC(C)(C)Cn1c(-c2cc(Br)c[nH]2)nnc1N(C)Cc1ccccc1O 1730433423 IHJCGXVDLVTIGG-UHFFFAOYSA-N 448.365 4.050 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C2CC(C(C)(C)C)C2)CCOC1 1746657506 DVNULXTWLSOJIJ-RGELYXPASA-N 428.577 4.269 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCC4)n3CC(C)(C)SC)CC2)cc1 1748847196 HVDWVYGOLOOJDQ-UHFFFAOYSA-N 429.634 4.413 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1ccc(OC)nc1 1763499221 MBSNKMQZRLYCRJ-LJQANCHMSA-N 434.588 4.480 10 10 IICE CCOCc1nnc(N(C)Cc2ccccc2O)n1Cc1cscc1C(F)(F)F 1766235918 NBAILSNQINWZKJ-UHFFFAOYSA-N 426.464 4.285 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc4nc(Cc5ccccc5)[nH]c4c3)CC2)cc1 1861865460 CFJKEZJKEYAMRF-UHFFFAOYSA-N 426.520 4.125 10 10 IICE CCN1C(=O)C(Nc2ccc(C(=O)OC)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873422647 HRTVMLCGTCOEQC-UHFFFAOYSA-N 443.503 4.093 10 10 IICE C[C@H](c1ccccc1O)N(C)C(=O)C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2060163211 CVELSKQIHZRWGZ-QUCCMNQESA-N 442.556 4.412 10 10 IICE CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)C(=O)c1ccn(-c2ccc(N)cc2)n1 2106704086 WSKVOSYJJFZBDO-UHFFFAOYSA-N 449.555 4.012 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NCc3cc(Br)cc(F)c3O)CCC[C@H]2C1 2149375966 QXPFXORXDDSZMH-MJEQTWJJSA-N 443.357 4.419 10 10 IICE COc1ccc2cc(C=C3SC(=S)N([C@H](C(=O)O)C(C)C)C3=O)c(Cl)nc2c1 2297580108 PKTBUNATOUCKBJ-HNNXBMFYSA-N 436.942 4.207 10 10 IICE Cc1ccc(CN[C@@H]2C[C@@H]3CC[C@H]([C@H]2F)N3C(=O)OC(C)(C)C)c(O)c1Br 2380801705 AHCNGDHBGVHAQJ-HWMZRRJGSA-N 443.357 4.431 10 10 IICE COc1ccc([C@@H]2Nc3c(C(=O)NC[C@@H]4CCCO4)cccc3[C@H]3C=CC[C@@H]32)cc1OC 14479451 IHMYISQGBICZFI-LYXWCMDISA-N 434.536 4.439 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cc(Cl)ccc2O)SC1=S)Nc1nccs1 15040926 MIKFTJXAMPUBCA-LCYFTJDESA-N 439.971 4.122 10 10 IICE C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S 47152367 XPZYBIXKJMXWAV-FFCYNSPCSA-N 447.925 4.477 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2cccc(OCc3ccc(C)cc3)c2)SC1=S 206836809 JBCRSWOXQZWAEK-UYRXBGFRSA-N 427.547 4.338 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)CSCc1ccc(Br)cc1F 437007624 KFAJEEYRHJPHQQ-UHFFFAOYSA-N 439.350 4.313 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccccc2Cl)cs1 748673848 MDZRFCRCVYODMO-UHFFFAOYSA-N 425.875 4.181 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1CCN(c2ccncc2C)CC1 752807681 KLIMFMXLOVGLTG-UHFFFAOYSA-N 432.362 4.123 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1c[nH]c2cccc(Br)c12 763924204 ACOIDVUSQYODHC-UHFFFAOYSA-N 442.357 4.069 10 10 IICE COc1ccc([C@H](C)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1NC(C)=O 765128645 WXTWTIZXSBCMOE-ZACQAIPSSA-N 429.536 4.257 10 10 IICE C[C@@H](NC(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccc(N2CCOCC2)cc1 776014907 SDDDFVYKIWDZCU-YJYMSZOUSA-N 443.416 4.465 10 10 IICE Cc1ccc(/C=C\C(=O)Nc2cccc3c2OCCN3C(=O)/C=C\c2ccc(C)nc2)cn1 791079042 XVTBKRHQPNBTQX-MIMPSMLTSA-N 440.503 4.184 10 10 IICE Cc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1NC(=O)CC(C)C 1129661156 HRHALXPBQACNTK-UHFFFAOYSA-N 445.510 4.024 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2 1129814994 RCJDXTXGSLDYBI-INIZCTEOSA-N 438.522 4.375 10 10 IICE CCOC(=O)c1cc(C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)[nH]c1C 1144704251 BEMHQLXFBQUNNO-UHFFFAOYSA-N 435.524 4.421 10 10 IICE Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)cc2)c(C)n1-c1ccc(Br)cn1 1150520487 RCFBLNVCEVETGP-ZDUSSCGKSA-N 428.330 4.318 10 10 IICE CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCc1c(O)cccc1F 1184349107 VFRWIABCWATUSC-QGZVFWFLSA-N 427.303 4.299 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@H]3COc3ccc(Cl)cc3)C2)cc1 1230859245 UVFKPFJBZISXOG-QUCCMNQESA-N 429.948 4.180 10 10 IICE Cc1ccc([C@H]2CCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)C2(C)C)cc1 1251105165 RRGLIXWEBALTEI-XMMPIXPASA-N 448.611 4.174 10 10 IICE CC(C)[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2CCCSc2nccs2)CCO1 1287288824 TYUHISWIJZMZFJ-IRXDYDNUSA-N 437.635 4.020 10 10 IICE C[C@H]1CCCN(C(C)(C)Cn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1291102868 UVBZEUAXLYGNRU-IBGZPJMESA-N 434.588 4.193 10 10 IICE CCc1nnc(N2CCC(CC)(CC)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1306133258 GVAVXLCXRIETHT-UHFFFAOYSA-N 425.621 4.114 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1ccc(Br)cn1 1313177302 RMCCXTOLXLRLTA-UHFFFAOYSA-N 443.139 4.044 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@@]23CCN(C(=O)OCc2ccccc2)C3)cc1 1354542068 VACBFNCSTHWKBQ-JYFHCDHNSA-N 435.568 4.198 10 10 IICE Cc1cc(N2C[C@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)ccc1F 1438178611 NUYIPGNFAHJJLK-OAQYLSRUSA-N 433.527 4.253 10 10 IICE Cc1cc(C(=O)N[C@H](CO)Cc2ccccc2)c(C)n1-c1ccccc1Br 1447874360 XCJYHQJJXJHABL-SFHVURJKSA-N 427.342 4.190 10 10 IICE Cc1ccc(O)c(CNC(=O)c2cc(I)cc(C(F)(F)F)c2)c1 1453651638 PFZXRWBRTKENEI-UHFFFAOYSA-N 435.183 4.254 10 10 IICE COc1ccc(CN2CCCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1463898284 JHTBLXXABGODSK-UHFFFAOYSA-N 445.563 4.263 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(-c2ccccn2)n1Cc1ccc(N(C)C)c(F)c1 1505236589 YDWDBIONWOXFAU-MRXNPFEDSA-N 428.581 4.171 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C)C3)n2CCCOC(C)C)c(C)n1-c1ccccc1 1510619244 NZYPTAZPPQNVIN-FQEVSTJZSA-N 437.588 4.393 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N(C)Cc1scnc1C 1510674545 PQTIJFLHLJPASE-UHFFFAOYSA-N 433.585 4.164 10 10 IICE Cc1nc(Cc2nnc(N(C)CC(F)(F)F)n2Cc2ccc(N(C)C)cc2C)cs1 1511514446 VRYHPLVMVUMDCE-UHFFFAOYSA-N 438.523 4.055 10 10 IICE CCN(Cc1cccs1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1515632342 ANZAVNABIVTDIU-UHFFFAOYSA-N 443.627 4.462 10 10 IICE Cc1ccc(C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)cc1-n1c(C)cc(C=O)c1C 1538935381 MGKHLDJKTTUVHO-UHFFFAOYSA-N 443.503 4.116 10 10 IICE Cc1cc(CCC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)ccc1Br 1539236375 SRCLKMPEHNVAHR-OAQYLSRUSA-N 432.406 4.175 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](ONC(=O)OC(C)(C)C)C(C)C)c1 1557089592 IBWWHNNOJWDNDC-OAQYLSRUSA-N 443.544 4.117 10 10 IICE CC(C)(C)OC(=O)NC[C@]12CCCC[C@H]1CN(C(=O)c1cc3cc(O)c(O)cc3s1)C2 1558856724 GWIWXUDPLHFPGM-WNSKOXEYSA-N 446.569 4.470 10 10 IICE CCc1nn(C)c(CC)c1CNC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1564385642 YXQOKSHYSLOSHN-INIZCTEOSA-N 432.012 4.434 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN([C@H](C)c4nccs4)CC3)c2C)c1 1565193218 RRBDCGJOKOCXTA-HXUWFJFHSA-N 437.613 4.447 10 10 IICE Cc1c(CN(C)C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)oc2c(C)cccc12 1565362934 CYLXCACDPDRDQJ-UHFFFAOYSA-N 448.567 4.093 10 10 IICE CCCCC1CCC(c2cc(NC(=O)c3cc(NS(C)(=O)=O)ccc3O)n[nH]2)CC1 1583082773 KIFDJHFFKAFGKV-UHFFFAOYSA-N 434.562 4.203 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)OC3(CCCC3)C2)c(C)n1-c1ccc(Br)cn1 1583634546 ULLSIBBPRPATLE-OAHLLOKOSA-N 432.362 4.425 10 10 IICE CCc1cc(Cl)cnc1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1587472818 FVECEASMUCNERF-UHFFFAOYSA-N 435.823 4.233 10 10 IICE CCOC[C@@H]1CCCCN1C(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1597059073 QZDQTRYEEWMKGZ-SUCHYCSPSA-N 438.640 4.147 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)COc2cccc3c2OC(C)(C)C3)cc1 1598290816 DZKKFRGIJDMYHT-JOCHJYFZSA-N 438.568 4.053 10 10 IICE COc1ccc([C@@H](C)NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1C 1611561247 QZQKIPFNMIDWNA-CQSZACIVSA-N 444.443 4.178 10 10 IICE C[C@H]1CCC[C@]1(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1612751329 JYOUEHZEILKANV-VMMOAZFZSA-N 442.604 4.090 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](C(=O)OC)C2)n1Cc1ccc(N(CC)CC)cc1 1613266703 BRVKITWUIREUNZ-AZUAARDMSA-N 427.593 4.076 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Cn2cccc(I)c2=O)c1C 1614589650 ZQBZSWMIKAZQDG-UHFFFAOYSA-N 446.288 4.052 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(C)CC3CCOCC3)ccc21 1618476537 RNLBQZZCLAOGGN-UHFFFAOYSA-N 425.621 4.160 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3nccnc3SCc3ccccc3)C2)cc1 1627158895 IPMMTCALFAUUGO-LJQANCHMSA-N 434.565 4.034 10 10 IICE Cc1cc(C(=O)N(C)[C@@H](CO)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1628297247 JKWMDEVATDVPGD-IBGZPJMESA-N 428.330 4.057 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(C(=O)N(CCN3CCCC3)c3ccccc3)ccnc21 1628433325 AQHPOMHCMBHDTN-UHFFFAOYSA-N 436.556 4.122 10 10 IICE COc1ccc(F)c2[nH]c(C(=O)N[C@@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc12 1629055193 DKZVNGFLOODFTJ-CYBMUJFWSA-N 433.430 4.316 10 10 IICE CCOc1ccc(N2CCN(C(=O)C3(C(=O)OC(C)(C)C)C(C)(C)C3(C)C)CC2)cc1 1632158197 VEOVFDOAQUOWKE-UHFFFAOYSA-N 430.589 4.128 10 10 IICE Cc1cc(C(=O)NCc2nn(C)c3ccccc23)c(C)n1-c1ccc(Br)cn1 1633715394 MKVRWCCPCLXUPY-UHFFFAOYSA-N 438.329 4.068 10 10 IICE Cc1ccc(O)c(CNC(=O)[C@H](NC(=O)OC(C)(C)C)c2cccc(Br)c2)c1 1641733437 VZTCVMJVQFUECM-GOSISDBHSA-N 449.345 4.345 10 10 IICE COc1cc(N2CCC(Oc3cccc(Br)c3)CC2)c([N+](=O)[O-])cc1OC 1642555390 XWNPVGUJFASOHZ-UHFFFAOYSA-N 437.290 4.422 10 10 IICE CC[C@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C[C@@H](CC)O1 1643170980 LPACSVXVMFRGDC-CFUNFGEESA-N 438.640 4.146 10 10 IICE COc1ccc(N(C)CC(=O)Nc2cc(OC)c(NC(=O)c3ccccc3)cc2OC)cc1 1646865890 WORFOYSUNXZPGO-UHFFFAOYSA-N 449.507 4.040 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@@H]3c3ccc(Br)cc3)C2)cc1 1687022752 GUHMMCJBPPEDBK-FXAWDEMLSA-N 430.346 4.193 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cc2ccccc2nc1O 1687868963 PZBBWRVSRFYRDC-UHFFFAOYSA-N 430.302 4.140 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCCN(C(C)(C)C)CC2)cc1F 1696609498 DKYBRPSTDYBMHK-UHFFFAOYSA-N 444.643 4.431 10 10 IICE CCN(CC)c1ccc(Cn2c(N(C)CC3COC(C)(C)OC3)nnc2C(C)(C)C)cc1 1710027515 DTPMSKSNSGOWMN-UHFFFAOYSA-N 443.636 4.305 10 10 IICE CCN(CCn1c(CC(C)C)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1710159104 MSBZVLHCTCSXSR-UHFFFAOYSA-N 431.581 4.076 10 10 IICE Cc1nn(C)c(C)c1CN(C)c1nnc(CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1742663830 APTHSYXUMDXMRA-UHFFFAOYSA-N 449.647 4.284 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2C[C@@H](C)CC[C@@H]2C)n1Cc1ccc(N(C)C)cc1C 1750129307 BYKAJBBQFKOJHY-JQIPMYIQSA-N 441.620 4.050 10 10 IICE Cc1cc(-c2nnc(N3CCCOCC3)n2CCCOC(C)C)c(C)n1-c1ccccc1 1751410498 LOPQROARCPGLFB-UHFFFAOYSA-N 437.588 4.394 10 10 IICE COc1cc(OC)c(OC)cc1/C=C1\C(=O)N(Cc2ccccc2F)N=C1C(F)(F)F 1865678249 BDLCRKSDTXWCDL-ZSOIEALJSA-N 438.377 4.196 10 10 IICE CCOC(=O)c1c(NC(=O)c2ccc(CS(C)(=O)=O)o2)sc(C)c1-c1ccccc1 1865786659 VLHBJAAHCKFUDG-UHFFFAOYSA-N 447.534 4.290 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4ccc(C)cc4O)cc3)CC2)cc1 1872882630 QSFXLOODPOXISK-UHFFFAOYSA-N 431.536 4.284 10 10 IICE CC(C)(C)OC(=O)N[C@H]1C[C@](F)(CNCc2cc(Cl)cc(Br)c2O)C1 2043089956 GVVZCHMYYGMYOG-LAUQKZGBSA-N 437.737 4.293 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2(C)CC2)c(CN)c1I 2079023278 SZOIUESNCTYHTA-AWEZNQCLSA-N 425.314 4.011 10 10 IICE CC[C@H](c1ccc(OC)cc1O)n1nc(C(C)(C)C)c(N)c1I 2079848210 DZNIZHCEIQXBBF-GFCCVEGCSA-N 429.302 4.081 10 10 IICE Cc1ccc([C@H](C)NC[C@H]2CN(C(=O)OC(C)(C)C)CCN2Cc2ccccc2)c(O)c1 2084722864 TVSUZTCQYAVNNU-UNMCSNQZSA-N 439.600 4.473 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)[C@H]2CC[C@@H]21 2121183671 LULCLHIYIOIMOP-KBMXLJTQSA-N 429.330 4.171 10 10 IICE CCOc1ccccc1NC(=O)CCN1C(=O)C(=Cc2ccc(OC)cc2)SC1=S 2296756244 RNQVOSBOJQJXCW-UHFFFAOYSA-N 442.562 4.324 10 10 IICE CCN(CC)CN1C(=O)C(=C2SC(=S)N(c3cccc(C)c3)C2=O)c2ccccc21 2313621580 VQXQIAHIIFZESG-UHFFFAOYSA-N 437.590 4.417 10 10 IICE COc1ccc(C=C2SC(=S)N(c3cccc(Cl)c3)C2=O)c(C(=O)O)c1OC 2314929504 NOKMSLBWLJTMRH-UHFFFAOYSA-N 435.910 4.461 10 10 IICE CCCCc1ccc(N2C(=O)S[C@H](CC(=O)Nc3cc([N+](=O)[O-])ccc3O)C2=O)cc1 16926402 PVBTXUUJVHCREN-GOSISDBHSA-N 443.481 4.240 10 10 IICE CC[C@H](C)N1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 33723705 LJUHYEZKISXVTC-ZSRMJVKVSA-N 442.610 4.439 10 10 IICE Cc1ccccc1-n1c(C)cc(/C=C2\C(=N)N3N=C(N4CCCC4)SC3=NC2=O)c1C 102463927 BQKZSEGMGUOQQW-HORDIMCOSA-N 432.553 4.075 10 10 IICE CC(C)(C)OC(=O)NC1CCC(OCCNCc2cc(Br)ccc2O)CC1 394349488 YWDJIYXQHTYIFV-UHFFFAOYSA-N 443.382 4.097 10 10 IICE CCOC(=O)c1ccn(-c2ccccc2NC(=O)c2cc(C)n(-c3ccccn3)c2C)n1 731012118 GEYJHUKJZSMTKU-UHFFFAOYSA-N 429.480 4.104 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)Cc3coc(-c4ccc(F)cc4)n3)cc2F)C[C@@H](C)O1 733216841 AOMYCULHFBPARZ-HZPDHXFCSA-N 441.478 4.092 10 10 IICE COc1ccccc1N1CC[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)C1 757295553 QRCRLMZIPOFATM-OAQYLSRUSA-N 448.567 4.345 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)c2ccc(OCCN(C)C)cc2)C1 766634819 NQBTWLZGHGURPE-UHFFFAOYSA-N 448.611 4.011 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1Br 768827605 YKDAMCZXYHXIHU-UHFFFAOYSA-N 443.389 4.303 10 10 IICE CCN1CCN(c2ccccc2N[C@@H](C)c2ccc(N3CCOCC3)cc2Cl)CC1 777289507 DKVWSNWKOFRPBH-IBGZPJMESA-N 429.008 4.492 10 10 IICE O=C(NCc1csc(-c2ccccc2)n1)C(=O)N(Cc1ccccc1O)C1CCCCC1 788459502 AOUREBXGESPUBF-UHFFFAOYSA-N 449.576 4.493 10 10 IICE Cc1cccc(C(=O)NCc2cc(Br)ccc2O)c1NC(=O)c1ccncc1 804736556 VALIEGUYXAQYCS-UHFFFAOYSA-N 440.297 4.040 10 10 IICE CCOC(=O)c1c(NC(=O)c2cc(CN(C)C)on2)sc(C)c1-c1ccc(F)cc1 1124558803 XUROBMIZKMZIMM-UHFFFAOYSA-N 431.489 4.341 10 10 IICE COc1ccc(N2CCC(NC(=O)CC[C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1 1125816639 PFKMZKMIYYPCKN-LJQANCHMSA-N 445.604 4.208 10 10 IICE CCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1128384876 OVUSKUSSKOMVOC-MRXNPFEDSA-N 434.989 4.300 10 10 IICE COc1ccccc1C/C(C)=C/C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438541 NDVYRSWNSILNSK-ZDJZVTAXSA-N 428.960 4.324 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)C[C@H]1c1ccc(O)cc1 1141336546 ORPFXXLUORIAQN-XZOQPEGZSA-N 432.520 4.137 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N(C)c1ccc(OCC(=O)OC)cc1 1268949336 ZLCMXEMUXJGUTP-ZROIWOOFSA-N 434.492 4.252 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)Cc3csc(Cc4cccc(Cl)c4)n3)C2)cc1 1278861904 QLVMFAPNKIVSFE-GOSISDBHSA-N 441.984 4.334 10 10 IICE CCN1CCC[C@H]1CN(CCN(C)C)C(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1292581791 GIMJYSMNBUNUPW-QFIPXVFZSA-N 431.024 4.236 10 10 IICE COC(=O)[C@@H](C)[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1ccccc1 1294481968 PVPRDEZMBJGHCR-UUOWRZLLSA-N 432.520 4.495 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)[C@H](CO)c2ccc(Cl)cc2)CCCC1 1298309874 GVWWLCJFYLDNLE-HSZRJFAPSA-N 426.944 4.374 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1csc([C@H]2CC[C@H](C)CC2)n1 1299699457 RCNASBBYDVPOEF-QAQDUYKDSA-N 430.570 4.277 10 10 IICE Cc1cc(-c2nnc(N3CCCC3)n2CCC(=O)NC(C)(C)C)c(C)n1-c1ccccc1 1304196582 TVWHUOCGBLWNAV-UHFFFAOYSA-N 434.588 4.258 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3ccccc3OC3CCCC3)cc2F)CC1 1359920266 NWOTZNKSYKOVNP-UHFFFAOYSA-N 439.575 4.148 10 10 IICE COc1ccccc1[C@@H](CO)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1446734490 SORDBLNDQSBVEE-HXUWFJFHSA-N 443.341 4.329 10 10 IICE Cc1ccc(C(=O)NC[C@H]2CCCN(CC(F)(F)F)C2)cc1-n1c(C)cc(C=O)c1C 1450321506 ZJGQCSOBDXATBU-GOSISDBHSA-N 435.490 4.219 10 10 IICE CNC(=O)OC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1450705779 JIHHHCCYRLJITF-SFHVURJKSA-N 448.361 4.207 10 10 IICE Cc1ccc(CN(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1C 1460893315 BIQUWMFSMZXVHD-UHFFFAOYSA-N 428.444 4.259 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)[C@@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)cc2)CC1 1462809902 SVYABARCZGEYIH-LEWJYISDSA-N 446.378 4.115 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H]3c3ccc(Br)cc3)C2)cc1 1478861305 XWCBUDQFHGAYAS-IERDGZPVSA-N 444.373 4.441 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2ccc(OC(C)C)nc2)n1 1492500266 WOEDNFVAOOXBRT-UHFFFAOYSA-N 444.539 4.221 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ncc(Cl)n2C)cc1F 1517003819 QMLWTNYDNRSJSN-UHFFFAOYSA-N 447.990 4.143 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H]1C)OC 1518718209 DPKLQFCCURHNCJ-JLMWRMLUSA-N 437.588 4.249 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc4ccc(Cl)cc4n3)cc2F)CC1 1521009422 JDBQGKNVUNQQFP-UHFFFAOYSA-N 426.923 4.099 10 10 IICE CCOC(=O)N1[C@H](C(=O)NCc2ccc(N(CC)CC)cc2)CC[C@@H]1c1ccc(C)o1 1534245584 FSMNQOPNSSGFKZ-RTWAWAEBSA-N 427.545 4.413 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCCOc1ccccc1 1540560209 FHSTZTYLLYCNJG-XDJHFCHBSA-N 444.553 4.002 10 10 IICE CC[C@H]1NC(=O)N(c2cccc(NC(=O)Cc3cc(C)n(-c4ccccc4)c3C)c2)C1=O 1542525480 KCFMILVXKMHAKL-JOCHJYFZSA-N 430.508 4.110 10 10 IICE Cc1cccc(CN(CCN(C)C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c1 1542840815 WRTZFXNEOYBWDM-UHFFFAOYSA-N 431.580 4.348 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1 1543651084 AERADRFJODGDPX-VWLOTQADSA-N 429.564 4.230 10 10 IICE C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C[C@@H]1C 1544303440 XRLMFNMYHDXRLQ-UXHICEINSA-N 439.648 4.315 10 10 IICE O=C(CO[C@H]1CCCc2ccccc21)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632354 IXDUUSVLQBCPNF-REWPJTCUSA-N 428.960 4.220 10 10 IICE COc1cc2oc(=O)cc(C)c2cc1CCC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1584096235 VRBMCVJDAAUBMU-SFHVURJKSA-N 436.552 4.164 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC2(CC1)CC2(F)F 1586744334 DFABZQHGQOKVFT-PTNGSMBKSA-N 440.512 4.065 10 10 IICE CN1C(=O)C[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1ccc(Cl)c(Cl)c1 1595436043 QVUHTQLWSLWVBA-AVRDEDQJSA-N 446.378 4.429 10 10 IICE Cc1cccc(CN(C)c2nnc(-c3cnccn3)n2CCCSc2nccs2)c1 1611941271 PTROGILZQSORGI-UHFFFAOYSA-N 437.598 4.319 10 10 IICE CCN(CC)c1ccc(Cn2c(N3C[C@H]4CC[C@@H](OC)[C@H]4C3)nnc2C(C)(C)C)cc1 1615383720 YLRSWQNOTBZKET-BAGYTPMASA-N 425.621 4.331 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3CCC3CCCCC3)CC2)cc1 1616347316 PSVZFLYQWCLGSW-ILBGXUMGSA-N 429.649 4.003 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@H]3CCN(C(=O)COc4ccccc4)C3)c2C)c1 1617763344 VMMDEPQLPYISTF-QFIPXVFZSA-N 445.563 4.121 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)nc(C(F)(F)F)c3)cc2F)C[C@@H](C)O1 1625090619 VYJPGPVDWFZJIM-TXEJJXNPSA-N 445.844 4.437 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)Sc1nc2ccccc2s1 1627013404 CFNMQPIMEWTKNC-CQSZACIVSA-N 430.551 4.074 10 10 IICE O=C(CCc1cccc(F)c1Br)N(Cc1ccccc1O)C[C@H]1CCCO1 1631219062 LXTHSUIDGURHDL-QGZVFWFLSA-N 436.321 4.434 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C2(CNC(=O)OCc3ccccc3)CCCC2)c1 1631542672 LKRPOVNDWYQYLU-KRWDZBQOSA-N 426.513 4.065 10 10 IICE CCc1ccc([C@@H](C)NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1632103317 ASFXGGCRNXXYAL-CQSZACIVSA-N 430.551 4.308 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccccc3C(=O)c3ccccc3)cc2F)CC1 1632993846 IKMACBJWQXUKML-UHFFFAOYSA-N 445.538 4.129 10 10 IICE O=C(C[C@H]1CCc2sccc2C1=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635945739 AQWGNOCUXBVNBY-PBHICJAKSA-N 432.973 4.023 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC(C)(C)CN(C)Cc2ccccc2)cc1 1637874444 XQTXUAMUCADRNX-UHFFFAOYSA-N 431.580 4.476 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@H](C)C[C@@H](C(=O)OC(C)(C)C)C3)ccc21 1638264778 FTCFLQRWFRPFPX-OXQOHEQNSA-N 428.573 4.344 10 10 IICE C[C@]1(Cc2cccc3ccccc23)CCCN1C(=O)c1cc(NS(C)(=O)=O)ccc1O 1641129410 QUEDMEXDPLLDFH-XMMPIXPASA-N 438.549 4.154 10 10 IICE CCOC(=O)c1c(NC(=O)COc2cnc(SC)nc2)sc(C)c1-c1ccccc1 1641190441 SOMJZTJCLMTTGN-UHFFFAOYSA-N 443.550 4.430 10 10 IICE COc1cc(OC)c2c(c1)N(C(=O)/C=C/[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CCC2 1641445792 DKSKGQSDGQASEG-SXSDINLZSA-N 430.545 4.186 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC(c4ccc(C(C)(C)C)cc4)CC3)nc12 1643151033 PVBTYJHUHYAQNV-UHFFFAOYSA-N 436.556 4.289 10 10 IICE CC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)cc1F 1645071855 BUMCSMQBYMKDIB-FQEVSTJZSA-N 434.442 4.420 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@@H]3CCc4ccccc4NC3=O)cc2Cl)C1 1680561315 BVDPTLHDWQIEIP-HRAATJIYSA-N 440.975 4.329 10 10 IICE COc1ccc(N2CCCN(C(=O)NCC(C)(C)Oc3cc(F)cc(F)c3)CC2)cc1 1682246009 DAZKEEXSPXTZEM-UHFFFAOYSA-N 433.499 4.053 10 10 IICE CCO[C@@H]1C[C@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1696206656 ONXTVFORBSNSJR-BHIFYINESA-N 441.620 4.192 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)OC(C)(C)C1 1697995071 JDECVEWCFZZZJM-LJQANCHMSA-N 437.588 4.393 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@H](C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1708445085 DGTYYQKZJGPADD-IPMKNSEASA-N 429.584 4.298 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1727044893 LOFLUQQAYPJWJQ-KRWDZBQOSA-N 432.576 4.012 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](C)N2CCC[C@H](C)C2)n1 1761916912 SFJCXXBQDBHAAF-AZUAARDMSA-N 434.588 4.111 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@](=O)C(C)(C)C 1766389641 VBFCEOUIHFMTLD-PMERELPUSA-N 427.618 4.356 10 10 IICE CCN(CC(C)C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1766534508 HUJLGNTVYDIUFK-UHFFFAOYSA-N 434.588 4.016 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1770515355 ZMXJYSKIISVGIQ-YLJYHZDGSA-N 433.597 4.105 10 10 IICE COCCCCCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1771017763 NGLCDIRYVPEPCC-UHFFFAOYSA-N 427.593 4.088 10 10 IICE COc1cc(/C=C2/SC(=S)N(C[C@H](c3ccccc3)N3CCCC3)C2=O)ccc1O 1858594214 PTYNZGFWFKDUFX-ALDSOSFCSA-N 440.590 4.439 10 10 IICE O=C(O)Cc1ccc(N2C(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)cc1 1860073476 IQXKYGZDRDRHOF-OVCLIPMQSA-N 434.882 4.281 10 10 IICE CCCC1=NN(CC(C)C)C(=O)/C1=C/c1ccc(OCC(=O)N(CC)CC)c(OCC)c1 1865677380 GIRCHCFBDUYOME-XSFVSMFZSA-N 443.588 4.370 10 10 IICE CCc1sc(NC(=O)CCCO)c(C(=O)OC)c1-c1ccc(Br)cc1 1865944141 PPCWISDILXUTII-UHFFFAOYSA-N 426.332 4.238 10 10 IICE CCCNC(=O)c1c(NS(=O)(=O)c2cc(C)c(C)cc2OC)sc2c1CCCC2 1871342708 AGEIHZKWCZONDJ-UHFFFAOYSA-N 436.599 4.193 10 10 IICE COc1ccc(C=C2SC(=S)N(NC(=O)c3csc4c3CCCC4)C2=O)cc1 2040469681 HUBOXCPFYXWBJS-UHFFFAOYSA-N 430.576 4.182 10 10 IICE COc1cc(C=C2SC(=O)NC2=S)ccc1OCC(=O)Nc1ccc(Cl)cc1 2040482794 YYXMHQLFSVCZPP-UHFFFAOYSA-N 434.926 4.491 10 10 IICE CC[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCc1cc(Br)cc(F)c1O 2107376160 CTCAWJLJENADGW-BLLLJJGKSA-N 431.346 4.419 10 10 IICE Cn1c(C=Cc2cn(C)c3ccccc23)nc2ccc(I)cc2c1=O 2296754069 ZGUHVASTGPSNPJ-UHFFFAOYSA-N 441.272 4.200 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=Cc2ccc(OC)c(O)c2)cc1 2297311018 FTLFFLGUNHPJEK-UHFFFAOYSA-N 445.431 4.152 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N(c2cccc(C(=O)O)c2)C1=O)C(=O)O 2314927331 DFDOXHFMGMFJFV-HNNXBMFYSA-N 443.502 4.033 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)C2=Cc2cccc(OC)c2O)cc1 2332099722 XVVDWLYIRVKFFT-UHFFFAOYSA-N 432.451 4.379 10 10 IICE CCN(C[C@@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2380757670 FKDXDAYSNDPIIL-CQSZACIVSA-N 443.382 4.315 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](C)N(C(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2381128398 TXILMFNUCQJSLV-ZDUSSCGKSA-N 441.366 4.210 10 10 IICE CN(C)c1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)NCc2ccccc2Cl)cc1 823087 SWHCTEKROVNPMI-XQNSMLJCSA-N 433.939 4.493 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccccc2O)SC1=S)NCc1ccccc1 15045234 ZVUBNMBVBWSFOU-HKWRFOASSA-N 440.590 4.470 10 10 IICE Cc1[nH]c2ccccc2c1/C=C\c1nc2ccc(I)cc2c(=O)n1C 33432233 HFEVXMSLGWEKPW-NTMALXAHSA-N 441.272 4.498 10 10 IICE NC(=O)c1ccccc1NC1=NC(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)S1 39869847 AKAPGSDVQHKYNQ-WOJGMQOQSA-N 434.433 4.036 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2ccccc2NS(C)(=O)=O)c(C)n1-c1ccccc1F 108601171 CMUDPJMYZWGDEZ-OAHLLOKOSA-N 429.517 4.096 10 10 IICE O=C1N=C(Nc2cc(C(=O)O)cc(C(=O)O)c2)S/C1=C/C(Cl)=C/c1ccccc1 208341603 AWPYOZVRHVRVIY-CJRIVRODSA-N 428.853 4.288 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cc(C)ccc3OC)[C@@H]2c2ccc(O)c(O)c2)cc1 526445840 ASQKDDLSEHCMCM-HSZRJFAPSA-N 433.460 4.481 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3C)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526495596 KADLOZDIWYWUPP-HSZRJFAPSA-N 433.460 4.481 10 10 IICE CC(C)NC(=O)[C@H](C(C)C)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 606671882 ACODGNACFTUZCN-MZLJFPOFSA-N 441.416 4.200 10 10 IICE CCOc1c(F)cccc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 742749690 KEDYLYSKYSEDQZ-HXUWFJFHSA-N 445.535 4.286 10 10 IICE CSc1ccccc1CN(C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 792158465 PHLQRCSZOWCVIE-UHFFFAOYSA-N 438.641 4.282 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)cc1F 804852128 ZZBFUVVPVVPPRU-GOSISDBHSA-N 448.542 4.228 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2 804969452 PZGUZWPRKSTOLZ-GOTSBHOMSA-N 437.559 4.358 10 10 IICE C[C@@H]1CN(c2ccccc2NC(=O)NCc2cc(Br)ccc2O)C[C@@H](C)O1 806217677 NXWBXRVADUCOKS-ZIAGYGMSSA-N 434.334 4.090 10 10 IICE COc1cccc(-c2nsc(NC(=O)NCc3cc(Br)ccc3O)n2)c1 806399746 YZYCRLFEODEMQA-UHFFFAOYSA-N 435.303 4.004 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@]2(CCCOC2)C1 812147949 OJYCSVNKXXHWKN-VWLOTQADSA-N 435.572 4.006 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCCN2Cc2ccc(N3CCOCC3)c(F)c2)C1 816658274 JDVVTLMEUSGCGH-UNMCSNQZSA-N 447.595 4.274 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cc(Cl)ccc2Br)N(C)C)cc1 1134681868 KQSJHEQNFNBGAC-LJQANCHMSA-N 438.797 4.130 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)c1 1140930543 SWQNGSMGWWOPOR-XPWALMASSA-N 434.540 4.030 10 10 IICE CCc1nnc(NC(=O)[C@H](C)[C@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)s1 1157071478 JYQBVKJLGLQBOL-KGLIPLIRSA-N 443.548 4.040 10 10 IICE Cc1cc(C(=O)NCc2nc(C(C)(C)C)n[nH]2)c(C)n1-c1ccc(Br)cc1 1161344379 RBZBJFNHPQTIED-UHFFFAOYSA-N 430.350 4.202 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cccc(COc4cccc(C=O)c4)c3)C2)cc1 1166215752 KRCDPILYZYSDAB-JOCHJYFZSA-N 430.504 4.095 10 10 IICE COc1ncc(Br)cc1CNC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 1253177571 ROEIIDWZIDFGQJ-UHFFFAOYSA-N 435.366 4.039 10 10 IICE COC[C@@H](Cc1ccccc1)N(C)C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1271596329 OFEHGVLJPMQWRY-JOCHJYFZSA-N 433.596 4.124 10 10 IICE CC(C)(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)cc1 1275224316 CLLCQKNAVSQEPO-UHFFFAOYSA-N 442.428 4.414 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@@H]1COCc2ccccc21 1276417823 GFZBXIRBKUQTNV-AUUUKSDWSA-N 444.603 4.117 10 10 IICE Cc1cc(-c2nnc(N3CCC(C)CC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1289359581 QGRZJJHUVWQJQK-UHFFFAOYSA-N 434.588 4.067 10 10 IICE C[C@@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1291089842 MBDHLFDPGYCXRH-GOSISDBHSA-N 429.584 4.226 10 10 IICE CC[C@H](C)[C@@H](Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1291419624 NSYDCRQRGYUIQH-XKCSPQBFSA-N 441.620 4.080 10 10 IICE COc1cccc(N(CC(=O)NCc2ccc3c(c2)CCCN3C)C(=O)OC(C)(C)C)c1 1292207607 XDQLXEHJMSQQNQ-UHFFFAOYSA-N 439.556 4.136 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@](C)(O)CSc1cccc(F)c1 1294684070 DNTQZNGKBHGZCF-LJQANCHMSA-N 442.350 4.186 10 10 IICE C[C@@H](NC(=O)N[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccc(N(C)C)cc1 1312530554 DQEDSXKJWHYELM-QAPCUYQASA-N 439.510 4.270 10 10 IICE CCO[C@@H](CCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)C1CCCC1 1314061146 VAJIRFLFHFROKI-GGAORHGYSA-N 442.604 4.500 10 10 IICE Cc1cccc2c1CCN(C(=O)CCN1C(=O)/C(=C/c3ccc(F)cc3)SC1=S)C2 1435087262 INKBZDCXPNIKEN-MOSHPQCFSA-N 440.565 4.310 10 10 IICE O=C(c1cc2cccc(C(F)(F)F)c2nc1O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446566538 LOHSUGMTCQPBHN-INIZCTEOSA-N 446.425 4.486 10 10 IICE CC(C)(C)N1C(=O)C[C@H](C(=O)NCc2c(O)cccc2F)[C@@H]1c1ccc(Cl)c(F)c1 1456031023 WCGQLJUTNONNLX-RBZFPXEDSA-N 436.886 4.328 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)O[C@]3(CCOC3)C2)c(C)n1-c1ccc(Br)cc1 1467423992 PDQYDIKOANNHQD-JOCHJYFZSA-N 447.373 4.267 10 10 IICE COCCN1[C@@H](C)CN(C(=O)c2cc(C)n(-c3ccccc3Br)c2C)C[C@H]1C 1469410685 LSGWPGHNTYPMMI-CALCHBBNSA-N 448.405 4.038 10 10 IICE CCOC(=O)[C@@H](Cc1cc(Cl)cc(Cl)c1)NCc1cc(F)cc(C(C)=O)c1O 1473699073 ASITZDTZTZOECK-GOSISDBHSA-N 428.287 4.305 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@](C)(O)C1CCCCC1 1517149883 WEFLWBNAIMVUQR-URXFXBBRSA-N 428.577 4.193 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NC[C@H]1CCCCC(F)(F)C1)c2[N+](=O)[O-] 1523817378 FXSUHSCEMLZEII-ZDUSSCGKSA-N 442.418 4.316 10 10 IICE CCCOc1nc2ccccc2cc1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1528266467 KDMXLADLMMVKGD-UHFFFAOYSA-N 441.478 4.068 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCOc3ccccc3C(C)C)cc2F)CC1 1530377117 OGHIHXGBYBTHHB-UHFFFAOYSA-N 427.564 4.176 10 10 IICE COC(=O)[C@@]1(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)CCCN(Cc2ccccc2)C1 1530623336 PHUCACSNUVYMOT-HHHXNRCGSA-N 445.563 4.032 10 10 IICE COc1cc(Cl)c(F)c(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 1537458668 HRZLRMPHIUDAFP-UHFFFAOYSA-N 428.838 4.488 10 10 IICE C[C@@H](NC(=O)[C@@H]1CSCN1C(=O)c1ccc(C(C)(C)C)cc1)c1ccc(N(C)C)cc1 1537679055 DOZMFABVJKGWFI-VGSWGCGISA-N 439.625 4.443 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3n[nH]c4ccc(Br)cc34)cc2)CC1 1543142615 GXWSSWVYPVEZES-UHFFFAOYSA-N 427.346 4.492 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1ccccn1 1543715014 IQHWTYKEFZVYCC-SSZFMOIBSA-N 445.635 4.219 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NC[C@@](O)(c2cccc(C(F)(F)F)c2)C(F)(F)F)cc1 1544636510 FIRLZRRIWVUNDZ-MRXNPFEDSA-N 448.323 4.048 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)NCc2ccccc2O)C1 1565048792 SVUJRJDBIWUFPN-WOJBJXKFSA-N 443.519 4.124 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCO[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1 1566255188 IRAPBMQTIVPMBD-KNQAVFIVSA-N 441.572 4.157 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2c(Br)ccc(Cl)c2[nH]1 1583335009 RCWMZGKBJBJIJV-UHFFFAOYSA-N 448.748 4.350 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CCSC2(CC(C(=O)NCc3cc(Cl)ccc3O)C2)C1 1583820590 IPAJFEQLGHXYOU-PKAMJGAUSA-N 440.993 4.231 10 10 IICE Cc1cc(CC(=O)Nc2ccc(S(=O)(=O)NC(C)(C)C)cc2)c(C)n1-c1ccccc1 1584869335 SQLOZIOLYVQESJ-UHFFFAOYSA-N 439.581 4.352 10 10 IICE CCOC(=O)c1ccn(-c2ccc(NC(=O)c3cc4cc(O)c(O)cc4s3)cc2F)n1 1586982787 FUVOOUHWJZQJCO-UHFFFAOYSA-N 441.440 4.066 10 10 IICE CC1(C)CC[C@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)OC1 1596542123 DKFICMSPSSRPSF-VQCBNXJZSA-N 438.640 4.051 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2cccc(F)c2)c(C)n1-c1cccc(Br)c1 1625147711 GQDOGVVVVPIGRI-HXUWFJFHSA-N 445.332 4.329 10 10 IICE Cc1cc(Br)cc(C)c1N1CCC[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 1627048425 UKRKZHXZGDSTHY-POZKEBTKSA-N 445.357 4.276 10 10 IICE Cc1cccc(N2CCN(CCC(=O)NCc3ccc(N4CCC(C)CC4)cc3)CC2)c1 1628609186 XNQKTGFQRVOOEH-UHFFFAOYSA-N 434.628 4.060 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2ccccc2N2CCOCC2)c1 1628941981 QANOGAUSLCMILP-UHFFFAOYSA-N 431.536 4.015 10 10 IICE Cc1csc(NCCNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)n1 1629476092 GFUYNIWKVVKQBA-UHFFFAOYSA-N 433.375 4.463 10 10 IICE COc1cc(C(=O)Nc2cccc(N3CCN(CCc4ccccc4)CC3)c2)ccc1F 1632692447 YMDTXOKNXLPFET-UHFFFAOYSA-N 433.527 4.451 10 10 IICE Cc1onc(-c2cccc(Cl)c2)c1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1633789165 DOSFHBFPTLPQCK-UHFFFAOYSA-N 425.916 4.195 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC(Cc3nncn3C)CC2)cc1 1635337368 PJVDMKGYPYAPCV-UHFFFAOYSA-N 431.544 4.391 10 10 IICE COC(=O)C1CC2(C1)C[C@H](NC(=O)c1cc(C)n(-c3ccc(F)cc3)c1C)CCS2 1640199298 FTGJWQLPLNRWCX-BISSLNBESA-N 430.545 4.180 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cn2c(C)c(Br)c3ccccc32)cc1 1644437692 HKWIXRJUECFKTQ-UHFFFAOYSA-N 444.373 4.316 10 10 IICE COc1ccc([C@@H](CNC(=O)OC(C)(C)C)CN(C)c2ccc(OC)cc2OC)cc1 1652957659 NBIACBJHHRGMNF-SFHVURJKSA-N 430.545 4.457 10 10 IICE CCCN(C[C@H]1COc2ccccc2O1)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1673745898 YOGSARNDDIAEDG-UGKGYDQZSA-N 425.573 4.254 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCC[C@H](C(F)F)C1 1693005368 HMMQFQSOKRSPSA-FQEVSTJZSA-N 440.542 4.168 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@H]1C 1695815327 WWYKQJVOPNYNKR-WOJBJXKFSA-N 438.664 4.216 10 10 IICE COc1cccc(-c2nnc(N3CCCO[C@H](C)C3)n2CCCSc2nccs2)c1 1697520359 HEYUXDRWWAWGDU-MRXNPFEDSA-N 445.614 4.208 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(C3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1706528460 MXLOMEBRWABPHN-HXUWFJFHSA-N 429.584 4.440 10 10 IICE CCc1nnc(N2CCS[C@@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1709165296 MNCFCIODEMGZHK-HXUWFJFHSA-N 431.675 4.020 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC[S@](=O)CC)C1 1709288451 IDWKGJNHJPFFFW-PKHCJMHPSA-N 439.629 4.358 10 10 IICE CN(C[C@H]1CCCOC1)c1nnc(-c2ccccc2)n1CCCSc1nccs1 1711153696 VQYRKCUULMFZGY-QGZVFWFLSA-N 429.615 4.447 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2noc3c2COCC3)n1CCCSc1nccs1 1727056328 ZSUDSDDEWLCYMS-AWEZNQCLSA-N 448.618 4.127 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCC(=O)N1 1743819081 QSKJYZKZIBDBTP-FXAWDEMLSA-N 434.588 4.114 10 10 IICE CC(C)[C@@H]1CN(c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1760966435 WFLVNIKPVHXQDH-FQEVSTJZSA-N 428.581 4.104 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCN(CCC(C)(C)C)CC1 1761698637 SANOEWJTWKPKLM-UHFFFAOYSA-N 440.680 4.458 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@H](O)c1ccc2c(c1)CCCN2C 2044730426 OIXBSIVGNREZCO-ISKFKSNPSA-N 439.600 4.128 10 10 IICE C[C@H](c1cc([N+](=O)[O-])ccc1O)n1ncc(C2CCCC2)c1I 2070258431 GKMRSOZEQAYAOG-SNVBAGLBSA-N 427.242 4.368 10 10 IICE COC(=O)c1c(C2CC2)nn([C@H](C)c2cc(C)c(C)cc2O)c1I 2079980657 HXROXKKJGDLDLK-LLVKDONJSA-N 440.281 4.083 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CNCc2cccc(Br)c2O)CC12CCC2 2116697736 DKWMFZGBSMRIQG-AWEZNQCLSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2C[C@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c1O 2236055872 SBCNLKOBROFBCV-WOSRLPQWSA-N 441.366 4.041 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)C1=Cc1ccc(N2CCCC2)c(F)c1 2294106398 GUFTZESLDUFUEB-UHFFFAOYSA-N 448.281 4.399 10 10 IICE CCN1C(=O)C(=Cc2cc(Br)ccc2OCc2cccc(F)c2)NC1=S 2297316413 QOQCLYSGPNOSPX-UHFFFAOYSA-N 435.318 4.245 10 10 IICE CC[C@H](C)N1C(=O)C(=Cc2cc3cccc(C)c3nc2N2CCOCC2)SC1=S 2314648143 QQFLWQGGWUVRCM-HNNXBMFYSA-N 427.595 4.380 10 10 IICE Cc1ccc(CNC[C@H]2CC3(CC3)CN2C(=O)OC(C)(C)C)c(O)c1Br 2352940965 KNXLQWIJSYTCCG-OAHLLOKOSA-N 425.367 4.342 10 10 IICE COC[C@@H](C)NC(=O)CSc1ncc(-c2ccc(Cl)cc2)n1Cc1ccccc1 11215082 GPEWISDDGLERNJ-MRXNPFEDSA-N 429.973 4.495 10 10 IICE NS(=O)(=O)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc([N+](=O)[O-])cc1)N3C[C@H]1CC=C[C@H]21 35337453 FUJFNZKSUFSRDU-WPUDHWPRSA-N 449.532 4.137 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(OC)c(OC)c3)[C@H]2c2ccc(O)c(O)c2)c1 526383574 YQIQZSLLPSWSQK-QHCPKHFHSA-N 449.459 4.181 10 10 IICE Cc1cc(C(=O)CSc2nnc(OC(C)C)s2)c(C)n1-c1ccc2c(c1)OCO2 743817872 QGYXZXRPJOZMQY-UHFFFAOYSA-N 431.539 4.437 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cccc(COC2CCOCC2)c1 769665300 SGQLAAXVSBGWEM-UHFFFAOYSA-N 441.483 4.410 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1 779401779 YCEDBJBLGNKGBT-JWQCQUIFSA-N 436.600 4.271 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC[C@H](C(F)(F)F)[C@H]2C)c([N+](=O)[O-])c1Br 795191581 GVKZBJHJRYADCS-RQJHMYQMSA-N 428.161 4.051 10 10 IICE O=C(NCc1cc(Br)ccc1O)N[C@@H]1c2ccccc2CC12CCOCC2 811955000 JNNXHMCFBMCFNG-LJQANCHMSA-N 431.330 4.048 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c(C)n1-c1cccc(C(C)C)c1 918207401 XVUNJJIJSKLLNN-KRWDZBQOSA-N 439.581 4.356 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3cc(C)ccc3C(C)C)CC2)c(OC)c1 1132032465 YLVNMQBEOBUAJA-IBGZPJMESA-N 426.557 4.252 10 10 IICE Cc1ccc(CCC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134883218 ZIMIYYRIHGALAP-OAQYLSRUSA-N 432.406 4.175 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Sc1ccccc1Cl 1137816880 UGFUZQZUAFTTEO-GFCCVEGCSA-N 428.337 4.381 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cc1 1139740234 TWQPOUQJVWOVHN-RTBURBONSA-N 446.551 4.096 10 10 IICE Cc1ccc([C@H](NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C2CC2)cc1 1141272774 DUGGFZZKJYBBQA-NRFANRHFSA-N 442.562 4.444 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)Cc2cccc(OC(F)(F)F)c2)cc1 1142712861 IYVVJVPHSVZTDO-OAQYLSRUSA-N 436.474 4.402 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cn1ccc2ccc(F)cc21 1156287354 NSQDGIXLVRLICT-UHFFFAOYSA-N 425.504 4.169 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)c1 1161579997 BITZTQIZUZTVQP-UHFFFAOYSA-N 446.525 4.447 10 10 IICE Cc1cc(CNC(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)n1-c1ccccc1 1225398839 RRXHTHIEZNKTDZ-KRWDZBQOSA-N 425.554 4.058 10 10 IICE CC(C)[C@H](Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1287162446 MRODVMXXTKIZGT-IBGZPJMESA-N 443.592 4.437 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1sc([C@H]2CCOC2)nc1C 1294685685 RQSOZBSKEWNOCX-LBPRGKRZSA-N 425.348 4.086 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CCCCCC[C@H]2NC(=O)OC(C)(C)C)cc1 1300281489 RZSADVMPWHWNTC-FGZHOGPDSA-N 447.620 4.454 10 10 IICE COCC(=O)N1CCCc2ccc(NC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)cc21 1304167577 UKDXGXSNXAGZSO-UHFFFAOYSA-N 435.499 4.411 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CC[C@@H](CC(C)C)C1 1304238877 YAGUPPZFYMMDTG-UNMCSNQZSA-N 425.621 4.467 10 10 IICE Cc1cc(-c2csc(NC(=O)C[C@H]3CCCS3(=O)=O)n2)c(C)n1-c1ccc(F)cc1 1306327328 DLHDGAIACJTTKS-QGZVFWFLSA-N 447.557 4.263 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CCC[C@H]3C)nnc2[C@]2(OC(C)C)CCOC2)cc1 1313678262 GFBHPBKHVMIVCQ-NLFFAJNJSA-N 441.620 4.202 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@H](CO)c2nc(-c3ccccc3)no2)c1 1322625905 DQQOSYRZXPNXQK-HXUWFJFHSA-N 436.899 4.261 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(C(CC)CC)C2)sc2c1CC[C@H](CC)C2 1349974186 HXKBZIOWPZPEOB-GJZGRUSLSA-N 434.602 4.415 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CCCc3cc(Br)cc(F)c32)C1 1352289861 PEROTZVUKRQZEB-OAHLLOKOSA-N 439.325 4.481 10 10 IICE CCc1ccccc1N1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CC1=O 1360071812 IWHHGIQHAQMHOR-IBGZPJMESA-N 447.501 4.259 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC([C@@H]2CCOC2)CC1 1361097701 GPFQRBTUVYZUBT-JOCHJYFZSA-N 425.621 4.152 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC[C@@H](C2CCCC2)C1 1436907635 CSCAOKJUXZJIHS-MCRQTXEHSA-N 432.586 4.456 10 10 IICE CC(=O)Nc1cc([N+](=O)[O-])c(Cl)cc1C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1440682954 KELOGVYRQLXCSG-UHFFFAOYSA-N 444.919 4.469 10 10 IICE Cc1cc(C(=O)CN2C(=O)NC3(C[C@H](C)C[C@@H](C)C3)C2=O)c(C)n1-c1ccc(F)cc1 1458997887 OKHNHONUMGAJFF-HUUCEWRRSA-N 425.504 4.163 10 10 IICE COC(=O)c1cc(-c2ccccc2CNC(=O)c2sccc2-n2c(C)ccc2C)[nH]n1 1466473057 DHNJKTPCVHHGJK-UHFFFAOYSA-N 434.521 4.262 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@H]2CCCOC2)n1CCC(C)(F)F 1517122666 ZJKXRQSRJJWDLE-IBGZPJMESA-N 433.547 4.454 10 10 IICE Cc1csc([C@@H](C)CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1521500937 IUENIMNCCSGLMQ-PFSWGADMSA-N 449.598 4.102 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc4c(Cl)nccc4s3)cc2F)CC1 1528701682 OKFYBTSYIRMQFJ-UHFFFAOYSA-N 432.952 4.161 10 10 IICE O=C(CCSc1ccc(F)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1535560546 CAVQIBJWQZVCPO-UHFFFAOYSA-N 427.589 4.156 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCCN(Cc3ccc(F)cc3)CC2)cc1 1539984079 HTNGWEOAXQSYBA-UHFFFAOYSA-N 447.554 4.323 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccccc3C(=O)N3CCOCC3)c2C)c1 1540645205 OJXMXIJNJWPKDI-UHFFFAOYSA-N 431.536 4.436 10 10 IICE Cc1ncc(CN(C)c2nnc(-c3ccccn3)n2CCCSc2nccs2)s1 1542955410 JKMRQGXVPIAVMW-UHFFFAOYSA-N 443.627 4.380 10 10 IICE COc1cc(CN2CC[C@@H](NC(=O)c3sccc3-n3c(C)ccc3C)C2)cc(OC)c1 1545471625 JITTWPUAUPHJJL-LJQANCHMSA-N 439.581 4.177 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CCCC[C@]3(C)NC(=O)OC(C)(C)C)C2)cc1 1557133383 JXBYQCKOKQVRRM-QLWBXOBMSA-N 445.604 4.111 10 10 IICE Cc1ccc(C(=O)NCc2cc(Cl)ccc2O)cc1S(=O)(=O)Nc1ccc(F)cc1 1583817988 WRWRXHHVMNKRDI-UHFFFAOYSA-N 448.903 4.224 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3csc(Cc4ccc(F)cc4)n3)C2)cc1 1585665253 OTUGPQKJNACXOG-QGZVFWFLSA-N 425.529 4.138 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C(F)(F)F)c(C)n1-c1ccc(Br)cc1 1586561150 QCRNHAWWKHQJDC-MRXNPFEDSA-N 431.252 4.260 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCCN3Cc3ccc(Cl)cc3)CC2)cc1 1596732834 IPMBDQIKAIWCSY-QHCPKHFHSA-N 427.976 4.052 10 10 IICE CC(C)=CCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1597893138 QCANQCHQWQTHTJ-QFIPXVFZSA-N 439.604 4.001 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2C[C@]2(C)CN(C)C2=O)c(C)n1-c1ccccc1 1611934123 WHOZRDZRWPQECN-SANMLTNESA-N 448.615 4.313 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)N(C)C)cc1 1618634917 CIPREAHFJCLNQB-DEOSSOPVSA-N 443.551 4.231 10 10 IICE CCOc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1CO 1622760434 VCCXZGJYPOYEEP-UHFFFAOYSA-N 444.329 4.395 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3CC(O)(c4cccc(Cl)c4)C3)cc2F)C[C@H](C)O1 1625090035 MPGPSGQZNFLHAN-CEWCGBLVSA-N 446.950 4.007 10 10 IICE COc1cc(CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)ccc1OCCN(C)C 1627100365 OEMJAOSDLBDXQJ-UHFFFAOYSA-N 435.568 4.282 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](OC(=O)N(C)C)C2)c(C)n1-c1ccc(Br)cc1 1627947759 QLFJTAJZLQQYNX-SFHVURJKSA-N 448.361 4.159 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3ccccc3Br)c2C)[C@@]12CCCO2 1633710344 JOVWCYHWNFRUEC-SJBKTWHCSA-N 447.373 4.313 10 10 IICE Cc1cc(C(=O)N(C)CCN2CCOC(C)(C)C2)c(C)n1-c1cccc(Br)c1 1635612083 LTTFOGMWPYZHQP-UHFFFAOYSA-N 448.405 4.039 10 10 IICE Cc1cc(C(=O)Nc2cccc(N(C)C(N)=O)c2)c(C)n1-c1ccc(Br)cn1 1635669264 QLRIQDMHILENHA-UHFFFAOYSA-N 442.317 4.019 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H]1CC(=O)N(c2cccc(C)c2C)C1 1635673528 QGUSZVWGICKPQX-QGZVFWFLSA-N 445.357 4.173 10 10 IICE CCc1nc(-c2ccccc2NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n[nH]1 1636442693 FARAQNXXUGZYSH-UHFFFAOYSA-N 427.508 4.435 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)[C@]12CCCO2 1638249474 DOTNDBXIUZUURE-TUNNFDKTSA-N 447.373 4.313 10 10 IICE COc1cc(OC)cc(C2(C(=O)NCc3cccc(Br)c3O)CCCC2)c1 1640088289 PMEIWZIPRMLREC-UHFFFAOYSA-N 434.330 4.300 10 10 IICE Cc1cc(C(=O)N2CCCNC(=O)[C@@H]2Cc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1641595857 GFIJEXBQSKCSGD-QHCPKHFHSA-N 435.955 4.321 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@@H](c2ccncc2)C1 1641886588 RXRSVGNGIYESBW-OKSBFYSISA-N 443.619 4.141 10 10 IICE Cc1cc(-c2nc(C)c(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)s2)ccc1F 1646435407 QSBFLTDXCGDHGS-UHFFFAOYSA-N 439.556 4.457 10 10 IICE CCN(CCc1cccs1)[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1657081183 XCEQORIKDWFGJP-MRXNPFEDSA-N 432.545 4.415 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3ccc(Cl)cc3)cc2F)C[C@@H](C)O1 1658641039 XAMTZKBAVMGDPQ-IAGOWNOFSA-N 447.982 4.234 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@](CO)(C(C)C)C2)sc(C)c1-c1ccccc1 1658832381 BVVKRVDMTOOLAX-XMMPIXPASA-N 444.597 4.179 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C(=O)OC(C)(C)C 1684534145 VONHMWLDIULEQF-FSSWDIPSSA-N 442.604 4.359 10 10 IICE Cc1cccc([C@H]2C(=O)NCCN2C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1 1684599733 IXRQDXIEYOWCFT-DEOSSOPVSA-N 430.552 4.094 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC(C)(C)c2ccc(Br)cc2)N(C)C)cc1 1685681413 GEUYJFPXNVSRKQ-FQEVSTJZSA-N 447.421 4.352 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(NC(=O)NCc3cc(Cl)cc(Cl)c3O)CCC[C@@H]12 1685756793 RJESXEUQXGJJRZ-QRWLVFNGSA-N 444.359 4.430 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCO[C@@H](C(C)(C)C)C1 1693005203 FLOCIXHGTBXFFJ-JOCHJYFZSA-N 434.588 4.014 10 10 IICE CCC[C@@H](Cn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1695109722 BOHRMRCWUVGBCS-IBGZPJMESA-N 447.599 4.156 10 10 IICE CCO[C@@H](CCn1c(C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)C1CCCC1 1695997989 AGMMBEWOODJVGZ-DEOSSOPVSA-N 441.620 4.297 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCC[C@@H](COC)C2)cc1 1710028027 OGHRGRYIXKGTOS-HSZRJFAPSA-N 448.615 4.021 10 10 IICE CCN(CC)C1CCN(c2nnc(-c3cccn3C)n2Cc2ccc(N(C)C)cc2C)CC1 1710042019 CCKPHXFFHMGLRB-UHFFFAOYSA-N 449.647 4.017 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)CC1 1711596221 SRSCZLICEKIHSZ-VWLOTQADSA-N 434.588 4.158 10 10 IICE COCC1(Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)CCCCC1 1712202910 XPNPOPYPOCYJNT-FQEVSTJZSA-N 428.577 4.111 10 10 IICE CCOCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1 1728958475 GRCOHPVRSGIPMW-UHFFFAOYSA-N 437.588 4.252 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCN(C2CCC2)C[C@@H](C)C1 1742141808 PDRXDJIOLMYRCN-HXUWFJFHSA-N 438.664 4.210 10 10 IICE COc1cc(/C=C2/SC(=S)N(Cc3ccco3)C2=O)cc(Br)c1O 1858586664 FGINLFWPNOWYKO-NTUHNPAUSA-N 426.313 4.158 10 10 IICE CC(C)CNCc1ccc(N(C)C[C@H](O)COCc2ccccc2)cc1Br 1916345139 SMIYLJDLZKASAP-NRFANRHFSA-N 435.406 4.209 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(CCC[C@@H]2NCc2ccc(Br)cc2O)C1 1918965351 UJOOTSFELIJUCB-PXNSSMCTSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H](NCc2cc(Br)cc(F)c2O)C1 1962885063 TZUJVLOERPYHBO-DOMZBBRYSA-N 431.346 4.467 10 10 IICE C[C@H](NC[C@H]1CN(C(=O)OC(C)(C)C)CCN1Cc1ccccc1)c1ccccc1O 2025252382 SQEQCJIEUYFVEA-FPOVZHCZSA-N 425.573 4.164 10 10 IICE Cc1cc(C=CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c(C)n1Cc1ccco1 2040481956 DWCOQMRSFUWIMS-UHFFFAOYSA-N 433.552 4.255 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(C)(C)C)c(CO)c1I 2079032738 JCQADZFPUQOYJU-CQSZACIVSA-N 428.314 4.291 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2ccc(Br)cc2O)[C@@H]2CCCC[C@H]21 2122810969 DRUGUFUCHYIJEN-YESZJQIVSA-N 425.367 4.422 10 10 IICE COc1ccc(Br)c(CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c1O 2236050663 IWTNURINJQXCAF-AGUYFDCRSA-N 441.366 4.183 10 10 IICE COc1ccc(Br)c(CN[C@H]2CC[C@H](CCNC(=O)OC(C)(C)C)C2)c1O 2236056174 UOPSYWCOXLEHJG-KGLIPLIRSA-N 443.382 4.336 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3ccc4nccnc4c3)SC2=S)cc1OC 2296605715 WBNALYWBZQAZMO-UHFFFAOYSA-N 437.546 4.091 10 10 IICE CCCN1C(=O)C(=C2C(=O)N(CCC)c3ccc(Br)cc32)SC1=S 2296711234 FAYUWCPXHWUSLW-UHFFFAOYSA-N 425.373 4.187 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)C2=Cc2ccc(OC)c(O)c2)cc1 2332100049 GCKKEMMVFLWIGB-UHFFFAOYSA-N 430.460 4.253 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCC[C@@H](C)N2C(=O)OC(C)(C)C)c(O)c1Br 2380744112 BFVXDVQLKYHJAM-UKRRQHHQSA-N 441.366 4.257 10 10 IICE Cc1ccc(CN(C)C(=O)O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2380787143 QDGUUUQDQFUPEM-CQSZACIVSA-N 443.338 4.041 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc(OC)c1O)N2 14460017 ZDWGRAJKBSZWAF-KLMMPHRKSA-N 428.554 4.304 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccc(C)cc3C)=NC2=O)ccc1OCC(=O)O 16916121 HCPSGOAEKBROPW-YBFXNURJSA-N 426.494 4.248 10 10 IICE CC1=NN2C(=N)/C(=C\c3cc(C)n(-c4ccc(Br)cc4)c3C)C(=O)N=C2S1 33469992 DJTNNQGMSCUNEE-BGQXKEBWSA-N 442.342 4.496 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(OC)c1O)N2 251401555 ZDWGRAJKBSZWAF-XOTWJMMUSA-N 428.554 4.304 10 10 IICE Cc1nc(C)n(-c2ccccc2NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)n1 435908622 WBNMDBKLKFMUST-UHFFFAOYSA-N 442.567 4.244 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)C1 436021648 JJIXFMNIWHSARW-LVXARBLLSA-N 431.580 4.444 10 10 IICE C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1ccc(N2CCOCC2)cc1Cl 762642234 KYCIFXOESDTJGZ-LLGFUMIMSA-N 438.012 4.473 10 10 IICE O=C(N[C@@H]1CCCc2cn(C3CCCC3)nc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 764764584 ZRYVUPHFOWVFRQ-FCHUYYIVSA-N 438.572 4.472 10 10 IICE C[C@H](NC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)c1ccc(N2CCOCC2)cc1 770278647 JMLSQFZZXVHTBU-KRWDZBQOSA-N 427.504 4.009 10 10 IICE C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1ccc(N2CCCCC2)cc1 773104203 NILVTSRFZXEGJZ-NRFANRHFSA-N 441.641 4.453 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)c(O)c1 794378569 YPZZFRWGABERLI-NDXORKPFSA-N 442.943 4.144 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12 819760721 HXFWEBIZUMRXDS-UHFFFAOYSA-N 429.419 4.081 10 10 IICE CCCN(CCC)c1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(OCC)cc3)C2=O)cc1 1084059865 HCJFDJMLJOFOSB-XLNRJJMWSA-N 435.524 4.378 10 10 IICE CN(C)c1cccc(COC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c1 1126421411 BBHYJHGSNDWILI-CPNJWEJPSA-N 444.553 4.226 10 10 IICE Cc1cc(CNC(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)c(C)n1-c1ccccc1 1132048160 LHWNKOUIKXQKDZ-UHFFFAOYSA-N 436.455 4.318 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cn(-c3ccccc3)nc2C(C)(C)C)N(C)C)cc1 1134681873 KSNXSARMFABGDS-QHCPKHFHSA-N 433.600 4.269 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cccc(C)c1F 1175569935 SBIYOTSUPBQRMP-HDICACEKSA-N 431.527 4.030 10 10 IICE O=S(=O)(CCSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)Nc1ccccc1 1188564793 KRLBRGGRUXWISZ-FQEVSTJZSA-N 443.594 4.263 10 10 IICE CC1(C)CN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2cccc(Cl)c21 1229782889 ZXRNZRMLLNSEQX-UHFFFAOYSA-N 435.902 4.462 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3C[C@@](CO)(c4ccccc4)C3)cc2Cl)C1 1235832702 GFDMJDXVDVNNPG-CTIGNXTNSA-N 442.003 4.468 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(Cc2nc3ccccc3s2)C2CC2)N(C)C)cc1 1251499993 AYLHDEFOJIHCOX-OAQYLSRUSA-N 437.613 4.339 10 10 IICE Cc1cc(-c2nnc(N3CCCC[C@@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1289359096 JGCOYYWBGYEKAN-LJQANCHMSA-N 448.615 4.457 10 10 IICE C[C@@H]1CCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1291170739 XKKRFWNOIMMVHS-GOSISDBHSA-N 436.579 4.390 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)cc1 1294465228 XKTFUKWONNMFJI-SFHVURJKSA-N 442.519 4.300 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H]3CC(c4ccc(Cl)cc4Cl)=NO3)CC2)cc1 1295273015 RTLBZUUFCGVAPJ-OAQYLSRUSA-N 448.350 4.234 10 10 IICE CC(C)N1C(=O)C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)[C@@H]1c1ccc(Cl)c(F)c1 1295562442 KGVMMJGLEWDPSE-MJGOQNOKSA-N 445.882 4.122 10 10 IICE CC(C)c1nnc(N2CCC[C@H](C(F)(F)F)C2)n1Cc1ccc(N2CCOCC2)cc1 1302651308 ZOKWHYSJJGCSEC-SFHVURJKSA-N 437.510 4.065 10 10 IICE C[C@H]1CSCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1305237348 LNKMPWCAOUTHEC-SFHVURJKSA-N 445.702 4.410 10 10 IICE CNC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)cc1 1307289942 BNTNSGBICBRDMJ-UHFFFAOYSA-N 441.325 4.478 10 10 IICE C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)N(Cc1ccco1)Cc1ccccc1O 1313137150 KOAAKBOUQNYOAA-NFBKMPQASA-N 433.552 4.465 10 10 IICE CCOCc1nnc(N2CCC[C@@H](OCC)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1314372343 QLUWFLRWODSIHF-HSZRJFAPSA-N 441.620 4.105 10 10 IICE COC(=O)[C@H]1C[C@@H](C(=O)Nc2nc(-c3cc(C)n(-c4ccc(F)cc4)c3C)cs2)C1 1352964664 BOQYDWGIGPVGCZ-GASCZTMLSA-N 427.501 4.494 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)cc1 1355015546 OIBWOUZGOWGXGN-AVRDEDQJSA-N 431.939 4.161 10 10 IICE Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)c1cccc3c1CCN(C(=O)OC(C)(C)C)C3)CC2 1357651684 NFLSDYJQQHYBID-UHFFFAOYSA-N 437.496 4.399 10 10 IICE CCc1nsc(N2CCN(C(=O)c3cc(-n4c(C)ccc4C)ccc3Cl)CC2)n1 1361056945 GUIBPDUJXBKXGM-UHFFFAOYSA-N 429.977 4.124 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](C)CS(=O)(=O)c3ccc(F)cc3)c2C)c1 1438310422 GFHQDPJJWSGUKK-KRWDZBQOSA-N 442.556 4.268 10 10 IICE CCOC(=O)CCN(C[C@@H]1CCCN1CC)C(=O)c1cc(C)n(-c2ccccc2C)c1C 1442120385 QJPXDCRLPVCNRD-QFIPXVFZSA-N 439.600 4.282 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1cccc(Cl)c1 1464503658 OGSDPYBKLWQIJE-KGVIQGDOSA-N 429.992 4.461 10 10 IICE COCCc1nc2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)ccc2o1 1465644941 SQTIPDCGJQJLIH-UHFFFAOYSA-N 431.492 4.418 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC([C@@](C)(O)C(F)(F)F)CC2)cc1 1466702946 YQGXENSBCSGCNG-JOCHJYFZSA-N 436.474 4.001 10 10 IICE Cc1ccc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc1-n1c(C)cc(C=O)c1C 1466902020 BDUGFOURUNUEHB-UHFFFAOYSA-N 433.464 4.027 10 10 IICE CN1CCN(c2ccc(CNC(=O)NCC(C)(C)c3ccc(C(F)(F)F)cc3)cc2)CC1 1469825321 KVHSJDYWUONGFP-UHFFFAOYSA-N 448.533 4.234 10 10 IICE COc1ccccc1[C@@H](NC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)c1ccccn1 1478363622 GGTRMNZKYRIIPX-UQBPGWFLSA-N 432.568 4.484 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C4CCCCC4)C3)cc2Cl)C1 1524704393 QHBOORMPUYWKPL-PKOBYXMFSA-N 432.008 4.374 10 10 IICE C[C@H](NC(=O)c1ccc(Cn2cc(Br)cn2)cc1)c1ccc(N(C)C)cc1 1537680595 YZTMIGINOHMCAS-HNNXBMFYSA-N 427.346 4.251 10 10 IICE CC(C)(C)c1ccc(C2(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CC2)cc1 1538132192 ZOSXPBQBZQJTND-UHFFFAOYSA-N 433.596 4.034 10 10 IICE CCOC(=O)[C@H]1CCCCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1542488828 PXOXGZOPZNXCLB-LJQANCHMSA-N 433.346 4.414 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(C(F)(F)F)cc1O 1545042908 UOOAFFGNEPZCLQ-ZDUSSCGKSA-N 430.373 4.411 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCC[C@H]1C(=O)N1c2ccccc2C[C@H]1C 1556515674 HXFMSPDENKCKIO-MISYRCLQSA-N 441.568 4.278 10 10 IICE COC(=O)c1cnc(CCNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)s1 1558645102 NPHCDWXXIAXTHF-UHFFFAOYSA-N 437.525 4.384 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CS(=O)(=O)c3ccccc3Cl)c2C)cc1 1559380618 KGHCJHOJPRVOBS-UHFFFAOYSA-N 445.924 4.191 10 10 IICE COC(=O)c1coc(/C=C/C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)c1 1565655925 GZFSQKSZALPVHX-BUHFOSPRSA-N 434.492 4.387 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1 1568735947 OXTMBSIGZRTFAD-JXFKEZNVSA-N 433.545 4.396 10 10 IICE Cc1cc(C)c(CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c(C)c1Br 1585539737 RMPODYWAHPQOQZ-UHFFFAOYSA-N 445.401 4.194 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccc(-c4ccc(C=O)o4)cc3O)c2)CC1 1610965754 NRXLPAUROCWDRI-UHFFFAOYSA-N 433.508 4.247 10 10 IICE CC1CCN(c2cccc(NC(=O)c3ccccc3NS(=O)(=O)C(F)(F)F)c2)CC1 1618192850 GEEYTUHDGYQDPK-UHFFFAOYSA-N 441.475 4.437 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)c1cccc(S(N)(=O)=O)c1 1625471053 NNFSVWAPCQYYLA-NRFANRHFSA-N 445.972 4.276 10 10 IICE Cn1nc(C(=O)NCc2cc(Cl)cc(Cl)c2O)c(Br)c1C(F)(F)F 1625688725 IIPSAIPDADMESB-UHFFFAOYSA-N 447.038 4.144 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H](C)c3ccc(S(C)(=O)=O)cc3)c2C)cc1 1642916257 UPORCAMBRPXPTH-INIZCTEOSA-N 440.565 4.040 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1645591997 NLVZTKQQDVIWMK-UHFFFAOYSA-N 444.579 4.034 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2ccccc2NC(=O)OC(C)(C)C)N(C)C)cc1 1647081745 MJSFMXPRRYAJPL-JOCHJYFZSA-N 440.588 4.061 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1cc2cnccc2o1 1650731996 PLKRGZRUKAEDLI-LICLKQGHSA-N 443.575 4.187 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(C)[C@H](CO)Cc3ccccc3)cc2Cl)C1 1680562490 KXUYRMGZTOHVOO-RXVVDRJESA-N 429.992 4.321 10 10 IICE CCCCNC(=O)OC[C@@H]1CCCCN1C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 1682101220 MYQKTULANLQKOM-UGKGYDQZSA-N 432.609 4.082 10 10 IICE COc1ccc(N2CCCN(C(=O)NC[C@H](CC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1682907740 ISSVXTAPIWSHDB-FQEVSTJZSA-N 447.620 4.311 10 10 IICE C[C@H]1CC[C@@H](C)N(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1742981104 NOPISLQTJDUBCQ-VQTJNVASSA-N 439.648 4.457 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CCCC4)n3CCOC(C)C)CC2)cc1 1748849807 ZBONLDBSPJMLSH-UHFFFAOYSA-N 441.620 4.161 10 10 IICE COCCCN1C(=O)C(N[C@H]2CCCC[C@@H]2C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873169449 AXKVAESJGNWJAA-MBSDFSHPSA-N 449.595 4.379 10 10 IICE Oc1c(F)cccc1Cn1nc(C2CC2)c(C(F)(F)F)c1I 2079834983 WGVGSFOHGIRPFA-UHFFFAOYSA-N 426.151 4.277 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C3(C)CC3)c(N)c2I)c(O)c1 2080048000 MDZKVLCJNROVPB-OAHLLOKOSA-N 441.313 4.081 10 10 IICE CCOc1cc(C=C2SC(=S)N(CC(=O)O)C2=O)ccc1OCc1ccccc1F 2297312081 GBMINMYPBGHZFG-UHFFFAOYSA-N 447.509 4.089 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccccc3)C2=O)ccc1OCCCC(=O)O 2297558913 JFPAUCZVNCQLCF-UHFFFAOYSA-N 429.519 4.345 10 10 IICE O=C(O)CN1C(=O)C(=Cc2cc(C34CC5CC(CC(C5)C3)C4)ccc2O)SC1=S 2297577683 PIYNXRMYJQDPTC-UHFFFAOYSA-N 429.563 4.146 10 10 IICE CCN1C(=O)C(=Cc2cn(Cc3c(F)cccc3Cl)c3ccccc23)C(=O)NC1=S 2313656583 IBZQJWVXJDTTOY-UHFFFAOYSA-N 441.915 4.129 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@H](C)CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352942070 ZEOCYMFCYJKSPB-ZFWWWQNUSA-N 427.383 4.446 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc4c(c3)OCO4)C(=O)N=C2O)c(C)n1-c1ccccc1 33414452 MPPUTMAGFIIHRN-ODLFYWEKSA-N 429.432 4.330 10 10 IICE COc1cccc(/C=C2/SC(=S)N(CCCC(=O)Nc3cccc(O)c3)C2=O)c1 35625013 ZPWDPFWLEBNRCD-LDADJPATSA-N 428.535 4.021 10 10 IICE CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccc(Cl)cc2)cc1 40406126 KYDFMBXPKDAQMV-UHFFFAOYSA-N 428.897 4.330 10 10 IICE COc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2=O)cc1 59270949 QHXSYJSCJWIOAY-SANMLTNESA-N 445.519 4.061 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(N3CCCCC3)nc2)C1 444036088 XBWDCZRJIAMGME-UHFFFAOYSA-N 445.611 4.110 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CSC[C@@H]3C(=O)Nc3ccccc3)ccc21 484754396 JZVCARDVYOKCFZ-JOCHJYFZSA-N 437.565 4.058 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](CNCc2cccc(Br)c2O)C1 717035715 JPQWLHXSCFYIQK-CYBMUJFWSA-N 435.309 4.137 10 10 IICE CCN(CC)CC1CCN(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)CC1 726722717 VYVTXRMOMJQYFO-UHFFFAOYSA-N 438.563 4.020 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@@H](CN2CCCCCC2)C1 728744679 CDORSKIZUUKIKO-QFIPXVFZSA-N 430.662 4.037 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Nc1cc(NC(C)=O)c(F)cc1F 743127642 HFFFFXXRKHRLME-UHFFFAOYSA-N 442.260 4.445 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNC(=O)NCc1c(O)ccc2c1CCCC2)c1ccccc1 743675767 YHBOSWPUWOAJNF-OAQYLSRUSA-N 439.556 4.336 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2c[nH]c3cccc(F)c23)NC(=O)OC(C)(C)C)cc1 761776629 RZNDPUFKARHXIS-FQEVSTJZSA-N 440.519 4.369 10 10 IICE COC(=O)c1nc([C@H]2CCCN2Cc2cc(C)cc(Br)c2O)sc1C 793234981 MMLKOZCPVQLNDM-CQSZACIVSA-N 425.348 4.352 10 10 IICE Cc1ccnc(C(=O)O[C@H](C)C(=O)c2cc(C)n(-c3ccc(OC(F)F)cc3)c2C)n1 795798608 VKKIKOIMBJTNNG-OAHLLOKOSA-N 429.423 4.222 10 10 IICE CC(=O)c1cc(F)cc(CN2CCOc3ccc(CNC(=O)OC(C)(C)C)cc32)c1O 864032689 IBJGGHRTDSWRAP-UHFFFAOYSA-N 430.476 4.158 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1C[C@H]1c1cccc(F)c1 1128623339 YGURQYKFZZEYAP-GGNDKMNLSA-N 444.528 4.228 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)NCc3cc(S(C)(=O)=O)ccc3F)c2C)c1 1138961189 JNFTYPFGEDGYQK-UHFFFAOYSA-N 428.529 4.184 10 10 IICE COCCCOc1cccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1C 1150355496 WGUMBTBMILAFJC-FQEVSTJZSA-N 446.975 4.164 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC(CCF)CC1 1150873101 LJWHMRMQLLQHDB-DTQAZKPQSA-N 426.604 4.328 10 10 IICE CC1(Nc2nc(CC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)cs2)CCCC1 1151903355 JDMDQVFDHHIZPY-LJQANCHMSA-N 429.586 4.344 10 10 IICE CCN(Cc1cc(Br)ccc1O)[C@@H](C)c1nc(N)nc(Nc2ccccc2)n1 1167512625 OUZWGBGWUFNXBM-ZDUSSCGKSA-N 443.349 4.249 10 10 IICE COc1cccc([C@H](NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c2nccn2C)c1 1168599884 YAUYZTZSKTYCEI-VWLOTQADSA-N 428.536 4.285 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cccc(COc3cccc(C=O)c3)c2)N(C)C)cc1 1180178897 HZSSIELRLOMSSL-SANMLTNESA-N 445.563 4.177 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](C)N(CC(F)(F)F)[C@H](C)C2)c(C)n1-c1ccccc1 1233973067 IEVPINHCXWRZIG-HDICACEKSA-N 436.522 4.303 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2CCC[C@H]2C2CCC2)cc1 1295411588 VHXLIOANHSAFAS-QFIPXVFZSA-N 438.620 4.080 10 10 IICE CCCCn1cc(Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)c(C)n1 1306720606 VUXDTMCMVKOKOC-UHFFFAOYSA-N 431.544 4.035 10 10 IICE COC(=O)c1ccc([N+](=O)[O-])c(OCC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)c1 1307290008 CYFUEQGSHKOTBZ-UHFFFAOYSA-N 440.427 4.498 10 10 IICE COc1ccc(N(CC(=O)Nc2ccc(I)cc2)CC(C)C)cc1 1307850451 QKMSFJLLAYJNBP-UHFFFAOYSA-N 438.309 4.401 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnc2scc(-c3ccccc3)n2c1=O 1327689213 ZLILNANXYWJFMW-UHFFFAOYSA-N 446.315 4.365 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C(CC)CC)C2)sc2c1CC[C@H](CC)C2 1349974188 HXKBZIOWPZPEOB-LSDHHAIUSA-N 434.602 4.415 10 10 IICE C[C@H](NC(=O)[C@H]1C[C@]1(C)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 1357927977 LEKJCIBGABGOQZ-POCHDABASA-N 443.385 4.441 10 10 IICE Cc1cc(-c2nnc(N3CCSCC3)n2CCCCCCO)c(C)n1-c1ccccc1 1361052847 YHJMZLJYIMNKRM-UHFFFAOYSA-N 439.629 4.459 10 10 IICE O=C(Cc1cc(Cl)cc2ccccc12)NCc1cc(F)c(N2CCOCC2)c(F)c1 1436624057 MEBONPKLYDTEOE-UHFFFAOYSA-N 430.882 4.467 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](c4nccc(C(F)(F)F)n4)C3)ccc21 1439744995 UISAJELPLKMJST-KRWDZBQOSA-N 446.473 4.343 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](O)c1cc(Cl)cc(Cl)c1 1445879104 DBMJNLBUKQYHSD-IEBWSBKVSA-N 443.758 4.167 10 10 IICE CCOc1ccc(N2CCN([C@H]3CCN(c4ccc(C(F)(F)F)cc4)C3=O)CC2)cc1 1459794194 CDCZAMTULMQRCW-NRFANRHFSA-N 433.474 4.032 10 10 IICE Cc1cc(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)nn1C(C)C 1463209543 UIMNHYLWSPYDOK-UHFFFAOYSA-N 439.317 4.497 10 10 IICE Cc1cccc(NS(=O)(=O)c2cccc(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)c2)c1 1467260039 OZWKFJUDVRPLED-SFHVURJKSA-N 437.565 4.353 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3c4ccc(Cl)cc4C[C@H]3C)cc2F)C[C@@H](C)O1 1473901911 NRIURCJSIZISIW-BRWVUGGUSA-N 445.966 4.160 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H](OC)c1cccc(OC)c1 1479024451 BKHIHYSMXJYMCT-LJQANCHMSA-N 437.334 4.083 10 10 IICE CCCCn1c([C@H]2OCC[C@H]2COC)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1500513970 YALHEMMDGYJJSE-UNMCSNQZSA-N 427.593 4.039 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@H](c4cnn(C)c4)C3)nnc2C(C)(C)C)cc1 1501847843 YTLGZTRYDPQUQO-HXUWFJFHSA-N 435.620 4.198 10 10 IICE COc1ncc(/C=C/C(=O)N2CCCc3c(NC(=O)CC4CCCCC4)cccc32)cn1 1537253837 SRUJMDPFCAVSHV-OUKQBFOZSA-N 434.540 4.387 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)N(C)C)cc1 1539234007 AMIKULOVQMSONY-NRFANRHFSA-N 444.551 4.271 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4cccc(F)c4)C3)cc2Cl)C1 1539913928 WQSSEELOQYOYBW-FUHWJXTLSA-N 443.950 4.385 10 10 IICE CC(C)CCC[C@H](C)NC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O 1540616334 KPDMBECYIVXFKY-HNNXBMFYSA-N 449.529 4.046 10 10 IICE CCCN(Cc1ccccc1O)C(=O)c1cc(Br)nn1-c1ncccc1Cl 1545504880 JPKSTAZRFMMMQE-UHFFFAOYSA-N 449.736 4.441 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](NC(C)=O)C1 1547019788 FJXZEGKOFTYQAV-NRFANRHFSA-N 434.588 4.258 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)c(C)n1-c1ccc(F)cc1 1557011197 SABGZDHAUBVYMQ-LAUBAEHRSA-N 427.520 4.315 10 10 IICE COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1565273173 OTOSGGOTAXYVJV-GBXCKJPGSA-N 436.600 4.130 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccccc1Oc1ccc(C)cc1 1567306640 WKVMNOXBDGTATG-NRFANRHFSA-N 449.503 4.032 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC/C=C/c1ccccc1 1583747208 NITWXFCHRANZKH-KLKNKQFKSA-N 426.538 4.247 10 10 IICE COc1ccc(N2CCN(C(=O)C3(CCCOCc4ccccc4)CC3)CC2)c(OC)c1 1595997583 XRCGWQNVSAVTSM-UHFFFAOYSA-N 438.568 4.130 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C(/C)c1ccccc1OC(F)F 1597567291 IPSBMIPNAKPVID-LCYFTJDESA-N 439.842 4.252 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)/C=C\c1ccc(S(C)(=O)=O)o1 1597567776 WCPMYSYWGWHYKA-AINHQSCGSA-N 425.506 4.192 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)COc2ccccc2Br)cc1 1598291093 JSFTVLIYIPNOAB-LJQANCHMSA-N 447.373 4.102 10 10 IICE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1612821174 NLEXGXBBYLUBEP-QFBILLFUSA-N 441.576 4.143 10 10 IICE CCCCN(CC)c1nnc(-c2noc3c2COCC3)n1Cc1ccc(N(C)C)cc1C 1614509150 JOBYEUNZQJWZRW-UHFFFAOYSA-N 438.576 4.055 10 10 IICE Cc1cc(C(=O)N2CC[C@H](C(C)(C)C)[C@@H](O)C2)c(C)n1-c1ccc(Br)cn1 1624128270 VJKXRYIQRPTFJA-ROUUACIJSA-N 434.378 4.121 10 10 IICE O=C(c1cc(Br)c2nccn2c1)N(Cc1ccco1)Cc1ccccc1O 1631142951 BCNVGXMQQNFZQR-UHFFFAOYSA-N 426.270 4.238 10 10 IICE O=C([C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1631219172 OOCHJTWGKBWZOU-KKSFZXQISA-N 449.334 4.400 10 10 IICE CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)c2sccc2-n2c(C)ccc2C)c1 1631404527 KMKHYSUZSMIYNK-UHFFFAOYSA-N 447.582 4.144 10 10 IICE COc1ccc(N2C[C@@H](NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2=O)cc1 1632493603 OJIMHNGYAHWXMH-SFHVURJKSA-N 437.927 4.291 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)COc2ccccc2)c(C)n1-c1cccc(Br)c1 1635828028 XUSVRJWHOJUJPK-LJQANCHMSA-N 443.341 4.026 10 10 IICE Cc1ccc(C(=O)N2CCNC(=O)[C@H]2CC2CCCCC2)cc1-n1c(C)cc(C=O)c1C 1639371290 CVJDCYIIHALQFV-XMMPIXPASA-N 435.568 4.126 10 10 IICE Cc1cc(C(=O)N2C[C@H]3COC[C@@]3(C(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(Cl)c1 1645146575 ZUJJCKBFPGWDCJ-XDHUDOTRSA-N 444.959 4.178 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccccc3)c3nc(O)n[nH]3)c2C)c1 1648699519 DTAZOSWDNOPRJL-QFIPXVFZSA-N 429.524 4.248 10 10 IICE COC(=O)/C=C\c1ccc(N2CCc3c(F)ccc(Br)c3C2)c([N+](=O)[O-])c1 1651108202 AFDCIJIMHFHUDF-CLTKARDFSA-N 435.249 4.245 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(Cc3ccsc3)C(C)(C)C)cc2F)C[C@H](C)O1 1654201810 MKSLINHDCTZCHZ-ROUUACIJSA-N 447.620 4.418 10 10 IICE Cc1cc([C@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C2CC2)ccc1F 1680743012 FGMZHEKIUNBCPZ-OAQYLSRUSA-N 433.474 4.199 10 10 IICE Cc1cc(CNC(=O)N[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)c(C)n1-c1ccccc1 1686491377 CBHKSPGYZCOAFP-MOPGFXCFSA-N 430.552 4.260 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CC2)n1CCc1ccc(OCC(F)(F)F)nc1 1696699714 IYYZZYVTLRBQQL-UHFFFAOYSA-N 447.461 4.076 10 10 IICE COCCO[C@@H](C)c1nnc(N2CC=CCC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1698139353 YRHSCDGWYCZQOG-NRFANRHFSA-N 439.604 4.053 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)C[C@H](C)O1 1727815157 GBIWEWIDKWCBFW-IEIRFRATSA-N 441.620 4.070 10 10 IICE CC[C@@H](C)NC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCCC1 1743884561 GMDNMHMTPNANQI-GOSISDBHSA-N 434.588 4.258 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)CCc2cccs2)cc1 1766613663 ITEXEJNPIWUZGV-FQEVSTJZSA-N 439.629 4.417 10 10 IICE CN[C@@H]1C(=O)Nc2cc(N(Cc3ccccc3)Cc3ccco3)c(Br)cc21 1915122949 FJRJWZMCPDPLKO-FQEVSTJZSA-N 426.314 4.462 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C(C)C)c(C(=O)O)c1I 2079138485 WSBPMRCRGLWEQL-GFCCVEGCSA-N 428.270 4.323 10 10 IICE CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCCOc1cccc(OC)c1 2293571156 JCVHOZVJHOVZRV-UHFFFAOYSA-N 445.562 4.383 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc4cc5c(cc4nc3O)OCO5)SC2=S)cc1 2296595838 GRTLVZSPZHZDQQ-UHFFFAOYSA-N 438.486 4.084 10 10 IICE CCC(NCCCn1ccnc1)=C1C(=O)N(c2nc3ccccc3s2)N=C1C(F)(F)F 2296662508 BBPBHEXIFQRXET-UHFFFAOYSA-N 448.474 4.102 10 10 IICE Cc1ccc(CNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(O)c1Br 2381146460 LSXFHZNKHBMUOB-KGLIPLIRSA-N 441.366 4.115 10 10 IICE C[C@H]1CCc2c(cc(-c3ccccc3)n2-c2ccc(C(=O)NCCN3CCOCC3)cc2)C1 20489486 DTRZWAFCYNDTOF-NRFANRHFSA-N 443.591 4.331 10 10 IICE COC(=O)c1scc(C)c1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 436012096 GRCCDESLCBCSSU-UHFFFAOYSA-N 425.554 4.203 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@]2(NCc3cc(Br)cc(F)c3O)CCC[C@@H]12 715745982 QBPBNXJLOGYFRO-BEFAXECRSA-N 429.330 4.316 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 726567311 GWOTXCRUVGURKX-VFNWGFHPSA-N 443.494 4.281 10 10 IICE CN1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 754857855 IMIXJEMMURQCDS-YADHBBJMSA-N 428.939 4.100 10 10 IICE Cc1cc(C(=O)COC(=O)c2scnc2Br)c(C)n1-c1ccc(F)cc1 754970489 ZASBUCLAKQENNX-UHFFFAOYSA-N 437.290 4.492 10 10 IICE COc1ccc(CN2CCN(Cc3cc(Cl)cc(Cl)c3O)CC2)c(OC)c1OC 768207856 KSCSAHCLWKZYMJ-UHFFFAOYSA-N 441.355 4.043 10 10 IICE Cc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c(C)c1Br 790695138 KOWZQOPWTOLOTL-UHFFFAOYSA-N 435.337 4.096 10 10 IICE C[C@@H](Oc1cccc(Br)c1)C(=O)NCc1cc(Br)ccc1O 804736172 LZSBUXDBDIGIIB-SNVBAGLBSA-N 429.108 4.001 10 10 IICE O=C(NCCc1nc2cc(Cl)ccc2s1)NCc1cc(Br)ccc1O 805195055 UPOBFEIDUXFBTJ-UHFFFAOYSA-N 440.750 4.460 10 10 IICE COC(=O)c1c(NC(=O)CCC(=O)N[C@@H](C)c2ccccc2)sc2c1CCCCC2 1125084003 NFDRGTQXDCBPCX-HNNXBMFYSA-N 428.554 4.400 10 10 IICE CCOC(=O)[C@@](C)(CNC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)c1ccccc1 1128033082 IJBZSSHLHYUWLH-MHZLTWQESA-N 448.563 4.166 10 10 IICE CCS(=O)(=O)c1cccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)c1 1128490073 ORPODNSIMRISMW-INIZCTEOSA-N 434.989 4.300 10 10 IICE Cc1cc(CNC(=O)C2(CC(=O)OC(C)(C)C)CCOCC2)c(C)n1-c1ccccc1 1132047921 BXNPQEVZIULEQN-UHFFFAOYSA-N 426.557 4.239 10 10 IICE CCOC(=O)C[C@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1ccccc1 1137475146 QHSJORJCMFBOPI-DEOSSOPVSA-N 432.520 4.260 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc(Cl)c(Br)c1 1142689627 AFGCHBBYNPSUJG-UHFFFAOYSA-N 426.694 4.014 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)CC1CC1 1144992866 NRQLZOFHGRBYPO-INIZCTEOSA-N 433.346 4.176 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2)c(C)n1-c1ccccn1 1161275543 FUJZTHRTOQFUFQ-SLFFLAALSA-N 438.572 4.255 10 10 IICE COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CN[C@@H](C)c2ccccc2O)cc1 1197004890 WFZLKVZRNOEHTK-UUOWRZLLSA-N 429.520 4.429 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](CCO)c3cc(Cl)cc(Cl)c3)C2)cc1 1230858885 PWOLXHBKRVHLFC-XLIONFOSSA-N 438.355 4.004 10 10 IICE O=C(NCCOc1ccc(Cl)c(Cl)c1)NCc1cccc(Br)c1O 1251499046 RPPLZBFVQUABMQ-UHFFFAOYSA-N 434.117 4.340 10 10 IICE CC(C)Cc1nnc(N2CCC[C@H](OCC3CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1287448870 GZHQBHZHNXTLTE-FQEVSTJZSA-N 429.584 4.125 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCC[C@H]1OC 1291443260 VIQFDRWFZCFCFH-XKCSPQBFSA-N 441.620 4.080 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)c1 1293984686 BNDHAJQLXHCJTO-JOCHJYFZSA-N 430.426 4.087 10 10 IICE O=C(C[C@@H]1CCc2sccc2C1=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294161603 PMGLQAVQKQLUMW-LSDHHAIUSA-N 434.508 4.270 10 10 IICE CCOC(=O)[C@@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@H](O)c1cccnc1 1302356306 JCOQFKZKAPUSOM-BJKOFHAPSA-N 449.551 4.008 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCC(CO)CC2)cc1 1313679107 JGOWNSZYYFVEPI-UHFFFAOYSA-N 439.629 4.034 10 10 IICE Cc1sc(NC(=O)C[C@H]2CCCS(=O)(=O)C2)c(C(=O)OC(C)C)c1-c1ccccc1 1358010354 XAZIDFLQPWUTDU-MRXNPFEDSA-N 449.594 4.442 10 10 IICE CC[C@H](C(=O)N(CC)Cc1cc(Br)ccc1O)N(C)C(=O)OC(C)(C)C 1445653810 IWJGJVYWCZYQQX-OAHLLOKOSA-N 429.355 4.149 10 10 IICE COc1cc(C[C@@H](CO)CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc(OC)c1 1446032170 AMEVYTUQBGEFFV-OAQYLSRUSA-N 436.552 4.001 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(CCc3ccccc3)ccc2O)N(C)C)cc1 1456938871 ZWUXPJGKSGTAJN-VWLOTQADSA-N 431.580 4.276 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)CCCC1 1460428968 AVDHHCYEZLBFQX-JOCHJYFZSA-N 438.490 4.487 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C\COc2ccccc2)NC(=O)OC(C)(C)C)cc1 1465324840 JKBPMQKZLOMLMY-RYGYDFEPSA-N 439.556 4.070 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)N1CCCN(c2ccc(OC)cc2)CC1 1479088036 SYASTXLOZGYHQA-NRFANRHFSA-N 434.584 4.430 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC(C)(C)C1)OC 1513441107 LHRXKBPHUCOKRA-NRFANRHFSA-N 437.588 4.393 10 10 IICE CO[C@@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1517764136 MFRCDMGEUBKKCR-PXNSSMCTSA-N 425.602 4.329 10 10 IICE CN(C)c1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c2ccccc2n1 1524059045 UTGLGXKFBVSEFW-MRXNPFEDSA-N 440.494 4.301 10 10 IICE CC(C)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1526967595 IOWDGJQQXZNPGR-GHTZIAJQSA-N 433.593 4.030 10 10 IICE COc1ccc(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1[N+](=O)[O-] 1538421744 QTQLLIJWTWNBTK-OAHLLOKOSA-N 431.920 4.352 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)Cc1ccncc1 1543020249 YPCUGWNXWSEBHX-QFIPXVFZSA-N 433.552 4.374 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cnn4c3N[C@H](C)C[C@@H]4C(F)(F)F)cc2)CC1 1543145823 DZPHYULJKKPGKL-DNVCBOLYSA-N 435.494 4.357 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@H](NC(=O)c4ccccc4)C3)c2C)cc1 1544510371 WJNRMFGXKWXQSL-NRFANRHFSA-N 431.536 4.137 10 10 IICE Cc1cc(C(=O)N[C@@H]2c3ccccc3C[C@H]2O)c(C)n1-c1ccccc1Br 1545552216 UKPXEMUGJYGDQG-NHCUHLMSSA-N 425.326 4.245 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(C)C[C@@H]3CCCOC3)ccc21 1554360551 ZMSVUYISPNPQRU-FQEVSTJZSA-N 425.621 4.160 10 10 IICE CO[C@H](Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)C(C)C 1554660053 QBVALZRKOSKGQB-XMMPIXPASA-N 448.615 4.172 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1 1557063417 NYCPNLILVAGSHY-OAHLLOKOSA-N 428.483 4.414 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@H]1COC(=O)NC1CCCCC1 1564946964 ZLJKCUGYCUZMAP-XXBNENTESA-N 444.620 4.225 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCOC[C@@H]2CC(=O)c2cccs2)c1 1566210984 SXDLPZCBFBBLHN-NRFANRHFSA-N 436.533 4.082 10 10 IICE Cc1cc(C(=O)N[C@H]2Cc3cccc(O)c3C2)c(C)n1-c1cccc(Br)c1 1567587744 SOVBXZGREKUQFQ-KRWDZBQOSA-N 425.326 4.459 10 10 IICE C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1586054827 OTRDSFGVOZHPHA-CLOONOSVSA-N 446.595 4.330 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)C2)cc1 1587112564 HBHWKUZPIJLBHA-KOSHJBKYSA-N 438.474 4.489 10 10 IICE Cc1cc(C(=O)Nc2ccccc2CNS(C)(=O)=O)c(C)n1-c1cccc(Cl)c1 1587896969 FIJXDUKMQHYMLA-UHFFFAOYSA-N 431.945 4.049 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3csc(-c4ccc(F)c(F)c4)n3)C2)cc1 1598362693 BXCYDHADTPRAMY-AWEZNQCLSA-N 429.492 4.353 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)C1(c2cc(F)cc(F)c2)CCCC1 1618539692 QWBGGTWQIHEZFP-UHFFFAOYSA-N 428.523 4.302 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@](C)(O)c1cccs1 1620118353 ZQCYWGRENTZMMM-QHCPKHFHSA-N 437.569 4.319 10 10 IICE CCOC(=O)Nc1ccc(Cl)c(C(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)c1 1623641876 ZFGOXJBGJZOQEZ-QGZVFWFLSA-N 432.904 4.435 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2cccc(Br)c2O)cc1)[C@H]1C[C@@H]1C 1625066570 LCUIBYYSLKUDQB-SGTLLEGYSA-N 432.318 4.238 10 10 IICE Cc1ccc(C(=O)NCCNc2ncccc2C(F)(F)F)cc1-n1c(C)cc(C=O)c1C 1626060969 BKJHVUQHVRJGQA-UHFFFAOYSA-N 444.457 4.471 10 10 IICE Cc1ccc(CN2C[C@H](C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)CC2=O)cc1 1627002189 ZDRVUXQCWQSLCH-HSZRJFAPSA-N 433.596 4.429 10 10 IICE Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1627692513 UCUVKAGNKYPZCN-QHCPKHFHSA-N 447.560 4.369 10 10 IICE O=C(NCCCSc1nccs1)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccncc1 1632807110 NYNSDHWWRUQRIB-LEWJYISDSA-N 438.622 4.052 10 10 IICE COC(=O)[C@@H]1C[C@@H]2C[C@H](NC(=O)c3cc(C)n(-c4cccc(Br)c4)c3C)[C@@H]2C1 1636370038 UFNOQNBJPLDYMK-IONDEXAJSA-N 445.357 4.174 10 10 IICE CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)[C@]12CCCO2 1638249471 DOTNDBXIUZUURE-KCZVDYSFSA-N 447.373 4.313 10 10 IICE C[C@@H]1CN(c2ccc(NC(=O)CN3CCCc4cc(OC(F)F)ccc43)cc2)C[C@@H](C)O1 1644806998 XYRUJLHULWGURD-IAGOWNOFSA-N 445.510 4.293 10 10 IICE CCC[C@@H](Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1649640993 JFFFFXSWURZEER-QFIPXVFZSA-N 443.636 4.407 10 10 IICE COc1ccc(N2C[C@H](NC(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1682608519 UTUFGXGJWQBBNG-OAQYLSRUSA-N 446.551 4.016 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@H]3CC[C@H](c4ccc(Cl)cc4)C3)cc2)CC1 1683345099 XTUPHXAREKWDLQ-UNMCSNQZSA-N 426.992 4.227 10 10 IICE CC(C)(C)CN(Cc1ccccc1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1685244708 VMWSHDORACEZOL-UHFFFAOYSA-N 436.600 4.146 10 10 IICE C=CCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)CC[C@H]1C 1705895562 LAOXBRIRIFSWQK-RTBURBONSA-N 446.599 4.280 10 10 IICE Cc1nnc(N2CCC(c3ccccc3CO)CC2)n1CCCSc1nccs1 1726376645 OUYAIGJHIFXIGZ-UHFFFAOYSA-N 429.615 4.102 10 10 IICE CC[C@H](Cn1c([C@H](C)CC)nnc1N(C)Cc1ccccc1O)NC(=O)OC(C)(C)C 1744114587 LUIWIFVPRZEQQH-SJLPKXTDSA-N 431.581 4.437 10 10 IICE CC/C=C\Cn1c([C@H]2CCCCO2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1745095588 GBHUHBZIOOWLBS-NAMKQITDSA-N 425.577 4.211 10 10 IICE Cc1cc(OCC(=O)N[C@@H](c2ccc(N(C)C)cc2)c2nccn2C)cc(C)c1Cl 1865928754 RXCWSFJBZYMHPZ-QFIPXVFZSA-N 426.948 4.041 10 10 IICE Cc1cc(C(=O)N(C)Cc2cnn(-c3ccccc3)c2)c(C)n1-c1ccc2c(c1)OCCO2 28489028 VRNZIZFGJOEOTB-UHFFFAOYSA-N 442.519 4.323 10 10 IICE Cc1cccc(Oc2nc3c(C)cccn3c(=O)c2/C=C2/SC(=S)N(C)C2=O)c1C 39836061 WNOVNUSFVXZNHX-GZTJUZNOSA-N 437.546 4.243 10 10 IICE COc1cccc(C[C@H](C)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 743606689 KJJMHBSENRUKEH-FUHWJXTLSA-N 433.499 4.196 10 10 IICE COc1cccc(-c2nsc(NC(=O)N(Cc3ccccc3O)C[C@@H]3CCCO3)n2)c1 757937139 PVHXERCXNHFCQP-SFHVURJKSA-N 440.525 4.132 10 10 IICE CCOC(=O)[C@@H](Cc1ccccn1)NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 760628325 RIBHKRXCQXNKMC-OAQYLSRUSA-N 425.916 4.047 10 10 IICE CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccc(N3CCOCC3)cc2)[C@H]2CCCC[C@@H]21 769231612 BZVOWAQKYACRKZ-FZSWRXECSA-N 427.633 4.207 10 10 IICE CC(C)(C)OC(=O)N1CCC(SCC(=O)NCc2ccc(N3CCCC3)cc2)CC1 777773908 KEYNZDKVIAXWEU-UHFFFAOYSA-N 433.618 4.036 10 10 IICE Cc1c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cnn1C1CCCCC1 781165496 GSEMDFYOWKYOEF-UHFFFAOYSA-N 435.616 4.159 10 10 IICE COc1ccccc1-c1ncc(/C=C2/SC(=S)N(c3cccc(C(=O)O)c3)C2=O)cn1 792867423 VDXXTMVRHQGHPS-GIJQJNRQSA-N 449.513 4.256 10 10 IICE Cc1nn(C)c(C)c1CCCNC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 799966684 PVBAVNBCWGIRHH-MRXNPFEDSA-N 432.012 4.359 10 10 IICE Cc1cc(COCC(=O)OCC(=O)c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)on1 801461094 FGZOHZNIGVFHIW-UHFFFAOYSA-N 434.851 4.126 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3ncc(C(F)(F)F)s3)cc2F)C[C@@H](C)O1 801751345 OWUSEMGMBVQKGE-PHIMTYICSA-N 432.443 4.236 10 10 IICE COCCn1c(C)c(C)c2cc(-c3nc([C@@H]4CCC(=O)N(CC5CCC5)C4)no3)ccc21 856557984 BUVLYGYDLFVHME-HXUWFJFHSA-N 436.556 4.461 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3ccc(C)nc3Cl)c2C)cc1 919252902 OPMBGELPJNKXJE-UHFFFAOYSA-N 440.883 4.277 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ccc([N+](=O)[O-])s1 1134538606 IZLAYEUXYQTPDS-UHFFFAOYSA-N 444.270 4.381 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1135800989 ZDNUBRAZHMWECE-UHFFFAOYSA-N 432.446 4.177 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnn(-c2ccccc2)c1Br 1276283677 KUMAWLWJDLRXHW-INIZCTEOSA-N 441.373 4.370 10 10 IICE CCC(C)(C)Cn1c(Cc2cccnc2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1291355350 MVHJRFOTQLPOSR-UHFFFAOYSA-N 448.615 4.425 10 10 IICE CCOCn1nc(C)c(C[C@H](C)C(=O)NCc2ccc(N3CCC(C)CC3)cc2)c1C 1293146943 XDRAAKQKYXSRDF-IBGZPJMESA-N 426.605 4.225 10 10 IICE COC1([C@@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CCOCC1 1299523812 JJUMTODPWSDWIM-MRXNPFEDSA-N 435.362 4.171 10 10 IICE CCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(N)=O)CC1 1305279228 MQOKRVPAOKNXAQ-UHFFFAOYSA-N 448.615 4.491 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCCCCC2)n1Cc1ccc(N(C)C)c(F)c1 1305771692 DGBDPFUZPIFMGX-UHFFFAOYSA-N 444.599 4.220 10 10 IICE CCN(CCNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1cccc(C)c1 1348431907 YRVSTYBKDQQAEZ-UHFFFAOYSA-N 432.612 4.359 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C=C\c3ccc(F)c4ccccc34)cc2)C1 1351135852 VSMVRZIYMSWYEE-JYHGAKRHSA-N 431.511 4.010 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)/C=C/c3ccc(F)c4ccccc34)cc2)C1 1351135854 VSMVRZIYMSWYEE-YNEJIKTKSA-N 431.511 4.010 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1CCSC[C@H]1C 1361095651 NANKKZKLLLSVMY-MRXNPFEDSA-N 443.020 4.358 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1scc(C)c1I 1436849781 OJQZOJNSXBWTDD-CYBMUJFWSA-N 442.366 4.397 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Br)c(Cl)cc3OC)C2)cc1 1437583248 ZGZVXMPWEYAOOK-GFCCVEGCSA-N 439.737 4.128 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C)c(C)n1-c1ccccc1 1438180101 UZKPOUSFWIGRHE-DENIHFKCSA-N 425.573 4.398 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCCCC[C@@H]3c3ccccc3)CC2)cc1 1442747373 UASGRDRHXDKOLM-UPTOSOBMSA-N 447.579 4.044 10 10 IICE CCn1cc(Cl)c(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n1 1462853633 MAFURLAFEXHPST-LCYFTJDESA-N 441.003 4.238 10 10 IICE COc1cccc([C@@H](O)CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1 1465913549 QOTUTKVAFZQMBM-NRFANRHFSA-N 443.341 4.329 10 10 IICE CCOc1ccc([C@@]2(C(=O)NCc3ccc4cccnc4c3O)CC2(Cl)Cl)cc1 1469251131 XDFIVTVJCZYEPX-OAQYLSRUSA-N 431.319 4.471 10 10 IICE COc1ccc([C@@H](CO)CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1478528222 MTENUJFYQBIXJY-FXAWDEMLSA-N 445.991 4.160 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1514015127 LCBUDKPXDSZEKF-RXVVDRJESA-N 448.615 4.456 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sc(C)cc3Br)cc2F)CC1 1521011139 VYCXHBYWZCWQHP-UHFFFAOYSA-N 440.382 4.030 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1 1525762533 RMHBVWCFDGPEDC-MRXNPFEDSA-N 437.565 4.203 10 10 IICE CC[C@H](C)c1ccccc1N1C[C@@H](C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)CC1=O 1526247581 ZABMZAAEFTUTBL-HBMCJLEFSA-N 449.595 4.204 10 10 IICE Cc1ccc(CO[C@H](C)C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1 1527246720 XGSMRUMCDCRLEW-QGZVFWFLSA-N 436.474 4.072 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@@H](Oc1ccccc1)c1ccccc1 1527864537 SIIOPGXMCPWUCA-DEOSSOPVSA-N 438.474 4.238 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1 1540536587 KBLKXJUAJGZTSH-UHFFFAOYSA-N 439.556 4.167 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 1540729261 PLKISMKZPATOIB-NRFANRHFSA-N 427.589 4.330 10 10 IICE C[C@H](CC(N)=O)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(N(C)C)cc1)CCC2 1543524551 DQJDSUUINTULHK-FDCFBWIESA-N 442.563 4.171 10 10 IICE C[C@H]1CCc2c(sc(NC(=O)[C@H]3CC(=O)N(C(C)(C)C)C3)c2C(=O)OC(C)(C)C)C1 1544362684 YYGAXGVQBLLQLN-KBPBESRZSA-N 434.602 4.414 10 10 IICE Cc1cc(O[C@H](C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccc1Cl 1544720963 MDGPWOFQYAENSU-LJQANCHMSA-N 442.003 4.264 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Br)cc3C(F)(F)F)CC2)cc1 1544745404 OZXOIBFPPYOFTJ-UHFFFAOYSA-N 443.263 4.439 10 10 IICE CCCCCn1c([C@H]2CCCCO2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1546975010 HKEKBRVYCQGAPB-JOCHJYFZSA-N 427.593 4.435 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccccn3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 1559359876 XJMPVQVTWIOIHG-SANMLTNESA-N 444.535 4.262 10 10 IICE CC[C@@H](NC(=O)N1CCN(c2cc(OC)c(OC)c(OC)c2)CC1)c1ccc(C)c(F)c1 1564469300 MNWPWWDQBJNTIA-HXUWFJFHSA-N 445.535 4.143 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@H](c2ccc(F)cc2F)c2nccn2C)C2CC2)cc1 1565449847 AZOUAWHHYYUMEZ-JOCHJYFZSA-N 439.510 4.228 10 10 IICE CC(C)(C)[C@H]1CN(c2nnc(-c3ccc[nH]3)n2CCCSc2nccs2)CCO1 1597196042 LYHXYPRJAKLTPQ-MRXNPFEDSA-N 432.619 4.163 10 10 IICE Cc1c[nH]c(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)c(C)c1=O 1598003151 AILUALKVJNMUBO-UHFFFAOYSA-N 428.330 4.092 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2cc(F)c(F)c(F)c2)c(C)n1-c1ccc(F)cc1 1618294945 IEWCUHUTLZHRAS-MRXNPFEDSA-N 434.433 4.232 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3C[C@H]3CCCS3)CC2)cc1 1619301665 SZGFPNFJIGBRFT-HXUWFJFHSA-N 429.634 4.197 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCNc2ncc(Cl)cc2Cl)CCCC1 1624700967 BTJLBXNMRIXJKF-UHFFFAOYSA-N 447.366 4.459 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)c1 1631189306 BJTQEIHLNPTLLX-DEOSSOPVSA-N 429.520 4.000 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C2CCC1(CNC(=O)OC(C)(C)C)CC2 1636266856 JWDBSEZQIBLOPB-ISKPRUBYSA-N 444.620 4.223 10 10 IICE Cc1cc(C(=O)Nc2c[nH]nc2C(F)(F)F)c(C)n1-c1ccc(Br)cn1 1645299348 RDXNMBGCSPDHDT-UHFFFAOYSA-N 428.212 4.246 10 10 IICE Cc1cc(C(=O)N[C@@H](c2cnn(C)c2)C(C)C)c(C)n1-c1ccc(Br)cn1 1646122339 KNOXKYVJBZVQTH-LJQANCHMSA-N 430.350 4.112 10 10 IICE COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1655103420 DCEASWSJPQCGGQ-INIZCTEOSA-N 433.892 4.125 10 10 IICE O=C(NCc1cc(Cl)ccc1O)NC[C@@H](C(=O)OCc1ccccc1)c1ccccc1 1681493605 KQPQIHHTGUONST-OAQYLSRUSA-N 438.911 4.372 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3ccc(C)c(Br)c3)CC2)cc1 1684987310 IESATJUCFPXDTK-UHFFFAOYSA-N 432.362 4.188 10 10 IICE CCC[C@@H](C)N(C)c1nnc([C@@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1695093707 USJMDHXOACSIAW-KNQAVFIVSA-N 438.620 4.139 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@](C)(OC)C2)cc1 1695621447 XOCGHJJHIITOCQ-VWLOTQADSA-N 434.588 4.240 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)c(F)c1 1763291485 TUCQQCBVGDUKLT-JXFKEZNVSA-N 439.583 4.018 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccc([N+](=O)[O-])cc3)C(=O)N(C3CC3)C2=O)cc1 1873422294 PJPVELKWWYGSBT-UHFFFAOYSA-N 442.475 4.357 10 10 IICE COc1ccc(N2CCN(CCC(=O)c3cccc(NC(=O)c4ccccc4)c3)CC2)cc1 1874724875 WDTRSDIIDUXITD-UHFFFAOYSA-N 443.547 4.343 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@H]3C[C@H]2CN(Cc2ccccc2)C3)c(Br)c1 2160692154 XBEPZKWDJFJJKW-OALUTQOASA-N 427.342 4.258 10 10 IICE [N-]=[N+]=NCC1CCN(C(=O)CC[C@H](NC(=O)OCc2ccccc2)C(F)(F)F)CC1 2180961488 GLWPJTWEJJQQDY-INIZCTEOSA-N 427.427 4.173 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C23CC3)c1O 2236054847 MTPQNVAHBYBBIH-ZDUSSCGKSA-N 441.366 4.043 10 10 IICE COc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1=O 2296173536 JAXBRAZJGOJZII-UHFFFAOYSA-N 449.894 4.423 10 10 IICE CC[C@@H](C)c1ccc(N2C(=O)NC(=O)C(=Cc3ccc(O)c(Br)c3)C2=O)cc1 2296398056 QHTIXXPZKASWSP-GFCCVEGCSA-N 443.297 4.335 10 10 IICE CCOc1cc(OCC)c(/C=C2/SC(=S)N(CCOC)C2=O)cc1Br 2953875 SEBWHCGCZUKAPP-OQLLNIDSSA-N 446.388 4.094 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(O)cc1O)N2)N1CCCCC1 13639855 HCTRFWHLEDSEDK-YZZKKUAISA-N 426.538 4.099 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cccc(O)c3)C2=O)ccc1OCCC(=O)O 16919522 MXYRLWIFQORQQQ-WOJGMQOQSA-N 445.518 4.050 10 10 IICE O=C1c2ccccc2-c2onc3c(N4CCCCCC4)cc(NCCN4CCOCC4)c1c23 20322179 DPPDZHRAHLZKEP-UHFFFAOYSA-N 446.551 4.164 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\C3=Cc4cccc(OC)c4OC3)SC2=S)cc1 33514406 BDULHFZAVFBCRO-DEDYPNTBSA-N 439.558 4.467 10 10 IICE C[C@@H]1Oc2ccccc2C=C1/C=C1\SC(N2CCN(Cc3ccccc3)CC2)=NC1=O 34967985 MWCKZGZQIYNGJF-PAJXCOJRSA-N 431.561 4.182 10 10 IICE CCOC(=O)CCN1C(=O)/C(=C/c2ccc(OCCc3ccccc3)cc2)SC1=S 40938117 AIAUHAFIHLKSDP-SILNSSARSA-N 441.574 4.463 10 10 IICE COCCCCc1cccnc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 463016376 ZLZJZXYBDASLLA-UHFFFAOYSA-N 434.584 4.411 10 10 IICE COc1ccccc1N1C(=O)C(O)=C(c2cccc(OC)c2OC)[C@@H]1c1ccc(O)c(O)c1 526405614 AMYFAJAIQAOOOQ-QFIPXVFZSA-N 449.459 4.181 10 10 IICE CCn1nc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(C)cc3)c2C)c(=O)c2ccccc21 735726007 BURXIUJUCJYFGA-UHFFFAOYSA-N 443.503 4.172 10 10 IICE CC(C)N1CC[C@@H](NC(=O)NCc2ccc(N3CC=CC3)cc2)[C@@H]1c1ccc(F)c(F)c1 778673856 GUESULVOCFQJFA-RPWUZVMVSA-N 440.538 4.364 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3cc(C)cc(C)c3OC)n2)c1 800924952 JVVFSLYECYRPTB-UHFFFAOYSA-N 434.539 4.254 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N2C[C@H](C[C@@H]3COCC(=O)N3)c3ccccc32)c1C 807705485 JKWFUPOHBSYIDL-LEWJYISDSA-N 443.547 4.052 10 10 IICE Cc1cc(C(=O)N2CC[C@H](Oc3ccnc(CN(C)C(C)C)c3)C2)c(C)n1-c1ccccn1 856660198 PEUIKXWVWIWYIS-QHCPKHFHSA-N 447.583 4.018 10 10 IICE CCOc1ccc(-c2nc(NS(=O)(=O)c3c(C)nn(C)c3Cl)sc2C)cc1 917846549 UFGMBHPTRKFMPE-UHFFFAOYSA-N 426.951 4.013 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2ccc(N3CCOCC3)cc2)c2ccc(C)cc2)cc1 920056516 WASNTJPHZAWHJZ-SANMLTNESA-N 445.563 4.429 10 10 IICE CCCN1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@@H](CC)C3)CC1=O 1128128187 HAAYGJQRFNZLAU-HUUCEWRRSA-N 434.602 4.415 10 10 IICE CCN(CC)c1ccc(CNC(=O)CC[C@@H]2COC(C)(C)N2C(=O)OC(C)(C)C)cc1 1136300127 GUEHCRYWFZVVLJ-HXUWFJFHSA-N 433.593 4.301 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(Br)cc2O)cc1 1136480394 LCUVTCRDHHNAHS-GOSISDBHSA-N 433.346 4.042 10 10 IICE CCOC(=O)[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1cccc(C)c1C 1138577618 JCQVWZCSUXDYKG-SANMLTNESA-N 446.547 4.487 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(OCCN4CCNC4=O)cc3C)c2C)c1 1138814772 YGBMQIVGKHHGPI-UHFFFAOYSA-N 446.551 4.367 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCc3ccc4c(c3)OC(F)(F)O4)c2C)cc1 1164187040 JVQCVDRFYVVKTI-UHFFFAOYSA-N 428.435 4.397 10 10 IICE Cc1cc(CC(=O)NCc2ccc(N3CCNC3=O)cc2)c(C)n1-c1ccc(Cl)cc1 1288289233 BZIOYIOSARLQAF-UHFFFAOYSA-N 436.943 4.136 10 10 IICE CCOCc1nnc(N2CC=C(C(F)(F)F)CC2)n1Cc1ccc(N(CC)CC)cc1 1297118054 OPBFKARURSNGHC-UHFFFAOYSA-N 437.510 4.408 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3NC(=O)c3ccccc3)C2)cc1 1299770937 WRZCCUFFJDVEAT-IBGZPJMESA-N 429.520 4.204 10 10 IICE COC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)s1 1312586135 NEXPHTGBCZELDL-CQSZACIVSA-N 435.977 4.424 10 10 IICE CC(C)Cc1ccc([C@@H](CNC(=O)NCc2cccc(Br)c2O)N(C)C)cc1 1312816832 DTFGQJYKOFVSRU-HXUWFJFHSA-N 448.405 4.455 10 10 IICE CCOC(=O)c1c(NC(=O)c2cnc3n2CCOC3)sc(C)c1-c1ccc(F)cc1 1356320628 AQKUUZUCYQDMEX-UHFFFAOYSA-N 429.473 4.018 10 10 IICE CC(C)c1cccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1444506021 LGOQDQYRTWDTMX-NRFANRHFSA-N 426.561 4.267 10 10 IICE CCOC(=O)c1csc(CCNC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)n1 1447843356 QHLJVEYIAPWFCP-UHFFFAOYSA-N 425.554 4.317 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H]3CCCCC34CCCC4)cc2F)C[C@@H](C)O1 1460137825 OGZWMZRTHBSGMM-YYDVJCTNSA-N 431.596 4.148 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)cc1 1461339356 VGAMSYDXTQXFEN-HSZRJFAPSA-N 449.517 4.044 10 10 IICE CCCc1c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(C)cc1 1463276953 BHLXVZGRMWJJPS-VWLOTQADSA-N 433.600 4.232 10 10 IICE CCOc1cccc2c1OCC(C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)=C2 1465951309 KTEDOHACOJJHFC-HXUWFJFHSA-N 442.943 4.001 10 10 IICE CC(C)COc1ccc(C(C)(C)NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1470905511 PHDLNLZRGHVOCA-UHFFFAOYSA-N 439.600 4.417 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CCC[C@H](C)C2)cc1 1501847921 ZBZKUCVDHXHEAH-RRPUWOKSSA-N 441.620 4.133 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(F)(F)F 1520666450 RPZZFLBGCGQZIQ-UKRRQHHQSA-N 427.490 4.464 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@H]2c3ccccc3CN2C(=O)OC(C)(C)C)cc1F 1527014347 XTESYCJJJGLPCZ-NRFANRHFSA-N 427.520 4.390 10 10 IICE COc1ccc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1OC1CCCC1 1539236544 USURIBSYRDMRGI-JOCHJYFZSA-N 425.573 4.115 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cnnn1-c1cccc(Cl)c1Cl 1541080900 PGKPCTGQQCUBNR-UHFFFAOYSA-N 448.379 4.057 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](CN3CCC(C)CC3)C2)cc1 1544462775 XBKAGYKFUXPOJO-XMMPIXPASA-N 435.612 4.420 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H](NC(=O)OC(C)(C)C)c2c(F)cccc2F)c1 1545683913 DHOUQHWCRPEIDT-HXPMCKFVSA-N 436.455 4.122 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc(Oc4cccc(OC)c4)cn3)CC2)cc1 1545931869 ZLWADPLYGWRZSQ-UHFFFAOYSA-N 433.508 4.244 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(-c2ccc(C=O)s2)cc1 1546152207 XFTRFOYFGBJSMA-UHFFFAOYSA-N 443.908 4.402 10 10 IICE CSC[C@@H]1CCCN1c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)cc1C 1555894975 AHTFVBQYPZJVKX-NRFANRHFSA-N 436.629 4.403 10 10 IICE C[C@@H](NC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1)c1ccc(N(C)C)cc1 1556259492 ATSWIWMABTYBOI-MRXNPFEDSA-N 441.528 4.184 10 10 IICE CC(C)(C)c1ccc(S(=O)(=O)CCN(Cc2ccccc2O)C[C@H]2CCCO2)cc1 1559634991 HDQDMQCXLNFILP-OAQYLSRUSA-N 431.598 4.145 10 10 IICE CC[C@@H](Cc1ccccc1)N(CC)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1564895744 SSVCAQBOHQRCHA-FQEVSTJZSA-N 431.527 4.354 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cnn(-c2cccc(Cl)c2)c1 1566357086 WJUQAYZEEWNGPV-LJQANCHMSA-N 445.350 4.279 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCc3ccc(Br)cc3F)C2)cc1 1585665259 OYDUOQLYHDLVML-OAHLLOKOSA-N 435.337 4.172 10 10 IICE C[C@@H]1SCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)[C@H]1C 1613037196 GVFRETIBTRZNLZ-FTRWYGJKSA-N 433.597 4.103 10 10 IICE C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1630288252 UKHXOHYVDCFZJO-FQEVSTJZSA-N 430.548 4.398 10 10 IICE Cc1oc2ccccc2c1CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1633488229 NWSNWAFWANANNJ-UHFFFAOYSA-N 442.518 4.239 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)C2CC2)cc1 1634218897 LJCWGJXUWNERDV-AHWVRZQESA-N 439.575 4.340 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1nc(Cl)sc1Cl 1639827483 VWMFCWKMWVERTE-UHFFFAOYSA-N 430.357 4.452 10 10 IICE COc1ccc(N2CC[C@@H](Nc3cc(C(F)(F)C(F)(F)F)ncc3[N+](=O)[O-])C2)cc1 1640146382 PYKHVWTUNWVUSA-LLVKDONJSA-N 432.349 4.343 10 10 IICE COc1cnc(C(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)nc1 1648493645 JZNNIDTWCLMUHX-SFHVURJKSA-N 430.430 4.411 10 10 IICE CC(=O)N1CCCCC[C@H]1C1CCN(Cc2cc(Br)cc(F)c2O)CC1 1651748323 IQBGUZMZHCNRBZ-IBGZPJMESA-N 427.358 4.297 10 10 IICE C[C@@H](N[C@@H](CF)c1ccc(F)cc1)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1655389546 MJWZDFJXWYQCES-SZNDQCEHSA-N 434.442 4.229 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N1C[C@H](C)C(F)(F)[C@H](C)C1 1724237101 XPIZBNLXGXJFNO-CALCHBBNSA-N 428.531 4.423 10 10 IICE CC[C@H]1[C@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1727660695 DPDYOPSEKKOVIG-VGSWGCGISA-N 434.588 4.114 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](C)C3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1742118455 FOOJRNPKCXGKPU-LJQANCHMSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2cscn2)cc1 1746094744 ZGPASLMBBXVGTP-UHFFFAOYSA-N 447.612 4.251 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1nnc(C)s1 1763499857 OHTGWTRQKJQHAF-MRXNPFEDSA-N 425.606 4.236 10 10 IICE CC(C)(C)OC(=O)N1CCCN(/N=N/c2ccc(I)cc2)CC1 1860484228 CWYFWEFRCNURTQ-VHEBQXMUSA-N 430.290 4.233 10 10 IICE CNC(=O)[C@@H]1CCCC[C@H]1C(=O)Nc1sc(C)c(-c2ccc(C)cc2)c1C(=O)OC 1866193013 NVKNKSUGPOWESY-IAGOWNOFSA-N 428.554 4.309 10 10 IICE O=C(N[C@]1(c2cc(F)ccc2O)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952765804 FXGNSEQKMAVULM-BWKNWUBXSA-N 433.435 4.370 10 10 IICE O=C(N[C@]1(c2cc(Cl)cc(Br)c2O)C[C@H]1C(=O)O)OCc1ccccc1 1952821757 SBTKKBYBUNHJNT-UGSOOPFHSA-N 440.677 4.034 10 10 IICE O=C(O)CCCN1C(=O)C(=Cc2ccc(-c3cccc([N+](=O)[O-])c3)s2)SC1=S 2053552016 DJZZEVTXQIENJY-UHFFFAOYSA-N 434.520 4.389 10 10 IICE COc1ccc(Br)cc1C=C1C(=N)N2N=C(c3ccccc3)SC2=NC1=O 2297335553 CBBZMWLZBNJMCX-UHFFFAOYSA-N 441.310 4.125 10 10 IICE COc1cccc(-n2c(C)cc(C=C3C(=N)N4N=C(c5ccco5)SC4=NC3=O)c2C)c1 2297469656 ALYKMQBFUIKNRN-UHFFFAOYSA-N 445.504 4.363 10 10 IICE CCOc1cccc(C=C2SC(=S)N(c3cc(OC)c(OC)c(OC)c3)C2=O)c1O 2321738464 BXIKQSJPHFTVKY-UHFFFAOYSA-N 447.534 4.223 10 10 IICE Cc1ccc(CNc2cnn(CCCNC(=O)OC(C)(C)C)c2)c(O)c1Br 2381141031 SXKBNICRSBZCLA-UHFFFAOYSA-N 439.354 4.187 10 10 IICE C[C@]12C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1ON(c1ccccc1)[C@@H]2c1ccccc1O 20069328 GDRSKIHXMKXIFJ-ZFGGDYGUSA-N 434.879 4.487 10 10 IICE CN1C(=O)/C(=C2/SC(=S)N(c3cccc(Br)c3)C2=O)c2ccccc21 33324090 DHVJSDGPISHVGJ-CCEZHUSRSA-N 431.336 4.202 10 10 IICE Cc1cc(/C=C2\C(=O)N(C3CCCCC3)C(=O)N=C2O)c(C)n1-c1ccc(C(=O)O)cc1 35363547 IYDHZHGKPIUUAG-MOSHPQCFSA-N 435.480 4.427 10 10 IICE CCN(CC)c1ccc(CN(C(=O)c2cccs2)C(C)C)c(OS(=O)(=O)CC)c1 37402149 GSSNVMIRNYMLML-UHFFFAOYSA-N 438.615 4.374 10 10 IICE CC(=O)N(C(=S)N1CCN(C(c2ccccc2)c2ccccc2)CC1)c1ccc(N)cc1 244315142 XFRMRJJIDNRODL-UHFFFAOYSA-N 444.604 4.314 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1 732473172 YPCMJXNNNGGAMK-IBGZPJMESA-N 442.560 4.067 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(Br)ncc1F 762764126 BBZNQZCVCJIFNQ-MRXNPFEDSA-N 447.396 4.366 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCc2ccc(N3CCCC3)cc2)C1 767588855 VTIGXJISADGGQL-UHFFFAOYSA-N 430.596 4.324 10 10 IICE COc1ccc(Br)c(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 768671004 WLKYWLBCINCICH-UHFFFAOYSA-N 444.417 4.280 10 10 IICE CC[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(Cl)c(Cl)c1O 775513510 KHQGAXSAXXDWKE-SQGPQFPESA-N 448.394 4.339 10 10 IICE Fc1cc(CN[C@H]2CC[C@@H](c3ccccc3)C2)ccc1N1CCN(c2ncccn2)CC1 780511003 MKPPQALUCGPGDI-PKTZIBPZSA-N 431.559 4.368 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(F)cc(F)c3Br)CC2)cc1 785872957 IBJONQJTTBJPOZ-UHFFFAOYSA-N 426.261 4.090 10 10 IICE COC(=O)c1cc2ccccc2c(CN(CCc2ccccn2)Cc2ccncc2)c1O 797824965 NCFDAWHTYCIRPE-UHFFFAOYSA-N 427.504 4.367 10 10 IICE O=C(Cc1c(F)ccc(Br)c1F)NCc1ccc(N2CCSCC2)cc1 800327204 SOWMJGPIRIBWSW-UHFFFAOYSA-N 441.341 4.139 10 10 IICE CC(C)OC(=O)NCc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1 806275737 SVXAAENLKQKCOC-UHFFFAOYSA-N 436.306 4.111 10 10 IICE Cc1ccc(S(=O)(=O)C2(C(=O)N(C)Cc3ccc(N4CCCC4)cc3)CCCC2)cc1 1124549634 NWUWMLKQXQNMEB-UHFFFAOYSA-N 440.609 4.340 10 10 IICE Cc1ccc(-c2nc(C(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)cs2)n1C 1125258390 HVAWBVPZBSWBDE-HZPDHXFCSA-N 442.560 4.140 10 10 IICE CC1(C)C[C@H](CNC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CCO1 1129509840 JTALUQKATRZIPM-VQCBNXJZSA-N 438.640 4.051 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1(F)CCN(C(=O)OC(C)(C)C)CC1 1135746023 KNNOYAGQVOITJG-UHFFFAOYSA-N 433.568 4.375 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCc3ccc(OCC(F)(F)F)nc3)c2C)cc1 1138556720 GQLHFCGTJIKUFW-UHFFFAOYSA-N 447.457 4.411 10 10 IICE Cc1cc(C(=O)N2CCc3ccnc(N)c3C2)c(C)n1-c1ccccc1Br 1150701815 QGWNRQJNIRMTPF-UHFFFAOYSA-N 425.330 4.032 10 10 IICE CCOC(=O)[C@H](CC1CC1)NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1154182086 DUDYDURRZGLCOK-IBGZPJMESA-N 433.346 4.318 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cc(Cl)ccc2O)[C@H]1c1ccccc1OC 1165498308 LOPQMIGYYABOLJ-WMZHIEFXSA-N 444.959 4.450 10 10 IICE COC(=O)[C@H](Cc1cc2ccccc2o1)NC(=O)Cc1cc(C)n(-c2ccccc2)c1C 1288740876 XTQOGVAHPFOMRE-QHCPKHFHSA-N 430.504 4.283 10 10 IICE Cc1cnc([C@H](C)Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1290293948 PIGPZAXVHSSBOC-BEFAXECRSA-N 427.574 4.430 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1293586897 LLQBARVVHKRKBM-PTUXOGIPSA-N 441.620 4.418 10 10 IICE Cc1ccc(C(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)cc1-n1c(C)cc(C=O)c1C 1294284873 QALRASLIHXVNBT-DEOSSOPVSA-N 438.568 4.405 10 10 IICE Cc1cc(C(=O)NC[C@H]2CC[C@H](C(F)(F)F)O2)c(C)n1-c1ccc(Br)cn1 1303441554 DGOLDMHGHMVCFJ-UKRRQHHQSA-N 446.267 4.091 10 10 IICE C[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1)c1ccc(N(C)C)cc1 1306829453 FSLCGHDQVMOYHJ-CJFMBICVSA-N 445.563 4.468 10 10 IICE C[C@H]1[C@@H](C(F)(F)F)CCN1[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307734521 PISDBCBECIXGJO-AHIWAGSCSA-N 430.426 4.062 10 10 IICE C[C@H](NC(=O)N1CCC[C@H](NC(=O)c2ccc(Cl)cc2)C1)c1ccc(N(C)C)cc1 1312534711 HAANBHVCBXTASC-JXFKEZNVSA-N 428.964 4.071 10 10 IICE CN(Cc1ccccc1)C1(CNC(=O)NCc2cccc(Br)c2O)CCC1 1312711702 FCCYSVIUTFZHFY-UHFFFAOYSA-N 432.362 4.009 10 10 IICE CCN(CCn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1)C(C)C 1313816902 YSIZFOJIVBZNDW-UHFFFAOYSA-N 440.636 4.001 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCC1CC1 1314557991 IZKVVHXVHLDJQU-HKBQPEDESA-N 439.629 4.358 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CCc3ccc(Br)cc3)cc2F)C[C@@H](C)O1 1350933305 MSJVAQWWTTUJRA-HZPDHXFCSA-N 449.364 4.451 10 10 IICE C[C@@H](NC(=O)CCc1cccc(F)c1Br)c1ccc(N2CCOCC2)cc1 1351695710 BJLIGKFLACCKQU-OAHLLOKOSA-N 435.337 4.235 10 10 IICE CC(C)COc1cccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1 1355131193 UESBDFFKALKGHX-KDURUIRLSA-N 444.547 4.169 10 10 IICE Cc1cc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)ccc1N(C)C 1356496219 NPMCJHSDKWJWGP-CPNJWEJPSA-N 443.569 4.430 10 10 IICE COc1ccc(N2CCCN(C(=O)Cc3c(Cl)cccc3Br)CC2)cc1 1358140993 RREIOZADDXWEMT-UHFFFAOYSA-N 437.765 4.393 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)Cc1ccccc1Cl 1441783525 LNJFODLMYKNZJU-ROUUACIJSA-N 447.982 4.231 10 10 IICE Nc1cn(Cc2ccc(C(=O)Nc3cccc(N4CCCC4)c3)cc2)nc1C(F)(F)F 1441790413 ILLFTJANKPZWAR-UHFFFAOYSA-N 429.446 4.385 10 10 IICE CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1448003634 IJXRIDUZIODNOD-RXVVDRJESA-N 439.556 4.202 10 10 IICE COC(=O)[C@H](C)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1460871946 FIINUTPUGILIFE-GOSISDBHSA-N 433.552 4.323 10 10 IICE Nc1c(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc(Cl)c1Cl 1465951388 LVKVHIUWMZFJKV-CYBMUJFWSA-N 428.747 4.329 10 10 IICE CC[C@@H]1CN(c2nnc([C@@H]3CCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1499727662 HPIUIMXULVHDLQ-TZIWHRDSSA-N 429.634 4.008 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(CC(=O)N(C)C)CC1 1500879997 AVQAJJQMIOYJBG-UHFFFAOYSA-N 448.615 4.457 10 10 IICE CCN(Cc1cnn(C)c1)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N(C)C)cc1C 1502051998 AFEXBEAYHBOBQK-UHFFFAOYSA-N 433.560 4.029 10 10 IICE C[C@@H]1CN(c2nnc(Cc3cccnc3)n2CCCSc2nccs2)C[C@@H](C)S1 1512486750 NLSDRDPYZRUWPU-HZPDHXFCSA-N 446.671 4.233 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512878447 ZDIRQSNQPXITRB-QUCCMNQESA-N 429.584 4.298 10 10 IICE Cc1ccc(I)cc1C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 1526187361 ZZNNXXCJKBAMKV-UHFFFAOYSA-N 434.321 4.470 10 10 IICE CCCOc1c(Cl)cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc1OC 1537477511 BAQOVFMGCBUWOA-FQEVSTJZSA-N 433.980 4.236 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CC[C@H](OCC(C)C)C1 1542227021 QEZSCLUOTCXTQU-QFIPXVFZSA-N 434.588 4.014 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1)c1cc(O)cs1 1543332271 FPFDZXLWGPPBLH-UHFFFAOYSA-N 426.878 4.299 10 10 IICE CC[C@@H]1CCC[C@@H]1Cn1c([C@H]2OCC[C@H]2COC)nnc1N(C)Cc1ccccc1O 1546643693 OPPXERJRZLANTB-VFSLUADLSA-N 428.577 4.170 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)C3(c4ccccc4)CCCCCC3)cc2)CC1 1556199388 JWPHUHPDJLTTHB-UHFFFAOYSA-N 433.596 4.264 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N(Cc2ccccc2)[C@H]2COC(C)(C)C2)N(C)C)cc1 1565452732 JVZQXAJCZRCUKB-DNQXCXABSA-N 438.616 4.135 10 10 IICE COc1cc(C)c([S@@](C)=O)cc1OC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1570510609 MIUPSWHOMYGAHQ-SSEXGKCCSA-N 425.506 4.180 10 10 IICE Cc1csc(CCCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)n1 1584396623 NDDUXLBEUHLJQB-UHFFFAOYSA-N 433.375 4.379 10 10 IICE CC[C@](C)(NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2)C(N)=O 1585333957 OCLHQIBCUYHWHI-OKQIWEBOSA-N 442.563 4.171 10 10 IICE Cc1cc(CC(=O)N[C@H](C(N)=O)c2ccc(Cl)cc2)c(C)n1-c1ccc(Cl)cc1 1586449695 HWCDGQWXVHXEQW-NRFANRHFSA-N 430.335 4.286 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@H](C)CC3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1611935071 GDUKJRAIOGAHHS-IBGZPJMESA-N 448.615 4.457 10 10 IICE CCOCc1nnc(N2C[C@@H](C)C[C@@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616731566 PGDNHCNJJNNKLJ-ICSRJNTNSA-N 429.634 4.041 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)c2ccccc2Br)N(C)C)cc1 1616866544 FKAKZFJLSUIISO-HXUWFJFHSA-N 432.406 4.212 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCC1 1617409441 OOZBGIWAOYLFTB-WJOKGBTCSA-N 439.629 4.358 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(C)c(-c2cnn(C)c2)c1 1618427215 DXMQDBOMFFCRMW-UHFFFAOYSA-N 448.567 4.398 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc21 1622634521 ANPBUUOQORKDKX-SFHVURJKSA-N 442.947 4.076 10 10 IICE O=C(Cc1ccc(O)c(O)c1)NC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 1625736081 FYAUGJSSDHZKDF-IBGZPJMESA-N 442.968 4.271 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)NCC2CC2)c(C)n1-c1ccc(C(C)C)cc1 1628986609 HAPTVNJYPSGYBK-JOCHJYFZSA-N 425.598 4.259 10 10 IICE O=C(NCc1cccc(-c2nc(CC(F)(F)F)no2)c1)c1cc2cc(O)c(O)cc2s1 1629007388 VKKGEIZHPWMZAH-UHFFFAOYSA-N 449.410 4.397 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cnc2ccccc2c1C(F)(F)F 1630282938 LFVKGFPMGJNGBQ-UHFFFAOYSA-N 429.442 4.145 10 10 IICE CCN(CC)c1ccc(CNC(=O)CCc2cc3c(C)cc(=O)oc3cc2OC)cc1F 1633263198 COPJBZUAOCPEGP-UHFFFAOYSA-N 440.515 4.344 10 10 IICE Cc1cc(-c2csc(NC(=O)[C@@H](CC(C)C)C(N)=O)n2)c(C)n1-c1ccc(F)cc1 1638142019 KCDMPHYFOOCYLT-SFHVURJKSA-N 428.533 4.443 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H]2CSCCN2Cc2ccccc2)c1 1638504257 ZEZOUFATDSUROE-VWLOTQADSA-N 447.604 4.254 10 10 IICE C[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C)c1cc(Cl)cc2c1OCC2 1638652392 ZRWHWIGRFHWGBI-YCRPNKLZSA-N 430.980 4.004 10 10 IICE Fc1cc(CNc2ccnc(CSc3ccccc3)n2)cc(F)c1N1CCOCC1 1640009078 MWSFXGMPLWLUSU-UHFFFAOYSA-N 428.508 4.496 10 10 IICE CCOC(=O)c1sc2nc(CN(C)C)nc(NCc3cccc(Cl)c3O)c2c1C 1640521019 OTMNRGQXEKKEGN-UHFFFAOYSA-N 434.949 4.209 10 10 IICE COC(=O)C[C@@H]1CCC[C@H]1NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1640859795 ZLQDEHURDWXIMB-HNAYVOBHSA-N 433.346 4.318 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCCC[C@@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1642611271 KNVXXBZWIKEEIL-YOSAUDMPSA-N 439.575 4.283 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3c(S(C)(=O)=O)nc4ccccc43)c2C)cc1F 1643567493 MCXUYRURSHDIMG-UHFFFAOYSA-N 439.512 4.178 10 10 IICE CN1C(=O)CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)[C@@H]1c1ccc(C(F)(F)F)cc1 1644590978 XTNDIORAIUYPLB-APWZRJJASA-N 440.849 4.290 10 10 IICE Cc1cc(C(=O)NC[C@@]2(OC(C)C)CCOC2)c(C)n1-c1ccc(Br)cc1 1652382128 OPQNKFXTSFXPLP-NRFANRHFSA-N 435.362 4.171 10 10 IICE COc1ccc([C@@H](CNC(=O)CN[C@H](C)c2ccccc2O)c2c[nH]c3ccccc23)cc1 1655349607 MVOIAKRCFJQQPY-WZONZLPQSA-N 443.547 4.481 10 10 IICE Cc1cc(CN2CCC[C@H]([C@@H]3C[C@H](NC(=O)OC(C)(C)C)CCO3)C2)ccc1N(C)C 1659304098 YBFSIGKGUSRACC-XJUOHMSHSA-N 431.621 4.345 10 10 IICE CSc1ccccc1OC[C@@H](O)CN(C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(C)C 1671844314 NVAVRWLXDBQZCH-NQIIRXRSSA-N 445.629 4.395 10 10 IICE CCc1ccc([C@H](CNC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)N(CC)CC)cc1 1673207229 BWPNMOXGVFCRRZ-DHLKQENFSA-N 438.616 4.219 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@H](C(F)(F)F)O3)cc2Cl)C1 1680562818 NGIQWYCJRRUYTR-QIIPPGSGSA-N 433.902 4.485 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCCSC[C@@H]3c3ccccc3OC)C2)cc1 1683945385 RUNLQQATAPNKJY-PGRDOPGGSA-N 441.597 4.172 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3cccc(F)c3)C[C@H]3CCCO3)C2)cc1 1686854780 CWADVAHRGXJBOJ-HYBUGGRVSA-N 441.547 4.051 10 10 IICE COC[C@@H]1CCCN(c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)C1 1697850409 GHDOYXSYYVIGQV-MRXNPFEDSA-N 433.603 4.348 10 10 IICE COCCCCCn1c(C2CCCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1697966201 HAPNKCQNJCDUMA-UHFFFAOYSA-N 445.583 4.227 10 10 IICE CCCc1nc(C)c(Cn2c(-c3cccc(C)n3)nnc2N(C)Cc2ccccc2O)o1 1709540816 KEYBLZNSBJTPGY-UHFFFAOYSA-N 432.528 4.288 10 10 IICE CC(C)CC[C@@](C)(O)Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1723367134 ZIPSOPSXALCSOV-HSZRJFAPSA-N 428.602 4.460 10 10 IICE CCC1(CC)CN(c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1727341925 QJZCYVVWSWSZOD-SFHVURJKSA-N 447.624 4.147 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1764935881 CKNKGUMRHCLFLX-FQEVSTJZSA-N 448.615 4.162 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3OCC[C@H]3COC)nnc2N2CC[C@H](C)[C@@H]2C)cc1 1764941219 GVOIGQRXCRISRK-YDWJEQILSA-N 441.620 4.131 10 10 IICE CCCCOc1ncccc1Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccccc1O 1765879786 OFTZTZQMZBWMDD-OAQYLSRUSA-N 437.544 4.094 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1CCc1cc(C(F)(F)F)ccn1 1768682927 AJQWKNTXLYZSJU-UHFFFAOYSA-N 431.462 4.229 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@@]21CNCc1ccc(Br)cc1O 2089363624 VRUXHRNBFICGKS-FOIQADDNSA-N 425.367 4.424 10 10 IICE CC[C@H](NC[C@@H](CCOC)NC(=O)OC(C)(C)C)c1cc(Br)ccc1O 2225569037 LLYFUQUPJJLNRE-ZBFHGGJFSA-N 431.371 4.125 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc4c(c3)OCCO4)SC2=S)cc1 2321569878 BYSHYFDMSKTWIU-UHFFFAOYSA-N 427.503 4.040 10 10 IICE Cc1ccc(CN[C@H]2CCCN(C(=O)OC(C)(C)C)C23CC3)c(O)c1Br 2352950395 RYBDJZWRDOXDCV-HNNXBMFYSA-N 425.367 4.485 10 10 IICE O=C1N=C(N2CCN(Cc3ccccc3)CC2)S/C1=C/c1ccc(Br)cc1 20289445 XJDJAWDHHBPHEM-XMHGGMMESA-N 442.382 4.237 10 10 IICE C=CCN1C(=O)/C(=C/c2c(NC3CCCCC3)nc3ccc(C)cn3c2=O)SC1=S 33507166 KZTOGCBMUFUDSU-ATVHPVEESA-N 440.594 4.135 10 10 IICE CN(CC(=O)N1N=C(c2cccn2C)C[C@H]1c1ccc(Cl)cc1)C(=O)CC(C)(C)C 35962131 XVWJLZORPVIPQS-FQEVSTJZSA-N 428.964 4.251 10 10 IICE CCC(=O)NCCc1c(/C=C2/C(=O)N(c3cccc(C)c3)C(=O)N=C2O)[nH]c2ccccc12 38162041 OHCNHCGDBCKVAJ-XMHGGMMESA-N 444.491 4.052 10 10 IICE CC(=O)[C@H](N=Nc1cc(C(F)(F)F)ccc1Cl)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 252601278 DZEAVLGCIUOLBY-HNNXBMFYSA-N 439.781 4.208 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H](NCc2cc(Br)cc(F)c2O)C12CCC2 715765324 GGORYCNNTQJLPK-LSDHHAIUSA-N 429.330 4.219 10 10 IICE Cc1occc1C(=O)NC1CCN(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)CC1 727437512 SOZULWLGRGIBGC-UHFFFAOYSA-N 437.515 4.212 10 10 IICE CN1C(=O)c2cccc3c(S(=O)(=O)Nc4nc(-c5ccc(F)cc5)cs4)ccc1c23 753691549 KXVVDXWGGNUBJP-UHFFFAOYSA-N 439.493 4.493 10 10 IICE COc1ccc(S(=O)(=O)Nc2cccc(CN[C@H](C)c3cc(OC)ccc3O)c2)cc1 756581167 AAXAHAGBEQMJHU-MRXNPFEDSA-N 442.537 4.061 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(Br)nc2)C1 766820674 JDLYDWWQJZYUTR-UHFFFAOYSA-N 427.346 4.204 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cc(F)ccc1Br 768532970 JWFZITSPYWHASM-UHFFFAOYSA-N 446.364 4.050 10 10 IICE Cn1ncc(Br)c1/C=C1/SC(=S)N(CCSc2ccccc2)C1=O 778245154 FUYFKHLQISOMDG-NTEUORMPSA-N 440.413 4.176 10 10 IICE Cc1cc(Br)c(O)c(CN2CCOC[C@@H]2c2noc(-c3ccccc3)n2)c1 781921046 RDOHRBIGQLSXLW-QGZVFWFLSA-N 430.302 4.087 10 10 IICE C[C@@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)c1ccc(N(C)C)cc1 782083598 RZKIHVOMXKMKOL-CQSZACIVSA-N 434.462 4.477 10 10 IICE C[C@H](NC(=O)N1CC[C@@]2(CCCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 801763822 NQZCJPTXGAAPDZ-UUOWRZLLSA-N 430.593 4.246 10 10 IICE O=C(NCCc1ccc(O)c(O)c1)c1cccc(Sc2cccc(Br)c2)n1 1137464909 VONOUZNRCUTBHK-UHFFFAOYSA-N 445.338 4.379 10 10 IICE Cc1cc(CC(=O)N(C)[C@@H](CNC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1138531030 OWCGJABUJBJPQN-QFIPXVFZSA-N 425.573 4.398 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)ccc1F 1140545076 OBVGTUUYWIVRDS-UHFFFAOYSA-N 429.517 4.010 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3ccccc3[S@@](=O)C(F)(F)F)c2)CC1 1153553092 XFKGHFCDHAYMKB-SSEXGKCCSA-N 439.503 4.097 10 10 IICE O=C(Nc1ccccc1)Nc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1167762203 JODXUQLRGQQRSY-UHFFFAOYSA-N 444.535 4.222 10 10 IICE Cc1nn(COCC[Si](C)(C)C)c(C)c1CCC(=O)NCc1cccc(Cl)c1O 1180410969 WBFBNXYAQZDAPH-UHFFFAOYSA-N 438.044 4.420 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)N(C)C)cc1 1256237203 UGHCAIXQZRBYKG-FQEVSTJZSA-N 434.506 4.363 10 10 IICE CCC(C)(C)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1305283263 WKROYGBSWVVPTR-UHFFFAOYSA-N 436.604 4.193 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](Oc3ccccn3)C2)n1Cc1ccc(N(C)C)cc1C 1305463543 NQBJTYNVSXUOQQ-XMSQKQJNSA-N 434.588 4.267 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N2CCC(F)(F)CC2)cc1 1313677578 UQRMIKLJSIFVQJ-UHFFFAOYSA-N 428.531 4.414 10 10 IICE CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1353910605 LCEUFRWULCEAMD-NBGIEHNGSA-N 433.596 4.245 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3=Cc4ccccc4O[C@@H]3C(F)F)cc2F)C[C@@H](C)O1 1357836130 NXXFIHSQVMGEOU-KIMHZCHSSA-N 446.469 4.165 10 10 IICE CC[C@@H](CC(F)(F)F)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1435818646 LIOWHHPBGHMKAQ-GFAPJHNFSA-N 434.480 4.264 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc(CN4CCC[C@@H]4C(N)=O)c3)c2C)c1 1442020458 WJXMOKSYGPQWKD-RUZDIDTESA-N 444.579 4.413 10 10 IICE O=C(C/C=C\c1ccc(Br)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 1444664788 RGYQQIWYAXLUOU-UPHRSURJSA-N 443.385 4.378 10 10 IICE CCOC(=O)C1(N(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)CCCCC1 1457623138 AVUKMPIZEXJDKG-UHFFFAOYSA-N 439.600 4.132 10 10 IICE COc1cc(F)c([C@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1465051007 DCWICJXFZADFCI-INIZCTEOSA-N 438.499 4.483 10 10 IICE Cc1cc(CCNC(=O)N2C[C@@H](NC(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1470969045 OWHZHCHVWCLBKH-UTKZUKDTSA-N 440.588 4.334 10 10 IICE O=C(Nc1nc2cccc(Cl)c2[nH]1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1472560279 DCPLDEWJLITTKP-UHFFFAOYSA-N 448.913 4.037 10 10 IICE CC[C@H]1c2ccccc2CCN1CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1473168153 ORCJMOXDJQUIQF-GLDPYIMESA-N 439.575 4.065 10 10 IICE CCCN1CCCC[C@@H]1Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccccc1O 1500992998 AIPZYRMOXYNHJW-OAQYLSRUSA-N 434.588 4.255 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCCO2)n1CC(C)(C)N1CCCCC1 1503487179 ICYZMNHRIQETER-OAQYLSRUSA-N 427.593 4.126 10 10 IICE Cc1nc2ccccc2c(=O)n1-c1ccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)cc1 1517372807 MIWNZLKOANRWOE-QGZVFWFLSA-N 426.520 4.251 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C1Cc2ccccc2C1 1526773018 BUHASQLPVYGAGE-NDENLUEZSA-N 440.565 4.043 10 10 IICE C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1537483503 OJGBFRHWYRBCOX-OZIPEELISA-N 435.490 4.474 10 10 IICE CCn1ncc(Br)c1C(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1538422441 WXNUHIYQTZXMBC-CYBMUJFWSA-N 439.785 4.485 10 10 IICE CC[C@@H](C)c1nnc(N(C)CCC2CCOCC2)n1Cc1ccc2c(c1)CCCN2C 1545351989 GURIXEIXMVYHLB-LJQANCHMSA-N 425.621 4.475 10 10 IICE Cc1ccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)cc1-n1c(C)cc(C=O)c1C 1556052007 CHURMFAKSWUSST-NRFANRHFSA-N 439.556 4.248 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(Br)ccc1N 1556426575 SFIPWEQOFJXRIP-UHFFFAOYSA-N 448.361 4.034 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 1564446433 SXNJDDHJENASSW-AEFFLSMTSA-N 432.971 4.363 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CCCCCN1C(=O)OC(C)(C)C 1565445386 XUONQDDIIDWFCA-NRFANRHFSA-N 432.609 4.464 10 10 IICE Cc1cc(C(=O)COc2ccc(-n3cnnn3)cc2)c(C)n1-c1cccc(C(F)(F)F)c1 1613289816 PHDKKSYPEMARGC-UHFFFAOYSA-N 441.413 4.350 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)C2)cc1C 1617513537 DQBILUATFLKANN-OAQYLSRUSA-N 445.519 4.147 10 10 IICE CN(C)C(=O)CCCn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1617587098 FWAFLOJYQOBSTO-UHFFFAOYSA-N 438.620 4.041 10 10 IICE COCCO[C@H](C)c1nnc(N(C)C2CCC(C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1619965825 LZMGRZXTCSGMKR-QPIRBTGLSA-N 447.599 4.270 10 10 IICE CCOc1ccccc1C(=O)N1CCN(C(=O)c2cc(C)ccc2-n2c(C)ccc2C)CC1 1624884497 NOJQTLGTXQWGFA-UHFFFAOYSA-N 445.563 4.399 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](NC(=O)c2ccc(OC)cc2)c2ccccc2)cc1 1626085758 PTJQIDZAUGZBOV-VWLOTQADSA-N 445.563 4.329 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3[nH]cnc3C(=O)c3ccccc3)cc2Cl)C1 1634022731 OSZQYIZSQQVHBH-MRXNPFEDSA-N 436.943 4.460 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccccc2C(=O)N2CCC[C@H](O)C2)c1C 1634177125 XKCIPBYXPMUERW-FQEVSTJZSA-N 431.536 4.252 10 10 IICE COC(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)o1 1634521628 XAYPBBHZZIWQSA-UHFFFAOYSA-N 431.286 4.166 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 1634611142 CCZUSSMPASCTJP-DEOSSOPVSA-N 438.616 4.074 10 10 IICE O=C(c1ccc2nc(O)n(CC(F)(F)F)c2c1)N(Cc1ccco1)Cc1ccccc1O 1635647310 GQCODNMMAMEBDY-UHFFFAOYSA-N 445.397 4.445 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)C1(S(=O)(=O)c2ccc(F)cc2)CCCCC1 1635960006 UALJNCRPFOLIKN-UHFFFAOYSA-N 445.556 4.203 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3nn(-c4ccc(C(C)C)cc4)cc3O)CC2)cc1 1636702255 JRBUWZGVUKCVTL-UHFFFAOYSA-N 434.540 4.062 10 10 IICE CN(Cc1ccccc1OC(F)(F)F)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1638917851 LXEYSSKDNRIXLP-LJQANCHMSA-N 438.494 4.096 10 10 IICE CCOC(=O)c1oc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1C(F)(F)F 1639305821 LNJOTTZDLJRNLE-RYUDHWBXSA-N 445.413 4.235 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CC2)[C@@H]2CCCOC2)c(C)n1-c1ccc(Br)cn1 1639929327 ZBWPMQZHNCZDMZ-UZLBHIALSA-N 432.362 4.187 10 10 IICE COc1ccc(NS(C)(=O)=O)cc1NC(=O)c1cc(C)n(-c2ccccc2C)c1C 1641188397 XKOBSCXDSWHQCZ-UHFFFAOYSA-N 427.526 4.035 10 10 IICE COC(=O)c1cc(Br)cc(C(=O)NCc2cc(Cl)cc(Cl)c2O)c1 1641997215 JHPAQPXAKQDWOV-UHFFFAOYSA-N 433.085 4.178 10 10 IICE CCOC(=O)Cc1csc(CNc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)n1 1651418342 DCKNFUUYCUYBTK-UHFFFAOYSA-N 425.466 4.000 10 10 IICE CC1(C)CCc2ccccc2[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C1 1676126592 STZJFYBCUHAWGF-XMMPIXPASA-N 448.611 4.291 10 10 IICE CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1676653842 YXJLYSUOJKDFGX-CAOCKLPOSA-N 438.616 4.165 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)N[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)cc1 1684737936 FAASQPZAKVMJKR-WGSAOQKQSA-N 442.560 4.113 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1C[C@@H](OCc2ccccc2)C1(C)C 1686204524 FOMWWLTZTOJPTG-DNQXCXABSA-N 437.584 4.049 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NC(=O)NCc2cc(Cl)cc(Cl)c2O)C(C)(C)C1 1687728547 YBUSGRJYUXGPRU-AWEZNQCLSA-N 432.348 4.144 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@H](C)c3nccs3)CC2)cc1 1711865477 WXKIBLYSCXUYAW-GOSISDBHSA-N 440.617 4.387 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2cnn(CC(C)C)c2C)n1 1724477774 GNDNMZGGBWDJLX-UHFFFAOYSA-N 445.571 4.200 10 10 IICE CCC[C@@H](Cn1c(N2CCCN(c3ccc(OC)cc3)CC2)nnc1C(C)(C)C)OC 1745291993 XANBFKKERBSDRD-NRFANRHFSA-N 429.609 4.116 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nccn1C(F)F 1745903718 YJAQZHNJOUVZTK-UHFFFAOYSA-N 425.487 4.449 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2CCCC(F)(F)F)CCOC1 1751010366 SNVDSLOVMHFTNS-FQEVSTJZSA-N 442.482 4.003 10 10 IICE CC[C@]1(C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1764351529 GQTGQFGAVWOVCN-XMMPIXPASA-N 443.661 4.182 10 10 IICE CC(=O)Nc1nc2ccc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)cc2s1 1874178935 BRCXIXJMLPELEC-UHFFFAOYSA-N 441.468 4.282 10 10 IICE COc1ccc(N2CCN(S(=O)(=O)c3ccc(-c4ccc(F)cc4)cc3)CC2)cc1 1892089777 NIGRNLXVILNHSK-UHFFFAOYSA-N 426.513 4.012 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]2CC[C@]21CNCc1cccc(Br)c1O 2089360183 VCOYUNABVACMHW-YWZLYKJASA-N 425.367 4.424 10 10 IICE C[C@@H](NCc1ccc(Br)cc1O)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116257365 SSLNKSHOPDGWJS-PXAZEXFGSA-N 425.323 4.492 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2ccc(OCc3ccc(C)cc3)cc2)SC1=S 2314766866 CINCVSYPIUHLFX-UHFFFAOYSA-N 427.547 4.338 10 10 IICE Cc1ccccc1C(=O)NN1C(=O)C(=Cc2ccc(O)c(Br)c2)SC1=S 2314769113 TUMOLWLGTYHOHZ-UHFFFAOYSA-N 449.351 4.009 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(O)cc1O)N2)N1CCCCCC1 13639849 JKOMCCPTKZDSGT-GLDPYIMESA-N 440.565 4.489 10 10 IICE O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)c1 14471726 UBEIWOQSWLPNQS-JQVVWYNYSA-N 425.510 4.206 10 10 IICE CCCCCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N([C@H](C)CC)C1=O 33723688 OHFHLJNFDUJCJD-UMWKZLPKSA-N 430.599 4.296 10 10 IICE CCOC(=O)c1ccc2c(c1)N(CC)/C(=C/C=C1/SC(=S)N(CC)C1=O)N2CC 35105448 YROPMQKTDXTVGR-JYFOCSDGSA-N 431.583 4.135 10 10 IICE C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 71939543 SAOATMLEZPYVGG-CYBMUJFWSA-N 441.330 4.177 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@H]2[C@@H](c2ccc(Cl)cc2)N3)CC1 226720971 NTFMATRYGUUETK-TXTKFYIRSA-N 444.000 4.103 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(OC)c(OC)c3)[C@@H]2c2ccc(O)c(O)c2)cc1 526377249 PKBDKJMBTJHKQH-HSZRJFAPSA-N 449.459 4.181 10 10 IICE O=C(O)/C=C/c1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)cc1Br 705929761 IEAMOZGPYMJVRV-NNIASQDCSA-N 427.342 4.115 10 10 IICE Cc1nn(C)c2ncc(S(=O)(=O)Nc3nc(-c4ccc5ccccc5c4)cs3)cc12 727243975 NFXJEFXTDQERSM-UHFFFAOYSA-N 435.534 4.354 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Nc3cccc(-c4ncc(C)o4)c3)cc2F)CC1 731402297 WUFPRMIJSPMOGU-UHFFFAOYSA-N 437.519 4.253 10 10 IICE CC(=O)N(C)c1cccc(NC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 746034674 CCCRYLSMOQGNPC-KRWDZBQOSA-N 432.471 4.061 10 10 IICE CCc1ccc(-c2csc(NS(=O)(=O)c3ccccc3Cn3ccnc3)n2)s1 759485953 WIYSZOAKBWXXLN-UHFFFAOYSA-N 430.580 4.480 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Nc3nc(-c4ccsc4)ns3)cc2F)C[C@H](C)O1 790522812 JEZSMYLLEPVCCH-STQMWFEESA-N 447.561 4.341 10 10 IICE CCN(CC)c1ccc(CNC(=O)NC2CC(N3CCC(C(F)(F)F)CC3)C2)cc1F 792079298 JVCCUUPHRKTWFF-UHFFFAOYSA-N 444.517 4.276 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3ccnc(O)c3Br)cc2Cl)C1 800571799 NETQHEZTDROZON-LBPRGKRZSA-N 438.753 4.369 10 10 IICE O=C(CSc1cccc(C(F)(F)F)c1)NCc1ccc(N2CCOCC2)c(F)c1 917156306 MJMNEKHUDPUQSZ-UHFFFAOYSA-N 428.451 4.090 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CCC(=O)N(c3cccc(F)c3)C2)cc1 1124884349 DLFCWYISYVMYRG-FQEVSTJZSA-N 449.526 4.457 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)Nc1cc(C(F)(F)F)ccn1)c2[N+](=O)[O-] 1128928527 STOMCGQQTNEXOE-UHFFFAOYSA-N 441.321 4.036 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Cc3cccc(C(F)(F)F)c3)CC2)c(OC)c1 1132032181 NEPKBQQXCKXVJY-MRXNPFEDSA-N 436.474 4.250 10 10 IICE NC(=O)Cc1cc(Br)c(-c2ccc(NC(=O)c3cc(O)cs3)cc2)s1 1136968583 OXQYHUDEHUQUOR-UHFFFAOYSA-N 437.340 4.225 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccn(-c2ccccc2Cl)n1 1137438299 KNWQTWMYRHFZQM-QGZVFWFLSA-N 445.350 4.279 10 10 IICE CCS(=O)(=O)N1CCC(CNC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)CC1 1153920216 OGYPPNVPWODLFE-UHFFFAOYSA-N 445.629 4.009 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(Br)c1Cl 1162539656 KRFLFIUGRZFVFZ-UHFFFAOYSA-N 426.694 4.014 10 10 IICE Cc1cc(C(=O)N2CCC(CN(CCO)C(C)C)CC2)c(C)n1-c1cccc(Cl)c1 1162806530 WNRORJGJCHPHGB-UHFFFAOYSA-N 432.008 4.302 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3ncccn3)C2)c(C)n1-c1ccc(Br)cc1 1178845931 YVOCQUYFXULQKJ-MRXNPFEDSA-N 425.330 4.276 10 10 IICE Cc1cc(CC(=O)Nc2ccc(CN3C(=O)CSC3=O)cc2)c(C)n1-c1ccccc1 1264856061 WPXOZMNHAJUCCU-UHFFFAOYSA-N 433.533 4.471 10 10 IICE CN(CCc1ccccc1C(=O)Nc1cccc(N2CCOCC2)c1)C(=O)OC(C)(C)C 1264944883 LQMQWUWKIIGYFK-UHFFFAOYSA-N 439.556 4.185 10 10 IICE Cc1csc([C@H](C)Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)n1 1304619816 KQCQRFZXYVFJFG-MRXNPFEDSA-N 434.569 4.175 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1306274816 KNHWEJDRMCOHGS-MAUKXSAKSA-N 445.662 4.403 10 10 IICE C[C@H]1[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1313127547 JFJPKSNCXVAFPS-NASSWSRMSA-N 430.593 4.071 10 10 IICE Cc1ccc(-c2nc(C)c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)s2)cc1 1351133813 DNVVRUMIFMCEEV-HXUWFJFHSA-N 448.592 4.059 10 10 IICE CC[C@](C)(NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1nccs1 1353971785 NJJXWJVUMAZBIA-LFDGNKEFSA-N 449.598 4.315 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CCN2C(=O)CCc3cc(F)ccc32)cc1 1355695430 CADHKLYTJACZNJ-UHFFFAOYSA-N 449.526 4.383 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(F)cc4)on3)cc2F)C[C@@H](C)O1 1357836554 XNTQCPVCIUQNRK-HUUCEWRRSA-N 427.451 4.163 10 10 IICE CCN(CC)c1ccc(CNC(=O)Cc2cccc(I)c2)cc1F 1443772213 PMBMOAWEFAVLJC-UHFFFAOYSA-N 440.300 4.135 10 10 IICE Nc1c(Br)cccc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1444985603 JPRYMUHRGJZUDM-LBPRGKRZSA-N 440.288 4.032 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@@H](c2ccccc2)c2ncc[nH]2)cc1 1450370429 CXRLAFJOXCZMLG-VWLOTQADSA-N 426.520 4.420 10 10 IICE O=C(NC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1c(F)ccc(O)c1O 1457550452 BTALPZTYJINDKU-KRWDZBQOSA-N 446.931 4.481 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3c(C)cccc3F)c3c2CCC3)cc1 1461338636 RKDLUATYMIIHRH-UHFFFAOYSA-N 436.531 4.026 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1 1469518818 PGBCDHJPLBFPJA-UQBPGWFLSA-N 446.636 4.328 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@H]1CCC[C@@H](OC)C1 1469740234 HMDUGBJNFAGKMV-LDQXTDLNSA-N 432.948 4.224 10 10 IICE Cc1cccc(C[C@]2(C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c1 1479343399 HFVLHVBRCMPMCN-MHZLTWQESA-N 448.611 4.004 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCCC2(C)C)nnc1[C@]1(OC(C)C)CCOC1 1510679756 FJEGIRMTCPTMLX-VWLOTQADSA-N 441.620 4.120 10 10 IICE CCOC(=O)c1c(NC(=O)Cc2nnn(C(C)(C)C)n2)sc(C)c1-c1ccc(C)cc1 1524870095 RUVKPAIMDTVKHO-UHFFFAOYSA-N 441.557 4.131 10 10 IICE COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1535188700 CCHGAKFDHLXEQT-HSZRJFAPSA-N 444.453 4.427 10 10 IICE CCn1ncc(Br)c1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1538422444 WXNUHIYQTZXMBC-ZDUSSCGKSA-N 439.785 4.485 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)COc1ccc(Cl)c2ccccc12 1557115000 RPUCTFZGSFCSDX-UHFFFAOYSA-N 427.884 4.170 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@@H](OC(C)(C)C)[C@@H]1n1cccn1 1564771470 QYACLCSFFXXKIA-YPAWHYETSA-N 427.593 4.066 10 10 IICE Cc1cc(C(=O)NCc2cccc(N(C)C)n2)c(C)n1-c1cccc(Br)c1 1566536515 MVRGNMCKRGKRRW-UHFFFAOYSA-N 427.346 4.248 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Br)ccc2OC(F)F)cc1 1586649025 FWIJZOUQHWILDV-UHFFFAOYSA-N 443.288 4.268 10 10 IICE Cc1cc(-c2nnc(N(C)CC(C)(C)C)n2CCOCCCO)c(C)n1-c1ccccc1 1611933341 BMPMAUVMOUGNMA-UHFFFAOYSA-N 439.604 4.234 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N(CC)C[C@H]2CCCO2)cc1 1615378018 HZVWIJXVIDVNQK-JOCHJYFZSA-N 434.588 4.240 10 10 IICE CCOC(=O)c1sc(CC2CCN(Cc3cc(F)cc(C(C)=O)c3O)CC2)nc1C 1620542842 LORLUJQRAFOVCC-UHFFFAOYSA-N 434.533 4.130 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C(F)(F)c1cccc(OC)c1 1626517208 XTWLURJHULCXSM-UHFFFAOYSA-N 434.483 4.176 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccccc3NCc3ccco3)cc2F)CC1 1627360214 DIAKCQLIDJOKQD-UHFFFAOYSA-N 436.531 4.103 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)C2)cc1 1630618784 HLVWQODIHMHAOT-JOCHJYFZSA-N 445.563 4.100 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCCOc1ccc2c(c1)OCO2 1631167471 RBIKPSJUQGMJSC-UHFFFAOYSA-N 436.302 4.091 10 10 IICE CCOc1ccc([C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2NC(=O)c2cc(O)cs2)cc1 1632522364 INBDPXYPTPAHSF-OALUTQOASA-N 446.569 4.375 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H]3COc4c(F)cc(F)cc4C3)c2C)c1 1637577897 JSTPASHCRXOXBR-HXUWFJFHSA-N 425.479 4.484 10 10 IICE COC(=O)c1ccc2nc(CNC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)[nH]c2c1 1638204284 BLZKHAXMALLNCP-UHFFFAOYSA-N 436.899 4.340 10 10 IICE C[C@H]1CCCN(c2ccc(CNc3ccc4nnc(Br)n4n3)cc2Cl)C1 1639841889 UYJPNUSDFODBPW-LBPRGKRZSA-N 435.757 4.389 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)c2C)c1 1645585616 ODRVFQSJVMZQIQ-UHFFFAOYSA-N 444.579 4.034 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccccc2NC(=O)OC(C)(C)C)N(C)C)cc1 1647081746 MJSFMXPRRYAJPL-QFIPXVFZSA-N 440.588 4.061 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4C(C)(C)[C@H]3C)cc2F)C[C@@H](C)O1 1647754717 NTRPBGMVFXJTDW-GUDVDZBRSA-N 439.575 4.242 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)[C@H]1CCN(c2ccccc2Cl)C1=O 1673743530 FRQXPVYTDQWXRY-JTSKRJEESA-N 442.991 4.092 10 10 IICE CCc1nc2c(s1)[C@H](N(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C)CCC2 1676653738 WFYBTPKKKKCGGD-UXHICEINSA-N 429.634 4.093 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2COC(C)(C)OC2)n1Cc1ccc2c(c1)CCCN2C 1694002511 DMAVTAMFPIUONB-SFHVURJKSA-N 441.620 4.058 10 10 IICE CCN(CC)[C@H](C)Cn1c(C2CCC2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1695609801 HEXQSNFVFUKMCW-HXUWFJFHSA-N 440.636 4.001 10 10 IICE CN(C)c1ccc(Cn2c(CC(C)(C)C)nnc2N2CCOC[C@@H](C3CCC3)C2)cc1F 1696609499 DMLOOFFEZFVCQU-FQEVSTJZSA-N 443.611 4.373 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1709197159 APVNYQYLUPXVCP-FDDCHVKYSA-N 448.615 4.456 10 10 IICE CCC[C@](C)(O)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1709446578 MUEIPGIVSLDLQM-RDGATRHJSA-N 441.620 4.307 10 10 IICE Cc1cccc(-c2nnc(N(CC(C)C)C(C)C)n2Cc2ccc(N3CCOCC3)cc2)n1 1751609726 TUTHQOANQSEHFB-UHFFFAOYSA-N 448.615 4.404 10 10 IICE Cc1nnc(N(C)C[C@H]2CCN(Cc3ccccc3)C2)n1CCCSc1nccs1 1751885880 VKWZNXVZVSYZPA-HXUWFJFHSA-N 442.658 4.184 10 10 IICE Cc1nnc(N(C)[C@H](C)c2cccs2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1762502784 PXYGIOJCSPULCP-QGZVFWFLSA-N 425.602 4.102 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@H](OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1763596549 YCUFWUHTIUAJJM-NNMXDRDESA-N 443.661 4.254 10 10 IICE CCN(CC(C)C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCOCC2)cc1 1764853260 ZOAWHZQWPGIJAV-UHFFFAOYSA-N 439.629 4.298 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ccccc2OC)sc(C)c1-c1ccccc1 1860747817 XAMGKXONAQPPAR-UHFFFAOYSA-N 438.505 4.486 10 10 IICE COc1ccc(C[C@@H](C(=O)N2CCN(c3ccc(OC)cc3)CC2)c2ccccc2)cc1 1891855640 JFGOOUSMSXKDBQ-AREMUKBSSA-N 430.548 4.379 10 10 IICE CN1CCCc2cc([C@H](O)CN(CCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2044734275 URMLQSWWRMZOGW-XMMPIXPASA-N 439.600 4.129 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N2CCC(N=[N+]=[N-])CC2)C1 2060640377 UJCVHGWEGZZHSL-QHCPKHFHSA-N 443.548 4.132 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H]4CCN(Cc5ccccc5)[C@H]4C3)ccc(N)c2C1 2132362380 GWWHCCTXYDZEGL-CPJSRVTESA-N 448.611 4.273 10 10 IICE CCOc1ccc(-n2c(C)cc(C=C3SC(=O)N([C@H](C)C(=O)OC)C3=O)c2C)cc1 2293998930 MGARAMHNXJNNDO-OAHLLOKOSA-N 428.510 4.091 10 10 IICE COC(=O)c1ccccc1-c1ccc(C=C2C(=N)N3N=C(CC(C)C)SC3=NC2=O)o1 2297310345 DDHWCUMSZNCEME-UHFFFAOYSA-N 436.493 4.398 10 10 IICE O=C1/C(=C/N2CCOCC2)SC(=S)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 59397225 ATCNEYDMGGFHOW-WQLSENKSSA-N 442.406 4.263 10 10 IICE CN(C)c1ccc(CNC(=O)CC[C@@H]2CCCN(C(=O)Nc3ccc(F)cc3)C2)cc1 65136475 KWMNSUZGOHDREV-IBGZPJMESA-N 426.536 4.232 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)Nc1ccc2nccnc2c1 102718676 YSKQXAFZJRKUPE-RQZCQDPDSA-N 440.937 4.123 10 10 IICE CCOC(=O)CCCN1C(=O)/C(=C\c2ccc(OC(C)C)c(OCC)c2)SC1=S 206867831 DWSTYMCCOJOEEE-QGOAFFKASA-N 437.583 4.417 10 10 IICE COc1ccc(O)c(CNc2cc(Br)ccc2I)c1 311640357 PGCHCCNGQSYNEF-UHFFFAOYSA-N 434.071 4.380 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(C)cc3)[C@@H]2c2ccc(O)c(O)c2)c1OC 526400468 KKRGYWVYWGXCID-JOCHJYFZSA-N 433.460 4.481 10 10 IICE CC[C@H](NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1nc2ccccc2[nH]1 727476648 ZVAZOTNHGBOBPU-FCEWJHQRSA-N 439.535 4.266 10 10 IICE CC(C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1)(c1ccccc1)c1ccccc1 729328285 QTTPOCZXRWPWST-QFIPXVFZSA-N 441.575 4.011 10 10 IICE Cc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)nc(C(F)(F)F)n1 778384291 KOOXTCREEJJPBU-UHFFFAOYSA-N 435.377 4.390 10 10 IICE C[C@H]1CC[C@@]2(CCN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)C2)C1 781796494 KXXSAVREYMHPFQ-HRAATJIYSA-N 425.495 4.264 10 10 IICE CC(=O)[C@@H](C)CCCCC(=O)O[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 783222748 PSLAEILMGXMKSL-RDJZCZTQSA-N 449.503 4.118 10 10 IICE O=C(NCCN1CCc2c(Cl)cccc2C1)N(Cc1ccco1)Cc1ccccc1O 785933815 CGTUUSWYXCXEMU-UHFFFAOYSA-N 439.943 4.409 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(C(=O)N(C)[C@@H]3CCCN(C)C3)cc2)c1 789891398 WEUPRMKAIRLAGE-LJQANCHMSA-N 446.389 4.241 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](C(=O)N4CCCC4)C3)cc2Cl)C1 800719790 NPLAQKJGAXHRFP-AZUAARDMSA-N 447.023 4.120 10 10 IICE Cc1nc(C(F)(F)F)ccc1NC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 801854180 ZCZOKLTWXTUXCV-UHFFFAOYSA-N 447.505 4.263 10 10 IICE CCN1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H]2CCCO2)CC1 812308557 QRKFEMHBZJRDCO-HSZRJFAPSA-N 448.615 4.064 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)sc2c1CC[C@@H](CC)C2 1124312959 DQOBZMCWAHALHP-HZPDHXFCSA-N 440.565 4.431 10 10 IICE C[C@H]1CN(C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c2ccccc2O1 1126262726 UKAOAAJFWRRTRS-BXUJETTOSA-N 442.537 4.231 10 10 IICE COc1ccc(N2CCN(C(=O)C(C)(C)Cc3ccc(Br)cc3)CC2)cc1 1127277273 YMWJHJDHEYJRSS-UHFFFAOYSA-N 431.374 4.375 10 10 IICE COc1cc(C)c(CN(C)C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1135766882 LWKJTPRPSACCQJ-UHFFFAOYSA-N 434.536 4.433 10 10 IICE CSc1ccc(O)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1147507484 RITLZTQVUHDXQV-IBGZPJMESA-N 445.585 4.176 10 10 IICE COC(=O)[C@H]1CCCCCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1153968814 ACTPGROMDPLNPO-LJQANCHMSA-N 433.346 4.414 10 10 IICE CCN(CC)S(=O)(=O)c1cc(NC(=O)[C@@H](C)Sc2ncc(Cl)s2)ccc1C 1189832154 KUKLWBVDCQGSIQ-GFCCVEGCSA-N 448.035 4.255 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](C)Sc3ccc(Cl)cc3)cc2F)CC1 1265012043 LQYGOITZEDOKCS-MRXNPFEDSA-N 435.996 4.418 10 10 IICE Cc1cc([C@@](C)(O)Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)c(C)o1 1289295787 SNNICOGOTKVBKV-VWLOTQADSA-N 438.572 4.470 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)N(C)C)cc1 1289601770 DCOVOIGSGLZXMO-PWRODBHTSA-N 430.390 4.038 10 10 IICE C[C@@H]1CCC[C@@H](N(C)c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1291074263 MKJUGOSADVTGRF-MISYRCLQSA-N 429.584 4.440 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCCN(C)C(C)C 1291563013 MAAQHWDADVFIBG-NRFANRHFSA-N 442.652 4.247 10 10 IICE Cc1ccc(C(=O)NCc2nc(Cc3ccccc3)no2)cc1-n1c(C)cc(C=O)c1C 1292239317 RBHQYUHKIGJLQB-UHFFFAOYSA-N 428.492 4.119 10 10 IICE O=C([C@H]1CCOc2ccc(Br)cc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 1295406136 PIEBZKWKOWGIOR-ROUUACIJSA-N 446.341 4.229 10 10 IICE Cc1cc(N2CCC[C@H](NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)n(C)n1 1297187531 KOXFIZPGMAHKKO-IBGZPJMESA-N 425.964 4.188 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccc(N(CC)CC)cc2)[C@H]1Oc1ccccc1 1312537583 VBKOYNAZFHVKQQ-RBZQAINGSA-N 425.573 4.299 10 10 IICE COc1cc(OC)cc(-c2nnc(N3CC[C@H](C)C3)n2CCCSc2nccs2)c1 1315343266 OYBKIUFJDQSARG-HNNXBMFYSA-N 445.614 4.447 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)cc1 1450295441 USUWQRLDYJVWDE-SIKLNZKXSA-N 448.454 4.169 10 10 IICE Cc1cc(C(=O)N[C@@H](c2nc(=O)o[nH]2)C(C)(C)C)c(C)n1-c1ccccc1Br 1452151424 OOGAUQPHVWVWAG-INIZCTEOSA-N 447.333 4.050 10 10 IICE COc1ccc(CCCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c(OC)c1 1457095581 KHFADHJOFGBIFO-SFHVURJKSA-N 448.510 4.413 10 10 IICE COc1ccc(N2CCCN(CCC(=O)Nc3ccc(N(C)C(C)C)c(F)c3)CC2)cc1 1459350283 NCFBOYVQMSMQCG-UHFFFAOYSA-N 442.579 4.220 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)Nc1ccccc1OCCF 1460298540 PKYADEPFJUXOBQ-QGOAFFKASA-N 448.516 4.404 10 10 IICE CN(c1ccc(CNC(=O)c2c(NC(=O)OC(C)(C)C)cnn2C)cc1)C1CCCCC1 1464543226 WTYQAGAWHJHTPA-UHFFFAOYSA-N 441.576 4.466 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2nccc3ccsc23)NC(=O)OC(C)(C)C)cc1 1465325424 QFRPMKHYFIPXRT-SFHVURJKSA-N 440.569 4.358 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1CC1(C)CC1 1503489482 WWEKRROHEZEMLB-SFHVURJKSA-N 441.576 4.492 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCCn1cc(Br)cn1 1545337343 SPYJXKAMNDJDAA-HNNXBMFYSA-N 447.381 4.183 10 10 IICE COCCO[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCCC1(F)F 1555615738 UBNMVPMGDGRSAM-WMZOPIPTSA-N 438.519 4.170 10 10 IICE CCCNC(=O)OC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1556508374 WJIZKAVHSDNOKB-FQEVSTJZSA-N 427.545 4.234 10 10 IICE COc1cccc(C)c1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1586274323 NLDCVISQJRYAPD-ATVHPVEESA-N 430.526 4.373 10 10 IICE C[C@H]1CN(C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)c2ccc(Br)cc2O1 1587043719 MMQMTLBXMSLNJG-SWLSCSKDSA-N 437.334 4.177 10 10 IICE CC(C)CSCCn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1607831707 IGIPVOPHVAIXPX-UHFFFAOYSA-N 445.677 4.438 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CCC(OC(C)C)CC1 1611963254 LDTQWWJQWNWLRI-UHFFFAOYSA-N 434.588 4.157 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC(OC(C)(C)C)CC2)cc1F 1617668562 BFZRVMLYVHYCLB-OAQYLSRUSA-N 445.583 4.167 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCC[C@@H]3CCCCO3)CC2)cc1 1619301748 WWHKXXHERMIVDG-QHCPKHFHSA-N 441.620 4.476 10 10 IICE COc1cccc(CNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)c3ccccc32)c1O 1631542044 DWLCJFGRTCCDHL-INIZCTEOSA-N 426.513 4.336 10 10 IICE C/C=C/C[C@@H](NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C(=O)OCC 1632607448 LZWCJNNWHQWUNF-WSSFADSRSA-N 433.346 4.484 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cn(-c4ccccc4C(F)(F)F)nn3)cc2)CC1 1633110584 CKMBUVSPHCUJCI-UHFFFAOYSA-N 443.473 4.452 10 10 IICE CC[C@@H](NC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1)c1ncc(-c2ccccc2)[nH]1 1636353546 DFRQQRBXEIJNQH-PGRDOPGGSA-N 433.556 4.362 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(Cl)c(CN(C)CCO)c2)c1 1639295144 REDLHNWZDJPGRM-UHFFFAOYSA-N 439.943 4.236 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCC2CCN(C3CCOCC3)CC2)c1 1640251515 KXZKTUIXBLMUTN-UHFFFAOYSA-N 429.992 4.368 10 10 IICE O=C(Cc1csc(-c2ccc(Cl)cc2)n1)NCc1ccc(N2CCC(O)CC2)cc1 1646431247 KERDMYGGWMBEMN-UHFFFAOYSA-N 441.984 4.284 10 10 IICE CC(=O)N1CCN(c2ccc(CNc3ccc(-c4ccc(Cl)s4)nn3)cc2)CC1 1651042668 VWKHSWBQKQAKIJ-UHFFFAOYSA-N 427.961 4.139 10 10 IICE Cc1cc(C(=O)Cn2cncc(F)c2=O)c(C)n1-c1ccc(Cl)c(C(F)(F)F)c1 1652843379 OVWCNZFGQIQVPZ-UHFFFAOYSA-N 427.785 4.345 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2C(=O)c2ccc(F)cc2)N(C)C)cc1 1653421033 HKUYFTPVZKKOIY-DEOSSOPVSA-N 433.527 4.155 10 10 IICE Cc1cccc([C@@H](NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c2ccccn2)c1 1679703670 UFAVQRSAJKJVJK-LOSJGSFVSA-N 431.584 4.148 10 10 IICE Cc1ccc([C@@H]2C[C@H](C)N(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1681850006 NAUXPENUKVABKF-FXAWDEMLSA-N 429.511 4.197 10 10 IICE C[C@H]1CCC[C@]1(O)Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1693645262 BITJTBOBGBUDAX-DFBJGRDBSA-N 425.621 4.363 10 10 IICE CCC(CC)NC(=O)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCCC1(F)F 1694332074 QOQJIOYFKPGCKJ-KRWDZBQOSA-N 449.546 4.364 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCOC)C[C@@H](C)O1 1694919919 KJVGMCVLIQZTTL-DENIHFKCSA-N 437.588 4.393 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N(C)Cc2ccsc2)cc1 1710024126 MUYGCWKDYJNNOQ-UHFFFAOYSA-N 440.617 4.009 10 10 IICE CSC[C@H]1CCCN1c1nnc(Cc2ccncc2)n1CCCSc1nccs1 1731098605 JHKSNERWMMKQKG-QGZVFWFLSA-N 446.671 4.235 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N2CCC(CO)CC2)cc1 1746094685 YAZVKQXWZFCAKR-UHFFFAOYSA-N 425.621 4.114 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)[C@H]1C 1752455988 KIPYNIXFNMIIQL-HRCADAONSA-N 439.676 4.489 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](CC(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1761012179 RBHSZCKYUOGUEV-QFIPXVFZSA-N 425.621 4.234 10 10 IICE Cc1nccnc1CCn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1762375060 ZAGVLBFWVMQISR-UHFFFAOYSA-N 433.604 4.054 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CC[C@@H]1CCCCO1 1767770645 VGYOPZQDEIMMIH-QFIPXVFZSA-N 427.593 4.010 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N([C@@H](CC(C)C)C(=O)O)C3=O)n12 1858592141 HTSTXLPCQHOXMB-XXNJBDPSSA-N 429.976 4.058 10 10 IICE CCCOC(=O)c1cccc(N2C(=O)/C(=C\c3ccc(O)c(OC)c3)SC2=S)c1 1860086886 NCWHPBLFRYANGT-WOJGMQOQSA-N 429.519 4.373 10 10 IICE CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccc(C)cc2)c1C(=O)OC 1866193015 NVKNKSUGPOWESY-SJORKVTESA-N 428.554 4.309 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCC1c2ccccc2-c2ccccc21)c1c(O)cc(O)cc1O 1951862839 GQESUSPRGKSMAW-RUZDIDTESA-N 449.459 4.032 10 10 IICE CCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(Cl)cc3)C2=O)cc1OC 2296441752 LSLJLZVDGWOICW-UHFFFAOYSA-N 448.953 4.294 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1[C@H]2C[C@@H](CN(c3ccc(OCc4ccccc4)cc3)C2)[C@H]1CO 2314471481 MJGDTIYRNXXENL-UWXQAFAOSA-N 438.568 4.224 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2ccc(OCCC(=O)O)cc2)SC1=S 2314931227 MUDFEEWHOIJLNF-UHFFFAOYSA-N 429.519 4.345 10 10 IICE C[C@@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3ccc(Cl)c(Cl)c3)s2)C1=O 11635438 SSUYBLRSPVUBFL-QMMMGPOBSA-N 446.406 4.228 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)NC3CCCCC3)CC2)c(C)n1-c1ccc(F)cc1 62694622 IZLAALZQVZCGDH-UHFFFAOYSA-N 440.563 4.076 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1 96748246 DBOYTMSCKNSBLD-OAHLLOKOSA-N 434.492 4.048 10 10 IICE CC[C@H](C)N1C(=O)/C(=C\c2cc3cccc(C)c3nc2N2CCOCC2)SC1=S 208278674 QQFLWQGGWUVRCM-VUODPORTSA-N 427.595 4.380 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@@H]32)cc1O 226668540 RCGJMINTISAEHC-STSQHVNTSA-N 426.538 4.012 10 10 IICE Cc1cn2c(CN(C)C(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)c(C)nc2s1 444324483 XVLDJHQOXLDIPM-UHFFFAOYSA-N 449.624 4.392 10 10 IICE COCCOCc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 683439727 DXEZZQZJXJVILN-UHFFFAOYSA-N 435.568 4.210 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](CCNCc2cc(Br)cc(F)c2O)C1 715811430 FHPLPPOBMRCANR-CYBMUJFWSA-N 431.346 4.421 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1 728877911 SUNXTMLCXPATHZ-UHFFFAOYSA-N 442.563 4.027 10 10 IICE CCOC(=O)c1cnn(CC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c1C(F)F 732717249 CEXLGXYIGNDJMR-UHFFFAOYSA-N 445.422 4.017 10 10 IICE CC1CCN(c2ccc(CNC(=O)N(C)[C@@H]3CCN(c4ccccc4F)C3=O)cc2)CC1 732890387 GKVQKSFCFXILPV-HSZRJFAPSA-N 438.547 4.009 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 734688117 HWZNTHIZCVSAOZ-LJQANCHMSA-N 437.519 4.339 10 10 IICE COc1ccc([C@@H](C)NC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1F 743506084 KIFGKXYCLAOCHR-GDBMZVCRSA-N 437.462 4.465 10 10 IICE COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)NCc1ccc(N2CCSCC2)cc1 746214630 ABIAJMFFLBYMNT-HSZRJFAPSA-N 425.598 4.467 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCC[C@@H]3CCc3ccccc3)cc2)C1 760821445 QPSOUNBAXPKKFX-UKILVPOCSA-N 448.611 4.085 10 10 IICE Cn1c(-c2ccccc2)cnc1SCc1coc(-c2ccc(S(C)(=O)=O)cc2)n1 761207441 VEXUDUBGMBMIJM-UHFFFAOYSA-N 425.535 4.438 10 10 IICE Cc1cc(C(=O)NCc2nnc(C3CCC3)n2C)c(C)n1-c1ccccc1Br 764356454 WXUNHMACCVHHFI-UHFFFAOYSA-N 442.361 4.183 10 10 IICE CC(C)(C)OC(=O)c1ccccc1NC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 775366585 YMWOXQCZOXJPLR-UHFFFAOYSA-N 439.556 4.172 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ccc(OC(F)F)c4cccnc34)CC2)cc1 775920869 FQMXJAZDQRYONN-UHFFFAOYSA-N 428.439 4.199 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(O)c2ccccc2c1 792070499 YSMYZWJKSLWQAN-UHFFFAOYSA-N 430.426 4.331 10 10 IICE CCN(CC)c1ccc(/C=C2\SC(=S)N(C(=O)c3cccc([N+](=O)[O-])c3)C2=O)cc1 1081112838 QEWASRXNYHMLGL-PDGQHHTCSA-N 441.534 4.483 10 10 IICE COc1cccc(-n2cc(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)nn2)c1 1128490577 VQUWOEMLPHFDMM-INIZCTEOSA-N 439.947 4.096 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3c(C(F)F)nc4cnccn34)cc2Cl)C1 1128490637 XJSUYGMHXOCUFP-ZDUSSCGKSA-N 433.890 4.487 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3ccc(OCCOc4ccccc4)cc3)C2)cc1 1130826537 BSWVPWOVYANHKA-QFIPXVFZSA-N 446.547 4.091 10 10 IICE CCc1nnc(NC(=O)[C@@H](C)[C@H](C)NC(=O)c2cc(C)n(-c3ccccc3C)c2C)s1 1140172733 ZKPCSNNGOPIZNO-HOTGVXAUSA-N 439.585 4.210 10 10 IICE COc1ccc(N2CCN(Cc3cc(Br)cc(F)c3F)CC2)c(OC)c1 1141805604 VHMQXOHTHMBOKA-UHFFFAOYSA-N 427.289 4.067 10 10 IICE CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NCc2ccc(O)cc2O)CC1 1142533875 UQNLBMFYOLOOSS-UHFFFAOYSA-N 440.540 4.217 10 10 IICE COC(=O)[C@H]1C[C@H](C)CCN1C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1155017317 YNDKXSNNMRIDCN-BFUOFWGJSA-N 433.346 4.270 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC(c4c(Cl)cccc4Cl)CC3)nc12 1170733825 WGMWVOFZVOWCJY-UHFFFAOYSA-N 449.338 4.298 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)Cc3csc(Cc4cccc(Cl)c4)n3)C2)cc1 1278861905 QLVMFAPNKIVSFE-SFHVURJKSA-N 441.984 4.334 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N(CCC1CC1)CC1CC1 1280370442 JKRQGRWVLUDTIW-CPNJWEJPSA-N 432.586 4.456 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1(O)CCOCC1 1294480124 AROXYTOFHLPIDZ-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)c1ccc(N=NC(N)=O)cc1 1296662113 GVNFGWFUYPARGV-GOSISDBHSA-N 447.333 4.379 10 10 IICE Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 1296676248 BZYRJVKCNQOZBU-INIZCTEOSA-N 428.529 4.134 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CCOC[C@@H]1C 1301684271 UVGHHPGJPIAGTL-GHTZIAJQSA-N 437.588 4.108 10 10 IICE CCC[C@](C)(O)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1306542907 PJFCAFXDYQQTON-SANMLTNESA-N 448.615 4.052 10 10 IICE CCN(CC(=O)Nc1ccccc1C(=O)Nc1ccc(OC)cc1)c1ccc(OC)cc1 1307550816 ARMGAIRLHGUXBW-UHFFFAOYSA-N 433.508 4.421 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(C)cc1 1307644699 WTGLBGRGJBPIMW-PWHSHALESA-N 427.564 4.105 10 10 IICE CN(CC1CCCCC1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1314797261 WYUYZFJINYDTBL-UHFFFAOYSA-N 431.635 4.334 10 10 IICE Cc1ccc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)c(C)c1 1349962503 REPHYBBPBZGWCZ-XDHOZWIPSA-N 428.554 4.350 10 10 IICE Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)COCc4ccnn4C)n3)c2C)cc1 1351052155 WDVSSQIPOVIRKO-UHFFFAOYSA-N 435.553 4.415 10 10 IICE Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1355131584 XPLNBRAVGZOJFH-BBWFWOEESA-N 434.939 4.485 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc(Br)cnc2F)cc1 1360068725 KVAIOLHQNPPETG-UHFFFAOYSA-N 434.231 4.254 10 10 IICE CC1(C)OC(=O)c2ccccc2[C@@H]1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333610 SCPZXOVUOURZET-MGPUTAFESA-N 444.478 4.106 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C(=O)OC)c3ccc(Cl)c(F)c3)ccc21 1435598712 XPEXEFLSPORVHP-OAQYLSRUSA-N 446.906 4.341 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(Br)c(Cl)cc3OC)C2)cc1 1437583252 ZGZVXMPWEYAOOK-LBPRGKRZSA-N 439.737 4.128 10 10 IICE COc1ccc(C[C@H](C)NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC 1444908000 OMGWGXCOXCYSSP-KRWDZBQOSA-N 434.536 4.214 10 10 IICE CCC[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@@H](O)c1ccccc1 1448956051 DFRGMENRVLQNQI-HOFKKMOUSA-N 433.596 4.426 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCCN(c4cccc(Cl)c4C)CC3)C2)cc1 1470771122 ATFOLLNQKOFWFU-IBGZPJMESA-N 442.991 4.158 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CC3)nnc2N2CCC(C(=O)C(F)(F)F)CC2)cc1 1501839470 SINATQNORGOUTA-UHFFFAOYSA-N 449.521 4.398 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCC[C@H]2C)CCOC1 1509796631 OMNQOYQPCBBIEN-YDIMBITNSA-N 428.577 4.097 10 10 IICE CC[C@@]1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(C)(C)O)CCO1 1513576307 LNZIPJFDXVUHKD-VWLOTQADSA-N 437.588 4.129 10 10 IICE C[C@H](NC(=O)CN(Cc1ccccc1)c1ccccc1)c1ccc(N2CCOCC2)cc1 1519155497 GXIPKCKDLPRECB-QFIPXVFZSA-N 429.564 4.407 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1ccc(Cl)c(I)c1 1520358459 CQGXUOIXYCIVBB-UHFFFAOYSA-N 434.020 4.387 10 10 IICE CCOC1CCC(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)CC1 1532491686 CDLXRRKSJVFUSO-QGOAFFKASA-N 437.558 4.308 10 10 IICE CCCN(C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)[C@@H](COC)C(=O)OCC 1537235007 QOOOWIPIVFLFIB-NRFANRHFSA-N 434.964 4.107 10 10 IICE O=C(Nc1cccc(-n2cccc2)c1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1540754545 WVYYPDLMZUDSGC-UHFFFAOYSA-N 439.518 4.298 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N(C)C[C@H](C)c1nccs1 1542227067 RPEAUFVITNIQBA-SFHVURJKSA-N 449.628 4.403 10 10 IICE Cc1ncc(CN(C)c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)s1 1542957076 OVHWPAJRJDKNFI-NRFANRHFSA-N 440.617 4.344 10 10 IICE CC1CCN(CCCCn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)CC1 1544489425 HEJRRILWQALUEN-UHFFFAOYSA-N 448.615 4.118 10 10 IICE CC[C@H](C)[C@@H](Cn1c(CC(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1545295949 CFRWEKFSGCOKSZ-PGRDOPGGSA-N 447.599 4.012 10 10 IICE CCCCCn1c([C@@H]2CCCCO2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1546975033 HKEKBRVYCQGAPB-QFIPXVFZSA-N 427.593 4.435 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N2CCC(CCCO)CC2)cc1 1547447128 PETWQJRXUIYSGN-UHFFFAOYSA-N 425.621 4.429 10 10 IICE Cc1cc(C(=O)Nc2ccc(-n3cnnn3)cc2)c(C)n1-c1cccc(Br)c1 1558906885 WSIDFYNPZCDSTL-UHFFFAOYSA-N 437.301 4.085 10 10 IICE CN(C)c1ccc2c(c1)OCCN2CC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1 1559714248 OPVJAWCQIVEUKK-UHFFFAOYSA-N 433.556 4.073 10 10 IICE CCNc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1566663559 UXRHEOMXSPZHKX-UHFFFAOYSA-N 440.569 4.029 10 10 IICE Cc1cc(C(=O)N(C)CCN2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccc(Br)cc1 1568575765 MCTUNWLBPQTCCA-CALCHBBNSA-N 448.405 4.038 10 10 IICE Cc1cc(F)ccc1[C@@H](C)NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1584051349 IFEQTMVGELHDQV-CYBMUJFWSA-N 432.407 4.309 10 10 IICE CCCc1c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cnn1-c1ccccc1C 1585536265 XMEJQQPDDREMRG-UHFFFAOYSA-N 432.568 4.024 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(N=NC(N)=O)cc1 1598121715 WLDQBBJXRDCRRN-MSOLQXFVSA-N 429.521 4.243 10 10 IICE CCCNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)C1 1614954110 VMCDGXMMLNBGIB-SFHVURJKSA-N 434.588 4.115 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C(C)C)C1 1618786178 NHESWZMNIVHXSZ-OAQYLSRUSA-N 448.615 4.361 10 10 IICE O=C(Nc1cc(C2CCCCC2)[nH]n1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1621511771 NVIVYVARJNXVME-UHFFFAOYSA-N 446.554 4.278 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C[C@@H]2CCC[C@H](C(F)(F)F)O2)cc1 1627204651 DNIPPQOXPMAREC-SLFFLAALSA-N 428.495 4.150 10 10 IICE CN(C)c1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccccc2n1 1630263059 SPKDJTOLDAPQTJ-GOSISDBHSA-N 438.959 4.054 10 10 IICE O=C(N[C@@H]1CCc2cc(Cl)ccc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1631993058 SYSUFTCQCQVTGT-QGZVFWFLSA-N 448.953 4.325 10 10 IICE O=C(C1=Cc2cc(Br)ccc2OC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1636950516 BDJLQOJTLYTZSJ-IBGZPJMESA-N 444.325 4.138 10 10 IICE Cc1cc(C(=O)Nc2cc(-c3nccn3C)[nH]n2)c(C)n1-c1cccc(Br)c1 1643746306 QNAJBXPABGKVBX-UHFFFAOYSA-N 439.317 4.233 10 10 IICE Cc1cc(C(=O)Cn2ccc(C(=O)OC(C)C)cc2=O)c(C)n1-c1ccc(F)c(Cl)c1 1651879297 PSFSXJLKAXLLCV-UHFFFAOYSA-N 444.890 4.496 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(CO)CCc4ccccc43)cc2Cl)C1 1680561285 BBRNLHBMUQIBSB-CJAUYULYSA-N 442.003 4.252 10 10 IICE Cc1ccc([C@H]2C[C@@H](C)N(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)cc1 1681850008 NAUXPENUKVABKF-XLIONFOSSA-N 429.511 4.197 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCC(C(N)=O)(c4ccccc4)CC3)c2C)c1 1683302795 BKIQBQBVJPSJES-UHFFFAOYSA-N 444.579 4.131 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 1685689937 ZTXSBBKTASSEMK-HXUWFJFHSA-N 444.620 4.465 10 10 IICE CCn1cc(CN(C)c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)cn1 1695782528 VZPYNRZIRMHYSZ-UHFFFAOYSA-N 435.620 4.286 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(c3nc(C)no3)CC2)n1Cc1ccc(N(C)C)cc1C 1708449272 WXYGGGPECPDSKD-MRXNPFEDSA-N 437.592 4.290 10 10 IICE CC(C)c1nnc(N(C)CCC(F)(F)F)n1Cc1ccc(N2CCC(CO)CC2)cc1 1741343273 HZOLBHLFUZFVLV-UHFFFAOYSA-N 439.526 4.047 10 10 IICE Cc1ccc(-c2nnc(N3C[C@@H](C)OC(C)(C)C3)n2CCCSc2nccs2)o1 1761746050 FRTIWYUYQLULDQ-OAHLLOKOSA-N 433.603 4.489 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)C[C@H]2CCCOC2)cc1 1764936015 VYMHKMUAQDYTLT-OAQYLSRUSA-N 436.604 4.041 10 10 IICE COCCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCOC1 1769637487 JPYNRMMUGYLXNY-JOCHJYFZSA-N 437.588 4.394 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)SC2=S)N(C)C)cc1 1858594166 NYBULIJBRKYUDG-LPGQDOADSA-N 443.550 4.108 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010390458 DPKVWSKHRLGYFE-WDSOQIARSA-N 431.537 4.034 10 10 IICE CN(Cc1ccccc1)C[C@@H](NC(=O)OC(C)(C)C)[C@@H](O)c1ccc(N2CCCC2)cc1 2044730829 RKDMDGBOSPOCLR-RPWUZVMVSA-N 439.600 4.346 10 10 IICE Cc1ccc(CNC(=O)CCC(C)(C)NC(=O)OC(C)(C)C)c(O)c1Br 2352636406 LFBXANJGZKAUKH-UHFFFAOYSA-N 429.355 4.163 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352685302 DSAXSZIUGOLHOP-FVQBIDKESA-N 425.367 4.341 10 10 IICE C[C@@H](Sc1ncc2ccccn12)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 26372402 OAVSANJHHHJXHF-CQSZACIVSA-N 427.485 4.229 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)c3cc(C)ccc3C)c3ccco3)CC2)cc1 38605954 WOZHXASAEZRXLB-XMMPIXPASA-N 433.552 4.198 10 10 IICE CC[C@@H](C)N1C(=O)/C(=C\c2c(NCC(C)C)nc3c(C)cccn3c2=O)SC1=S 39723628 LRCPGRFVERWDAJ-DWKHYPNZSA-N 430.599 4.071 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4ccc(Cl)cc4Cl)c3N)CC2)cc1 40727795 QMFCQIQLBIAVEG-UHFFFAOYSA-N 445.354 4.444 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccccc4C)c3C(F)(F)F)CC2)cc1 105968972 AVRLCFRLWYWDPU-UHFFFAOYSA-N 444.457 4.171 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccccc3CN3CCC[C@H]3C(N)=O)c2C)c1 110830674 MKLJTDBYGSLLJL-DEOSSOPVSA-N 430.552 4.105 10 10 IICE CSc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@@H]3C=CC[C@@H]32)cc1 226790649 MCXYKLOUFZBCQH-QTEQDKRBSA-N 442.606 4.256 10 10 IICE COCCOc1cc(C)ccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 435570934 ZLNGTPWWJCNFCE-UHFFFAOYSA-N 435.568 4.380 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccccc2O[C@H]2CCOC2)C1 435811139 VOQUKCFKYQQGQA-IBGZPJMESA-N 433.552 4.214 10 10 IICE CCN(C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H](C)c1cccnc1 734526282 PAAATCCUWDDDLG-INIZCTEOSA-N 436.478 4.230 10 10 IICE Cc1cc(C)cc([C@@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)c1 753113530 QGXXMTALHCMMSE-HXUWFJFHSA-N 425.548 4.103 10 10 IICE CC(C)(C)OC(=O)c1ccc(CNC(=O)NCc2cccc(Br)c2O)cc1 764790336 KCKXNKMGQUJXMW-UHFFFAOYSA-N 435.318 4.109 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)C1 768129701 ANRRSKWOMWKIHA-HSZRJFAPSA-N 443.950 4.050 10 10 IICE Cc1oc(-c2ccccc2)nc1CC(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768543350 IAWWOJSROWJXSW-UHFFFAOYSA-N 444.579 4.041 10 10 IICE CCS[C@H]1CC[C@@H](N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 769060345 PNBBCIRWFUVVCP-PKTZIBPZSA-N 430.662 4.034 10 10 IICE CCn1nccc1S(=O)(=O)Nc1nc(-c2ccc(OCc3ccccc3)cc2)cs1 769848085 LYOGCTRNDZXHAB-UHFFFAOYSA-N 440.550 4.406 10 10 IICE COc1cc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)ccc1F 786874096 MKMZFQPOMCOUCA-UHFFFAOYSA-N 432.420 4.484 10 10 IICE COc1cc(Cl)cc(CN2CCN(C(=O)OC(C)(C)C)C[C@@H]2c2cccnc2)c1O 800531497 CEGHRTKEMWMUNQ-GOSISDBHSA-N 433.936 4.243 10 10 IICE COC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802683897 CHGYUKJTRMOOKU-UNMCSNQZSA-N 435.572 4.004 10 10 IICE CCc1noc(C[C@]2(O)CCCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)C2)n1 856673905 LYIGHOXJTBCXQY-XMMPIXPASA-N 448.527 4.056 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C\c2cccc(OCC(F)(F)F)c2)SC1=S 917620044 QNNTTXWFQZVVFV-GXDHUFHOSA-N 433.473 4.474 10 10 IICE Cc1ccc(C(=O)CCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1C 918141298 ULDHMVMARGPKST-OALUTQOASA-N 426.532 4.335 10 10 IICE Cc1cc(-c2ccc(/C=C3/C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)o2)cc([N+](=O)[O-])c1C 1084404679 ANJMQEYXFUODMM-WQRHYEAKSA-N 449.394 4.277 10 10 IICE CCOc1ccc(-c2noc(CCC(=O)N(C)Cc3ccc(N4CCCC4)cc3)n2)cc1 1124549563 MTRPECCUIQBEAW-UHFFFAOYSA-N 434.540 4.327 10 10 IICE O=C(Cc1ccc(NC(=O)C(F)(F)F)cc1)Nc1c(-c2ccccn2)nc2ccccn12 1126863491 HMDWHQILEPQMGN-UHFFFAOYSA-N 439.397 4.078 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN(Cc3ccccc3)C3CCCCC3)CC2)cc1 1190474614 FRTRHMKVEVEUOT-AREMUKBSSA-N 437.628 4.013 10 10 IICE Cc1cc(CN(C)Cc2cccc(N3C[C@H](C)CS3(=O)=O)c2)ccc1N1CCCCC1 1193898061 ILDHXJQYLDONGL-FQEVSTJZSA-N 441.641 4.403 10 10 IICE COc1ccc(OC)c(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)c1 1198836663 FTSDSYCJBIEGQZ-UHFFFAOYSA-N 436.508 4.366 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3C[C@@H](OCc4ccccc4)C3(C)C)CC2)cc1F 1235188085 VFWOKTHWHLTOBE-DHIUTWEWSA-N 441.547 4.050 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@H]1CCCC1(F)F 1288283234 FYVUFAOVABMAAL-IZCBMXNHSA-N 442.528 4.359 10 10 IICE C[C@@H]1CCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1291163723 LGDVRCMMYLGOQH-MJGOQNOKSA-N 429.584 4.298 10 10 IICE O=C(Cc1ccc(OCc2ccncc2)cc1)NCc1ccc(N2CCSCC2)cc1 1291629277 SUQMDMVHRYHIDH-UHFFFAOYSA-N 433.577 4.073 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H](C)C[C@H]2CC)n1Cc1ccc(N(C)C)cc1C 1292020485 HYSQEDUWJIGBBN-DYESRHJHSA-N 440.636 4.244 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1440664363 IQAAZLFUNONTOB-LJJIPZOBSA-N 439.987 4.459 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cnn(Cc3ccccc3)c2)cc1 1441332011 HTJMOJMSOVRFTA-UHFFFAOYSA-N 426.520 4.010 10 10 IICE COC(=O)[C@@H](C)N(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CCC1 1447684061 IAHLZUFTHWXOKU-OAHLLOKOSA-N 433.346 4.413 10 10 IICE Cc1cc(CNC(=O)[C@@H](C(C)C)n2nnc(-c3ccccc3)n2)c(C)n1-c1ccccc1 1462086152 QDWKRTLAHSTPPE-HSZRJFAPSA-N 428.540 4.261 10 10 IICE O=C(CSCC(F)(F)F)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1463204579 AIVGOLWEHMLSFZ-UHFFFAOYSA-N 445.264 4.393 10 10 IICE Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N2CCCC2)c(C)n1-c1ccc(C(C)C)cc1 1463832593 QNXQNVJMAXJADI-JOCHJYFZSA-N 425.598 4.355 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C1 1470556135 MZUDIPWDBOWCHE-GBESFXJTSA-N 432.609 4.031 10 10 IICE O=C(CN1CCN(c2ncccc2[N+](=O)[O-])CC1)Nc1ccc(N=Nc2ccccc2)cc1 1473528425 AFJNQMSETWOLPA-UHFFFAOYSA-N 445.483 4.166 10 10 IICE COc1cccc([C@@H]2CCN(C(=O)NCc3ccc(N4CCC(O)CC4)cc3)C2(C)C)c1 1479030747 QGBNZEPZRVBWEY-DEOSSOPVSA-N 437.584 4.134 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)COc3ccc4c(c3)CCCC4)cc2F)C[C@@H](C)O1 1516818317 UAAQLUOCNAGACY-HDICACEKSA-N 426.532 4.013 10 10 IICE CCC[C@@]1(C(=O)OCC)CCCN1C(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1524832021 TZZITJOBKOZWJZ-SANMLTNESA-N 439.600 4.132 10 10 IICE CCNC(=O)OC[C@@H]1CCCCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1539878532 FTDVNJZXWVMQQS-NRFANRHFSA-N 431.964 4.417 10 10 IICE CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1540808136 ZQULNGIMLRXYNH-UHFFFAOYSA-N 433.508 4.016 10 10 IICE O=C(CCC(=O)c1ccc(Cl)cc1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1545632748 UTQBQQXVXXZRII-LJQANCHMSA-N 435.351 4.443 10 10 IICE CN1CCCc2cc(Cn3c(CC(C)(C)C)nnc3N(C)C[C@H]3CCCOC3)ccc21 1554360552 ZMSVUYISPNPQRU-HXUWFJFHSA-N 425.621 4.160 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCC3(CC(N)=O)CCCCC3)cc2Cl)C1 1564650044 RSAZIMKEXXVHCM-KRWDZBQOSA-N 435.012 4.201 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CC1(NC(=O)OC(C)(C)C)COC1 1566849037 HHFPSDVDDLKPCI-GOSISDBHSA-N 440.540 4.166 10 10 IICE COc1ccc(N2CCN(CCNC(=O)CC3CCC(c4ccccc4)CC3)CC2)cc1 1583751869 ISRZQOUJWVNRQK-UHFFFAOYSA-N 435.612 4.298 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cnn(CC(C)C)c3-c3ccccc3)C2)cc1 1584444521 QKAQZGJFMXXYIE-FQEVSTJZSA-N 432.568 4.471 10 10 IICE Cc1ccc(C(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1597063689 AAEKOYKUONLEPS-HNNXBMFYSA-N 427.545 4.106 10 10 IICE CCC[C@H](C)CN(C)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1614363552 FCAXIEVKFPLHJX-NZQKXSOJSA-N 441.620 4.277 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)Oc2ccc(Br)cc2)N(C)C)cc1 1618643739 NIGCWZUYUDLIFV-HXUWFJFHSA-N 448.405 4.092 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC(C)(C)C)C3)cc1F 1627604412 HHNPDUZBCRFPFH-WSTZPKSXSA-N 433.568 4.324 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ncsc2C2CC2)NC(=O)OC(C)(C)C)cc1 1629685604 PDWSQMFJXKTAJU-QGZVFWFLSA-N 430.574 4.082 10 10 IICE COc1ccc(-n2ccc(CNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)n2)cc1 1631105776 RYCASDANRAZBBC-UHFFFAOYSA-N 428.492 4.031 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2Cc3c(C)cccc3N2C(=O)OC(C)(C)C)c1 1631542947 NOHNUBHTKWUPNJ-YWZLYKJASA-N 426.513 4.253 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@]3(C)CC(c4cccc(Cl)c4F)=NO3)CC2)cc1 1632044197 GDCMKVMERIZROD-QHCPKHFHSA-N 445.922 4.156 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CC[C@@H](c2nccs2)C1 1633225745 LAPGXFXDNSEFPA-LKKYZFDUSA-N 449.648 4.202 10 10 IICE COC(=O)C[C@@H]1CCC[C@H]1NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1640856436 WZQLVZRHVBITNS-HNAYVOBHSA-N 433.346 4.318 10 10 IICE CC(C)(C)OC(=O)N1[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)CC[C@@H]1C1CC1 1643394558 LGAGWJHQEKOXMN-FGZHOGPDSA-N 427.589 4.471 10 10 IICE C[C@H]1CC[C@H](C(F)(F)F)CN1CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1645250606 CWZDCGOFOCVFLV-KBPBESRZSA-N 430.426 4.063 10 10 IICE CC(=O)c1cc(F)cc(CN2CC[C@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C2)c1O 1647788522 ZTANUOIFPFMWEC-PBHICJAKSA-N 448.457 4.259 10 10 IICE Cc1cc(C(=O)CSc2nnnn2C2CC2)c(C)n1-c1ccc(OC(F)(F)F)cc1 1652556674 FPVGRLSSZDJPHR-UHFFFAOYSA-N 437.447 4.289 10 10 IICE COc1ccc2c(c1)CCCCN2C[C@H](O)c1ccc2c(c1)CN(C(=O)C(F)(F)F)CC2 1652934232 JFDNAUAZJSYGLZ-QFIPXVFZSA-N 448.485 4.019 10 10 IICE COc1ccc(CN[C@@H](CNS(=O)(=O)c2ccc(C)cc2C)c2ccccc2)cc1C 1653936350 XQLOXLHOINVHSH-QHCPKHFHSA-N 438.593 4.430 10 10 IICE Cc1cc(CCNC(=O)N2CC[C@H](C(=O)N(C)c3ccccc3)C2)c(C)n1-c1ccccc1 1674924976 XFTBHADFLVRKML-QHCPKHFHSA-N 444.579 4.331 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)C2CC2)cc1 1675780050 JQVHXNNIPPQTQO-JQVVWYNYSA-N 442.604 4.215 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccccc4[C@@H]3CO)cc2Cl)C1 1680561273 AVBUQVAYUFZFOW-HXOBKFHXSA-N 427.976 4.378 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H]3CCO[C@H]3c3ccc(Cl)cc3)C2)cc1 1683504515 VYANYAFQELPTJX-USCONSEESA-N 429.948 4.004 10 10 IICE CCN(C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1686826806 PWEIUYCZBDSHPH-RXVVDRJESA-N 432.609 4.033 10 10 IICE CC1CCN(c2ccc(Cn3c(CC(C)(C)C)nnc3N(C)CCn3cccn3)cc2)CC1 1693701841 SMWYTFFKBWDLGL-UHFFFAOYSA-N 449.647 4.484 10 10 IICE Cc1cnn([C@@H]2CCCN(c3nnc(CC(C)C)n3CCCSc3nccs3)C2)c1 1762183767 YXWNMAWUGFELCT-GOSISDBHSA-N 445.662 4.462 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1c(C)nn(C)c1C 1763500272 QDTXZTZLPYFBLH-GOSISDBHSA-N 435.620 4.427 10 10 IICE COCCC1(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCCC1 1769590045 URDUYMPFZZLVOP-OAQYLSRUSA-N 428.577 4.459 10 10 IICE COC[C@@H]1[C@H]2CCN(c3nnc(CC(C)(C)C)n3Cc3ccc(N(C)C)cc3C)C[C@H]21 1770228767 AWAGUNIZNFXXMO-BHDDXSALSA-N 425.621 4.008 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)NCc2ccc(F)cc2)sc(C)c1-c1ccccc1 1860760067 RCDRGIORPMOHTN-UHFFFAOYSA-N 440.496 4.294 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC3CCCCCC3)C(=O)N(CCN(C)C)C2=O)cc1 1873167852 AMTRBJCJAKCFKX-UHFFFAOYSA-N 448.611 4.048 10 10 IICE CC[C@@H](NCCCOCCNC(=O)OC(C)(C)C)c1cc(Br)ccc1O 2111840563 HJQZXNXDKFCNBH-MRXNPFEDSA-N 431.371 4.127 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CNCc2cc(Br)ccc2O)C12CCC2 2120832589 QSAXHFBZOCAUQD-HNNXBMFYSA-N 425.367 4.424 10 10 IICE CCCCCN1C(=O)C(=Cc2c(NCC(C)C)nc3ccccn3c2=O)SC1=S 2296731446 YEBVJVOVZLAXGJ-UHFFFAOYSA-N 430.599 4.154 10 10 IICE COC(=O)[C@@H](c1ccccc1)N1C(=O)C(=Cc2ccc(Br)o2)SC1=S 2314769201 ORBRJMIBUMZZKB-CQSZACIVSA-N 438.324 4.158 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CNC(=O)C=Cc3ccc([N+](=O)[O-])cc3)cc2)c1 2328297987 XNDLWRZFEVCLHC-UHFFFAOYSA-N 444.491 4.243 10 10 IICE CCCN(CCC(=O)N(C)Cc1ccc(C)c(Br)c1O)C(=O)OC(C)(C)C 2380785748 DINIXEMFDBGYGG-UHFFFAOYSA-N 443.382 4.459 10 10 IICE CCNc1cc(N2CCN(c3ccccn3)CC2)c2noc3c2c1C(=O)c1ccccc1-3 9641881 OFIGUBCMJWCESG-UHFFFAOYSA-N 425.492 4.193 10 10 IICE CCOc1cc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c([N+](=O)[O-])cc1OC 11085536 LUWHYKATDFQJSA-UHFFFAOYSA-N 437.496 4.382 10 10 IICE CCc1ccc(Cc2cnc(NC(=O)CCCN3C(=O)[C@@H](C)SC3=S)s2)cc1 11636173 FPARTRVAUVMUMX-CYBMUJFWSA-N 433.624 4.264 10 10 IICE COc1ccc([C@H]2N=C(c3ccc4c(c3)OCO4)C[C@@H](c3ccccc3O)N2)cc1OC 53363258 CLEAOMNBWGEQGZ-DFBJGRDBSA-N 432.476 4.361 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@@H](c2ccccn2)c2ccc3cccnc3c2O)c1 54620933 QXUWBVRXJYJUHU-JOCHJYFZSA-N 443.459 4.110 10 10 IICE COC(=O)/C=C/c1ccc(N2CCO[C@@H](c3ccccc3Br)C2)c([N+](=O)[O-])c1 72073130 BEIPTSQJQITLCS-QRBZPYHOSA-N 447.285 4.121 10 10 IICE COc1cc(C)cc(CNC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)c1 752205936 HPWMGHMDABBXDY-LDADJPATSA-N 446.619 4.363 10 10 IICE Oc1c(Br)cc(Br)cc1CNc1cccc2c1OCC[C@H]2O 768529426 NELJOEDEJUBXRQ-CQSZACIVSA-N 429.108 4.345 10 10 IICE CCCN(Cc1cc(Br)ccc1O)C1CCN(c2cc(C)nc(C)n2)CC1 769424184 YJQKUGFFJVLLJC-UHFFFAOYSA-N 433.394 4.443 10 10 IICE Cc1cc(NC(=O)NCc2cc(Br)ccc2O)ccc1N1CCSCC1 806247644 NRRPGVPVKUXZCH-UHFFFAOYSA-N 436.375 4.338 10 10 IICE CC(=O)C(=O)CSc1ncc(-c2ccc(Br)cc2)n1CCCOC(C)C 808014178 ATHNOWWCYRZLGG-UHFFFAOYSA-N 439.375 4.378 10 10 IICE CN(C)c1nc(CNCc2cc(Br)ccc2O)c(Cl)n1-c1ccccc1 809713489 RMNANEYNPALHGY-UHFFFAOYSA-N 435.753 4.350 10 10 IICE CCOC(=O)[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(O)c1 1137441794 MYIHICHEWQJRSE-HSZRJFAPSA-N 440.927 4.416 10 10 IICE Cc1cc(C(=O)N[C@H](CCO)c2ccccc2F)c(C)n1-c1ccc(Br)cn1 1143073966 KYTJDAJAUIVYRM-LJQANCHMSA-N 446.320 4.244 10 10 IICE Cc1ccccc1N(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C(C)C 1191997939 MVYDIHYUDFGIHN-WOJBJXKFSA-N 427.564 4.279 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3c(-c4c(F)cccc4Cl)noc3C)C2)cc1 1278861797 OGGFWFSUTUYUPT-CQSZACIVSA-N 429.879 4.460 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCCOc2ccc(Br)cc2)c1 1292390841 DMLPDELLSGSTCO-UHFFFAOYSA-N 441.325 4.478 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@H]3CCCN(C(=O)OC(C)(C)C)C3)c2C)cc1 1292572005 DYEJRDBEPDBBII-LJQANCHMSA-N 441.572 4.480 10 10 IICE CCc1csc([C@H]2CCCN(c3nnc(CC)n3Cc3ccc(N(C)C)c(F)c3)C2)n1 1292672047 WJGULRXPDNWYLR-KRWDZBQOSA-N 442.608 4.497 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cnccn2)n1C[C@@H]1CCCCC(F)(F)C1 1298363279 BKXCUNDJQYOVPN-MRXNPFEDSA-N 428.487 4.293 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CCOc1ccc(Cl)cn1 1298364842 IXJZJHAICCCRFP-UHFFFAOYSA-N 441.963 4.480 10 10 IICE C/C=C/[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)NCc1ccc(N2CCCCC2)cc1 1299788558 VCLXXJZWXBMVOT-BPCMGAEPSA-N 427.589 4.352 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnnn1C 1306564408 ATZAZSHTIFNSIC-KRWDZBQOSA-N 432.576 4.154 10 10 IICE CCCC1(Cn2c(COCC)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CCC1 1306605616 ANKRREQQENAEOT-UHFFFAOYSA-N 445.583 4.259 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1 1360273603 NRMOBSSXHJNOCB-VTJDKEBTSA-N 439.987 4.425 10 10 IICE CC(C)OCCCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1360387004 WTIUCONDIHOYDJ-UHFFFAOYSA-N 436.604 4.335 10 10 IICE C[C@@H](NC(=O)c1ccccc1-n1ncc(Cl)c(Cl)c1=O)c1ccc(N(C)C)cc1 1435947250 IOWXFVNFTDUZSP-CYBMUJFWSA-N 431.323 4.096 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCC(CN=[S@@](C)(=O)N(C)C)CC3)c2C)c1 1457071390 UFWUNWWOLYFDKF-WJOKGBTCSA-N 444.645 4.138 10 10 IICE Cc1ncccc1[C@@H](C)OC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1461686734 CMZKRKPOBPCBCU-IIMQCXAKSA-N 430.526 4.425 10 10 IICE O=C(CCCc1ccc(Br)cc1)NCc1ccc(N2CCC(CO)CC2)cc1 1465394916 GYENSCAJNUVCCD-UHFFFAOYSA-N 445.401 4.297 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@]1(c2ccccc2)C[C@@H](NC(=O)OC(C)(C)C)C1 1467840184 KVIMLTBQCQKGSW-YGFACIEFSA-N 445.556 4.119 10 10 IICE Cc1cc(C(=O)N2CCO[C@]3(CCSC3)C2)c(C)n1-c1ccccc1Br 1469308896 ACFMCYSISUGNIQ-HXUWFJFHSA-N 435.387 4.205 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)N1C[C@H](C)O[C@@H](C)C1 1495138203 UNGLGTSYVQQTPG-FHWLQOOXSA-N 429.609 4.021 10 10 IICE CCN1CCN(c2ccc(CNC(=O)/C=C\c3ccccc3C(F)(F)F)cc2F)CC1 1528701163 FTPWTHLHZOGUTH-NTMALXAHSA-N 435.465 4.316 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(C(F)(F)F)cc1O 1545042904 UOOAFFGNEPZCLQ-CYBMUJFWSA-N 430.373 4.411 10 10 IICE CC(=O)N1CC[C@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)c2ccccc21 1545816203 CLQAPSPRPUSLIM-DEOSSOPVSA-N 429.520 4.063 10 10 IICE CCS(=O)(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1556434613 HYOOGNZBKOBEQX-UHFFFAOYSA-N 430.957 4.471 10 10 IICE COC(=O)[C@@H](Cc1ccccc1O)NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1557590486 BPGKSGKNBYABNH-HSZRJFAPSA-N 434.536 4.437 10 10 IICE COc1ccc(N(C)CCN(C)[C@@H](C)C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1 1559966919 ONRZHTIYBXCPAM-FQEVSTJZSA-N 445.563 4.321 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3nc4ccc([N+](=O)[O-])cc4[nH]3)c2C)c1 1564658962 YEMJSGQXRAGXCH-UHFFFAOYSA-N 432.484 4.186 10 10 IICE Cc1ccc(O)c(CNC(=O)NC[C@@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)c1 1564736221 PSXPFNZCQIHDAI-HXUWFJFHSA-N 425.529 4.034 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 1564946471 PZZYJAZSVDZYFP-JRGCBEDISA-N 441.576 4.163 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(Cc3cccc(F)c3)CC2)N(C)C)cc1 1565453070 RBSQXPWLFCYNLR-XMMPIXPASA-N 426.580 4.159 10 10 IICE COc1ccc(-c2noc(CCCC(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)n2)cc1 1584087996 BUGYIHDWUYFRQB-SFHVURJKSA-N 436.556 4.190 10 10 IICE Cc1cccc([C@H](CNC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)N2CCOCC2)c1 1595719358 GJTGJNQYHVGKQY-VWLOTQADSA-N 435.543 4.345 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2cccc(F)c2Br)cc1 1598290769 COWIWPFOWAZZCE-KRWDZBQOSA-N 435.337 4.476 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 1616754504 LZXSNBIAZVFRKS-IBGZPJMESA-N 439.556 4.284 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)Cc3ccccc32)cc1F 1625952328 XVASSKRMMPUEED-IBGZPJMESA-N 427.520 4.042 10 10 IICE CCO/C=C/[C@](O)(CNC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C)C(F)(F)F 1628621709 AFTDWKUEACEUJS-SGQUHAKNSA-N 430.854 4.321 10 10 IICE CCc1nsc(N2CCN(C(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)n1 1629045087 VFZRNYZQDOMIDQ-UHFFFAOYSA-N 429.977 4.124 10 10 IICE COCc1cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)ccc1F 1633602831 CLWJBOXRRXTQMR-UHFFFAOYSA-N 446.320 4.467 10 10 IICE Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1)C2=O 1637244162 VJLPFWXPABPOKG-MOPGFXCFSA-N 442.515 4.475 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H](O)c2ccccc2Br)c1 1637961194 RGZUSBKGUWYQHQ-OAQYLSRUSA-N 441.325 4.133 10 10 IICE CCCCC[C@@H]1CCCCN1CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1647827416 BWSMVALBNIMFIK-KCZVDYSFSA-N 433.612 4.490 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CCC[C@H]3CC3CCCC3)cc2F)C[C@@H](C)O1 1654062611 OVRIDJOYDOLJEQ-JQVVWYNYSA-N 431.596 4.100 10 10 IICE C[C@H]1CN(c2ccc(CNc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)cn2)CCO1 1654973027 MRZHDVZQNLQSEV-KRWDZBQOSA-N 432.480 4.058 10 10 IICE COc1ccc(N2CCN([C@H](C)c3nc(-c4ccc(F)c(C)c4)no3)CC2)c(OC)c1 1659861143 LNGHHGCZTQEJBH-MRXNPFEDSA-N 426.492 4.085 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1C[C@H](CCN2CCCC2=O)c2ccccc21 1682097286 PBZFJJAOVWIPFD-UNMCSNQZSA-N 448.611 4.318 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCSC[C@H]3c3ccccc3)C2)cc1 1682188164 ILIWDYBTJAQZJM-CVDCTZTESA-N 425.598 4.411 10 10 IICE CCC[C@@H](C)CN(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCOCC2)cc1 1695077410 VDXQLOBBZIVHQE-OAQYLSRUSA-N 448.615 4.021 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N(C)Cc2cccs2)cc1 1695618459 AACMSTLWOKZNES-UHFFFAOYSA-N 435.601 4.271 10 10 IICE COCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nccs1 1712374608 XWRFVTWBOLMRBS-UHFFFAOYSA-N 436.585 4.330 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCC[C@@H]1OC 1727004262 VWGCYDWLSNGLNO-WFXMLNOXSA-N 445.583 4.081 10 10 IICE CC(C)CN1CCC[C@@H](Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1741556061 LRONUWKTQMKYIJ-HXUWFJFHSA-N 434.588 4.050 10 10 IICE CC/C=C\Cn1c(-c2cccc(C)n2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1763620587 GKMJKNSCQDJETR-WAYWQWQTSA-N 432.572 4.340 10 10 IICE COC1(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)CCC(C)CC1 1769769660 HMYOLRRHYRYCRA-VZQLXNMESA-N 428.577 4.457 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](Cc3ccncc3)c3ccc(Cl)cc3)CC2)cc1 1858086245 CYHHQZZFQHQKLG-XMMPIXPASA-N 435.955 4.419 10 10 IICE O=C(O)CCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc(O)nc(O)c1 1952222496 RUIGQKOMMPUGLN-NRFANRHFSA-N 448.475 4.328 10 10 IICE COc1cccc(O)c1CNc1cc(Br)ccc1I 2104441748 BCZCSJCABJILMP-UHFFFAOYSA-N 434.071 4.380 10 10 IICE COc1cc(C)c(C=C2C(=O)NC(=S)N(c3cc(Cl)cc(Cl)c3)C2=O)cc1C 2297559182 ZHUHAZBYCMGSIU-UHFFFAOYSA-N 435.332 4.450 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(Cl)cc2Cl)SC1=S)c1cccc(O)c1 2314926499 KQZNWNVBRGVOAQ-UHFFFAOYSA-N 425.318 4.245 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C23CCC3)c(O)c1Br 2352672211 QJPQRBVUDMXIMX-OAHLLOKOSA-N 425.367 4.485 10 10 IICE O=C1/C(=C\N2CCN(C/C=C\c3ccccc3)CC2)SC(=S)N1CCc1ccccc1 102676195 DDCSDFUIZUSMAW-ZOFKLYGDSA-N 449.645 4.262 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccccc3NC(=O)c3ccccc3)CC2)cc1 108575489 GMFULFICRQXOBK-UHFFFAOYSA-N 429.520 4.300 10 10 IICE CCCCOc1ccc(/C=C2/SC(=S)N(CCCC(=O)OC)C2=O)cc1OCC 206860514 HNWPOKSYRHSCBY-NBVRZTHBSA-N 437.583 4.419 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H](Cn3ccnc3)c3ccc(C)cc3C)CC2)cc1 750292782 XXMDEMGUUVHPCI-RUZDIDTESA-N 447.583 4.218 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)c1C(F)F 769167594 RDZNLTRJLNNGCM-UHFFFAOYSA-N 446.420 4.267 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccc(Cl)cc2)c1 769529498 CMVROKPTHWFITH-HBGVWJBISA-N 442.943 4.144 10 10 IICE C[C@H](NC[C@H](CO)Cc1ccc(C(F)(F)F)cc1)c1ccc(N2CCOCC2)c(F)c1 773082853 XCPZHNFFJLEPQK-FUHWJXTLSA-N 440.481 4.183 10 10 IICE CC[C@H](C)n1ncc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 790676572 KONFNNCYYIDJON-HRAATJIYSA-N 443.592 4.224 10 10 IICE COC(=O)c1ccc(Br)cc1CN(Cc1ccccc1O)C[C@@H]1CCCO1 801524154 ZPSZXPPGFCYSII-SFHVURJKSA-N 434.330 4.123 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 1142689905 FDVRMMRDSDDLBP-UHFFFAOYSA-N 438.524 4.117 10 10 IICE Cc1cc(C(=O)NC(c2nccn2C)c2nccn2C)c(C)n1-c1ccc(C(C)C)cc1 1147853428 KLVBEMFOJLBASI-UHFFFAOYSA-N 430.556 4.204 10 10 IICE O=C(CCCOc1cccc(Br)c1)NCc1cccc(Br)c1O 1156790197 FKHAOBPDDZQHBQ-UHFFFAOYSA-N 443.135 4.393 10 10 IICE Cc1cc(C(=O)N[C@@H](c2ccccc2F)[C@@H](C)O)c(C)n1-c1ccc(Br)cn1 1164548322 FQBJIMWZHYHXTM-JLTOFOAXSA-N 446.320 4.243 10 10 IICE CC(C)(C)[C@@H]1Cc2ccccc2N(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1 1175333155 RNLSIYUCVRJSPD-OAQYLSRUSA-N 439.575 4.004 10 10 IICE C[C@@H](Cn1ncc2ccccc2c1=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 1185839051 XOCISVLRUWHWCR-INIZCTEOSA-N 428.448 4.036 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cccc2nccnc12 1288080600 JHCBLCJKLLSJAG-FOWTUZBSSA-N 440.575 4.311 10 10 IICE CCC[C@](C)(O)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1293843568 HLSAMPVZRLAGHY-FPGHNAPASA-N 430.593 4.090 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)Cc1csc(-c2ccc(CC)cc2)n1 1299699453 QZGFRQSRSRLXHZ-UHFFFAOYSA-N 438.549 4.213 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(F)c(Cl)c([N+](=O)[O-])c3Cl)C2)cc1 1300634433 UHUMWBNJLCONDT-JTQLQIEISA-N 428.247 4.058 10 10 IICE CC(C)[C@@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1302763000 WNMPEWVFWIEXEJ-OAQYLSRUSA-N 425.621 4.234 10 10 IICE CCN(CC)CCCn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1313712328 NVYFRVUNJBEBDN-UHFFFAOYSA-N 428.968 4.067 10 10 IICE COCCN(CC(C)C)c1nnc(CC(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1316088337 IJBPCWNUKNYEBE-UHFFFAOYSA-N 427.637 4.406 10 10 IICE FC(F)[C@@H]1CCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1316517285 XAJHNUPZMNTXTC-CQSZACIVSA-N 436.557 4.461 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1ccc(F)c(I)c1 1353911579 SKCKTPSKHBFDRO-UHFFFAOYSA-N 438.284 4.303 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 1444803004 KQDJWRZADGUDEU-UHFFFAOYSA-N 447.491 4.498 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1 1446795799 BECUDPUAWNEXSR-NFBKMPQASA-N 435.568 4.410 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccnc2N2CCCCC2)cc1 1453249732 WDHLEWGLDHGWRY-UHFFFAOYSA-N 430.552 4.151 10 10 IICE COc1ccc(C(=O)C[C@@H](C)C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952038 TXXRYTFHRYKXNR-UZLBHIALSA-N 444.959 4.044 10 10 IICE Cc1cc(C(=O)NCc2ccc(NC(=O)C(F)(F)F)nc2)c(C)n1-c1ccc(F)cc1 1468828010 ICDDZDJGQYXXOQ-UHFFFAOYSA-N 434.393 4.059 10 10 IICE Cc1ccc(O)c(CNC(=O)c2nn(-c3ccc(Br)cc3)c3c2CCCC3)c1 1470255204 SMOKHQJBTOTUSJ-UHFFFAOYSA-N 440.341 4.458 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCc2c(Cl)cccc2OC(F)F)cc1 1471092646 XOTJRRUFSKQERX-UHFFFAOYSA-N 427.879 4.228 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](C)C(C)(C)c3ccccc3)cc2F)C[C@@H](C)O1 1473340331 FXSOJIVCHQWWAN-HSALFYBXSA-N 441.591 4.011 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N[C@@H]1CCC[C@@H](c2ccccc2)C1 1478590032 QFXIBNRWNJFJQT-WOJBJXKFSA-N 429.511 4.327 10 10 IICE CCOC[C@H]1CCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C1 1503161234 XSPCWIVITSMTHG-NRFANRHFSA-N 425.621 4.296 10 10 IICE CC[C@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(CC)CC)cc2)CCS1 1514178836 ZBLFXCLFSCRSRQ-UNMCSNQZSA-N 443.661 4.398 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCCc1ccccc1F 1520243365 KUPOTLXCOCOTGT-RGEXLXHISA-N 446.544 4.305 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccnn1CCc1ccccc1 1520922715 QGEBNNZEMJHVNW-UHFFFAOYSA-N 440.494 4.126 10 10 IICE CC[C@@H](C)CCCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1527966436 DBUIHYCUFCYMII-LJQANCHMSA-N 427.568 4.165 10 10 IICE CN(C)c1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)nc2ccccc12 1531501409 BGEJFSJKIOUPRR-INIZCTEOSA-N 440.494 4.301 10 10 IICE Cn1cc(-c2ccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc2)cn1 1531502349 GLJFKJKRMGFKHN-IBGZPJMESA-N 426.467 4.087 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)Oc2cccc(C(=O)N3CCOCC3)c2)c1 1533901314 XPQYPXUFBOMJFF-UHFFFAOYSA-N 438.911 4.439 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N[C@H](CC(C)(C)C)c3ccccc3)CC2)cc1 1540817979 JTIUHMZBJFOFME-DJKHGBOQSA-N 449.595 4.194 10 10 IICE Cc1ccc(C(=O)Nc2cccc(CN3CCOC3=O)c2)cc1-n1c(C)cc(C=O)c1C 1540968672 SPDMXNGERLZAMK-UHFFFAOYSA-N 431.492 4.420 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)c2ncc([N+](=O)[O-])cc2Br)cc1 1559156699 HKSOYPQQSFUNAP-KRWDZBQOSA-N 435.322 4.004 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@H](CSc3ccccc3)C2)N(C)C)cc1 1565452643 IOJPPRKEGYAMIL-CVDCTZTESA-N 426.630 4.179 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)N(C)C)cc1 1586060323 GUUVPDJQAGLQKD-FQEVSTJZSA-N 446.473 4.459 10 10 IICE CC[C@H](C)c1nnc(N(CC)C[C@H]2CCCO2)n1Cc1ccc(N2CCSCC2)cc1 1613191310 ONCMKLFTOJWPLE-SIKLNZKXSA-N 443.661 4.398 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(SC)CC1 1613317018 UEIBOZWYLJOQAA-INIZCTEOSA-N 433.597 4.162 10 10 IICE CCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(OC)CCOC1 1614485674 GXNFGSQVDKKTPJ-VWLOTQADSA-N 437.588 4.394 10 10 IICE CO[C@H]1CCN(c2nnc(-c3cccc(Cl)c3)n2CCCSc2nccs2)C1 1620137114 LTLNNKIDMYKKRT-INIZCTEOSA-N 436.006 4.463 10 10 IICE COc1ccc(N2CCN(CCC(=O)Nc3c(Cl)cccc3Cl)CC2)c(OC)c1 1620515489 NCMPZVITBSCIIO-UHFFFAOYSA-N 438.355 4.161 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)/C=C\c3cccc(OC4CCCC4)c3)cc2)CC1 1626095341 TUEYSXJLAPFJEJ-RAXLEYEMSA-N 447.579 4.039 10 10 IICE COc1ccc(CCNC(=O)c2ccccc2N(C)C(=O)/C=C/c2ccc(C)nc2)cc1 1627165714 NWDMNLMUCMXSQB-NTCAYCPXSA-N 429.520 4.047 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1(c2ccc3c(c2)OCCO3)CC1 1631166710 JLTZBXFWJXEQLD-UHFFFAOYSA-N 432.314 4.006 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(F)cc(Br)c3F)CC2)cc1 1632158168 TWUHZEZDYYNNFT-UHFFFAOYSA-N 425.273 4.088 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC(C)(C)CCC(=O)OC(C)(C)C)C1 1634887367 OCJRZOZITZBIRW-UHFFFAOYSA-N 441.616 4.425 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(Cl)cc(F)cc2Br)cc1 1639814035 HPHBWVYBAUBDSD-UHFFFAOYSA-N 429.717 4.459 10 10 IICE CCOC(=O)c1sc2nc(C)nc(NCc3ccc(N4CCC(O)CC4)cc3)c2c1C 1640200168 GRYXZYGWFKDDDS-UHFFFAOYSA-N 440.569 4.058 10 10 IICE O=C(NCc1c(O)cccc1O)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1 1647269556 HXGXGKHSBPOKNU-UHFFFAOYSA-N 442.397 4.023 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2CC2CCCC2)c(C)n1-c1ccccc1 1692989076 RBOWZXSVFJPTCP-QGZVFWFLSA-N 434.588 4.243 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCNC(=O)c1cccs1 1695513983 WOAICAFCRKRHOE-UHFFFAOYSA-N 448.596 4.300 10 10 IICE CCC(O)(CC)Cn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1727288826 NURLFQMWAWLCMX-UHFFFAOYSA-N 434.588 4.128 10 10 IICE CCC(CC)[C@@H](Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O)N(C)C 1743993156 HZIDMZWCHHQLKJ-IFMALSPDSA-N 429.609 4.228 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N(C)Cc2cnn(CC)c2)cc1 1746090300 UAYWFGSJRFRIOW-UHFFFAOYSA-N 444.587 4.087 10 10 IICE C[C@H]1CCC[C@@](Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752088515 ZSCVIEYXPCLXAY-UQBPGWFLSA-N 434.588 4.193 10 10 IICE CCS(=O)(=O)c1ccc(O)c(N=c2cc(C(C)(C)C)nc(-c3cccc(C)c3)[nH]2)c1 1859832510 AYOOQJLIBMAMSF-UHFFFAOYSA-N 425.554 4.414 10 10 IICE CCCC[C@H](NC(=O)/C(C)=C/c1ccccc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1868748513 MOXMCYZDMXYORB-NJCFQMBCSA-N 449.595 4.122 10 10 IICE C[C@@H](c1ccccc1O)N(C)C(=O)[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2010160068 YDRYHTCTSUAGRI-FXAWDEMLSA-N 428.529 4.022 10 10 IICE Cc1ccccc1OCC1=NN2C(=N)/C(=C\c3c(C)[nH]c4ccccc34)C(=O)N=C2S1 96499374 IYUMQMJOKUDFEL-UVYYMYQDSA-N 429.505 4.483 10 10 IICE CC(=O)[C@@H](/N=N/c1ccc(Cl)cc1C(F)(F)F)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 111486989 AEASHRDYTBPWPD-CBEZKNFISA-N 439.781 4.208 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(Cc2ccco2)C[C@@H]2CCCO2)C1 426884363 TVHCACLPKBTQOP-NRFANRHFSA-N 435.568 4.209 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCC[C@@H]2c2nc(CCOCC3CC3)no2)cc1 581796738 FBYTYIHRKSXZMG-JOCHJYFZSA-N 434.540 4.424 10 10 IICE C[C@H]1[C@@H](NCc2cc(Br)ccc2O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709343741 MXTXYFRAPDLOQL-NKKGCODLSA-N 425.367 4.421 10 10 IICE CC[S@@](=O)CCNC(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 735108823 DLOQCVCIDJXGIS-VPTFNQTCSA-N 441.519 4.250 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1(C(=O)Nc2ccc(F)cc2)CC1 769299328 XMFCEQVFRAFDQN-UHFFFAOYSA-N 435.293 4.061 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)OCC(=O)Nc2ccccc2Cl)C1 769665886 XGTHGMNPLLHBCH-UHFFFAOYSA-N 439.943 4.243 10 10 IICE CC(C)n1ncc2c1C[C@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)CC2 790583523 IJHXCNJLVJHSPB-OAQYLSRUSA-N 435.572 4.392 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2CC(F)F)c(C)n1-c1ccccc1Br 804725859 YHFAAKYOWURETN-CQSZACIVSA-N 427.289 4.353 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)sc2c1CCCC2 1124635401 XWLNXLFWZJBNFU-LBPRGKRZSA-N 432.929 4.059 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)OCc2cn(CCc3ccccn3)nn2)c1 1129164779 ZZLSUVDVDOFODE-UHFFFAOYSA-N 435.915 4.334 10 10 IICE O=C(Cc1c[nH]c2cnc(Cl)cc12)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1148444554 UMPOZDBRLWIJSC-AWEZNQCLSA-N 434.874 4.145 10 10 IICE COCCN(Cc1cccc([N+](=O)[O-])c1Br)c1ccc(OC)c(OC)c1 1167695110 DLZXQZUUGRNGQJ-UHFFFAOYSA-N 425.279 4.028 10 10 IICE C[C@@H](NC(=O)c1cc(I)c(F)cc1F)c1ccc(N(C)C)cc1 1269587274 DPTHDPCNIFCGHE-SNVBAGLBSA-N 430.236 4.126 10 10 IICE Cc1ccc2c(C(=O)N[C@H](C)Cc3ccc(O)c(O)c3)cc(-c3cnn(C)c3)nc2c1C 1296246994 QEFHGKOUCNKBBV-OAHLLOKOSA-N 430.508 4.024 10 10 IICE CNc1cc(I)ccc1C(=O)NCc1ccc(N2CCCCC2)cc1 1299788168 CCOXUNHHNCWYAJ-UHFFFAOYSA-N 449.336 4.253 10 10 IICE CC[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@@H](C)O1 1306454547 XGSNEFZQFFARKT-XXBNENTESA-N 425.621 4.437 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC)c2cnn(C)c2)sc(C)c1-c1ccccc1 1307883914 XNCRADKCCPOEOP-UHFFFAOYSA-N 426.542 4.099 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NCc3ccc(N(C)C)cc3)cc2)c1 1351266183 QMVIQODNZMFNMU-UHFFFAOYSA-N 438.549 4.067 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(C)(C)n2ccc(NC(=O)OC(C)(C)C)n2)cc1 1355911079 NTBWKCMXDYGQBO-UHFFFAOYSA-N 429.565 4.128 10 10 IICE COc1cc(OCC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)ccc1[N+](=O)[O-] 1436047029 ISDQITYVFHZTEA-HNNXBMFYSA-N 447.919 4.188 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1[C@@H](NC(=O)OCc2ccccc2)[C@H]2C=C[C@H]1C2 1464508436 TYHXFRSYGSENNK-TWVZQSRDSA-N 447.579 4.218 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CC1CC(NC(=O)OC(C)(C)C)C1 1465851496 VRICVPHZJKOYKI-UHFFFAOYSA-N 441.366 4.197 10 10 IICE COc1ccccc1[C@@H](NC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C)c1ccccn1 1478363621 GGTRMNZKYRIIPX-KBMIEXCESA-N 432.568 4.484 10 10 IICE Cc1coc(C)c1Cn1c(CC(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1492635233 LAVGSABTISQFHH-UHFFFAOYSA-N 437.588 4.208 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(C)C)C2)cc1 1529706828 IQHFEAYCPQDIIB-WIYYLYMNSA-N 447.620 4.213 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3c(C)ccc(Br)c3OC)C2)cc1 1529708051 OQAQPMUNHMHMTR-HNNXBMFYSA-N 433.346 4.031 10 10 IICE CCC[C@@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccn1 1537512727 RKSNBSZLGUXZML-XWALVKJWSA-N 443.569 4.470 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CSCc3ccc(Br)cc3)C2)cc1 1538747966 WBOGHPWCAWSIEP-KRWDZBQOSA-N 435.387 4.086 10 10 IICE CCN(CC)[C@H](C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccccc1 1539581345 DFCNBMUEVBDEPY-UGKGYDQZSA-N 431.527 4.456 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4cccc(F)c4)C3)cc2Cl)C1 1539913930 WQSSEELOQYOYBW-SJLPKXTDSA-N 443.950 4.385 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2nccn2CCc2ccccc2)c1 1545372658 JPLWKJIHXVAQNJ-UHFFFAOYSA-N 426.520 4.276 10 10 IICE Cc1cc(C(=O)N[C@@H]2CN(c3ccccc3)C2=O)c(C)n1-c1ccccc1Br 1556167465 HEXYOIKYRMMISH-LJQANCHMSA-N 438.325 4.002 10 10 IICE CC(C)(C)OC(=O)c1ccccc1CNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1565148770 SDKMHDHJOGNNJW-FQEVSTJZSA-N 440.540 4.238 10 10 IICE Cc1cccc([C@H](C)CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1 1565897421 NQEHZRHMQBDEBG-OAHLLOKOSA-N 430.551 4.096 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2cccc(Cl)c2nc1C 1566849549 LVXYZVWHHCMHKU-UHFFFAOYSA-N 433.291 4.371 10 10 IICE Cc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)nn1CC(F)(F)F 1584246418 IWCWBMBSCMFDAX-UHFFFAOYSA-N 433.478 4.114 10 10 IICE Cc1ccc(C(=O)NC[C@@](C)(O)c2ccc(F)cc2F)cc1-n1c(C)cc(C=O)c1C 1586883040 TXTPNOBCNFJXJX-XMMPIXPASA-N 426.463 4.131 10 10 IICE CC[C@@H](C)N(CC)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 1587197163 NTOXHZSUAZLWOO-DYTQJMLRSA-N 441.416 4.297 10 10 IICE Cc1cc(CCNC(=O)c2cn(-c3cccc(Cl)c3F)nn2)c(C)n1-c1ccccc1 1595950641 TWLDJZJMDMEVSZ-UHFFFAOYSA-N 437.906 4.440 10 10 IICE CN1C(=O)c2ccc(-c3ccc(F)cc3F)cc2O[C@@H]2CN(Cc3ccccc3O)C[C@@H]21 1615262374 FQMQTMUPTNHBPF-XUZZJYLKSA-N 436.458 4.055 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3sc(-c4ccc(OC)cc4F)nc3C)C2)cc1 1617262938 PEAYIOWLXGYBLX-HNNXBMFYSA-N 441.528 4.284 10 10 IICE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@@H]1C(=O)NCc1cccc(Br)c1O 1626821754 FCEYPVMSOPPCCQ-INIZCTEOSA-N 441.366 4.197 10 10 IICE Cc1cc(C(=O)NCc2ccccc2N2CCN(C)CC2)c(C)n1-c1cccc(Cl)c1 1628685911 QDPVSHNVNVALHB-UHFFFAOYSA-N 436.987 4.429 10 10 IICE COc1cc(OC)cc(N2CC[C@@H](NC(=O)c3sccc3-n3c(C)ccc3C)C2)c1 1629263774 FTEIHLDGQXVACX-QGZVFWFLSA-N 425.554 4.182 10 10 IICE CCCCNc1nc(CC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cs1 1630280565 NNXDKDQTUYLRTD-HNNXBMFYSA-N 438.544 4.284 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](n3ccnn3)CC2)c(C)n1-c1ccc(Br)cc1 1634165292 MNIGMYALVZOXPI-SFHVURJKSA-N 442.361 4.316 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCC(=O)Nc3cccc(F)c3)cc2Cl)C1 1634720298 SXXZEGYXSJKBME-HNNXBMFYSA-N 432.927 4.153 10 10 IICE Cc1cc(C(=O)N[C@@H](C2CCOCC2)C2CC2)c(C)n1-c1ccc(Br)cn1 1639717647 VJEMDNNRGWDKSS-HXUWFJFHSA-N 432.362 4.187 10 10 IICE COC1CCN(c2ccc(CN(Cc3ccccc3)[C@H](C)CN3CCOCC3)cc2)CC1 1657198205 XMTZNGWAYWJMBI-HSZRJFAPSA-N 437.628 4.025 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCC3(OCCO)CCC(F)(F)CC3)c2C)c1 1684479110 STRRHSKIMBWBJX-UHFFFAOYSA-N 449.542 4.159 10 10 IICE Cc1ccc(CCN(Cc2ccco2)C(=O)NCc2ccc(N3CCN(C)CC3)cc2)cc1 1684970195 GUZQYPKQVVHESP-UHFFFAOYSA-N 446.595 4.294 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCc3ccccc3)c3ccccn3)C2)cc1 1687025052 LJPMPGCUOICNIQ-SQJMNOBHSA-N 430.552 4.342 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)N(C)C(=O)OC(C)(C)C 1693999871 VVGOMWFJKRXKMK-IRXDYDNUSA-N 431.581 4.389 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCOC2)nnc1N1CCC[C@@H](C(C)C)C1 1707305277 VWRWYTRWEXVBSZ-IFMALSPDSA-N 425.621 4.467 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1Cc1cn2cc(Cl)cc(Cl)c2n1 1744548865 JKEKHZWDSAJEOH-UHFFFAOYSA-N 431.327 4.185 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)CC1 1747451786 RSOOPGRSUVCMTI-HKBQPEDESA-N 439.629 4.358 10 10 IICE CC(C)C(C)(C)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1750574223 DNTZLXBLNPSEDC-UHFFFAOYSA-N 436.604 4.428 10 10 IICE Cc1noc(C)c1CN(C)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1762658788 PYONXTQXENJCPY-QGZVFWFLSA-N 448.618 4.400 10 10 IICE C[C@H]1C[C@@H](C)CN(CCCCn2c(-c3cccnc3)nnc2N(C)Cc2ccccc2O)C1 1762723697 KEEDSAMUSUVJGR-OYRHEFFESA-N 448.615 4.440 10 10 IICE COc1ccc(-c2nnsc2C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 1874179969 UBAOUEDNPRJPCQ-UHFFFAOYSA-N 441.468 4.241 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](CNCc2cccc(Br)c2O)C12CCC2 2120833489 YXLJHVTWXJGEDK-OAHLLOKOSA-N 425.367 4.424 10 10 IICE CN1CCc2cc([C@H](O)c3cc(I)ccc3Br)ccc21 2163078083 ZGJLVPHUCKMYJT-INIZCTEOSA-N 444.110 4.128 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)c1ccc(Br)cc1I 2207264062 ANCHUQYTSITFIP-INIZCTEOSA-N 445.142 4.429 10 10 IICE COc1ccc(Br)c(CN[C@@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)c1O 2236055472 QCIFEVWJUCBYGQ-MJBXVCDLSA-N 441.366 4.041 10 10 IICE COc1ccc(Br)c(CNC2[C@H](C)CN(C(=O)OC(C)(C)C)C[C@H]2C)c1O 2236055952 SVFCXJGXMLSQSO-CHWSQXEVSA-N 443.382 4.144 10 10 IICE Cc1ccc(O)c([C@@H](C)NC2CN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)C2)c1 2259378719 BKPOAGHVOLGHDV-QGZVFWFLSA-N 449.592 4.208 10 10 IICE CCOc1cc(C=C2C(=O)N(c3ccc(I)cc3)N=C2C)ccc1O 2297349795 MKTVWZWTXRBAGV-UHFFFAOYSA-N 448.260 4.202 10 10 IICE CC(=O)Nc1cccc(NC=C2C(=O)N(c3ccc(Br)c(C)c3)N=C2C)c1 2297465635 XDDWWFQKFFMNIR-UHFFFAOYSA-N 427.302 4.434 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@@H]2[C@H](c2cccc(Cl)c2)N3)CC1 14460352 OESDAGULAZQRDM-JTAQYXEDSA-N 444.000 4.103 10 10 IICE COc1cccc(N(C(=O)CC(C)C)C2CCN(Cc3cccc(OC)c3O)CC2)c1 34683452 RVWLKBQVXJKJCK-UHFFFAOYSA-N 426.557 4.453 10 10 IICE Cc1ccc(C(=O)N2CCN(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)cc1 62694529 YXIXLRPIBYFZFE-UHFFFAOYSA-N 433.527 4.182 10 10 IICE COC(=O)c1cccc(-c2ccc(/C=C3/C(=O)N(c4cccc(C(=O)O)c4)N=C3C)o2)c1 100281710 DYAZSYUSRRURMU-DEDYPNTBSA-N 430.416 4.238 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1 734471308 MKOKRJJKRNEFLI-FOCLMDBBSA-N 449.576 4.404 10 10 IICE C[C@H](NC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc2c(c1)OCO2 743521035 OJIKMEPYPJTZLU-GOEBONIOSA-N 433.455 4.046 10 10 IICE CC(=O)N1CCCc2cc(S(=O)(=O)Nc3nc4c(s3)CCc3ccccc3-4)ccc21 748671806 WAKXHHUDHJWIGB-UHFFFAOYSA-N 439.562 4.009 10 10 IICE CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(Cc2ccc(N3CCOCC3)cc2)[C@@H]2CCCC[C@H]12 769231617 BZVOWAQKYACRKZ-MQXBQSNKSA-N 427.633 4.207 10 10 IICE Cc1cc(Br)cc2c(C(=O)NCc3ccc(N4CCOCC4)cc3)coc12 771267288 SBCRORWJCMTMOO-UHFFFAOYSA-N 429.314 4.270 10 10 IICE C[C@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1nc(Br)ccc1F 788694030 UDRZBNFXLIEWTM-INIZCTEOSA-N 447.396 4.366 10 10 IICE CCS(=O)(=O)c1ccc(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 800049769 VUISKDJIOJZRMZ-QGZVFWFLSA-N 449.016 4.229 10 10 IICE COc1ccccc1-c1ncc(CN[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cn1 813772958 WLZMTJYKGLPMKQ-FQEVSTJZSA-N 438.959 4.265 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(C(F)(F)F)ccc3-n3cccn3)CC2)cc1 915334309 ICFPPXSWCJZFHX-UHFFFAOYSA-N 445.445 4.254 10 10 IICE COc1ccc([C@H](C)NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1F 918195405 REKMTYJDRBGHFZ-XHSDSOJGSA-N 433.499 4.147 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C1(c2ccc(I)cc2)CC1 1126004652 IHGDWEARYGFDGX-UHFFFAOYSA-N 434.321 4.014 10 10 IICE COc1cc(N2CCN(C(=O)[C@H]3CCC[C@H]3Cc3ccccc3)CC2)cc(OC)c1OC 1127931918 GQYHZCFKBGAEFF-UNMCSNQZSA-N 438.568 4.020 10 10 IICE Cc1ccc(-n2cnnc2SCC(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1C 1136025297 FNNPEVGIPXCAHU-UHFFFAOYSA-N 435.597 4.235 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1csc(N2CCCCC2)n1 1139585887 XHJOZMOMWZVXES-UHFFFAOYSA-N 444.601 4.136 10 10 IICE Cc1ccc(C(=O)NCc2cccnc2-n2ccnc2C)cc1-n1c(C)cc(C=O)c1C 1142056892 HSEKNYXMRBGIAO-UHFFFAOYSA-N 427.508 4.034 10 10 IICE CCCCCc1cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n[nH]1 1147506317 NATANIKVDGKYCT-NRFANRHFSA-N 443.592 4.204 10 10 IICE COC(=O)C1CC2(C1)C[C@H](Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)CCS2 1164310505 NLOBPXNISLSPAH-WCCYLALTSA-N 440.521 4.455 10 10 IICE COc1ccccc1[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1c(O)ccc2ccccc12 1179033461 XGIVKXMEVXYWKC-QFIPXVFZSA-N 436.508 4.436 10 10 IICE COc1ccc(Cl)cc1CN1CCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 1234556195 QCOXHTBKMNWJKO-KRWDZBQOSA-N 430.980 4.003 10 10 IICE Cc1ccc([C@H]2CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)C2)c(C)c1 1251750506 CPZRMUZUVZCQPU-IBGZPJMESA-N 429.511 4.117 10 10 IICE COc1ccc([C@H](NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)c2ccco2)cc1 1251937178 UQQLQSVJVNBYGR-URXFXBBRSA-N 436.508 4.474 10 10 IICE CCOC(=O)[C@@H]1CSCCN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1264337951 AJPQSYIZJYXBCA-FQEVSTJZSA-N 426.542 4.289 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)N(C)C(=O)OC(C)(C)C 1302848211 XFDNATZSVGZFIC-KRWDZBQOSA-N 431.581 4.074 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H](OC)C(C)(C)C 1305384814 VRWZAITWVSPYSD-SIKLNZKXSA-N 443.636 4.326 10 10 IICE Cc1c(Cl)ccc2c1CN(C(=O)NCc1cc(F)c(N3CCOCC3)c(F)c1)CC2 1312833758 NHVXQBOMTIZSON-UHFFFAOYSA-N 435.902 4.031 10 10 IICE CC(C)(C)OC(=O)CC1(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CCC1 1445883082 MOAZTDOQXQTDRA-SFHVURJKSA-N 436.980 4.028 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cnn(-c2ccccc2Cl)c1C 1446812900 CJXVNBBYUXBOQW-UHFFFAOYSA-N 448.306 4.009 10 10 IICE Cc1cc(C(=O)N[C@H]2CC(=O)N(c3ccccc3F)C2)c(C)n1-c1cccc(Cl)c1 1450259606 PMLBWOXPLWKWMM-KRWDZBQOSA-N 425.891 4.422 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)/C(F)=C\c3ccc(C(F)(F)F)cc3)cc2)C1 1464363652 RPLHWGICMCSSSW-RONKMWSCSA-N 449.448 4.034 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CCc3ccc([N+](=O)[O-])cc3Cl)cc2F)C[C@@H](C)O1 1516816976 OXCOSWDCJXKDOC-HUUCEWRRSA-N 449.910 4.250 10 10 IICE CN(C)c1ccc(CNC(=O)c2cnc(Nc3ccccc3)nc2C(F)(F)F)cc1F 1527014392 ZHJNRAGHXLGKDP-UHFFFAOYSA-N 433.409 4.374 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(c3ccc(Br)cc3)CCC2)N(C)C)cc1 1539236058 OMFIINDSLGRYEQ-NRFANRHFSA-N 444.417 4.356 10 10 IICE CC[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)[C@H]1CN(Cc2ccccc2)CCO1 1543744721 PVLNGIOVPAAYSM-KAYWLYCHSA-N 445.607 4.432 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N(C)CCC2CCOCC2)cc1 1547444055 KSHRRJXMHONYEV-UHFFFAOYSA-N 436.604 4.421 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCO[C@](C)(CC)C2)cc1 1547446921 KQMDEFOELNOSBE-SQJMNOBHSA-N 441.620 4.072 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)C[C@@H]1c1ccccc1 1556914446 DSVBXAKGUCIJPS-DNQXCXABSA-N 432.520 4.132 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)Nc1ccc(Cl)nc1 1559342165 SDMLXYQAVBEACJ-UHFFFAOYSA-N 430.917 4.120 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](c3ccccc3)C3(CO)CCOCC3)c2C)cc1 1570788391 MKMZSCGEERSVBJ-VWLOTQADSA-N 448.563 4.363 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC2(CC(=O)OC(C)(C)C)CCC2)CCCC1 1583541347 FBIWRDWKOASZJF-UHFFFAOYSA-N 426.557 4.299 10 10 IICE CC(C)(C)OC(=O)N[C@H](C[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1)C1CCCC1 1594973805 KWLZOOLAXIZOAE-QFBILLFUSA-N 432.561 4.424 10 10 IICE CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc4cccc(OC)c4c3=O)c2C)cc1 1614589604 XXPTZUKVNWDSLM-UHFFFAOYSA-N 431.492 4.094 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(Cl)c(I)c1 1622664026 DACJVNLAGPWAEW-UHFFFAOYSA-N 441.696 4.459 10 10 IICE CC(C)C[C@@H](C(=O)NCc1cccc(Br)c1O)N(C)C(=O)OC(C)(C)C 1626821772 FKHZJPFBMIDUIU-HNNXBMFYSA-N 429.355 4.053 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)CC12CCC2 1628497947 LJWXUUTZGYCWKN-CQSZACIVSA-N 432.542 4.365 10 10 IICE CC(C)(C)c1ccc(C(F)(F)C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 1629962772 DJWMTRBFKQXIES-UHFFFAOYSA-N 434.502 4.493 10 10 IICE Cc1cc(C(=O)N2C[C@]3(C)CN(C)C[C@@]3(C)C2)c(C)n1-c1cccc(Br)c1 1630892102 CANTWQYJRIJTOG-VXKWHMMOSA-N 430.390 4.270 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCSc1ccc(Cl)cc1 1631530941 BKNJAXQWBKEOPR-UHFFFAOYSA-N 428.337 4.383 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](OCC1CCCC1)c1ccccc1 1632701421 DWBOADHXVLUDCN-QHCPKHFHSA-N 445.943 4.495 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(C)n1-c1ccccc1 1634049868 QVFRYCHEBCALCE-FQRUVTKNSA-N 430.596 4.456 10 10 IICE Cc1cc(C(=O)N2CCC(C(=O)OC(C)C)CC2)c(C)n1-c1ccc(Br)cn1 1638611182 YSSMAERBWPFQBD-UHFFFAOYSA-N 448.361 4.055 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CC[C@H](C)N(C(=O)OC(C)(C)C)C3)ccc21 1642247094 GAUHINQBFFQDFC-JXFKEZNVSA-N 443.588 4.422 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3ccc(N4CCCCCC4)cc3)CC2)cc1 1653840186 DNWKSGQZZURILA-UHFFFAOYSA-N 436.600 4.226 10 10 IICE CC(C)c1ccc(O[C@@H](C)CNC(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cc1 1672572255 QBYAISNPGBUTSQ-YADARESESA-N 426.605 4.245 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCC[C@H]3CC3(O)CCCCC3)C2)cc1 1683340113 PMGCDNVLGZENLU-IRLDBZIGSA-N 429.605 4.171 10 10 IICE COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)Cc3ccc(N(C)C)cc3C)CC2)c1 1686826690 NKECAWLXVFOCCS-KBMIEXCESA-N 439.600 4.156 10 10 IICE Cc1cc(-c2nnc(N3CC[C@@H](C)C3)n2CCSCCCO)c(C)n1-c1ccccc1 1692985036 LNWMEQXYFWPRBF-GOSISDBHSA-N 439.629 4.314 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCOC2)nnc1N1CC[C@H](C)C(C)(C)C1 1707305380 YHEZPEFXQJBFCS-FPOVZHCZSA-N 425.621 4.467 10 10 IICE CCCN1CCCC[C@@H]1Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1728141616 FVSXXPSSBYZAFT-IFMALSPDSA-N 427.593 4.126 10 10 IICE CC(C)c1nnc(N2CC[C@H](C(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1741346917 YOIDYIQWWHYEEL-IBGZPJMESA-N 429.584 4.298 10 10 IICE C[C@@H]1C[C@@H]1n1c([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nnc1N(C)Cc1ccccc1O 1742977509 SYLMBCLJRPHTIU-QRQLOZEOSA-N 441.576 4.316 10 10 IICE CCN(CC)C(=O)COc1cn(CC)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1871082341 IIKBZEVQYWYRAJ-UHFFFAOYSA-N 448.567 4.471 10 10 IICE O=C(Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O)Nc1ccccc1F 1873861597 CPNZPAJCXORCCS-UHFFFAOYSA-N 438.462 4.352 10 10 IICE O=C1c2ccccc2C(=O)c2c1c(C(=O)NCCc1c[nH]c3ccccc13)c1ccccn21 1873941622 TXYDWZNIHBRGOB-UHFFFAOYSA-N 433.467 4.169 10 10 IICE CC[C@@H](NCCC1(OC)CN(C(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2167024547 YFTNLWGSBNWLLL-MRXNPFEDSA-N 443.382 4.221 10 10 IICE CC(C)(C)OC(=O)N1CC[C@](COCc2ccccc2)(C(=O)N[C@H]2CCC[C@H]2N=[N+]=[N-])C1 2218743786 KHHDYAFQCVQOKV-YYDVJCTNSA-N 443.548 4.178 10 10 IICE CCSC1=NSC2=NC(=O)/C(=C\c3ccc(-c4ccc(C(=O)OC)cc4)o3)C(=N)N12 20114677 ZPPKESRGSKXKCN-OIQQPNLJSA-N 440.506 4.063 10 10 IICE CCOc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)ccc1OCCOc1ccccc1 35125935 YVHOPZIRPXJDOR-XLNRJJMWSA-N 444.487 4.005 10 10 IICE CCCC(=O)Nc1ccc(CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 435559974 SJCNADDMHJHPPO-UHFFFAOYSA-N 446.595 4.463 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(N(C)C)cc3)[C@@H]2c2ccc(O)c(O)c2)c1 526365664 CWIPNLOZHVRRBD-HSZRJFAPSA-N 432.476 4.230 10 10 IICE COc1ccc(-c2csc(N3N=C(C)[C@@H](N=Nc4cccc(C(=O)O)c4)C3=O)n2)cc1 575732635 IMWHIQLZTOQPKD-GOSISDBHSA-N 435.465 4.392 10 10 IICE Cc1sc(NS(=O)(=O)c2cccc3c2OCCO3)nc1-c1c(F)cc(F)cc1F 729111069 AEBMTBVFHCUVDM-UHFFFAOYSA-N 442.440 4.108 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)C(=O)c2cnn(C(C)(C)C)c2)cc1 732114863 OPNKFTVVQRLMDE-UHFFFAOYSA-N 434.540 4.129 10 10 IICE Oc1cc(OCc2ccccc2)ccc1CN1CCOC[C@@H]1C[C@H](O)c1cccs1 753548056 AMZIYZLNGHMRMZ-REWPJTCUSA-N 425.550 4.357 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2cccc(F)c2)cs1 761341535 FIAQZRKYHZMWPV-UHFFFAOYSA-N 447.513 4.107 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cc(Br)ccc1Br 797611812 BRCCMIZIVLKILG-SECBINFHSA-N 444.123 4.376 10 10 IICE C[C@@H](NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)c1cnn(C2CCCC2)c1 800476564 LEVAYPXCMNUIES-LJQANCHMSA-N 449.578 4.105 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1ccccc1OCC(F)(F)F 804940313 OWIKCZZREAPXCB-UHFFFAOYSA-N 433.224 4.095 10 10 IICE Cc1cc(CCNC(=O)N[C@H](C)c2ncc(Br)cn2)c(C)n1-c1ccccc1 814441646 MCISMFBGFLXCJG-OAHLLOKOSA-N 442.361 4.250 10 10 IICE CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1137658424 HMHGVDMLBIWMRF-ZEQKJWHPSA-N 435.612 4.282 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnc(-c2cccnc2)s1 1139584157 BLVVQCUQXBMYDD-UHFFFAOYSA-N 438.553 4.207 10 10 IICE C[C@H](Oc1ccc(F)cc1Cl)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348680 QSLCYYSGMNSTAG-GUYCJALGSA-N 441.330 4.386 10 10 IICE CCOC(=O)c1cn(C)nc1NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1160248491 FULSSQBLGDWJPH-UHFFFAOYSA-N 445.317 4.019 10 10 IICE CCOC(=O)c1cnc(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)c(Cl)c1 1184099124 NWFITDATBBSUGU-UHFFFAOYSA-N 425.916 4.292 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(CC(F)(F)F)[C@H](C)C3)cc2Cl)C1 1235836279 ZIMHQERJWKORJM-HZPDHXFCSA-N 446.945 4.354 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC(Cc3ccccc3C(F)(F)F)C2)N(C)C)cc1 1251500213 CVDIELGQERLMLK-QFIPXVFZSA-N 448.533 4.258 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)[C@@H]3C[C@]3(C)c3cccc(Br)c3)C2)cc1 1278861333 IHDWUXZUUFJZPT-RBDMOPTHSA-N 429.358 4.130 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc[nH]2)nnc1N(C)C[C@H](C)c1nccs1 1289424473 VWGWJKGAKNDZLG-KRWDZBQOSA-N 435.601 4.392 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](SC)C(C)(C)C 1306179621 WUYNCFJIWFWENT-FQEVSTJZSA-N 431.650 4.344 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@](C)(Cc3ccc(Cl)cc3)C(C)C)nc12 1307795488 ZUEFDFKTXBQDNQ-JOCHJYFZSA-N 430.936 4.012 10 10 IICE FC(F)[C@H]1CCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1316517284 XAJHNUPZMNTXTC-AWEZNQCLSA-N 436.557 4.461 10 10 IICE O=C(/C=C/c1cncc(F)c1)N(CCc1ccccn1)c1ccc(Br)cn1 1436990645 SFBVZUARRCYRIH-QPJJXVBHSA-N 427.277 4.062 10 10 IICE Cc1c(Br)cnc(O)c1C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1454476603 QCBVOZUAGWDAKX-UHFFFAOYSA-N 428.330 4.238 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@](C)(CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1455935495 XRKWEIBGTUMQHA-VWLOTQADSA-N 447.620 4.357 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@@H](C)O[C@H](C3CC3)C2)sc(C)c1-c1ccccc1 1460038595 LOUFKRMHRNWFGO-BEFAXECRSA-N 442.581 4.338 10 10 IICE COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)NCc2cccc(O)c2O)c1 1471644522 UAPHDBIQUGOFGG-UHFFFAOYSA-N 429.476 4.198 10 10 IICE CCCCN(CC)c1nnc([C@H]2CCC(=O)N2)n1Cc1ccc(N2CCC(C)CC2)cc1 1500438435 NUTJXWSPDTUNCA-JOCHJYFZSA-N 438.620 4.140 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@H](c4cnn(C)c4)C3)nnc2C(C)(C)C)cc1 1501847838 YTLGZTRYDPQUQO-FQEVSTJZSA-N 435.620 4.198 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H](CCC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1529803981 LZDDNCGGEKSPNF-OAQYLSRUSA-N 433.593 4.110 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C(=O)/C=C\c2cnc3ccccc3n2)C1 1535503739 XVHDMADKSNSKFS-MENFKHAKSA-N 444.535 4.373 10 10 IICE CC[C@@]1(C)CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CCO1 1546097808 QAYCDAOMVOPALO-VWLOTQADSA-N 425.621 4.439 10 10 IICE CCN(CCn1c(C2CCC2)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1547589239 XCCBOLRPNVUHAU-UHFFFAOYSA-N 429.565 4.145 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(COC)CC1 1555489343 CAHONXTVWCGDNL-UHFFFAOYSA-N 437.588 4.252 10 10 IICE C[C@H](NC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)cc1Cl 1564674386 ZNRRXELWGMPFFK-AWEZNQCLSA-N 449.382 4.256 10 10 IICE Cc1nc(C)c(C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)s1 1618361941 DAWXBUPOQOIUSQ-UHFFFAOYSA-N 428.315 4.484 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1ccc(Oc2ccc(C)cn2)cc1 1623929519 ZOJLJLIBIOJKFH-UHFFFAOYSA-N 440.883 4.357 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)C1 1625239279 XJHDKJDYHBOULP-UHFFFAOYSA-N 432.542 4.176 10 10 IICE CCO[C@@H](C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1)c1ccccc1 1629678639 FGOVHGBROGAHRB-FCHUYYIVSA-N 441.572 4.212 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Cl)cc3NCC(F)(F)F)CC2)cc1 1630082006 RPGIJQUCQADKEC-UHFFFAOYSA-N 427.854 4.285 10 10 IICE Cc1cc(F)c2nc(O)cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@H]3CCCO3)c2c1 1631608337 TYHKNWLDLLCMOF-LJQANCHMSA-N 437.515 4.275 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3[C@@H](CNC(=O)OC(C)(C)C)C3(F)F)c2C)c1 1631793857 JKPJZQRFDSSTAP-WOJBJXKFSA-N 447.526 4.425 10 10 IICE COC(=O)c1cn([C@H]2CCCN(C(=O)c3cc(C)n(-c4ccc(C(C)C)cc4)c3C)C2)nn1 1632338266 LMLPIIINJPJPKP-NRFANRHFSA-N 449.555 4.073 10 10 IICE CCc1cccc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1O 1634162589 MMHRXAXSNFUSHO-HXUWFJFHSA-N 427.545 4.016 10 10 IICE Cc1cc(C(=O)N[C@@H]2COc3ccccc3C2=O)c(C)n1-c1cccc(Br)c1 1636365762 UKTAOZKILJECFD-LJQANCHMSA-N 439.309 4.230 10 10 IICE Cc1ccc(N2C(=O)C(=O)N(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2=O)c(C)c1 1640842054 OJNPOZOPUQODKR-UHFFFAOYSA-N 443.503 4.198 10 10 IICE COc1ccc(Cl)cc1N1C[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)CC1=O 1643394176 BFWBHVMFDJFRMF-GOSISDBHSA-N 441.959 4.008 10 10 IICE CCN(C)c1ccc(CN(Cc2ccccc2)CC2(O)CN(C(=O)OC(C)(C)C)C2)cc1 1644359658 FTRVSNSDIWQIPS-UHFFFAOYSA-N 439.600 4.127 10 10 IICE CC(C)CN(Cc1ccccn1)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1655659146 VOOVOAWMSNDANP-GOSISDBHSA-N 441.531 4.342 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(Cc3ccccc3)CC3(O)CCCC3)C2)cc1 1682187986 CKHYPEUWHLPLBB-JOCHJYFZSA-N 437.584 4.038 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(Cl)c(C(F)(F)F)c3)C2)cc1 1682646130 NZHWIULMOWBEDQ-AWEZNQCLSA-N 427.854 4.446 10 10 IICE Cc1cccc(CN(Cc2ccco2)C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1 1682986976 TZYTZJPLWAYJPB-UHFFFAOYSA-N 433.552 4.461 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@@H]1CN(C)C(=O)OC(C)(C)C 1683426071 USYXYZXNAROLTM-SIKLNZKXSA-N 446.636 4.423 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c2C)c1 1684599790 KFPUKHDZLUBDEZ-QGZVFWFLSA-N 428.577 4.457 10 10 IICE CC(C)c1nnc(N2CC[C@](O)(c3ccccc3F)C2)n1CCCSc1nccs1 1691796029 BVCITNZUWFCAAD-OAQYLSRUSA-N 447.605 4.277 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@H](C)CC[C@@H]2C)n1Cc1ccc2c(c1)CCCN2C 1712515676 CUUZBXJKGZFPPH-HSALFYBXSA-N 441.620 4.058 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1723358402 QXQRBRLEWBWETL-VQTJNVASSA-N 429.584 4.298 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1726461025 SDIBCTIBDXFTGF-KDURUIRLSA-N 443.611 4.373 10 10 IICE CCCNC(=O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](CC)C1 1728199580 VSNCAKFIXZXAHS-FQEVSTJZSA-N 434.588 4.115 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)[C@@H](C)C1 1729229658 CWEFWIWMAGXCMX-UWGAKSRVSA-N 439.629 4.213 10 10 IICE CCCn1c([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nnc1N(C)Cc1ccccc1O 1772878189 SURWNZVWMDHWES-SFHVURJKSA-N 429.565 4.145 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)/C(=C\c3ccc(O)c(OC)c3)SC2=S)c1 1860085339 FLIYWXUOQUWDSD-LZYBPNLTSA-N 435.910 4.247 10 10 IICE CC(C)N1C(=O)C(=Cc2cccc(OCC(=O)Nc3ccc(F)cc3)c2)SC1=S 2042453589 RTJGAAKITVPVHN-UHFFFAOYSA-N 430.526 4.453 10 10 IICE Cc1cc(O)c([C@@H](C(C)C)n2nc(C(F)(F)F)c(C(N)=O)c2Br)cc1C 2080033758 LWFCUQUSVRWZSK-CYBMUJFWSA-N 434.256 4.331 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2CCC[C@@](NCc3c(O)cccc3Br)(C2)C1 2138716998 FJGAOYAUPYRDPN-VBKZILBWSA-N 425.367 4.424 10 10 IICE COc1cc(N2CCCC2)c(OC)cc1C=C1NC(=O)N(c2cccc(Cl)c2)C1=O 2293308529 FCLMQVQZZHAGMW-UHFFFAOYSA-N 427.888 4.055 10 10 IICE Cc1ccc(Cn2cc(C=C3C(=O)NC(=O)N(Cc4ccco4)C3=O)c3ccccc32)cc1 2296398075 RNWXCIQTMCGKKR-UHFFFAOYSA-N 439.471 4.253 10 10 IICE Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(O)c(Cl)c3)C2=O)cc1Cl 2296926500 PIDIMKIDGYLAFM-UHFFFAOYSA-N 425.655 4.327 10 10 IICE O=C(O)Cc1ccc(N2C(=O)C(=CC=Cc3ccccc3[N+](=O)[O-])SC2=S)cc1 2314532562 LDNBFRAXPKPXKD-UHFFFAOYSA-N 426.475 4.184 10 10 IICE Cc1ccc(CNC[C@H]2CN(C(=O)OC(C)(C)C)CC23CC3)c(O)c1Br 2352676379 OUXRMZASXPDVTF-HNNXBMFYSA-N 425.367 4.200 10 10 IICE Cn1c(CCc2cccc(NS(=O)(=O)c3cccc4nsnc34)c2)nc2ccccc21 21357320 UMQUIEXTOYPALR-UHFFFAOYSA-N 449.561 4.164 10 10 IICE COc1cc(/C=C2\SC(=S)N(CNc3ccccc3F)C2=O)cc(OC)c1OC 102867180 DNPXIKNSEXGWRZ-YVLHZVERSA-N 434.514 4.122 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(-c3cc(O)n[nH]3)cc2)C1 444752660 KBXSXBLHAIWFOT-UHFFFAOYSA-N 429.524 4.142 10 10 IICE CCOc1ccc(-c2csc(NS(=O)(=O)c3c(C)oc(C)c3C(=O)OC)n2)cc1 727248921 NEDAHVUELAHXMK-UHFFFAOYSA-N 436.511 4.006 10 10 IICE Cc1nc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(-c2ccccc2)o1 759160922 MFVIDSYJKFSZHY-UHFFFAOYSA-N 430.552 4.112 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(C)[C@H]3c3ccc(Cl)cc3)CC2)cc1 760368196 DJNMHCGILOZRIY-GOTSBHOMSA-N 442.991 4.062 10 10 IICE Cc1cc(C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 763774207 UHHKZJYAKKMEHS-PZJWPPBQSA-N 428.916 4.305 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@@]4(CCO[C@@H](C)C4)C3)n2C)c(C)n1-c1ccccc1 800747816 RASNTDMMKGLMQK-XHNVNVPESA-N 435.572 4.052 10 10 IICE C[C@H](OC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O)c1nnc(-c2ccccc2)o1 913224453 XGAYGBRIZPDPCR-ZDUSSCGKSA-N 439.427 4.012 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)cc1 1130744667 DUUHQZFJXCSOJY-UHFFFAOYSA-N 438.549 4.403 10 10 IICE COC(=O)[C@@H](F)CNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 1133717193 IXFUUJDJKBLGQQ-JIHAQRTOSA-N 447.510 4.029 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cccc(NC(=O)OC(C)(C)C)c2)N(C)C)cc1 1134681741 FMIAKIKJVDVWCF-JOCHJYFZSA-N 440.588 4.061 10 10 IICE CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1134881691 DOESURHSZYEFSU-SQJMNOBHSA-N 448.652 4.049 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(-c2cccc(C)c2)c1C 1139585568 SCZKLNTVNNSKQY-UHFFFAOYSA-N 448.567 4.491 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cnn(-c2ccc(C(F)(F)F)cc2)c1 1141803061 DUPAYJTVHGJCPO-UHFFFAOYSA-N 446.498 4.374 10 10 IICE CCC[C@@](C)(NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1198632883 MXQJNZVEWHDATB-BVFVYWQFSA-N 441.591 4.361 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)cc2Cl)C1 1270438828 CNTUUBJRKDEUBR-MRXNPFEDSA-N 435.996 4.450 10 10 IICE O=C(c1cc2ccc(C(F)(F)F)cc2nc1O)N(Cc1ccccc1O)C[C@H]1CCCO1 1295404983 CWEALXMGLSHXIM-QGZVFWFLSA-N 446.425 4.486 10 10 IICE COc1cc(I)ccc1NC(=O)c1cc2cc(O)c(O)cc2s1 1298433354 JMNGMMHBAPJSSC-UHFFFAOYSA-N 441.246 4.178 10 10 IICE O=C(CSc1ccccc1C(=O)NCc1ccc(O)cc1O)NC1CCCCCCC1 1299569649 FIHGBQIOKXGNOP-UHFFFAOYSA-N 442.581 4.349 10 10 IICE CNC(=O)CC1(CNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CCCCC1 1313054850 TZOLUAMENMJVQF-UHFFFAOYSA-N 440.588 4.144 10 10 IICE Cc1nc2cc(F)cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2nc1C 1445889268 XZAWSYBXDYGCLS-SFHVURJKSA-N 442.922 4.139 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCCNC(=O)/C=C/c3ccccc3)c2C)cc1 1448193351 GUWLVYRMLOJFTE-XNTDXEJSSA-N 431.536 4.052 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2nn(C)c(C(F)(F)F)c2Br)cc1 1463773347 BBFPUKIYCYJZSK-UHFFFAOYSA-N 447.299 4.320 10 10 IICE Cc1c(C(=O)NCc2ccc3c(c2)CCCN3C)c(=O)oc2ccc(Br)cc12 1464510991 IELGTJDEURFYJF-UHFFFAOYSA-N 441.325 4.176 10 10 IICE Cc1cc(C(=O)NC[C@H](C)N2CCC(C)CC2)c(C)n1-c1ccc(Br)cn1 1464555785 XDURLVFPMGVLMX-INIZCTEOSA-N 433.394 4.102 10 10 IICE COC(=O)[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C[C@H]1c1ccc(Cl)cc1 1478471105 NRJRADKVZDIOHQ-ONGXBYRLSA-N 429.948 4.065 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](OCC3CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1495597154 GRUKDGDMYLWTQV-YLJYHZDGSA-N 429.584 4.440 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCN(CC(F)(F)F)CC1 1500880839 WRANBXRRPGAFTG-UHFFFAOYSA-N 446.521 4.447 10 10 IICE CC[C@H]1CCCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1514050347 NULOFVNQBPDDRU-FQEVSTJZSA-N 425.621 4.285 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 1528924698 QNFSTZUMWJWMDH-AUSIDOKSSA-N 439.600 4.417 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](C)SCc1nc(O)c2ccccc2n1 1529277963 LGRQVXYVLLYQTA-IRXDYDNUSA-N 438.597 4.079 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1cccc(F)c1F 1534102775 LCZCNEPCYQXHCU-GDNBJRDFSA-N 438.546 4.324 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(F)(F)c2cccc(Br)c2)N(C)C)cc1 1537483580 OXQANWMQJYWPDI-SFHVURJKSA-N 440.332 4.026 10 10 IICE C[C@]1(c2ccccc2)C[C@@H]1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1539522158 UTARUZSRNHJJKL-JYPQMMOESA-N 440.565 4.263 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)/C(F)=C/c1ccc(F)c(C(F)(F)F)c1 1542302216 MEORKBSHGZVGLE-UNOMPAQXSA-N 426.385 4.308 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(Cl)cc(Br)c1 1557115813 WRGXOWJQDSONFC-UHFFFAOYSA-N 426.694 4.014 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)CC2=CCCOC2)sc(C)c1-c1ccccc1 1559981094 FDCWEQQYDHKYLD-UHFFFAOYSA-N 428.554 4.117 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1OC1CCCCC1 1566023442 UWGIZCLTMDGFEL-UHFFFAOYSA-N 426.532 4.428 10 10 IICE CNS(=O)(=O)Nc1ccc(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)cc1 1618204325 AMOPWDZWYIYEFL-UHFFFAOYSA-N 440.569 4.346 10 10 IICE Cc1ccc(C(=O)N[C@H](CC(N)=O)c2ccccc2Cl)cc1-n1c(C)cc(C=O)c1C 1621282383 JRDXWENLZUYZSH-OAQYLSRUSA-N 437.927 4.215 10 10 IICE O=C(NC[C@@H]1CCN(c2cccc(Br)c2)C1)c1cc2cc(O)c(O)cc2s1 1626614484 KFFVJZZAXIHPNO-LBPRGKRZSA-N 447.354 4.331 10 10 IICE COCCCOc1cccc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1C 1626654155 BZQHNGCHDZVAGK-UHFFFAOYSA-N 437.584 4.195 10 10 IICE COc1ccc([C@@H](CNC(=O)c2cc3cc(O)c(O)cc3s2)N2CCCCC2)cc1 1628503674 RQQIDJWQGWJLHJ-GOSISDBHSA-N 426.538 4.278 10 10 IICE O=C(c1cnn2cccc(Br)c12)N(Cc1ccco1)Cc1ccccc1O 1631142947 AVNCZRCSRMNYSS-UHFFFAOYSA-N 426.270 4.238 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H]2N(C(=O)OCc3ccccc3)CC2(C)C)cc1F 1633263429 IJITZHIZMWKFSX-JOCHJYFZSA-N 441.547 4.335 10 10 IICE C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1635992303 CALBDSWDEDRZPO-MAUKXSAKSA-N 433.474 4.028 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@@H](Cc3ccccc3)[C@H](O)C(F)(F)F)c2C)cc1 1636710741 SGHOMOMPQUCYJA-VXKWHMMOSA-N 446.469 4.367 10 10 IICE O=C(/C=C/c1ccc(I)o1)NCc1cc(Cl)cc(Cl)c1O 1637134481 NRCCIITWEGKJBO-DUXPYHPUSA-N 438.048 4.226 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](CC(=O)O[C@@H]2CCOC2)CC(C)C)cc1 1640201498 ABFRWNVZUOKDMD-NZQKXSOJSA-N 426.557 4.208 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[S@](=O)C(C)(C)CC3)cc2Cl)C1 1681828339 SMSNQMOHTJVABA-HJWYETAXSA-N 426.026 4.019 10 10 IICE O=C(NCCc1sccc1Br)NCc1cccc(Br)c1O 1687441452 NFEGQNMXCJISCH-UHFFFAOYSA-N 434.153 4.021 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1707964509 DGASJKBBOSTHCK-BGYRXZFFSA-N 425.621 4.234 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)(C)C)n3CCCCSC)CC2)cc1 1711865023 FSFSLBUIPLIISK-UHFFFAOYSA-N 431.650 4.444 10 10 IICE CC(C)c1nnc(N2CCN(Cc3ccsc3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1723192016 ZACVYIZOIQNTEY-UHFFFAOYSA-N 442.608 4.039 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@H]1CCO[C@H](C)C1 1763747508 GXXRYURNCYQGEV-OTWHNJEPSA-N 445.583 4.081 10 10 IICE CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCN(C(C)=O)C1 1766039450 BMPBVYXUAMVMLN-OAQYLSRUSA-N 434.588 4.067 10 10 IICE CN(C)c1ccc(Cn2c(-c3cnn(C)c3)nnc2N2CC=C(C(C)(C)C)CC2)cc1F 1766909675 LUINTCXDKIDUEH-UHFFFAOYSA-N 437.567 4.115 10 10 IICE COc1ccc([C@H](CN2C(=O)/C(=C\c3ccc(N(C)C)cc3)SC2=S)N(C)C)cc1 1858594153 NFVZGIWLHBONSY-LQOIVRHRSA-N 441.622 4.265 10 10 IICE CCCCCCNC(=O)Cn1c2c(c3ccccc31)CCn1c-2nc2ccccc2c1=O 1860343659 MBAGCKGKBDHSTP-UHFFFAOYSA-N 428.536 4.271 10 10 IICE NCc1ccc(N2CCN(Cc3ccccc3)C[C@H]2C(F)(F)F)c(Br)c1 2130167562 GGJJFVAADJFAGP-SFHVURJKSA-N 428.296 4.161 10 10 IICE Oc1cccc(Br)c1CN[C@H]1CN(Cc2ccccc2)[C@@]2(CCCOC2)C1 2156287993 KDXZOCILBSBFOD-GCJKJVERSA-N 431.374 4.068 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)c1O 2236054492 IWTNURINJQXCAF-ZSOGYDGISA-N 441.366 4.183 10 10 IICE CC(C)(C)OC(=O)N[C@H]1[C@H]2C[C@@H](CN(c3ccc(OCc4ccccc4)cc3)C2)[C@H]1CO 2314466856 MJGDTIYRNXXENL-JVODISISSA-N 438.568 4.224 10 10 IICE Cc1cccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)SC2=S)c1 2314836136 AMHASEITIXXMAK-CYBMUJFWSA-N 427.507 4.132 10 10 IICE Cc1ccc(CNC2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352672080 PUFTZORIUMBMSK-GJZGRUSLSA-N 425.367 4.198 10 10 IICE COc1cc(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)cc(Cl)c1OC 108898698 MJTCTFGEMCDOPV-UHFFFAOYSA-N 429.948 4.142 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(CN2CCCC2)c1 726566772 DIJFPHDGVKZZJP-UHFFFAOYSA-N 429.511 4.283 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)CN2CCC(NC(=O)c3ccoc3C)CC2)c1C 727436665 FULGESAGMVNFRH-UHFFFAOYSA-N 433.552 4.381 10 10 IICE O=C(Cn1c(-c2cscn2)nc2ccccc21)N(Cc1ccccc1O)C[C@@H]1CCCO1 751294871 RNMXZHPCTVZFLI-SFHVURJKSA-N 448.548 4.073 10 10 IICE O=C(O)c1cccc(N2C(=O)/C(=C/c3cnc(-c4ccncc4)s3)SC2=S)c1 753135347 OQYLVGKOXWRSLS-DHDCSXOGSA-N 425.516 4.309 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2CCC(O)(c3ccccc3)CC2)C1 766892953 UKYHRHGIOLTKQW-UHFFFAOYSA-N 445.607 4.354 10 10 IICE Cc1nc([C@@H]2CCCOC2)sc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 794238827 NJEACDLODXEQQK-RLFYNMQTSA-N 447.576 4.028 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2COC(=O)N2CCCC2)c(C)n1-c1ccc(F)cc1 1140284274 BVLHHBKSGLKQGJ-OAQYLSRUSA-N 427.520 4.460 10 10 IICE C[C@@H](Oc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cn1)c1ccccc1 1158716694 HEYAPNGDORNQEV-DVECYGJZSA-N 432.568 4.320 10 10 IICE Cc1cc(C(=O)N2NC(=O)C[C@@H]2c2ccccc2)c(C)n1-c1ccc(Br)cc1 1160290692 KPWPVONSBYTVAC-HXUWFJFHSA-N 438.325 4.475 10 10 IICE C[C@@H](N[C@H](C)c1c(F)cccc1F)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1176323223 SPBYCXXCASTAJN-ZIAGYGMSSA-N 434.442 4.418 10 10 IICE COc1cn(C)nc1[C@@H](C)NC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1178929909 WRXGQKATDIDALY-CYBMUJFWSA-N 431.334 4.090 10 10 IICE COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1F 1192625991 HTEJFEUNFFFDHZ-GJZGRUSLSA-N 446.478 4.288 10 10 IICE CC(C)c1csc(Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)n1 1287168096 FGQVPCRJEMNPNJ-UHFFFAOYSA-N 434.569 4.234 10 10 IICE Cc1cc(-c2nnc(N3CCC[C@@H](CC(N)=O)C3)n2CCC(C)C)c(C)n1-c1ccccc1 1289359037 HXKQPQWYMZECNZ-NRFANRHFSA-N 448.615 4.491 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)c2cc3cc(Br)cnc3n2C)cc1 1290323942 IRHAQZMITZOGFB-UHFFFAOYSA-N 429.362 4.454 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC[C@@H](NC(=O)C(C)C)C2)cc1 1295411476 UCUAJCDKEIBMCA-OAQYLSRUSA-N 440.636 4.037 10 10 IICE Cc1cc(C(=O)NCC2(c3ccccn3)CC2)c(C)n1-c1ccc(Br)cn1 1295580941 SZADKOLCQWGTSU-UHFFFAOYSA-N 425.330 4.108 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1n[nH]cc1[N+](=O)[O-] 1306453271 VHPLBFURCNYTLW-HNNXBMFYSA-N 433.390 4.243 10 10 IICE Cc1cc(C(=O)CSc2nnnn2Cc2ccco2)c(C)n1-c1ccc(F)c(Cl)c1 1307283860 AIKYFGMBOYHTBP-UHFFFAOYSA-N 445.907 4.489 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc(C)c1Cl 1350933513 OHPCMFVGUHZORB-CALCHBBNSA-N 434.939 4.405 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C/c3ccc(C(C)(C)C)cc3)CC2)cc1 1351470218 KAQSWUKRZWTYGX-OVCLIPMQSA-N 435.612 4.334 10 10 IICE Cc1cc(Br)c(N)c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 1442196544 WCLRJYLCBJLSRQ-UHFFFAOYSA-N 443.389 4.124 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(F)(F)c3ccccc3Br)CC2)cc1 1446416584 CSGXNMGAYVUGGC-UHFFFAOYSA-N 439.300 4.288 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@@H](c2ccccc2)C2(CO)CCC2)cc1 1452440113 OTTHPUGSBFQADS-SANMLTNESA-N 430.548 4.469 10 10 IICE Cc1cc(C)cc(CSCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)c1 1458982873 BAWXMUHSFPCQNM-UHFFFAOYSA-N 442.606 4.474 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)n(C2CCOCC2)n1 1459576992 JVQXMWHDMOSHEJ-INIZCTEOSA-N 430.980 4.363 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)CN(C)CCc2ccccc2)cc1 1465013745 VSGDSEWCWPVODD-UHFFFAOYSA-N 431.580 4.469 10 10 IICE COC(=O)Cc1ccccc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1465730930 ODRPAFCYBJPPKH-UHFFFAOYSA-N 442.313 4.219 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)cc1 1466932557 XVILKNUDMNKTKP-KNQAVFIVSA-N 436.474 4.049 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2ccc(OCCN(C)C)c(C)c2)CCCC1 1468847704 FCIOBLWAEWGAPS-UHFFFAOYSA-N 435.568 4.416 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCN(c4ccc(Cl)cc4Cl)C3)C2)cc1 1470026522 PTHYDRCEZKBCGA-SJORKVTESA-N 449.382 4.159 10 10 IICE Cc1c(Br)cccc1C[C@H](CO)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1478471266 SAIMZIGELKTGCR-IRXDYDNUSA-N 448.405 4.035 10 10 IICE Cc1cccc(-c2nnc(N3CCC(OC(C)C)CC3)n2Cc2ccc(N(C)C)cc2C)n1 1492510776 CLDIDZRTWAODHU-UHFFFAOYSA-N 448.615 4.465 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N(C)CC(F)(F)F)cc1 1501841190 ZOBHGSZAJQFOSA-QGZVFWFLSA-N 425.499 4.065 10 10 IICE CSc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1531501813 CEEDEDDRXXLLRD-CYBMUJFWSA-N 437.468 4.317 10 10 IICE Cc1nc(SCC(C)C)sc1CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1539707905 VEQJGSNLMHSOJK-IBGZPJMESA-N 434.675 4.227 10 10 IICE CC(C)(C)[C@H]1CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CCO1 1541167590 IWRYPPPPLJVRAJ-QGZVFWFLSA-N 444.630 4.230 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cn3cc(C=O)c(-c4ccccc4)n3)c2C)c1 1557888197 PQIVWZPFNCGCLA-UHFFFAOYSA-N 426.520 4.395 10 10 IICE COc1ccccc1-c1ccc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)s1 1584515231 LPAMQSJIFCGUHI-UHFFFAOYSA-N 444.503 4.469 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc(NC(=O)CN3CCCCCCC3)cc2)cc1 1584631619 YVVDZLJNHATBGN-UHFFFAOYSA-N 436.516 4.306 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)c1C 1585112685 YOMYZQFKNYTJHV-HSZRJFAPSA-N 436.625 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1615382266 RPPMSVOAKYMPJE-FQEVSTJZSA-N 448.615 4.162 10 10 IICE C[C@H]1Cc2cc(NC(=O)CCN3C(=O)/C(=C\c4ccc(F)cc4)SC3=S)ccc2O1 1616190226 KUDHPAQULXSHIP-MDBUFAAASA-N 442.537 4.379 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)cc2)CC1 1616251589 HARWGUOFVLRYBZ-UHFFFAOYSA-N 444.579 4.001 10 10 IICE CN(c1ccc(CNC(=O)[C@@H]2CCO[C@@H]2CNC(=O)OC(C)(C)C)cc1)C1CCCCC1 1625904865 DEZDQJNHZCGJIA-FGZHOGPDSA-N 445.604 4.002 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H](F)[C@H]3CCN(C(=O)OC(C)(C)C)C3)cc2)CC1 1627467753 QAASNZUVWPTVGM-PZJWPPBQSA-N 433.568 4.134 10 10 IICE CC(C)(COCc1ccccc1)C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630262831 PZRZEJGAHTZQSK-NRFANRHFSA-N 430.976 4.369 10 10 IICE CC[C@@H](C(=O)NCc1ccc(N2CCCCC2)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1630698274 QPYFIZBFWWSPOV-NRFANRHFSA-N 438.963 4.251 10 10 IICE C[C@H](CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C(=O)c1cccc(F)c1 1631425752 NJHQNTIWNLZDSJ-QRWLVFNGSA-N 432.923 4.174 10 10 IICE CN1CCN([C@H]2CC[C@@H](NC(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)CC2)CC1 1633562620 OMLIWQXUNYLAJT-UHGJSFDGSA-N 448.615 4.456 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3cc(Cl)ccc3Cl)CC2)cc1F 1635890612 OGZMAFCAORENKH-UHFFFAOYSA-N 427.303 4.259 10 10 IICE Cc1cc(COc2ccc(C(=O)NCc3c(O)cccc3F)cc2Br)on1 1652295993 ZAWKKWCWCPOHAP-UHFFFAOYSA-N 435.249 4.099 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Cn3nc(-c4ccccc4[N+](=O)[O-])oc3=O)c2C)c1 1652821760 CDKOBMBLIRHXKI-UHFFFAOYSA-N 446.463 4.319 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(CO)CCc4ccccc43)cc2Cl)C1 1680561284 BBRNLHBMUQIBSB-BVZFJXPGSA-N 442.003 4.252 10 10 IICE CN(Cc1cc(Br)cs1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1684608068 ZTJQZOSTSBJPTP-GOSISDBHSA-N 439.423 4.021 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)N3CCC[C@H]3CCCc3ccccc3)cc2)CC1 1685243783 BDBVYWKSJIKMOF-RUZDIDTESA-N 448.611 4.085 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3C[C@@H](C(F)(F)F)O[C@H](C)C3)cc2Cl)C1 1686269462 PYYFWBIUFMGNHN-LBTNJELSSA-N 433.902 4.438 10 10 IICE C[C@@]1(Cc2ccccc2F)CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686725772 VZNRIYCCMRQYFY-DEOSSOPVSA-N 447.501 4.247 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCC(C)(c4cccc(Cl)c4)CC3)cc2)CC1 1687441273 HWLAGVFUPKMHLF-UHFFFAOYSA-N 441.019 4.355 10 10 IICE CN(C)c1ccc(Cn2c(CC3CCCC3)nnc2N(C)CCc2nccs2)cc1F 1696609784 FHDCLVNGVZLOSM-UHFFFAOYSA-N 442.608 4.400 10 10 IICE CC(C)[C@@H]1CN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)CCO1 1706346186 WMUVMAPNVYAXHC-SFHVURJKSA-N 429.615 4.445 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CC2)n1CCc1nc(C(F)(F)F)cs1 1729420244 KOTYVUFETJJOSP-UHFFFAOYSA-N 437.491 4.291 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CC4)n3CC(C)(C)C(F)(F)F)CC2)cc1 1730181326 IYGROIIMTVDEQN-UHFFFAOYSA-N 437.510 4.469 10 10 IICE Cc1cc(-c2nnc(Nc3ccn(C)n3)n2C[C@@](C)(O)C(C)C)c(C)n1-c1ccccc1 1742120254 SZRLVYHWLVQARM-XMMPIXPASA-N 433.560 4.237 10 10 IICE CC[C@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)CCO1 1763459188 BHDUYZIJRGBMAI-QFIPXVFZSA-N 425.621 4.475 10 10 IICE CCO[C@]1(c2nnc(N3CC[C@H](C)[C@@H]3C)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1765869138 KAXMEVVTLGWWNV-ZYLNGJIFSA-N 441.620 4.059 10 10 IICE CSCCCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1771482902 XKPRTTUZCUZARW-UHFFFAOYSA-N 431.650 4.093 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3CC(=O)Nc3ccccc3C)CC2)cc1 1873831431 LGKFQAVBEHNWLW-UHFFFAOYSA-N 443.547 4.147 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](F)[C@@H](NCc1ccc(Br)cc1O)C2 1878876072 ZAPHLZQKQDAQHM-JKQORVJESA-N 429.330 4.123 10 10 IICE O=C(O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)c1cc([N+](=O)[O-])ccc1O 1951368713 SEQMYHHHJNWZQO-OAQYLSRUSA-N 448.431 4.355 10 10 IICE CC(C)(C)OC(=O)NCCC(CCNC(=O)OC(C)(C)C)N[C@H]1CCc2cccc(O)c21 2084886538 SHVFXNQJNJBMMU-SFHVURJKSA-N 449.592 4.167 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNCc1cc(Br)cc(F)c1O)c1ccco1 2116245703 GOQOZVVQZKHJEW-CQSZACIVSA-N 429.286 4.242 10 10 IICE COCCNCc1ccc(N(C)[C@H]2CC[C@@H]2OCc2ccccc2)c(Br)c1 2156439604 XNIGBJLNVXXOKK-VXKWHMMOSA-N 433.390 4.369 10 10 IICE Cc1cc(Br)c(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccccc34)C2=O)cc1C 2313549054 MBGACICPFJDKHH-UHFFFAOYSA-N 438.281 4.214 10 10 IICE CCN(CC)CN1C(=O)C(=C2SC(=S)N(c3ccc(F)cc3)C2=O)c2ccccc21 2313621572 URKWZVBALHTDTR-UHFFFAOYSA-N 441.553 4.248 10 10 IICE Cc1ccc(CNC(=O)C[C@H](C)CCNC(=O)OC(C)(C)C)c(O)c1Br 2352644028 VSYGBQRKLDWFQF-GFCCVEGCSA-N 429.355 4.020 10 10 IICE COc1ccc([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)c1 2505594 HBWFYRSPPHDDAH-JOCHJYFZSA-N 433.460 4.455 10 10 IICE CC(=O)N1CC[C@@H](NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c2ccccc21 436037306 ZFIDNPWTKWZHDO-HSZRJFAPSA-N 444.579 4.022 10 10 IICE C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1CNCc1cc(Cl)cc(Br)c1O 723791547 DFASBHUPOPSYJJ-DGCLKSJQSA-N 433.774 4.401 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3ccc(N(C)C(C)=O)cc3)n2)c1C 743046175 DFTSSJBALDQPHT-UHFFFAOYSA-N 446.598 4.422 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)N[C@H](C)c1cc(OC)ccc1OC 745340359 XIJDCRCTJYBPBT-CYBMUJFWSA-N 437.334 4.465 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)c(Cl)c3)cs2)cc1 747849704 NFKSVLCNMUITGF-UHFFFAOYSA-N 438.914 4.060 10 10 IICE Cc1noc([C@H](OC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c2ccccc2)n1 766805592 RZOAGKMTKGFBKZ-RUZDIDTESA-N 444.535 4.432 10 10 IICE COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)c1 769540311 LFYHEZYKDVCIMD-JHVJFLLYSA-N 442.943 4.144 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(C(=O)NCc3ccc(C)c(F)c3)CC2)c1 781897701 SKFFHXPSVHEPPV-UHFFFAOYSA-N 449.364 4.439 10 10 IICE CC(C)[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(F)(F)F 787703904 FMBBJIWDNNNANG-TZIYXEQSSA-N 436.546 4.433 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2cc(Cl)c(O)c(Cl)c2)c(F)cc1Cl 795345296 OECPNRFJYGVUMD-UHFFFAOYSA-N 428.652 4.079 10 10 IICE CCOC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@@H]2CCCO2)C1 802695086 QNIUWUKBLRHXNL-GGAORHGYSA-N 449.599 4.394 10 10 IICE Cc1nn(C)c(C)c1[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1O)C(F)(F)F 806388024 MMOIPAVREHUZJA-CQSZACIVSA-N 425.238 4.152 10 10 IICE COc1ccccc1-c1ncc(CNCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cn1 813770250 PINPBKDUNCFDFY-ROUUACIJSA-N 436.531 4.195 10 10 IICE CCN(C(=O)/C=C/c1cc2cnn(C(C)C)c2[nH]c1=O)c1ccc(Br)cc1 914758348 KHXQKCPHYBGNOI-BJMVGYQFSA-N 429.318 4.134 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCSc3ccc(Br)cc3)C2)cc1 1130826822 KLLLVCLDDOKKCT-INIZCTEOSA-N 435.387 4.335 10 10 IICE O=C(NC[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1)Nc1cccc(F)c1 1142990829 CQJBHKJZVHBEJO-ZDUSSCGKSA-N 443.500 4.126 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(C(=O)Nc2ccccc2O)CC1 1153494966 PINIVZCKHJHJGN-UHFFFAOYSA-N 445.519 4.103 10 10 IICE Cc1cc(C(=O)N2CCC[C@]3(CCS(=O)(=O)C3)C2)c(C)n1-c1cccc(C(C)C)c1 1158229826 HUGNMWPDKXLGSV-DEOSSOPVSA-N 428.598 4.258 10 10 IICE O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1Cc1ccc(N2CCOCC2)cc1 1167749568 HONMROHEIWDAGD-NRFANRHFSA-N 434.367 4.433 10 10 IICE COc1ccc(N2CCN(CC[S@](=O)c3cc(Cl)ccc3Cl)CC2)cc1F 1168067789 KVQSPGDMUIHRMO-MHZLTWQESA-N 431.360 4.071 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](C)N[C@@H](C)c2ccccc2O)sc2c1CC[C@@H](C)C2 1175419250 UJTKOMOQWSCXNV-QLFBSQMISA-N 430.570 4.433 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3cc(F)cc(F)c3)C2=O)c(C)n1-c1ccccc1 1188987832 GOQGVRHLFIUBGK-XMMPIXPASA-N 437.446 4.022 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C3)cc2)CC1 1190760885 MASOCRBUSRDHLS-NRFANRHFSA-N 431.621 4.381 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N1[C@H]2CC[C@H]1CC(CC(F)(F)F)C2 1229780187 FSXFVZLDGTXHNY-HOTGVXAUSA-N 447.448 4.206 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)[C@H](C)c2ccco2)cc1 1295413624 BUYOOXDWUJISGX-GOSISDBHSA-N 431.544 4.420 10 10 IICE C[C@@H](NC(=O)c1ncoc1C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1 1296650921 XBJZGSIETISWKR-MRXNPFEDSA-N 442.560 4.346 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCC[C@@H](COC)C2)cc1 1313676990 HJRBLIPBVYLSKG-OAQYLSRUSA-N 434.588 4.097 10 10 IICE O=C(CCc1cccc(OCc2ccccc2)c1)NCc1ccc(N2CCOCC2)c(F)c1 1354656674 DQJJIAUGSYPTPZ-UHFFFAOYSA-N 448.538 4.490 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H](C(=O)OC(C)(C)C)C3CCCC3)cc2F)C[C@@H](C)O1 1354659203 UNYSLTHJUAAZEK-DRSNIGMVSA-N 448.579 4.204 10 10 IICE CCN(CC)c1nc2sc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)cc2s1 1439959634 GAKRPTIXBJGHMB-KRWDZBQOSA-N 445.658 4.303 10 10 IICE Cc1cnc(Cl)c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1444498954 CVWHRXLFEPKXOD-SFHVURJKSA-N 432.952 4.105 10 10 IICE CC[C@@H]1CCCC[C@@H]1OCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1444501311 HRXXBBQKBCGJBK-QIJUGHKUSA-N 447.620 4.420 10 10 IICE CC(C)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1446563453 GAUCFGVEUSDRQT-PMACEKPBSA-N 434.577 4.229 10 10 IICE CCOc1ccccc1CN1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)[C@@H](C)C1 1448235960 MHULGBHSVOPKBX-FQEVSTJZSA-N 432.568 4.234 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCc1cc2ccccc2nc1O 1448682033 CHEZQSMYHXFOOH-UHFFFAOYSA-N 449.551 4.262 10 10 IICE CCCN(CC)c1ccc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)cc1 1456127466 IYPJXSOKECJORM-UHFFFAOYSA-N 426.580 4.134 10 10 IICE Cc1cc(C(=O)N2CCN(C)c3ccccc3C2)c(C)n1-c1ccc(Br)cn1 1464773036 FKOKPUYZOJQIRW-UHFFFAOYSA-N 439.357 4.344 10 10 IICE Cc1cc(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1465824722 SHPTYASWSQQOFU-LJQANCHMSA-N 431.964 4.416 10 10 IICE CNS(=O)(=O)c1cc(NC(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)ccc1O 1467900073 XTQXLUUQVJKPIN-UHFFFAOYSA-N 441.553 4.084 10 10 IICE C[C@@H](NC(=O)NCc1ccc(I)c(Cl)c1)c1ccccc1O 1469957036 YSYFOSFWJYZOSL-SNVBAGLBSA-N 430.673 4.211 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N=[S@@](C)(=O)c2ccc(N(C)C)cc2)cc1 1471018105 NZTCHUHFLGFRBH-HKBQPEDESA-N 437.565 4.199 10 10 IICE CC(C)N(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(F)cc1 1473271125 SESFDJFTFODWKN-QZTJIDSGSA-N 431.527 4.110 10 10 IICE C[C@@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1494242808 FKGMKQMVVFZFLK-CQSZACIVSA-N 446.983 4.189 10 10 IICE CCCC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@@]2(OCC)CCOC2)CCC1 1500202397 NIUJCLGMRWLJSH-XMMPIXPASA-N 428.577 4.243 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3sc(SC4CCCC4)nc3C)CC2)cc1 1519587556 UMUJNDXQKNYMMN-UHFFFAOYSA-N 431.627 4.386 10 10 IICE CC(C)(C)c1csc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 1525805806 JQQFRWZAVLTWNA-UHFFFAOYSA-N 427.492 4.226 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)cc2F)C[C@@H](C)O1 1526004009 VTZYNUQKWIFXRU-IAGOWNOFSA-N 441.503 4.086 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NCc1cccc(F)c1F 1534102776 LCZCNEPCYQXHCU-XNTDXEJSSA-N 438.546 4.324 10 10 IICE CC(C)(C)OC(=O)[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(C)(C)C 1539581911 MCMHMNYCPJATKM-QAPCUYQASA-N 440.531 4.377 10 10 IICE Cc1ccc(C(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1-n1c(C)cc(C=O)c1C 1543193650 LUDZECOSQYUJCX-UHFFFAOYSA-N 431.471 4.069 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)cc1 1565785319 GISYHJBNLBIXKH-KRWDZBQOSA-N 441.572 4.068 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)/C=C\c1csc(C(F)(F)F)c1 1566849284 IXMXFTZAJWKWKT-DJWKRKHSSA-N 433.835 4.341 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H](CC(F)(F)F)C1 1570485662 LJQHWWRFKMOJHJ-LBPRGKRZSA-N 448.488 4.059 10 10 IICE CCn1c(=O)n(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c2ccccc21 1586082420 POZYEOPWDYVQIZ-QGZVFWFLSA-N 440.975 4.029 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(c4ccc(F)cc4)C3)cc2Cl)C1 1586083080 VWPGXLQBTYUUMH-FUHWJXTLSA-N 443.950 4.385 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccc(Cl)c(Cl)c1 1616599569 PTEGRDSRRBYEAH-UHFFFAOYSA-N 448.394 4.289 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)oc1Br 1622634926 MPKXSWZKVSVTKQ-CQSZACIVSA-N 427.726 4.104 10 10 IICE CC(=O)N(c1ccc(NC(=O)NCc2cccc(Br)c2O)cc1)[C@@H]1C[C@@H]1C 1625066568 LCUIBYYSLKUDQB-KPZWWZAWSA-N 432.318 4.238 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCC[C@H](C(C)(C)C)CC3)CC2)cc1 1625352962 OIJUQQUHFNCURG-LCIJNYEZSA-N 441.616 4.011 10 10 IICE CCOc1ccc(N(C)C(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1625553315 GIYUKMIWFITBBV-XMHGGMMESA-N 444.553 4.479 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)N[C@H](C)c1ccccc1O 1632246122 AXEIPLDEKUUDDI-OAHLLOKOSA-N 428.485 4.132 10 10 IICE C[C@@H]1OC[C@]2(CC[C@H](CNC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)O2)[C@@H]1C 1638513378 JWBYKOGIJGSXRU-YBWLXYFRSA-N 441.572 4.030 10 10 IICE Cc1ncc(I)c(N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)n1 1642095267 FGCOFQMVAXMVQN-UHFFFAOYSA-N 434.256 4.304 10 10 IICE CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccccc2O)c1 1643738903 WSLNBSLCSCCQTD-MRXNPFEDSA-N 441.505 4.050 10 10 IICE COc1ccccc1NC(=O)c1ccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccccc2O)cc1 1644182897 AFDHRCQRYDWBHO-DLBZAZTESA-N 433.508 4.331 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc(C(=O)OC)c1 1652342780 SRLBDXIRNAUGHY-UHFFFAOYSA-N 435.476 4.237 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@H]3CC[C@@H](C(F)(F)F)O3)cc2Cl)C1 1680562820 NGIQWYCJRRUYTR-XUWXXGDYSA-N 433.902 4.485 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](N(C)C(=O)OC(C)(C)C)C1 1683421085 DOLWEPJENVTEDZ-RXVVDRJESA-N 432.609 4.033 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CC(C)(C)OC(C)(C)C1 1693006292 UXGMWELWBKXGPK-UHFFFAOYSA-N 434.588 4.157 10 10 IICE CCCCN1CCCC[C@H]1Cn1c(-c2cccn2C)nnc1N(C)Cc1ccccc1O 1764143716 GGRKWGKFKCGGJC-NRFANRHFSA-N 436.604 4.280 10 10 IICE Cc1ccc(N2N=C(C(F)(F)F)/C(=C/c3cc4c(cc3[N+](=O)[O-])OCCO4)C2=O)cc1 1865679663 YXWCTHVUGLKUHB-ZSOIEALJSA-N 433.342 4.023 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(O)C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C2=O)cc1 1872958280 YQUPJFNCUOUXAM-UHFFFAOYSA-N 437.839 4.498 10 10 IICE CC[C@@H](C)N1C(=O)C(NCCCOC(C)C)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873165280 FZEDUOFDKVCLPL-GOSISDBHSA-N 437.584 4.377 10 10 IICE O=C(N[C@@]1(c2c(O)cccc2F)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952772868 QITJOMIKHDDKDF-DFBJGRDBSA-N 433.435 4.370 10 10 IICE C[C@H](OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)[C@H](O)c1ccc2c(c1)CCN2C 1999507088 GCYLQOISKQUTJJ-PDIWNELESA-N 426.557 4.211 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cc(Br)ccc3O)C[C@@]2(C)C1 2116288605 RZYDYKIOKRTMIS-UVFQYZLESA-N 425.367 4.280 10 10 IICE COc1ccc(Br)c(CN[C@]23CCCN(C(=O)OC(C)(C)C)C[C@H]2C3)c1O 2236056534 WFZWOFPJXYSIES-XCLFUZPHSA-N 441.366 4.043 10 10 IICE CC[C@@H](NC(=O)C=Cc1ccc(C(C)C)cc1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 2330398757 LTBUKWPUUIVTDN-RUZDIDTESA-N 449.595 4.075 10 10 IICE CN(C)c1ccc([C@@H](O)Cc2ccc(I)c(Br)c2)cc1 2377340010 MWPDKIWEQSXACO-INIZCTEOSA-N 446.126 4.396 10 10 IICE CC(=O)Oc1ccc(/C=C2\SC(N(C)c3ccc(Cl)cc3)=NC2=O)cc1OC(C)=O 15016308 ZZTRXZYPOBRXQL-ODLFYWEKSA-N 444.896 4.297 10 10 IICE COc1cc(/C=C2\C(=O)N(c3cc(C)cc(C)c3)C(=O)N=C2O)cc(Br)c1O 34221893 OTNRQFCLIBVRPV-AUWJEWJLSA-N 445.269 4.287 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(C)oc4c3CN(Cc3ccccc3)CC4)CC2)cc1 65289659 IMTBXNPFMYOCHS-UHFFFAOYSA-N 445.563 4.117 10 10 IICE Cc1cc(C(=O)COC(=O)CCc2ccccn2)c(C)n1-c1ccc(OC(F)F)cc1 745525960 VHBBFBCJAIETAM-UHFFFAOYSA-N 428.435 4.449 10 10 IICE CCn1cnc(S(=O)(=O)Nc2nc(-c3ccccc3)c(C(=O)c3ccccc3)s2)c1 747859014 UUVZZEAPWSIEJK-UHFFFAOYSA-N 438.534 4.058 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc([N+](=O)[O-])cc(C)c3C)n2)cc1OC 748992378 NTYDMKRUDPOBPS-UHFFFAOYSA-N 449.510 4.153 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 764541576 UNRDTMDUJCRICK-FXAWDEMLSA-N 443.544 4.343 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(CN2CCOCC2)cn1 774091801 XTTBYQNLQVGNAC-HXUWFJFHSA-N 431.536 4.023 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCO[C@@H](c3ccccc3C(F)(F)F)C2)cc1F 781933180 LJCFKYDFFLDHSL-LJQANCHMSA-N 425.426 4.194 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)CO[C@H](C)c3nccn3C)c2C)c1 805685990 GXDBEIHEAYAIKQ-QGZVFWFLSA-N 441.553 4.053 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)C2CCN(C(=O)c3ccoc3)CC2)cc1 914456349 XNEQAHJRPXZADP-UHFFFAOYSA-N 435.524 4.020 10 10 IICE Cc1cc(C)n([C@H](C)CC(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)n1 919312508 ZCJCEKPRGZHVSS-QGZVFWFLSA-N 437.496 4.013 10 10 IICE CCN1CCN(c2ccc(CNC(=O)C3(Cc4ccccc4Cl)CC3)cc2F)CC1 1125908288 RYAAXCYCFOWMBT-UHFFFAOYSA-N 429.967 4.260 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CSc1ccc(OC)cc1 1139585684 UMEPJFLUUKOMCM-UHFFFAOYSA-N 430.570 4.176 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)CCC(=O)c1c(F)cccc1F 1149901178 WHADMVULOQKLQV-UHFFFAOYSA-N 426.257 4.445 10 10 IICE CCCCOc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(O)c1 1160960588 NBNXUMSTLXLCFV-SFHVURJKSA-N 432.948 4.325 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1ccc2cc[nH]c2c1)C(=O)NCc1cc(Cl)ccc1O 1165508032 KNLMITTUJSSVMI-IBGZPJMESA-N 443.931 4.279 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC(Cc4cccc(OC(F)(F)F)c4)C3)C2)cc1 1230858464 KZLHNIMWMNOTBZ-GOSISDBHSA-N 449.473 4.057 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCNC(=O)c2ccc(Br)cc2)cc1 1264770755 KLBLJBYSUZGOGM-UHFFFAOYSA-N 440.341 4.016 10 10 IICE CC[C@@H]1CN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1293586898 LLQBARVVHKRKBM-UEVCKROQSA-N 441.620 4.418 10 10 IICE CCOCCN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1297529239 JGYOUOBHOWEQCX-UHFFFAOYSA-N 443.661 4.085 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2O)cc1 1300092749 QFYSUHSWPHVZSB-UHFFFAOYSA-N 431.798 4.225 10 10 IICE COc1ccc(N(CC(=O)NCC(=O)OC(C)(C)C)Cc2ccc(C(C)C)cc2)cc1 1307568995 IFRLIWDCNKYSOD-UHFFFAOYSA-N 426.557 4.283 10 10 IICE COC1CCN(c2ccc(CN3C[C@H]4CCC[C@]4(NC(=O)OC(C)(C)C)C3)cc2)CC1 1307960382 LFJBPZIVVKEGLE-NLFFAJNJSA-N 429.605 4.181 10 10 IICE Cc1cc(CNC(=O)N2CCN(C(=O)CC3CCCCC3)CC2)c(C)n1-c1ccccc1 1313133598 TZXHORWUAZCZFW-UHFFFAOYSA-N 436.600 4.418 10 10 IICE CCO[C@H]1CCCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(CC)CC)cc2)C1 1314279402 XQPZYHVLPXTRAV-DEOSSOPVSA-N 448.615 4.164 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(NC(=O)Cc2cccnc2)cc1 1352945349 QCIVIWGVQOHMII-UHFFFAOYSA-N 430.552 4.380 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2C[C@]23CCN(C(=O)OCc2ccccc2)C3)cc1 1354542071 VACBFNCSTHWKBQ-OZXSUGGESA-N 435.568 4.198 10 10 IICE Cc1ccc(CNC(=O)c2cccc(CNC(=O)c3ccc(N=NC(N)=O)cc3)c2)cc1 1441528117 ZTROTNYEPQKNMB-UHFFFAOYSA-N 429.480 4.017 10 10 IICE Cc1ccc(C(=O)N(C)C2CC(NC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1449743481 AVPJPMMGHDBZBZ-UHFFFAOYSA-N 439.556 4.343 10 10 IICE O=C(NCc1ccc2cccnc2c1O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1 1451953039 KPSHSACBRQXKSA-QFIPXVFZSA-N 429.442 4.011 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCCc3nc4ccc([N+](=O)[O-])cc4[nH]3)c2C)cc1 1455675985 DWLRVNXNNFEOBE-UHFFFAOYSA-N 447.495 4.250 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)COc3ccccc3OCc3ccccc3)C2)cc1 1461497592 UTYVQFQNPFNQMR-NRFANRHFSA-N 432.520 4.048 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(Cc3ccccc3Br)CC2)N(C)C)cc1 1463287003 WLGRPHJCIKBLLG-OAQYLSRUSA-N 444.417 4.257 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCS(=O)(=O)C3(CCC3)C2)c(C)n1-c1cccc(C(C)C)c1 1472001067 UFSSLNJVZBQMNG-HXUWFJFHSA-N 428.598 4.447 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CNCc1cccc(Br)c1O)CC(F)(F)F 1474496040 LYRDOQZXTDMYPX-LLVKDONJSA-N 427.261 4.090 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)COc3ccc([N+](=O)[O-])c(F)c3)cc2Cl)C1 1519551457 NWWHKPCLAXTHCD-CQSZACIVSA-N 435.883 4.319 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)COCCc1ccc(Br)cc1 1525114115 VOZYRWQSHMPEKQ-UHFFFAOYSA-N 431.374 4.267 10 10 IICE CC(C)(C)OC(=O)N1CCc2occc2[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 1543591866 RUHXNKZZGVODIR-NRFANRHFSA-N 425.529 4.031 10 10 IICE C[C@H]1CCc2sc(-c3nnc(N(C)Cc4ccccc4O)n3C[C@H](C)N(C)C)cc2C1 1543868693 SWJJLDZGIVLMCE-IRXDYDNUSA-N 439.629 4.424 10 10 IICE CCCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)N(C)CC 1547009812 IHNJWTQNPGJCNW-UHFFFAOYSA-N 436.604 4.457 10 10 IICE Cc1cc(C(=O)NC[C@@]2(OC(C)C)CCOC2)c(C)n1-c1ccccc1Br 1558478211 LRGWLYVUZMUKGF-NRFANRHFSA-N 435.362 4.171 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NC3(c4cccc(OC(F)(F)F)c4)CC3)C2)cc1 1564962373 JULZUHICPVKAPY-MRXNPFEDSA-N 449.473 4.409 10 10 IICE C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1583318309 JTOXFNTUFBCNOV-NWDGAFQWSA-N 446.381 4.173 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(CC(=O)OC(C)(C)C)C2CCC2)C1 1586279385 PUWCOHNKCWETGV-UHFFFAOYSA-N 439.600 4.131 10 10 IICE Cc1cc(CNC(=O)CN(C[C@@H]2CCCO2)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1587886199 KNMSXXBBLFYXCH-QFIPXVFZSA-N 441.572 4.126 10 10 IICE O=C(NCc1cccc(O)c1O)[C@H](Oc1ccc(Br)cc1F)c1ccccc1 1593739915 ZAPZUAWFQJCSPG-HXUWFJFHSA-N 446.272 4.436 10 10 IICE Cc1cc(C(=O)NCC(=O)NC2CCCCC2)c(C)n1-c1cccc(Br)c1 1597881202 ODRZHVWWUGYTGF-UHFFFAOYSA-N 432.362 4.035 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)c3cccc(O)c3)CC2)c(C)n1-c1cccc(Cl)c1 1622837393 LSUKMIQQWXLQOY-UHFFFAOYSA-N 437.927 4.051 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(Br)n(C)n2)cc1 1628565534 QXNPFIHKQODNOY-UHFFFAOYSA-N 443.345 4.104 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N3CCN(Cc4nccn4C(F)F)CC3)c2C)c1 1631283319 FMZHHWHLIKVLCY-UHFFFAOYSA-N 441.526 4.261 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CC[C@](C)(NC(=O)C(F)(F)F)C2)c1 1632630143 RYJWINAKTOLUEZ-IBGZPJMESA-N 427.854 4.031 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCc1ccccc1OC(F)(F)F 1632701697 KRDLBXXONQJYFC-UHFFFAOYSA-N 445.821 4.079 10 10 IICE C/C=C\[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1638244093 RBOHNQHQCCPMKH-CKDISWFASA-N 429.605 4.167 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3cccc(-c4ccccc4)c3)CC2)cc1 1640218286 YKLMSLFLDISCHF-CCEZHUSRSA-N 441.531 4.206 10 10 IICE CC[C@H](C)c1nnc(N2CCC(c3ccnn3C)CC2)n1Cc1ccc(N(C)C)cc1C 1694052248 XBTMXDUFSJJGLC-SFHVURJKSA-N 435.620 4.332 10 10 IICE CCOC(=O)N[C@@H](CC(C)C)Cn1c(C2CCC2)nnc1N(C)Cc1ccccc1O 1728708793 SFSDIOKOWWDDSG-IBGZPJMESA-N 429.565 4.048 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@H]3C)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1742118884 ARXLVXBIZCYGSL-RTBURBONSA-N 438.645 4.244 10 10 IICE CCCCN(C)CC1CCN(c2nnc(CC)n2Cc2ccc3c(c2)CCCN3C)CC1 1745426381 PPIROPGMPVXTAO-UHFFFAOYSA-N 438.664 4.220 10 10 IICE CN(CC(C)(C)C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1768598334 AGNXMEDCDDXLBB-UHFFFAOYSA-N 427.637 4.315 10 10 IICE COC(=O)c1c(NC(=O)C(=O)Nc2ncc(C)s2)sc(C)c1-c1ccc(C)c(C)c1 1860768079 VDOHYOYTVGAPAI-UHFFFAOYSA-N 443.550 4.469 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2c(O)cccc2Br)C[C@H]1C1CC1 1895877170 XXQYXTPWVZCBNB-PBHICJAKSA-N 425.367 4.422 10 10 IICE CC(C)(C)OC(=O)N1CC(N(CCCOc2ccc(N)cc2)OCc2ccccc2)C1 2006999909 QRXXTTDNFFMAAN-UHFFFAOYSA-N 427.545 4.091 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCC[C@@H]1CNCc1cc(Br)cc(F)c1O 2087520722 PYBXVZOEWQIBMI-MLGOLLRUSA-N 431.346 4.467 10 10 IICE CN(C[C@]1(Br)CC1(F)F)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2202538869 WTWRIMFAUBLKCB-GOSISDBHSA-N 446.336 4.171 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=Cc1ccc(SCc2ccco2)o1 2297348266 ZKMWJNCMKVMGRK-UHFFFAOYSA-N 428.853 4.485 10 10 IICE CCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N([C@@H](C)c2ccccc2)C1=O 2314413684 DXNKHMVJBWDKLO-AWEZNQCLSA-N 436.562 4.089 10 10 IICE O=C(O)[C@@H](Cc1ccc(O)cc1)N1C(=O)C(=Cc2cccc3ccccc23)SC1=S 2318684180 SNCOKPNDGYYCHC-LJQANCHMSA-N 435.526 4.443 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(c4ccc(CC(=O)O)cc4)C3=O)n12 2321582927 FKGZTVIMHMVDBW-UHFFFAOYSA-N 449.966 4.391 10 10 IICE CCCC[C@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323815941 DSTCUZHLVUIQRI-GFCCVEGCSA-N 432.336 4.433 10 10 IICE Cc1ccc(CNC(=O)[C@H]2C[C@H](C)CCN2C(=O)OC(C)(C)C)c(O)c1Br 2380747858 YBGNRYJHLWHYJR-IUODEOHRSA-N 441.366 4.115 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 14470798 FRVPGFYRPRNZIK-SIFCLUCFSA-N 433.917 4.325 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C/c3c[nH]c4ccc(Br)cc34)C2=O)c1 103666349 UVEAZLNGAYXPDI-IUXPMGMMSA-N 438.281 4.214 10 10 IICE N=C1/C(=C\c2ccc(OCc3ccc4c(c3)OCO4)c(Cl)c2)C(=O)N=C2SC=CN12 103801785 KXFULBKXNWDZCG-CVFAXBIPSA-N 439.880 4.425 10 10 IICE COc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 210717927 TWAGMEAPOFLDDQ-QGOAFFKASA-N 430.526 4.454 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cs1 743047242 ZSSDULDVTNLCHB-UHFFFAOYSA-N 448.469 4.185 10 10 IICE C[C@H]1CCN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)[C@H](c2ccco2)C1 769932962 RPIWGUJAGYMDSO-YOEHRIQHSA-N 446.550 4.461 10 10 IICE COc1ccc(S(=O)(=O)Nc2cccc(CNCc3cc(Cl)cc(C)c3O)c2)cc1 776175477 RQGDDCGJFSXYCV-UHFFFAOYSA-N 446.956 4.453 10 10 IICE COC(=O)/C=C\c1ccc(N2[C@H]3CC[C@H]2CC(N(C)C(=O)c2ccccc2)C3)c([N+](=O)[O-])c1 776818310 VMTSMIJFQLFQRR-FKUJVYATSA-N 449.507 4.053 10 10 IICE C[C@@H]1CN(c2ccc(NC(=O)/C=C/c3ccc(O)c(O)c3)cc2C(F)(F)F)C[C@@H](C)O1 779515412 WBJSRKZMGCXADS-CCRJBVLDSA-N 436.430 4.382 10 10 IICE CCN(C)Cc1cc(O[C@@H]2CCN(Cc3cc(OC)cc(C(C)(C)C)c3O)C2)ccn1 856548871 MNWLDGYMUWBRHG-OAQYLSRUSA-N 427.589 4.198 10 10 IICE COc1ccc(-c2n[nH]c(CNC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)n2)cc1 1136708950 SSZRENYFGIGAHE-UHFFFAOYSA-N 435.915 4.471 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(N(C)c4ccccc4)n3)CC2)cc1F 1150239531 HBDXKNFKPFUXPW-UHFFFAOYSA-N 426.517 4.021 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NCc3nc4c(s3)COCC4)cc2Cl)C1 1235833225 JXMKWSVTELXRTA-AWEZNQCLSA-N 434.993 4.105 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CC[C@@H]2c2ccc(Br)cc2)N(C)C)cc1 1251501394 QMGJRJLZTNZPAW-RTWAWAEBSA-N 445.405 4.274 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccccc1CN(C)C(=O)OC(C)(C)C 1252638929 BRWZRLIGANHJNB-UHFFFAOYSA-N 440.588 4.461 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)cc1 1264668252 FYZAXUVQYXNBNL-UHFFFAOYSA-N 443.613 4.028 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Cl)cc(Br)c2F)cc1 1278289050 UDKIFPRRHMCZSJ-UHFFFAOYSA-N 429.717 4.459 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(I)cc1O 1291850546 SLXYWGUZYXOQCH-UHFFFAOYSA-N 438.309 4.114 10 10 IICE CCOc1ccc([C@H](C)NC(=O)CCCNC(=O)c2cc3cc(O)c(O)cc3s2)cc1 1294550177 LAIFFHJRYXVGPP-AWEZNQCLSA-N 442.537 4.099 10 10 IICE CC(C)(C)OC(=O)N1CCc2ncc(NC(=O)c3cc4cc(O)c(O)cc4s3)cc2C1 1295803326 DUSBROIIUCVSDM-UHFFFAOYSA-N 441.509 4.253 10 10 IICE CCS(=O)(=O)Cc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1299437981 LXVDIFARGASVTQ-UHFFFAOYSA-N 438.549 4.402 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(Cc2ccncc2)n1Cc1ccc(N(C)C)c(F)c1 1302732170 QYMVKZWCBYYFCH-QGZVFWFLSA-N 442.608 4.095 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)c2ccc(OC)c(OC)c2)sc2c1CC[C@@H](C)C2 1307441890 FKAJZLCIIOYPTM-CQSZACIVSA-N 446.569 4.142 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(C(=O)CCC2CCCCC2)CC1 1312883416 CTQPEELZZARAPJ-OAQYLSRUSA-N 442.648 4.206 10 10 IICE C[C@H](CNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1)c1ccc(S(C)(=O)=O)cc1 1313171961 BDCXCYNGEJDZJQ-LJQANCHMSA-N 443.613 4.026 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1Cc1ccc(OC(C)(C)C)nc1 1314751249 QOSLMBABCOLTQT-UHFFFAOYSA-N 444.539 4.303 10 10 IICE CN(CCc1cccs1)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1314830434 VHDQFLPWQMPWKN-UHFFFAOYSA-N 443.627 4.114 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)n1Cc1ccco1 1323303842 ONVCUNZEBRTOLP-UHFFFAOYSA-N 446.595 4.208 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccccc3SCc3nc(C)no3)CC2)cc1 1336530492 CHOFNBHCWCDJIM-UHFFFAOYSA-N 438.553 4.031 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3ccccc3OC3CCCCC3)cc2)C1 1356433498 NQZIPHUOTYPJJP-FQEVSTJZSA-N 435.568 4.030 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1358371020 HNPVGFVDYUQLMQ-KRWDZBQOSA-N 431.939 4.335 10 10 IICE O=C(CO[C@H]1CCCc2ccccc21)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1435333541 RRDCQIXEDFSUFW-AVRDEDQJSA-N 430.495 4.467 10 10 IICE COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NC(=O)c1ccccc1-n1c(C)cc(C=O)c1C 1449406673 HMIZNQTUXMGKOW-MBSDFSHPSA-N 432.520 4.057 10 10 IICE Cc1cnc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)s1 1464829938 PYUKMLZJGDXGLH-SFHVURJKSA-N 444.557 4.152 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F 1465030973 OZYMFULDMJMEAS-HXUWFJFHSA-N 437.487 4.127 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)c1ncnc2cc(I)sc12 1472725056 FIIYDIRIVZGRPZ-UHFFFAOYSA-N 438.338 4.388 10 10 IICE CCOCc1nnc(N(C)[C@@H]2C[C@@H](OCC)C23CCC3)n1Cc1ccc(N(C)C)cc1C 1503005787 BQGBKBPHLQAFRS-FGZHOGPDSA-N 441.620 4.021 10 10 IICE Cc1cc(-c2nnc(N3CCOC(C)(C)C3)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1510617429 FTWMDFXBWKRBNV-UHFFFAOYSA-N 437.588 4.129 10 10 IICE CCN(CC(C)C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1nncn1C 1515460449 SXKJRLZKWTVXQK-UHFFFAOYSA-N 432.576 4.012 10 10 IICE CCCOc1ccc(OCC(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc1 1524065960 BAFIUJMFURTZMP-QGZVFWFLSA-N 434.483 4.241 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCCN2CCN(c3ccccc3)CC2)c1C 1540821763 WGYNCYUCPIAILQ-UHFFFAOYSA-N 430.596 4.345 10 10 IICE CC(C)[C@H](Cn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O)c1cccnc1 1541307507 HDPQVKANIYTKNA-YADHBBJMSA-N 435.572 4.349 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H]1COc2ccc(Cl)cc2C1 1545632839 WZKRIWXQLHBOEE-VQIMIIECSA-N 435.351 4.031 10 10 IICE CC(C)(C)[S@@](C)(=O)=NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1584721474 BQGDFQYDVPKBER-LHPDUPQPSA-N 430.642 4.152 10 10 IICE COc1cccc(Cl)c1NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O 1595916706 OWBJMAXKOVNDSN-UHFFFAOYSA-N 436.807 4.285 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)c3[nH]c4ccc(Cl)cc4c3Cl)cc2)CC1 1596354799 DLPPXWWHSZIORZ-UHFFFAOYSA-N 445.350 4.106 10 10 IICE O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1cccc(Cl)c1O)OCc1ccccc1 1606860786 TUKJBSVKNYNBBM-NRFANRHFSA-N 438.911 4.200 10 10 IICE Cc1noc(C2(C)CCN(c3nnc(C(C)C)n3CCCSc3nccs3)CC2)n1 1612635680 GSYZOEFKBRVCQU-UHFFFAOYSA-N 447.634 4.290 10 10 IICE CC[C@H](Cn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1613636904 OBWQDDJKDOKBNJ-YADHBBJMSA-N 427.593 4.181 10 10 IICE CCOCc1nnc(N2C[C@H](C)C[C@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616731568 PGDNHCNJJNNKLJ-UYAOXDASSA-N 429.634 4.041 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@@H]3CCC[C@@H](C(C)(C)C)CC3)CC2)cc1 1625352964 OIJUQQUHFNCURG-YBYKEUDPSA-N 441.616 4.011 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(CNC(=O)OC(C)(C)C)n(C)c2C)cc1 1626085395 JFFIORWWXVLYCA-UHFFFAOYSA-N 428.577 4.134 10 10 IICE CN(c1ccc(CNC(=O)c2c(Br)nc3n2CCC3)cc1)C1CCCCC1 1627006210 LRLKQTMLVXWQQP-UHFFFAOYSA-N 431.378 4.291 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CNc2cccc(C(F)(F)F)c2)cc1 1627205580 TXODSHRJCPFBSV-NRFANRHFSA-N 435.490 4.391 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@H]2CCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1628495390 KYROVLGREYBJFO-AEFFLSMTSA-N 425.520 4.260 10 10 IICE CCOCn1nc(C)c(C[C@H](C)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1C 1628873646 HGRPQBGBGCJQIN-IBGZPJMESA-N 426.605 4.321 10 10 IICE Cc1ccc(OCC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c(C)c1 1629679075 KGPXOELBYBKEBD-NRFANRHFSA-N 441.572 4.130 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c2C)cc1 1633345646 GEERMVOVEVTSBY-OAQYLSRUSA-N 429.561 4.382 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)C3(c4ccccc4)CCCC3)CC2)c(OC)c1 1634370742 DRHKJQVXJMEDRO-FQEVSTJZSA-N 437.584 4.436 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(Cl)c(CN(C)CCO)c1 1634836595 GIHCTKZPBWYNNH-UHFFFAOYSA-N 439.943 4.236 10 10 IICE COC(=O)[C@@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1 1636236970 BFDUKAPERBYEAK-LJQANCHMSA-N 428.838 4.315 10 10 IICE Cc1cc(C(=O)N(C)CCN2CCN(Cc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1636301163 CEBFVNGXWBHGPZ-UHFFFAOYSA-N 448.586 4.123 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)Cc2cccc(F)c2)c(C)n1-c1ccc(Br)cc1 1637718370 SHCAHOUCDXGZJN-FQEVSTJZSA-N 445.332 4.329 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC(=O)c3cc4cc(O)c(O)cc4s3)C[C@H]2C1 1638771293 BRZQOMMYUFFOTO-QEJZJMRPSA-N 432.542 4.078 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc3c(c2)nc(C)n3[C@@H](C)CO)cc1 1640679651 RQTYJLPGHGQTKH-KRWDZBQOSA-N 444.535 4.299 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccc(C(C)C)cc4)c3C)CC2)nn1 1641121032 VXAZOMDTILIEAK-UHFFFAOYSA-N 447.583 4.369 10 10 IICE CCOC(=O)C1=C(CSc2ncc(C(C)(C)C)s2)NC(=O)N[C@@H]1c1ccccc1 1643770519 GMWDMAUOPPHFMO-QGZVFWFLSA-N 431.583 4.404 10 10 IICE CCOCN(C(=O)CN1CCCN(c2ccc(OC)cc2)CC1)c1c(C)cccc1CC 1657023670 LSZYDJWIZYOOEK-UHFFFAOYSA-N 439.600 4.105 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](CC3CC3)c3ccccc3)cc2F)C[C@@H](C)O1 1658037658 HBQNEIXHPDBWRI-IECBHUPTSA-N 439.575 4.187 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCO)Cc3ccccc3)cc2Cl)C1 1682024328 QANGJVTZFPTJCP-WIYYLYMNSA-N 429.992 4.369 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC/C=C\c3ccc(Br)cc3)C2)cc1 1682626892 LDXVBHPYLLPYAB-KVLZDYKBSA-N 430.346 4.049 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCCc1cc(C(F)(F)F)ccn1 1686629867 YRFYIQDTZXXQGF-UHFFFAOYSA-N 446.267 4.343 10 10 IICE CCSc1cc(Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)ccn1 1696532936 KPBOTXPHBZQTFX-LJQANCHMSA-N 425.558 4.027 10 10 IICE CC(C)N(C)CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1706555480 AQQUEZLPHMKUBV-UHFFFAOYSA-N 426.653 4.444 10 10 IICE CCC1CCN(c2nnc(C(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1709287579 RXJUXPUBPALSRW-UHFFFAOYSA-N 425.621 4.285 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)C[C@@H]3C)n2CCCC(C)C)c(C)n1-c1ccccc1 1724196360 NWPQBEVVDDLHRE-FQEVSTJZSA-N 448.615 4.456 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2CC(C)(C)OC[C@@H]2C)cc1 1728383780 DOWVRWDUCZSHAA-FQEVSTJZSA-N 448.615 4.162 10 10 IICE CC1(C)CN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CCS1 1742004175 QGOBKDYWMXADSF-UHFFFAOYSA-N 432.644 4.311 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1743843415 MMWDYTJILBHKCW-GOSISDBHSA-N 436.604 4.361 10 10 IICE CN(CCOC(C)(C)C)c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1747980337 GZNLXDOGXRCYOY-MRXNPFEDSA-N 439.651 4.062 10 10 IICE C[C@@H]1CCC[C@](Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752088512 ZSCVIEYXPCLXAY-CLOONOSVSA-N 434.588 4.193 10 10 IICE CC[C@]1(C)CC[C@H](Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)O1 1762426335 LRGSUYCNKCPNOA-NTKDMRAZSA-N 445.583 4.224 10 10 IICE C[C@H]1COCC[C@@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1763208316 HYOAIZILOHEXFG-DOTOQJQBSA-N 427.936 4.008 10 10 IICE CCN(c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCC(CO)CC2)cc1)C(C)C 1764782099 LTAGSKCZRYNZSR-UHFFFAOYSA-N 448.615 4.140 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)C1 1768371523 GGBKULSAFHRICP-DBXWQHBBSA-N 447.624 4.493 10 10 IICE CN(C)c1ccc(Cn2c(C3CCCC3)nnc2N2CCCN(C(C)(C)C)CC2)cc1F 1768495104 UTXLPYWCLCLASN-UHFFFAOYSA-N 442.627 4.500 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@H]3CCSC3)CC2)cc1F 1768705178 YJKLOWNJPMGNHP-QGZVFWFLSA-N 447.624 4.094 10 10 IICE CS[C@@H](C)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1771392894 VGZHFDHWHOLRDK-IBGZPJMESA-N 436.629 4.252 10 10 IICE CC(=C/c1ccccc1)/C=C1\SC(=S)N([C@@H]2CC(=O)N(c3ccc(C)cc3)C2=O)C1=O 1772759302 MHYXYOUEGHKRLY-IBBFZIETSA-N 448.569 4.475 10 10 IICE CCCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCOC(C)C)C1=O 1873164522 GEAUGEDTERQDRP-UHFFFAOYSA-N 437.584 4.379 10 10 IICE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2ccc(Br)cc2I)C1 2207276807 ZWPLFNRLWWLAQX-SECBINFHSA-N 449.090 4.216 10 10 IICE CCN1C(=O)C(=Cc2ccc(OC(=O)c3ccc([N+](=O)[O-])cc3)c(OC)c2)SC1=S 2293264715 LMKUVFXNCIMYHQ-UHFFFAOYSA-N 444.490 4.044 10 10 IICE COc1ccc2[nH]cc(C=C3SC(=S)N([C@@H](Cc4ccccc4)C(=O)O)C3=O)c2c1 2297471608 UEEILFGJBHVNAT-SFHVURJKSA-N 438.530 4.074 10 10 IICE CCNc1nc2ccccn2c(=O)c1C=C1SC(=S)N([C@H](C)c2ccccc2)C1=O 2314413685 DXNKHMVJBWDKLO-CQSZACIVSA-N 436.562 4.089 10 10 IICE O=C1C(=Cc2ccc3c(c2)OCO3)SC(=S)N1C[C@@H](c1ccccc1)N1CCCC1 2323886470 AWIBEOIREGPEER-SFHVURJKSA-N 438.574 4.454 10 10 IICE Cc1cc(C(=O)CSc2ccccc2Cl)c(C)n1-c1ccc(S(N)(=O)=O)cc1 11481244 JXDGXGSPKKUNDB-UHFFFAOYSA-N 434.970 4.370 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3ccc(C)cc3)C2=O)cc1OC 33318032 NVXQORVGPAQSES-CPNJWEJPSA-N 442.562 4.242 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N(CC(C)C)C1=O 33490820 QGOBKTIBKYIWMI-BOPFTXTBSA-N 444.626 4.462 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 33768062 UZBKFXNAPWWUJW-LFIBNONCSA-N 443.843 4.303 10 10 IICE CC[C@@H](C)N(Cc1ccc(N(CC)CC)cc1OS(=O)(=O)CC)C(=O)NC(C)(C)C 36008662 YXSJZSAMYJSQJM-QGZVFWFLSA-N 441.638 4.370 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccccc3C)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526494430 CZJBKHWXZHOAOO-HSZRJFAPSA-N 433.460 4.481 10 10 IICE CCCn1c(/C(Cl)=C/c2cnn3ccccc23)nc2cc(S(=O)(=O)N(C)C)ccc21 729643783 IBDCXTMVZUPTEZ-ATVHPVEESA-N 443.960 4.081 10 10 IICE O=C(NCCc1ccc2ccccc2n1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743570145 UWYMUASCAKPTPA-LJQANCHMSA-N 440.494 4.347 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)cs2)ccc1Cl 757500604 NVEFAMDGOKGWSN-UHFFFAOYSA-N 438.914 4.060 10 10 IICE Cc1cc(C(=O)COC(=O)c2nc(Cl)ccc2F)c(C)n1-c1ccc2c(c1)OCO2 758892746 DFQWEEDQMNIXQA-UHFFFAOYSA-N 430.819 4.050 10 10 IICE COc1cccc(-c2nsc(NC(=O)NCc3cccc(Br)c3O)n2)c1 765339904 SEKDEFDMJPFUPI-UHFFFAOYSA-N 435.303 4.004 10 10 IICE C[C@@H](NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)c1cncc(F)c1 782067140 JJPUGBJEPHSMJN-DZZSIBQASA-N 435.571 4.141 10 10 IICE COc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1nc(-c2cc3ccccc3o2)cs1 795605642 IBJLDYANCOJIKL-UHFFFAOYSA-N 431.451 4.274 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)C[C@@]2(CCO[C@H](C)C2)O1 797440066 LVEQXRLWKVDEBX-RNHFSVANSA-N 429.605 4.324 10 10 IICE Cc1cc(F)cc([C@]2(F)CCN(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)C2)c1 799893762 WPDRHOYESYZKIP-KOSHJBKYSA-N 429.511 4.312 10 10 IICE Cc1cc(-c2nnc(N(C)C[C@H]3CCCOC3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802682729 OLCZDXBWJNLNCZ-FYYLOGMGSA-N 449.599 4.394 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(NC(=O)c2ccco2)cc1 806183142 NKTPQDNCMIYMCG-UHFFFAOYSA-N 430.258 4.322 10 10 IICE O=C(Nc1nc(-c2ccccc2)co1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 816509188 GZXRTGVGWGMKLX-UHFFFAOYSA-N 441.490 4.162 10 10 IICE O=[N+]([O-])c1ccc(NC(=S)NNc2nnc(-c3ccccc3)n2-c2ccccc2)cc1 915121798 LSEHWCIAZFRHSH-UHFFFAOYSA-N 431.481 4.156 10 10 IICE C[C@@H](NC(=O)Cc1ccc(O)c(O)c1)c1nc(-c2ccc(Br)cc2)cs1 1137324510 GCUGBPWTWRNMPG-LLVKDONJSA-N 433.327 4.404 10 10 IICE Cc1cc(CC(=O)NCc2cccc(NC(=O)[C@H]3CCCO3)c2)c(C)n1-c1ccccc1 1142179044 DXMZZKHJHIUPHY-XMMPIXPASA-N 431.536 4.071 10 10 IICE CC[C@@](CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)(C(=O)OC)c1ccccc1 1161599741 CIGKMQPMTAXHQR-MHZLTWQESA-N 446.547 4.086 10 10 IICE CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)C1=O 1187965366 WWUOLHUUVRKMLP-RUZDIDTESA-N 448.498 4.058 10 10 IICE Cc1cc(F)ccc1C1CCN(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)CC1 1251750580 FPNSZDZNTSDOEQ-UHFFFAOYSA-N 447.501 4.338 10 10 IICE Cc1cc(OCC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc(C)c1Cl 1266259039 ORNFTLOGYIACLG-UHFFFAOYSA-N 442.003 4.184 10 10 IICE CC[C@@H](C)NC(=O)c1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1290971843 RKEPQRWUMAANRR-GOSISDBHSA-N 445.563 4.294 10 10 IICE CC[C@@H]1CCCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc3c(c2)CCCN3C)C1 1293387491 VTHBHJXPJDBPHJ-VQTJNVASSA-N 441.620 4.059 10 10 IICE O=C(CCOc1ccc(Cl)c(F)c1)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1294858223 BHCGFLDHDZDTCB-INIZCTEOSA-N 441.330 4.388 10 10 IICE CCOc1ccc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1297009156 CGCQVEVEVARNLU-QGZVFWFLSA-N 443.975 4.021 10 10 IICE C[C@H]1[C@H](C(F)(F)F)CCN1[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307734522 PISDBCBECIXGJO-OGHNNQOOSA-N 430.426 4.062 10 10 IICE Brc1cnc(CNCc2ccc(N3CCCCC3)c(Br)c2)cn1 1308904025 NMXSDEZZFCFFSQ-UHFFFAOYSA-N 440.183 4.282 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NCc1cccc(C(F)(F)F)n1 1312726077 NWWLNRZUFWGOBZ-UHFFFAOYSA-N 432.240 4.300 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCS(C)(=O)=O)C(C)C 1313581143 FEPJTXFHSDPTNY-UHFFFAOYSA-N 443.617 4.022 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cccc(C)n3)n2CCCSc2nccs2)C1 1315246984 IGRSLUSCFIMACK-OAQYLSRUSA-N 444.630 4.293 10 10 IICE CC(=O)c1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)ccc1OC(C)C 1445882195 KNSRWCNFFCBVCC-HXUWFJFHSA-N 444.959 4.430 10 10 IICE CC(C)(C)OC(=O)CCCCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1456078038 UFDCJYFQTMVERH-UHFFFAOYSA-N 426.504 4.275 10 10 IICE CCc1c(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnn1CCC(C)C 1457092029 FFSREORKDNDLBP-QGZVFWFLSA-N 434.531 4.492 10 10 IICE Cc1ccc(N2N=C(Br)C[C@H]2C(=O)NCc2c(O)ccc3c2CCCC3)cc1 1465953335 FKSNRZFQWAXXPH-IBGZPJMESA-N 442.357 4.183 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCCC[C@@H]2c2nc3ccccc3[nH]2)N(C)C)cc1 1471548524 VQIGBOXHOMQADV-DHIUTWEWSA-N 434.588 4.168 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)C[C@@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1496759623 CUWZUJZBOUCWIS-LPHOPBHVSA-N 444.599 4.075 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3c(Cl)cccc3OCC3CC3)c2)CC1 1523223898 MBBDYGYQEOFQKC-UHFFFAOYSA-N 427.932 4.050 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnnn1-c1cccc(Cl)c1Cl 1528932294 IAUZJPWHJLLCEH-CQSZACIVSA-N 432.355 4.310 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(Cl)c1 1530833042 AVFHKOKXGCZERH-DYESRHJHSA-N 434.367 4.204 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)ccc1Br 1534308305 BEMAVFNRBWDDQB-HUUCEWRRSA-N 435.337 4.440 10 10 IICE CCC[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)c1ccccn1 1537512725 RKSNBSZLGUXZML-OGBKAESYSA-N 443.569 4.470 10 10 IICE CCNC(=O)OC[C@H]1CCCCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1539878533 FTDVNJZXWVMQQS-OAQYLSRUSA-N 431.964 4.417 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541443745 BVNURTZTXOYEPC-SFTDATJTSA-N 439.648 4.216 10 10 IICE CCOC(=O)[C@H](CCOC(C)(C)C)NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1546271531 GIFCSSJGAREWIF-NRFANRHFSA-N 442.556 4.082 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1547448675 PHFQMLYCDDINBT-HXUWFJFHSA-N 448.615 4.162 10 10 IICE CCO[C@]1(c2nnc(N3CC[C@H](CC)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1547892601 KUVAMMCBYRIVDN-NBGIEHNGSA-N 441.620 4.061 10 10 IICE CCOc1ccc2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)[nH]c2c1 1566357221 ZCPPMKVNLOIEKS-GOSISDBHSA-N 427.932 4.320 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(N=S(C)(C)=O)c2)C1 1597012041 GTSIPLJWPNXZRY-UHFFFAOYSA-N 438.597 4.406 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cnn(-c4cccc(C(F)(F)F)c4)c3C)C2)cc1 1617262916 OKCALPKWQQUQMB-QGZVFWFLSA-N 444.457 4.217 10 10 IICE CCCCC[C@H](NC(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)C(C)(C)C 1617322949 NVTKLSVRRJXAET-MTVZPNFRSA-N 429.605 4.011 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2nc(C(C)(C)C)no2)c(C)n1-c1ccc(Br)cn1 1620989242 WAOWYJOJCLONBE-LBPRGKRZSA-N 446.349 4.423 10 10 IICE CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1624850975 FFWDSVDYLKSRKS-KRWDZBQOSA-N 431.536 4.365 10 10 IICE CC(=O)Nc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)nc1 1625018121 CMJLRHHIHBTKHZ-UHFFFAOYSA-N 427.302 4.462 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C2(CNC(=O)OCc3ccccc3)CCCC2)c1 1631542673 LKRPOVNDWYQYLU-QGZVFWFLSA-N 426.513 4.065 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc(C)cc(Br)c1F 1632701909 QPUDWUGPLPYTRT-UHFFFAOYSA-N 444.684 4.071 10 10 IICE CCOC(=O)c1sc2nc(C)nc(N(Cc3ccccc3O)C[C@H]3CCCO3)c2c1C 1639661685 NKAOLWSDIAAZEI-QGZVFWFLSA-N 441.553 4.376 10 10 IICE CCS(=O)(=O)NCCSc1ncc(-c2ccc(Br)cc2)n1CC(C)C 1651676912 GXFUOOWKLZEKAS-UHFFFAOYSA-N 446.436 4.000 10 10 IICE C[C@H]1CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CCc2ccc(Cl)cc21 1687807834 WIYMDEPQOCTDHK-SBUREZEXSA-N 429.008 4.380 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1695627683 ZMGJUDNCIXVJJA-PZJWPPBQSA-N 441.620 4.070 10 10 IICE C[C@H]1CCCN(CCCCn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)C1 1708085070 KAPPHXKCCMIIDX-NRFANRHFSA-N 448.615 4.118 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(OCC(F)(F)F)nc1 1723269022 DCBJLUUYKNITHG-UHFFFAOYSA-N 449.477 4.203 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1C[C@H]1CCC[C@H](O)C1 1729419943 ABNKMNMGUZFSOU-LLMJNHHCSA-N 442.604 4.090 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1C[C@H](C)C(F)(F)[C@H](C)C1 1742138665 CKQBVDHOHJTHQJ-HDICACEKSA-N 442.558 4.434 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](C)C(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1750723932 XITDNRPQDRGBSX-LJQANCHMSA-N 443.611 4.373 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3C[C@H](c3cccnc3)C(C)C)CC2)cc1 1770259457 XKKJWJHJGOYTEQ-DEOSSOPVSA-N 434.588 4.147 10 10 IICE O=C(Cc1csc(-c2ccc(OC(F)(F)F)cc2)n1)NCCc1ccc(O)c(O)c1 1860210562 CUBCPRDXPSLOEX-UHFFFAOYSA-N 438.427 4.021 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(NC(C)C)C(=O)N(CCOc3ccccc3)C2=O)cc1 1873166739 GDGZLKIPKMLPTL-UHFFFAOYSA-N 443.547 4.251 10 10 IICE CC(C)(C)OC(=O)N1CCC12CC(CNCc1cc(Br)cc(F)c1O)C2 1966072180 LMFZXBVEIVXXJV-UHFFFAOYSA-N 429.330 4.173 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C3(C)CC3)c(CN)c2I)c(O)c1 2079026162 WTTCDWNNPKPIQJ-INIZCTEOSA-N 437.325 4.011 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C(F)F)c(C=O)c2I)c(O)c1 2079059855 BDVNUMOAERVWKR-AWEZNQCLSA-N 434.224 4.497 10 10 IICE COc1ccc([C@H](C(C)C)n2nc(C(C)C)c(C=O)c2I)c(O)c1 2079998118 MJFFMNUXUCFGJA-KRWDZBQOSA-N 442.297 4.383 10 10 IICE OCc1ccc(N2CCCN(Cc3ccccc3)CC(F)(F)C2)cc1Br 2096468151 NOVYIIAHCNRDLN-UHFFFAOYSA-N 425.317 4.289 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CC3(CC3)CN2C(=O)OC(C)(C)C)c1O 2236055918 SLYTVUQWSUECSZ-ZDUSSCGKSA-N 441.366 4.043 10 10 IICE CC[C@@H]1CC[C@@H](NCc2c(Br)ccc(OC)c2O)CN1C(=O)OC(C)(C)C 2236056603 XBDSVNKDRBVZMT-ZIAGYGMSSA-N 443.382 4.431 10 10 IICE N=C1C(=Cc2ccc(-c3cccc(C(=O)O)c3)o2)C(=O)N=C2SC(c3ccccc3)=NN12 2293430021 ZERBJZQVEPIGAX-UHFFFAOYSA-N 442.456 4.312 10 10 IICE O=C1C(=Cc2cc3cc4c(cc3nc2O)OCO4)SC(=S)N1c1ccccc1F 2296604985 RVHPPROODZUTMT-UHFFFAOYSA-N 426.450 4.214 10 10 IICE O=C(CN1C(=O)/C(=C/c2ccccc2O)SC1=S)Nc1cccc(C(F)(F)F)c1 15035738 ZYXZYQHISALHER-NVNXTCNLSA-N 438.452 4.251 10 10 IICE CN(C)c1ccc(CNC(=O)CCCc2nc3cccnc3n2Cc2ccccc2)cc1 33072579 UIDZNYQSBZSNCT-UHFFFAOYSA-N 427.552 4.185 10 10 IICE COc1ccc(CN(C)C(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 683462486 GLVGHDBVCXNEEI-UHFFFAOYSA-N 435.568 4.084 10 10 IICE CC(C)[C@@H](NC(=O)N(Cc1ccc(N(C)C)cc1)Cc1ccco1)c1nnc2ccccn12 726283401 YVVSRGSYRGWFMO-HSZRJFAPSA-N 446.555 4.497 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@H]1CCOc2ccc(Br)cc21 745747708 IBZBBUPCPFDRNN-SFHVURJKSA-N 431.330 4.357 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)N(C)Cc3nc4c(s3)CCCC4)cc2F)C[C@@H](C)O1 747495722 MPVFUGPITJTDQR-IYBDPMFKSA-N 446.592 4.116 10 10 IICE COc1ccc(CN(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C2CC2)cc1 769039548 XLIACFFONOKGTH-UHFFFAOYSA-N 448.611 4.101 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)C1 769060335 PNBBCIRWFUVVCP-DHIUTWEWSA-N 430.662 4.034 10 10 IICE CC(C)N(C(C)C)S(=O)(=O)c1ccc(N2CC=C(c3ccc(Cl)nc3)CC2)nc1 773247487 MQCLPLOXQWODEZ-UHFFFAOYSA-N 434.993 4.231 10 10 IICE COC(=O)/C=C\c1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)C2)c([N+](=O)[O-])c1 773247872 NNEDZETYCOGQJN-VURMDHGXSA-N 445.516 4.008 10 10 IICE O=C([C@@H]1CCn2c(cnc2C2CCCCC2)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 777808460 BMXMLTWKWVLRSD-NFBKMPQASA-N 437.584 4.407 10 10 IICE COc1ccc(N2CCN(C(=O)c3c(Cl)cccc3Br)CC2)c(OC)c1 1132031961 DNRSUHTVLVZVTR-UHFFFAOYSA-N 439.737 4.082 10 10 IICE CC(C)(C)c1ccc2[nH]c(C(=O)NCc3ccc(N4CCC[C@@H](C(N)=O)C4)cc3)cc2c1 1136340399 OPNRDWJENOBHMM-GOSISDBHSA-N 432.568 4.097 10 10 IICE O=C(CSc1nccc2ccccc12)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1137438229 ISNUWJLEVIEFJQ-IBGZPJMESA-N 441.984 4.467 10 10 IICE COc1ccc(CN2CC[C@H]2CNC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1 1147930290 IEJBAFNMNAHGNZ-QFIPXVFZSA-N 433.552 4.116 10 10 IICE Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(-c3ccc(F)cn3)n2)c(C)n1-c1cccc(F)c1 1166240126 JZABGGGXLVZHAL-UHFFFAOYSA-N 437.406 4.422 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN(CC3CCC3)[C@H](C)c3ccccc3)CC2)cc1 1167453925 OXRKDIKOXIQMBV-GJZUVCINSA-N 437.628 4.041 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCC[C@@H]1CCCN1C(=O)OC(C)(C)C 1228516548 KQDHOUPWXQODMP-OAQYLSRUSA-N 432.609 4.464 10 10 IICE CC[C@H](C)c1nnc(N2CCSC[C@H]2C)n1Cc1ccc(N2CCSCC2)cc1 1291682216 PCKHPMLVWHVDPK-ZWKOTPCHSA-N 431.675 4.335 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 1299477649 CYEVSEDSMSMWLJ-GOSISDBHSA-N 437.971 4.285 10 10 IICE C[C@H](NC(=O)c1cc(Br)cc(I)c1)c1ccccc1O 1302538293 MIDATWZTCXBSKL-VIFPVBQESA-N 446.082 4.250 10 10 IICE COC1CCN(c2ccc(CN3C[C@@H]4CCC[C@@]4(NC(=O)OC(C)(C)C)C3)cc2)CC1 1307960381 LFJBPZIVVKEGLE-NBGIEHNGSA-N 429.605 4.181 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(I)c(Cl)c1 1353244978 GIIWIIXGPIJWIJ-UHFFFAOYSA-N 428.701 4.249 10 10 IICE O=C(C[C@@H]1CSc2ccccc2O1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1354767405 NZAYCRVZHRVRIY-CRAIPNDOSA-N 434.508 4.316 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1357323377 KTASXNFBWRUWHH-AZUAARDMSA-N 434.492 4.094 10 10 IICE COc1ccc2c(c1)[C@H](C(=O)NCc1ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c1)CCC2 1357836115 NNZXBOXSYQGDHL-CBGDNZLLSA-N 426.532 4.184 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3[C@@H](C)OC(C)(C)N3C(=O)OC(C)(C)C)cc2)CC1 1443669969 ZONFIYDEQDSDAA-WIYYLYMNSA-N 445.604 4.300 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1=C(c2ccccc2)SCCO1 1445883854 OHCSSSRGVBFHJM-LJQANCHMSA-N 444.984 4.258 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2c2cccn2C)c(C)n1-c1ccc(Br)cc1 1447529454 ZFKVARAWJWGDOY-NRFANRHFSA-N 442.357 4.409 10 10 IICE Cc1cc(CC(=O)N[C@](C)(CNC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1456045153 BEFYURKGMKVAGP-RUZDIDTESA-N 425.573 4.446 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCc1ccc(S(=O)(=O)CC)cc1 1458854442 CUVFJBAVHQESSH-UHFFFAOYSA-N 444.578 4.427 10 10 IICE CCOC(=O)c1n[nH]c([C@@H](CC(C)C)NC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)n1 1467595552 YVYATPNCYIUZLK-LJQANCHMSA-N 441.507 4.045 10 10 IICE CC(C)[C@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@@H](O)c1ccccc1 1467625624 KXLUPWGERIYJJS-SVBPBHIXSA-N 433.596 4.282 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(N(C)C(=O)OC(C)(C)C)s3)C2)cc1 1469281155 ZDHIUFMOFMKMKQ-INIZCTEOSA-N 445.585 4.384 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCC[C@H]1CN(C)C(=O)OC(C)(C)C 1470556420 USYXYZXNAROLTM-KNQAVFIVSA-N 446.636 4.423 10 10 IICE CCOC(=O)CN(CCCC1CCN(C(=O)OC(C)(C)C)CC1)Cc1ccccc1O 1473572379 OETARJCIYPBTCB-UHFFFAOYSA-N 434.577 4.185 10 10 IICE COCCN(CCNC(=O)N(Cc1ccccc1O)C1CCCCC1)C(=O)OC(C)(C)C 1478368655 PYMAUYFNWOVSOF-UHFFFAOYSA-N 449.592 4.120 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccncc4)[C@H](C)C3)cc2Cl)C1 1478528045 LHAIJASFUILUOO-RTBURBONSA-N 442.007 4.392 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC(O)(CC)CC 1495642006 WKBGTYKPQWMGIO-IBGZPJMESA-N 429.609 4.068 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1CCCCn1cc(Br)cn1 1508914943 JLLBITMBLDKSET-UHFFFAOYSA-N 447.381 4.183 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)N3CCCC3)nnc2N(CC)C2CCCC2)cc1 1515524281 TUVRWOLRGCTPGM-UHFFFAOYSA-N 438.620 4.178 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCO[C@](C)(CC)C2)cc1 1515529964 APZMVASBAKSBDF-RCZVLFRGSA-N 441.620 4.420 10 10 IICE CCO[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCC[C@@H]2CC)CCOC1 1516140251 DQXGFEALJQUMGL-XLNZFTOWSA-N 428.577 4.099 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S)OCC1CC1 1525601709 VFRKZBNCQMEKJE-WJDWOHSUSA-N 438.640 4.051 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1 1530895660 AELDXFYJKLIGES-UHFFFAOYSA-N 440.544 4.048 10 10 IICE Cc1c(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 1534241695 GCWQQPLKJYBHFH-UHFFFAOYSA-N 436.468 4.500 10 10 IICE COc1ccc(-c2cncc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)c2)c(C)c1 1539705547 FWYBREKPDVXFCD-VWLOTQADSA-N 432.568 4.164 10 10 IICE Cc1cc(C)cc(CN(C)C(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)c1 1543977292 QWCXIUPVKAYFGZ-UHFFFAOYSA-N 428.444 4.259 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ccn(-c2ccc(Br)cc2)n1 1545639634 XHLLLWYRZDNJHF-UHFFFAOYSA-N 426.314 4.149 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCCCC1CCN(C(=O)OC(C)(C)C)CC1 1556157923 MTTZCGNGYLTKHH-KRWDZBQOSA-N 434.577 4.353 10 10 IICE O=C(Nc1ccsc1C(=O)NCc1cc(O)ccc1O)c1ccc(Br)cc1 1558173986 ATEJWUGJDQEKLJ-UHFFFAOYSA-N 447.310 4.104 10 10 IICE COC1CCN(c2ccc(CN(C[C@H](O)COc3cccc(C)c3)C(C)C)cc2)CC1 1559561768 NWZQEYJWOFFNRE-DEOSSOPVSA-N 426.601 4.261 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@H](C)c3ccc(Cl)c(Cl)c3Cl)nc12 1559701241 PNDKJCVBGOPRFG-VIFPVBQESA-N 443.718 4.423 10 10 IICE C[C@]1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CC1(Br)Br 1570027792 XKRNDCZNSNXYIG-LLVKDONJSA-N 431.939 4.211 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](C)COc2c(F)cccc2F)CCCC1 1585962729 RIXALDBLVNCUOX-HNNXBMFYSA-N 428.479 4.391 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3sc(C)nc3-c3cccs3)C2)cc1 1598364159 NTAYTNOTSTWOQY-MRXNPFEDSA-N 427.595 4.374 10 10 IICE CCOC(=O)Cc1nnc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)s1 1611082001 YTLRXEYENFDGBF-UHFFFAOYSA-N 426.542 4.427 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC(c3cnn(C)c3)CC2)cc1 1615375225 HNLVVIZLHCLEHK-UHFFFAOYSA-N 435.620 4.414 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCc2ccc(Br)s2)N(C)C)cc1 1618636367 YEPQMIXOKWHQDC-SFHVURJKSA-N 438.435 4.318 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2CCN(CCc3ccccc3)CC2)c1 1624312309 YYNCMRLCJWOEFN-UHFFFAOYSA-N 429.564 4.344 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc(OCc2ccccc2)cs1 1628764775 ZMDDZKLAHBHJAO-UHFFFAOYSA-N 440.540 4.357 10 10 IICE Cc1cc(Br)ccc1C(=O)N1CCC[C@@H](C(=O)N[C@H](C)c2ccccc2O)C1 1632247333 ZGARSACFWWRVGZ-HZPDHXFCSA-N 445.357 4.193 10 10 IICE CCOc1ccc(N2CCN(C(=O)C[C@H](CC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1636706784 GGKAOCLORLGDIM-IBGZPJMESA-N 433.593 4.063 10 10 IICE COC(=O)c1cnc(SCc2cc(Cl)ccc2I)s1 1641152067 QFKCAVCCMLDGCS-UHFFFAOYSA-N 425.700 4.480 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 1642997902 QZPOTHSWDZLBPG-VBKZILBWSA-N 431.989 4.265 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@H](C)[C@H](C(=O)OC(C)(C)C)C3)ccc21 1643590035 PDMGPXBGQBIZDD-IIBYNOLFSA-N 428.573 4.344 10 10 IICE COc1ccc2c(c1)CN(CC(=O)NCc1ccc(N(C)C)cc1)[C@@H](c1ccccc1)C2 1653765176 WSBUBOFXHALLAC-AREMUKBSSA-N 429.564 4.177 10 10 IICE Cc1cc(CN2CCC(CO[C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)ccc1N(C)C 1655245453 FMIPFZXGILUTSD-QFIPXVFZSA-N 431.621 4.299 10 10 IICE COC(=O)c1cnc(SCC(=O)N(C)[C@@H](c2ccccc2)c2ccc(F)cc2)s1 1656581214 VHHAOSXVKGHWFD-IBGZPJMESA-N 430.526 4.409 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(c4cc(Cl)ccc4Cl)CC3)C2)cc1 1683782448 OEBFNQDUQPMRDO-QGZVFWFLSA-N 449.382 4.113 10 10 IICE CN(C)c1ccc(Cn2c(N(C)Cc3ccc(N4CCCC4)cc3)nnc2C(C)(C)C)cn1 1696611119 UVWCHDAHRZELHQ-UHFFFAOYSA-N 447.631 4.322 10 10 IICE CC[S@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1 1729229655 CWEFWIWMAGXCMX-MRRBFIHVSA-N 439.629 4.213 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2CCCOC2)n1CCC1CC(OC(C)(C)C)C1 1729420312 MOCOEISVZVCRND-CKHPTIKVSA-N 442.604 4.498 10 10 IICE Cc1cc(-c2nnc(Nc3ccn(C)n3)n2CCCOC(F)F)c(C)n1-c1ccccc1 1751411038 APWAZEHMJCAGIO-UHFFFAOYSA-N 441.486 4.459 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](c3nc(C)no3)C2)n1Cc1ccc(N(C)C)cc1C 1752742039 HUDOQIDPJQJWGK-OXQOHEQNSA-N 437.592 4.290 10 10 IICE CCc1nnc(N(C)[C@H]2CCC[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1764699986 BOFUGYCNHOIZTO-CVDCTZTESA-N 425.621 4.112 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CC3(SC)CC3)CC2)cc1F 1768704424 DEFRIKPLMOZYNN-UHFFFAOYSA-N 447.624 4.237 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@H](C)C1 1770784531 QASWUFPAUUCOKK-IEBWSBKVSA-N 443.592 4.279 10 10 IICE O=C(NC1CC1)c1nn(Cc2cccc(C(F)(F)F)c2O)c(C(F)(F)F)c1Cl 2079239494 CEPHYRWZKFQAGL-UHFFFAOYSA-N 427.732 4.220 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3c(O)cccc3Br)C[C@]2(C)C1 2116279453 XGLAPVBLPPHLJB-PJSUUKDQSA-N 425.367 4.280 10 10 IICE Brc1cc(N2C[C@H]3C[C@H]2CN(Cc2ccccc2)C3)ccc1CNC1CC1 2160686402 UFFVIZVZIYKIOY-AVRDEDQJSA-N 426.402 4.412 10 10 IICE CC1=NN(c2cccc(Cl)c2)C(=O)C1=CNc1ccc(S(=O)(=O)NC(C)(C)C)cc1 2297511338 CKSZNJUSAOXIBT-UHFFFAOYSA-N 446.960 4.135 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)C(=Cc3ccccc3O)SC2=S)cc1 2314831110 CPVYOZBUJVCWIE-UHFFFAOYSA-N 442.562 4.411 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccc(O)cc2)SC1=S)Nc1ccc(O)cc1 2314831404 KIIJBLJMUPZPSB-UHFFFAOYSA-N 442.562 4.498 10 10 IICE O=C(O)[C@@H](Cc1ccc(O)cc1)N1C(=O)C(=Cc2c(F)cccc2Cl)SC1=S 2323809156 DLPYNADYUZVDAG-OAHLLOKOSA-N 437.901 4.082 10 10 IICE COC(=O)c1ccc(C=C2C(=O)N(Cc3ccc(F)cc3)N=C2c2ccc(OC)cc2)cc1 2332139312 SSLWBMVHXANJEC-UHFFFAOYSA-N 444.462 4.451 10 10 IICE Cc1ccc(N2N=C(C(F)(F)F)C(=Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C2=O)cc1 2332141501 YXWCTHVUGLKUHB-UHFFFAOYSA-N 433.342 4.023 10 10 IICE Cc1ccc(CN[C@@H]2CN(C(=O)OC(C)(C)C)[C@H]3CCC[C@H]23)c(O)c1Br 2352679349 IZKRGAUKCKENQN-OAGGEKHMSA-N 425.367 4.341 10 10 IICE COc1cc2c(NCc3ccc(N4CCOCC4)cc3C(F)(F)F)ncnc2cc1F 302314106 PSEQUFPMBSLZGE-UHFFFAOYSA-N 436.409 4.245 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 730137968 GFSBWXFIIWGULX-GOSISDBHSA-N 443.544 4.344 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)COC(=O)c2cnc(-c3cnn(C)c3)s2)c1C 732689313 YUGVXBWBHBSUCN-UHFFFAOYSA-N 434.521 4.299 10 10 IICE COC(=O)Cc1ccc(S(=O)(=O)Nc2nc(-c3c(C)cc(C)cc3C)cs2)cc1 733730746 FRVVURQBPUHZRB-UHFFFAOYSA-N 430.551 4.252 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccn(-c3cccc(Cl)c3)n2)cc1 751402997 AYCOCOVWBNABTO-JOCHJYFZSA-N 438.959 4.413 10 10 IICE C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 754143477 ZLKVKDNTKJMZMY-NTCAYCPXSA-N 449.429 4.170 10 10 IICE Cc1nn(C)c(C)c1CCN[C@H](C)c1cc(Br)cc(Br)c1O 756380059 SGSUZQCKUGRIMP-SECBINFHSA-N 431.172 4.161 10 10 IICE CCCN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C1CCN(c2cc(C)nc(C)n2)CC1 769422966 NXVPDDDDSHJZAG-UHFFFAOYSA-N 433.940 4.242 10 10 IICE CCOC(=O)C[C@H]1C[C@@H](OC)CN1C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 775971946 AYJJWAMWIKVEFD-WOJBJXKFSA-N 438.528 4.351 10 10 IICE Cc1cc(Cl)cc(CNCc2ccccc2CS(=O)(=O)N2CCC(C)CC2)c1O 776251980 GISZPSNZJFREJS-UHFFFAOYSA-N 437.005 4.206 10 10 IICE CC[C@@H](C)NS(=O)(=O)Cc1cccc(NCc2cc(C)cc(Br)c2O)c1 781635341 GFAWHCVVWVSQOH-CQSZACIVSA-N 441.391 4.293 10 10 IICE Cc1cc(Br)c(O)c(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1 781637706 XJGLXQMQRXYHHR-UHFFFAOYSA-N 444.417 4.285 10 10 IICE C[C@@](CO)(NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 796472303 WVNVOWZMZKLPJU-NRFANRHFSA-N 448.361 4.345 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3CCC(C(=O)N4CCCC4)CC3)c2C)cc1F 800743980 WLMBCSLQKSXJEX-UHFFFAOYSA-N 425.548 4.059 10 10 IICE Cc1cccc(-c2nnnn2[C@@H]2C[C@H]2C)c1NC(=O)NCc1ccc(N2CCCC2)cc1 806468867 HEPAFKYMUWAJJY-DYESRHJHSA-N 431.544 4.151 10 10 IICE Cc1cc(C(=O)COC(=O)[C@H]2CCCN2C(=O)c2ccccc2)c(C)n1-c1ccccc1 912681586 HSUMXMJGDIXMDI-HSZRJFAPSA-N 430.504 4.125 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)sc2c1CCCC2 1124635400 XWLNXLFWZJBNFU-GFCCVEGCSA-N 432.929 4.059 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1 1125160736 MXGHDUZORZYZOR-UHFFFAOYSA-N 432.407 4.422 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H]1CCc2ccc(F)cc21 1125965788 QPVWEYYYLTYNSD-NPBUNYCVSA-N 444.528 4.360 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](C)Oc1ccc(F)cc1Br 1129974401 OLIDZWZZMBKWRC-LSDHHAIUSA-N 437.353 4.477 10 10 IICE Cc1cc(C(=O)NCC(C)(C)C2(O)CCOCC2)c(C)n1-c1ccc(Br)cc1 1142572990 VQBIOROVCIYWON-UHFFFAOYSA-N 449.389 4.154 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(F)cc1 1147362148 YMHVCDMKIPWYFL-OAQYLSRUSA-N 425.891 4.422 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCC(CO)(C(F)(F)F)CC3)cc2Cl)C1 1235832766 GRTGIBDMOVJOHJ-OAHLLOKOSA-N 447.929 4.423 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@H]3c4ccccc4CC[C@H]3O)cc2Cl)C1 1235833619 LIERWOOCIFWKMS-AVIJNYRZSA-N 427.976 4.424 10 10 IICE CCCN(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)[C@H]1CCc2ccccc21 1251750860 PNXWPEZUXMXSEI-QFIPXVFZSA-N 429.511 4.411 10 10 IICE C[C@H]1CCCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1291089843 MBDHLFDPGYCXRH-SFHVURJKSA-N 429.584 4.226 10 10 IICE Cc1nc(O[C@H](C)C(F)(F)F)ccc1C(=O)NCc1cccc(Br)c1O 1297440798 QNDGNOJWKUZUQX-SNVBAGLBSA-N 433.224 4.118 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(Cl)cn3)c2C)c(OC)c1 1307263056 DFJGLJSHUXFIGS-UHFFFAOYSA-N 428.872 4.199 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1314750968 OZACIYSUVGGDTK-UHFFFAOYSA-N 438.582 4.321 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)Cc1cccc(I)c1 1349118248 ODPQPRBLDANIIM-UHFFFAOYSA-N 434.321 4.093 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](CO)Cc1cccc(Br)c1 1447667757 RHQMUGOYQUZDDX-QGZVFWFLSA-N 447.398 4.499 10 10 IICE CCOC(=O)[C@]1(COC)CCCN(C(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)C1 1448192414 NRPQVUCICULWSZ-HSZRJFAPSA-N 432.948 4.179 10 10 IICE CC(C)C[C@@H](CC(=O)NCc1cccc(Br)c1O)NC(=O)OC(C)(C)C 1448961086 NBUKKABSZQRFAA-AWEZNQCLSA-N 429.355 4.100 10 10 IICE O=C(NCc1cc(O)ccc1O)c1cccnc1Oc1ccc(F)cc1Br 1455357134 OMDCTEZGCUZKNQ-UHFFFAOYSA-N 433.233 4.117 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3ccc(OCCOc4ccccc4)cc3)CC2)cc1 1458036735 ACUGLAATZDMCFW-UHFFFAOYSA-N 446.547 4.044 10 10 IICE Cc1cccc(C2=CCN(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)CC2)c1 1470449282 LZICIWSWLCKNCK-UHFFFAOYSA-N 427.495 4.109 10 10 IICE COc1ccc(CN(C)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)cc1OC(F)F 1470556208 OKJVZCSYWDBPHT-MRXNPFEDSA-N 435.515 4.444 10 10 IICE CCN(Cc1nc2c(s1)C[C@H](C)CC2)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1471546483 CENPLUVERVVQBZ-UTKZUKDTSA-N 443.661 4.168 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3C[C@H](CNC(=O)OC(C)(C)C)C3)c2C)cc1 1472272374 OACCMMRMMMYYBG-IYARVYRRSA-N 427.545 4.136 10 10 IICE CCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)Cc1ccc(OC)cc1 1473714356 DGCYNRUYEFPFTQ-UHFFFAOYSA-N 442.515 4.321 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(Cc2ccncc2)n1CC(F)(F)F 1503474383 ZLPUQFWYFAIESW-UHFFFAOYSA-N 430.478 4.063 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccncc2)nnc1N1CCS[C@H](C)[C@H]1C 1510684027 WGPYYSRARMUJGN-RTBURBONSA-N 436.629 4.017 10 10 IICE CCc1nnc(N2CCC[C@H](n3nc(C)cc3C)C2)n1CCCSc1nccs1 1513891132 FGMKTLKYKOLKJI-KRWDZBQOSA-N 431.635 4.134 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@H](COC)C2)cc1 1515530871 GFUYLIKYABJOKV-JTHBVZDNSA-N 441.620 4.277 10 10 IICE CCOC[C@@H]1CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1516636320 AUJSOPBWNUNCTG-NFBKMPQASA-N 441.620 4.195 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2ccn(CCc3ccccc3)n2)cc1 1520969104 BGLCFIOBIKMGPD-UHFFFAOYSA-N 430.474 4.397 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3sc4cccc(F)c4c3Cl)cc2)C1 1527735471 UAHROAPJADPNHV-AWEZNQCLSA-N 445.947 4.326 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2cc(F)ccc2CS(C)(=O)=O)c1 1533776952 MALMLRWEQDQWAM-UHFFFAOYSA-N 448.947 4.361 10 10 IICE Cc1cc(CNC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1-c1ccccc1 1535142473 BWOGRBTZFNOROY-UHFFFAOYSA-N 430.957 4.228 10 10 IICE CCO[C@@H]1C[C@](NC(=O)OC(C)(C)C)(C(=O)NCc2ccc(N(CC)CC)cc2)C1(C)C 1542089500 QETINRLZZMUMLH-NLFFAJNJSA-N 447.620 4.248 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cc(F)cc(N3CCOCC3)c2)cc1 1544474764 MYUIIZDOWISZLX-UHFFFAOYSA-N 435.499 4.064 10 10 IICE CN(C)c1ccc(Cn2c(N3CCC[C@H](C[C@@H]4CCOC4)C3)nnc2C(C)(C)C)cc1F 1552836759 JLLFSGRDDNSDGN-QUCCMNQESA-N 443.611 4.472 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H]3CCC[C@@H]3C)CC2)cc1F 1554960219 CMWTWAHBRWCGBU-RBUKOAKNSA-N 429.584 4.387 10 10 IICE O=C(NCc1c(O)cccc1F)c1nn(-c2c(Cl)cc(Cl)cc2Cl)cc1O 1559037159 LPERBZKRXOABGB-UHFFFAOYSA-N 430.650 4.313 10 10 IICE OC1CCN(c2ccc(CNc3nc(C(F)(F)F)c(Br)s3)cc2)CC1 1559244313 WRSRYDLWMIJCAT-UHFFFAOYSA-N 436.297 4.498 10 10 IICE Cc1cc(CN2CC[C@@]3(C2)CN(C(=O)OC(C)(C)C)CCO3)ccc1N1CCCCC1 1560142280 OZUGGIQFQVAJDA-RUZDIDTESA-N 429.605 4.197 10 10 IICE Cc1cc(C(=O)NC(C)(C)CCN2CCOCC2)c(C)n1-c1cccc(Br)c1 1585292410 JHXJHVBELPYEKZ-UHFFFAOYSA-N 448.405 4.087 10 10 IICE CCCCN1CCC(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1585303435 VLKPGTROBSKHBI-UHFFFAOYSA-N 433.394 4.246 10 10 IICE Cc1cccc(CN2CCO[C@@H](CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)C2)c1 1587489246 DCJSDAGFYWJLCZ-DEOSSOPVSA-N 431.580 4.342 10 10 IICE CCOC(=O)N1[C@H](C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)CC[C@H]1c1ccc(C)o1 1597800731 OMYACGGLIWUYOQ-HSQYWUDLSA-N 441.572 4.372 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc(-c2cccc(C)n2)n1CCCSc1nccs1 1615569206 ZCCGFBUNJCLIBA-QGZVFWFLSA-N 444.630 4.293 10 10 IICE C[C@H](Sc1nc2ccccc2s1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1616858198 IUXBHQNEEAKDIY-HNAYVOBHSA-N 428.627 4.262 10 10 IICE C[C@@H]1Nc2ccnn2[C@@H](C)[C@@H]1CCC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1626479142 CFHZJFKMXRUZRV-TWOQFEAHSA-N 447.530 4.041 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 1627359473 YMEMFYFIJRSTBG-UHFFFAOYSA-N 449.282 4.182 10 10 IICE Cc1ccc(CCNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1629160628 TYGVAIFRRPTOLJ-XMHGGMMESA-N 428.554 4.084 10 10 IICE Cc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1634725206 RUFBUCYZHWCJJD-QGZVFWFLSA-N 449.345 4.345 10 10 IICE Cc1cc(C(=O)N2CC[C@H](N3CCC3)[C@@H](F)C2)c(C)n1-c1ccc(Br)cc1 1635745748 QUJBNIZZSDETHY-PMACEKPBSA-N 434.353 4.115 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](C(=O)OC(C)(C)C)C(C)C)cc1 1639240454 HZPISWDGOUVBDH-JOCHJYFZSA-N 426.557 4.179 10 10 IICE Cc1cc(CNC(=O)[C@]2(C)C[C@H](NC(=O)OC(C)(C)C)CCO2)c(C)n1-c1ccccc1 1643369372 CRHDDPOJLZDUPQ-NLFFAJNJSA-N 441.572 4.173 10 10 IICE Cc1cc(CN2Cc3ccccc3C[C@H]2C(=O)NCCc2ccc(F)cc2)ccc1N(C)C 1644337767 BHCAXTLCSLFYRQ-MHZLTWQESA-N 445.582 4.486 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H](O)[C@H]3c3ccc(Br)cc3)cc2)CC1 1655242428 LMBQAGVWLJBHRK-DHIUTWEWSA-N 445.401 4.372 10 10 IICE Cc1cc(CN2CCC(CO[C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)ccc1N(C)C 1655245452 FMIPFZXGILUTSD-JOCHJYFZSA-N 431.621 4.299 10 10 IICE CCCN(CCc1cccc(F)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683014182 KMPMOIWMDAZJII-UHFFFAOYSA-N 435.490 4.105 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@]2(C)Cc2ccccc2F)N(C)C)cc1 1684607962 XYPLCQNPLQVWKT-ILBGXUMGSA-N 426.580 4.301 10 10 IICE C[C@@H]1CCC[C@](Cn2c([C@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1708027835 RKHYIGYKLHDNFG-QVNIBDNGSA-N 441.620 4.025 10 10 IICE C[C@H]1[C@H](C)CCN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1726599873 YSSAYVDGYXYCLY-MOPGFXCFSA-N 425.621 4.067 10 10 IICE CC[C@@H](C)c1nnc(N2CCSC(C)(C)C2)n1Cc1ccc(N2CCOCC2)cc1 1743804288 ZQFWQVPHZZQPLH-GOSISDBHSA-N 429.634 4.008 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1C[C@H]1CCCN1C(=O)OC(C)(C)C 1767111948 LDAKKGAHQLOEMC-GOSISDBHSA-N 443.592 4.317 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccsc2)n1C[C@@H](c1ccco1)N(C)C 1767112710 AUWZHAXQPMDOKE-IBGZPJMESA-N 437.569 4.168 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc(Br)cc2)N2CCCCC2)cc1 1858074370 HZDPCBHPXPPYPA-OAQYLSRUSA-N 430.390 4.472 10 10 IICE O=C(N[C@]1(c2cccc(F)c2O)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952777027 XXYSIVIKWQCRTK-CPJSRVTESA-N 433.435 4.370 10 10 IICE CN[C@@H](c1ccc(N(C)C)cc1)[C@@]1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)C1 2044751719 DQJXJKACXVJPAW-JYFHCDHNSA-N 438.616 4.183 10 10 IICE Oc1cccc(Br)c1CN[C@H]1CN(Cc2ccccc2)C2(CCOCC2)C1 2156293682 VXBXMZAOIPPICB-GOSISDBHSA-N 431.374 4.068 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1CCNCc1cc(Br)ccc1O 2226208810 XMNHLVJWOCYVQW-CQSZACIVSA-N 435.309 4.279 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(c4cccnc4)SC3=NC2=O)c(C)n1-c1ccc(F)cc1 2297469621 IWJBCAJRZWRQPY-UHFFFAOYSA-N 444.495 4.296 10 10 IICE Cc1ccc(N2C(=O)NC(=O)/C(=C\c3cccn3CCOc3ccccc3)C2=O)cc1Cl 2215771 WSTKILZJXWILGY-XSFVSMFZSA-N 449.894 4.195 10 10 IICE Cc1ccc(CCNC(=O)c2cnn3c(O)c(Cc4cc(C)ccc4C)c(C)nc23)cc1 3008216 GGCUISWDFWTJPR-UHFFFAOYSA-N 428.536 4.232 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1F 743323809 QUOSNLXKDSDXEB-IBGZPJMESA-N 429.536 4.034 10 10 IICE O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1[C@@H]1CCCc2cn(C3CCCC3)nc21 762327767 PRZXFDZTXLNAKZ-GOSISDBHSA-N 428.920 4.199 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)c1 804646535 FEUQYANJGGLZNE-UHFFFAOYSA-N 438.959 4.419 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 804736444 SRLOFRPLKOBZEF-UHFFFAOYSA-N 442.191 4.154 10 10 IICE Cc1cc(-c2nnc(N3CCCO[C@@H](C)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 812251924 JRXQKVXMNBXILT-UGKGYDQZSA-N 435.572 4.147 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)/C=C\c1ccc2ccc(Cl)cc2n1 912873653 ONXPOMBNRBSYAV-RAXLEYEMSA-N 437.927 4.169 10 10 IICE CC(=O)Nc1cc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)ccc1C 919177105 QMPUAGDPTRIPFP-UHFFFAOYSA-N 448.475 4.129 10 10 IICE CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1128490705 YERBIEWVBOKSHL-HJPURHCSSA-N 425.960 4.170 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c1 1129641331 SSZPQADHMFSPDS-GOSISDBHSA-N 447.963 4.113 10 10 IICE CCC[C@@H](C)C(=O)NCCNC(=O)c1cc(C)n(-c2cccc(Br)c2)c1C 1159022493 COZRTDVVKAOASR-CQSZACIVSA-N 434.378 4.139 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2C[C@@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)cc1 1162149128 ORKUDPWUJFNABC-LAUBAEHRSA-N 438.568 4.275 10 10 IICE CC[C@@H]1CN(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)CC[C@H]1NC(=O)OC(C)(C)C 1230194820 GBLUVIZBZWNXEG-WOIUINJBSA-N 446.636 4.327 10 10 IICE Cc1cc(CNC(=O)c2oc3ccccc3c2CS(C)(=O)=O)c(C)n1-c1ccccc1 1287662151 WGKLJSPPYJRLBJ-UHFFFAOYSA-N 436.533 4.315 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccccc3O)n2CCSCC(F)(F)F)o1 1289538012 AOFNHPXJRISMNF-UHFFFAOYSA-N 426.464 4.484 10 10 IICE CCCn1c(C)c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c2cc(OC)ccc21 1289600967 XETOWOPEKNFDOR-XMMPIXPASA-N 436.600 4.467 10 10 IICE Cc1cnc([C@@H](C)Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)s1 1290293953 PIGPZAXVHSSBOC-KXBFYZLASA-N 427.574 4.430 10 10 IICE Cc1csc(CCCCn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1290329172 NVDIGBOCEIOCFB-LJQANCHMSA-N 441.601 4.302 10 10 IICE CCOCc1nnc(N2CCS[C@@H](C)[C@H]2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1297345855 ZOUWDEMOCLENCN-UXHICEINSA-N 443.661 4.429 10 10 IICE CCC[C@@](C)(O)Cn1c(-c2cccc(C)n2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1306537429 SLLRGQCEWZNJMU-AREMUKBSSA-N 448.615 4.436 10 10 IICE COc1ccc2ccccc2c1CCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1313271985 YQHRIVXXFJMBDF-NRFANRHFSA-N 434.536 4.487 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)nc1 1355015813 RDMJPEPDHLLKCD-OAQYLSRUSA-N 430.552 4.217 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@H](C)C2 1355244939 IFVIKCLDGHWCMW-GJZGRUSLSA-N 444.553 4.018 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(C(C)C)c3-c3ccccc3)CC2)c(OC)c1 1438186994 VLRMGOAWCFLTGU-UHFFFAOYSA-N 434.540 4.111 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]3[C@@H]2CCCN3C)sc(C)c1-c1ccccc1 1460731260 QUHSMZRCXHXHJE-OALUTQOASA-N 441.597 4.007 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnnn1-c1c(Cl)cccc1Cl 1460983884 QTUMDRKUIIDXFP-AWEZNQCLSA-N 432.355 4.310 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(NC(=O)OC(C)(C)C)cc3)C2)cc1 1461077990 REUDLUNIQSMZPZ-LJQANCHMSA-N 439.556 4.227 10 10 IICE Cc1ccc(C(=O)NC2CC2)cc1NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 1464208697 FQDHILFTWZDGMT-UHFFFAOYSA-N 429.520 4.288 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2c2ccccc2Cl)c(O)c1O 1467452175 NCUUFNQCISHQRW-GOSISDBHSA-N 446.931 4.494 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c(C)n1-c1ccc(Br)cn1 1468281099 QYYQXDVQZSDVNY-QXAKKESOSA-N 432.362 4.017 10 10 IICE O=C(NCCOc1c(Cl)cc(Br)cc1Cl)c1c(F)ccc(O)c1O 1472540905 TXRINUSBQRXQAY-UHFFFAOYSA-N 439.064 4.115 10 10 IICE CC1(C)CCN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C[C@H]1c1ccccc1 1479343395 HFTDVQWIYQFPTI-DEOSSOPVSA-N 448.611 4.114 10 10 IICE COC[C@H]1CCN(c2nnc(Cc3ccccc3F)n2CCCSc2nccs2)C1 1504703568 FHLWOGSRTKDHPB-INIZCTEOSA-N 447.605 4.120 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1CCCc1cnn(C)c1 1509131039 DPOJHJIQTCXNRR-UHFFFAOYSA-N 435.620 4.080 10 10 IICE COCC[C@H]1CCN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C1 1519011712 OYZNLZVPPNIEGZ-LJQANCHMSA-N 425.621 4.160 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCCc1ccc(Cl)cc1 1521697216 GQYZRHJDXZZNCI-AQTBWJFISA-N 448.972 4.429 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCC1(c2ccccc2)CC1 1524064373 ZHVXLCWXUIAEQQ-XMHGGMMESA-N 440.565 4.265 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H](CC)N2CCCC2=O)sc(C)c1-c1ccc(F)cc1 1531739934 LGAVXTNNCVIOFP-MRXNPFEDSA-N 432.517 4.379 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1(c2ccc(F)cc2)CC1 1534131905 GJEJCZCHRCXVKG-AQTBWJFISA-N 444.528 4.362 10 10 IICE Cc1nc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)sc1Br 1545040832 ICDDZGDWDWNBGU-LLVKDONJSA-N 446.317 4.214 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C2)CCCC1 1557184951 WJAYRLJPVQHGQG-UTKZUKDTSA-N 440.584 4.355 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(Cc2cccc(OCc3ccccc3)c2)CC1 1557876104 NMNOHFJGLJWEPZ-BENRWUELSA-N 444.531 4.034 10 10 IICE CN(CC(=O)N1c2ccccc2NC(=O)C1(C)C)c1ccc(OCc2ccccc2)cc1 1559756193 SQYQLHRSBQHUOX-UHFFFAOYSA-N 429.520 4.466 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)N[C@H]1CCCc2c(F)cc(F)cc21 1564839602 KKIONDRGEGGWIC-QHCPKHFHSA-N 429.511 4.050 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NCCOc2ccc(Cl)c(Cl)c2)cc1 1564840627 VRELVJWXOXIIJH-UHFFFAOYSA-N 426.344 4.159 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3cc(Br)cn(C4CC4)c3=O)cc2)CC1 1565663563 HLKFUJJECGCXHP-UHFFFAOYSA-N 444.373 4.112 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(F)cc3NC(=O)OC(C)(C)C)CC2)cc1 1566326544 QGZJXOHUXBHCCJ-UHFFFAOYSA-N 429.492 4.144 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(Br)cc(N4CCCC4)c3)ccc21 1583627750 GJHSJBVUXXMTJY-UHFFFAOYSA-N 428.374 4.362 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CN(C(=O)c1ccccc1)c1ccccc1 1584096494 XRJKVOOEEDKZDC-NRFANRHFSA-N 429.564 4.455 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)cc1 1584698291 ROJWNUYICGXKDN-NRFANRHFSA-N 441.453 4.426 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)c2C)c1 1587881104 RWVQTQUYMZENRI-UHFFFAOYSA-N 429.480 4.426 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(I)c(O)c1 1596954802 YASXUIDWFMXVSP-UHFFFAOYSA-N 438.309 4.114 10 10 IICE CS[C@H]1CN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C[C@H]1N1CCCC1 1611064585 LHWGZWLNOKHAGS-YADHBBJMSA-N 432.033 4.328 10 10 IICE COc1cc(N(C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC 1611773983 NFOIHMQNFVLZDW-UHFFFAOYSA-N 447.797 4.359 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](c2cccc(Br)c2)N2CCCC2)c1 1630366681 VWHYDSCUOPKQDG-JLTOFOAXSA-N 433.346 4.178 10 10 IICE CCOC(=O)c1c[nH]nc1[C@@H]1CCN(C(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)C1 1641510521 HJTLRHVZXGTLEI-MRXNPFEDSA-N 440.931 4.277 10 10 IICE COc1cc(N2CCN(Cc3cccc(C)c3Br)CC2)cc(OC)c1OC 1653226536 RGGNNAHIRRLQON-UHFFFAOYSA-N 435.362 4.106 10 10 IICE COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N[C@H](C)c1ccccc1O 1659815853 WRFXWFPWBNGZPY-ZIAGYGMSSA-N 426.435 4.114 10 10 IICE NC(=O)C1CCN(c2ccc(CNC(=O)NCc3ccc(-c4ccccc4)s3)cc2)CC1 1674711882 BVCOUBNLNXNPOH-UHFFFAOYSA-N 448.592 4.116 10 10 IICE CC1(C)C[C@H](NC(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ccc(F)cc2O1 1679299165 DWFLYLMCSPEPEQ-IBGZPJMESA-N 449.473 4.042 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)cc2Cl)C1 1680357874 LNTPJKZCLDFYCJ-JKSUJKDBSA-N 439.000 4.289 10 10 IICE CN1CC[C@@H](CNC(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccc(Cl)c(F)c1 1681171549 ZQQAOXHLXUIDAH-UGSOOPFHSA-N 426.319 4.330 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](CCO)Cc3ccccc3)cc2Cl)C1 1682024325 QANGJVTZFPTJCP-GHTZIAJQSA-N 429.992 4.369 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4c(Br)cccc4C3)C2)cc1 1682188720 ZBUOAQVWUDYPTO-MRXNPFEDSA-N 444.373 4.052 10 10 IICE CCc1nnc(N(C)[C@@H](C)C2CCCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1694648851 WFDVGTKJGSETPL-SFHVURJKSA-N 429.584 4.270 10 10 IICE Cc1nc(CCn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)sc1C 1706992308 WUZKMWPGCPLYLM-IBGZPJMESA-N 427.574 4.178 10 10 IICE CC[C@@H]1C[C@H](C)CN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1709220955 WODIANOKQBYXHO-FXAWDEMLSA-N 434.588 4.114 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCOC[C@@H]1OC 1710030989 ZJISOVNWOCLFNI-REWPJTCUSA-N 437.588 4.250 10 10 IICE Cc1nnc(N2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)n1CCCSc1nccs1 1742813885 BKPIMTVZJLMRQI-QGZVFWFLSA-N 445.589 4.464 10 10 IICE CCC1(CC)CCN(c2nnc(C(=O)N3CCCC3)n2CCCSc2nccs2)C1 1744261773 FIVNEWYHBWANPH-UHFFFAOYSA-N 448.662 4.170 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC(C)(C)C)OC 1749324347 JDBSGRIBRDYRPM-NRFANRHFSA-N 439.604 4.496 10 10 IICE C[C@H]1C[C@H](C)CN(C(C)(C)Cn2c([C@H]3CCCO3)nnc2N(C)Cc2ccccc2O)C1 1751996315 XSYSYLIEUQVFKO-CNNODRBYSA-N 441.620 4.228 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4C)c(C)s2)c(C)c1 1859572485 LCDZHYNRZGLZLR-UHFFFAOYSA-N 441.578 4.445 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(c4ccc5c(c4)OCO5)C3=O)n12 1860074903 YVEBLXFKIKXABB-WLRTZDKTSA-N 435.939 4.492 10 10 IICE CCN1CCc2cc([C@@H](N)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999537488 ZMMOJRZVZPEBPT-FYYLOGMGSA-N 425.573 4.179 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]2CC[C@@]21CNCc1cccc(Br)c1O 2089360180 VCOYUNABVACMHW-FOIQADDNSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N[C@H]1c2ccccc2C[C@@H]1NCc1ccc(Br)cc1O 2144131260 XKFICJIMDXIZEC-HKUYNNGSSA-N 433.346 4.435 10 10 IICE COc1ccc(Br)c(CN[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)c1O 2227750646 ZGLHGNIJYRVHDC-LJQANCHMSA-N 429.355 4.043 10 10 IICE CCN(CC)c1ccc(C=c2sc3nc(C=Cc4ccc(Cl)cc4)nn3c2=O)cc1 2296718426 BKXLPZAXJPWXBT-UHFFFAOYSA-N 436.968 4.369 10 10 IICE CCOc1c(Br)cc(C=C2C(=O)N(C)N=C2c2ccc(OC)cc2)cc1OC 2332126859 LPYDWGXGHPZASR-UHFFFAOYSA-N 445.313 4.125 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380744199 CIAMSLWEYGGCJJ-HUUCEWRRSA-N 441.366 4.163 10 10 IICE CCOC(=O)N1CCN(c2cc(NC(C)C)c3c4c(onc24)-c2ccccc2C3=O)CC1 9641728 NVNIVGTXQQNQFJ-UHFFFAOYSA-N 434.496 4.138 10 10 IICE O=C1/C(=C\c2ccc(I)o2)SC(=S)N1Cc1ccccc1 33322132 ZCMWHIDGUNYIDU-XYOKQWHBSA-N 427.288 4.286 10 10 IICE CCC1=NN2C(=N)/C(=C\c3ccccc3OCCOc3ccc(C)cc3)C(=O)N=C2S1 33726684 JPZZPWYIOXKZBU-UQIYEGRLSA-N 434.521 4.482 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccc(F)cc4)C3=O)c2C)c1 59271054 PCDQAZNHXNWCQG-VWLOTQADSA-N 433.483 4.192 10 10 IICE COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/C(=O)N(c3cccc(C(=O)O)c3)N=C2C)o1 100288808 BFKAQVYUXBBGHJ-XDHOZWIPSA-N 447.403 4.368 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3cccc(Br)c3O)C[C@H]2C1 401140044 VCPFGEZHRSWYSI-HRCADAONSA-N 425.367 4.280 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@H]1C[C@@H]1c1cc(F)ccc1F 741542518 RJCDKNDQHAPSQY-AEFFLSMTSA-N 440.412 4.240 10 10 IICE CCOC(=O)c1csc(C2CCN(C(=O)N[C@@H](C)c3ccc(N(C)C)cc3)CC2)n1 759150316 RZGHPTPABPQQNC-HNNXBMFYSA-N 430.574 4.036 10 10 IICE O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(Cc2ccc(N3CCOCC3)c(F)c2)CC1 769306849 DFOHXMRBOBXXCF-QHCPKHFHSA-N 443.950 4.264 10 10 IICE COc1c([N+](=O)[O-])cc(N2CCC[C@@H](C(F)(F)F)[C@H]2C)c([N+](=O)[O-])c1Br 775547452 PHBSDYGNYQCKAR-HTQZYQBOSA-N 442.188 4.441 10 10 IICE O=C(NCc1cc(Br)ccc1O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 804739799 UDWFHDMOHNBXIE-HUUCEWRRSA-N 425.120 4.337 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1cc2c(cc1Cl)OCCCO2 806178049 OBALNRMSIAJWDI-UHFFFAOYSA-N 427.682 4.291 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1nc2c(s1)CCC2 1124592407 VVXYOBYWDPNKNP-GDNBJRDFSA-N 433.555 4.001 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cnc(F)c(Br)c2)cc1 1124885600 YSICWORKPLNKAA-UHFFFAOYSA-N 432.293 4.485 10 10 IICE Cc1cc(CCNC(=O)[C@H](C)CS(=O)(=O)c2ccc(F)cc2)c(C)n1-c1ccccc1 1131782161 VZLBXNDGGJWOQF-QGZVFWFLSA-N 442.556 4.002 10 10 IICE Cc1noc(C[C@@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)n1 1134484016 LWXHSXNVHNMZQX-SFHVURJKSA-N 426.948 4.463 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1 1141812212 NRMQFGLVPQVXNP-UHFFFAOYSA-N 430.552 4.301 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1 1142410325 INILESAJZFOIBJ-UHFFFAOYSA-N 428.598 4.278 10 10 IICE CCOc1ccc(OCCCC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1150347940 LYDBIJMISJDEJV-FQEVSTJZSA-N 446.975 4.384 10 10 IICE COC1CCN(c2ccc(CN3CCN(C(=O)c4c(F)cccc4Cl)CC3)cc2)CC1 1190819889 ZPWRLBABAKXWSG-UHFFFAOYSA-N 445.966 4.052 10 10 IICE Ic1ccc([C@@H]2CCCN2Cc2ccc(N3CCOCC3)cc2)cc1 1192918951 QMENXPDNWFRDSB-NRFANRHFSA-N 448.348 4.465 10 10 IICE C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)N1CC[C@@](C)(C(F)(F)F)C1 1197555805 YRJOXOSXBYQOGK-WHEQGISXSA-N 430.426 4.063 10 10 IICE Cc1cccc(CN2CCN(C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2)c1 1233975116 WTVREYHSZIDDMG-UHFFFAOYSA-N 430.596 4.472 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)CC1 1251602517 JORKWCPMRIWLHQ-QGZVFWFLSA-N 431.577 4.107 10 10 IICE CCN(CC)Cc1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1291755249 BNHQZTGCUAXWNE-KDURUIRLSA-N 427.564 4.211 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)c3ccccc3C2)c(C)n1-c1cccc(Cl)c1 1296784700 ZXLGXRYTTKXAFN-UHFFFAOYSA-N 428.941 4.177 10 10 IICE CC1CCN(c2ccc(Cn3c(C4CCC4)nnc3N(C)CCCCCO)cc2)CC1 1305065569 HUJMPJLZWNMJBL-UHFFFAOYSA-N 425.621 4.429 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](c3ccnn3C)C2)n1Cc1ccc(N(C)C)c(F)c1 1305483913 YLDVNUOZCLHNAD-PKOBYXMFSA-N 439.583 4.163 10 10 IICE CN(Cc1cccc(C(F)(F)F)c1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1312833737 MIXXXYDCKJGUIX-UHFFFAOYSA-N 443.416 4.162 10 10 IICE CSCCCCn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1316463798 OQOWGSIENKIUOV-HXUWFJFHSA-N 429.634 4.162 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(OC(F)(F)F)cc1 1356422291 SJAUMCAFHFZCNF-UHFFFAOYSA-N 433.474 4.047 10 10 IICE COc1ccccc1Oc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)nc1 1357129594 SXLGEZLWEFLOQJ-SFHVURJKSA-N 433.508 4.210 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)nn1-c1ccccc1Br 1357201242 VHEULJBGKYPXQG-UHFFFAOYSA-N 431.309 4.078 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)Cc3ccc(Br)cc3Cl)C2)cc1 1436971345 MZPYSKTUEWYEFI-CQSZACIVSA-N 437.765 4.296 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCc2ccc(Br)cc2F)N(C)C)cc1 1439959375 DPKPMQFAQVGXPU-HXUWFJFHSA-N 436.369 4.006 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4ccc(C(F)(F)F)cc4nc3O)CC2)cc1 1446421093 RTUNJYBXQGAJEP-UHFFFAOYSA-N 445.441 4.320 10 10 IICE CCC(CC)(C(=O)CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)C(=O)OC 1458907960 JDCKZGZXXSTKBX-SFHVURJKSA-N 430.570 4.370 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N[C@H]2CC(=O)N(c3ccc(Oc4ccccc4)cc3)C2)cc1 1464435512 LAAOMDQIEYEXGJ-SFHVURJKSA-N 443.463 4.177 10 10 IICE Cc1cc(CC(=O)N2CCN(CC(F)(F)C(F)F)CC2)c(C)n1-c1ccc(Cl)cc1 1465183043 FCHYVIZZAFBESI-UHFFFAOYSA-N 445.888 4.335 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)c1 1468844005 HSUMNHXYLIOPGP-UHFFFAOYSA-N 439.581 4.019 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cc(NC(=O)OC(C)(C)C)nn3C)c2C)c1 1471017132 GCUBYSVQBSPXIE-UHFFFAOYSA-N 437.544 4.413 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@H](c3ccccc3)C3(CO)CCCC3)C2)cc1 1478859235 DBLDNNHNCWFOPW-HYBUGGRVSA-N 437.584 4.115 10 10 IICE Cc1cc(-c2nnc(N(C)CCC3CC3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1510621104 GWFGMLBKFYHSGW-UHFFFAOYSA-N 448.615 4.361 10 10 IICE CCC1(CC)CN(c2nnc([C@H]3CCCO3)n2Cc2ccc(N(C)C)c(F)c2)CCS1 1513602163 GFCLBVFOSPZXBF-HXUWFJFHSA-N 447.624 4.495 10 10 IICE CCN(Cc1cccs1)c1nnc([C@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1515635871 ZNLAHVNIVCMXGP-HXUWFJFHSA-N 429.565 4.471 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(Br)c3F)CC2)cc1 1526035217 CVOPSFHVFLFWNN-UHFFFAOYSA-N 427.701 4.213 10 10 IICE CCOC(=O)C1CCC(CC(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)CC1 1542490405 MIXSSRRAHGMQPW-POOLCLQXSA-N 430.589 4.020 10 10 IICE O=C(c1c(Br)nc2n1CCCC2)N(Cc1ccco1)Cc1ccccc1O 1545496295 GFQXMDSAKQXBBY-UHFFFAOYSA-N 430.302 4.123 10 10 IICE CCO[C@@]1(c2nnc(N3CCC(C)=C(C)C3)n2CCCSc2nccs2)CCOC1 1547889019 OPCLGUQBLNBQAZ-NRFANRHFSA-N 449.646 4.116 10 10 IICE COC(=O)[C@@H]1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)[C@H]2CCCC[C@H]21 1557394444 IGTIOHAYCKOHMD-ZRBLBEILSA-N 436.552 4.409 10 10 IICE CCN(C[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CO1)c1ccc(OC)c(OC)c1 1616266235 SOZBMKBFSHEYFE-IBGZPJMESA-N 434.577 4.336 10 10 IICE O=C(NC1(c2cccc(Cl)c2)CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1617950896 JVFNAMUEZIEBCO-UHFFFAOYSA-N 448.953 4.327 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1ccc(SC(F)(F)F)nc1 1622634515 AFGAZXFOWLMUAS-HNNXBMFYSA-N 445.894 4.447 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@](C)(Cc2ccccc2)[C@H](C)O)CCCC1 1623463173 GXZLPLDFTVYVFB-UZTOHYMASA-N 434.580 4.275 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(-c2cccc(F)c2)no1 1626510909 CIJKNUBCGUBOQF-UHFFFAOYSA-N 439.487 4.483 10 10 IICE CCOC(=O)c1cc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc([N+](=O)[O-])c1 1627002142 YJWIJDCJOJXTFL-UHFFFAOYSA-N 439.512 4.470 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc2c(c1)ncn2Cc1ccccc1OC 1627028865 RFXUZEPUBKJNNV-UHFFFAOYSA-N 436.508 4.215 10 10 IICE Nc1cc(Cl)c(Cl)cc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630261870 DSSFPAHFBWPJKJ-ZDUSSCGKSA-N 428.747 4.329 10 10 IICE Cc1cc(C(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)[C@@H](C)C2)c(C)n1-c1ccccn1 1639802355 KNQZQVPXESRMOM-QFBILLFUSA-N 426.561 4.112 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCNc2ccc3ccccc3n2)cc1 1643505630 OIOWYEPBXKOTSG-UHFFFAOYSA-N 426.520 4.226 10 10 IICE O=C(NCc1c(O)cccc1O)c1cc2cc(Br)cc(Br)c2o1 1647270856 ZTPDKSLGDHNNSF-UHFFFAOYSA-N 441.075 4.299 10 10 IICE C[C@H](NC(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1681779775 RLOFVRNSKAUDJL-PZBISTMVSA-N 430.593 4.291 10 10 IICE Cc1cc(CCNC(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)c(C)n1-c1ccccc1 1683150265 ZCRSTQKIBUPDLU-XMMPIXPASA-N 430.552 4.084 10 10 IICE Cc1ccc(C)c(C2CCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CC2)c1 1685248972 ULXMKHKWCRSZHN-UHFFFAOYSA-N 448.611 4.094 10 10 IICE CCc1nnc(N2CCN(c3cccc(C)c3)CC2)n1CCCSc1nccs1 1709138057 PYZXRYBBYGHQBK-UHFFFAOYSA-N 428.631 4.114 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C)[C@@H](C)C3)n2CCCSc2nccs2)n1 1726061243 YSVMSUGWFBSQMF-HOTGVXAUSA-N 445.662 4.261 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(Cc2ccccn2)n1CC(F)(F)F 1729405036 MSGFWSDYQIYEDT-UHFFFAOYSA-N 430.478 4.063 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CC[C@H](C(C)C)C3)n2CCCSc2nccs2)n1 1742697814 SWYVBNZYKVXLJT-SFHVURJKSA-N 445.662 4.261 10 10 IICE CCN(CC)c1ccc(Cn2c(CN3CCCC3=O)nnc2N(C)C2CCCCC2)cc1 1746093768 OJHNLCVBDQCQGV-UHFFFAOYSA-N 438.620 4.064 10 10 IICE CO[C@H]1CCCN(c2nnc(Cc3ccc(F)cc3)n2CCCSc2nccs2)C1 1749180610 ZRFCUDQUVVGOKY-SFHVURJKSA-N 447.605 4.262 10 10 IICE Cc1nnc(N2CCC(OCCc3ccccc3)CC2)n1CCCSc1nccs1 1751910181 RMJRUEIOAAXDAG-UHFFFAOYSA-N 443.642 4.454 10 10 IICE CCC[C@H]1CN(c2nnc(Cc3cccnc3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1763972818 ULZSCZOAXJOOAJ-DEOSSOPVSA-N 448.615 4.164 10 10 IICE CC(C)Oc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)c(CC(=O)O)s2)cc1 1858004162 OPWVYQNXIVQCON-UHFFFAOYSA-N 438.552 4.087 10 10 IICE Cc1nc2ccc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)cc2nc1C 1866004508 NFQDHFDCMQBSJF-RUZDIDTESA-N 431.584 4.270 10 10 IICE COc1ccc(N2CCN(Cc3ccc(C(=O)Nc4cc(C)ccc4O)cc3)CC2)cc1 1872884111 LSWCDSHBJVWIOD-UHFFFAOYSA-N 431.536 4.284 10 10 IICE Cc1ccc([C@H](C2CC2)n2nc(C(C)(C)C)c(CO)c2I)c(O)c1 2079032508 FCVURWHXSNJCCG-INIZCTEOSA-N 440.325 4.291 10 10 IICE CC(C)(C)OC(=O)N1CCCC[C@H](CNCc2cc(Br)cc(F)c2O)C1 2102324973 JVSKDBDIEJXJSR-CYBMUJFWSA-N 431.346 4.421 10 10 IICE COCC[C@]1(NCc2cc(Br)ccc2O)CCCN(C(=O)OC(C)(C)C)C1 2157553995 PZYRDVIZIOSBDV-HXUWFJFHSA-N 443.382 4.051 10 10 IICE O=C1NC(=O)N(Cc2ccc(F)cc2)C(=O)C1=Cc1ccc(OCc2ccccc2)cc1 2296400232 GXBPWSJCWMGQNR-UHFFFAOYSA-N 430.435 4.067 10 10 IICE COc1ccc(C=C2SC(=S)N([C@H](CC(=O)O)c3ccccc3)C2=O)cc1OC 2297554746 XEPSCNHVKJUICU-OAHLLOKOSA-N 429.519 4.121 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccc([N+](=O)[O-])cc1 2314832062 YVJYNGNVFZERIC-UHFFFAOYSA-N 433.536 4.276 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)[C@H](NCc1ccc(Br)cc1O)C2 2333640171 VSJKWBNERXJKBY-FRFSOERESA-N 425.367 4.280 10 10 IICE CCN(CCN=[N+]=[N-])C(=O)[C@H](Cc1ccccc1Br)NC(=O)OC(C)(C)C 2362990054 PQSHAGLQDSQQPR-HNNXBMFYSA-N 440.342 4.044 10 10 IICE Cc1ccc(CN(C)C(=O)c2cnc(NC(=O)OC(C)(C)C)o2)c(O)c1Br 2380786469 KNKCONAPMMBVRV-UHFFFAOYSA-N 440.294 4.070 10 10 IICE Cc1ccc(CNC(=O)[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2381135468 QTAOMXRGYQLOIL-ZIAGYGMSSA-N 441.366 4.019 10 10 IICE COCCN1C(=O)/C(=C2\C(=O)N(Cc3ccc(Cl)cc3)c3ccccc32)SC1=S 2688811 MXQDPDKZTZOKGI-ISLYRVAYSA-N 444.965 4.105 10 10 IICE COc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)ccc1OS(=O)(=O)c1ccccc1 13119029 OTSBHYWBOWHUNY-QNGOZBTKSA-N 448.500 4.269 10 10 IICE CCOC(=O)c1csc2ncnc(Nc3cccc4c3C(=O)c3ccccc3C4=O)c12 71529856 TXRIPIRPKWXWKF-UHFFFAOYSA-N 429.457 4.387 10 10 IICE COc1cc(OC)c(-n2c(C)cc(/C=C3\C(=N)N4OC(C)=CC4=NC3=O)c2C)cc1Cl 96468644 WOIXUNMRZQOWMD-UOMFMSKPSA-N 440.887 4.215 10 10 IICE CCCCCOc1ccc(/C=C2/SC(=S)N(CCC(=O)OC)C2=O)cc1OCC 206834779 ORQHLHIJZMTXLQ-NBVRZTHBSA-N 437.583 4.419 10 10 IICE COc1cc(/C=C2\SC(=S)N(c3ccccc3F)C2=O)ccc1OCCC(=O)O 210445090 ZCVOWPSRVYYTAD-BOPFTXTBSA-N 433.482 4.094 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CNC(=O)c1cc2c(s1)CCCC2 726798276 NHOYGQOCHBADLB-UHFFFAOYSA-N 425.598 4.006 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)N[C@@H](C)Cn1cncn1 749213001 NUBLOYJLQCPERL-LIRRHRJNSA-N 446.477 4.161 10 10 IICE O=S(=O)(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc2ccccc12 752248764 WHRIJCYNALTVCR-UHFFFAOYSA-N 432.492 4.389 10 10 IICE Cc1ncc(/C=C\C(=O)N(C)c2ccc(CNC(=O)/C=C/c3cnc(C)s3)cc2)s1 765483029 TWFGHCIABNNSOM-GOOGBFEESA-N 438.578 4.222 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCC(c2cccnc2)CC1 768939523 AMJVSRKGWKSPQP-UHFFFAOYSA-N 430.499 4.241 10 10 IICE CCN(Cc1c(F)cccc1F)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 769052381 ALZQTJVOGFJWBZ-UHFFFAOYSA-N 442.554 4.229 10 10 IICE COC(=O)CN(Cc1cccc(OCc2ccccn2)c1)Cc1cc(Cl)ccc1O 769379762 MAEOLNPVDDBNDP-UHFFFAOYSA-N 426.900 4.195 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)Cc2cnn(C)c2C)sc(C)c1-c1ccccc1 790449635 BTWFJFVYLMCZKR-UHFFFAOYSA-N 440.569 4.013 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(-c2ccoc2)n1CCc1ccccc1 802296381 AFRQVMHCTLLEBW-UHFFFAOYSA-N 443.551 4.254 10 10 IICE COC(=O)/C=C/c1ccc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 918736250 UPHPBEWVISBNGZ-WEPHUFDCSA-N 426.313 4.348 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnn(-c3ccc(Br)cc3)c2)cc1 1125233327 HYKUGIQZIGDGQW-UHFFFAOYSA-N 427.346 4.411 10 10 IICE CCOC(=O)C1([C@H](C)NC(=O)c2cc(-n3c(C)ccc3C)ccc2Cl)CCOCC1 1134595518 VNLMXOFBIIDZMY-KRWDZBQOSA-N 432.948 4.226 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc2sc(N(CC)CC)nc2s1 1162539616 IVRXXZPIMXGKEY-UHFFFAOYSA-N 447.582 4.115 10 10 IICE CN1CCC[C@H](c2cccc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c2)C1 1182951939 NMWXTBGNWIJMJW-REWPJTCUSA-N 442.003 4.249 10 10 IICE COc1cc(F)c(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)c(Cl)c1 1264641019 TXZCSZWLOWNSPE-UHFFFAOYSA-N 446.828 4.273 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Br)cc(N4CCCC4)c3)C2)cc1 1278860866 CLFMCVAXYUVAIG-GOSISDBHSA-N 444.373 4.067 10 10 IICE CN1CCN(c2ccc(CNC(=O)C3(c4ccc(Cl)c(Cl)c4)CCC3)cc2)CC1 1288329655 FIOSNHIFBQBKPP-UHFFFAOYSA-N 432.395 4.483 10 10 IICE Cc1cc(-c2nnc(N3CC(=O)N(C)[C@H](C)C3)n2CCCC(C)C)c(C)n1-c1ccccc1 1289356725 WUXFGZSTKDPPPY-HXUWFJFHSA-N 448.615 4.456 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3cc(Cl)c4c(c3)OCCO4)c2C)cc1 1292150240 BQZMCXMPQRXWPE-UHFFFAOYSA-N 426.900 4.457 10 10 IICE CCC1CCN(c2nnc([C@H]3OCC[C@H]3COC)n2Cc2ccc(N(C)C)cc2C)CC1 1293505023 DHKROEKBBNRXLH-GMAHTHKFSA-N 441.620 4.051 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)COc3cc(Cl)cc(Cl)c3)cc2F)C[C@@H](C)O1 1350933558 PBSPOHLZKANJCG-ZIAGYGMSSA-N 441.330 4.441 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3c(C)nn(Cc4ccc(F)cc4)c3Cl)C2)cc1 1437577089 LNOSNXQTSQGFOM-SFHVURJKSA-N 442.922 4.050 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C)ccc21 1438328190 NAMYMENANWWMAE-YADARESESA-N 433.596 4.402 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCCc2cccnc21 1438791492 AIAUHMLCCNCKSI-NBVRZTHBSA-N 441.553 4.182 10 10 IICE Cc1cc(CC(=O)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)c(F)c2)c(C)n1-c1ccccc1 1439323396 KBSOIXVDMOVCMW-WIOPSUGQSA-N 437.490 4.003 10 10 IICE Cc1cc(CC(=O)N2CSC[C@H]2C(=O)NCCC(C)C)c(C)n1-c1ccc(Cl)cc1 1443383671 CVBSOYNHVYANMQ-NRFANRHFSA-N 448.032 4.354 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nc(C(F)(F)F)n2ccccc12 1445651914 DRTYJOKHAIVMPG-UHFFFAOYSA-N 442.235 4.484 10 10 IICE C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1450720825 DKGUTKFOCQCNKL-IINYFYTJSA-N 433.332 4.076 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC(c3nccc(-c4cccc(F)c4)n3)CC2)cc1 1454178754 CFZACEOGWYNEBX-UHFFFAOYSA-N 432.459 4.465 10 10 IICE Cc1cc(C(=O)NCc2c(O)ccc3ccccc23)cc(C)c1OCC(=O)N1CCCCC1 1456307294 AVLPGXAXBGOFPN-UHFFFAOYSA-N 446.547 4.484 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cccc3ncnc(O)c23)cc1 1465006822 PQKGUQXCTTXSQU-UHFFFAOYSA-N 428.492 4.257 10 10 IICE C[C@H](NC(=O)c1cc(C2CCN(C(=O)OC(C)(C)C)CC2)no1)c1ccc(N(C)C)cc1 1467259227 GXQUFPZGVQXUKW-INIZCTEOSA-N 442.560 4.346 10 10 IICE COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)/C=C\c1cc2cnn(C(C)C)c2[nH]c1=O 1469205546 NHUITGAEHSGYOT-NSDNCLLMSA-N 434.540 4.189 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1ncccc1C 1495641925 WCPVUAURJJOGLE-LJQANCHMSA-N 434.588 4.269 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@H]2CCC[C@H]2C)CCOC1 1509796627 OMNQOYQPCBBIEN-KHCICDEESA-N 428.577 4.097 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSCC1 1513513886 OQFIHLJTXPMBNA-UHFFFAOYSA-N 439.629 4.457 10 10 IICE Cc1onc(-c2cccs2)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1516814566 KEOHJPWCMGOOLG-OKILXGFUSA-N 429.517 4.394 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCCN(C(=O)N3CCCC3)C2)c(C)n1-c1ccc(Cl)cc1 1521127861 AEXFQAXLLWIJQR-NRFANRHFSA-N 442.991 4.086 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(Br)n(C)n3)cc2Cl)C1 1524255466 PELMFPVCLGDFGR-GFCCVEGCSA-N 425.758 4.002 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)CCCc3ccc(Br)s3)C2)cc1 1529708595 PRUQJNUYEMOQQH-OAHLLOKOSA-N 437.403 4.485 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C[C@H]3CCCN(C(=O)NCC(C)C)C3)c2C)c1 1531612954 YUSUWHNAKBNPKR-JOCHJYFZSA-N 438.616 4.486 10 10 IICE Cc1c(I)cccc1C(=O)N(C)Cc1ccc(N2CCCC2)cc1 1531693899 MKIXHRIRMGYODD-UHFFFAOYSA-N 434.321 4.472 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@@H]1C[C@H]2CC[C@H]1C2 1536315697 YUZKMUPPCUVKFJ-IBPFFVFCSA-N 432.586 4.360 10 10 IICE C[C@H]1CCCCN1CCCn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1544027911 ZABIITVSGKHQQP-SIKLNZKXSA-N 427.593 4.126 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@H]2CCN(c3ccccc3Cl)C2)cc1 1544529703 JFJJASBAJHGYHW-RBBKRZOGSA-N 442.003 4.440 10 10 IICE CN(CCn1c(C2CCCC2)nnc1N(C)Cc1ccccc1O)C(=O)OC(C)(C)C 1554291912 KRHVLNMBYSLKLX-UHFFFAOYSA-N 429.565 4.145 10 10 IICE Cc1cc(C(=O)N[C@@H](C(C)C)[C@@H](CO)C(C)C)c(C)n1-c1ccc(Br)cn1 1556712892 ZJHLABHLNPCALK-ICSRJNTNSA-N 436.394 4.271 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1 1556897515 MSPCVPRJHBERBU-LVXARBLLSA-N 429.564 4.228 10 10 IICE Cc1cc(C(=O)NCC[C@H](N(C)C)C(F)(F)F)c(C)n1-c1ccccc1Br 1558263729 ZMLBUUWRKSXHIB-KRWDZBQOSA-N 446.311 4.469 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](C(=O)NCC4CC4)C3)cc2Cl)C1 1564650450 XAQWQUAZKPVRIZ-PXNSSMCTSA-N 447.023 4.024 10 10 IICE CC1(C)C[C@@H](c2ccccc2)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1564895622 OZFWXECDZLATHC-NRFANRHFSA-N 429.511 4.484 10 10 IICE CC[C@H](OC1CCCC1)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1565882037 NTLRKAGVIMLYKQ-SFTDATJTSA-N 433.593 4.172 10 10 IICE O=C(Cc1cc(Cl)cc2ccccc12)NCc1ccc(N2CCC(O)CC2)c(F)c1 1586864891 VRPITSKTRXCXTL-UHFFFAOYSA-N 426.919 4.452 10 10 IICE COC(=O)c1cc(-c2ccccc2CNC(=O)Cc2cc(C)n(-c3ccccc3)c2C)[nH]n1 1597877825 KAGHFESCSCWVEB-UHFFFAOYSA-N 442.519 4.130 10 10 IICE CC[C@H]1C[C@@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1614116433 IUSLADGXWHQTSO-QUCCMNQESA-N 429.584 4.125 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1 1618593713 OYUMNKZBVIOBQX-DEOSSOPVSA-N 445.519 4.146 10 10 IICE CC(=O)c1cc(Cl)cc(CN2CCC(Cc3nc(-c4cc(C)ccn4)no3)CC2)c1O 1620545577 CHPLTOAOOUVVAY-UHFFFAOYSA-N 440.931 4.456 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCCC[C@@H]3COC(=O)N3CCCC3)c2C)cc1 1623655188 CBSHRISUYGKUAK-OAQYLSRUSA-N 439.556 4.330 10 10 IICE Cc1ccc(C(=O)N(C)Cc2nc(O)c3ccccc3n2)cc1-n1c(C)cc(C=O)c1C 1624568479 FYESLKXLIMXCFS-UHFFFAOYSA-N 428.492 4.136 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1scc(Br)c1Br 1627028448 IDPLIJWLSNPKNP-UHFFFAOYSA-N 440.153 4.394 10 10 IICE Cc1cc(C(=O)N[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)c(C)n1-c1ccccn1 1634510614 VNFXFFPCDLAWKY-VWLOTQADSA-N 432.524 4.020 10 10 IICE Cc1cc(C(=O)N2CCC(O)(C3CCC3)CC2)c(C)n1-c1ccc(Br)cn1 1639843720 MUDADLWRBFDZIG-UHFFFAOYSA-N 432.362 4.019 10 10 IICE COc1cc(N2CCC([C@H]3CCCN3C(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])cc1OC 1642157165 IQCLVPPFBIYYGR-MRXNPFEDSA-N 435.521 4.228 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)Nc2ccc(N3CCc4ccccc43)cc2)cc1 1646717677 CRAYNNVBZITPLF-UHFFFAOYSA-N 444.579 4.396 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](CCNC(=O)OC(C)(C)C)C3)ccc21 1648143243 ULOVXCJRJKMNFX-IBGZPJMESA-N 443.588 4.281 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCCN([C@@H](C)c2ccccc2F)C1=O 1672983623 HCSYEWJZPOISQY-UWJYYQICSA-N 427.520 4.205 10 10 IICE COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)CCC2 1683252948 AYDNOVJECIKZPQ-PGRDOPGGSA-N 437.584 4.198 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1CCc1cnc2c(Cl)cnn2c1 1693999104 QZIUSMJJIFLFSZ-OAHLLOKOSA-N 439.951 4.072 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@@H](C(C)C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1725296661 HBMLJHVQRUWJBY-GOSISDBHSA-N 442.608 4.370 10 10 IICE CSCCCn1c(-c2ccc(C)o2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1731131213 ZHUDGOPCZLFREH-UHFFFAOYSA-N 441.601 4.073 10 10 IICE C[C@@H]1C[C@H]1n1c([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nnc1N(C)Cc1ccccc1O 1742977506 SYLMBCLJRPHTIU-BHIYHBOVSA-N 441.576 4.316 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1 1771022280 JNKQTGAYHVERKC-UHFFFAOYSA-N 447.587 4.149 10 10 IICE CCOC(=O)c1cccc(NC(=O)c2c3c(n4ccccc24)C(=O)c2ccccc2C3=O)c1 1873951572 HFZKYIKMHUXUNJ-UHFFFAOYSA-N 438.439 4.144 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@@H](NCc3cc(Br)ccc3O)[C@H]2C1 2092949355 WGZDZHFYNYFOKH-RRQGHBQHSA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1CC(F)(F)C[C@@H]1CCNCc1cc(Br)ccc1O 2226208809 XMNHLVJWOCYVQW-AWEZNQCLSA-N 435.309 4.279 10 10 IICE Cc1ccc([N+](=O)[O-])cc1-n1c(C)cc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c1C 2295356253 XAOSOBAFPYJDJW-CIAFOILYSA-N 430.464 4.404 10 10 IICE CC[C@H](C)Oc1ccc(C=C2SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 2297561642 QODOHLZCALGJDV-AWEZNQCLSA-N 442.562 4.419 10 10 IICE O=C(COc1cccc(C=C2SC(=S)NC2=O)c1)Nc1ccccc1C(F)(F)F 2314835602 MPBUULUCOSWGBE-UHFFFAOYSA-N 438.452 4.212 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccccc3OC)SC2=S)cc1 2314837413 RZZZXNNEWGAARH-CQSZACIVSA-N 442.562 4.322 10 10 IICE COc1cc(C=C2C(=O)N(c3ccc(Cl)cc3)N=C2C(F)(F)F)cc(OC)c1O 2332147486 GZNMFEFYZYHFLT-UHFFFAOYSA-N 426.778 4.411 10 10 IICE CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(\C)Nc1ccc(Cn2cncn2)cc1 13168774 AOMFBBIJIAHHLM-XSFVSMFZSA-N 429.509 4.045 10 10 IICE COCCNC(=O)c1cccc2c1N[C@@H](c1cc(Br)ccc1O)[C@@H]1CC=C[C@H]21 14461217 NBWONPMIJBUYLO-IUSZMWJPSA-N 443.341 4.357 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)c(C(=O)O)c1OC 16906145 TZPCPBGYMYVJAS-MHWRWJLKSA-N 429.519 4.425 10 10 IICE COc1ccc2nc(/C=C3/SC(=S)N(c4ccc(C(=O)O)c(O)c4)C3=O)ccc2c1 37645417 JITFHGLEDSNJIX-GIJQJNRQSA-N 438.486 4.053 10 10 IICE COc1cc(N2CCCCC2)ccc1/C=C1/NC(=O)N(Cc2ccc(Cl)cc2)C1=O 96868528 DSSBEXURSSQUNY-DEDYPNTBSA-N 425.916 4.432 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3cccc(F)c3)[C@@H]2c2ccc(O)c(O)c2)c(OC)c1 526149866 DNDUIHFRWXJPET-JOCHJYFZSA-N 437.423 4.311 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3cccc(-n4cccn4)n3)no2)C1 577798250 FQKPRFNFGFTNBW-UHFFFAOYSA-N 439.523 4.087 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(N3C[C@@H]4CC[C@H](C3)N4Cc3ccccc3)ccc(N)c2C1 687235756 PDRRGZAYJRCHNY-OYRHEFFESA-N 448.611 4.415 10 10 IICE O=S(=O)(Nc1nc2c(s1)CCc1ccccc1-2)c1cc2c(cc1Cl)OCCO2 727244257 WNARNFIWPDFPHC-UHFFFAOYSA-N 434.926 4.134 10 10 IICE COC(=O)/C=C\c1ccc(S(=O)(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cc1 747859158 WVHOKHOOLZYGEZ-WTKPLQERSA-N 436.461 4.075 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1)[C@H](c1c(F)cccc1Cl)N1CCCCC1 753803757 RSBYCJYYFRDTQO-QHCPKHFHSA-N 445.966 4.159 10 10 IICE COc1cc(N2CCN(C(=O)c3cc4cc(Cl)ccc4o3)CC2)cc(OC)c1OC 759222708 UVNZFUCOKVUOOS-UHFFFAOYSA-N 430.888 4.074 10 10 IICE O=C(NCc1cc(F)cc(Br)c1)NCc1cccc(Br)c1O 764762547 HTXDEIVJUVWHIC-UHFFFAOYSA-N 432.087 4.056 10 10 IICE CC(C)N1CCN(c2cccc(NC(=O)c3cc(Br)cc4nc[nH]c34)c2)CC1 800528992 XZLCOFMTWDZBLQ-UHFFFAOYSA-N 442.361 4.108 10 10 IICE CCOC(=O)c1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)nc1C 915042611 VRCDWNFPHYHJOV-UHFFFAOYSA-N 438.455 4.153 10 10 IICE CCOC(=O)c1c(NC(=O)COc2c(C)nn(C)c2C)sc(C)c1-c1ccc(F)cc1 1124635102 KZQWCMKDLIZIFU-UHFFFAOYSA-N 445.516 4.407 10 10 IICE C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661175 IHWOREOKBIDWDP-MRXNPFEDSA-N 432.511 4.183 10 10 IICE COC(=O)c1cccc2c1CCN2C(=O)c1ccccc1CCN(C)C(=O)OC(C)(C)C 1134350406 COMACSBFFREBIU-UHFFFAOYSA-N 438.524 4.086 10 10 IICE COc1cc(N2CCC3(CC2)CN(C(=O)OC(C)(C)C)[C@@H]3C(C)C)c([N+](=O)[O-])cc1OC 1164357848 DZSWQHGNQRDXAA-HXUWFJFHSA-N 449.548 4.474 10 10 IICE COc1ccc(N(CCc2ccccc2)C[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1 1167881173 JGGAVJNDKXCHCC-QHCPKHFHSA-N 446.547 4.069 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCc4cc(Br)cc(C)c4C3)C2)cc1 1252924795 UKVKELNAMCRNFM-GOSISDBHSA-N 444.373 4.113 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C)C[C@@H]2Cc2ccccc2)c(C)n1-c1ccccc1 1253808625 VYKKHFMDAIFURP-SANMLTNESA-N 430.596 4.205 10 10 IICE Cc1nc(Cl)ccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1270983867 YNBCUWYEBBDZNU-GDNBJRDFSA-N 435.933 4.413 10 10 IICE COc1ccc(N2CCN(CCNC(=O)c3ccc(-c4ccc(C)cc4)cc3F)CC2)cc1 1292281085 CSJRUFMMOSRCFQ-UHFFFAOYSA-N 447.554 4.362 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N[C@@H](c3nccn3C)C(F)(F)F)cc2Cl)C1 1312590605 MSRFUQBLVIHALU-DYVFJYSZSA-N 443.901 4.413 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)NC(C)C)nnc2N2C[C@@H]3CCC[C@@]2(C)C3)cc1 1313672142 BUFWFXMQIQQECU-NLFFAJNJSA-N 438.620 4.080 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)sc1Br 1435574888 ZEBSAPGOGCOHNA-UHFFFAOYSA-N 448.430 4.281 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Oc4cccc(Cl)c4)cn3)cc2)CC1 1438903568 RVCXKHZNVOQCLN-UHFFFAOYSA-N 436.943 4.209 10 10 IICE Cc1ccc(C(=O)N2CCN(CCc3cccs3)CC2)cc1-n1c(C)cc(C=O)c1C 1442267471 YINLBYHXLRFOEC-UHFFFAOYSA-N 435.593 4.277 10 10 IICE Cc1cc(C(=O)N2C[C@@H](C)O[C@@]3(CCCOC3)C2)c(C)n1-c1ccccc1Br 1448546545 YTZKTTMFASEBMB-ZHRRBRCNSA-N 447.373 4.267 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccc2nc(O)n(CC(F)(F)F)c2c1 1450723561 XNBTZTIPWZOQCP-UHFFFAOYSA-N 434.201 4.247 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F 1455215476 RJVBFFIGLDEBJN-RBBKRZOGSA-N 444.453 4.171 10 10 IICE Brc1cnn(CCCNCc2ccc3c(c2)CCN3Cc2ccccc2)c1 1461544471 WDJMWZPAMKQZAB-UHFFFAOYSA-N 425.374 4.388 10 10 IICE COc1ccc([C@H](CN(C)C)NC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)cc1 1470968534 ALXOSTIOKPXCOL-VWLOTQADSA-N 434.584 4.247 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(c2ccc(F)cc2Cl)CC1 1478841311 SZOASEYNJJGBSN-QGZVFWFLSA-N 432.971 4.316 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NC[C@H](Cc2ccccc2)c2ccccn2)N(C)C)cc1 1479535046 RVWYZOLORRZBMN-JYFHCDHNSA-N 445.611 4.076 10 10 IICE CCN(CC(C)C)c1nnc(-c2cccn2C)n1Cc1ccc(N2CCSCC2)cc1 1501705813 GURBIIQNLDYTGB-UHFFFAOYSA-N 438.645 4.367 10 10 IICE Cc1cnc([C@H](C)Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)s1 1511442811 WVWLMMBLYBHINL-MRXNPFEDSA-N 434.569 4.175 10 10 IICE C[C@H]1COCC[C@@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1512544095 UHFKQZGNVDJCAT-XHYAQGIWSA-N 442.604 4.211 10 10 IICE CC[C@@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1514065950 TWADUJKPCVQDIJ-LJQANCHMSA-N 429.584 4.127 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(OCc4ccccc4)ccc3[N+](=O)[O-])CC2)cc1 1518369056 KUAJSWHIWNGTCU-UHFFFAOYSA-N 447.491 4.145 10 10 IICE COc1cc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)cc1OC 1524793111 AHZLCHISFJTUFY-UHFFFAOYSA-N 433.346 4.337 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1nc(NCc2ccco2)ncc1Cl 1528924076 IMRRBRDFXUACFA-HNNXBMFYSA-N 427.936 4.071 10 10 IICE C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1531196621 QNQOPAGPHIMWAW-IHIBIECDSA-N 446.491 4.216 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)C[C@@H]3COCCN3C(=O)OC(C)(C)C)c2C)c1 1531612277 NWCIEQFTHAHITH-JOCHJYFZSA-N 441.572 4.045 10 10 IICE O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1534010249 QGKCDNYSEXGFCY-UHFFFAOYSA-N 438.798 4.344 10 10 IICE Cc1ccc(C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)cc1-n1c(C)cc(C=O)c1C 1540824012 FMWPXZASCPSOMT-UHFFFAOYSA-N 437.883 4.452 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(Cl)c(Cl)c2N)c1 1543126171 ZNHQUVPLIJTTMP-UHFFFAOYSA-N 443.334 4.320 10 10 IICE COCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)N[C@@H](C)c1ccccc1O 1560075212 WRFXWFPWBNGZPY-UONOGXRCSA-N 426.435 4.114 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCCC(=O)Nc2cc(Cl)cc(Cl)c2)c1 1564841038 KMLBOZNDZXFXKX-NSHDSACASA-N 426.300 4.097 10 10 IICE Cc1ccc(O)c(CNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2cccc(F)c2)c1 1564900908 XEGUKCHISPYCEV-BJKOFHAPSA-N 433.527 4.307 10 10 IICE Cc1cc(CNC(=O)N2CCC[C@H](NC(=O)c3ccccc3)C2)c(C)n1-c1ccccc1 1565193311 VFDHNXGXRKNXKK-QHCPKHFHSA-N 430.552 4.198 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cnc(Nc2ccccc2)nc1C(F)(F)F 1567467205 DQCCOGPYMRHRTF-GFCCVEGCSA-N 432.402 4.011 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1 1570022953 GSXXXXAZHAUFBL-NRFANRHFSA-N 430.426 4.389 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(F)c(F)cc1I 1583569351 JBVRZUKGSGZGFD-UHFFFAOYSA-N 444.263 4.298 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(-c2ccc(OC(F)(F)F)cc2)[nH]n1 1586832003 HBBOGGFJDOLXRR-UHFFFAOYSA-N 432.402 4.081 10 10 IICE CCC(CC)[C@@H](NCC(=O)NCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 1616683963 NZDCENSXFMIGAE-RUZDIDTESA-N 427.564 4.046 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(O)nc2cc(F)ccc12 1618427316 JQFMPAIZNHKPBM-UHFFFAOYSA-N 439.487 4.082 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)CCCC1 1618658102 NZJRZIPOVMOODA-HSZRJFAPSA-N 446.469 4.095 10 10 IICE COc1cccc(-n2cc(C(=O)N(Cc3ccccc3O)[C@@H](C)c3ccccc3)nn2)c1 1623924074 GCLHKUNQRJFKQT-SFHVURJKSA-N 428.492 4.385 10 10 IICE COc1ccc(OC(F)(F)F)c(C(=O)Nc2cccc(N3CCN(C(C)C)CC3)c2)c1 1624596233 ORJWMPNWWXLKKS-UHFFFAOYSA-N 437.462 4.377 10 10 IICE Cc1ccc(C(=O)NCc2cc(F)ccc2N2CCOCC2)cc1-n1c(C)cc(C=O)c1C 1628295954 DRCHPLAPBZINRH-UHFFFAOYSA-N 449.526 4.121 10 10 IICE Cc1c(Br)cnn1CC(=O)N(Cc1ccccc1O)[C@@H](C)c1ccccc1 1632697260 JKJZJFSHBWAVTJ-HNNXBMFYSA-N 428.330 4.450 10 10 IICE Oc1ccccc1CN(C[C@H]1CCCO1)c1ncnc2cc(F)c(Br)cc12 1639662004 ZMGSNFZXTTUGPT-CQSZACIVSA-N 432.293 4.423 10 10 IICE CCOc1ccc(N(Cc2nnnn2-c2ccccc2Br)CC2CC2)cc1 1644160719 GSSGROMORMTOJA-UHFFFAOYSA-N 428.334 4.240 10 10 IICE Cc1cc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)ccc1N1CCCCC1 1644876140 HZMQCOVZVVRURX-NRFANRHFSA-N 438.591 4.269 10 10 IICE O=C(NC/C=C/c1ccc(Br)cc1)NCc1cccc(Br)c1O 1649418802 MQWROQKSLWSOJH-NSCUHMNNSA-N 440.135 4.430 10 10 IICE Cc1ccc(-n2nc(C)cc2NC(=O)CN2CCCc3cc(OC(F)F)ccc32)cc1 1652727248 RWRGZPZZRYAQSK-UHFFFAOYSA-N 426.467 4.482 10 10 IICE Cc1cc(CCNC(=O)NCC2CCN(c3ccncc3)CC2)c(C)n1-c1ccccc1 1680762565 VUTGBUVWWPJKOZ-UHFFFAOYSA-N 431.584 4.247 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1 1682071632 NZFZCGOLFUHDOJ-PMACEKPBSA-N 432.609 4.368 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 1682097847 XANSEWMLISOKAR-NWVWQQAFSA-N 427.564 4.429 10 10 IICE COc1cccc(CN(C[C@@H]2CCCO2)C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c1 1683420921 AXXDXQUOYUCQLY-NLFFAJNJSA-N 439.600 4.391 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3ccon3)n2C[C@](C)(O)C(C)C)c(C)n1-c1ccccc1 1707272837 ZIQUQIWNPMBCMK-VWLOTQADSA-N 448.571 4.384 10 10 IICE Cc1cc(-c2nnc(N3CCC(F)(F)CC3)n2CC(C)(C)O)c(C)n1-c1ccccc1 1724195854 HLZXXTVEQCQGPB-UHFFFAOYSA-N 429.515 4.359 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](C3CCOCC3)C2)n1Cc1ccc(N(C)C)cc1C 1743641181 LBXIMQRXLFHPHV-AVRDEDQJSA-N 425.621 4.467 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1CCSC1 1761842078 BFWFTHIXBGVRFX-RBUKOAKNSA-N 429.634 4.270 10 10 IICE CN(C)c1ccc([C@@H](CNS(=O)(=O)Cc2ccc(Cl)cc2)N2CCCCC2)cc1 1858074893 VXCHZORXBZSBED-JOCHJYFZSA-N 436.021 4.053 10 10 IICE O=C(N[C@H](C(=O)O)c1cc(F)cc(F)c1O)OCC1c2ccccc2-c2ccccc21 1951519181 VUZPRAJCPOBACU-FQEVSTJZSA-N 425.387 4.335 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC12CCC(NCc1cccc(Br)c1O)CC2 2090479647 UOBSVRQRZYWITJ-FXUPRZHBSA-N 425.367 4.470 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2cccc(OCc3ccc(Br)cc3)c2)S1 2293449725 RBHCQSARUOZTAA-UHFFFAOYSA-N 431.311 4.135 10 10 IICE CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(F)c4)c3C)C2=O)cc1 2313560166 LOAAJMQIYNHVRP-UHFFFAOYSA-N 431.467 4.462 10 10 IICE Cc1nc2scc(C)n2c1C=C1SC(=S)N(Cc2ccc(C(=O)O)cc2)C1=O 2323844125 DJCWEUJTJXFGQS-UHFFFAOYSA-N 429.548 4.112 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(O)c1Br 2381132860 GXUTVQYGPPMVJP-UONOGXRCSA-N 441.366 4.115 10 10 IICE Cc1cc(CCNC(=O)Cc2csc(NC(=O)c3ccco3)n2)c(C)n1-c1ccccc1 11085486 YWHDHHOTMLDWEG-UHFFFAOYSA-N 448.548 4.297 10 10 IICE Cc1ccc(COc2ccc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)cc2)cc1 20356300 ZKBSVCMPCKTYRP-BJRGRWSZSA-N 445.548 4.246 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1)N2)N1CCOCC1 20699497 UVHIHJSTROXJTD-WOIUINJBSA-N 430.957 4.187 10 10 IICE Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4C)c3C)C2=O)cc1 59270940 RTCKZRRERGEWTC-SANMLTNESA-N 429.520 4.361 10 10 IICE O=C(COc1ccccc1/C=C1/SC(=S)NC1=O)Nc1cccc(C(F)(F)F)c1 210895048 DHWOBVQKRBLNEB-OVCLIPMQSA-N 438.452 4.212 10 10 IICE CN(C)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc(Br)ccc1O)N2 226720789 GVDHMLUQYWVWLX-SXGZJXTBSA-N 449.370 4.232 10 10 IICE COc1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1OC 526380799 AZRIXYSICDPDCZ-QFIPXVFZSA-N 437.423 4.311 10 10 IICE COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(-c2ccc(SC)cc2)cs1 731054666 JOMTWDSQXNRTBN-UHFFFAOYSA-N 437.524 4.250 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@@H]1CCCc2cn(C3CCCC3)nc21 764682996 NHTPNIJZPRJSJJ-JOCHJYFZSA-N 439.629 4.428 10 10 IICE CCn1c(O)nnc1C1CCN(C(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)CC1 779232187 UOMWVADQLKUYPJ-UHFFFAOYSA-N 427.936 4.084 10 10 IICE Cc1cc(O)c(C(C)C)cc1NS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1 779839531 QQSGJJSWKVEHFN-UHFFFAOYSA-N 425.510 4.272 10 10 IICE C[C@H](NC(=O)[C@]1(NC(=O)OC(C)(C)C)[C@H]2CCCO[C@@H]2C1(C)C)c1ccc(N(C)C)cc1 783718199 PNUXGBGYTJRQFR-SBSRMGESSA-N 445.604 4.028 10 10 IICE C[C@H](NC[C@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(Cl)c(Cl)cc1O 797022901 XWDXCYUJXTXHHX-NWDGAFQWSA-N 435.398 4.122 10 10 IICE Cc1cc(CCNC(=O)N2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)c(C)n1-c1ccccc1 797414006 KWCZZXOYZTYDNN-OHUGHZGNSA-N 425.573 4.005 10 10 IICE O=S(=O)(c1ccccc1Cn1ccnc1)N(Cc1ccccc1O)C1CCCCC1 799773510 GXTPTSYBUIRQPZ-UHFFFAOYSA-N 425.554 4.161 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3ccnc(-n4ccnc4)c3)cc2Cl)C1 800702127 AOOHNDLFRVTDGO-QGZVFWFLSA-N 438.963 4.156 10 10 IICE CCOC(=O)COc1ccc(OC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1126456587 IIBVUIJETZINEQ-UHFFFAOYSA-N 437.492 4.076 10 10 IICE Cc1cc(CC(=O)NCc2ccc(S(C)(=O)=O)c(Cl)c2)c(C)n1-c1ccccc1 1128077312 LQAQYVBJCKXEKQ-UHFFFAOYSA-N 430.957 4.010 10 10 IICE CCCc1c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)cnn1-c1ccc(C)cc1 1129990620 DVSSTSMDIGBXME-HXUWFJFHSA-N 432.568 4.398 10 10 IICE Cc1cc(C(=O)Nc2ccc(F)c(S(=O)(=O)N(C)C)c2)c(C)n1-c1cccc(Cl)c1 1140539204 BHTBRMPIMUGDEF-UHFFFAOYSA-N 449.935 4.389 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)Nc3ccc(OCCN(C)C)c(F)c3)c2C)cc1 1142010176 LPSDVFOFRUVEFQ-UHFFFAOYSA-N 425.504 4.435 10 10 IICE O=C(N[C@@H](c1cccc([N+](=O)[O-])c1F)C(F)(F)F)c1cc2cc(O)c(O)cc2s1 1142285609 YEYUUKDSFFMCCP-HNNXBMFYSA-N 430.335 4.393 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCc2ccc(OCCCN(C)C)cc2)CCCC1 1144106344 LFQRGOIWRHRISQ-UHFFFAOYSA-N 449.595 4.176 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 1157102647 OQZWHJBOOQZULA-UHFFFAOYSA-N 440.521 4.490 10 10 IICE NS(=O)(=O)c1ccc2c(c1)N(CC(=O)Nc1ccc(N=Nc3ccccc3)cc1)CCC2 1191882969 ZNWKQFPWPOQEBX-UHFFFAOYSA-N 449.536 4.141 10 10 IICE Ic1ccc([C@H]2CCCN2Cc2ccc(N3CCOCC3)cc2)cc1 1192918953 QMENXPDNWFRDSB-OAQYLSRUSA-N 448.348 4.465 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3ccc(F)cc3OC(F)F)CC2)cc1F 1231411907 GNHORMOLMUFKBO-CYBMUJFWSA-N 441.425 4.168 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@]2(C)Cc2ccc(F)c(F)c2)N(C)C)cc1 1256237233 VFFWZYXXXDKIIM-NOZRDPDXSA-N 444.570 4.440 10 10 IICE COc1cc(Br)c(OC)c(C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)c1 1276285061 ZFYCTNGDWZDRGS-CQSZACIVSA-N 435.362 4.202 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)COc3ccccc3OCc3ccccc3)C2)cc1 1276832662 YOJSXYBOHPTXOC-QFIPXVFZSA-N 446.547 4.296 10 10 IICE Cc1cc(C(=O)NCC2(C(=O)N(C)C)CCCC2)c(C)n1-c1ccccc1Br 1293371082 KIAGSOAKRYGZOV-UHFFFAOYSA-N 446.389 4.235 10 10 IICE CCCCN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1294194448 JIFKFFUCTWBOTH-QHCPKHFHSA-N 441.620 4.013 10 10 IICE CC(C)Cc1nnc(N2CCOC[C@@H](C3CCC3)C2)n1CCCSc1nccs1 1302981793 MXTLDCJCKYGANY-SFHVURJKSA-N 435.663 4.368 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1305381519 IRZOEMHIZWYLRB-QGZVFWFLSA-N 441.551 4.353 10 10 IICE CC[C@@H](C)CN(C)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1305585620 KRQJIVHDVSUOHJ-GOSISDBHSA-N 431.600 4.373 10 10 IICE Cc1cc(CC(=O)NCCn2cc(-c3ccccc3)nn2)c(C)n1-c1ccc(Cl)cc1 1305797065 GPBZETPHBSIDJU-UHFFFAOYSA-N 433.943 4.365 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N(C)CCCc3cc(-c4ccccc4)no3)C2)cc1 1312902144 JDPNDHJVPHAPSQ-HXUWFJFHSA-N 448.567 4.451 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@](C)(Cc3ccccc3)c3ccccc3)cc2)CC1 1313212267 PUGUNHXFZBOSKT-NDEPHWFRSA-N 442.607 4.396 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)/C=C/[C@]3(C)CC[C@H](C)C3(C)C)CC2)cc1 1353706657 JCAOKNBRYSWLBF-GSCLJDIUSA-N 427.633 4.342 10 10 IICE COc1ccc([C@H](OC)[C@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1357782147 AGPVSNWDAGPGOH-UZTOHYMASA-N 449.595 4.309 10 10 IICE CCCCn1nccc1NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1358503571 GIKQFSGKVCCRTR-SSZFMOIBSA-N 432.546 4.052 10 10 IICE CC(C)c1nnc(N(C)[C@@H](C)c2ccco2)n1Cc1ccc(N2CCOCC2)c(F)c1 1359677183 XKKRKOFNSIWCNX-KRWDZBQOSA-N 427.524 4.216 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cnc(Oc2ccccc2)cn1 1361063317 MQBXSHKESOTWLU-INIZCTEOSA-N 440.450 4.269 10 10 IICE Cc1nn2c(c1Cl)N(C(=O)c1cccc3c1CCN(C(=O)OC(C)(C)C)C3)CCC2 1439495818 HDFRFTARNZZEJZ-UHFFFAOYSA-N 430.936 4.189 10 10 IICE CCOC(=O)c1cnn(-c2ccc(NC(=O)c3cc(O)cs3)cc2)c1C(F)(F)F 1440749574 WYLFPDSWUFAQPU-UHFFFAOYSA-N 425.388 4.087 10 10 IICE COc1ccc([C@H](NC(=O)c2cccc(O)c2O)c2ccccc2)cc1Br 1443418525 VODCHOPRLHPZKB-LJQANCHMSA-N 428.282 4.388 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCS(=O)(=O)c1ccc(Cl)cc1 1458139696 WWAMKQQPWDIKHS-UHFFFAOYSA-N 444.896 4.365 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1ccc(Br)cc1 1463886197 KHYQMQQSCRXQFW-IRXDYDNUSA-N 448.405 4.086 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](C)[C@H]1CNC(=O)OC(C)(C)C 1470556401 UFFXMBIDWYMNNS-LQBOVUBWSA-N 446.636 4.327 10 10 IICE COc1cc(N2CCN([C@H](C)c3ccc(OC(F)(F)F)cc3)CC2)cc(OC)c1OC 1473363711 KOHJVJBQBYAAKL-OAHLLOKOSA-N 440.462 4.494 10 10 IICE CC[C@H](C)CN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1513099357 YNYLEPCSXUTWNR-IBGZPJMESA-N 427.637 4.315 10 10 IICE CCc1cc(C(=O)NCc2ccc(N3CCN(CC)CC3)c(F)c2)ccc1Br 1521017005 QZBRGWXRZOOBPU-UHFFFAOYSA-N 448.380 4.223 10 10 IICE COc1ccc([C@@H](OC)[C@H](C)NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1527126905 GKTBREGPWZKTRU-QLXKLKPCSA-N 436.552 4.430 10 10 IICE C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1537483506 OJGBFRHWYRBCOX-XLEIFJPLSA-N 435.490 4.474 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1nscc1I 1540464373 BLVSNLFKJXQQEH-UHFFFAOYSA-N 441.338 4.010 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cc3ccnc(O)c3Br)c2C)c1 1544079363 FYKFNOBBMJPMPK-UHFFFAOYSA-N 428.330 4.125 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(C)[C@H]2c2ccc(F)cc2)cc1 1545813533 JHTVQPCNXGCOAF-AHWVRZQESA-N 433.527 4.150 10 10 IICE Cc1cc(C(=O)N2CCC[C@H]2[C@@H](O)C(F)(F)F)c(C)n1-c1ccccc1Br 1545995921 BOICIJVYMSLROW-DLBZAZTESA-N 445.279 4.384 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N(C)CCn2cc(Br)cn2)c1 1584311054 YYQGGYMDPPHGNF-UHFFFAOYSA-N 435.753 4.479 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1cccc(C(F)(F)F)c1 1598008840 HIZVQEFMSWVGCE-UHFFFAOYSA-N 447.501 4.001 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1CCCSc1nccs1 1613172919 DYJNZAXDJDMDQA-CYBMUJFWSA-N 440.042 4.454 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3nn(-c4ccc(F)cc4F)cc3O)cc2)CC1 1616694857 IZGOYISKDFFGFD-UHFFFAOYSA-N 426.467 4.022 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCCCOC(C)C)CC2)cc1F 1619302169 JSWXYTYRXHXWOX-UHFFFAOYSA-N 447.599 4.255 10 10 IICE COC(=O)c1cc(CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)n(C)c1C 1625088945 MVGWIHDQIBYZEI-UHFFFAOYSA-N 427.932 4.040 10 10 IICE C[C@H](NC(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1625882026 ADDXCZIESMGFPD-RXVVDRJESA-N 447.620 4.372 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)cc1 1628469340 XDFMJXOYMZYJJZ-HXUWFJFHSA-N 435.609 4.262 10 10 IICE CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1630698069 JOWHAHPJCQQULP-IBGZPJMESA-N 437.531 4.185 10 10 IICE Cc1cc(C(=O)NC[C@@]2(O)CCc3ccccc32)c(C)n1-c1cccc(Br)c1 1631213576 GDJRHEIKTBZIOF-QHCPKHFHSA-N 439.353 4.420 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@H](O)c2c(F)cccc2Cl)CCCC1 1635719658 AOTULPIZYSODHW-NRFANRHFSA-N 430.907 4.171 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)c1 1635938662 PHAKPLYIYKURTB-XMMPIXPASA-N 431.580 4.342 10 10 IICE Cc1ccn(CC(=O)N[C@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)c(=O)c1 1638240963 KNXIWOBXGDCGAE-FQEVSTJZSA-N 443.469 4.468 10 10 IICE CC[C@@H](NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccccc1OC 1644242893 HEIBQSCIPXBCAV-JOCHJYFZSA-N 428.488 4.150 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1654404232 DQAQGALGHWMRNZ-WOJBJXKFSA-N 427.564 4.218 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2cc(C(F)(F)F)n(C)n2)cc1 1676682354 OZOWYWPQIWADLM-UHFFFAOYSA-N 435.450 4.010 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@@H]1COC2(CCC(C)CC2)O1 1680866612 PDIFXNUQIAQKRB-GBXVCHKXSA-N 441.366 4.008 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H](Oc3ncccc3F)C2)c(C)n1-c1ccccc1 1684322506 PZSUPPZQPRTHCJ-JOCHJYFZSA-N 436.531 4.424 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@@]2(C)Cc2ccccc2F)N(C)C)cc1 1684607963 XYPLCQNPLQVWKT-NOZRDPDXSA-N 426.580 4.301 10 10 IICE CN(C)c1ccc(CN(C(=O)NC[C@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)C2CC2)cc1 1687692944 KZORXYBJVNHDAL-RBUKOAKNSA-N 430.593 4.120 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3cccc(C(F)(F)F)c3C2)N(C)C)cc1 1687806272 BRFJLFZOWAAGDA-NRFANRHFSA-N 434.506 4.142 10 10 IICE CC(C)OCCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1692618060 WYEFHYMEKBPUKS-QFIPXVFZSA-N 441.620 4.224 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@H](c3cnn(C)c3)C2)cc1 1695627703 ZSIKZCNUGMVWMV-NRFANRHFSA-N 435.620 4.099 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1CC[C@H]1CCCCO1 1696685074 UJUUPJVZVUHBMW-JOCHJYFZSA-N 441.620 4.008 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1C[C@H](c1cccs1)N(C)C 1696700491 FIUKNEZSLKNKSE-QUCCMNQESA-N 441.601 4.226 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H]2c2nncn2C)n1Cc1ccc(N(CC)CC)cc1 1708504986 RISGNNNMPCAHEK-WIYYLYMNSA-N 436.608 4.156 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1COCCO1 1708575477 XIDQDLRAWFNCLO-GCJKJVERSA-N 437.588 4.250 10 10 IICE CCCCN(CC)c1nnc(Cc2cn3ccccc3n2)n1Cc1ccc(N(C)C)c(F)c1 1709615819 GERNOMONYQAIES-UHFFFAOYSA-N 449.578 4.396 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2C[C@@H](OC)C(C)(C)C2)cc1 1710025487 BGXZAUIUBHJTOD-JOCHJYFZSA-N 434.588 4.096 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C1 1711596676 HZPWMDQIVKLUKI-RUZDIDTESA-N 434.588 4.077 10 10 IICE C[C@H]1CCCN(c2nnc(CC(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1726566055 ICAWZFLQOIDXPV-FQEVSTJZSA-N 439.648 4.360 10 10 IICE CCN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1)[C@H](C)C1CCC1 1728285248 IGUFOVGZSRVSCL-LJQANCHMSA-N 425.621 4.475 10 10 IICE CCN(CC1CCC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)NC 1728461753 FTORHCMQCLZPEN-UHFFFAOYSA-N 434.588 4.115 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@H]3CCO[C@H]3C(C)C)CC2)cc1 1730181912 VEAJTAMWYHLINX-OFNKIYASSA-N 441.620 4.188 10 10 IICE CC[C@H](C)c1nnc(N(C)C[C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763515222 BHDSOIOQGMKIPQ-FPOVZHCZSA-N 443.661 4.256 10 10 IICE CC[C@@H](C)NC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=CCC1 1763926923 XVNCVBSBNJTUPD-LJQANCHMSA-N 446.599 4.424 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC(NC(=O)C(C)C)CC2)cc1 1764931271 QEZNHJBNQQPMJK-UHFFFAOYSA-N 440.636 4.037 10 10 IICE COC[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@H](C)OC)C1 1770902171 VNUSNDWXZFKAKF-FPOVZHCZSA-N 437.588 4.250 10 10 IICE CCOc1cc(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)ccc1O 1860083915 FJAROBLWJBKWEA-RQZCQDPDSA-N 432.479 4.114 10 10 IICE CN1C(=O)COc2cc(N3C(=O)/C(=C\c4c(F)cccc4Cl)SC3=S)ccc21 1860087726 QEJJHYACHVIJQL-LZYBPNLTSA-N 434.901 4.240 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCc2ccccc2)[C@@H]1c1cc(Br)cc(F)c1O 1952850191 CSUJEDLWBQBODS-BBRMVZONSA-N 438.249 4.078 10 10 IICE CCOc1cccc(CNCCNC(=O)OCC2c3ccccc3-c3ccccc32)c1O 1960169181 BTCZTQTYEDXUIC-UHFFFAOYSA-N 432.520 4.419 10 10 IICE CCN(C[C@@H](C)NC(=O)OC(C)(C)C)c1ccc(N)c2c1CCN(C(=O)OC(C)(C)C)C2 2044738773 LXPHGDJPFDKOFT-MRXNPFEDSA-N 448.608 4.302 10 10 IICE CCC1=NN2C(=N)C(=Cc3ccccc3OCCOc3ccc(C)cc3)C(=O)N=C2S1 2297306512 JPZZPWYIOXKZBU-UHFFFAOYSA-N 434.521 4.482 10 10 IICE CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(F)cc3)c2C)C1=O 2313559898 AYCZMCKJHSKCII-UHFFFAOYSA-N 431.467 4.462 10 10 IICE CS(=O)(=O)Oc1ccc(Cl)cc1/C=C1/SC(=S)N(Cc2ccccc2)C1=O 3000712 HAJWXDGQIANWNQ-MHWRWJLKSA-N 439.967 4.080 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 14472268 QLJBGIYWAKSRKB-XXULJNORSA-N 427.526 4.498 10 10 IICE COc1cc(/C=C2\SC(N3C[C@@H](C)O[C@H](C)C3)=NC2=O)ccc1OCc1ccccc1 15911905 PERNXZAKWQXXKK-MPRKLJSHSA-N 438.549 4.354 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S)Nc1ccc(O)cc1 210719213 WUSSABWPYNPHBQ-XDHOZWIPSA-N 437.546 4.494 10 10 IICE Cc1nn(-c2ccccc2)cc1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 436034022 NDTIIDPFJWFBQI-UHFFFAOYSA-N 441.579 4.218 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3nccn3C(F)F)CC2)c(C)n1-c1cccc(Cl)c1 743959801 MMYQIGBDHPHHKA-UHFFFAOYSA-N 447.917 4.297 10 10 IICE Cc1ccc(-c2csc(NS(=O)(=O)c3cc(C(=O)N(C)C)ccc3Cl)n2)s1 747750364 RRZOJDKSYXTBIM-UHFFFAOYSA-N 441.987 4.336 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3CCCCN3C(=O)c3cc(C)cc(C)c3)CC2)cc1 773314622 PBMNDIJRRBFVSQ-VWLOTQADSA-N 449.595 4.092 10 10 IICE COC(=O)[C@@H](NCc1cc(C)cc(Br)c1O)c1ccc(OC)c(Cl)c1 779179250 CLGAUDWSTRWGIH-INIZCTEOSA-N 428.710 4.129 10 10 IICE CC1(C)[C@H](C(F)(F)F)CCN1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 786800449 AZZPKLUQMLSGRM-HXUWFJFHSA-N 438.538 4.091 10 10 IICE COC(=O)[C@H]1CCCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1153971492 OTQMGNQCJAOCKU-LJQANCHMSA-N 433.346 4.414 10 10 IICE COc1ccc(N(C)CCN(C)[C@H](C)C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)cc1 1195787684 BNHBFRNHRZCCSS-HXUWFJFHSA-N 449.595 4.272 10 10 IICE Cc1cc(CNC(=O)N[C@@H](CO)c2cccc(Br)c2)c(C)n1-c1ccccc1 1234325165 APWOTZMKHQXDOG-NRFANRHFSA-N 442.357 4.389 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(c3ccc(F)cc3)C2=O)c(C)n1-c1ccc(Cl)cc1 1276052381 YCVSXZZTZAJZLD-QFIPXVFZSA-N 439.918 4.351 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(C2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291747359 WKGLNNDTNIIOGD-LJQANCHMSA-N 425.621 4.285 10 10 IICE CN(C[C@@H]1CCCOC1)c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1298560347 YCJBUUZSFNOHPP-IRXDYDNUSA-N 437.635 4.021 10 10 IICE C[C@H]1[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 1352925815 HDWJTRABWBNAFE-YJBOKZPZSA-N 443.510 4.289 10 10 IICE CCN1CC[C@H](N(C)C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)C[C@@H]1C 1444620142 VWJISIWPEVWEIO-KSSFIOAISA-N 433.394 4.196 10 10 IICE CC(C)(C)OC(=O)N[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)c1ccc(F)cc1F 1445904408 XKQWTJPPCHIPPJ-NRFANRHFSA-N 446.494 4.431 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 1452627877 CBVZLIVRPUUNJP-RQOWECAXSA-N 427.715 4.420 10 10 IICE COC(=O)Nc1cc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccc1F 1457088682 ASYDLWVNIGZVRJ-AWEZNQCLSA-N 437.418 4.004 10 10 IICE COc1nc(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cc2ccccc12 1457095499 JQEYCRBSKMCHFE-INIZCTEOSA-N 427.451 4.244 10 10 IICE C[C@H](NC(=O)[C@H](c1ccc(Cl)cc1Cl)N1CCOCC1)c1ccc(N(C)C)cc1 1459175886 AGIQZNSGCQMRRV-BTYIYWSLSA-N 436.383 4.310 10 10 IICE CCN(CC)c1ccc(Cn2c(N3CC[C@@]4(CCCOC4)C3)nnc2C(C)(C)C)cc1 1501847850 YUTFWAWYLZFRPB-VWLOTQADSA-N 425.621 4.477 10 10 IICE CSCCCN(C)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1505251723 MPAVFZZEFYFJPM-UHFFFAOYSA-N 433.691 4.366 10 10 IICE CC(C)(C)C1=CCN(c2nnc([C@H]3CCC(=O)N3)n2CCCSc2nccs2)CC1 1508472878 IVMMEIPALPYJEV-MRXNPFEDSA-N 446.646 4.051 10 10 IICE CCc1nc(CN(C)c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)cs1 1513751624 YKNSVOJNDTTZQN-UHFFFAOYSA-N 442.658 4.097 10 10 IICE FC1(F)CCN(c2nnc([C@H]3CCCCO3)n2CCCSc2nccs2)CC1 1521006817 XOUGRMJKFDBFNE-CQSZACIVSA-N 429.562 4.394 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(-c4c(F)cccc4F)n3)CC2)c(OC)c1 1530968739 XZRLIHRGJFJJNL-UHFFFAOYSA-N 445.491 4.068 10 10 IICE C[C@@]1(CCNC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)CC1(Cl)Cl 1533029873 QIOWREDRHXHQSI-HXUWFJFHSA-N 447.274 4.074 10 10 IICE CS[C@@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)C(C)(C)C 1538396759 ZEBJOUGCOINYKN-QZFKAFNDSA-N 440.631 4.311 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c(C)n1-c1ccn(C)n1 1543541456 WUCPQTJEZDPNPL-UHFFFAOYSA-N 431.540 4.329 10 10 IICE Cc1cc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)c(C)n1-c1cccc(Br)c1 1556668426 DHRKHEBOGYIFDD-QFIPXVFZSA-N 430.390 4.415 10 10 IICE CN(C)c1ccc(CN(C[C@H]2C[C@@]3(CCN(C(=O)OC(C)(C)C)C3)CO2)C2CC2)cc1 1559492459 QFQKEJODABXVOO-RCZVLFRGSA-N 429.605 4.133 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](C)[C@H](OC)C2)sc(C)c1-c1ccccc1 1559757310 YJKOATAEXZARAP-MAUKXSAKSA-N 430.570 4.196 10 10 IICE CN(C)c1ccc(CNC(=O)CN2CCC(c3ccccc3Br)CC2)cc1 1559763636 IHXGEXSRNWMMKN-UHFFFAOYSA-N 430.390 4.011 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H]1COC(=O)NC1CCCCC1 1564946961 ZLJKCUGYCUZMAP-AUSIDOKSSA-N 444.620 4.225 10 10 IICE Cc1cc2c(CCNC(=O)N(Cc3ccccc3O)C[C@H]3CCCO3)c[nH]c2cc1F 1565146261 ATPQDJQFWWFSQG-LJQANCHMSA-N 425.504 4.254 10 10 IICE COC(=O)CN(Cc1ccc(Cl)cc1)C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1 1583777662 NUJVTFPHSKIINX-UHFFFAOYSA-N 438.911 4.375 10 10 IICE C[C@H](NC(=O)[C@@H]1[C@@H](NC(=O)OCc2ccccc2)[C@H]2C=C[C@H]1C2)c1ccc(N(C)C)cc1 1585422788 CQESRGJEFZPJHY-PFIXWSCPSA-N 433.552 4.047 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCc3ccccc3C2)NC(=O)OC(C)(C)C)cc1 1618253112 KRWUBGGFLGBRJP-GMAHTHKFSA-N 437.584 4.240 10 10 IICE CC(C)(C)OC(=O)N1[C@H](C(=O)NCc2ccc(N3CCSCC3)cc2)CC[C@H]1C1CC1 1624892069 AIENTYJEKYJISO-SFTDATJTSA-N 445.629 4.034 10 10 IICE COc1ccc(/C=C(/C(=O)NCc2ccc(N3CCOCC3)cc2)c2cccs2)cc1 1626693239 KUXAWKSLAAFZPS-HAVVHWLPSA-N 434.561 4.450 10 10 IICE Cn1cccc1[C@H]1CCCN1C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1628950788 LDDIJABERSBDHY-GXYBQNOFSA-N 443.569 4.119 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccccc1COCc1ccccc1 1629967546 GJEPCDCKRHNJFB-UHFFFAOYSA-N 448.538 4.434 10 10 IICE Cc1cc(C)c(C)c(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccccc2O)c1C 1630363096 JBEDAPKKIIDYQU-UHFFFAOYSA-N 438.549 4.357 10 10 IICE O=C(NCc1cccc(Br)c1O)c1nn(-c2cccc(F)c2)c2c1CCCC2 1635839913 NUZFNAWLQUDFCW-UHFFFAOYSA-N 444.304 4.288 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccc(I)c(Cl)c2)c1 1636061250 KVVUIPRMIRGOFI-VIFPVBQESA-N 431.657 4.150 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 1636262652 IURGXBYXXGIMKX-UUOWRZLLSA-N 427.564 4.286 10 10 IICE CN(C(=O)/C(=C\c1cccnc1)NC(=O)c1ccccc1)c1ccc(Br)cc1 1638972675 OMLVIEFKCBQBIY-XSFVSMFZSA-N 436.309 4.278 10 10 IICE O=C(CSCC(=O)OC1CCCCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1656496175 XCFARRBUJGMUEJ-UHFFFAOYSA-N 437.517 4.010 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]2C(F)(F)F)sc(C)c1-c1ccccc1 1658864139 IRXMBJKNQSVZST-AWEZNQCLSA-N 426.460 4.475 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H]2C[C@H](c3ccc(Br)cc3)C2)cc1 1673228012 CCYVPKHWFFKCRR-UAPYVXQJSA-N 446.389 4.482 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC3(CC3)C2)n1CCCSc1nccs1 1708746448 QNUSORRQJPSMTK-UHFFFAOYSA-N 448.662 4.216 10 10 IICE C[C@H]1CN2CCC[C@@H]2CN1c1nnc(CC(C)(C)C)n1CCCSc1nccs1 1726739563 CZWJBNQGGUMMAO-DLBZAZTESA-N 434.679 4.179 10 10 IICE CN(C)c1ccc(Cn2c(-c3cccn3C)nnc2N2CC=C(C(F)(F)F)CC2)cc1F 1747573262 YVSINCFDZNTZFF-UHFFFAOYSA-N 448.468 4.236 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCC1(OC)CCC1 1761877722 KDFAFVNPKFWPDE-SFHVURJKSA-N 445.583 4.225 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CC1(OC)CCC(C)CC1 1763070385 FEGBJRGWQVVACO-UHFFFAOYSA-N 441.620 4.161 10 10 IICE CCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C(N)=O)CC1 1763997153 XLCVKIVFOKVMHQ-UHFFFAOYSA-N 434.588 4.245 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1C[C@H](C)O[C@H](C)C1 1767771771 PKHJLEKAOBWGGI-VTYHHJSWSA-N 441.620 4.255 10 10 IICE CCOC(=O)CC(=O)Nc1sc(C)c(-c2ccc(Br)cc2)c1C(=O)OC 1866121411 OISIRYGECWTFCK-UHFFFAOYSA-N 440.315 4.164 10 10 IICE COc1ccc(N2CCN(C(=O)CCCCCC(=O)N3CCCCCCC3)CC2)cc1 1866382900 MNKHBRYPZNSCGO-UHFFFAOYSA-N 429.605 4.087 10 10 IICE Cc1ccc([C@@H](n2nc(C(F)F)c(CN)c2I)C2(C)CC2)c(O)c1 2079052211 SPIBJFCCIFTRIW-CQSZACIVSA-N 447.267 4.288 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3c(O)cccc3Br)CCC[C@@H]12 2087287575 TWPQKFAOLPDJCL-XLIONFOSSA-N 425.367 4.424 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CN(Cc3ccccc3)CC2(C)C)c1O 2236053231 RDQLOTDBELGRKA-QGZVFWFLSA-N 433.390 4.411 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1O 2236053578 WYPADIUTVIIDJX-UONOGXRCSA-N 443.382 4.289 10 10 IICE COc1ccccc1OCCCOc1ccc(C=C2C(=N)N3C=CSC3=NC2=O)cc1 2297313921 WGGSFCJGPWPFCM-UHFFFAOYSA-N 435.505 4.320 10 10 IICE COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)C1=Cc1ccc(OC)c([N+](=O)[O-])c1 2313510703 HEJJVNMLIUDPSD-UHFFFAOYSA-N 428.828 4.134 10 10 IICE CCCOc1ccc([C@@H](CC(=O)O)N2C(=O)C(=Cc3ccc[nH]3)SC2=S)cc1OC 2323679958 RLYAIZOUYKMTJV-OAHLLOKOSA-N 446.550 4.229 10 10 IICE COc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)cc1O 14457129 RCGJMINTISAEHC-BSRJHKFKSA-N 426.538 4.012 10 10 IICE COCCNC(=O)c1cccc2c1N[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CC=C[C@H]21 14471236 AVPLTBQWZCPHJR-MDOVXXIYSA-N 427.888 4.451 10 10 IICE O=C1/C(=C\NC2Cc3ccccc3C2)C(C(F)(F)F)=NN1c1nc2ccccc2s1 21345189 JNTWXYBYIYVRMS-PTNGSMBKSA-N 428.439 4.202 10 10 IICE CCOC(=O)COc1ccc(/C=C2\SC(=S)N(c3ccccc3)C2=O)cc1OCC 33436666 SUXPXEBOCBJBFA-UYRXBGFRSA-N 443.546 4.433 10 10 IICE CCn1cc(-c2nc(C(=O)N3CCN(c4ccc(OC)cc4)CC3)cs2)c2cccnc21 65241079 YYOBGBJIFFNZTC-UHFFFAOYSA-N 447.564 4.151 10 10 IICE COc1cc([C@@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@@H]3C=CC[C@@H]32)ccc1O 226657225 XYSAVTXIARQLBC-STSQHVNTSA-N 426.538 4.012 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)C1 444143236 LZIITXLGEWVCRX-QFIPXVFZSA-N 446.595 4.011 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(OC4CCCCC4)cc3)cc2)C1 735432382 KUYCNIINGMZGPA-OAQYLSRUSA-N 435.568 4.030 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc(F)c(C)cc3F)n2)cc1OC 762628015 JQJNMSRPEIEZJC-UHFFFAOYSA-N 426.466 4.215 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H]3CCCc4cn(C5CCCC5)nc43)CC2)cc1F 764755198 DOYFCVZUCXLQPC-NRFANRHFSA-N 441.551 4.055 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)[C@H]2CCOC[C@@H]2C)sc(C)c1-c1ccccc1 769253763 CEMDXFYLAYWZNR-YOEHRIQHSA-N 445.537 4.055 10 10 IICE C[C@H](NC(=O)C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccc(N(C)C)cc1 773846742 OAHCAVUXAJADJL-LBPRGKRZSA-N 443.853 4.163 10 10 IICE COc1ccc(N2C(=O)/C(=C/c3c(Br)cnn3C)SC2=S)cc1Cl 779204045 NYILCYNSKKRNNR-MLPAPPSSSA-N 444.763 4.250 10 10 IICE Cc1ccc(NC(=O)NCc2cc(Br)ccc2O)cc1C(=O)N(C)C(C)C 806465851 KUIVATNKDOMRKD-UHFFFAOYSA-N 434.334 4.265 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1 857547521 IGMBQUBXGZWCIP-GOSISDBHSA-N 429.731 4.042 10 10 IICE Cc1nc(C2CCC2)sc1CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1125188872 WOMWZUGOROVMOJ-GJZGRUSLSA-N 431.577 4.331 10 10 IICE COC(=O)c1ccsc1NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1141707775 JHICURKCLHZBKF-UHFFFAOYSA-N 434.315 4.352 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N[C@H](c2nccn2C)C(C)(C)CO)cc1 1143509167 GYONYXOXGJDWNP-OAQYLSRUSA-N 434.544 4.391 10 10 IICE CCCCN1C(=O)CC[C@H](C(=O)NCc2cccc(Cl)c2O)[C@@H]1c1ccccc1OC 1159033387 HQUIYPYWVPURHJ-AVRDEDQJSA-N 444.959 4.450 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)CSc3ncccc3C(=O)OC)c2C)cc1 1188599190 QHFNTBWBJDOKPR-UHFFFAOYSA-N 438.505 4.037 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCCC[C@H]3COC(=O)N3CCCC3)ccc21 1271924330 FHTOTIFIMCTOHZ-NRFANRHFSA-N 441.572 4.132 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3c(Cl)cccc3Br)CC2)cc1 1295275076 FDHFIMSHOGBUFX-UHFFFAOYSA-N 437.765 4.393 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)c(F)c4)c3C)C2=O)o1 1307297519 CKGIPHOZOSLSLX-XMMPIXPASA-N 437.471 4.093 10 10 IICE CN(C)c1ccc(CNC(=O)CCC(=O)NC(c2ccccc2)c2ccccc2)cc1F 1357201123 RVFAOHPSGITMOM-UHFFFAOYSA-N 433.527 4.194 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c1 1441141387 SCKUZPPXXPQPNO-UHFFFAOYSA-N 443.425 4.451 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)O[C@@H]([C@H]2CCCOC2)C(F)(F)F)CCCC1 1459759445 PZDLNXJKGGFAAP-QKKBWIMNSA-N 425.447 4.429 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)OCc3cn(CCc4ccccc4)nn3)ccc21 1460684760 KFVJATZAYDYEPC-UHFFFAOYSA-N 432.524 4.096 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCCC[C@H]3Cc3ccccc3F)C2)cc1 1470593212 LAUXTLJUFGEEIY-KNQAVFIVSA-N 425.548 4.467 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)Nc1ccccc1C(=O)NCc1ccccc1 1473290093 UQAJFPWVGMEOEN-UHFFFAOYSA-N 443.547 4.407 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1493597491 FNUOGKZQVMMYND-UZKOGDIHSA-N 428.577 4.109 10 10 IICE Cc1ccc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)cc1C 1520969453 GVLPFGXTBQCIMG-IBGZPJMESA-N 447.501 4.313 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)CCc3cccc(F)c3Br)C2)cc1 1526246222 GEKWQFFHTXPALJ-HNNXBMFYSA-N 435.337 4.172 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)[C@@H]1C[C@H]1c1ccc(F)cc1F 1534129553 GEMHBKBJHVFGFN-ZWKOTPCHSA-N 440.412 4.240 10 10 IICE CC(C)(C)OC(=O)NCC[C@H]1Cc2ccccc2N(C(=O)/C=C/c2cncc(F)c2)C1 1536029517 UTQVQFPZWTZRMQ-BLGFXRMMSA-N 425.504 4.354 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCC(c2ccco2)CC1 1538884533 NYYZHQFDGXFBKI-RGEXLXHISA-N 444.553 4.416 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C/C=C\c1ccc(Br)cc1 1540536857 UXGXYPODHTWWAM-IHWYPQMZSA-N 429.358 4.348 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1CCCN(C)C1CCCCC1 1554174998 GAMFXBBVGHQKAW-OAQYLSRUSA-N 441.620 4.169 10 10 IICE CN1CCc2[nH]c3ccc(C(=O)N(Cc4ccc(N(C)C)cc4)CC(F)(F)F)cc3c2C1 1557276211 UIIPHBPWAJLESG-UHFFFAOYSA-N 444.501 4.427 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@H](Oc1ccc(Br)cc1)c1ccccc1 1558174992 XDGCGJMDWDGHPV-HXUWFJFHSA-N 428.282 4.297 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@@](C)(O)c3ccc(F)cc3)cc2Cl)C1 1564650431 WTEYRHLFVAPVFU-WAIKUNEKSA-N 433.955 4.422 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 1568137539 WESKICVKZKFIIU-YKSBVNFPSA-N 442.556 4.251 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CC[C@H](CNC(=O)OC(C)(C)C)C3)ccc21 1570390795 YEVPTMWCIXWKJH-AZUAARDMSA-N 443.588 4.328 10 10 IICE CCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccccc1Cl 1586060685 KESWLDCSFJSGHC-HSZRJFAPSA-N 439.991 4.187 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1O 1587446988 FRXKUMCTMDSLAN-CYUIRQCWSA-N 430.526 4.000 10 10 IICE CCc1nc(C)c(COC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)o1 1596303058 KKBGFBOOFLZZFE-YBEGLDIGSA-N 434.514 4.019 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)C[C@@H](c3ccc(O)cc3)C3CC3)cc2F)C[C@@H](C)O1 1596693988 ATXMUXZFOQVYES-DRSNIGMVSA-N 426.532 4.345 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCN(C(=O)OCc4ccccc4)CC3)c2C)cc1 1596788303 ZFYAPDZCBFFMHT-UHFFFAOYSA-N 447.535 4.197 10 10 IICE CCc1ccc(N(CC)CC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1 1615910168 LQVPRRDSEWKKAI-KDURUIRLSA-N 427.564 4.144 10 10 IICE CCO[C@@H]1C[C@@](NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)(C(=O)OC)C1(C)C 1616581952 UVOPUZQKYQCGQN-AUSIDOKSSA-N 432.948 4.224 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1ccc(Br)c(Br)c1 1627028678 NMZHQSUDYKVKDJ-UHFFFAOYSA-N 448.151 4.262 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)ccc21 1627465155 XGSJGIYQFNFLHN-RUZDIDTESA-N 436.600 4.003 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)[C@@H]2CCCCO2)NC(=O)OC(C)(C)C)cc1 1629678514 BNYKIMYILXZAQL-PMACEKPBSA-N 433.593 4.030 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)Cc3nc(C4CCCC4)cs3)cc2F)C[C@@H](C)O1 1630555948 SLSPGSITDOZOLK-IYBDPMFKSA-N 431.577 4.412 10 10 IICE CC(C)c1ccc2c(c1)CN(C(=O)NCc1cc(F)c(N3CCOCC3)c(F)c1)CC2 1635996467 BEDVCCSGHDTOIV-UHFFFAOYSA-N 429.511 4.193 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCCC12CCN(C(=O)c1ccc(N=NC(N)=O)cc1)CC2 1648910835 DGSOOGOWXDHXNP-KRWDZBQOSA-N 443.548 4.396 10 10 IICE COC(=O)/C=C\c1ccc(N(C)C2(CNC(=O)OC(C)(C)C)CCCCC2)c([N+](=O)[O-])c1 1651373234 UDIOGSZHFIWFER-BENRWUELSA-N 447.532 4.445 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C 1682881148 HCUQAQBFOWQFCM-DEOSSOPVSA-N 426.605 4.374 10 10 IICE CCc1ccccc1[C@H](CNC(=O)NCc1cc(C)ccc1O)NC(=O)OC(C)(C)C 1683073938 HCDLPLJHWBCGTN-FQEVSTJZSA-N 427.545 4.328 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1CSCCN1Cc1ccccc1 1686093298 PONYYNZLZRICTL-XMMPIXPASA-N 438.641 4.046 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc2c(c1)CCCN2C 1698150066 PPFBLWZKTAIRMV-UXHICEINSA-N 441.620 4.059 10 10 IICE C=CC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)CC1 1705780979 MSDFRZBYDCWQNE-UHFFFAOYSA-N 437.632 4.235 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2C[C@@](C)(O)C(C)C)n1 1724477206 LOMRKSBYUVKPTC-AREMUKBSSA-N 448.615 4.292 10 10 IICE COc1ccc(N2CCCN(c3nnc([C@@H]4CCOC4)n3CC(C)(C)C(C)C)CC2)cc1 1748848147 VMLZWYGTLGZBDO-HXUWFJFHSA-N 441.620 4.190 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCOC(C)(C)[C@@H]2C)cc1 1766610962 XLGCOGZTYORTPG-IBGZPJMESA-N 434.588 4.238 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C2CC2)n1Cc1ccc(N2CCSCC2)cc1 1771451337 GWPUXJKXZXTLNH-KRWDZBQOSA-N 431.675 4.335 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3ccc(Cl)cc3)N=C2C(F)(F)F)cc(OC)c1O 1865679880 LFSNFNPOXKFVJF-AUWJEWJLSA-N 440.805 4.407 10 10 IICE CC(C)(C)OC(=O)N[C@H](Cc1ccc(Br)cc1)C(=O)NCCCCN=[N+]=[N-] 2180953851 DFXMZFFWMAAEFM-OAHLLOKOSA-N 440.342 4.092 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)Nc1ccc(C(=O)O)cc1 2293039584 QBSRBEJBEGLZOP-UHFFFAOYSA-N 444.509 4.144 10 10 IICE CN(C)c1ccc(C=CCN2CCC3(CC[C@@H](CNC(=O)c4ccccc4)O3)CC2)cc1 2297516613 VISLHQDOIJQNOT-VWLOTQADSA-N 433.596 4.209 10 10 IICE COc1ccc(C=C2SC(=S)N(c3cc([N+](=O)[O-])ccc3OC)C2=O)cc1OC 2318755885 AOJLWLQDZYEXRI-UHFFFAOYSA-N 432.479 4.026 10 10 IICE Cc1ccc(CNC(=O)[C@@H]2CCC[C@@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380722535 QNILOYYDQSXSLN-VBKZILBWSA-N 441.366 4.163 10 10 IICE COc1cc(/C=C2\SC(=S)N(Nc3nc4ccccc4s3)C2=O)cc(OC)c1O 14904670 AJMHIDRHKKJJKL-DHDCSXOGSA-N 445.547 4.247 10 10 IICE CN(C)c1ccc(CNC(=O)c2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)cc1 18215456 QJIYHOPZJTVXCL-WUKNDPDISA-N 435.549 4.095 10 10 IICE O=C1N=C(N2CCN(c3ccccc3F)CC2)S/C1=C\C=C\c1ccccc1[N+](=O)[O-] 39870373 NRKQNNHRFUAPPK-QBEBGYDGSA-N 438.484 4.083 10 10 IICE Cc1ccc(-n2c(C)cc(/C=C3/C(=O)NC(=O)N(Cc4ccco4)C3=O)c2C)cc1Cl 59534712 LVERMKNQXQIRRX-GRSHGNNSSA-N 437.883 4.311 10 10 IICE O=C1/C(=C\c2ccc(O)c(Br)c2)C(O)=NC(=S)N1c1ccccc1Cl 96868525 REKWTTYXARWXKF-YFHOEESVSA-N 437.702 4.480 10 10 IICE O=C(CN1C(=O)/C(=C\c2ccccc2O)SC1=S)Nc1cccc(C(F)(F)F)c1 210673020 ZYXZYQHISALHER-OVCLIPMQSA-N 438.452 4.251 10 10 IICE COC(=O)/C=C/c1ccc(N2CCC(c3nc(-c4ccccc4)no3)CC2)c([N+](=O)[O-])c1 728908568 MVVBLSJHYQBDDH-CSKARUKUSA-N 434.452 4.215 10 10 IICE COC(=O)[C@H]1CC12CCN([C@@H]1CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C1=O)CC2 733797713 FAEKPIGVMHGBLG-NHCUHLMSSA-N 446.507 4.009 10 10 IICE COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1nc(-c2cccs2)cs1 761344708 ZGQLJUIAOJPKRF-UHFFFAOYSA-N 435.552 4.030 10 10 IICE CN1CC[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@H]1c1ccc(F)c(F)c1 764510018 CIPLBRRUPYANDF-JTHBVZDNSA-N 441.478 4.421 10 10 IICE Cc1cc(Br)c(O)c(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)c1 781902237 PCCHFWSCESUKRB-UHFFFAOYSA-N 436.325 4.388 10 10 IICE CCOC(=O)c1c(NC(=O)COC(=O)[C@H]2CCCOCC2)sc(C)c1-c1ccccc1 787106995 MOLJGUCENUXBBS-KRWDZBQOSA-N 445.537 4.199 10 10 IICE COc1ccc(CNC(=O)N[C@@H]2CCN(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c(O)c1 793042818 UNHFWWXZRPHROD-CTNGQTDRSA-N 435.927 4.217 10 10 IICE C[C@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc(N2CCOCC2)cc1 798061020 RIRHQGODAIDQRZ-BEVDRBHNSA-N 431.483 4.041 10 10 IICE CCn1ncc(NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1C(F)(F)F 799237643 GFKGYOMSICSBKF-UHFFFAOYSA-N 447.408 4.314 10 10 IICE Cc1nc(C(F)(F)F)ccc1NC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 801847511 YYMPBLNGLJIIHX-STQMWFEESA-N 440.441 4.483 10 10 IICE COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)C1 1136418340 FIYXOSDNNADCFR-AVRDEDQJSA-N 439.600 4.221 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCC3CCN(CC(F)(F)F)CC3)c2C)cc1 1149086760 PCCVOADSARBVTC-UHFFFAOYSA-N 437.506 4.497 10 10 IICE Cc1cc(C(=O)N[C@@](C)(CO)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1155040868 OSFOFUVWHVANCV-NRFANRHFSA-N 434.378 4.313 10 10 IICE COc1ccc(C2=NO[C@@H](CNC(=O)Cc3cc(C)n(-c4ccccc4)c3C)C2)cc1F 1155324189 PNLGVRFWBDALTH-OAQYLSRUSA-N 435.499 4.094 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCC(C)(C)c3ccccc3Br)C2)cc1 1230599999 FGXKLKZRFABCRS-MRXNPFEDSA-N 446.389 4.313 10 10 IICE COc1ccc(N2CCN(C(=O)CCOc3cc(C)ccc3C(C)C)CC2)c(OC)c1 1287478165 NWRJUNYYJHXMPR-UHFFFAOYSA-N 426.557 4.253 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCN(CCCOCC(F)(F)F)CC2)c1 1292168393 TWOGFHDGFBWLRU-UHFFFAOYSA-N 437.506 4.129 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCOCC2)cc1 1293884054 SYALDMPUGDMXLW-FQEVSTJZSA-N 448.615 4.406 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)C[C@@H]1C(=O)Nc2ccc(Br)cc21 1297005608 JVUHWOZWBRWVNK-KRWDZBQOSA-N 431.330 4.409 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@H](O)COc1cccc(C(F)(F)F)c1 1307499708 OEZVCLVEGLKCDW-INIZCTEOSA-N 448.279 4.435 10 10 IICE CC(=O)c1cc(Cl)cc(CN2C[C@H](CCNC(=O)C(F)(F)F)c3ccccc32)c1O 1308012567 MJVDDNMXGXJOPL-ZDUSSCGKSA-N 440.849 4.421 10 10 IICE COc1ccc2ccccc2c1CCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 1313271986 YQHRIVXXFJMBDF-OAQYLSRUSA-N 434.536 4.487 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCC[C@@H]2C(C)C)n1Cc1ccc(N(C)C)cc1C 1316293152 SFWRIFOZGLKCSX-WWNPGLIZSA-N 441.620 4.050 10 10 IICE CCc1ccc(C(=O)N2CCN(C(=O)Cc3cc(C)n(-c4ccccc4)c3C)CC2)cc1 1349650833 QRWQOKKAVLESSZ-UHFFFAOYSA-N 429.564 4.184 10 10 IICE CC1CCN([C@H](CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)C(C)C)CC1 1350326705 JUXYHGCYRKVCAE-AREMUKBSSA-N 438.660 4.281 10 10 IICE Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)c1 1444991567 WNAJAOLIHDSRIQ-INIZCTEOSA-N 449.454 4.059 10 10 IICE CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)C1(CC)CC 1459990509 RFPZPOXXMFDPBT-WQTXXOFMSA-N 448.563 4.362 10 10 IICE Cc1cc(CC(=O)Nc2ccc(C(N)=O)cc2OCC(F)F)c(C)n1-c1ccccc1 1460684853 BVTHJYAHOLLPKM-UHFFFAOYSA-N 427.451 4.018 10 10 IICE Cc1nc(O[C@H](C)C(F)(F)F)ccc1C(=O)NCc1ccc(N2CCSCC2)cc1 1464260631 MWHQJRSRTHMYBS-OAHLLOKOSA-N 439.503 4.203 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](O)c1ccc(C(F)(F)F)cc1 1465850117 AWCJPLWBHUXCDB-MRXNPFEDSA-N 432.236 4.256 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)C1 1467702699 PUWKEJWRSYGYPJ-OXJNMPFZSA-N 439.556 4.424 10 10 IICE Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC1CCN(c2ccc(OC(F)F)cc2)CC1 1472681069 YEZSCZKDFODMLS-UHFFFAOYSA-N 435.353 4.029 10 10 IICE COC(=O)/C=C/c1ccc(N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c([N+](=O)[O-])c1 1472687108 SDZQKGFNFUQJMF-YXOJNZSOSA-N 445.903 4.217 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@H]1CCN(c2ccc(F)cc2)C1=O 1473158049 DOUCMMCMDZOPGU-QFIPXVFZSA-N 439.531 4.409 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCCC12CCN(Cc1ccc(N3CCOCC3)cc1)CC2 1473898621 ANHXJXQBZDGDSR-QFIPXVFZSA-N 443.632 4.430 10 10 IICE C[C@H]1CN(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)CCN1c1ccncc1 1478528042 LHAIJASFUILUOO-MOPGFXCFSA-N 442.007 4.392 10 10 IICE CC[C@H](Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1497328710 NCYWTCXDWZRMJI-HXUWFJFHSA-N 429.609 4.017 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N(CC)C[C@H]2CCCO2)cc1 1501847329 KOWROLPDEOESFY-FGZHOGPDSA-N 427.593 4.029 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](C)CN1CCCCC1 1505089087 AEUFMXWDCNSCCD-IBGZPJMESA-N 436.604 4.472 10 10 IICE CCC[C@H]1CN(c2nnc(C(C)C)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1514372779 FHAJBTVNFFQYPR-NRFANRHFSA-N 429.634 4.008 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccnc(O[C@H]4CCOC4)c3)cc2Cl)C1 1524256027 QCTKSWPXOUSTGX-APWZRJJASA-N 429.948 4.069 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(OCC(F)(F)F)o1 1537458685 IJXUWUAUNWNUJY-UHFFFAOYSA-N 434.361 4.221 10 10 IICE COc1ccc(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1[N+](=O)[O-] 1538421743 QTQLLIJWTWNBTK-HNNXBMFYSA-N 431.920 4.352 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)Cc3ccn(CC(F)(F)F)n3)cc2Cl)C1 1538422762 YBZMRQVUSQVWRM-CQSZACIVSA-N 428.886 4.194 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@@H](C)Oc1ccc(C(C)C)c(C)c1 1546151963 NGDJBTGJMJIYAP-MRXNPFEDSA-N 433.932 4.447 10 10 IICE O=C(c1c(F)ccc(O)c1O)N1CCN(Cc2ccc(-c3ccccc3F)s2)CC1 1558892667 HWNDCYQOYSNRTM-UHFFFAOYSA-N 430.476 4.063 10 10 IICE COc1cc(/C=C/C(=O)NCc2ccc(N3CCCCC3)cc2)cc(Br)c1O 1570581783 IXPGJLIDBAHRMV-JXMROGBWSA-N 445.357 4.483 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C(F)(F)c3ccccc3Br)C2)cc1 1584444511 QCALSIUZSKCFDW-AWEZNQCLSA-N 439.300 4.192 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](c3ccccc3)N3CCN(C)CC3)c2C)c1 1587880819 JOEHBKAODSROJL-SANMLTNESA-N 430.596 4.007 10 10 IICE Cc1cc(CN(C)c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)no1 1611944378 NVFMLHGTMJWFOO-UHFFFAOYSA-N 440.548 4.117 10 10 IICE C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1612821173 NLEXGXBBYLUBEP-LPHOPBHVSA-N 441.576 4.143 10 10 IICE CN(C)c1ccc(Cn2c(Cc3cccnc3)nnc2N2CC[C@H](C(C)(C)C)C2)cc1F 1617667995 YNMQUFTYWNKREQ-FQEVSTJZSA-N 436.579 4.390 10 10 IICE COc1cc(C)c([C@@H](C)NC(=O)CN(C)c2ccc(-c3nccs3)cc2)cc1OC 1618415153 FZGPVVZZWITPLN-MRXNPFEDSA-N 425.554 4.449 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Nc3ccc(N4CCNC(=O)C4)c(Cl)c3)c2C)c1 1625550456 LHSFLYIIXRLFDZ-UHFFFAOYSA-N 436.943 4.244 10 10 IICE C[C@@H](NC(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1625882025 ADDXCZIESMGFPD-NQIIRXRSSA-N 447.620 4.372 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)c1 1626043605 DILNYYXEJCMVSZ-QFIPXVFZSA-N 439.556 4.426 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C(=O)c2cc(Cl)cc(Cl)c2)cc1 1626106577 OVRVTIFGGDQSAQ-FQEVSTJZSA-N 435.351 4.450 10 10 IICE CN(C)CC1CCN(c2ccccc2NC(=O)c2cc3cc(O)c(O)cc3s2)CC1 1626503802 ZYLOBNHYUHXWQD-UHFFFAOYSA-N 425.554 4.343 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC[C@H]2CC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1628496492 ZFPQXVFVPATZKG-PMACEKPBSA-N 433.593 4.030 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 1630475348 IMRGKVGHCPADCE-OAQYLSRUSA-N 435.911 4.095 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)Cc3ccccc3)CC2)c(C)n1-c1cccc(Cl)c1 1634576700 DJDIJPUHQSFBSF-UHFFFAOYSA-N 435.955 4.275 10 10 IICE Cc1cc(C(=O)NCC(=O)N2CCOc3ccccc32)c(C)n1-c1ccc(C(C)C)cc1 1634616940 HARNRMPDMHPOCY-UHFFFAOYSA-N 431.536 4.373 10 10 IICE Cc1ccc(C(=O)Nc2ccc(N3CCC(O)CC3)cc2)cc1-n1c(C)cc(C=O)c1C 1636122386 MPKSOGQYLGBFHO-UHFFFAOYSA-N 431.536 4.428 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)cc1 1637594757 RNCUTZODABYFON-QGZVFWFLSA-N 442.519 4.419 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)[C@@H](C)C2)c(C)n1-c1ccccn1 1639802354 KNQZQVPXESRMOM-LPHOPBHVSA-N 426.561 4.112 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cnn(CC2CCCC2)c1 1639827297 OHONDORNKJDHBJ-UHFFFAOYSA-N 426.561 4.076 10 10 IICE Cc1cc(Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)ccc1N1CCOCC1=O 1643256658 QCBGTJQPMKKGND-UHFFFAOYSA-N 431.448 4.241 10 10 IICE O=C(NCc1c(O)cccc1F)c1ccccc1C(=O)c1ccc(Br)cc1 1652295501 LWQJZHLPPROVBQ-UHFFFAOYSA-N 428.257 4.455 10 10 IICE COCCN(Cc1csc(-c2cccc(C(=O)OC)c2)n1)c1ccc(OC)c(OC)c1 1652711519 OUDODZHMKSOXJG-UHFFFAOYSA-N 442.537 4.267 10 10 IICE C[C@H](NCC1CCN(C(=O)OCc2ccccc2)CC1)c1ccc(N2CCOCC2)cc1 1653133527 LQOXZAHXRFMVSX-NRFANRHFSA-N 437.584 4.223 10 10 IICE CC[C@H](NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)C(=O)NCc1cccs1 1683149127 KPORVYVRBTWJDK-QFIPXVFZSA-N 438.597 4.092 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2cccc(OC(F)(F)F)c2)CC1 1684141855 OBLHUZPOXABIHV-UHFFFAOYSA-N 449.473 4.035 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@@H]2CCCCO2)nnc1N(C)CCc1nccs1 1693005947 NRUADFJHCBPQOY-FQEVSTJZSA-N 440.617 4.078 10 10 IICE CCN(c1nnc([C@@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1)[C@H](C)C1CCC1 1709956330 ZZISLJVCCFBITN-YLJYHZDGSA-N 429.584 4.440 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1C[C@@](C)(O)c1ccsc1 1711097038 VVBAQOMNXBAQRI-HSZRJFAPSA-N 426.586 4.322 10 10 IICE CCOCc1nnc(N2CCCC[C@@H](SCC)C2)n1Cc1ccc(N(C)C)c(F)c1 1747170866 VRBUEOOLSIHMCO-GOSISDBHSA-N 435.613 4.180 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CCC[C@@H](O)C1 1747720685 PMJHVKKILPWKNZ-RBBKRZOGSA-N 425.621 4.363 10 10 IICE CC(C)CCCn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1750780162 OVQGLCBUROIRMS-UHFFFAOYSA-N 436.604 4.193 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2CCN(C3CCCCC3)CC2)nnc1C(C)(C)C 1761698450 PBBGQKGXZYSQGP-UHFFFAOYSA-N 438.664 4.453 10 10 IICE C[C@@H](Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O)N1CCC[C@@H](C)C1 1762883762 HIYLLKSRSTVHTJ-MOPGFXCFSA-N 439.629 4.393 10 10 IICE CC[C@H](C)c1nnc(N2CCC([C@H]3CCOC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1763603221 WLAGIJGTVAGBMV-PXNSSMCTSA-N 429.584 4.298 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCCC(=O)NC 1765325996 SMDFIBQFEKIOHS-YRNVUSSQSA-N 434.588 4.281 10 10 IICE O=C1/C(=C\c2cc3c(cc2[N+](=O)[O-])OCCO3)C(c2ccccc2)=NN1c1ccccc1 1865679346 ISHQTRIRLBNEJD-UYRXBGFRSA-N 427.416 4.201 10 10 IICE Cc1cc(C)c2c(=O)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c2c1 1866413637 FUDLRPZPDYYCQR-XMMPIXPASA-N 446.595 4.168 10 10 IICE O=C(CSCc1nc2ccccc2[nH]1)Nc1cccc2c1C(=O)c1ccccc1C2=O 1874178993 GJLHSAZAOUZFOT-UHFFFAOYSA-N 427.485 4.210 10 10 IICE CCN1CCc2cc([C@@H](O)[C@@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999501440 AZNVCPJMWFXVGJ-FYYLOGMGSA-N 426.557 4.213 10 10 IICE CN(c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@]1(CN)CC[C@@H]1OCc1ccccc1 2018785596 FAKPVRXSDHLTBM-DHLKQENFSA-N 425.573 4.224 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C(C)C)c(C(=O)OC)c1I 2078982326 SWHDBRGXHITTFS-ZDUSSCGKSA-N 442.297 4.411 10 10 IICE CC[C@@H](c1ccc(C)cc1O)n1nc(C2CC2)c(C(=O)O)c1I 2078992702 RUCNDXJBPCBTJV-LBPRGKRZSA-N 426.254 4.077 10 10 IICE CC(C)(C)OC(=O)N1CC[C@]2(CNCc3cccc(Br)c3O)CCC[C@H]12 2087283116 VBQQKEBABXIVNR-JXFKEZNVSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CNCc3cc(Br)cc(F)c3O)C[C@@H]21 2140716818 FKAYPIZKHYUZDO-XFJVYGCCSA-N 429.330 4.029 10 10 IICE CC[C@H]1[C@@H](NCc2c(Br)ccc(OC)c2O)CCN1C(=O)OC(C)(C)C 2227747973 HZUCBALKDQHDRB-GJZGRUSLSA-N 429.355 4.041 10 10 IICE Cc1cccn2c(=O)c(C=C3SC(=S)N(C(C)C)C3=O)c(NC3CCCCC3)nc12 2314414814 NIJNEUGDBQGUKT-UHFFFAOYSA-N 442.610 4.357 10 10 IICE CCCOc1cccc(C=C2SC(=S)N([C@@H](Cc3ccccc3)C(=O)O)C2=O)c1 2323866030 JRVUFIJBGXUVJV-SFHVURJKSA-N 427.547 4.373 10 10 IICE C/C(=C1/SC(=S)N(NC(=O)Cc2ccccc2)C1=O)c1ccc(Br)cc1 39862288 JOSAQSCJOTUPPO-ATVHPVEESA-N 447.379 4.314 10 10 IICE COC(=O)c1c(NC(=O)[C@H](C)[C@@H]2Sc3ccccc3NC2=O)sc2c1CCCC2 40839484 ONMQFNYVLYYFCE-DIFFPNOSSA-N 430.551 4.101 10 10 IICE COc1ccc(N2CCN(C(=O)CN(Cc3ccccc3)Cc3ccccc3)CC2)cc1 68786363 FXRCONQCWXXXJZ-UHFFFAOYSA-N 429.564 4.046 10 10 IICE Cc1cccc(OCCOCCOc2ccccc2/C=C2/SC(=S)N(C)C2=O)c1 103475822 AMSYMXZKQHJRNO-HMMYKYKNSA-N 429.563 4.300 10 10 IICE Cc1cccc2cc(/C=C3/SC(=S)N(CC(C)C)C3=O)c(N3CCOCC3)nc12 208278716 UAMVZTCZEGUREV-LDADJPATSA-N 427.595 4.237 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(C3CCCCC3)C2=O)ccc1OCCC(=O)O 210465317 HNFJWTPASIAPOU-AQTBWJFISA-N 435.567 4.473 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@]3(C2)OCc2ccccc23)C1 435998057 VELYSUXGHBPWBZ-HHHXNRCGSA-N 429.564 4.066 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(SC)cc3)cs2)c(C)c1 727246563 NCUGTBRNFLKHMA-UHFFFAOYSA-N 434.564 4.428 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 731123627 HEHAZHQKTKRIDC-LJQANCHMSA-N 432.609 4.321 10 10 IICE CCc1nc2cc(NC(=O)C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)ccc2o1 737082046 MVTCJMJWONBETA-UHFFFAOYSA-N 430.508 4.095 10 10 IICE CCOc1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3)cs2)cc1OCC 743776450 IEHJPJQBVGVRAF-UHFFFAOYSA-N 434.539 4.417 10 10 IICE O=S(=O)(Cc1ccccc1CNCc1cc(-c2ccccc2)ccc1O)N1CCCC1 754844630 YPYWUBZKKRKKKW-UHFFFAOYSA-N 436.577 4.275 10 10 IICE O=C(Nc1cc(F)ccc1C(=O)NCc1cccc(Br)c1O)c1ccoc1 765748635 YNXCIPJFPDTFIH-UHFFFAOYSA-N 433.233 4.069 10 10 IICE COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 786874222 JRSFKIVQGFZFBS-GFCCVEGCSA-N 439.946 4.073 10 10 IICE Cc1cncc(/C=C/C(=O)Nc2cccc3c2OCCN3C(=O)/C=C/c2cncc(C)c2)c1 791076198 HWTXRVCPNPSLKX-CDJQDVQCSA-N 440.503 4.184 10 10 IICE COc1cc(C)c(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)cc1OC 916669542 CMXRUSGXTWAUAO-IYBDPMFKSA-N 431.508 4.087 10 10 IICE COC(=O)c1ccc(OCCNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1 1126059959 VMYQUZLXADZPTQ-UHFFFAOYSA-N 440.927 4.272 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cn(Cc4cccc(F)c4)nn3)cc2Cl)C1 1128488590 FOUXQGZDFJORQD-MRXNPFEDSA-N 441.938 4.285 10 10 IICE C[C@@H](CC(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1)c1ccccc1C(F)(F)F 1133847682 REOWKSRQZRFCQO-INIZCTEOSA-N 447.501 4.217 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@@H]2O)c(C)n1-c1ccc(Br)cc1 1141668762 MASGYPJRFFGMGB-FPOVZHCZSA-N 441.325 4.081 10 10 IICE Cc1cc(C(=O)N2CCO[C@@H](CNC(=O)OC(C)(C)C)C2)c(C)n1-c1ccc(Cl)cc1 1154527182 RPUZMLFJESELIB-IBGZPJMESA-N 447.963 4.113 10 10 IICE COc1ccccc1N1CCCN(C(=O)c2ccccc2-n2c(C)cc(C=O)c2C)CC1 1180669091 XGUSYPFXSJFFFN-UHFFFAOYSA-N 431.536 4.268 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H](C)Cc2cn(C)c3ccc(F)cc23)cc1 1251848638 FTMOJWKTSBUVCP-KRWDZBQOSA-N 426.536 4.035 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2cnc3ccccc3n2)C1 1276403080 OKGANZNNXROHOX-SYGIOELKSA-N 430.508 4.126 10 10 IICE CCC(CC)(CNC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C(F)(F)F 1288026583 YBIAQDGNIXOMSZ-UHFFFAOYSA-N 448.397 4.469 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc(OCc2ccccc2)cs1 1293928984 NORKIBMMTLDROE-UHFFFAOYSA-N 436.577 4.466 10 10 IICE CC(C)(C)OC(=O)N[C@@H](Cc1cc2ccccc2o1)C(=O)NCc1c(O)cccc1F 1303875763 OEXFOPXPIYIHJC-SFHVURJKSA-N 428.460 4.030 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(CCc3ccccc3)c2C)ccc1N(C)C 1307388320 BRHUMSSCCGOSDG-UHFFFAOYSA-N 434.536 4.462 10 10 IICE Cc1ncn(CC(=O)c2cc(C)n(-c3ccc4c(c3)CCC4)c2C)c(=O)c1Br 1307410133 IKDBYDWEXCQMLQ-UHFFFAOYSA-N 440.341 4.093 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 1312883989 GAPCTJIJFUIEQU-FXAWDEMLSA-N 441.538 4.383 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N2CCC(OC(C)C)CC2)cc1 1313678569 DDYZXHYTRNOUIM-UHFFFAOYSA-N 449.603 4.023 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1C[C@H](C1CCCCC1)N(C)C 1314750091 HPZUXFAOYOIZBE-JOCHJYFZSA-N 434.588 4.193 10 10 IICE FC(F)(F)C1CCN(c2nnc([C@@H]3CCOC3)n2CCCSc2nccs2)CC1 1316510886 RLKSCXQCODBEND-CYBMUJFWSA-N 447.552 4.200 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)c1cc(Br)ccc1OC(F)F 1354370493 CLDJQGGDHGCJJD-UHFFFAOYSA-N 427.245 4.156 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@@H]3CC(C)(C)Oc4ccccc43)cc2F)C[C@@H](C)O1 1355131213 ULEBRRAOKZUIDU-MBOZVWFJSA-N 426.532 4.400 10 10 IICE C[C@@H](NC(=O)CCCc1ccc(Br)cc1)c1ccc(N2CCOCC2)cc1 1357128306 LBQCLUFKZFFBJE-QGZVFWFLSA-N 431.374 4.486 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CS(=O)(=O)Cc3ccccc32)c(C)n1-c1ccc(Cl)cc1 1437934794 YTWPAJXLIUZACG-JOCHJYFZSA-N 442.968 4.076 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(/C)c3cccc(C(F)(F)F)c3)CC2)c(OC)c1 1438186985 MLIPBAGVVHPRGA-SSZFMOIBSA-N 434.458 4.475 10 10 IICE COC(=O)CNC(=O)c1ccc(NC(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)cc1 1440711138 DMZNXWVUNJBTRM-UHFFFAOYSA-N 447.535 4.373 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(N=NC(N)=O)cc2)C1 1451108595 KJTYFBUKOPDULR-HKUYNNGSSA-N 443.548 4.491 10 10 IICE CCc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnn1CCC(C)C 1457092020 FFSREORKDNDLBP-KRWDZBQOSA-N 434.531 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cccc(Cn3ccnc3)c2)cc1 1464048429 WOWYZRGZXYGXSE-UHFFFAOYSA-N 426.520 4.010 10 10 IICE COc1cccc(C[C@@H](C)CC(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1465952207 XUSDBBVJDZMABJ-UTKZUKDTSA-N 430.976 4.404 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCc4cc(Br)cc(F)c43)C2)cc1 1470594103 RJEOBCSXGSUAMT-CQSZACIVSA-N 448.336 4.195 10 10 IICE COc1ccccc1[C@@H]1CCCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786707 SWZGCCPSPNRJJW-NRFANRHFSA-N 445.510 4.247 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC[C@H](C3CCC3)C2)n1Cc1ccc(N(C)C)cc1C 1495930518 CGZQKIKYICQYKO-XMSQKQJNSA-N 425.621 4.467 10 10 IICE Cc1oc(Br)cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1526003844 UCXGRELXQZLIQD-RYUDHWBXSA-N 425.298 4.033 10 10 IICE CCOc1ccc(Br)c(C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1F 1528317466 KCKGFJOAEQHFEK-CYBMUJFWSA-N 437.309 4.004 10 10 IICE C/C(=C\C(=O)N(Cc1ccncc1)c1ccc(F)c(Br)c1)c1cnccn1 1530039772 JNQDSIGWCAFVBQ-GXDHUFHOSA-N 427.277 4.410 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(NC(=O)OC(C)(C)C)CC2(CCC2)C1 1531705406 HDILYKHHXNQQDQ-UHFFFAOYSA-N 427.589 4.473 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1533327083 AXWGPEKVYVARQM-HOTGVXAUSA-N 441.519 4.019 10 10 IICE C[C@H]1CN(c2nnc(-c3ccc(Cl)nc3)n2Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 1544740694 UWHZSBSEQUMZOX-GJZGRUSLSA-N 428.943 4.339 10 10 IICE Cc1cc(C(=O)N2CCC(c3ccon3)CC2)c(C)n1-c1ccc(Br)cn1 1557558208 KBFLOGPURHNCEI-UHFFFAOYSA-N 429.318 4.259 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1C[C@@H](F)CN1C(=O)OCc1ccccc1 1570027294 DDUUWPYQHAMJNZ-NVXWUHKLSA-N 441.286 4.064 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(F)c1 1595925815 OZVVBMDRXZWFJG-UHFFFAOYSA-N 432.293 4.329 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)COCCNC(=O)OC(C)(C)C 1597561108 OQRHELJIXJQKQH-SFHVURJKSA-N 428.529 4.023 10 10 IICE CC(C)Oc1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cn1 1610928433 BFINTWYSKIQDPD-NRFANRHFSA-N 437.544 4.092 10 10 IICE Cc1nnc(N(Cc2ccc([N+](=O)[O-])cc2)C2CC2)n1CCCSc1nccs1 1612546800 PMEWCWUZQACOLN-UHFFFAOYSA-N 430.559 4.303 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CC[C@@H](C)[C@@H]2CC)n1Cc1ccc(N(C)C)c(F)c1 1613554050 RXHDWWKXLWFUNW-UZLBHIALSA-N 444.599 4.075 10 10 IICE C[C@@H]1CC(=O)Nc2ccc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)cc2N1 1624286089 GOXNVMIIKDMFOG-QGZVFWFLSA-N 432.524 4.331 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N[C@@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c1 1627090250 IMBSUMHIYCNECZ-CVEARBPZSA-N 440.931 4.241 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1COC(=O)c1ccccc1NC(=O)c1cc(O)cs1 1627312846 BSQJRWUQFSAFTK-AWEZNQCLSA-N 446.525 4.262 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@H](N(C)CCc4ccccc4)C3)c2C)cc1 1628730715 URMYCZQKBYUMPN-DEOSSOPVSA-N 431.580 4.492 10 10 IICE Cc1cc(C(=O)N2CCC(NC(=O)OCc3ccccc3)CC2)c(C)n1-c1ccccn1 1632358393 XUUYRMFEFHMWNU-UHFFFAOYSA-N 432.524 4.020 10 10 IICE Cc1cc(CC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)c(C)n1-c1ccc(Cl)cc1 1636280432 DGCCLYDLTVZZCL-XMMPIXPASA-N 437.971 4.495 10 10 IICE Cc1cc(CCNC(=O)N(C)C2CC(NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1637409974 FEZASNIMOKBBFN-UHFFFAOYSA-N 440.588 4.334 10 10 IICE Cc1cc(C(=O)N(C)C[C@H](O)COCc2ccccc2)c(C)n1-c1cccc(Cl)c1 1638544969 VJICHNCVIQNTLB-QFIPXVFZSA-N 426.944 4.397 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H](C)c3cc(Cl)cc4c3OCC4)CC2)cc1 1676325957 OGILTYAITUVKCX-MRXNPFEDSA-N 429.948 4.266 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1 1687849029 YVVUIYSHLJKYIS-LJQANCHMSA-N 432.609 4.321 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1744778357 GKZFTICMBJPTIK-FDDCHVKYSA-N 448.615 4.456 10 10 IICE COCCC(C)(C)Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1749599555 URRQIDNLAQCNIX-UHFFFAOYSA-N 443.636 4.111 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3Cc3csc(C)c3)CC2)cc1F 1770259487 YFZGKQSKDWWIMB-UHFFFAOYSA-N 443.592 4.468 10 10 IICE CC(C)=CC(=O)Nc1cccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)n1 1860567914 VOGNQRLOFKBUPL-UHFFFAOYSA-N 425.444 4.014 10 10 IICE COC(=O)c1c(NC(=O)[C@H](N)Cc2ccc(F)cc2)sc(C)c1-c1ccc(C)cc1 1866005192 MSBDQRGYUWAXLA-GOSISDBHSA-N 426.513 4.466 10 10 IICE CCCn1cc(OCCC(C)C)c(=O)cc1CN1CCN(c2ccc(OC)cc2)CC1 1870350863 APKGCMKWPMZVJQ-UHFFFAOYSA-N 427.589 4.014 10 10 IICE C[C@@H]1C[C@](CN)(N(C)c2ccc(CNC(=O)OC(C)(C)C)cc2)CN1Cc1ccccc1 2074363418 DLOOKSOZJSCXIK-FQRUVTKNSA-N 438.616 4.139 10 10 IICE Cc1ccc([C@@H](C2CC2)n2nc(C(F)(F)F)c(N)c2I)c(O)c1 2079048734 VGKDSDDPMOLBQC-GFCCVEGCSA-N 437.203 4.102 10 10 IICE COc1ccc([C@@H](C(C)C)n2nc(C(C)(C)C)c(N)c2I)c(O)c1 2079848802 NHWHYRZALRNRIR-OAHLLOKOSA-N 443.329 4.327 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](NCc2cccc(Br)c2O)(C(F)(F)F)C1 2103576906 DNXHUCRHYPZGPB-INIZCTEOSA-N 439.272 4.186 10 10 IICE CC(C)(C)OC(=O)Nc1cc(OCCNCc2ccc(Br)cc2O)ccn1 2240555313 FXZNCMVVCRLCNQ-UHFFFAOYSA-N 438.322 4.065 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccc(Br)cc34)C2=O)c1 2297312953 UVEAZLNGAYXPDI-UHFFFAOYSA-N 438.281 4.214 10 10 IICE C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314837521 TYZFVOUQVNMBCV-NSHDSACASA-N 447.925 4.477 10 10 IICE COc1ccc(N2C(=O)/C(=C\c3cc(OC)c4c(c3)OCCO4)SC2=S)cc1F 726630156 UACWZCFCHUUTRO-RQZCQDPDSA-N 433.482 4.020 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1ccc(N3CCCC3)cc1)O[C@@H](C)C2 730823766 OVMWXJHUOWXADB-HYVJGQCMSA-N 435.568 4.364 10 10 IICE COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@H]3c3ccccc3OC(F)(F)F)CC2)cc1 741184260 BWUCKGGPNLYYIV-VQTJNVASSA-N 434.458 4.483 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cn(-c3nc(C)cc(C)n3)nc2C(C)C)cc1F 742652885 DBUAGEPTMPLIFW-UHFFFAOYSA-N 438.551 4.318 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)n1Cc1ccncc1 762589395 JULYTMAHLPGNOE-RUZDIDTESA-N 446.595 4.436 10 10 IICE C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 768915361 KJVNLAQSYUZLFH-IPHXSNPTSA-N 441.959 4.035 10 10 IICE COc1cc(O)c(CN[C@@H]2CC(=O)N(C(C)C)[C@@H]2c2ccc(Cl)c(F)c2)cc1OC 783602278 CDPRMVWJIJAVRB-VGOFRKELSA-N 436.911 4.042 10 10 IICE CC1(C)Cc2ccccc2N(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 816901834 ACNHFHWSLRBCSI-UHFFFAOYSA-N 442.562 4.484 10 10 IICE CC(C)N(C)Cc1cc(O[C@@H]2CCN(Cc3ccc(Br)cc3O)C2)ccn1 856559016 OAQNWQXGENFFTA-HXUWFJFHSA-N 434.378 4.043 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1ccc(N2CCC(CO)CC2)cc1)c1ccccc1 919969649 BHXIZHRJMSQYHH-UHFFFAOYSA-N 443.547 4.078 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3csc(-c4ccc(F)cc4)n3)cc2F)CC1 1125907915 PBLBDYKUSRRARK-UHFFFAOYSA-N 442.535 4.160 10 10 IICE COc1ccc(C[C@@H](C)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1127693374 XNZRFEISOMVZDR-HXUWFJFHSA-N 433.596 4.411 10 10 IICE COCc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1 1128563243 QVICGNBKCOCWLL-LDADJPATSA-N 430.526 4.202 10 10 IICE C[C@H]1Cc2cccc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)c2O1 1136903951 PFXYJNYWRASGEK-KKSFZXQISA-N 439.556 4.072 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@@H](c1ccccc1)N1CCSCC1 1137349515 WMDUYOZEFWHPAC-HXUWFJFHSA-N 449.414 4.293 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](C(=O)Nc2cn[nH]c2)c2ccccc2)c1C 1137630447 YOHRVWMGIMRCOE-HSZRJFAPSA-N 427.508 4.235 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCc3cccc(CN4CCO[C@H](C)C4)c3)c2C)cc1 1142116267 NXMFAPIBKZDALO-HXUWFJFHSA-N 447.579 4.253 10 10 IICE C[C@@H]1Cc2cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)ccc2O1 1147508193 UVYYVIPKLKBMLQ-IERDGZPVSA-N 439.556 4.072 10 10 IICE Cc1cc(CCNC(=O)CCc2ccccc2N2CCOCC2)c(C)n1-c1ccccc1 1150449787 MUIRRSHGIAVZIP-UHFFFAOYSA-N 431.580 4.222 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H](C)SCc1nc(O)c2ccccc2n1 1155704764 OUCKRQQHTLUBNP-INIZCTEOSA-N 425.554 4.492 10 10 IICE CCc1nc(N)nc(SCC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 1165953254 UCWALVZHMUPZHW-UHFFFAOYSA-N 446.374 4.161 10 10 IICE COC(=O)[C@]1(C(F)(F)F)CCN(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)C1 1234325360 CVEOHEKMUXIVAV-NRFANRHFSA-N 437.462 4.040 10 10 IICE CN=[S@](C)(=O)c1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 1272548804 WESVBIMOBGCWFC-WJOKGBTCSA-N 438.597 4.133 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@H](CCOC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291500477 YCNYLDWQDGRCQK-PZJWPPBQSA-N 443.661 4.256 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnccn1)OC 1292175968 WYTUOIKPKUHYLJ-QFIPXVFZSA-N 445.571 4.204 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N[C@@H]3CCc4ncc(Br)n4C3)c2C)c1 1305281695 YNWKELCIMDRFKG-QGZVFWFLSA-N 441.373 4.415 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)N[C@@H](C)c2ccccc2O)[C@H]1c1ccc(Cl)c(F)c1 1312364907 JRPAZZGNZBBDNG-LTBCBRHQSA-N 433.911 4.296 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)(C)C)nnc2N2C[C@H]3CCCN3C[C@@H]2C)cc1 1313678042 BBRZGJRXTUIVFG-NZQKXSOJSA-N 438.664 4.434 10 10 IICE O=C1/C(=C\c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCc2cccc(F)c21 1435499746 GMEWVDPYOLLZJV-SFQUDFHCSA-N 430.501 4.145 10 10 IICE CC(C)(CC(F)(F)F)NC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1435911835 INRXQYYAZXQXSD-LCYFTJDESA-N 434.480 4.264 10 10 IICE CC[C@](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)(C(=O)OC)c1ccccc1 1449318964 PHGGMRKCKGCRNK-AREMUKBSSA-N 432.520 4.423 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4cc(Cl)cc(Br)c4)CC3)CC2)cc1 1458045407 RTZUPMMFPUAHSL-UHFFFAOYSA-N 449.776 4.492 10 10 IICE Cc1cc(NCc2ccc(N3CCC(C(N)=O)CC3)cc2)c([N+](=O)[O-])cc1C(F)(F)F 1458613424 BZLYJYNFUJHDFL-UHFFFAOYSA-N 436.434 4.236 10 10 IICE Cc1ccccc1C1(NCC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCC1 1460330503 FUBIRNCBGWZLFH-WOJBJXKFSA-N 439.575 4.033 10 10 IICE CCN(C)c1ccc(CN2CC[C@@H](c3ccc(F)cc3)[C@@H](NC(=O)C(F)(F)F)C2)cc1 1460390629 MATRPHZPNZMPEN-SFTDATJTSA-N 437.481 4.318 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@@H](C)Oc2ccc(C)cc2Br)cc1 1461344344 IALFVWLTNCOXKA-MRXNPFEDSA-N 435.362 4.128 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)/C=C/SCc2ccco2)NC(=O)OC(C)(C)C)cc1 1465325796 ZSTDUUIMFHJDOF-PKHIPVCBSA-N 445.585 4.475 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCN([C@H](C)c4ccc(Cl)cc4)CC3)C2)cc1 1470772357 JWPDDKKLOTZGNB-NQIIRXRSSA-N 442.991 4.016 10 10 IICE CCOC(=O)CN(CC(=O)Nc1cc(Cl)c(Cl)cc1Cl)Cc1ccccc1O 1473572424 RAZZDCCVECLFBT-UHFFFAOYSA-N 445.730 4.356 10 10 IICE COCC1(C)CCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CC1 1518770812 CSUIDWGBCGTKFL-UHFFFAOYSA-N 444.630 4.232 10 10 IICE O=C(CCOc1cc(Cl)cc(Cl)c1)NCc1ccc(N2CCOCC2)c(F)c1 1526003471 PRQCXMPHUIARED-UHFFFAOYSA-N 427.303 4.054 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccc(OC)c1 1532276914 XDHIRUOXSFHGOW-QHCPKHFHSA-N 440.927 4.329 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4ccccc4n3CC(F)(F)F)CC2)c(OC)c1 1534589128 XVTCXUSCWDLWAQ-UHFFFAOYSA-N 447.457 4.183 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2cc(S(C)(=O)=O)ccc2F)c1 1538188226 ZBTTWLUYTMXCJZ-UHFFFAOYSA-N 434.920 4.220 10 10 IICE CCOC(=O)C[C@H](NC(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1cccc(OC)c1 1544715654 TUXFIWASRRICFJ-DEOSSOPVSA-N 448.519 4.340 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@](C)(O)[C@@H](C)CC 1545503421 ABEHNBVKCHUIOX-RLSLOFABSA-N 443.636 4.314 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1cc(-c2ccc(OC(F)(F)F)cc2)[nH]n1 1545639053 ASBRIRCFPDTRPX-UHFFFAOYSA-N 431.414 4.490 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)C1CC(O)(c2cccc(Cl)c2)C1 1588193203 OOORJXXCOJUDNW-UHFFFAOYSA-N 438.749 4.454 10 10 IICE CC[C@@H](C)c1nnc(N2CCOC[C@@H](C3CCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1613355460 NOCJUTGNNOUBEK-XLIONFOSSA-N 429.584 4.298 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@H](CC)[C@@H]2CCCO2)sc(C)c1-c1ccccc1 1617103418 LSQUBPFJUMLSLQ-MSOLQXFVSA-N 430.570 4.386 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)Cc1ccc(-n2cccc2)cc1 1618427637 YERFXYPUULLNRV-UHFFFAOYSA-N 433.552 4.408 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccccc1O)c1cccc(Br)c1 1622772752 FSMPXGKSYHRZIY-QGZVFWFLSA-N 435.318 4.037 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CC[C@@H](O)c1ccc(C(C)(C)C)cc1 1623928853 QSAZOADGALKHDB-HXUWFJFHSA-N 447.959 4.359 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Cn2cc(C=O)c(-c3ccccc3)n2)cc1 1624287399 ZCIHJSVHLNECHB-UHFFFAOYSA-N 442.519 4.251 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1628932418 VSRKYTKIZCVPCA-QFIPXVFZSA-N 425.573 4.495 10 10 IICE Cc1cccnc1Oc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)cc1 1629967947 KKLGFFFVFRRULU-UHFFFAOYSA-N 435.499 4.213 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](/C=C\C(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)C1 1633402157 UCHLJLXMIIWLRZ-QJWNTBNXSA-N 429.517 4.467 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)c1csc(I)c1 1637129743 IJJFHFOPEJVROQ-UHFFFAOYSA-N 428.078 4.295 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3cc(C(F)(F)F)ccc3Cl)CC2)cc1F 1642236033 PJRIHWMPXBVYQR-UHFFFAOYSA-N 445.844 4.267 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCn1ccc2cc(Cl)ccc21 1643244876 FNZBPCREVSZRJD-UHFFFAOYSA-N 428.916 4.372 10 10 IICE COc1ccc(C)cc1[C@@H](C)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1653831604 MTTSKGAZWGPGJH-MRXNPFEDSA-N 428.488 4.068 10 10 IICE CC(C)CN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1ccccc1 1654404231 DQAQGALGHWMRNZ-PMACEKPBSA-N 427.564 4.218 10 10 IICE Cc1cc(CCNC(=O)N2CCCC[C@@H]2COC(=O)NC2CC2)c(C)n1-c1ccccc1 1684443621 CMWMUPMMQRVPOW-HSZRJFAPSA-N 438.572 4.089 10 10 IICE Cc1cc(C)n(Cc2nnc(N3CCC[C@H]3C(C)C)n2CCCSc2nccs2)n1 1707829373 FILXJRBJBGUKIQ-SFHVURJKSA-N 445.662 4.403 10 10 IICE CC[C@@H](C)c1nnc(N2CC=C(COC)CC2)n1Cc1ccc(N2CCSCC2)cc1 1708434402 GAEHADDAEHWLFO-LJQANCHMSA-N 441.645 4.176 10 10 IICE Cc1cc(Cn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)cs1 1724215038 VDGNDRMGIIAUPH-UHFFFAOYSA-N 425.602 4.293 10 10 IICE C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)[C@@H]1C 1726599883 YSSAYVDGYXYCLY-RTBURBONSA-N 425.621 4.067 10 10 IICE C[C@@H]1CCC[C@@](Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1752093907 XGWYNLZPPDZRNG-FQRUVTKNSA-N 448.615 4.116 10 10 IICE CCN(CC1CCC1)c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(C)C)cc1C 1766810627 ZTTLEELQUWNYFJ-GMAHTHKFSA-N 441.620 4.051 10 10 IICE CN1CCc2cc([C@@H](O)C[C@H](COCc3ccccc3)NC(=O)OC(C)(C)C)ccc21 1999508876 LXLXWIFYTYJDIG-GGAORHGYSA-N 426.557 4.213 10 10 IICE Cc1ccc([C@H](n2nc(C3CC3)c(CN)c2I)C(C)(C)C)c(O)c1 2079002869 PYLOOIRUHVWHLA-KRWDZBQOSA-N 439.341 4.473 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(Br)cc(F)c2O)[C@H]2CC[C@H]21 2121183672 LULCLHIYIOIMOP-VNQPRFMTSA-N 429.330 4.171 10 10 IICE OCc1ccc(N2C[C@@]34CCC[C@@]3(CN(Cc3ccccc3)C4)C2)c(Br)c1 2153332580 BZCAAIOJUCDWES-ZRZAMGCNSA-N 427.386 4.434 10 10 IICE Cc1ccc(OCCn2cc(C=C3C(=N)N4N=CSC4=NC3=O)c3ccccc32)cc1 2293402307 HUWQEEHJMLEYIK-UHFFFAOYSA-N 429.505 4.278 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccc(OCc2cccc(F)c2)cc1 2313558114 SZCUPYVVBAMSKX-UHFFFAOYSA-N 434.398 4.210 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(=Cc3ccc(O)c(OCC)c3)SC2=S)cc1 2314732796 ZKXFOQLSAJQXBU-UHFFFAOYSA-N 429.519 4.373 10 10 IICE O=C(CCCCCN1C(=O)C(=Cc2ccc(O)cc2O)SC1=S)Nc1ccccc1 2314831057 BMHHOSHULFZBPN-UHFFFAOYSA-N 442.562 4.498 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@@H]2CC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380761832 JLVNDKYROYUHED-ZFWWWQNUSA-N 441.366 4.115 10 10 IICE CCN(CC)c1ccc(/C=C2/N=C(c3ccc(I)cc3)OC2=O)cc1 3024559 DBBGTBBVXSHYJG-QGOAFFKASA-N 446.288 4.482 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(O)c(OC)c1)N2 14459059 RXQBFGRONAKLEI-BSRJHKFKSA-N 428.554 4.258 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478329 FZHFETZVPJXVCI-PPSDVSMJSA-N 427.526 4.498 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478428 XQUBCKFRSLPEOD-XLNZFTOWSA-N 434.540 4.493 10 10 IICE CCOC(=O)Cc1sc(NS(=O)(=O)c2ccccc2Cl)nc1-c1ccccc1 71556440 XNTBCJCYNXPNEG-UHFFFAOYSA-N 436.942 4.370 10 10 IICE O=C(CCCCCN1C(=O)/C(=C\c2ccccc2O)SC1=S)Nc1nccs1 210757936 QNZFBWDUDHIDPS-NTCAYCPXSA-N 433.580 4.249 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3cccc(Br)c3O)C[C@H]2C1 401140045 VCPFGEZHRSWYSI-JYJNAYRXSA-N 425.367 4.280 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cnc(Cl)c(Cl)c3)n2)cc1OC 739384835 NOURCQYCMGBUBF-UHFFFAOYSA-N 446.337 4.330 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3csc(C(=O)OC)c3)n2)c1C 743046119 ANVUDSHOXHQKBQ-UHFFFAOYSA-N 439.584 4.287 10 10 IICE CC(C)CC[C@@](C)(O)CNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 743774507 ADQSDCVKPIMJGZ-VMTBQTDASA-N 440.656 4.033 10 10 IICE COC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1 747857316 MQYUUKLOLHEDJQ-RUDMXATFSA-N 436.461 4.075 10 10 IICE COc1cc(N2CCN(Cc3ccc(-c4ccncc4)cc3F)CC2)cc(OC)c1OC 761220191 VXOOXSMPPJKEEF-UHFFFAOYSA-N 437.515 4.236 10 10 IICE CCc1c(C)nn(-c2cccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)c2)c1C 766998951 JTEGYMLFESIRGQ-UHFFFAOYSA-N 446.595 4.190 10 10 IICE COc1cccc(CNCc2ccc(N3CCN(CC4CC4)CC3)cc2)c1OC(F)F 768670981 VOJNIPRDLLLPBK-UHFFFAOYSA-N 431.527 4.118 10 10 IICE Cc1cc(Br)cc(/C=C2\SC(=S)N(c3ccc(C(N)=O)cc3)C2=O)c1 772178593 IGMPDZQGCTUUMB-DHDCSXOGSA-N 433.352 4.262 10 10 IICE C[C@@H](N[C@H]1CCc2nc(-c3ccccc3)ncc2C1)c1ccc(N2CCOCC2)c(F)c1 776931975 OROWHLNAWLTKPR-GCJKJVERSA-N 432.543 4.327 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3COc4ccc(Br)cc43)cc2)CC1 1136705681 XCEDQJZUTXXJOR-HXUWFJFHSA-N 429.358 4.478 10 10 IICE CC(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc1 1142528446 YCKORLOZXMNTQQ-UHFFFAOYSA-N 443.613 4.072 10 10 IICE COC(=O)c1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc2[nH]ccc12 1160355825 VNDBLZKFXQCKOM-UHFFFAOYSA-N 429.476 4.356 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCCC[C@@H]3c3cccc(C(F)(F)F)c3)nc12 1193704884 ZTUVELJWBAAVHO-GOSISDBHSA-N 448.445 4.358 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)/C(=C\c1ccccc1)C(F)(F)F 1266258975 MLXZDDHAIQRWIJ-XQNSMLJCSA-N 443.513 4.481 10 10 IICE CC(C)c1nnc(N2CC[C@H](C)[C@@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1287192295 IOEPMRCCDKGGLR-PMACEKPBSA-N 425.621 4.141 10 10 IICE Cc1nc(-c2c(C)noc2C)sc1C(=O)NCc1ccc(N2CCSCC2)cc1 1291625787 BRXYTZASFYXTAX-UHFFFAOYSA-N 428.583 4.207 10 10 IICE Cc1cc(CC(=O)Nc2ccc(OCc3nn[nH]n3)cc2)c(C)n1-c1ccc(Cl)cc1 1293568923 RKNPPFAASAAIAE-UHFFFAOYSA-N 436.903 4.021 10 10 IICE CC(C)(C)OC(=O)[C@]1(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)CC=CCC1 1294858251 BWRVMVUFZDWGHE-YADARESESA-N 448.991 4.194 10 10 IICE CC(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)nc1C 1295128412 QZAGGLJTRKATTR-UHFFFAOYSA-N 441.329 4.088 10 10 IICE CC(C)O[C@@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CC[C@@H](C)C2)CCOC1 1304971744 IWOIDYMHNCWSOI-IECBHUPTSA-N 428.577 4.097 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@](C)(O)[C@H](C)CC 1305384743 VEAQXTQSEHTCFY-WZOHSFFVSA-N 443.636 4.062 10 10 IICE COc1ccc2c(c1)[C@@H](C(=O)N[C@@H]1CCCN(Cc3cc(Cl)ccc3O)C1)CCC2 1445885546 RKYXZDUDXACYSQ-CTNGQTDRSA-N 428.960 4.255 10 10 IICE Cc1cc(CC(=O)N2CCC(N3CCOC[C@H]3C)CC2)c(C)n1-c1ccc(Cl)cc1 1450520927 DUSXWCSCXHTKTN-GOSISDBHSA-N 429.992 4.002 10 10 IICE CN(C(=O)c1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1cccnc1N1CCCC1 1457366550 NLLKDCUJBKDUAL-UHFFFAOYSA-N 436.556 4.252 10 10 IICE C[C@@H]1CN=C(N2CCN(C(=O)c3ccccc3N=Nc3ccc(N(C)C)cc3)CC2)S1 1465133780 VDECXYJLAQVVRC-QGZVFWFLSA-N 436.585 4.417 10 10 IICE COc1cccc([C@H](NC(=O)OC(C)(C)C)C(=O)NCc2c(O)ccc3c2CCCC3)c1 1465959057 XCLZOCICKQZISR-QFIPXVFZSA-N 440.540 4.162 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(Br)c(CO)c3)ccc21 1469641870 XEXLWAGPNGXNIM-UHFFFAOYSA-N 431.330 4.412 10 10 IICE COc1ccc([C@@H](NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c2ccccc2)cc1 1470905215 MQPVWISHPBYPAD-SANMLTNESA-N 445.563 4.245 10 10 IICE Cc1ccc2c(c1)OCCN2C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1524239587 KGMCRDAUNGSFGB-UYRXBGFRSA-N 442.537 4.151 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)ccc1N1CCOCC1 1537497826 VFBAMTQADHOVRI-UHFFFAOYSA-N 435.490 4.102 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(F)cc1NC(=O)OC(C)(C)C 1539302879 YBYAJYUSFSERRU-UHFFFAOYSA-N 443.519 4.282 10 10 IICE CCc1ccc(-c2nc(CC(=O)NC[C@H](c3ccc(N(C)C)cc3)N(C)C)cs2)cc1 1539705923 JEBUYRWIIITMFS-HSZRJFAPSA-N 436.625 4.400 10 10 IICE CCS[C@@H]1CC[C@@H](N(C)c2nnc([C@H]3CCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1552511265 AEZVNOHCTRXOSB-IPMKNSEASA-N 447.624 4.146 10 10 IICE Cc1nc2cccc(Cl)c2cc1C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 1566023066 KXGVNBOMZCYUGV-UHFFFAOYSA-N 427.907 4.227 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCc1ccc2occc2c1 1585741006 WDRGIDPTDGPMSZ-XDHOZWIPSA-N 440.521 4.480 10 10 IICE COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3Cl)CC2)c(OC)c1 1595989929 MJSJXFNMZSRKLO-QZTJIDSGSA-N 435.351 4.463 10 10 IICE C/C=C/C[C@H](NC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C(=O)OCC 1611354221 RTJIPZDOJRHWGJ-FZMUQLTDSA-N 433.346 4.484 10 10 IICE CO[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CC1(C)C 1619530747 LGMUZPZRNYHWON-QFIPXVFZSA-N 425.621 4.295 10 10 IICE COCCOc1ccccc1N1CCN(C(=O)c2cc(C)n(-c3ccccc3C)c2C)CC1 1622043866 NJPIVDJPXPFFFC-UHFFFAOYSA-N 447.579 4.390 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1 1623471463 FTSIRFZZMMROOS-XMMPIXPASA-N 435.568 4.437 10 10 IICE Cc1cc(CNC(=O)[C@@H]2Cc3cc(Br)ccc3O2)c(C)n1-c1ccccc1 1624075714 ZMFIMTXMTYMKQO-NRFANRHFSA-N 425.326 4.477 10 10 IICE Cc1cc(C(=O)NCc2ccc3cnn(C)c3c2)c(C)n1-c1ccc(Br)cn1 1624902914 RHQGHPAOOORSKM-UHFFFAOYSA-N 438.329 4.068 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)cc1 1634611143 CCZUSSMPASCTJP-XMMPIXPASA-N 438.616 4.074 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)NCC1(c2ccccc2)CCOCC1 1642089723 UWZPYHYIYGMESF-UHFFFAOYSA-N 448.485 4.202 10 10 IICE Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1642997860 QATJFTXCXSNPIN-RBBKRZOGSA-N 436.600 4.361 10 10 IICE COC1CCN(c2ccc(CN3C4CCC3(CNC(=O)OC(C)(C)C)CC4)cc2)CC1 1648588249 XFIBHIZKINADRQ-UHFFFAOYSA-N 429.605 4.324 10 10 IICE CCOC(=O)c1cnc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c(Cl)c1 1650700430 XNIHNMUQNHDWJQ-UHFFFAOYSA-N 441.915 4.413 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1COC2(CCC(C)CC2)O1 1680866613 PDIFXNUQIAQKRB-WSGJVKOYSA-N 441.366 4.008 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1695292625 MSKYKLSDBBNIHQ-IFMALSPDSA-N 438.664 4.390 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CC(C)(C)SC)CC2)cc1F 1697471398 AIKFHOMAFFRWSG-UHFFFAOYSA-N 435.613 4.093 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC1CCOCC1 1712390253 NSROHHDPAFBBGL-UHFFFAOYSA-N 437.588 4.252 10 10 IICE CCOCCN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(C)CC2)cc1 1747340534 TXOYUJFJOLPXHH-UHFFFAOYSA-N 434.588 4.097 10 10 IICE CN(Cc1cccc(F)c1)c1nnc([C@H]2CCOC2)n1CCCSc1nccs1 1747741034 FRRQJNZJNIEXQU-INIZCTEOSA-N 433.578 4.196 10 10 IICE CCOc1cc(C=C2C(=O)N(c3ccccc3)N=C2C)cc(Cl)c1OCC(=O)OC 1857626354 RKKFQJXGAQWHBZ-UHFFFAOYSA-N 428.872 4.097 10 10 IICE Cc1c(OCCOc2ccc(N)cc2)c(=O)ccn1C1CCN(Cc2ccccc2)CC1 1857911034 MZPGQQRLGOBHAK-UHFFFAOYSA-N 433.552 4.034 10 10 IICE COc1cccc(C=C2SC(=S)N(CCCC(=O)Nc3ccc(O)cc3)C2=O)c1 2296885094 CATWVFDOLPIGPR-UHFFFAOYSA-N 428.535 4.021 10 10 IICE COc1cccc2c1OCC(C=C1SC(=S)N(Cc3ccc4c(c3)OCO4)C1=O)=C2 2314450596 GSCGWWNOVUPFTR-UHFFFAOYSA-N 439.514 4.144 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2cccc(OCc3ccc(C)cc3)c2)SC1=S 2314767931 JBCRSWOXQZWAEK-UHFFFAOYSA-N 427.547 4.338 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(C)c3)C2=O)ccc1O[C@@H](C)C(=O)O 2314930871 AEKFGIMBQDXGFY-ZDUSSCGKSA-N 429.519 4.261 10 10 IICE CC(C)(C)OC(=O)N1C[C@@]2(CNCc3cc(Br)cc(F)c3O)CC[C@H]1C2 2338387583 DPPKLSVMJITFRA-LIRRHRJNSA-N 429.330 4.173 10 10 IICE Cc1ccc(CN[C@@H]2C[C@H](CNC(=O)OC(C)(C)C)C2(C)C)c(O)c1Br 2352940325 DDOBQJRIWADFMX-HUUCEWRRSA-N 427.383 4.492 10 10 IICE COc1cccc2c1OCC(/C=C1\SC(=S)N(Cc3ccc4c(c3)OCO4)C1=O)=C2 33514402 GSCGWWNOVUPFTR-OCKHKDLRSA-N 439.514 4.144 10 10 IICE CC[C@@H](C)Oc1ccc(/C=C2\SC(=S)N(NC(=O)c3ccc(OC)cc3)C2=O)cc1 33546609 QODOHLZCALGJDV-RMENWYJGSA-N 442.562 4.419 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 226803241 FCGBWFYRUSJTSC-PQNGQFLHSA-N 434.540 4.493 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 226871455 FZHFETZVPJXVCI-DYXJYMTDSA-N 427.526 4.498 10 10 IICE CC[C@H](NCc1cnn(C)c1NC(=O)OC(C)(C)C)c1cc(Br)ccc1O 379932358 WUKWRFVFUFOSFC-HNNXBMFYSA-N 439.354 4.476 10 10 IICE Cc1nc(C2(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)CCCCC2)no1 435526693 OSBLGDQSBXPWMR-UHFFFAOYSA-N 435.572 4.075 10 10 IICE COc1ccc(Nc2nc(C(=O)N[C@H](C)c3ccc(N4CCOCC4)cc3)cs2)cc1 743323087 RYUDRJRMLYSFDN-MRXNPFEDSA-N 438.553 4.223 10 10 IICE O=S1(=O)CCc2ccc(S(=O)(=O)Nc3ccc(N=Nc4ccccc4)cc3)cc21 763275229 WELOQIUBGXEKFI-UHFFFAOYSA-N 427.507 4.233 10 10 IICE COc1ccc(N2CCC(NC(=O)N[C@@H]3CCCc4cn(C5CCCC5)nc43)CC2)cc1 764711430 ZHHUJQKSBSDJAT-HSZRJFAPSA-N 437.588 4.352 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(F)cc1F 769281410 ALABGPVIJLEERJ-LPTQZCDUSA-N 428.479 4.102 10 10 IICE C[C@H](NCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(N(C)C)cc1 775834344 RUSZSSVQQQHYAQ-AWEZNQCLSA-N 425.514 4.074 10 10 IICE O=C1N=C(SCC(=O)N2CCOC[C@@H]2C2CC2)S/C1=C/c1csc2ccccc12 814772888 HTLVYLVTSRWXQP-TWIVVOHQSA-N 444.603 4.242 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCCN2Cc2ccc(N3CCOCC3)c(F)c2)C1 816658272 JDVVTLMEUSGCGH-IRLDBZIGSA-N 447.595 4.274 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(OCC4CC4)c(Cl)c3)cc2F)C[C@@H](C)O1 1125259124 XVKPAMZHEJMIKF-GASCZTMLSA-N 447.938 4.207 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc2c(C)nn(-c3ccccc3)c2n1 1129814467 GYQJHKPZKSOLRZ-GOSISDBHSA-N 427.552 4.464 10 10 IICE Cc1cc(C(=O)NCc2ccc(N(C)C)nc2)c(C)n1-c1ccccc1Br 1136204774 XYIZDIGJAWVIAC-UHFFFAOYSA-N 427.346 4.248 10 10 IICE C/C=C\c1ccc(OCC(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(OC)c1 1136480435 MLFSVPKUZFVLDM-DADDIACRSA-N 438.568 4.381 10 10 IICE C[C@@H](NC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1ccc(N2CCOCC2)cc1 1142503847 GMRQHIXSNOPYSL-YLJYHZDGSA-N 433.593 4.030 10 10 IICE COc1ccc(C2=NO[C@H](CNC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)C2)cc1 1227036077 OKFRRUDBDBASSD-DEOSSOPVSA-N 446.551 4.138 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CC[C@H](C)N(C(=O)OC(C)(C)C)C1 1230200615 LEDAJVFHIXDDGX-CMKODMSKSA-N 432.609 4.079 10 10 IICE CCO[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H]2CCN(c3ccc(OC)cc3)C2)C12CCCCC2 1230301189 TYSMNPWQKHBGDA-WWPVKYPJSA-N 429.605 4.291 10 10 IICE CCOC(=O)[C@H]1[C@H](C)N(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@H](C)C[C@H]1C 1289761614 JEDSLJMXKATYLK-ZAEZVXHUSA-N 428.573 4.343 10 10 IICE Cc1cc(C(=O)NCCCCNc2ccccn2)c(C)n1-c1ccc(Br)cn1 1292947753 WEKVEEXWLHIRQU-UHFFFAOYSA-N 442.361 4.269 10 10 IICE CCC[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)CCO1 1294095442 PBJIOOMOUASQEQ-QHCPKHFHSA-N 425.621 4.439 10 10 IICE Cc1cccc(CNC(=O)c2ccc(C(=O)NCc3c(O)ccc4c3CCCC4)cc2)c1 1294869855 OEPUIQPGFJCWIF-UHFFFAOYSA-N 428.532 4.439 10 10 IICE CCN(CC1CC1)c1nnc(Cc2csc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1295689981 KNKKHIBMHUIZDO-UHFFFAOYSA-N 428.581 4.124 10 10 IICE CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)N1CCOCC1 1306923940 ICIMBMQZVQTTMJ-HSZRJFAPSA-N 425.529 4.375 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H]1CSc2ccccc2O1 1312921286 GJBJJZCISFFRNA-HNNXBMFYSA-N 437.359 4.240 10 10 IICE Cc1sc(NC(=O)CC[C@H]2CC[C@@H](C(N)=O)O2)c(C(=O)OC(C)C)c1-c1ccccc1 1353944037 AONGHWSKYPDXQV-SJORKVTESA-N 444.553 4.040 10 10 IICE Cc1nc(-c2ccccn2)sc1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1354658532 PQCYXDPHFJTAKJ-GASCZTMLSA-N 440.544 4.196 10 10 IICE COC(=O)Nc1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1F 1357551495 LKCFCWDZEPHMLJ-UHFFFAOYSA-N 425.460 4.485 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)Cc2ccc3c(c2)OC(F)(F)O3)cc1 1360069424 YJHBSGXOMZATOR-UHFFFAOYSA-N 430.373 4.208 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCCCC[C@@H]3c3ccccc3)CC2)cc1 1442747360 UASGRDRHXDKOLM-KVACCUTFSA-N 447.579 4.044 10 10 IICE CC(C)O[C@]1(c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCC[C@@H]2C)CCOC1 1509796625 OMNQOYQPCBBIEN-AXHZCLLHSA-N 428.577 4.097 10 10 IICE C[C@@H](NC(=O)CSc1ccccc1Br)c1ccc(N2CCOCC2)cc1 1519155644 HOULYAYBQXSKRI-OAHLLOKOSA-N 435.387 4.255 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccccc2OCc2cn3ccccc3n2)cc1 1530897222 PDKIKVDGDIXSPH-UHFFFAOYSA-N 444.535 4.130 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)c2cn(CCc3ccccc3)nn2)cc1 1533209286 CNQGJTGTGGBQDP-UHFFFAOYSA-N 429.524 4.022 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)cc2)CC1 1536924042 AUOASVLGVHBXQA-UHFFFAOYSA-N 446.507 4.069 10 10 IICE CCCCN1C(=O)C[C@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[C@H]1c1ccc(OC)cc1 1538976884 TXBLFNMIXOMPGX-FMNCTDSISA-N 437.584 4.328 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)CC3(Cn4cnnn4)CCCCC3)cc2Cl)C1 1539913910 WJAMQTPFOADWME-SFHVURJKSA-N 445.011 4.220 10 10 IICE Cc1cc(CNC(=O)[C@H](COC(C)C)NC(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1544088011 XPHULMVTZYRKOO-NRFANRHFSA-N 429.561 4.029 10 10 IICE COc1cccc2c1CN(C(=O)CCCN1C(=O)/C(=C/c3cccs3)SC1=S)C2 1544482129 VNFPGDSXKRPUPW-WQRHYEAKSA-N 444.603 4.281 10 10 IICE CC(C)c1csc(CNC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1545390788 MISLIZYNHXPZOF-CXUHLZMHSA-N 449.598 4.313 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)cc1 1545942520 XTVBVXGFZBPYLN-VWLOTQADSA-N 432.564 4.368 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CCOC(C)(C)C2)cc1 1547449412 VZRJACPVNUUXPK-UHFFFAOYSA-N 439.629 4.440 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCC[C@@H]3c3ccc(C(C)C)cc3)CC2)cc1 1559718244 DLEZDGDPEIDBMS-XNMGPUDCSA-N 437.628 4.139 10 10 IICE COC(=O)[C@@H](c1cc(OC)ccc1Br)N(C)Cc1ccc(N(C)C)c(C)c1 1559853850 LEHMWTVZYZKROO-HXUWFJFHSA-N 435.362 4.178 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCC(O)(Cc3ccccc3F)CC2)c1 1568347567 FWAVMNQZFSNFOZ-UHFFFAOYSA-N 434.511 4.256 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)CCCc1ccc(O)c(F)c1 1568379136 VBXHAZATYWFRNM-UHFFFAOYSA-N 430.520 4.243 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cnc4ccnn4c3C(F)F)cc2Cl)C1 1586083330 ZYYOAJQFKILZNK-CYBMUJFWSA-N 433.890 4.487 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc(F)c2Br)cc1 1598290770 COWIWPFOWAZZCE-QGZVFWFLSA-N 435.337 4.476 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H](c1cccnc1)C(C)C 1614012315 QOYMHOYXBUNTFW-DEOSSOPVSA-N 448.615 4.401 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CNC(C)(C)c3cccc(Cl)c3)cc2F)C[C@@H](C)O1 1616714084 IEDRRXZHEMYACZ-IAGOWNOFSA-N 447.982 4.234 10 10 IICE COc1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1OC(F)F 1624371036 CPSDEBMBGBBWJD-UHFFFAOYSA-N 442.462 4.376 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)c1cnn2c1N[C@@H](C1CC1)C[C@H]2C(F)F 1625241067 UEQYNJFHBRZDDP-UXHICEINSA-N 431.531 4.400 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@H]2[C@@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1625680343 VCUMCNUXCQZQIR-PKOBYXMFSA-N 432.362 4.281 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1 1628667635 YVRNSJVLYVWYOV-PVABEOQZSA-N 433.335 4.410 10 10 IICE Nc1c(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)ccnc1-c1ccccc1 1629055411 JBFSNGZOIYPLDP-KRWDZBQOSA-N 438.478 4.331 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c2ccc(F)cc2n1 1630257206 QWFOUFJYEVYCOT-GOSISDBHSA-N 427.907 4.436 10 10 IICE CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1cc(C)n(-c3ccccc3)c1C)CC2 1637410679 QJOJJJQRIQGTJA-UHFFFAOYSA-N 430.552 4.363 10 10 IICE COc1ccc2c(c1)CCCCN2CC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1 1642311887 UJHBLYDCYBSAPO-DEOSSOPVSA-N 442.003 4.445 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)Cc2ccoc2)c(C)n1-c1ccc(Br)cc1 1643626785 RIJQBHUOHZXLFU-QGZVFWFLSA-N 431.330 4.031 10 10 IICE CCN(CC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)Cc1cc(Br)ccc1O 1653469765 YDVKUKPNXNTNNW-CYBMUJFWSA-N 441.316 4.474 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)CCC1CCN(c2ccncc2)CC1 1673745878 YBBFNZURPKWIPL-NRFANRHFSA-N 437.632 4.335 10 10 IICE O=C(NCCCOc1ncc(C(F)(F)F)cc1Cl)NCc1cc(Cl)ccc1O 1681313928 DHUPCSFSUKBDQU-UHFFFAOYSA-N 438.233 4.381 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]2[C@H]1CCN2C(=O)OC(C)(C)C 1683254378 PMUOBRXBDOLYMJ-YUXAGFNASA-N 444.620 4.175 10 10 IICE Cc1cc(CCNC(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c(C)n1-c1ccccc1 1684445199 YJOABQLGDPYCMU-JOCHJYFZSA-N 430.552 4.021 10 10 IICE CCN(CC)CC[C@@H](NC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1)c1ccccc1 1685766508 AIJUTNKNOUSUFE-HSZRJFAPSA-N 442.579 4.139 10 10 IICE C[C@@H]1CCC[C@]1(O)Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1693645260 BITJTBOBGBUDAX-CLOONOSVSA-N 425.621 4.363 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@H]1OCCC1(C)C 1694110075 VGMHNNYXXJFTAC-DENIHFKCSA-N 441.620 4.332 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc(CC(C)(C)C)n1CCCn1cccn1 1696684758 IRWUBXICCQWNJH-UHFFFAOYSA-N 435.620 4.390 10 10 IICE CCCN1CCC[C@H]1Cn1c(Cc2ccsc2)nnc1N(C)Cc1ccccc1O 1709802795 ODPVKRTUJRDREL-FQEVSTJZSA-N 425.602 4.147 10 10 IICE COC1(CCn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)Cc2ccccc2O)CCC1 1711618224 DQPWHBJAYAXBAV-TZIWHRDSSA-N 442.604 4.498 10 10 IICE Cc1cc(-c2nnc(N(C)CC(=O)NC(C)C)n2C[C@H]2CC2(C)C)c(C)n1-c1ccccc1 1724206160 VCYLGVWTMRJXEP-HXUWFJFHSA-N 448.615 4.360 10 10 IICE C[C@H]1C[C@@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1726486902 QHMUSOKFCDGAPZ-GDAAHCPNSA-N 441.576 4.047 10 10 IICE CCc1nnc(N2CCC[C@@H](c3noc(C(C)C)n3)C2)n1Cc1ccc(N(C)C)cc1C 1727576981 OWDATHBRGFJNBJ-LJQANCHMSA-N 437.592 4.154 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(C(=O)Nc2ccccn2)n1Cc1ccc(N(C)C)cc1C 1743838361 FNBSCNQYLQVBSU-GOSISDBHSA-N 449.603 4.221 10 10 IICE CCOC(=O)C(=O)Nc1sc(C)c(-c2ccc(Br)cc2)c1C(=O)OCC 1860738070 MXHQOKNFZIFQJA-UHFFFAOYSA-N 440.315 4.164 10 10 IICE COc1ccc(CC(=O)NCc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c(Br)c1 1891165587 WOQKPMUYSQJLRF-LPHOPBHVSA-N 429.358 4.305 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C(C)C)c(CN)c2I)c(O)c1 2078984792 ZNCKPADORPUQCM-KRWDZBQOSA-N 427.330 4.329 10 10 IICE NCc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)cc1Br 2130170727 SYHRKNOYELUNBY-GOSISDBHSA-N 428.296 4.161 10 10 IICE COc1ccc(Br)c(CN[C@H]2CCN(C(=O)OC(C)(C)C)CC2(C)C)c1O 2236038075 SXGPGYVNJRSSGI-INIZCTEOSA-N 443.382 4.289 10 10 IICE COc1cc(OC)c(-n2c(C)cc(C=C3C(=N)N4N=CSC4=NC3=O)c2C)cc1Cl 2297469783 MUJCKHJCMHKQFZ-UHFFFAOYSA-N 443.916 4.014 10 10 IICE CC(C)C[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(F)c(Br)c2)SC1=S 2323813074 VJUHHEFIENWXPU-LBPRGKRZSA-N 432.336 4.289 10 10 IICE COc1ccc(N2N=C(C(F)(F)F)C(=Cc3cc(OC)c(OC)c(OC)c3)C2=O)cc1 2332115182 WCPQGQRLBZNLEN-UHFFFAOYSA-N 436.386 4.070 10 10 IICE Cc1ccc(CN(C)C(=O)C2CCN(Cc3ccccc3)CC2)c(O)c1Br 2380767533 GVJUXHWCPWWLLY-UHFFFAOYSA-N 431.374 4.334 10 10 IICE O=c1c2ccccc2nc(-c2ccc(F)cc2)n1NCc1cc(Br)ccc1O 27531285 GLPQZIBNAVKXPB-UHFFFAOYSA-N 440.272 4.414 10 10 IICE CC(=O)Nc1ccc(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])N=C2c2ccccc2)cc1 33303885 FWODMTMTPWFRET-RCCKNPSSSA-N 426.432 4.388 10 10 IICE COc1ccc(OC)c(CCn2c(-c3ccc(N4CCCC4)cc3)cc(C(N)=O)c2C)c1 43223908 UGIUXZALKUADJX-UHFFFAOYSA-N 433.552 4.423 10 10 IICE Cc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3OCCN(C)C)cs2)cc1C 71556395 UGABFVKXIGZSIT-UHFFFAOYSA-N 431.583 4.168 10 10 IICE CN(C)CCOc1ccccc1-c1csc(NS(=O)(=O)c2ccccc2Cl)n1 71556402 CCQXGJDJHATIRT-UHFFFAOYSA-N 437.974 4.205 10 10 IICE CCOC(=O)COc1ccccc1/C=C1/SC(N(C)c2ccc(Cl)cc2)=NC1=O 96836008 GIEBYSCSWKTSCI-LDADJPATSA-N 430.913 4.389 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccc(F)cc1 210715491 QHQGXKYLUKDLTJ-SFQUDFHCSA-N 445.497 4.354 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3cc(Br)ccc3O)C[C@H]2C1 401125638 NPKMFGUVOKOFEQ-JLJPHGGASA-N 425.367 4.280 10 10 IICE O=C(CCOc1cccc(Cl)c1Cl)NCc1ccc(N2CCC(CO)CC2)cc1 735828249 LPQBMAZFIPLQAV-UHFFFAOYSA-N 437.367 4.287 10 10 IICE CC(C)c1noc(CCCNC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n1 749356454 NPWKDYIQCIQJME-UHFFFAOYSA-N 425.533 4.197 10 10 IICE Cc1nccn1-c1ccc([C@@H](C)NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 754925979 MFIRQXCKOMKUDM-JPYJTQIMSA-N 434.540 4.338 10 10 IICE CCCn1c(C)cc(-c2csc(NS(=O)(=O)c3csc([N+](=O)[O-])c3)n2)c1C 768849383 OEBDTHHHIPATME-UHFFFAOYSA-N 426.545 4.409 10 10 IICE CCN(C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@H](C)Cc1ccsc1 779654422 BQGSFIFJPNHKIC-HXUWFJFHSA-N 440.657 4.443 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccc(F)cc2)c1 792238328 PPVZQBKJBUYSGF-IFXJQAMLSA-N 432.492 4.026 10 10 IICE O=C(NCc1cc(Br)ccc1O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] 804735430 YRMBKUCOTOUZDU-UHFFFAOYSA-N 428.242 4.055 10 10 IICE Cc1nccn1-c1ccc([C@@H](C)NC(=O)NCc2cc(Br)ccc2O)cc1 806938118 GXCYKYVADHFKRU-CYBMUJFWSA-N 429.318 4.209 10 10 IICE CC(C)CN1C[C@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@H](C)C3)CC1=O 1128878689 BFBFNPMEVNADKD-LSDHHAIUSA-N 434.602 4.271 10 10 IICE C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549080 CFGUDPRDYHYJGW-LBPRGKRZSA-N 445.293 4.192 10 10 IICE O=C(Nc1cccc(Cl)c1)N1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)CC1 1136481472 XPTHTWKCMDNNPV-UHFFFAOYSA-N 445.928 4.346 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)C1=Cc2ccccc2O[C@@H]1C(F)F 1137440443 VRNVOWYOKSHXKA-UWJYYQICSA-N 448.897 4.236 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2 1142418459 FCTJVIYYZKHXIU-CTIGNXTNSA-N 429.605 4.288 10 10 IICE CCc1noc(-c2ccc(CCNC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc2)n1 1143377682 AIDBICIBFWBQGM-UHFFFAOYSA-N 442.519 4.492 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]2C)c1 1152644578 SRKNPRZOKWWIDL-QZTJIDSGSA-N 439.556 4.377 10 10 IICE COC(=O)CC[C@H](Cc1ccccc1)NC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 1153375735 ZENPJZACLOZGPO-OAQYLSRUSA-N 434.536 4.397 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H]3c4ccccc4OC[C@H]3CO)cc2Cl)C1 1235833715 MESCJMAJPCOMKN-PRCFCKQXSA-N 443.975 4.118 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@H](C)c2ccc(Br)cc2F)cc1 1251605578 UNKZVVLJHPWAQG-CQSZACIVSA-N 438.341 4.436 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)C2)cc1 1252923693 NJJFDADCUOSWGX-HKUYNNGSSA-N 433.474 4.492 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N[C@H](CO)Cc3c[nH]c4ccccc34)c2C)c1 1254073506 ISEWVBPERUEVPZ-QFIPXVFZSA-N 430.552 4.287 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(C)C)n2Cc2cnnn2C)c(C)n1-c1ccccc1 1289355364 BPMCXFBUEVIRAZ-UHFFFAOYSA-N 432.576 4.012 10 10 IICE Cc1cc(-c2nnc(N3CCS(=O)CC3)n2CCCC(C)C)c(C)n1-c1ccccc1 1289360967 QEHBWFMLWXAPKH-UHFFFAOYSA-N 439.629 4.358 10 10 IICE CC(C)[C@@H]1CCCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)C1 1302729179 AWBWWCXHJGPFCS-HXUWFJFHSA-N 436.579 4.390 10 10 IICE COC(=O)c1ccc(OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1[N+](=O)[O-] 1307328173 RRDFQRVEDOMRET-UHFFFAOYSA-N 426.400 4.190 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](c3ccncc3)C3CCCCC3)cc2F)CC1 1360093367 CSSZUCRKWAOGPC-RUZDIDTESA-N 438.591 4.343 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCC2)[C@@H](C(=O)NCCCSc2nccs2)C1 1443486178 BJUBBEIMEORKLR-OAHLLOKOSA-N 425.620 4.169 10 10 IICE Cc1ccc(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)c(O)c1O 1444952717 DSRRTAVZFCYLCZ-FQEVSTJZSA-N 425.868 4.350 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccc(N3N=C(Cc4ccccc4)CC3=O)cc2)c1 1457617179 RCGXAJWWNNIZRG-KRWDZBQOSA-N 443.503 4.227 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2Cc3c(F)cc(C)cc3N2C(=O)OC(C)(C)C)c1 1465991299 AGMJUJUUCKIPPG-VLIAUNLRSA-N 444.503 4.392 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1nccs1 1519065195 BMGWYFAPOWEUAS-UHFFFAOYSA-N 436.585 4.482 10 10 IICE COc1cccc(CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1C 1529591457 DBOPVZNZQXWDPJ-UNOMPAQXSA-N 444.553 4.050 10 10 IICE COc1cc(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1OCCC(C)C 1535345986 SHWPOXJDGDPUIJ-UHFFFAOYSA-N 448.510 4.165 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)Cc3ccn(CC(F)(F)F)n3)cc2Cl)C1 1538422761 YBZMRQVUSQVWRM-AWEZNQCLSA-N 428.886 4.194 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCN3C(=O)COc4ccccc43)cc2Cl)C1 1539911657 ACLVXZDOULCHIE-QGZVFWFLSA-N 441.959 4.008 10 10 IICE COc1ccc(N2C[C@H](C(=O)NCc3cc(C)n(-c4cccc(C)c4)c3C)CC2=O)cc1 1544079357 FWOXKCUHGMUAGA-OAQYLSRUSA-N 431.536 4.080 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(Br)=NN1c1ccc(C)cc1 1544093285 BOLBPGZCVWQCDF-HXUWFJFHSA-N 443.389 4.397 10 10 IICE Cc1c(Br)cncc1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1544529768 LVCRMUYUWKSTMY-GOSISDBHSA-N 432.362 4.040 10 10 IICE CC/C=C/Cn1c(-c2ccc(C)o2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1546784135 ZNLWEDBRJPOVEQ-AATRIKPKSA-N 425.508 4.287 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2C[C@H](C)OC(C)(C)C2)cc1 1547447473 BVKPDOPBRQIYLO-FQEVSTJZSA-N 448.615 4.162 10 10 IICE CC(C)c1ccc([C@@H](NCC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C(C)C)cc1 1559708542 VTOKLXSQWDHCPJ-SANMLTNESA-N 441.591 4.389 10 10 IICE CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)N1Cc2cccc(O)c2C1 1564598604 IIOQVLDRIYZMDB-GOSISDBHSA-N 433.346 4.218 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CCC(=O)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1565882004 NCMDIJJMORKHIX-OAQYLSRUSA-N 439.556 4.098 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3csc([C@H]4CC[C@H](C)CC4)n3)CC2)cc1F 1566347807 VYDMYPIWTPIGFH-QAQDUYKDSA-N 431.577 4.476 10 10 IICE C[C@H](NC(=O)c1cc2c(Br)c(F)ccc2[nH]1)c1ccc(N2CCOCC2)cc1 1583676474 NIBVIXWNUOSEDT-ZDUSSCGKSA-N 446.320 4.397 10 10 IICE O=C(C[C@H]1CSc2ccccc2O1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1595584383 MZUKCNWAGUBPOG-MSOLQXFVSA-N 432.973 4.070 10 10 IICE CCOC(=O)CC1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)CC1 1623856020 PBOJSURMSQFLHQ-UHFFFAOYSA-N 448.361 4.057 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H](c3ccc(N(C)C)cc3)N(C)C)ccc21 1627465158 XGSJGIYQFNFLHN-VWLOTQADSA-N 436.600 4.003 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1cccc(CS(=O)(=O)C(C)C)c1 1629000383 BTWPPDDHTDFKAV-UHFFFAOYSA-N 438.549 4.482 10 10 IICE Cc1ccc(O)c(CNC(=O)c2ccc(OCc3cc(C)on3)c(Br)c2)c1 1629736504 IJNFMXOEAQUOPZ-UHFFFAOYSA-N 431.286 4.269 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2(c3ccc(F)cc3)CCOCC2)cc1 1635674163 QEWYHQVUVRJETR-UHFFFAOYSA-N 434.511 4.410 10 10 IICE Cc1cc(C(=O)Nc2cn(C)nc2C(F)(F)F)c(C)n1-c1ccc(Br)cn1 1638129000 QWNZKIUARPUNJA-UHFFFAOYSA-N 442.239 4.256 10 10 IICE COc1ccc(N(C)CCN(C)[C@@H](C)C(=O)N(c2nccs2)C2CCCCC2)cc1 1646718894 JTNOMLAVZHDDKJ-SFHVURJKSA-N 430.618 4.274 10 10 IICE C[C@H](NC(=O)N1CCC[C@H]2CC[C@]21CNC(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 1680281233 WMWABZQEHVDKGU-KDLAUNOPSA-N 430.593 4.293 10 10 IICE COc1ccc(OC)c([C@@H](O)[C@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1683307483 HTZLFUSUGUBTFT-XDHUDOTRSA-N 437.540 4.033 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1 1683421119 GESRUBLPGOJDQV-LJQANCHMSA-N 448.611 4.258 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@]2(C)Cc2cccc(F)c2)N(C)C)cc1 1684606242 CURAMECFNLIAJR-UKILVPOCSA-N 426.580 4.301 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@H](CC(C)(C)C(N)=O)C3)cc2Cl)C1 1686268769 HEGFXPNSQULYAT-PKOBYXMFSA-N 449.039 4.400 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCCCC[C@H]3c3c(C)n[nH]c3C)C2)cc1 1686854946 KXLRBGSKTPPEPL-UGKGYDQZSA-N 425.577 4.188 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCO[C@@H](COc4ccccc4)C3)c2C)c1 1687284684 HUPLUVJTYIXEJE-RUZDIDTESA-N 433.552 4.392 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC[C@@H](c3nc(C)no3)C2)cc1 1695622663 XECHYEOYIJWPSM-HXUWFJFHSA-N 437.592 4.371 10 10 IICE CC(C)c1nnc(N(C)Cc2ncc(Cl)n2C)n1CCCSc1nccs1 1760897407 BFDGTPMHXOBDGY-UHFFFAOYSA-N 426.015 4.064 10 10 IICE COc1ccc(OCc2nnc(N3CC[C@H](C)C3)n2CCCSc2nccs2)cc1 1770281566 VPMHNIYMOUGNNQ-INIZCTEOSA-N 445.614 4.351 10 10 IICE CSCC[C@H](C)N(C)c1nnc(Cc2cccnc2)n1Cc1ccc(N(C)C)cc1C 1770547014 WCIQUEYJGIXUBN-IBGZPJMESA-N 438.645 4.264 10 10 IICE Cc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccccc3[N+](=O)[O-])C2=O)cc1 2296755606 QOBDHUQYWFUUMA-UHFFFAOYSA-N 427.507 4.133 10 10 IICE CCOc1cc(C=C2SC(=S)N(C)C2=O)ccc1OCc1ccccc1[N+](=O)[O-] 2297499346 UMCSOOFIDSKMPK-UHFFFAOYSA-N 430.507 4.404 10 10 IICE O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)C1=Cc1ccc(N2CCCCC2)o1 2313560158 LJJCEMXCUAZFBU-UHFFFAOYSA-N 434.279 4.243 10 10 IICE CCOc1ccc(C=C2SC(=S)N(CC(=O)OC3CCCCC3)C2=O)cc1OC 2314740482 JLSJKVOCQWECCL-UHFFFAOYSA-N 435.567 4.171 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1OCC 2314764461 CUCMUGPAXRCPQP-UHFFFAOYSA-N 442.562 4.420 10 10 IICE COC(=O)c1c(NC(=O)C=Cc2cnc(N(C)C)nc2)sc(C)c1-c1ccc(C)cc1 2330058025 USXUKGFTMZZBSM-UHFFFAOYSA-N 436.537 4.326 10 10 IICE CC[C@H]1C[C@@H](C(=O)NCc2ccc(C)c(Br)c2O)N(C(=O)OC(C)(C)C)C1 2380719414 CYGMNTQHDGKONJ-ZFWWWQNUSA-N 441.366 4.115 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1c[nH]c3ccccc13)N2)N1CCOCC1 14544778 LIVRQJJFONDDEK-RGZWJVDOSA-N 435.549 4.015 10 10 IICE CCCCCCN1C(=O)/C(=C2\SC(=S)N(CCC(=O)OCC)C2=O)c2ccccc21 40938021 IBFRIHCKLPBEIT-HNENSFHCSA-N 446.594 4.138 10 10 IICE COc1ccc(C(=O)Nc2cc(F)ccc2C(=O)Nc2cccc(N3CCOCC3)c2)cc1 726527765 UHIPDIBQNQHCBI-UHFFFAOYSA-N 449.482 4.176 10 10 IICE Cc1ccc(CC[C@@H](C)NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)o1 743554349 BPPKENUSUYBJFU-OAHLLOKOSA-N 439.478 4.264 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@H]2NC(=O)N[C@@H](C)Cn1cncn1 749212994 NUBLOYJLQCPERL-IFXJQAMLSA-N 446.477 4.161 10 10 IICE Cc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1[C@H](C)C1CC1 752842620 WKXDNHKAMRAJFY-IXDOHACOSA-N 429.540 4.237 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@H](C)c2nc3ccccc3o2)C1 766764946 MLAJJWKMCJPCPQ-SFHVURJKSA-N 430.552 4.469 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)C[C@H](O)c2cccs2)C1 768099775 YYAVHPADFOFMMN-JTSKRJEESA-N 425.598 4.098 10 10 IICE Cc1cc(NC(=O)C(=O)N(CC2CCCC2)c2ccc(N)cc2)n(-c2ccccc2C)n1 784114073 WGDSESVRBWWVLL-UHFFFAOYSA-N 431.540 4.233 10 10 IICE Cc1cc(Br)c(O)c(CNc2ccc(C(=O)N3CCOCC3)c(Cl)c2)c1 787788956 XRJXMVYRCCYFCU-UHFFFAOYSA-N 439.737 4.201 10 10 IICE COc1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)OCC(=O)C(C)=O)cc1OC 808498625 XBJBFNXIXNPZHB-ATVHPVEESA-N 445.471 4.054 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2[C@H]3CC[C@H]2[C@H](CO)C3)sc(C)c1-c1ccccc1 810102226 GWAREJPWYUAFNC-FHWLQOOXSA-N 442.581 4.074 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3ccc(C)cc3Cl)n2)cc1 824981139 OTKYQHSLDWONAM-UHFFFAOYSA-N 449.985 4.251 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(F)cc(Br)cc4[nH]3)CC2)cc1 914748114 HIFXFHAADNWEIC-UHFFFAOYSA-N 432.293 4.041 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)cc1 915680251 CRDQFRTZSYFUCH-LEOXJPRUSA-N 439.987 4.496 10 10 IICE CCN(Cc1ccccc1)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1124445283 UUKCTCNHHXIWQB-RGEXLXHISA-N 428.554 4.466 10 10 IICE Cc1cc(Cl)c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)cc1[N+](=O)[O-] 1127182187 SQVAWWHFVNQCJS-UHFFFAOYSA-N 442.947 4.019 10 10 IICE COc1cc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)cc(Cl)c1OCC(C)C 1134681928 NEWIFNUHAFTUNJ-NRFANRHFSA-N 448.007 4.482 10 10 IICE COc1cccc(CCC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1 1136904552 WEDXWTCSXBHALI-JOCHJYFZSA-N 441.572 4.076 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3[C@H](CCCN3C)C2)c(C)n1-c1ccc(Br)cc1 1137305145 AVYBZTXJGHROCG-UTKZUKDTSA-N 430.390 4.413 10 10 IICE Cc1cc(C(=O)NCCC(=O)N2CCCCCC2)c(C)n1-c1cccc(Br)c1 1142582273 FPPHZNCZLMYSBR-UHFFFAOYSA-N 446.389 4.379 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)C[C@@H](C)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)cc1 1146950106 JEBFHZMODZDMCQ-AQNXPRMDSA-N 445.604 4.063 10 10 IICE Cc1cc(CC(=O)N[C@H](CCNC(=O)OC(C)(C)C)C(F)F)c(C)n1-c1ccccc1 1159013117 RISXKIBUKYRTSA-LJQANCHMSA-N 435.515 4.301 10 10 IICE C[C@H](NC(=O)NCc1cc(Cl)ccc1I)c1ccccc1O 1230842917 VBCKESWFUJUXFD-JTQLQIEISA-N 430.673 4.211 10 10 IICE Cc1cc(CC(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)c(C)n1-c1ccccc1 1264289026 FGQKFHVTXAUZJJ-JOCHJYFZSA-N 431.536 4.184 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N(CC1CCC1)CC1CC1 1270363153 WWUYJAHGSPSLLQ-XDHOZWIPSA-N 432.586 4.456 10 10 IICE CC(C)SCCn1c(-c2cnn(C)c2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1288423839 VMXKYDXSVQNLEE-UHFFFAOYSA-N 439.633 4.057 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCSCC3)cc2)c(C)n1C[C@H]1CCCOC1 1291627620 NCIHBSLYKZHISG-OAQYLSRUSA-N 427.614 4.015 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1291736394 HJHZEHZELHLQSK-HXUWFJFHSA-N 434.588 4.097 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1F 1293225332 QQTRDHRGHPYYJA-KXBFYZLASA-N 437.556 4.049 10 10 IICE Cc1cc(-c2nnc(Nc3cnn(C)c3)n2CCCOC(F)F)c(C)n1-c1ccccc1 1304197540 VCCOJWYRHPVGOH-UHFFFAOYSA-N 441.486 4.459 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H]3CCC[C@H](C2)C3O)n1Cc1ccc(N(CC)CC)cc1 1305419145 TVBUXXPEECQMNX-JEXLMAPJSA-N 425.621 4.283 10 10 IICE CCc1nnc(N2C[C@H](C)O[C@@H](c3ccccc3)C2)n1CCCSc1nccs1 1306112506 KYZGQSQHYTWILK-FUHWJXTLSA-N 429.615 4.446 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@@H]3c3ccc(OC)c(F)c3)C2)cc1 1312903362 XYWCGPCIZCTQDE-HTAPYJJXSA-N 427.520 4.216 10 10 IICE COc1ccc(N2CCCN(C(=O)C(C)(C)Oc3ccc(Br)cc3)CC2)cc1 1356396894 JBZAFFVMTAICGU-UHFFFAOYSA-N 447.373 4.354 10 10 IICE NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)c3cc4cccc(Cl)c4s3)cc2)C1 1356433398 MFGHXYFLLHVUNP-INIZCTEOSA-N 427.957 4.186 10 10 IICE Cc1ccc(C(=O)NCCNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)cc1F 1357816657 IJCDCBRKISCXDY-UHFFFAOYSA-N 441.934 4.284 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCSc3ccccc3Br)C2)cc1 1437575320 GTRKDPPZTSZUKP-HNNXBMFYSA-N 435.387 4.335 10 10 IICE CC[C@@](C)(CCCNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C1OCCO1 1444854926 UAKJYNWMIRWRJM-VWLOTQADSA-N 426.557 4.135 10 10 IICE Cc1cc(CNC(=O)[C@H](C(C)C)N2C(=O)c3ccccc3C2=O)c(C)n1-c1ccccc1 1462084828 LNPGBFFSMNHDBA-QHCPKHFHSA-N 429.520 4.031 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)c4ccc(Cl)cc4S3(=O)=O)c2C)cc1 1473030530 LOLBRUBJBGMNTF-UHFFFAOYSA-N 442.924 4.083 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CC)C[C@@H]2CCCO2)sc(C)c1-c1ccccc1 1473140352 QOBCJEPTZYURDX-SFHVURJKSA-N 430.570 4.340 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)c2C)c1 1479099771 ORHZFVUAGJVQQL-UHFFFAOYSA-N 447.539 4.343 10 10 IICE COc1cc(Br)cc(CNC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)c1 1479269330 VOQBNWFXESGWSS-UHFFFAOYSA-N 432.362 4.398 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCC[C@H]3CCCCO3)CC2)cc1F 1504292805 SRZNAKQUIOMZSW-HXUWFJFHSA-N 445.583 4.225 10 10 IICE Cc1cc(CCNC(=O)c2ccc(S(=O)(=O)CC3CC3)cc2)c(C)n1-c1ccccc1 1534542598 IVOZEIXWSBHOJP-UHFFFAOYSA-N 436.577 4.250 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CC[C@H](c2ccccc2)C1 1535474861 POMQOCKBRDSHJS-OFBHVFLISA-N 440.565 4.433 10 10 IICE CC(C)c1nsc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1537168272 CCARRJCNBVWJNI-LCYFTJDESA-N 436.559 4.031 10 10 IICE Cc1cc(C(=O)NC[C@H]2COc3ccccc3O2)c(C)n1-c1ccccc1Br 1540603444 IGHMNNGRXGTXHB-INIZCTEOSA-N 441.325 4.426 10 10 IICE NC(=O)N=Nc1ccc(C(=O)NCc2ccc(Cl)cc2I)cc1 1556401424 JEASGUAVUWAKCI-UHFFFAOYSA-N 442.644 4.037 10 10 IICE O=C(NCc1cccc(Cl)c1O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 1558757171 SBIOXPZCQINVIW-INIZCTEOSA-N 427.715 4.273 10 10 IICE Cc1ccccc1CCN(C)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559863234 SEAOYCNRKXUZEH-SFHVURJKSA-N 426.516 4.272 10 10 IICE Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1-n1c(C)cc(C=O)c1C 1567294474 BSIVKMOOUZFJCP-UQBPGWFLSA-N 429.564 4.465 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCCCC[C@H]1C(=O)NCc1ccc2cccnc2c1O 1570533778 QAIBEOYDPTYRLG-RTBURBONSA-N 427.545 4.420 10 10 IICE CC/C=C\Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@H](CC(N)=O)C1 1614272847 QWNNBSMWRFDDII-BHQIVLKMSA-N 446.599 4.411 10 10 IICE COc1cc(F)cc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c1 1623217405 YXKOURHSMHXEOK-UHFFFAOYSA-N 432.293 4.329 10 10 IICE CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1624069958 MMSFJCHGLKZWEK-SANMLTNESA-N 442.563 4.247 10 10 IICE CCCc1nc(C(=O)NCc2ccc(N(CC)CC)c(F)c2)nn1-c1ccccc1F 1628770007 RXWGTJAKSSSFPZ-UHFFFAOYSA-N 427.499 4.274 10 10 IICE CC[C@H](NCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(Cl)cc1 1658008038 AYNDMPZLLVESNX-YVHKJVDXSA-N 447.982 4.450 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N3CCCSC[C@H]3c3ccccc3OC)C2)cc1 1683945381 RUNLQQATAPNKJY-AVRDEDQJSA-N 441.597 4.172 10 10 IICE CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1684606635 HWYLBNDOEORHGW-VWLOTQADSA-N 448.615 4.020 10 10 IICE CC(C)Cc1nnc(N(C)Cc2cnc(C(C)C)nc2)n1Cc1ccc2c(c1)CCCN2C 1692082141 DKMARRICVIZSST-UHFFFAOYSA-N 447.631 4.457 10 10 IICE CCO[C@H]1C[C@@H](N(C)c2nnc(C(C)C)n2Cc2ccc3c(c2)CCCN3C)C1(C)C 1696191336 PSPPSCRHKJPAOF-YADHBBJMSA-N 425.621 4.472 10 10 IICE CCSCCCn1c(CC(C)(C)C)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1 1710962958 MLEDPIFJOZHZND-UHFFFAOYSA-N 449.640 4.484 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCC(F)(F)C2)cs1 1725250718 GPDVITJVUGXVIP-OAHLLOKOSA-N 433.528 4.411 10 10 IICE CN(CC1CC(F)C1)c1nnc(Cc2ccccn2)n1CCCSc1nccs1 1729457458 YLDXYYNWYRQFAG-UHFFFAOYSA-N 432.594 4.087 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@@H]1CCSC1 1747355165 ZIKYJKBIPHIDIL-HXUWFJFHSA-N 425.602 4.331 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C(F)(F)F)O[C@H](C)C2)n1Cc1ccc(N(C)C)c(F)c1 1763557148 DPCSDQODZOLHJO-IYOUNJFTSA-N 443.489 4.201 10 10 IICE COc1ccccc1CN1C(=O)/C(=C\c2cc(OC)c(OC)c(OC)c2)SC1=S 1858588781 ATQQXLHHOXOTHB-WOJGMQOQSA-N 431.535 4.122 10 10 IICE COc1ccc(Br)cc1CC(=O)NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 1891165616 XRAGRLFETJKBNY-JXFKEZNVSA-N 429.358 4.305 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@H](NCc2c(O)cccc2Br)C(F)(F)CC1 1966027494 IFSCGRYOQIDBOF-OAHLLOKOSA-N 435.309 4.279 10 10 IICE CC(C)(C)OC(=O)Nc1ccc(C(=O)NCCCN=[N+]=[N-])cc1I 2010390416 DBZRIWWQICKCBK-UHFFFAOYSA-N 445.261 4.068 10 10 IICE Cc1nn(Cc2c(O)cccc2Br)c(I)c1C(F)F 2079596277 YCDMNRRFKYGQTA-UHFFFAOYSA-N 443.029 4.250 10 10 IICE CCc1nn(Cc2cccc(Cl)c2O)c(I)c1C(F)(F)F 2079678520 VMZNJOABCRXLPW-UHFFFAOYSA-N 430.595 4.476 10 10 IICE COc1ccc(Br)cc1C=C1C(=N)N2N=C(c3cccs3)SC2=NC1=O 2293355691 XNVJYOUKVFSSMJ-UHFFFAOYSA-N 447.339 4.187 10 10 IICE CCN(CC)c1ccc(NC=C2C(=O)NC(=S)N(c3ccc(C(C)C)cc3)C2=O)cc1 2296132710 FYLMMATUOUZNCE-UHFFFAOYSA-N 436.581 4.400 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C(=O)NC2=S)cc1 2296943027 DQZITQQMSDWPCX-UHFFFAOYSA-N 449.507 4.073 10 10 IICE CCOc1cc(C=C2SC(=S)NC2=O)ccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 2297303208 UNBSZQSNUJHVJI-UHFFFAOYSA-N 447.450 4.183 10 10 IICE O=C(NN1C(=O)C(=Cc2ccc(Br)o2)SC1=S)c1ccc(Cl)cc1 2314717491 HRLQNJGTDIKMMH-UHFFFAOYSA-N 443.731 4.242 10 10 IICE CCN(CC)CCn1cc(C=C2SC(=S)N(CCCC(=O)O)C2=O)c2ccccc21 2326954703 BUMBPHUAPYRSPT-UHFFFAOYSA-N 445.610 4.049 10 10 IICE Cc1ccc(CN[C@]23CCC[C@]2(F)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2380791530 AFAZWLZRUBPCGW-PMACEKPBSA-N 443.357 4.434 10 10 IICE COC(=O)c1ccccc1-c1ccc(/C=C2/C(=N)N3N=C(CC(C)C)SC3=NC2=O)o1 27549486 DDHWCUMSZNCEME-GJXXPDGXSA-N 436.493 4.398 10 10 IICE CCNc1nc2ccccn2c(=O)c1/C=C1\SC(=S)N([C@H](C)c2ccccc2)C1=O 33517580 DXNKHMVJBWDKLO-CPZHOGDASA-N 436.562 4.089 10 10 IICE CN(C)c1ccc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)cc1Br 59106160 BFDQYFIFBGGNCL-ZROIWOOFSA-N 432.249 4.161 10 10 IICE CN(C)c1ccc([C@H]2CC(c3ccccc3)=NN2C(=O)COc2ccc(C=O)cc2)cc1 72413062 ORJLSNWEAVYKMY-RUZDIDTESA-N 427.504 4.322 10 10 IICE COCCN1C(=O)/C(=C\c2cc(C(C)C)c(OC)cc2C)C(=O)N(c2ccccc2)C1=O 96836811 JBDPEMPCTRPVOJ-RCCKNPSSSA-N 436.508 4.152 10 10 IICE CCC1=NN2C(=N)/C(=C\c3cccn3-c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)N=C2S1 102446592 VQNQQJJJGYENLI-CJHGCLHJSA-N 428.861 4.068 10 10 IICE CCCCCOc1ccc(/C=C2/SC(=S)N(CCCC(=O)OC)C2=O)cc1OC 206456502 JUIIRYHLZUIIBA-NBVRZTHBSA-N 437.583 4.419 10 10 IICE Cc1noc(C(F)F)c1C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 746079815 JSGQTECEJYAYPU-UHFFFAOYSA-N 432.379 4.097 10 10 IICE C[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1CCSc2ccccc21 751936129 HQMFWEYNUUIULX-CQSZACIVSA-N 439.562 4.000 10 10 IICE CO[C@@H]1CC[C@@H]2OCCN(CC(=O)c3cc(C)n(-c4ccc(OC(F)F)cc4)c3C)[C@@H]2C1 755052246 FABOHIBDEQIPOY-LSWJPFSZSA-N 448.510 4.147 10 10 IICE Cc1ccc(N2C[C@H](C(=O)Nc3c(-c4ccccn4)nc4ccccn34)CCC2=O)cc1C 760533373 XMVMLBONVBKJMW-LJQANCHMSA-N 439.519 4.395 10 10 IICE Cc1onc(-c2ccc(F)cc2)c1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768914281 VDWZEBUDAWPKQW-UHFFFAOYSA-N 448.542 4.251 10 10 IICE O=S(=O)(/C=C/c1cccc(Br)c1)NCc1cc(Br)ccc1O 796191476 VFSOZFRFJUNNQA-VOTSOKGWSA-N 447.148 4.008 10 10 IICE Cc1sc(NS(=O)(=O)c2cccc3c2OCO3)nc1-c1c(F)cc(F)cc1F 800927196 SNQLHOLRPOTNSZ-UHFFFAOYSA-N 428.413 4.065 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCOCC1 857547522 IGMBQUBXGZWCIP-SFHVURJKSA-N 429.731 4.042 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)cc1 915680254 CRDQFRTZSYFUCH-YSZBQJHXSA-N 439.987 4.496 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)Nc1nc2c(s1)CCC2 917191871 QNSPDNXHBHAISS-UHFFFAOYSA-N 442.566 4.017 10 10 IICE CC(C)(C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cc1F 1127181926 PYQJLBLAQKBIOP-UHFFFAOYSA-N 427.539 4.091 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCc3ncc(-c4ccc(Cl)cc4)o3)C2)cc1 1130826927 NLNKLFXHHRFRQW-SFHVURJKSA-N 425.916 4.331 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])N(C)C)cc1 1134882807 VAOSKRFTCUDWKV-QGZVFWFLSA-N 425.316 4.000 10 10 IICE CC(C)(C)OC(=O)N1CCC(OC(=O)c2ccc(NC(=O)c3cc(O)cs3)cc2)CC1 1136561766 WUCZRYRMZCQBFW-UHFFFAOYSA-N 446.525 4.262 10 10 IICE CCN(C(=O)c1cccc(-n2c(C)cc(C=O)c2C)c1)c1ccc(N2CCOCC2)cc1 1149445873 SOQKPWBRMDTGOJ-UHFFFAOYSA-N 431.536 4.410 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)C2)cc1 1162718704 OSZRWHLVGKGZDV-HXUWFJFHSA-N 433.552 4.368 10 10 IICE CN(CC(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(OCc2ccccc2)cc1 1169342305 KGQXMJYATMOTNZ-UHFFFAOYSA-N 435.593 4.108 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)NCc1ccc(CN2CCCC2)cc1 1191711408 JZODAPIMUSLTFW-UHFFFAOYSA-N 447.501 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CCC[C@](C)(OC)C2)cc1 1295414827 LNDRVGLNQYJSCN-OFVILXPXSA-N 441.620 4.072 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(O)ncc3Br)cc2Cl)C1 1297009295 FWRNQTGRTGVGEO-LBPRGKRZSA-N 438.753 4.369 10 10 IICE FC(F)[C@H]1CCCN(c2nnc([C@@H]3CCCOC3)n2CCCSc2nccs2)C1 1302950402 SVUXPFHVKPLMQN-LSDHHAIUSA-N 443.589 4.293 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H]2CCCO2)c(C)n1-c1ccccc1Br 1304200017 FQCNEQNNFNPLBU-MSOLQXFVSA-N 447.373 4.267 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1CC(F)(F)C1 1305527371 OOILMNBXUHZJQE-HNNXBMFYSA-N 437.510 4.311 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)sc2c1CC[C@H](CC)C2 1348205044 JKYXPEYYWUMFHI-LSDHHAIUSA-N 444.553 4.020 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(Br)cc4)CCC3)CC2)cc1 1356444803 CXEQDVCGRCSNMJ-UHFFFAOYSA-N 429.358 4.228 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccn2C)nnc1N1CCC[C@@H](C(F)(F)F)C1 1361095484 JYWJJBDJHAOJJV-GOSISDBHSA-N 446.521 4.485 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)c(C)n1-c1ccccc1 1438179632 PKNLJOQTBRDPCC-NRFANRHFSA-N 427.614 4.091 10 10 IICE O=C(C[C@@H]1C(=O)Nc2c(Br)cccc21)NCc1ccc(N2CCCCC2)cc1 1469302690 MAAWQNNXHQYYKJ-SFHVURJKSA-N 442.357 4.182 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2ccccc2NC(=O)c2ccccc2)N(C)C)cc1 1472281250 SUAPFHXAHHHAIY-DEOSSOPVSA-N 430.552 4.038 10 10 IICE CC[C@H](CC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1)c1ccc(OC)cc1 1521010210 PFYHJXOSHXDHPG-HXUWFJFHSA-N 427.564 4.176 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(Cl)c(F)cc2Br)cc1 1530908020 WEUQICYJPLBKID-UHFFFAOYSA-N 429.717 4.459 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(-c3cccc(Cl)c3F)no2)N(C)C)cc1 1539236319 RRMDTTVGVXDWBF-LJQANCHMSA-N 430.911 4.233 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2ccc(OCCN3CCN(C)CC3)cc2)c1 1544826456 PGFGFKORFQQKTQ-UHFFFAOYSA-N 446.595 4.281 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CC(=O)c2ccccc21 1546230042 HPHJIXDGXLMJQR-CJMVGXJBSA-N 442.587 4.173 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3C[C@@H]3CCCSC3)CC2)cc1 1554960003 WAJYZMWPZISVCA-FQEVSTJZSA-N 443.661 4.345 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](CO)Cc2ccc(Br)cc2)cc1 1556181909 HNLKECJKCQVWBF-IBGZPJMESA-N 441.369 4.438 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(Cc2ccccc2)[C@@H]2COC(C)(C)C2)N(C)C)cc1 1565452734 JVZQXAJCZRCUKB-ZEQRLZLVSA-N 438.616 4.135 10 10 IICE Cc1cc(C(=O)N[C@H]2c3ccccc3C[C@H]2O)c(C)n1-c1ccc(Br)cc1 1566325073 ZLEWAQCPPYKLCF-RTWAWAEBSA-N 425.326 4.245 10 10 IICE Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1616858581 OKBDUUGQFQNXDY-OAQYLSRUSA-N 440.588 4.280 10 10 IICE Cc1cc(CCC(=O)NCc2cccc(Br)c2O)ccc1Br 1623365208 ZLPHUKRSKSIGCK-UHFFFAOYSA-N 427.136 4.475 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccccn1 1625822658 DXMGPCOIHGQSQT-HSZRJFAPSA-N 425.916 4.351 10 10 IICE O=C(NCc1ccc(O)cc1O)[C@@H](Oc1ccc(Br)cc1F)c1ccccc1 1626838160 OSVURLKBQDHDAH-FQEVSTJZSA-N 446.272 4.436 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CC[C@@H](N(C)CCc4ccccc4)C3)c2C)cc1 1628730716 URMYCZQKBYUMPN-XMMPIXPASA-N 431.580 4.492 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@@H](c1ccncc1)C1CCCC1 1631425346 CMFDMABYBOSMJU-FYYLOGMGSA-N 427.976 4.495 10 10 IICE Cc1ccccc1[C@H](O)CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1635692517 XQFHIYQQENLXJA-LJQANCHMSA-N 428.330 4.023 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ccc2cccnc2c1O)Cc1ccccc1 1638573275 PTIDREOFDVCROT-HXUWFJFHSA-N 435.524 4.083 10 10 IICE COC(=O)/C=C\c1ccc(N2CC(Cc3ccc(Br)cc3)C2)c([N+](=O)[O-])c1 1640490266 XLWWVLHZJSNTDD-UITAMQMPSA-N 431.286 4.222 10 10 IICE Cc1cc(CNC(=O)CO[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1643366673 REGSGZVGJLNNKS-QFIPXVFZSA-N 441.572 4.126 10 10 IICE COc1ccc(Cl)cc1N1C[C@@H](C(=O)NCc2ccc(N3CCCCC3)cc2)CC1=O 1643394177 BFWBHVMFDJFRMF-SFHVURJKSA-N 441.959 4.008 10 10 IICE CC(=O)c1cc(F)cc(CN2C[C@@H](NC(=O)OC(C)(C)C)[C@H](c3cccc(F)c3)C2)c1O 1643406549 AYLOBOYQZTXACH-LEWJYISDSA-N 446.494 4.366 10 10 IICE C[C@H](NC(=O)c1c[nH]cc1-c1cc(Br)c2c(c1)OCCO2)c1ccccc1O 1643744781 CEGHMNLFZYJIFZ-LBPRGKRZSA-N 443.297 4.412 10 10 IICE COc1ccccc1[C@@](N)(C(=O)NCCc1cc(C)n(-c2ccccc2)c1C)C(F)(F)F 1648952762 OCOMCWCWZHHPGA-HSZRJFAPSA-N 445.485 4.178 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4F)C3=O)c2C)c1 1651792131 UNZRIHKEOPSPGL-AREMUKBSSA-N 447.510 4.500 10 10 IICE CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 1657724963 FENLTHZEUBICGH-FQEVSTJZSA-N 437.367 4.339 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCC[C@@H](c4ccn(C)n4)C3)cc2Cl)C1 1680561978 GVWFWBWLMMIVJW-PKOBYXMFSA-N 429.996 4.399 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NC[C@H](OCC3CC3)c3ccc(Cl)cc3)C2)cc1 1686425918 LZICIAZMSPFSMV-REWPJTCUSA-N 443.975 4.394 10 10 IICE C#CCN(CC#CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cc(C)no1 1705590313 HPFPEWDQOHVFRB-UHFFFAOYSA-N 438.535 4.160 10 10 IICE CC(C)c1csc(Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)n1 1741324725 VYIOGCGWFXWJOS-UHFFFAOYSA-N 434.569 4.234 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccccn2)nnc1N1CCC[C@@H](C(F)F)C1 1742139178 KXSRJWBWIJIXQZ-GOSISDBHSA-N 426.515 4.244 10 10 IICE CCC(CC)(Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C)OC 1762146656 IPRGRWOPSVJEKT-UHFFFAOYSA-N 443.636 4.254 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1765070600 BHSOZZHYRMXAMS-VGOFRKELSA-N 435.620 4.187 10 10 IICE CN(C[C@@H]1CCCCO1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1767218300 VNEBZGKVSYVUOJ-NRFANRHFSA-N 443.661 4.182 10 10 IICE CC(=O)c1ccc(S(=O)(=O)N(CCc2c[nH]c3ccccc23)c2ccc(N)cc2)cc1 1857992448 SKNGTVWBYBIUTR-UHFFFAOYSA-N 433.533 4.391 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@@H](c2cccc(Br)c2O)C1 1952539165 UBSUCJILWRODLQ-RHSMWYFYSA-N 434.286 4.329 10 10 IICE Cc1ccc(N2C(=O)C[C@H](N3C(=O)C(=CC=Cc4ccccc4)SC3=S)C2=O)cc1 2053493718 DNRROVRYDPUHRR-SFHVURJKSA-N 434.542 4.085 10 10 IICE CCc1nn(Cc2c(O)cccc2Br)c(I)c1C1CC1 2079636328 XOBRKHKNYPSNTN-UHFFFAOYSA-N 447.114 4.444 10 10 IICE CC[C@@H](c1ccc(OC)cc1O)n1nc(C2CCC2)c(C=O)c1I 2080022945 RAZIDVGJAABHEP-HNNXBMFYSA-N 440.281 4.281 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@@H](NCc1cccc(Cl)c1O)CO2 2160178404 AQZNRAATUXEHQT-LJQANCHMSA-N 430.932 4.096 10 10 IICE COc1ccc([N+](=O)[O-])cc1N1C(=O)C(=Cc2c(C)nc3scc(C)n23)SC1=S 2321635473 RPTKUAHNWLZBBX-UHFFFAOYSA-N 446.535 4.335 10 10 IICE Cc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)C3(CC3)C2)c(O)c1Br 2352688304 UDDRUKADATVWED-OAHLLOKOSA-N 425.367 4.485 10 10 IICE O=C(CN1C(=O)/C(=C/c2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccc(Cl)cc1 15035498 QLCZOCVSDHNPIC-DHDCSXOGSA-N 433.898 4.088 10 10 IICE CC(C)CCNC(=O)[C@@]1(C)Cn2c(cc3ccccc32)C(=O)N1Cc1ccc(N(C)C)cc1 21858822 IZVHZMVSJSKRFK-HHHXNRCGSA-N 446.595 4.284 10 10 IICE O=C1N=C(O)/C(=C/c2ccc(Oc3ccc([N+](=O)[O-])cn3)cc2)C(=O)N1c1cccc(F)c1 33316851 DWOZRMBMNDHQPO-ZDLGFXPLSA-N 448.366 4.428 10 10 IICE Cc1cc(C(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c(C)n1-c1cccc(C(F)(F)F)c1 97605401 RNIDBMAMSWEKIV-NRFANRHFSA-N 433.430 4.016 10 10 IICE CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1 101350518 CKSZNJUSAOXIBT-CPNJWEJPSA-N 446.960 4.135 10 10 IICE COc1ccc(CN2CCCN(C(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)CC2)cc1 247828100 KGTSABIKCPBOOM-UHFFFAOYSA-N 447.579 4.459 10 10 IICE CCOc1cccc(C2=C(O)C(=O)N(c3ccc4c[nH]nc4c3)[C@@H]2c2ccc(O)c(O)c2)c1 526281981 IZHDPOBYVSUYEI-HSZRJFAPSA-N 443.459 4.430 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NC1CCN(C(=O)c2ccc(OCC)cc2)CC1 731278636 HUMAMEPSNPMLCN-UHFFFAOYSA-N 439.556 4.017 10 10 IICE C[C@@H](NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1)c1ccc(-c2cccnc2)cc1 747591189 DMYNLHWIEFMVQJ-HXUWFJFHSA-N 430.552 4.488 10 10 IICE C[C@@H](OC(=O)c1csc(Cc2ccc(N)cc2)n1)C(=O)N1c2ccccc2CC[C@H]1C 751930647 GXERSDGMUJSIAR-HZPDHXFCSA-N 435.549 4.229 10 10 IICE C[C@@H](NCC1(O)Cc2ccccc2C1)c1cc(Br)cc(Br)c1O 756594329 MPEYVUZTSVDXDE-LLVKDONJSA-N 441.163 4.098 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1csc(-c2ccccn2)n1 757955026 BDJAELOPPZRFFX-UHFFFAOYSA-N 448.596 4.059 10 10 IICE Cc1cc([C@@H](CC(=O)N(C)Cc2ccccc2O)NC(=O)OC(C)(C)C)cc(Cl)n1 788519067 YXKGNSFNXGDLHQ-QGZVFWFLSA-N 433.936 4.364 10 10 IICE C[C@H](N[C@H]1CCN([C@H](C(=O)OC(C)(C)C)c2ccccc2)C1=O)c1cc(F)cc(F)c1O 788982827 INQSBZZAEJLWIN-GKCIPKSASA-N 446.494 4.005 10 10 IICE COc1c([N+](=O)[O-])cc(N2CC[C@H](C(F)(F)F)[C@@H]2C)c([N+](=O)[O-])c1Br 795191562 GVKZBJHJRYADCS-BQBZGAKWSA-N 428.161 4.051 10 10 IICE CCN(C)Cc1cc(O[C@H]2CCN(Cc3ccc(OCc4ccccc4)cc3O)C2)ccn1 856550817 HUQCSQJTFBPFGY-SANMLTNESA-N 447.579 4.471 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C[C@H]3CCC[C@@H](C(F)(F)F)C3)CC2)cc1 1124586327 YTGSKCDTMDKMOX-RBUKOAKNSA-N 441.538 4.082 10 10 IICE Cc1ccc(Cl)cc1OCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125132072 XUFIBGQWKKZVIR-UHFFFAOYSA-N 442.865 4.199 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)[C@@H](CN1CCCC1)c1ccccc1 1136546235 ADXNRJYLXHQIGY-QHCPKHFHSA-N 443.538 4.253 10 10 IICE CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C 1136918954 OISVMJMIYDSWLP-VWLOTQADSA-N 442.563 4.279 10 10 IICE C[C@@H](Cn1ccc2ccccc21)C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1150348079 NEZWJJVWACSESU-LAUBAEHRSA-N 425.960 4.417 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCCC23OCCO3)c(C)n1-c1cccc(Br)c1 1152019965 AVUADXHYUCOBCW-IBGZPJMESA-N 433.346 4.272 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CC[C@](C(N)=O)(c3ccccc3)C2)cc1 1161868212 AHXAJSMJKYALAA-AREMUKBSSA-N 441.535 4.437 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1Cc1ccc(N2CCOCC2)cc1 1167739302 BTLRPOREBMTPEC-DHIUTWEWSA-N 429.605 4.277 10 10 IICE COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1Cc1ccc(N2CCC(OC)CC2)cc1 1167778245 DCEARTMGQRJJEG-DEOSSOPVSA-N 437.584 4.222 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C(F)(F)F)cc3N3CCCC3)C2)cc1 1278861854 PLZHKZXMDDKLGV-KRWDZBQOSA-N 433.474 4.323 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccccc3O)n2CCN(C(C)C)C(C)C)cs1 1290394374 JLZTXARZVVJBDF-UHFFFAOYSA-N 442.633 4.095 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccccn2)n1CC1CCC(F)(F)CC1 1314753417 PBLBHJGDTWMMAL-UHFFFAOYSA-N 427.499 4.431 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC4CC4)n3CCSC(C)C)CC2)cc1 1315512165 JJGCETNCILKIRH-UHFFFAOYSA-N 429.634 4.098 10 10 IICE COCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H]1C 1316261986 CSPAIJLNECSKBW-AZUAARDMSA-N 437.588 4.250 10 10 IICE Cc1nc2c(F)cccc2cc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1354326621 BUNKXRZPANGUQM-UHFFFAOYSA-N 447.432 4.468 10 10 IICE CCC[C@@H](NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)[C@H](O)c1ccccc1 1448956071 DFRGMENRVLQNQI-YIXXDRMTSA-N 433.596 4.426 10 10 IICE O=C(NCc1c(O)cccc1O)c1cccnc1SCc1ccc(Br)cc1 1456233693 FCBUOOJFXZXSNR-UHFFFAOYSA-N 445.338 4.478 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)c1cc(Cl)cc(Br)c1O 1457557530 WYYAPLQVKADFFS-UHFFFAOYSA-N 441.778 4.291 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCCOc3cccc(Br)c3)C2)cc1 1461497026 SFCIUMAIGUURCI-KRWDZBQOSA-N 433.346 4.012 10 10 IICE COCCOc1ccccc1N1CCN(C(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1 1465760958 AAODIHXTFAKQDR-UHFFFAOYSA-N 433.552 4.082 10 10 IICE CC(C)(C)OC(=O)N1CCC(C2(C(=O)NCc3c(O)ccc4c3CCCC4)CC2)CC1 1465958578 QAKJDUUBGXFSDH-UHFFFAOYSA-N 428.573 4.315 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1CC(C)(C)N1C[C@H](C)O[C@H](C)C1 1495138204 UNGLGTSYVQQTPG-GBESFXJTSA-N 429.609 4.021 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)O[C@@H]1COc2ccccc21 1520031422 NGMPMIAWTYSMOJ-AUUUKSDWSA-N 429.494 4.094 10 10 IICE CC[C@@H](CC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(C)(C)C 1527966720 JOUYJCSSIYZTOV-IBGZPJMESA-N 427.568 4.021 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)c(C)n1-c1ccccc1 1534543522 YVDAXSZNIUZERQ-HSZRJFAPSA-N 447.554 4.444 10 10 IICE CCCCSc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1536524870 ZUXJVVRMFKRRRI-UHFFFAOYSA-N 442.585 4.169 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H](C)n3nnc(-c4ccccc4)n3)cc2Cl)C1 1538422341 UKLQZDQVPZPNKS-IRXDYDNUSA-N 438.963 4.107 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3cc(C(F)(F)F)cc(Cl)n3)CC2)cc1 1565302933 YAUNDGGQEUROCV-UHFFFAOYSA-N 442.869 4.184 10 10 IICE CN(Cc1c(Cl)cccc1Cl)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1565363595 TWNXDFPAMQRPJR-UHFFFAOYSA-N 449.382 4.037 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)cc1 1586376081 TWNYNSWPQUDKBK-QHCPKHFHSA-N 439.506 4.146 10 10 IICE CCC[C@H](C)N1C[C@@H](C(=O)N(Cc2ccc(N(C)C)cc2)c2ccc(OC)cc2)CC1=O 1616620600 WUXQDJDRTISGPL-FPOVZHCZSA-N 437.584 4.332 10 10 IICE Cc1cc(C(=O)N2CC[C@@H](c3ccccn3)C2)c(C)n1-c1ccc(Br)cn1 1617846690 PPHPTHSWWZDQAP-MRXNPFEDSA-N 425.330 4.276 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C[C@H](O)c1ccc(Cl)cc1 1626510764 AFRMXPDGANQUOP-NRFANRHFSA-N 432.948 4.152 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@@H]2CCCC2=O)c(C)n1-c1ccc(Br)cn1 1633205788 JRPPFXYCSWAWCD-FUHWJXTLSA-N 430.346 4.225 10 10 IICE C/C=C/C[C@@H](NC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C)C(=O)OCC 1633749483 NZZXSLAKUVEKNK-WSSFADSRSA-N 433.346 4.484 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-c2ccc(C)nn2)cc1 1634385318 XPGCVLVAXXAYEE-UHFFFAOYSA-N 446.551 4.454 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)Nc2ccc(Cl)cc2Nc2ccccc2)c1 1635446354 JFTXGCJSXLOEJN-UHFFFAOYSA-N 431.901 4.413 10 10 IICE COC(=O)[C@@H](COC1CCC1)N(C)C(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C 1636221304 XWSQVYDMQSTJCJ-HSZRJFAPSA-N 426.557 4.400 10 10 IICE O=C(C[C@H]1C(=O)Nc2ccc(Br)cc21)NCc1ccc(N2CCCCC2)cc1 1638693594 HEVOLNXOJWMUMM-LJQANCHMSA-N 442.357 4.182 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC[C@H](c3ccc(F)c(F)c3)C2)N(C)C)cc1 1638918247 SOPXOXKOTTVHHT-WMZHIEFXSA-N 430.543 4.223 10 10 IICE CC(C)c1ccc(-n2cc(O)c(C(=O)NCc3cccc(Br)c3O)n2)cc1 1640084507 YSKVNOQNWWNZIH-UHFFFAOYSA-N 430.302 4.099 10 10 IICE CCOC(=O)c1c(C(F)(F)F)coc1CN1CCCN(c2ccc(OC)cc2)CC1 1641554441 LFCYIVKILCICLM-UHFFFAOYSA-N 426.435 4.196 10 10 IICE CCOc1ccc(N2CCN(CC3CCN(C(=O)OCc4ccccc4)CC3)CC2)cc1 1642354913 SVPRFOQLTIGYSW-UHFFFAOYSA-N 437.584 4.256 10 10 IICE Cc1ccc(SCC(=O)c2cc(C)n(-c3ccc(S(N)(=O)=O)cc3)c2C)cc1C 1643461020 MZBHMSYQXNGVEH-UHFFFAOYSA-N 428.579 4.333 10 10 IICE CCC(O)(CC)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCOC1 1649579206 JGXXOGXOIUOTQW-NRFANRHFSA-N 437.588 4.129 10 10 IICE Ic1cc2ncnc(NCc3ccc(N4CC=CC4)cc3)c2s1 1655174197 ZSEVMLWQYZZVDQ-UHFFFAOYSA-N 434.306 4.284 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3c(Cl)cccc3OC(F)F)C2)cc1 1682188570 UTZJSKZWGOHKHJ-AWEZNQCLSA-N 439.890 4.276 10 10 IICE Cc1cccnc1Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1693284506 SUTVSPQSEXEKFU-UHFFFAOYSA-N 448.615 4.091 10 10 IICE C[C@@H]1CCCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1693674136 JEMFVMUVNPTXRD-LJQANCHMSA-N 425.621 4.069 10 10 IICE CCN(CC1CCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1695710102 MDDPBHIYTUQQEV-UHFFFAOYSA-N 439.648 4.459 10 10 IICE CC(C)Cc1nnc(N(C)C[C@H]2CCCO2)n1Cc1ccc(N2CCC(C)CC2)cc1 1706383960 PARYOKYATMVKJQ-HSZRJFAPSA-N 425.621 4.376 10 10 IICE CSCC[C@@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)cc1 1712798424 VMRGLALSCIVYHA-GOSISDBHSA-N 429.634 4.008 10 10 IICE CC(C)Cc1nnc(N2CC[C@@H](CN3CCCCC3)C2)n1CCCSc1nccs1 1750730874 HKCRIADKNMZMSO-IBGZPJMESA-N 448.706 4.428 10 10 IICE CC[C@@H](C)c1nnc(N(C)[C@H]2CCCc3c2cnn3C)n1Cc1ccc(N(C)C)cc1C 1752611803 IKCXEEQTJKINCC-VGSWGCGISA-N 435.620 4.462 10 10 IICE CC[C@@H]1[C@@H](C)CCN1c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C 1763257148 UTSQVKQZOCNBPN-GAJHUEQPSA-N 435.620 4.187 10 10 IICE CCC(C)(C)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1763334771 UPLXDIJAAMUWAS-JOCHJYFZSA-N 441.620 4.429 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCOC2)n1C[C@H]1CCCO[C@H]1C(C)(C)C 1768681472 KDGVRWTZNCMJBP-KCZVDYSFSA-N 442.604 4.355 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCCO1 1769713192 IDFGMSRWULLACK-JOCHJYFZSA-N 437.588 4.394 10 10 IICE O=C1/C(=C\c2cccc(O)c2)SC(=S)N1c1ccc(I)cc1 1860074663 BCPYRAFDCZBENH-NTEUORMPSA-N 439.299 4.403 10 10 IICE CC(C)Oc1cccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCC(=O)N4C)C2=O)c1 1860087809 UYTANLLHOPALTE-VXLYETTFSA-N 440.546 4.235 10 10 IICE Cn1cc(CCNC(=O)c2c3c(n4ccccc24)C(=O)c2ccccc2C3=O)c2ccccc21 1873970931 CKWMOFCHELTLNA-UHFFFAOYSA-N 447.494 4.179 10 10 IICE Oc1c(Br)cccc1CN[C@H]1CN(Cc2ccccc2)C[C@@H]1C(F)(F)F 1878710428 OFHSUPFPGZKEII-RDJZCZTQSA-N 429.280 4.307 10 10 IICE CC(C)Cc1cnn(Cc2cccc(Br)c2O)c1I 2070300151 TYZUXESOGIAHEQ-UHFFFAOYSA-N 435.103 4.203 10 10 IICE CN(C)C(=O)CN(Cc1ccccc1)c1ccc(CNC(C)(C)C)cc1Br 2152240958 QADBZLIMXAJXIG-UHFFFAOYSA-N 432.406 4.432 10 10 IICE CC(C)(C)OC(=O)Nc1cc(CNCc2cc(Br)cc(F)c2O)ccn1 2231895943 GNEMOCTXSFGZBX-UHFFFAOYSA-N 426.286 4.326 10 10 IICE CCOC(=O)c1ccc(-c2ccc(C=C3C(=O)NN(c4ccc(Cl)cc4)C3=O)o2)cc1 2294746002 IIOQAGZRAJGCPI-UHFFFAOYSA-N 436.851 4.238 10 10 IICE COc1ccc(C=C2SC(=S)N(CCc3ccc(OC)c(OC)c3)C2=O)c(OC)c1 2296700335 ZCOMHGGFCGFOJS-UHFFFAOYSA-N 445.562 4.165 10 10 IICE CCOC(=O)c1sc(N2N=C(C)C(=Cc3ccc(N(CC)CC)cc3)C2=O)nc1C 2297313168 LLFSRCYSEBKZIZ-UHFFFAOYSA-N 426.542 4.281 10 10 IICE Cc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)cc1 2314836256 BZNPKPCJIWRHFS-CYBMUJFWSA-N 427.507 4.132 10 10 IICE Cc1ccc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c(O)c1Br 2352636294 KVFDDKJDDOIEID-OAHLLOKOSA-N 429.355 4.019 10 10 IICE COc1ccc(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1OC 8608801 UGLFTLSTBIHHIY-DEOSSOPVSA-N 445.563 4.304 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(N(C)C)cc1 33305053 IEWSDWCUNVHXPE-XDHOZWIPSA-N 441.325 4.392 10 10 IICE COc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3ccc(F)cc3)C2=O)cc1OC 33417592 IWXHZNSYASSHKK-LDADJPATSA-N 446.525 4.073 10 10 IICE CCCCCNc1nc2ccc(C)cn2c(=O)c1/C=C1\SC(=S)N(C(C)C)C1=O 33489108 BYNMFNGUMIVZJM-WJDWOHSUSA-N 430.599 4.215 10 10 IICE COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C/c1ccc(OC)c(OC)c1OC 96736616 AKMNOLURYMQWPH-FHHIAAGZSA-N 437.492 4.146 10 10 IICE CCOC(=O)C1=C(C)NC(COCCN=[N+]=[N-])=C(C(=O)OCC)[C@H]1c1ccccc1Cl 504242588 WGHUZAUDVHLRQX-SFHVURJKSA-N 448.907 4.008 10 10 IICE CC(C)CNC(=O)Nc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 586609482 DVRDSSJCZZZAGW-UHFFFAOYSA-N 441.487 4.492 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccccc1N1CCCCC1 733217288 JSRQBIPRHVMQFZ-UHFFFAOYSA-N 447.501 4.462 10 10 IICE COc1cccc(N2CCC[C@H](NC(=O)N(Cc3ccco3)Cc3ccccc3O)C2)c1 735385923 RBNLUACUVDVCQU-FQEVSTJZSA-N 435.524 4.375 10 10 IICE COc1cc(N(C)CC(=O)Nc2cccc(-c3csc(C)n3)c2)cc(OC)c1OC 741795241 IDVGDNMGNGNDGL-UHFFFAOYSA-N 427.526 4.219 10 10 IICE O=S(=O)(Nc1nc(-c2ccc(F)c(F)c2)cs1)c1ccccc1Cn1ccnc1 759477397 OVXGEYIFOULWHP-UHFFFAOYSA-N 432.477 4.134 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)NCc2cccc(Br)c2O)c1C(F)F 765769155 JAVYGJYEVBMSJR-UHFFFAOYSA-N 442.182 4.258 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccc(NS(=O)(=O)c3cc(C)sc3C)cc2)cc1 917055339 BGHLILUJUJLYCS-UHFFFAOYSA-N 436.580 4.275 10 10 IICE Cc1ccc(/C=C\C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Br)c1 920881894 SQSLFMPXJIVRNU-JEZWAEDTSA-N 429.358 4.485 10 10 IICE CCOc1ccc(C(C)(C)C(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cc1OCC 1131030105 KUFDKSUJOLLIAH-LJQANCHMSA-N 426.557 4.165 10 10 IICE O=C(CN1CCCc2cc(OC(F)(F)F)ccc21)NCc1ccc(OC(F)F)cc1 1167755212 GPAHIFPMBMCQHO-UHFFFAOYSA-N 430.373 4.256 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@H](CC(C)(C)C)c3ccc(F)cc3)CC2)cc1 1168593952 OEVWNQSIVMLXLA-ILBGXUMGSA-N 443.607 4.084 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@@H]1[C@H]1CCCO1 1289423169 HDYRXNOTRNSKHK-FGZHOGPDSA-N 425.621 4.437 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1 1296626673 XVPJTGRWMYRGMB-RTWAWAEBSA-N 439.556 4.472 10 10 IICE CC[C@@](NC(=O)c1cc(C)n(-c2ccccn2)c1C)(C(=O)OC)c1ccc(Cl)cc1 1297721453 DHFHGCDTJFPXQN-QHCPKHFHSA-N 425.916 4.351 10 10 IICE COCCS(=O)(=O)c1ccc(NC(=O)c2cc(C)ccc2-n2c(C)ccc2C)cc1 1298901757 HJIHVAUQLSJQNT-UHFFFAOYSA-N 426.538 4.075 10 10 IICE COc1ccccc1[C@@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)c1noc(C)n1 1456530509 XUZZWONLPSVCMK-XMMPIXPASA-N 430.508 4.242 10 10 IICE COc1cc([C@@H](C)NC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)ccc1S(C)(=O)=O 1457264389 AOMNURXUNJQWFN-QGZVFWFLSA-N 440.565 4.306 10 10 IICE CS[C@@H]1CCCC[C@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1461307857 BAYFMIYATYWCNK-BWJIRVQHSA-N 438.615 4.207 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccc(CC(=O)N3CCc4ccccc43)cc2)cc1 1464715912 IECUNVNPPBNBJH-UHFFFAOYSA-N 427.464 4.233 10 10 IICE Cc1cc(C(=O)N2CSC[C@H]2C(=O)NCCC(C)C)c(C)n1-c1cccc(Cl)c1 1464852767 LMMHAFPOODBMFV-FQEVSTJZSA-N 434.005 4.425 10 10 IICE CN(Cc1ccccc1O)C(=O)c1csc(C2CCN(C(=O)OC(C)(C)C)CC2)n1 1465843065 PGXPNCJPFSMFMJ-UHFFFAOYSA-N 431.558 4.235 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)c1cccc(C)c1C 1473232016 WBSPAUQGKYZQEL-OALUTQOASA-N 427.564 4.199 10 10 IICE CCOC(=O)c1c(C)oc2nc(CN3C[C@@H](C(C)C)Cc4cc(OC)ccc43)nc(N)c12 1473569479 HJWOYOAHQUCTCR-INIZCTEOSA-N 438.528 4.134 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1Cc1ccc(Cl)s1 1498659646 RGDYNWTWJCOEEX-UHFFFAOYSA-N 431.993 4.077 10 10 IICE CON(C)c1nnc(-c2cc3c(s2)CC[C@H](C)C3)n1Cc1ccc(N(C)C)c(F)c1 1505090502 LLKNRKUOEYNCIW-AWEZNQCLSA-N 429.565 4.382 10 10 IICE CC[C@@H]1CN(c2nnc(-c3ccccc3F)n2CCCSc2nccs2)CCO1 1514148306 WTPSUELDMVWCRJ-OAHLLOKOSA-N 433.578 4.338 10 10 IICE CCOC[C@H]1CCCN(c2nnc([C@@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)C1 1516636330 AUJSOPBWNUNCTG-REWPJTCUSA-N 441.620 4.195 10 10 IICE CCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 1524254560 KDINOIHROPTKSA-MRXNPFEDSA-N 434.989 4.300 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)cc2F)C[C@@H](C)O1 1526004007 VTZYNUQKWIFXRU-CALCHBBNSA-N 441.503 4.086 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](F)c3ccc(C(F)(F)F)cc3)CC2)c(OC)c1 1530968251 MOJHDYBCIKEXAK-LJQANCHMSA-N 426.410 4.082 10 10 IICE CN(C)[C@H](C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ccc(Cl)cc1 1533327065 ASSHHLOKHSVAMZ-XLIONFOSSA-N 437.918 4.329 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(O[C@@H](C)C(F)(F)F)nc3C)CC2)cc1 1534519217 RGRIVBGSXQWYBF-INIZCTEOSA-N 437.462 4.081 10 10 IICE C[C@H](NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(N(C)C)cc1 1537679635 LXCVKXOJZRUXEQ-IFCGJNOESA-N 434.367 4.456 10 10 IICE COc1ccc(-n2cc(C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)nn2)cc1 1538420879 GVYUROKVBKGDFI-INIZCTEOSA-N 439.947 4.096 10 10 IICE Cc1ccccc1CN1CCN(C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)CC1 1540298538 RZVVYWSWCGXDAZ-UHFFFAOYSA-N 429.564 4.102 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cc(Cl)c3N)cc2F)C[C@@H](C)O1 1543232987 ACPCXYTYAIMQPT-VXGBXAGGSA-N 426.319 4.258 10 10 IICE CC[C@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCC(=O)N(C)C)C1 1546686469 RPVJYZWBTZZGSK-NRFANRHFSA-N 448.615 4.457 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3C[C@H](OC)C(C)(C)C)CC2)cc1F 1554960474 JHWOZGNYLNKSOX-NRFANRHFSA-N 447.599 4.012 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)c1C 1565905854 CPEVCFRELOKVSK-HFZDXXHNSA-N 431.580 4.422 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@H]3C[C@]3(C)c3cccc(Br)c3)C2)cc1 1584444636 VERPQSYCTQFFOL-FQQGMQMYSA-N 443.385 4.378 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C3)ccc21 1584862106 ICJKEGXIMYNWAV-JXFKEZNVSA-N 428.573 4.344 10 10 IICE CN(C)c1ccc(Cn2c(N(C)[C@@H]3CCCc4c3cnn4C)nnc2C(C)(C)C)cc1F 1617667330 OAVVVQTVWWUBCR-LJQANCHMSA-N 439.583 4.076 10 10 IICE CCC1(c2ccccc2)CN(C(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)C1 1626148595 PEHIPPSVGXMMPO-UHFFFAOYSA-N 442.562 4.058 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cnc(-c2ccccc2Cl)s1 1630282888 JXVPBVGQMFTKJK-UHFFFAOYSA-N 427.957 4.355 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4c(Br)cccc4cn3)CC2)cc1F 1631377936 VBXDVURRDTVKJC-UHFFFAOYSA-N 444.304 4.107 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1635801034 AWJPWOIENHUAQL-WIYYLYMNSA-N 444.620 4.081 10 10 IICE COc1ccc([C@H](O)CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)cc1 1635820654 IGVQXAXGIRDESU-OAQYLSRUSA-N 443.341 4.329 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1 1636262486 HKQQSNWORCCEOL-YJBOKZPZSA-N 435.494 4.348 10 10 IICE Cc1c(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cnn1CC(C)C 1636516405 FMFOQXIHEWXNAS-VCHYOVAHSA-N 446.573 4.217 10 10 IICE O=C(c1cc2cc(O)c(O)cc2s1)N1CCO[C@H](c2cccc(OC(F)(F)F)c2)C1 1637148470 GJMBRCKHUKPDFK-INIZCTEOSA-N 439.411 4.425 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccccc4F)C3=O)c2C)c1 1652632769 IRWNGLNHSXUYNL-RUZDIDTESA-N 433.483 4.192 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H]3C[C@H]3c3ccccc3Br)C2)cc1 1680604769 HZWCILONZRTFDR-MFMILTCTSA-N 444.373 4.139 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCC(C)(C)O)C1 1712051841 RBHJUKAJVAPAIE-NRFANRHFSA-N 437.588 4.129 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1712798958 DIEZTYFNFPMASP-RXVVDRJESA-N 443.661 4.181 10 10 IICE Cc1cc(-c2nnc(N3CCOC(C)(C)C3)n2CCCCCO)c(C)n1-c1ccccc1 1724199820 WZDFKKKTRCJEBT-UHFFFAOYSA-N 437.588 4.130 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H](C)C1 1741112340 CQHLLZQUOFUVPR-OALUTQOASA-N 448.615 4.361 10 10 IICE CC[C@@H](C)c1nnc(N2CCO[C@H](C(C)C)C2)n1Cc1ccc(N2CCSCC2)cc1 1743782355 GRAJESYJRVFZLP-KNQAVFIVSA-N 443.661 4.254 10 10 IICE CC(C)=CCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1760827055 LNZQLYWXUNUUOD-UHFFFAOYSA-N 446.599 4.093 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@](C)(OC)CC2)n1Cc1ccc(N2CCOCC2)cc1 1763677684 VYBNRFOHBQMCFN-NLFFAJNJSA-N 441.620 4.072 10 10 IICE CCN(CC)CCNC(=O)c1ccc(/N=N/N2CCN(c3cccc(Cl)c3)CC2)cc1 1860480829 GYRDPDJHLUCLEA-CYYJNZCTSA-N 442.995 4.233 10 10 IICE CC[C@@H]1CCCN1c1cc(N2CCN(c3ccc(OC)cc3)CC2)nc(-c2cccnc2)n1 1869373822 SECWZXMSZGHKPZ-OAQYLSRUSA-N 444.583 4.253 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C3CC3)c(CN)c2I)c(O)c1 2079006786 IDKXLDDMRHRGOL-KRWDZBQOSA-N 425.314 4.083 10 10 IICE CCc1nn([C@H](c2ccc(C)cc2O)C2(C)CC2)c(I)c1C(=O)O 2079124396 IVHAYUATNFSXHM-OAHLLOKOSA-N 440.281 4.152 10 10 IICE COCCNCc1ccc(N(CCCN(C)C)Cc2ccccc2)c(Br)c1 2152207360 QJTFOUJVYFYQHD-UHFFFAOYSA-N 434.422 4.143 10 10 IICE CSc1ncc(CNC(=O)c2cc(Br)c(Br)s2)s1 2257098480 WYFJLOQMPLTWIW-UHFFFAOYSA-N 428.196 4.382 10 10 IICE O=C1NC(=O)N(C2CCCCC2)C(=O)C1=Cc1ccc(-c2cc(C(=O)O)ccc2Cl)o1 2294353263 NITZCLZBZVGGMH-UHFFFAOYSA-N 442.855 4.093 10 10 IICE CCCOc1ccc(C=C2SC(=S)N(CCCCCC(=O)OC)C2=O)cc1OC 2297306879 PJHCOEZDCKVPKR-UHFFFAOYSA-N 437.583 4.419 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccc([N+](=O)[O-])c2)SC1=S)Nc1ccc(F)cc1 2314831709 QHQGXKYLUKDLTJ-UHFFFAOYSA-N 445.497 4.354 10 10 IICE O=C(O)[C@H](Cc1ccc(O)cc1)N1C(=O)C(=Cc2c(F)cccc2Cl)SC1=S 2323809155 DLPYNADYUZVDAG-HNNXBMFYSA-N 437.901 4.082 10 10 IICE Cc1ccc(CN(C)C[C@H]2CC2(Br)Br)c(O)c1Br 2327609917 QGKHKDQYMMUEKO-SNVBAGLBSA-N 441.989 4.401 10 10 IICE COc1cc(OC)c(OC)cc1C=C1C(=O)N(c2ccc(Br)cc2)N=C1C 2332141179 MJJHZJAWPXLZOB-UHFFFAOYSA-N 431.286 4.281 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2352941325 PNGVTSWUHZMEJK-CYBMUJFWSA-N 429.355 4.067 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@]2(C)CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2380760323 WQDLKZSTUJTZOO-HXUWFJFHSA-N 441.366 4.211 10 10 IICE CC[C@@H](CCNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380786089 HAROLJKOHVBSDJ-AWEZNQCLSA-N 443.382 4.363 10 10 IICE CC(=C/c1ccccc1)/C=C1/SC(=S)N(NC(=O)c2ccccc2[N+](=O)[O-])C1=O 1452155 BYMVPSWDCRIMSD-RTNVFWHRSA-N 425.491 4.087 10 10 IICE COc1ccc(/C=C2/SC(=S)N(c3ccccc3Cl)C2=O)c(C(=O)O)c1OC 16906166 UHDBXTSGFJBTSZ-NTEUORMPSA-N 435.910 4.461 10 10 IICE COc1ccc(CCN2C(=O)c3ccccc3[C@@H](C(=O)O)[C@@H]2c2ccccc2O)cc1OC 20583477 FJWBMPGQFPUEPT-RPWUZVMVSA-N 447.487 4.017 10 10 IICE CSc1nc2ccccc2n1C(=O)CCN1C(=O)/C(=C\c2ccco2)SC1=S 33633135 GGLZVCARTOPPLC-RVDMUPIBSA-N 429.548 4.283 10 10 IICE Cc1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=S)N=C2O)c(C)n1C[C@H]1CCCO1 59109255 ORMMPLXXTNUBSZ-NPBUNYCVSA-N 427.501 4.095 10 10 IICE Cc1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)nn1-c1ccc(Br)cc1 430596085 NSTNRTBBKJJKIV-UHFFFAOYSA-N 441.329 4.048 10 10 IICE CCNC(=O)Nc1cccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c1 444051287 RQCVCCXPGSFGCA-UHFFFAOYSA-N 433.556 4.188 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(CN3CCCC3=O)c2)C1 683440636 LXZNACXSYLIKLG-UHFFFAOYSA-N 444.579 4.169 10 10 IICE CC[C@@H](NCCOCCCNC(=O)OC(C)(C)C)c1cc(Br)ccc1O 698772037 ASYFVXRBRNXQRQ-MRXNPFEDSA-N 431.371 4.127 10 10 IICE C[C@@H]1[C@H](NCc2c(O)cccc2Br)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 709436153 KVHYSLMUHGPSFP-BQGCOEIASA-N 425.367 4.421 10 10 IICE CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)c2sccc2-n2c(C)ccc2C)C1 742137468 BYOYGPZOWAUMNO-MRXNPFEDSA-N 441.519 4.419 10 10 IICE Cc1nn(C)c(C)c1C[C@H](C)C(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 745280897 ZQMDVMIJEAAQEI-AWEZNQCLSA-N 425.504 4.188 10 10 IICE CN1CC[C@H](NC(=O)NCc2ccc(N3CCSCC3)cc2)[C@H]1c1ccc(Cl)cc1 760305218 CRZOPVFKDSELBZ-FCHUYYIVSA-N 445.032 4.138 10 10 IICE CN(CCC(F)(F)F)[C@@H](CNC(=O)NCc1ccccc1O)c1ccc(Cl)cc1 790883736 XQOPWRBLPONGGE-KRWDZBQOSA-N 429.870 4.470 10 10 IICE CCc1cc(C(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c2c(C(C)C)noc2n1 801158884 MDIYIGHCFSUUGF-UHFFFAOYSA-N 436.556 4.047 10 10 IICE CC[C@@H](C)Oc1cc(C(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)ccn1 1125196487 MDGCKYHZRJOKHA-OAHLLOKOSA-N 437.462 4.044 10 10 IICE C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 1135914798 QMRXUFGZHLJQJK-CTUHWIOQSA-N 433.596 4.495 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2COC(=O)N2CCC[C@H](C)C2)c(C)n1-c1ccccn1 1157242973 LLERELPVUWFPTK-GHTZIAJQSA-N 438.572 4.352 10 10 IICE CCOC(=O)c1c(NC(=O)CN(CCO)C2CCCCC2)sc(C)c1-c1ccccc1 1168317567 QWDRZOQKAVXPEW-UHFFFAOYSA-N 444.597 4.466 10 10 IICE CC[C@@H]1C[C@@H](C)CN1c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1293295820 ARAGFLCOJVPLML-IEBWSBKVSA-N 429.584 4.224 10 10 IICE CCOC[C@@H]1CCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)C1 1297371878 OSHQDUNLRFYNDD-QGZVFWFLSA-N 444.630 4.232 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1OCCC1(C)C 1301682140 CFKFYFMSOWIKKN-QFIPXVFZSA-N 437.588 4.250 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1cc(C)ccc1C 1307535754 QANGFUOLJJPNRE-BGYRXZFFSA-N 427.564 4.199 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCN(c4cccc(Cl)c4)C3=O)ccc21 1361201058 OVRPLDDSWJWTJU-OAQYLSRUSA-N 439.943 4.093 10 10 IICE CCc1ccc(N2C[C@@H](C(=O)N(Cc3ccc(N(C)C)cc3)CC(F)(F)F)CC2=O)cc1 1435078484 XEPMIFFPEXDFJQ-IBGZPJMESA-N 447.501 4.259 10 10 IICE O=C(/C=C\c1nc2ccccc2s1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880085 FNKKMPLRXDZTFQ-DOOKAGJSSA-N 427.957 4.449 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](CO)c2ccccc2OC(F)(F)F)c1 1448933414 FPULUFSXAREMKJ-HXUWFJFHSA-N 446.425 4.269 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl 1451668364 MBXUTEKMMNYMDO-LSDHHAIUSA-N 436.383 4.234 10 10 IICE Cc1noc2nc(C(C)C)cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)c12 1465951945 SGPFKKPXIQEMFW-QGZVFWFLSA-N 442.947 4.408 10 10 IICE COC(=O)[C@H](c1ccc(Br)s1)N(C)Cc1cc(Cl)cc(C(C)=O)c1O 1473731678 YIXQAJMMNMCTLA-HNNXBMFYSA-N 446.750 4.418 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1479063689 KPQITWUPCVMXDG-OAQYLSRUSA-N 440.588 4.335 10 10 IICE Cc1c(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cccc1C(=O)N1CCOCC1 1518558756 NSIOIYXJVJPJBK-UHFFFAOYSA-N 431.536 4.056 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cnc(CCC(F)(F)F)s3)cc2F)C[C@H](C)O1 1527482238 VPZNYBKNJGIWGB-STQMWFEESA-N 445.482 4.321 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccccc4)nc3)cc2F)CC1 1530377672 YWINMULHFFTNOU-UHFFFAOYSA-N 434.515 4.085 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 1539467819 FAUKCUKSJFMBRW-SANMLTNESA-N 441.575 4.287 10 10 IICE CC(C)OCCCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1541753846 SSWUUINBSPGGQV-UHFFFAOYSA-N 434.588 4.392 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H]([C@H]2CCOC2)C1 1542226950 NPMYXCOQRNGHLV-SFTDATJTSA-N 425.621 4.152 10 10 IICE Cc1cc(C(=O)N2CCC(Cn3cnnc3)CC2)c(C)n1-c1ccc(Br)cc1 1557382291 NMJXNMYSUISDRA-UHFFFAOYSA-N 442.361 4.001 10 10 IICE COC(=O)[C@H]1C[C@@H](C(F)(F)F)CN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)C1 1557482274 KANIWMIZNDLPTL-LSDHHAIUSA-N 426.410 4.047 10 10 IICE CCN(C(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)[C@@H]1CCN(CC(F)(F)F)C1 1557709543 XLDMCBFLGWQAFF-MRXNPFEDSA-N 437.506 4.014 10 10 IICE COC(=O)c1cc(OCC(=O)c2cc(C)n(Cc3cccs3)c2C)ccc1N(C)C 1559456379 ALLNKCWBPPFVNR-UHFFFAOYSA-N 426.538 4.329 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cn(-c2ccc(Br)cc2)cn1 1584094242 CPHBWCSHLKETMA-INIZCTEOSA-N 441.373 4.370 10 10 IICE O=C(Nc1ccc(OCC2CC2)cc1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1585933288 XRKYZNPYUFDOTB-UHFFFAOYSA-N 444.534 4.296 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cccc2nsnc12 1587465405 MRZSBIDTCSHFKI-UVTDQMKNSA-N 446.604 4.373 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1csc(I)n1 1587476156 XGHJGNYTISIFGR-UHFFFAOYSA-N 441.338 4.010 10 10 IICE Cc1ccc(-c2nnc(N(C)C[C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)o1 1612018458 RFKBITMCDUDMPS-GOSISDBHSA-N 427.524 4.105 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3c4ccccc4SC[C@H]3C)cc2F)C[C@@H](C)O1 1615994932 NLGUFJBZSQOJKN-KURKYZTESA-N 443.588 4.056 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Cl)cc(F)c3Br)C2)cc1 1617262946 PKBMQIMLIJUJLZ-GFCCVEGCSA-N 427.701 4.259 10 10 IICE COC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCOC1 1618907738 FSGHZQWZUCMZDC-FQEVSTJZSA-N 437.588 4.250 10 10 IICE Cc1cc(C(=O)N2CCN(CCOC(C)C)CC2)c(C)n1-c1ccc(Br)cc1 1621562601 BMADBBWQYWTDJA-UHFFFAOYSA-N 448.405 4.039 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1C[C@@H](OC(C)(C)C)[C@@H]1n1cccn1 1635334218 CSQDULSPRQJWFO-DNVJHFABSA-N 439.604 4.212 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H](C)c1ccccc1[N+](=O)[O-] 1638707681 PCSNQLHQXFMJCS-ZDUSSCGKSA-N 436.306 4.398 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)CC2(CNC(=O)OC(C)(C)C)CCCCC2)cc1 1639814055 IITDEIDRGDEDEL-UHFFFAOYSA-N 447.620 4.455 10 10 IICE Cc1cc(C(=O)Cn2cnc3cccc(F)c3c2=O)c(C)n1-c1ccc(OC(F)F)cc1 1651840440 ONYVRLIESRDSCJ-UHFFFAOYSA-N 441.409 4.427 10 10 IICE COC(=O)c1ccc(S[C@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1652595544 NKSJKCFVIDXDRO-CQSZACIVSA-N 445.496 4.368 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H](C)N[C@@H](C)c2cc(OC)ccc2O)sc2c1CCCC2 1653961805 XRPZYLOZTOFTGI-KBPBESRZSA-N 446.569 4.196 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccc(Cl)cc1 1660293551 BLEONXXNGRXMNS-IAGOWNOFSA-N 433.955 4.235 10 10 IICE COc1ccc(OC)c([C@@H](O)[C@@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)c1 1683307482 HTZLFUSUGUBTFT-OSPHWJPCSA-N 437.540 4.033 10 10 IICE C[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)CC(C)(C)O1 1693753766 LGFIIHXSQWEMAS-GOSISDBHSA-N 443.661 4.181 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CCNC(=O)C(C)C 1695226740 RTKZIWVWJVARKL-UHFFFAOYSA-N 436.604 4.361 10 10 IICE CN(Cc1cccc(F)c1)c1nnc(-c2cnn(C)c2)n1CCCSc1nccs1 1711088918 QLABJEDFCVFEDD-UHFFFAOYSA-N 443.577 4.093 10 10 IICE COCCC1(Cn2c(-c3cnccn3)nnc2N(C)Cc2ccccc2O)CCCCC1 1730645376 ZGYICORONHXHGH-UHFFFAOYSA-N 436.560 4.064 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3cccnc3)nnc2N(C)CC(F)(F)F)cc1 1746092500 DSVVVENIQXKHQJ-UHFFFAOYSA-N 432.494 4.157 10 10 IICE C[C@H]1COC(C)(C)CN1c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1770682890 ODIABYZADYFXIG-HOTGVXAUSA-N 437.635 4.162 10 10 IICE CN(Cc1ccccc1)C(=O)c1c[nH]nc1[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1 1848357328 DPNXWVBFVCAWSP-DEOSSOPVSA-N 431.584 4.475 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)c3nn(-c4ccccc4)c4c3CCC4)cccc21 1861858707 IGGXFNMGLJDQEU-UHFFFAOYSA-N 433.467 4.389 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccccn4)nc4ccc(F)cc34)CC2)cc1 1873831996 XXSFCBKYODBINW-UHFFFAOYSA-N 442.494 4.407 10 10 IICE CC(C)(C)OC(=O)N1CC2(CCC2)C[C@@H]1CNCc1c(O)cccc1Br 1965971499 YMPZTENKBUSEBH-CQSZACIVSA-N 425.367 4.424 10 10 IICE C[C@H](N)c1ccc(N2CCCN(Cc3ccccc3)CCOCC2)cc1Br 2144880460 UWDHQKPOCUVOER-SFHVURJKSA-N 432.406 4.198 10 10 IICE COc1ccc(Br)c(CN[C@H](CNC(=O)OC(C)(C)C)C2CCCC2)c1O 2236055034 NLNSYXKPUCLACP-MRXNPFEDSA-N 443.382 4.336 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(NC(=O)c2cccc([N+](=O)[O-])c2)C1=O 2296763901 BBFSIEPNQMJCNX-UHFFFAOYSA-N 425.491 4.087 10 10 IICE CC[C@@H](Oc1cccc(C=C2SC(=S)N(CCc3ccc(O)cc3)C2=O)c1)C(=O)O 2314930494 FCFCUUWRSTWRKE-GOSISDBHSA-N 443.546 4.078 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2C[C@@H]3CC[C@H]2N3C(=O)OC(C)(C)C)c1O 2358678271 SBCNLKOBROFBCV-HEHGZKQESA-N 441.366 4.041 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457447 NMFAWQPPLQLABQ-GCHBTCAUSA-N 428.554 4.304 10 10 IICE COc1cc(/C=C2\SC(=S)N([C@@H](C)C(=O)Nc3ccc(Cl)cc3)C2=O)ccc1O 15046039 QDIAGCMGBWVRDA-MTUBTWAWSA-N 448.953 4.283 10 10 IICE O=C(/C=C/c1c(F)cccc1F)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 71933392 RLXWGYFVBDMHLG-VOTSOKGWSA-N 426.385 4.150 10 10 IICE CC1(C)CC(=O)c2cc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)ccc2O1 170565376 HTMSBGJIEJWIAT-UHFFFAOYSA-N 425.440 4.458 10 10 IICE O=C(O)/C=C/c1ccc(N2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c(Br)c1 687214779 PQKZBZCJRNUYDE-BZZHFGAJSA-N 427.342 4.400 10 10 IICE CC[S@@](=O)CCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(N(C)C)cc1)CC2 739581055 ZOMSEYJJUUKNKC-YAPOEIJFSA-N 447.604 4.286 10 10 IICE CC1CCN(c2ccc(CNC(=O)N[C@H](Cc3nccn3C)c3ccccc3)cc2)CC1 743600164 KUAAQWOAEHQAQW-XMMPIXPASA-N 431.584 4.440 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)C1 767563302 UBTTULIADSJMRG-NDEPHWFRSA-N 445.607 4.380 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCCCC(F)(F)F)C2=O)cc2c1OCCO2 794861008 BPFYOYVYZZNIQL-UVTDQMKNSA-N 433.473 4.400 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cc(=O)c3ccccc3[nH]2)cc1 842894466 KRFGGCROIPQISA-UHFFFAOYSA-N 427.504 4.450 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](N3CCCC3)CC2)c(C)n1-c1ccc(Br)cn1 1136844912 YLXCUDQIRFCVIS-IBGZPJMESA-N 445.405 4.342 10 10 IICE Cc1cc([C@H]2CCCN2C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)on1 1141731775 DLYHTJNAKKAGFU-UWCCDQBKSA-N 445.541 4.077 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1nn(C(C)C)c(=O)c2ccccc12 1149893367 ZMUVQIUTFONEKJ-UHFFFAOYSA-N 444.329 4.108 10 10 IICE COC(=O)[C@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1ccc2c(c1)CCO2 1155119657 ZMBFVBFEIMNYGD-XMMPIXPASA-N 432.520 4.290 10 10 IICE Cc1cc(CC(=O)N2C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C2)c(C)n1-c1ccccc1 1155303361 NBPBAIZAHFKBNC-NRFANRHFSA-N 425.573 4.398 10 10 IICE COc1ccc(N2CCN(CC(=O)Nc3ccc(-c4ccccc4)cc3)CC2)c(OC)c1 1197096139 QSEZXUWMBBCBLF-UHFFFAOYSA-N 431.536 4.132 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccnc(OCc4ccccc4)c3)cc2F)C[C@@H](C)O1 1291755271 CBBPQZYZPDMNST-RTBURBONSA-N 449.526 4.343 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(Cl)c(Br)c(OC)c1N 1292178283 FCTCWCRONSOMNI-UHFFFAOYSA-N 440.769 4.422 10 10 IICE CCO[C@@]1(c2nnc(N(CC(C)C)C(C)C)n2Cc2ccc(N(C)C)cc2C)CCOC1 1296563576 VFJBWNOAFAJKBZ-VWLOTQADSA-N 443.636 4.224 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](OC(C)(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1302660584 NNSCWJXUTCBQHF-JOCHJYFZSA-N 441.620 4.070 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1302699912 DTOUQSNWCBGEKH-PXNSSMCTSA-N 433.597 4.105 10 10 IICE O=C(NCc1c(O)cccc1O)[C@@H](Oc1ccc(F)cc1Br)c1ccccc1 1304053562 NZYBZHAAYCKETB-FQEVSTJZSA-N 446.272 4.436 10 10 IICE CCC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC(C)(OC)C1 1306529797 UQCKVJBRUDDNDF-DEOSSOPVSA-N 437.588 4.129 10 10 IICE Cc1cc(CC(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)c(C)n1-c1ccccc1 1353405505 IWRHLEZPFMVVTO-UHFFFAOYSA-N 430.552 4.365 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)CCc3cccc4ccccc34)CC2)cc1 1353705518 BOSSAFPSXCDTIW-UHFFFAOYSA-N 431.580 4.110 10 10 IICE CC(C)N1C(=O)C[C@@H](C(=O)NCc2ccc(N(C)C)cc2)[C@H]1c1ccc(Cl)c(F)c1 1355878935 OSTOHBLIDKTZMH-XMSQKQJNSA-N 431.939 4.160 10 10 IICE COc1ccc(N2CCN(C(=O)[C@H](C)Oc3ccccc3Cc3ccccc3)CC2)cc1 1356445647 KLDVAHCILHOYNW-NRFANRHFSA-N 430.548 4.402 10 10 IICE O=C(Nc1cccc(N2CCS(=O)(=O)CC2)c1)c1c(Cl)cc(Cl)cc1Cl 1359946612 VXDYLGUOPNYBOH-UHFFFAOYSA-N 433.744 4.134 10 10 IICE Cc1cccc(N2C[C@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)c1C 1438179542 OSWXLCOOLPXMDO-HSZRJFAPSA-N 429.564 4.423 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(N)c(OC(F)(F)F)c2)cc1 1442611899 HOGJGSWENVYYHT-SFHVURJKSA-N 437.462 4.055 10 10 IICE Cc1ccc(C(C)(C)CNC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cc1 1443411780 YGGPOSFDCODHKO-UHFFFAOYSA-N 444.578 4.271 10 10 IICE O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 1452948189 VOBRUBKTEWLJIG-INIZCTEOSA-N 427.715 4.273 10 10 IICE C[C@H](NCC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1ccccc1O 1460635048 ALCRECVLWFXDQP-FQEVSTJZSA-N 440.547 4.271 10 10 IICE COc1cc(N)c(C(=O)N(Cc2ccco2)Cc2ccccc2O)cc1Br 1465841490 ZWRQZXNRMMANFX-UHFFFAOYSA-N 431.286 4.181 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)NC[C@]3(c4ccccc4)C[C@H](O)C3)cc2Cl)C1 1469959996 MTSSONNLIKCASE-HMHJJOSWSA-N 442.003 4.468 10 10 IICE C[C@@H]1CSCCN1c1nnc([C@@H]2CCCCO2)n1CCCSc1nccs1 1494614499 YQTNRUMHYPKDGC-CABCVRRESA-N 425.649 4.100 10 10 IICE C[C@H]1C[C@H](C)CN(c2ccc(C(=O)NCc3ccc(N(C)C)c(F)c3)cc2[N+](=O)[O-])C1 1519249830 UHMUJKUYDDNYIT-HOTGVXAUSA-N 428.508 4.212 10 10 IICE CC[C@H](C)CCCCC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 1527966435 DBUIHYCUFCYMII-IBGZPJMESA-N 427.568 4.165 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCO[C@H](C(C)C)C1 1542228337 GYRTYDUCHUTUIL-QFIPXVFZSA-N 439.629 4.214 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1C[C@@]1(O)CCC[C@@H]1C 1545503943 LHAWXDQNXWQNRJ-RLSLOFABSA-N 441.620 4.068 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCS[C@@H](C)[C@@H]2C)cc1 1547446587 BRJQDOMRFHHCEA-IRFCIJBXSA-N 443.661 4.397 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1CC1CCC(F)(F)CC1 1554175702 SVOQSVVYSMAUCL-UHFFFAOYSA-N 427.499 4.431 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(C2CC2)nc2ccc(OC)cc12 1557115355 SUYPAVLEACAWCQ-UHFFFAOYSA-N 434.492 4.032 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc([C@H]4CCCN(C)C4)c3)cc2F)C[C@@H](C)O1 1558915504 PXKFZHZELYDABE-YYDVJCTNSA-N 439.575 4.179 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H](O)COc2cccc(F)c2)cc1 1566327614 BABNLWRAZDUVIY-HXUWFJFHSA-N 436.487 4.477 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2cncc3nc(C(F)(F)F)[nH]c23)cc1 1570906678 RKDKCYKSMTVODP-UHFFFAOYSA-N 445.367 4.247 10 10 IICE CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1583700012 PMCAGZXSLOEYAK-UHFFFAOYSA-N 442.491 4.391 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H]1CCC2(CN(C(=O)OC(C)(C)C)C2)O1 1584914989 COUCBNDJJXEZQY-QGZVFWFLSA-N 445.585 4.054 10 10 IICE CC(C)(C)Cc1nnc(N2CCN3CCCC[C@@H]3C2)n1CCCSc1nccs1 1597336575 HXLGBRFKISYEKU-QGZVFWFLSA-N 434.679 4.180 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3csc(-c4c(F)cccc4F)n3)C2)cc1 1598363026 CHVWTJHPGVDVPU-CQSZACIVSA-N 429.492 4.353 10 10 IICE Cc1cc(C(=O)CN2C(=O)[C@H](C)N(c3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cn1 1613456751 OHYMEWOUHHKYNX-INIZCTEOSA-N 436.899 4.183 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC(OCCCOc2ccccc2)C1 1621067299 IGMCHSLEGNGBMP-UHFFFAOYSA-N 432.520 4.217 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H](CC(N)=O)c3ccccc3Cl)c2C)cc1 1621282309 GQSYIRMFHLOMQQ-OAQYLSRUSA-N 425.916 4.103 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H](c3ccncc3)C3CCCC3)cc2F)C[C@@H](C)O1 1625089688 DSOLHYZRKFDWJA-GGUMNFRJSA-N 425.548 4.425 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1Cc1ccco1 1630256933 IBODKTORHJOLGH-FQEVSTJZSA-N 441.959 4.500 10 10 IICE CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 1631438894 OMAAUTOOKYSKPV-HSZRJFAPSA-N 436.552 4.422 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 1634768259 NJNUXAYHFRFPHC-KESTWPANSA-N 447.501 4.412 10 10 IICE Cc1ccc(C(=O)NC/C=C\CNC(=O)OC(C)(C)C)cc1-n1c(C)cc(C=O)c1C 1637212257 MHQCAWGWIAOWDK-FPLPWBNLSA-N 425.529 4.026 10 10 IICE O=C(CCSc1ccccc1Br)NCc1ccc(N2CCC(O)CC2)cc1 1646431897 TZNBPHSKSKBOBE-UHFFFAOYSA-N 449.414 4.209 10 10 IICE Cc1cc(C(=O)Cn2nnnc2Cc2ccccn2)c(C)n1-c1cc(Cl)cc(Cl)c1 1656347142 HYXMKQDBKAJKQW-UHFFFAOYSA-N 441.322 4.256 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCCCc4cc(OC)c(OC)cc43)C2)cc1 1674325771 DDBNUFBQAVJHSR-PGRDOPGGSA-N 439.556 4.058 10 10 IICE COC(=O)c1nc([C@@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)sc1C 1683253100 CTBFDLXNKKXYDT-BEFAXECRSA-N 444.601 4.090 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC=C(c4ccc(Cl)nc4)CC3)C2)cc1 1683340298 RQXQIFYJMSLYAG-QGZVFWFLSA-N 426.948 4.069 10 10 IICE CCS(=O)(=O)c1ccccc1CCNC(=O)N(Cc1ccccc1O)C1CCCCC1 1685210836 DXIVXWNCPMXUIL-UHFFFAOYSA-N 444.597 4.273 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccccc1SC(F)(F)F 1687155494 PEDXGDBWPXUUFX-UHFFFAOYSA-N 439.503 4.259 10 10 IICE Cc1cc(CCNC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c(C)n1-c1ccccc1 1687218116 ZNYWODOCASPPFK-UHFFFAOYSA-N 447.539 4.077 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@H](C)C3)n2CCNC(=O)C(C)C)c(C)n1-c1ccccc1 1692981474 GUIPDWOCPCASIB-RTBURBONSA-N 448.615 4.217 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C[C@@H](C)C1(F)F 1731154970 VEMACPMFUCXEIW-QLFBSQMISA-N 443.589 4.496 10 10 IICE Cc1cc(-c2nnc(N3CCC(CC(N)=O)CC3)n2CCC(C)C)c(C)n1-c1ccccc1 1751410335 FQWQUEGWKYOQPW-UHFFFAOYSA-N 448.615 4.491 10 10 IICE CCC1CCN(c2nnc([C@H](C)OCCOC)n2Cc2ccc(N(C)C)cc2C)CC1 1765166067 UAAMEBASCBZAGG-IBGZPJMESA-N 429.609 4.051 10 10 IICE COc1ccccc1-c1nnc(N2C[C@H](C)O[C@@H](C)C2)n1CCCSc1nccs1 1770391989 KSHJADLZSLUMGZ-HOTGVXAUSA-N 445.614 4.206 10 10 IICE Cc1ccc(-c2nn(-c3ccccc3)cc2C=C2SC(N3CCOCC3)=NC2=O)cc1 2040469429 UULRYSGLSSLMQZ-UHFFFAOYSA-N 430.533 4.150 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2[C@@H](NCc3cccc(Br)c3O)CCC[C@H]2C1 2092943086 HDCSSKJHYMIZMC-UXLLHSPISA-N 425.367 4.280 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](CNCc2c(O)cccc2Br)CC12CCC2 2116697742 DLZMLSZQYPFEJN-AWEZNQCLSA-N 425.367 4.424 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)C[C@H]21 2137342838 FHHSXHYOHXYJCL-DVUFPGTOSA-N 429.330 4.075 10 10 IICE Oc1ccc(Br)cc1CNCCc1cccc(I)c1 2273836313 QAGKJKYNNDRLLX-UHFFFAOYSA-N 432.099 4.092 10 10 IICE COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)C1=Cc1cc(Br)ccc1OC 2297309770 ZPKRNQWNPNYCFY-UHFFFAOYSA-N 446.272 4.474 10 10 IICE Cc1ccc(CNC[C@H]2CC2(Br)Br)c(O)c1Br 2307472255 DGORUXICADTQJZ-SECBINFHSA-N 427.962 4.059 10 10 IICE Cc1ccc(CNC(=O)[C@@]2(C)CC[C@@]2(C)NC(=O)OC(C)(C)C)c(O)c1Br 2380755916 GSQUWSSWMKHZBU-WOJBJXKFSA-N 441.366 4.163 10 10 IICE CC[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(C)c(Br)c1O 2380756527 LXKRRRVTPJBCNX-WFASDCNBSA-N 443.382 4.409 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)c3cc4ccccc4o3)c3ccco3)CC2)cc1 38598112 YBLMHTZVTUXBMW-JOCHJYFZSA-N 445.519 4.328 10 10 IICE Cc1ccc(C2=NC(=O)/C(=C3\C(=O)N(C)c4c(C)cc(Br)cc43)S2)cc1 104010169 STPOYVUWYBAPEV-BMRADRMJSA-N 427.323 4.474 10 10 IICE CCOC(=O)c1ccc(N2C(=O)C(O)=C(c3ccc(F)cc3)[C@@H]2c2ccc(O)c(O)c2)cc1 526280162 YONUGNVQUPOKLX-QFIPXVFZSA-N 449.434 4.471 10 10 IICE Cc1cc(C(=O)[C@H](C)OC(=O)/C=C/c2cnccn2)c(C)n1-c1ccc(OC(F)F)cc1 735936733 TXMZDGLTTUOHJI-UFNQUYMESA-N 441.434 4.313 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)c1 743337067 PBHRGOYIBSJFEB-FUHWJXTLSA-N 428.529 4.104 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccccc3NC(=O)c3ccccc3)CC2)cc1F 753740983 AHNSNICPXOJAHQ-UHFFFAOYSA-N 433.483 4.049 10 10 IICE C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 764535899 HOVMQBGXFQWCSJ-SIKLNZKXSA-N 444.620 4.464 10 10 IICE CN(c1ccc(CNC(=O)N2CCC[C@H]([C@H](O)C(F)(F)F)C2)cc1)C1CCCCC1 764766187 GKILAWNXGOVSPJ-PXNSSMCTSA-N 427.511 4.300 10 10 IICE CCN1CCN(c2ccc(CN[C@@H](C)c3ccc(-n4cncn4)cc3Cl)cc2F)CC1 765851418 GAGBATSTTXLBHP-KRWDZBQOSA-N 442.970 4.053 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3csc(-c4ncccn4)n3)cc2Cl)C1 800048414 ATEWTKRTRQMBRX-AWEZNQCLSA-N 427.961 4.420 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)CC2)cc1 915321293 DBKXGRVJFZMWNI-UHFFFAOYSA-N 444.507 4.375 10 10 IICE COCCCOc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1C 1125160538 KVTKFGWNERWNLI-UHFFFAOYSA-N 429.472 4.438 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@@H](C(=O)OC(C)(C)C)C(C)(C)C)cc2F)C[C@@H](C)O1 1125256297 HILCGJZRCDIEDY-YRNRMSPPSA-N 436.568 4.060 10 10 IICE COc1ccc2c(CC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)coc2c1C 1125258146 FEYHNTOGQKBEPA-IYBDPMFKSA-N 440.515 4.361 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2cccc(NC(=O)OC(C)(C)C)c2)N(C)C)cc1 1134681742 FMIAKIKJVDVWCF-QFIPXVFZSA-N 440.588 4.061 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 1136025214 AMYWBJFLACNRBJ-HXUWFJFHSA-N 429.973 4.402 10 10 IICE COC(=O)c1cc(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)n(-c2ccccc2)n1 1142528423 XDPWSAYTALBMLB-UHFFFAOYSA-N 446.551 4.358 10 10 IICE CCCCc1nc(C)c(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1 1264688856 BLXFTKRFLZHCFU-HOTGVXAUSA-N 433.593 4.406 10 10 IICE Cc1cc(-c2nnc(N3CCOC[C@H]3C)n2CCOC(C)(C)C)c(C)n1-c1ccccc1 1289360076 CBNITRVYBIXHCU-LJQANCHMSA-N 437.588 4.393 10 10 IICE CC[C@@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)[C@H]1CCSC1 1291361141 HPFMFZNTWNLQOB-GBXCKJPGSA-N 439.629 4.455 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@](C)(OC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291532055 LIOHNQQZZKPESL-NTKDMRAZSA-N 443.661 4.398 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CC3(N4CCOCC4)CCCC3)cc2Cl)C1 1297010870 UOWQHVPMSBDZFN-LJQANCHMSA-N 434.024 4.228 10 10 IICE CC(C)(C)c1nnc(N2CCC(Cn3cccn3)CC2)n1CCCSc1nccs1 1302053239 FLHFIZSPXRERRS-UHFFFAOYSA-N 445.662 4.328 10 10 IICE CCOc1ccc(N2CCN(CC[S@@](=O)c3cc(Cl)ccc3Cl)CC2)cc1 1307599417 KNEMSVACVVUBLZ-HHHXNRCGSA-N 427.397 4.322 10 10 IICE C[C@@H](NC(=O)N1CCC[C@H](NC(=O)c2ccc(Cl)cc2)C1)c1ccc(N(C)C)cc1 1312534714 HAANBHVCBXTASC-UZLBHIALSA-N 428.964 4.071 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(CCO)CCc3ccccc3)cc2Cl)C1 1312586161 OFSWIXKNGTXKIB-IBGZPJMESA-N 429.992 4.323 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)[C@@H]3CCCN(C(=O)N4CCCC4)C3)cc2Cl)C1 1436047046 JBDWSARENLJMJQ-UYAOXDASSA-N 447.023 4.120 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(-c4ccc(C)cc4)c3C(C)C)CC2)cc1F 1445840824 FCTDPCUXBBJCDL-UHFFFAOYSA-N 436.531 4.414 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCc1ccnc(OC2CCOCC2)c1 1458175028 JDJPEUGLMYGNJQ-UHFFFAOYSA-N 433.464 4.391 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccc(Cl)c2)cc1 1463775130 GKOGMBUFTPWEGY-GMAHTHKFSA-N 427.976 4.364 10 10 IICE CCOc1ccc([C@@]2(C(=O)NCc3ccc(N4CCOCC4)cc3)CC2(Cl)Cl)cc1 1464453430 QWGLBEBEGBBBCO-JOCHJYFZSA-N 449.378 4.054 10 10 IICE CC[C@H](C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C)n1nnc(-c2ccc(Cl)cc2)n1 1469106305 KAMUJFTWHMJFSI-HRAATJIYSA-N 440.979 4.066 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)c(C)n1-c1ccccc1Br 1469557703 KKMCXXAHSVQRAG-ZACQAIPSSA-N 448.405 4.084 10 10 IICE CC(C)(C)OC(=O)[C@](C)(CNC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccc1 1469790419 TUXHGQVSFYMOGC-HSZRJFAPSA-N 427.522 4.342 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\C(=O)N(CC(C)C)c3ccc(C)cc3C)CC2)cc1 1469827789 OSOXLOQWANPGHZ-SEYXRHQNSA-N 449.595 4.206 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4cccc(F)n4)CC3)cc2Cl)C1 1478527584 FQIZHSZOISNTKG-KRWDZBQOSA-N 445.970 4.142 10 10 IICE CC1CCN(c2ccc(Cn3c(-c4cnccn4)nnc3N(C)CC(F)(F)F)cc2)CC1 1493873915 QHESMICZEKCCFK-UHFFFAOYSA-N 445.493 4.018 10 10 IICE CCC[C@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1500232220 JHPTVXDKSKBUKR-KNQAVFIVSA-N 443.661 4.398 10 10 IICE CC(C)CCN(C)c1nnc(-c2noc3c2COCC3)n1CCCSc1nccs1 1509284649 QWBIGTGBTBBZDD-UHFFFAOYSA-N 448.618 4.127 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N1CCS[C@H](C(C)C)C1 1510683995 VXDLLWSWPDQZHT-RTWAWAEBSA-N 429.634 4.130 10 10 IICE CCN(CC)[C@@H](C(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1)c1cccc(C(F)(F)F)c1 1531729987 OIFXTTYAHNIHNP-DENIHFKCSA-N 449.517 4.492 10 10 IICE CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1c(O)ccc2c1CCCC2)Cc1ccccc1 1545639483 QGMNKOKCHBRTOM-HXUWFJFHSA-N 438.568 4.413 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2ccc[nH]2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1546884248 FQKWGVKOANZHBL-LJQANCHMSA-N 436.604 4.155 10 10 IICE Cc1cc(I)cc(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1556508256 SMKLVRJYPGIXFT-UHFFFAOYSA-N 425.247 4.478 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)C[C@H](C)NC(=O)OC(C)(C)C)ccc21 1557181539 KFGVLSIQBPEENT-HOTGVXAUSA-N 431.577 4.326 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)C2CC2)cc1 1564590599 WSRMHYQFDPNUFO-MOPGFXCFSA-N 430.593 4.263 10 10 IICE CC(C)N(Cc1cccc(Cl)c1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1565363373 OACUWQWMVBTYSF-UHFFFAOYSA-N 442.991 4.162 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C12CCCC2 1583728121 MPCCYZUZEZRNNM-SFHVURJKSA-N 432.542 4.365 10 10 IICE Cc1cc(Br)ccc1C(=O)N1CCC[C@H](C(=O)N[C@@H](C)c2ccccc2O)C1 1587451546 ZGARSACFWWRVGZ-HOTGVXAUSA-N 445.357 4.193 10 10 IICE Cc1cc(CNC(=O)CN(C[C@H]2CCCO2)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1587886198 KNMSXXBBLFYXCH-JOCHJYFZSA-N 441.572 4.126 10 10 IICE COC(=O)c1ccc(OC)c2c1CCN(C(=O)c1cc(C)n(-c3ccc(OC)cc3)c1C)C2 1594150818 DLOVDNXTPQGSOE-UHFFFAOYSA-N 448.519 4.096 10 10 IICE CCc1nnc(N2CCC(Cn3nc(C)cc3C)CC2)n1CCCSc1nccs1 1613973016 YLSSKEBEFCFUAI-UHFFFAOYSA-N 445.662 4.209 10 10 IICE CC(C)(O)c1cccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1 1616765198 NXLURJRTOKKKPS-PDGQHHTCSA-N 444.553 4.283 10 10 IICE CCN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1cc2cc(O)c(O)cc2s1 1629369107 KYGCTYDLACGGOA-UHFFFAOYSA-N 438.427 4.432 10 10 IICE Cc1ccn2cc(CNC(=O)c3cc(C)n(-c4ccc(Br)cn4)c3C)nc2c1 1630882542 CHUVYARVWJNJCH-UHFFFAOYSA-N 438.329 4.138 10 10 IICE Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(C(=O)N[C@H](C)c2ccccc2O)cc1 1632247232 WCLLDDDCEACYQQ-OAHLLOKOSA-N 428.485 4.132 10 10 IICE Cc1ccc(C(=O)NCC(=O)OCc2ccc(Cl)cc2)cc1-n1c(C)cc(C=O)c1C 1637165226 BRRNNVRNFCUSCE-UHFFFAOYSA-N 438.911 4.342 10 10 IICE CCn1c(SCC(=O)c2cc(C)n(-c3ccc(F)cn3)c2C)nnc1-c1cccnc1 1643753715 WPTRBDVBUGDQJE-UHFFFAOYSA-N 436.516 4.277 10 10 IICE CC[C@@H](NCc1ccc(N2CCC(OC)CC2)cc1)c1ccccc1OCC(=O)N(C)C 1645094203 WJRGYFGSQJLFSE-XMMPIXPASA-N 439.600 4.010 10 10 IICE C[C@H](C(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)N1CCOc2cc(N(C)C)ccc21 1645147760 LMBQPBAKXQDGJG-CYBMUJFWSA-N 444.507 4.380 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1Cl 1645412281 BNTSVRQBJJQBKZ-CALCHBBNSA-N 433.955 4.235 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@](C)(OC)C2)sc(C)c1-c1ccccc1 1653497116 GBHIHDLPKSXCQO-HSZRJFAPSA-N 430.570 4.340 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(O)CCO[C@H]1C)C(C)C 1695536053 PNEOGIVYRNLPKB-CPJSRVTESA-N 437.588 4.127 10 10 IICE CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@]1(O)CCSC1 1695627896 AXRNJDQIWTZADH-HSZRJFAPSA-N 425.602 4.067 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@]3(O)CCCC3(C)C)CC2)cc1 1697470133 CMCUORBLOATXRN-RUZDIDTESA-N 441.620 4.068 10 10 IICE CCOCc1nnc(N2CCC[C@@H](OC(C)(C)C)C2)n1Cc1ccc(N(C)C)cc1C 1710713142 HEXFRKRRNDLBQR-OAQYLSRUSA-N 429.609 4.021 10 10 IICE Cc1cc(C)n(Cc2nnc(N(CC(C)C)C(C)C)n2Cc2ccc(N(C)C)cc2C)n1 1742691166 UJBLMDDVAMDYSV-UHFFFAOYSA-N 437.636 4.433 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3CCCOC(C)C)CC2)cc1 1748849820 ZIRSJICEIUWOER-UHFFFAOYSA-N 429.609 4.017 10 10 IICE CC(C)Cn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1[C@]1(OC(C)C)CCOC1 1761114505 ZNIACQSNZPTLSY-VWLOTQADSA-N 441.620 4.211 10 10 IICE CCN(CC(C)C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCSCC2)cc1 1766533741 UIAXCNNGBIJGGE-UHFFFAOYSA-N 436.629 4.424 10 10 IICE CC[S@@](=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1 1768308411 IIWGQOJKQCCEHJ-WJOKGBTCSA-N 437.613 4.278 10 10 IICE CCC(=O)NCc1ccc(OC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1858890568 AUCKANKBVZCBCP-UHFFFAOYSA-N 428.444 4.099 10 10 IICE COC(=O)c1c(NC(=O)C(C)(C)C(=O)O)sc(C)c1-c1ccc(Br)cc1 1865995607 OYZUXLLPKNFGAK-UHFFFAOYSA-N 440.315 4.322 10 10 IICE COc1cc([C@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)cc(O)c1O 1951417018 BZQLIRSWVYQFCX-FQEVSTJZSA-N 449.459 4.161 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)CC(=O)N1CCC[C@@H](CN=[N+]=[N-])C1 2010406501 VJMOMDRUCRPOLA-OALUTQOASA-N 431.537 4.036 10 10 IICE Cc1ccc([C@@H](n2nc(C3CC3)c(CN)c2I)C2(C)CC2)c(O)c1 2078998410 GDWBANYHVLRFGI-QGZVFWFLSA-N 437.325 4.227 10 10 IICE CCOc1ccc(-n2cccc2C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 2297346702 UTRTXVORTQLLOX-UHFFFAOYSA-N 435.867 4.196 10 10 IICE COc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1ccc(C)c(C)c1 2297347414 HIZPIQIRGPMIMZ-UHFFFAOYSA-N 447.491 4.220 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccccc3)C2=O)ccc1O[C@H](C)C(=O)O 2314933896 DZABSQPCLQLPSU-CYBMUJFWSA-N 429.519 4.343 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3ccc(N(C)C)cc3)SC2=S)N(C)C)cc1 2323879879 NFVZGIWLHBONSY-FQEVSTJZSA-N 441.622 4.265 10 10 IICE O=C(Cn1cc(/C=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc21)NC[C@@H]1CCCO1 3648609 PYGUOUXPSNUWBQ-NAGKPISUSA-N 435.911 4.083 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@@H](C(C)C)n3cnc4cc(F)c(F)cc43)CC2)cc1 109506884 HGAUYWORFVPCDO-HSZRJFAPSA-N 442.510 4.259 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1cccc(NC(=O)[C@H]2C[C@H]2C)c1 743808431 UGFSAUXQQNJUPR-ACJLOTCBSA-N 431.330 4.412 10 10 IICE Cc1noc(C)c1CO[C@@H]1CCN(CC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)C1 762630948 AKUUBFLQBJIFRT-OAQYLSRUSA-N 425.504 4.312 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1c[nH]c2cccc(Br)c12 763434733 SVXKSBBXTPBTAZ-UHFFFAOYSA-N 428.330 4.039 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccc2Br)n1C[C@@H]1CCOC1 812384391 MJTZLLDWJOTEAX-HNNXBMFYSA-N 443.345 4.086 10 10 IICE CC(C)CN1C[C@@H](C(=O)Nc2sc3c(c2C(=O)OC(C)(C)C)CC[C@H](C)C3)CC1=O 1128878687 BFBFNPMEVNADKD-GJZGRUSLSA-N 434.602 4.271 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](C)[C@H]3C(=O)OC(C)(C)C)ccc21 1129949584 ABZISCVDVRXXCC-AOMKIAJQSA-N 428.573 4.487 10 10 IICE Cc1cc(CCNC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c(C)n1-c1ccccc1 1131781774 NZSJOLHQJNIWFX-WOJBJXKFSA-N 432.568 4.075 10 10 IICE Cc1ccc(C(=O)Nc2ccccc2CN2C(=O)CCC2=O)cc1-n1c(C)cc(C=O)c1C 1136426291 SKLSLQCYHGTUNE-UHFFFAOYSA-N 443.503 4.116 10 10 IICE Cc1cccn2cc(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c3ccc(N(C)C)cc3)cc12 1147503534 AGKQFJORXNJUOC-OAQYLSRUSA-N 436.556 4.310 10 10 IICE C[C@@H]1CC2(CCN(C(=O)OC(C)(C)C)CC2)CN1C(=O)c1ccc(N=NC(N)=O)cc1 1162713136 RVWYCRQQPRGYGD-OAHLLOKOSA-N 429.521 4.101 10 10 IICE CN(Cc1nnnn1-c1ccc(OC(F)F)cc1)c1ccc(OCc2ccccc2)cc1 1193460232 LDBWIPMBIVSSJI-UHFFFAOYSA-N 437.450 4.479 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@H](CC(F)(F)F)C3)cc2Cl)C1 1227208267 MZDDEWANPQPMSR-GOEBONIOSA-N 433.902 4.439 10 10 IICE CC(C)C[C@@H](CNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)C(=O)OC(C)(C)C 1230278440 NJINQMMIVUFHKF-VQTJNVASSA-N 434.577 4.087 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1234173333 WTDMNRJGGRFAEB-IBGZPJMESA-N 438.547 4.179 10 10 IICE Cc1cc(CCNC(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)c(C)n1-c1ccccc1 1253807922 LLFLJAKXGMLQTI-HSZRJFAPSA-N 445.485 4.386 10 10 IICE C[C@H]1CCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1291163724 LGDVRCMMYLGOQH-PKOBYXMFSA-N 429.584 4.298 10 10 IICE CCOC(=O)CS[C@@H](CNC(=O)c1ccc(-n2c(C)ccc2C)cc1)C(F)(F)F 1302854057 NBEWLYYBMYDAKE-KRWDZBQOSA-N 428.476 4.051 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@H](C)CC[C@H]3C)n2CCCSc2nccs2)n1 1304751465 LSSIPDHPPHBVLP-NVXWUHKLSA-N 445.662 4.403 10 10 IICE C[C@@H]1CCCC[C@@H]1OCCn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1305005004 PNXQSZFJSFYCRB-XXBNENTESA-N 435.572 4.201 10 10 IICE CN(CC(=O)Nc1ccccc1C(=O)NC1CC1)c1ccc(OCc2ccccc2)cc1 1307689972 VRFYWADYWPQNRE-UHFFFAOYSA-N 429.520 4.233 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CCCCCC2)cc1 1313678887 MLNUOTBSKDJATI-UHFFFAOYSA-N 435.620 4.415 10 10 IICE CCOCCC1(Cn2c([C@H]3CCOC3)nnc2N(C)Cc2ccccc2O)CCCC1 1314447408 LZMZAMOHOGNRGI-FQEVSTJZSA-N 428.577 4.111 10 10 IICE COCC(C)(C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OC)C1 1315767949 SQHLBQQQGPVLQI-NRFANRHFSA-N 437.588 4.250 10 10 IICE CC(C)(C)OC(=O)[C@]1(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)CC=CCC1 1357324253 UCKQDNQHYYSYMV-AREMUKBSSA-N 431.488 4.469 10 10 IICE CC(C)(C)OC(=O)N1CCc2c(cccc2C(=O)N(C[C@@H]2CCCO2)c2ccncc2)C1 1360759280 NGKQYFBIDDTJHS-FQEVSTJZSA-N 437.540 4.201 10 10 IICE Cc1cc(C(=O)Nc2ccccc2C(=O)N(C)C)c(C)n1-c1ccc(Br)cn1 1441219111 LEGHHURBMYNSJJ-UHFFFAOYSA-N 441.329 4.206 10 10 IICE CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C1 1448003629 IJXRIDUZIODNOD-NQIIRXRSSA-N 439.556 4.202 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N1CCCOc2ccccc21 1458517376 HQVBPROLNGFZJY-RGEXLXHISA-N 442.537 4.233 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)CN3C(=O)N[C@](C)(c4ccc(C)o4)C3=O)c2C)c1 1458942400 MHHWCNQLCNOHIH-RUZDIDTESA-N 433.508 4.262 10 10 IICE COc1ccc(N(CC(=O)NCc2cc(Cl)ccc2OC)Cc2ccco2)cc1F 1459672142 OKAXUMGWYYNPCM-UHFFFAOYSA-N 432.879 4.412 10 10 IICE COc1cccc(OCCN2CCN(C(=O)c3cc(C)ccc3-n3c(C)ccc3C)CC2)c1 1466267180 SDYCLROJGBMVIJ-UHFFFAOYSA-N 447.579 4.248 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC3(c4ccc(Br)cc4)CC3)C2)cc1 1470592450 DIRUFYLOHNWDNI-INIZCTEOSA-N 444.373 4.273 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1 1478482540 LGJULASBIHWZHR-INIZCTEOSA-N 433.474 4.368 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCSC(C)C 1495110758 GODGZNYKZITVOY-IBGZPJMESA-N 431.650 4.406 10 10 IICE CO[C@@]1(C)CCCN(c2nnc(-c3cccnc3)n2CCCSc2nccs2)CC1 1504020916 FMMOOHLFWAWWHA-NRFANRHFSA-N 444.630 4.374 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3CC[C@H]3C[C@H](F)C3)CC2)cc1F 1504295498 ITEPSCQEALGKAL-IYARVYRRSA-N 447.574 4.479 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)cc2F)CC1 1521011176 XILDZFJNZXIXJX-UHFFFAOYSA-N 442.535 4.103 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCOC[C@H]3c3cc(F)cc(F)c3)ccc21 1528920632 KEAZXBAZUUIAFD-QHCPKHFHSA-N 428.479 4.396 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C\c3ccc4cc(OC)ccc4c3)CC2)c(OC)c1 1534596460 QUAVYEFNJIBRAU-WZUFQYTHSA-N 432.520 4.228 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)c1 1539834648 RWBKLQNKEFEORK-QHCPKHFHSA-N 430.483 4.299 10 10 IICE CC[C@H](NC(=O)Cc1cc(C)n(-c2ccccc2)c1C)[C@@H]1CN(Cc2ccccc2)CCO1 1543744723 PVLNGIOVPAAYSM-SVBPBHIXSA-N 445.607 4.432 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1 1556367092 SOHXMLYNKHWEDL-QGZVFWFLSA-N 445.357 4.337 10 10 IICE O=C(NCCN1CCC2(CCCCC2)CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1564642683 UMHALLFVONAJNJ-QFIPXVFZSA-N 429.605 4.129 10 10 IICE C[C@H](c1ccco1)N(C)c1nnc(-c2cnccn2)n1CCCSc1nccs1 1611254479 COZDTDAOKYDOIR-CQSZACIVSA-N 427.559 4.164 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N2CCNC(=O)c3cc(Br)ccc32)cc1 1611266376 YAZUPTUTGJJWCV-UHFFFAOYSA-N 438.325 4.247 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(C(=O)OC)CC2)n1Cc1ccc(N(CC)CC)cc1 1613217257 SBPJFOMTDQEJGH-GOSISDBHSA-N 427.593 4.076 10 10 IICE CN(c1nnc(-c2ccccc2Cl)n1CCCSc1nccs1)[C@H]1CCOC1 1617733751 PFRLZTOWMVPJON-AWEZNQCLSA-N 436.006 4.463 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@@H]2CCC(C)(C)CO2)NC(=O)OC(C)(C)C)cc1 1618254197 YJKXTTMMHXYVEI-PMACEKPBSA-N 433.593 4.030 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1 1628435419 BILCUDRTRHHVLU-UHFFFAOYSA-N 429.564 4.230 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 1635228725 JXTNTLYXYZAFBJ-DEOSSOPVSA-N 433.527 4.197 10 10 IICE O=C(C[C@H](c1ccccc1)c1ncc[nH]1)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941625 UUADHMNNDBEVMR-NHCUHLMSSA-N 438.959 4.072 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C3)c2C)cc1 1638286776 WQSIGLMWBPLQSY-OAQYLSRUSA-N 441.572 4.478 10 10 IICE CCOC(=O)c1cnc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)n1C 1641530284 WPYPGVLNOTXMHQ-UHFFFAOYSA-N 445.317 4.019 10 10 IICE CCn1c(C)cc2[nH]nc(NC(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)c2c1=O 1641672830 IHSNZGAEAMIPDS-UHFFFAOYSA-N 437.931 4.295 10 10 IICE CN(CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)Cc1ccc(Cl)c(F)c1 1642594382 HRAMIBKRUOOMBU-UHFFFAOYSA-N 436.870 4.325 10 10 IICE CCCCN(Cc1ccccc1O)C[C@@]1(O)CCCN(C(=O)OCc2ccccc2)C1 1645427938 ARPOALLCGPZQKQ-VWLOTQADSA-N 426.557 4.158 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NC[C@@H]3CN(Cc4ccc(C)cc4)CCO3)c2C)cc1 1648932942 XIQHCNDVSHMZRI-RUZDIDTESA-N 447.579 4.042 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@H]3CCCCc4cc(OC)c(OC)cc43)C2)cc1 1674325770 DDBNUFBQAVJHSR-GCJKJVERSA-N 439.556 4.058 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@H](Cn1ccccc1=O)c1ccccc1 1681822630 MMBCVNQMYBNNLB-XMMPIXPASA-N 430.552 4.031 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC([C@H]2CCCO2)CC1 1693006457 ZJZSFOJDSQMWBI-HSZRJFAPSA-N 425.621 4.295 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@@H]1C 1698335717 YZKYPZJKWKAGBE-ZWKOTPCHSA-N 425.602 4.329 10 10 IICE CCC[C@H](C)CN(C)c1nnc([C@H]2CCOC2)n1Cc1ccc(N2CCSCC2)cc1 1709475076 BOVHUOVRHZMIEB-FPOVZHCZSA-N 443.661 4.256 10 10 IICE CCn1cc(C2CCN(c3nnc(CC(C)C)n3Cc3ccc(N(C)C)cc3C)CC2)cn1 1746342773 YQEMLSUMHNXXAX-UHFFFAOYSA-N 449.647 4.500 10 10 IICE CCCCn1c(Cc2ccsc2)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1764126173 REFIPVFBRRCQIE-UHFFFAOYSA-N 425.602 4.456 10 10 IICE CC[C@H]1C[C@H](C)CN1c1nnc(CC(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1765063938 MIZWCHRYOFRMCQ-REWPJTCUSA-N 439.648 4.358 10 10 IICE COc1ccccc1-c1cc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)nn1C 1871333127 HBFWZJKSRXPKJA-UHFFFAOYSA-N 437.455 4.123 10 10 IICE CCCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCCOC(C)C)C1=O 1873164407 AADODVLBVHWYCE-UHFFFAOYSA-N 437.584 4.379 10 10 IICE O=C(N[C@]1(c2ccc(F)cc2O)C[C@@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952760646 HBBBMIQHAYLFOM-BWKNWUBXSA-N 433.435 4.370 10 10 IICE O=C(N[C@]1(c2cc(F)ccc2O)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952765807 FXGNSEQKMAVULM-OFVILXPXSA-N 433.435 4.370 10 10 IICE Brc1cc(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)ccc1CNC1CC1 2188882475 ZDNUZTDSAKJPRV-XXBNENTESA-N 426.402 4.412 10 10 IICE Cc1cc(Br)cc(C=C2C(=O)NN(c3cc(Cl)cc(Cl)c3)C2=O)c1O 2313656825 SLQBECIOEYGIRA-UHFFFAOYSA-N 442.096 4.231 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N(Cc4ccc(C(=O)O)cc4)C3=O)n12 2323844182 GYYAGLOMWMSCAA-UHFFFAOYSA-N 449.966 4.457 10 10 IICE COc1ccc(C2=NN(Cc3cccc(F)c3)C(=O)C2=Cc2ccc3c(c2)OCCO3)cc1 2332127298 KFYYLBLFQSTINM-UHFFFAOYSA-N 444.462 4.436 10 10 IICE COc1ccc(C2=NN(Cc3ccccc3F)C(=O)C2=Cc2ccc(C(=O)O)cc2)cc1 2332139381 ATKMTOHIOXAYMJ-UHFFFAOYSA-N 430.435 4.363 10 10 IICE Cc1ccc(CNC(=O)[C@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380744300 CIAMSLWEYGGCJJ-LSDHHAIUSA-N 441.366 4.163 10 10 IICE Cc1ccc(N2CCN(C3=NC(=O)/C(=C/c4cccc([N+](=O)[O-])c4)S3)CC2)cc1Cl 1183210 JXBPFGJFZFEPHM-UNOMPAQXSA-N 442.928 4.349 10 10 IICE CC[C@@H]1SC(=S)N(CC(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)C1=O 11635644 YGRFDAVHNLPWER-AWEZNQCLSA-N 440.015 4.273 10 10 IICE O=C(O)c1ccc(COc2ccc(/C=C3\C(=O)N(c4ccccc4)C(=O)N=C3O)cc2)cc1 33311473 VUPVHPPYNMRRFH-STZFKDTASA-N 442.427 4.471 10 10 IICE COc1ccc(N2CCN(c3ccc(-c4nc(-c5cccc(C)c5)no4)cn3)CC2)cc1 65097890 IERIHAFEJJDZEG-UHFFFAOYSA-N 427.508 4.442 10 10 IICE CCOC(=O)Cc1cnc(NC(=O)c2sc(Nc3ccc(C)cc3)c(C#N)c2N)s1 139730422 XKTXDXXMEXHART-UHFFFAOYSA-N 441.538 4.068 10 10 IICE CCCN1C(=O)/C(=C/c2c(Oc3ccccc3F)nc3ccccn3c2=O)SC1=S 213154970 LSJVMZYRHHWCEU-VBKFSLOCSA-N 441.509 4.237 10 10 IICE CCOC(=O)[C@H](C(C)C)N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S 606672033 KWMCGNCXTRKJAY-XXYUJHKVSA-N 428.373 4.238 10 10 IICE O=C(NCc1cc(F)cc(NCc2cc(Br)cc(F)c2O)c1)C(F)(F)F 715746580 RMMAIZQWZPUISP-UHFFFAOYSA-N 439.178 4.224 10 10 IICE C[C@@H](NCc1cc(Br)cc(F)c1O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 715828240 OAAFXEQZTWGUSA-CHWSQXEVSA-N 431.346 4.419 10 10 IICE CC1CCN(c2ccc(CNC(=O)N3CCC(C(=O)N[C@@H](C)C(C)C)CC3)cc2)CC1 731121372 SXPYPAMDJAXSDM-FQEVSTJZSA-N 428.621 4.005 10 10 IICE CC[S@](=O)CCNC(=O)N[C@@H]1CCCc2c1cc(C)n2-c1cccc(C(F)(F)F)c1 735108818 DLOQCVCIDJXGIS-JJCDCTGGSA-N 441.519 4.250 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3ccccc3CCc3ccccc3)c2)CC1 739765309 GXBZSLKXZDPOOO-UHFFFAOYSA-N 427.548 4.426 10 10 IICE CC1CCN(c2cccc(NS(=O)(=O)c3ccc(NC(=O)C(F)(F)F)cc3)c2)CC1 740609125 DQSDIFLJCIEMBK-UHFFFAOYSA-N 441.475 4.225 10 10 IICE Cc1ccc(/C=C\C(=O)OCC(=O)N(C)Cc2ccc(N(C)C)cc2)c(Br)c1 749626019 GLVJSEYWMBMKSV-XFXZXTDPSA-N 445.357 4.039 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)c1ncc(Br)cc1Br 759964232 YLRLPNVBWIRPKE-UHFFFAOYSA-N 440.135 4.121 10 10 IICE COc1cc2c(cc1F)CN(C(=O)NC1CCN(c3ccc(OC(F)F)cc3)CC1)CC2 777736032 BAQCMVFWZZQCCB-UHFFFAOYSA-N 449.473 4.172 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 801549249 HLPFVTNYAJJENU-NRFANRHFSA-N 426.532 4.141 10 10 IICE CC[C@@H](NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)c1ccc(C(F)(F)F)cc1O 810224341 VJLAQYYAPBZFFM-QKNQBKEWSA-N 447.501 4.051 10 10 IICE CN(C)c1ccc(CNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(Cl)c2)cc1F 1125535247 UHNMOHBFXDCTEU-VLIAUNLRSA-N 438.330 4.034 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1nn(-c2ccc(Cl)cc2F)c2c1CCC2 1126004827 MJNVIENLDSMBEL-UHFFFAOYSA-N 426.923 4.458 10 10 IICE CCSc1cc(Cl)ccc1C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1 1136454102 KPEZRBQTSNIINH-UHFFFAOYSA-N 434.005 4.013 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@H](CCC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1137658528 LHGPMOYOHSWRAS-NRFANRHFSA-N 433.593 4.063 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](CCC(C)C)NC(=O)OC(C)(C)C)CC2)cc1 1137658529 LHGPMOYOHSWRAS-OAQYLSRUSA-N 433.593 4.063 10 10 IICE COc1ccc(OC(F)(F)F)c(C(=O)NCc2ccc(N3CCSCC3)cc2)c1 1141803762 NBZCSXYPWMUIFC-UHFFFAOYSA-N 426.460 4.077 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2nc(C3CC3)cs2)NC(=O)OC(C)(C)C)cc1 1147508972 YEJSDDFEVIRYIV-QGZVFWFLSA-N 430.574 4.082 10 10 IICE COC(=O)c1c[nH]c2cc(NC(=O)Cc3ccc(-n4c(C)cc(C=O)c4C)cc3)ccc12 1147886210 ZPBPHCDSORTGMK-UHFFFAOYSA-N 429.476 4.356 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCC1=CCN(C(=O)OC(C)(C)C)CC1 1155100782 ULCDMWGGFKAMGI-UHFFFAOYSA-N 437.540 4.204 10 10 IICE Cc1cc(C(=O)Nc2ccc3c(=O)n(C)c(=O)n(C)c3c2)c(C)n1-c1ccc(C(C)C)cc1 1178406495 PTQPTWLLEFJFTO-UHFFFAOYSA-N 444.535 4.020 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)N(O)Cc1cccc2ccccc12 1229782270 USGGLJUQKSKJLJ-UHFFFAOYSA-N 427.451 4.056 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2cccc(C(F)(F)F)c2)CC1 1253512840 ZNCZWGBDLUZMAC-UHFFFAOYSA-N 433.474 4.155 10 10 IICE COC(=O)[C@@H](NC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)c1cc(C)cc(C)c1 1296804208 BOTLUFQFCHSGAK-VWLOTQADSA-N 432.520 4.096 10 10 IICE C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NCc2c(O)ccc3ccccc23)c1 1304089954 SIYNBSGRAWBMJX-QGZVFWFLSA-N 438.549 4.039 10 10 IICE CC[C@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@](C)(O)CC)CCO1 1306396656 JFXSOYKLOJCLPL-SQJMNOBHSA-N 437.588 4.129 10 10 IICE CN(C)c1ccc(Cn2c([C@@H]3CCO[C@H]3C(C)(C)C)nnc2N(C)CC2CC2)cc1F 1314658476 AGOIHHHZQPIIHM-WIYYLYMNSA-N 429.584 4.296 10 10 IICE Cc1cc(-c2nnc(N(C)[C@H](C)CC(N)=O)n2C[C@@H]2CCC[C@H]2C)c(C)n1-c1ccccc1 1361044803 FRPPBWMZWMBRKF-OPYAIIAOSA-N 448.615 4.489 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)c3cccc(Nc4ccccc4)c3)CC2)cc1 1440676267 USJFDQYPHHKNMI-UHFFFAOYSA-N 444.579 4.381 10 10 IICE CCNC(=O)N1CCc2ccc(NC(=O)c3ccccc3-n3c(C)cc(C=O)c3C)cc21 1444579627 OMYDTWQROFTEFZ-UHFFFAOYSA-N 430.508 4.251 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(CNC(=O)c2cccs2)cc1 1460987580 ZZPXQROTPYWARB-GOSISDBHSA-N 435.593 4.414 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H](n2cncn2)C(F)(F)F)cc1 1462159935 UTGNFYDAYRHPOP-GOSISDBHSA-N 431.422 4.293 10 10 IICE Cc1cccc(C)c1OC[C@H](O)CNC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1465907078 JJAMTLRVHPRWGR-HSZRJFAPSA-N 440.971 4.463 10 10 IICE CCOC(=O)[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1Nc1cccc(C)c1C 1466674376 SQMCFPFRUMPUAY-QFIPXVFZSA-N 448.519 4.362 10 10 IICE CCN(C(=O)OC(C)(C)C)[C@H](C)CNC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 1478573856 ZZZCOSUDLAOVDH-LJQANCHMSA-N 432.609 4.464 10 10 IICE Cc1onc(-c2cccs2)c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1516814567 KEOHJPWCMGOOLG-ZIAGYGMSSA-N 429.517 4.394 10 10 IICE CC(C)(C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(C(F)(F)F)c1 1528261070 DLXSKPWMERUWSB-UHFFFAOYSA-N 442.428 4.414 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCCNC(=O)c3ccccc3)cc2Cl)C1 1530423136 AGLZXRSAJFCHMH-GOSISDBHSA-N 427.976 4.403 10 10 IICE COc1ccc(/C=C(\C(=O)NCc2ccc(N3CCN(C)CC3)cc2)c2cccs2)cc1 1536524792 WSTKQKLTJSZBBY-MOHJPFBDSA-N 447.604 4.366 10 10 IICE CCOCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCn1ccnc1C 1548249195 BPOLVAPLCSPBRI-UHFFFAOYSA-N 447.587 4.030 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)(C)C)n3C[C@@H]3CC[C@@H](F)C3)CC2)cc1F 1554960123 AQPAZSIRVWARGK-QZTJIDSGSA-N 447.574 4.479 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCCN2C(=O)C(F)(F)F)c(C)n1-c1cccc(Cl)c1 1557171242 FHMIOYPYMWOOAN-KRWDZBQOSA-N 441.881 4.421 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c(C)n1-c1ccc(Br)cn1 1557683938 OGUVGADHXXUQKP-SFHVURJKSA-N 445.405 4.103 10 10 IICE Cc1cc(CNC(=O)N[C@H]2CCN(C(=O)Nc3ccccc3)C2)c(C)n1-c1ccccc1 1564636490 JDOAVVCANUOLNA-QFIPXVFZSA-N 431.540 4.200 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCC3(C(=O)OC(C)(C)C)CCOCC3)c2C)c1 1570657829 DFOTVHNFOFHRRI-UHFFFAOYSA-N 426.557 4.271 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC(C)(C)CCNC(=O)OC(C)(C)C)CCCC1 1585315344 JCTOBAHWQLVVAP-UHFFFAOYSA-N 443.588 4.338 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)COC(c3ccccc3)c3ccccc3)C2)cc1 1585665900 WQQXTKUETIXCFY-OAQYLSRUSA-N 430.548 4.444 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3CCCC[C@@]3(C)NC(=O)OC(C)(C)C)CC2)cc1 1596733447 RTEQXALHTDRLDO-SQJMNOBHSA-N 445.604 4.208 10 10 IICE O=C1/C(=C/c2cccs2)SC(=S)N1CCCC(=O)N(CC(F)F)C1CCC1 1597971552 LATHQGUECSPLIQ-UVTDQMKNSA-N 430.567 4.376 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)[C@H](C)C3)n2CCC(=O)NC(C)C)c(C)n1-c1ccccc1 1611935372 PGZHGOBCGUWOLN-RTBURBONSA-N 448.615 4.360 10 10 IICE Cc1cc(C(=O)CN2C(=O)c3cc(Cl)c(Cl)cc3C2=O)c(C)n1-c1ccc(F)cn1 1613317828 YMXHRMJEIHRDAF-UHFFFAOYSA-N 446.265 4.414 10 10 IICE CCN1C[C@H](C)N(c2nnc(CC(C)(C)C)n2CCCSc2nccs2)C[C@H]1C 1615768119 IXLJBLWJEHZTOJ-SJORKVTESA-N 436.695 4.425 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(Cc3ccccc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1616214702 HRLFIQMKKKPBHF-BGYRXZFFSA-N 441.591 4.356 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1ncccc1NCC1CCC1 1620754265 RNLRNDBHELENLJ-KRWDZBQOSA-N 430.499 4.294 10 10 IICE COC(=O)c1ccc(OC)c(F)c1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1627142430 WZIMQJRARPWHNB-UHFFFAOYSA-N 440.471 4.102 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2cccc(CN3CCO[C@@H](C)C3)c2)c1 1630930915 KUVQBCHCAQQJBL-FQEVSTJZSA-N 445.563 4.057 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2cc(C(=O)OC(C)(C)C)ccn2)C1 1640740978 FTWMMFMVKJLVME-UHFFFAOYSA-N 448.567 4.397 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](CC)OC[C@H]2C)sc(C)c1-c1ccccc1 1643670862 ZAKKBUJLCCVFSB-QAPCUYQASA-N 430.570 4.338 10 10 IICE COc1cc(N(C)CC(=O)N2CCC(CCc3ccc(C)cc3)CC2)cc(OC)c1OC 1657329756 YRJMFDZBUISHPX-UHFFFAOYSA-N 440.584 4.328 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N[C@@H](Cn3ccnc3)c3ccc(C)cc3C)C2)cc1 1680875441 ANDLEZBPVXJZNV-BWKNWUBXSA-N 447.583 4.076 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@H](C)c3cc(Cl)cc4c3OCC4)CC2)cc1F 1687705200 WZMGVKIXXFDSEU-CQSZACIVSA-N 433.911 4.015 10 10 IICE CC[C@H](C)[C@@H](Cn1c(C(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1693965788 NRPDZICTGBCCNY-SIKLNZKXSA-N 429.609 4.188 10 10 IICE CCCCCn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1695166849 OZQYGVNERBRXNP-UHFFFAOYSA-N 447.587 4.352 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc3c(c2)OCO3)n1CCCSc1nccs1 1706378500 HTMTVXURIVMLRX-UHFFFAOYSA-N 445.614 4.481 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@H]2c2nncn2C)n1Cc1ccc(N(CC)CC)cc1 1708504985 RISGNNNMPCAHEK-RXVVDRJESA-N 436.608 4.156 10 10 IICE CCOCc1nnc(N(CC)C2CCCC2)n1Cc1ccc(N2CCSCC2)cc1 1710655465 IWWSEMULNYDZBV-UHFFFAOYSA-N 429.634 4.185 10 10 IICE CC(C)c1nnc(N2CCC[C@@H](C[C@H]3CCOC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1723171231 CNTJPRCKAVXMOW-AZUAARDMSA-N 429.584 4.298 10 10 IICE CCN1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(F)(F)F)C[C@@H]1C 1767114730 RPOOFPZQKFODKM-KRWDZBQOSA-N 446.521 4.445 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCC4)nc(-c4ccccc4C)n3)CC2)cc1 1867957160 NYEKQIFRLOGRJV-UHFFFAOYSA-N 429.568 4.387 10 10 IICE COCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N([C@H](C)c2ccccc2)C1=O 1873165424 NTVCTCPFGVSMOY-HXUWFJFHSA-N 443.547 4.171 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc(Cl)cc4Cl)nn3C)CC2)cc1 1891861784 GXRZFJWVHNVXTQ-UHFFFAOYSA-N 445.350 4.365 10 10 IICE CCc1nn(Cc2ccc(Cl)cc2O)c(I)c1C(F)(F)F 2079683756 QDZXCELFDNSHLQ-UHFFFAOYSA-N 430.595 4.476 10 10 IICE CC[C@H](N=c1nc(CNC(=O)OC(C)(C)C)[nH]s1)c1cc(Br)ccc1O 2130961493 CNMOCMDNLGKQDT-LBPRGKRZSA-N 443.367 4.016 10 10 IICE COc1ccc(Br)c(CNCC[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)C2)c1O 2236051497 UHEPAXRVWRPFPB-UONOGXRCSA-N 443.382 4.336 10 10 IICE CC[C@@H](C)Oc1ccc(C=C2C(=O)NC(=S)N(c3ccccc3F)C2=O)cc1Cl 2294235497 YQCSSUPYTOHHFL-GFCCVEGCSA-N 432.904 4.488 10 10 IICE O=C1C[C@H](N2C(=O)C(=Cc3ccc(Cl)cc3)SC2=S)C(=O)N1c1ccc(F)cc1 2296774280 FZDZVXDSEUWJEK-HNNXBMFYSA-N 446.912 4.012 10 10 IICE O=C(CCN1C(=O)C(=Cc2ccc(Cl)cc2)SC1=S)Nc1ccccc1[N+](=O)[O-] 2296881521 MIEXUTLDBYZAGH-UHFFFAOYSA-N 447.925 4.478 10 10 IICE Nc1ccc(NC(=O)OCc2cc(I)ccc2Br)cc1 2367278422 FKHQUYTYEKMQBJ-UHFFFAOYSA-N 447.070 4.385 10 10 IICE CC[C@@]1(C(=O)NCc2ccc(C)c(Br)c2O)CCN(C(=O)OC(C)(C)C)C1 2380747461 UMRMJMNJCRQOJH-HXUWFJFHSA-N 441.366 4.117 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@](C)(NC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2380764079 ANJFPTVXEJLPTE-FQEVSTJZSA-N 443.382 4.361 10 10 IICE CC(=O)OCCNc1cc(N2C[C@H](C)C[C@@H](C)C2)c2noc3c2c1C(=O)c1ccccc1-3 9641366 AJBURZRJCQBHAX-HUUCEWRRSA-N 433.508 4.497 10 10 IICE CC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC)c(O)c1)N2 14457444 NMFAWQPPLQLABQ-SWDAYOAKSA-N 428.554 4.304 10 10 IICE CN1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@H](c2cccc(Cl)c2)N3)CC1 14460351 OESDAGULAZQRDM-QTEQDKRBSA-N 444.000 4.103 10 10 IICE O=C(NC[C@@H]1CCCO1)c1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1O)[C@H]1CC=C[C@H]21 14475974 WAVNCFHPGJQZAM-FIEAQMJYSA-N 435.480 4.036 10 10 IICE CCOc1ccc(NC(=O)[C@H](C)N2C(=O)/C(=C/c3ccccc3F)SC2=S)cc1 15047501 YZLRGYISSHDSDR-CYUIRQCWSA-N 430.526 4.453 10 10 IICE Cc1cc(Br)cc(C)c1CNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 726245175 HGVBMIBAWPNNLK-QGZVFWFLSA-N 446.389 4.463 10 10 IICE Cc1nc2ccc(CNCc3ccc(N4CCN(c5ncccn5)CC4)c(F)c3)cc2s1 755196531 WIHFDLJIYGCZCK-UHFFFAOYSA-N 448.571 4.150 10 10 IICE CN1CCCc2cc(CNC(=O)Nc3ccc4c(c3)CCC(=O)N4CC(F)(F)F)ccc21 782081557 JXFYNOCFUNTQJR-UHFFFAOYSA-N 446.473 4.232 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3sc(-c4ccccc4)nc3C)cc2F)CC1 1125907147 IBLCAGOZYSZQMW-UHFFFAOYSA-N 438.572 4.330 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cccc([N+](=O)[O-])c3N3CCOCC3)c2C)c1 1132044516 TULNZOSTARBGOY-UHFFFAOYSA-N 448.523 4.077 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](CO)Cc1ccc(Br)cc1 1138197839 IPSOOLQYSAASQP-QGZVFWFLSA-N 447.398 4.499 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1138265907 WVRAOBGPISWCAK-HXUWFJFHSA-N 425.529 4.036 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]2C)c1 1152644576 SRKNPRZOKWWIDL-MSOLQXFVSA-N 439.556 4.377 10 10 IICE C[C@H](c1cc2ccccc2o1)N(C)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1251105894 XNHILAHULIGVLR-QGZVFWFLSA-N 434.540 4.037 10 10 IICE O=C(CCCOc1ccc(Cl)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266258976 MNPYGNMFQSZWNV-UHFFFAOYSA-N 442.003 4.347 10 10 IICE CC(C)Cc1nnc(N2CCCC3(CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1287450680 MRIFWSLWGLWUMM-UHFFFAOYSA-N 429.584 4.127 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2C[C@@]2(C)c2cccc(Br)c2)N(C)C)cc1 1289602914 YBJYAPYNACKKHO-GIWBLDEGSA-N 444.417 4.212 10 10 IICE CCCOc1ccc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1OCCC 1301350532 OOWYXBCPWMAAFD-UHFFFAOYSA-N 426.557 4.155 10 10 IICE CC(=O)c1cc(F)cc(CN(CCc2ccc(Cl)cc2)C[C@H](O)C(F)(F)F)c1O 1307813632 NSONLPWMABRSAK-SFHVURJKSA-N 433.829 4.355 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccc(Br)cc2)n1C[C@@H]1CCCO1 1324675983 DUNNYEUYBNSVQM-SFHVURJKSA-N 443.345 4.229 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1c2ccoc2CCN1C(=O)OC(C)(C)C 1442343467 PQQSFMNDMFTXME-OAQYLSRUSA-N 427.545 4.229 10 10 IICE COc1ccc(NC(=O)[C@@H](C)N2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)cc1 1459464300 JTBCAYXGZGTSGI-QGZVFWFLSA-N 439.556 4.500 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCc4c(Cl)cc(Cl)cc4[C@H]3C)nc12 1459644528 CDGYGCNQKCMLQK-LLVKDONJSA-N 435.311 4.038 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](C)O[C@@H](C3CC3)C2)sc(C)c1-c1ccccc1 1460038600 LOUFKRMHRNWFGO-HNAYVOBHSA-N 442.581 4.338 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@@H]1CCCC1(F)F 1460197409 BLYWYNBXRFPTEP-LQELWAHVSA-N 430.567 4.281 10 10 IICE Cc1nc(C2CCCCC2)sc1C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1462805297 JVYFXHHMUWZAFJ-UHFFFAOYSA-N 440.613 4.131 10 10 IICE COc1ccc2nc(C)c(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)cc2c1 1465951105 JCLBGEGWHPASEQ-LJQANCHMSA-N 439.943 4.305 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@H](C)OCCc1ccccc1 1467632188 SEZKSNVIERNBCS-IBGZPJMESA-N 426.557 4.023 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)NCc3ccncc3OC[C@@H]3CCOC3)c2C)c1 1470406655 PTTSSETXXLNZPK-OAQYLSRUSA-N 448.567 4.212 10 10 IICE CCCN(Cc1nc(O)c2sccc2n1)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 1470555618 HHBRJKCKLFVABO-MRXNPFEDSA-N 441.601 4.324 10 10 IICE O=C(Nc1cccc(C(=O)N2Cc3cccc(O)c3C2)c1)c1ccc(Br)o1 1471355887 ZCTOCKRTCSJLNT-UHFFFAOYSA-N 427.254 4.156 10 10 IICE COCC(=O)N1CCCc2ccc(NC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)cc21 1472134502 DWHKOJUDQOEHAW-UHFFFAOYSA-N 447.535 4.281 10 10 IICE COC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3c(F)cccc3F)C2)sc2c1CCCCC2 1515329062 NAFKBCYXCXSPED-LBPRGKRZSA-N 448.491 4.073 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)C3(c4ccccc4Cl)CCOCC3)C2)cc1 1529706324 GBKROAIXYYYQDR-SFHVURJKSA-N 428.960 4.040 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C2)cc1 1529706826 IQHFEAYCPQDIIB-NQIIRXRSSA-N 447.620 4.213 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cn(-c2ccc(Cl)cc2)nc1C 1546151874 KIZGSXDZWCYYHG-UHFFFAOYSA-N 448.306 4.009 10 10 IICE Cc1ccc(C(=O)NCCCC(=O)N2CCc3ccccc32)cc1-n1c(C)cc(C=O)c1C 1565630474 BURVZXGJWZTCLL-UHFFFAOYSA-N 443.547 4.314 10 10 IICE COc1ccc(-c2cc(C(=O)N(Cc3ccco3)Cc3ccccc3O)nn2C)cc1OC 1566302680 GEDHDYFCXDDVDO-UHFFFAOYSA-N 447.491 4.246 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCOc1ncc(Cl)cc1Cl 1566354127 TYTFVHVTLBQJAJ-UHFFFAOYSA-N 432.307 4.417 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(NC(=O)c4cccs4)cc3)C2)cc1 1584438486 DYWHESKMIJFSLJ-KRWDZBQOSA-N 435.549 4.265 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)C3(C(=O)OC(C)(C)C)CCCCCC3)C2)cc1 1584444611 UIMLHYBPHOBXPM-LJQANCHMSA-N 430.589 4.320 10 10 IICE C[C@@H](NC(=O)c1ccc2c(c1[N+](=O)[O-])C(=O)c1ccccc1C2=O)C1CCC(F)(F)CC1 1586220693 AHPDOEPFKQNRHK-GFCCVEGCSA-N 442.418 4.314 10 10 IICE CC(C)[C@@H]1OCC[C@@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1603137095 MMKDNTIZPJEMNV-NQIIRXRSSA-N 441.963 4.397 10 10 IICE C[C@@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1612945201 YVJIGIYFLCZRIQ-HKUYNNGSSA-N 429.584 4.298 10 10 IICE C[C@@H]1SCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)[C@@H]1C 1613037197 GVFRETIBTRZNLZ-GQIGUUNPSA-N 433.597 4.103 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(-n3nc(C)c(Cl)c3C)cc2)cc1 1616532835 GASKAQJSKKCWJT-UHFFFAOYSA-N 426.948 4.360 10 10 IICE COC1(C)CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)(C)C)C1 1619037900 QMGMPHKLRZAKEV-UHFFFAOYSA-N 437.588 4.393 10 10 IICE C[C@H](C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)N1CCC(Cc2ccccc2)CC1 1623641594 WEOUNNBJFZKCJT-BWKNWUBXSA-N 436.596 4.243 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2nc(-c3ccncc3)no2)C(C)C)c1 1626395351 MEOUWWAGJSJSHQ-QFIPXVFZSA-N 443.507 4.479 10 10 IICE CCN(C[C@@H]1CCN(C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)C1)CC(F)(F)F 1630724134 DIPFDSRMPCXWLO-SFHVURJKSA-N 435.490 4.253 10 10 IICE COC(=O)[C@@H](CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C1CCCCCC1 1646224865 XWUJMKOMSUTXGA-DEOSSOPVSA-N 438.568 4.325 10 10 IICE COc1cn(C)nc1[C@H](C)NC(=O)c1cc(C)n(-c2ccccc2Br)c1C 1652634819 LXPCMNBYHWIXIW-ZDUSSCGKSA-N 431.334 4.090 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NCc2ncc(C(F)(F)F)cn2)cc1 1672909921 QDPYQVTUSDICIJ-UHFFFAOYSA-N 433.434 4.066 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@H](c1nc(-c2cccnc2)no1)C(C)C 1682097048 IDCVHZRIRRCZKP-UTKZUKDTSA-N 436.560 4.134 10 10 IICE COc1cccc2c1OCCC[C@@H]2NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 1683779253 VQHQORAJROYOKE-ICSRJNTNSA-N 426.513 4.005 10 10 IICE CCCOc1ccc(C(C)(C)NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1684281023 SDDLUZZLGFMYSX-UHFFFAOYSA-N 425.573 4.171 10 10 IICE COc1ccc(N2CCN(C(=O)NCC3(Cc4ccccc4)CCCC3)CC2)cc1F 1685919261 AYBDIAZBUKXBTJ-UHFFFAOYSA-N 425.548 4.469 10 10 IICE CNC(=O)[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(C)C 1729618658 BTOPMLKWTKMHFX-GOSISDBHSA-N 436.604 4.217 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc([C@H]2CCOC2)n1CCCC(C)(C)C 1747719999 JAGXMAZPUOWMTD-NRFANRHFSA-N 441.620 4.081 10 10 IICE CCN(C[C@H]1CCCO1)c1nnc([C@H]2CCCCO2)n1CCCSc1nccs1 1766822932 LXDGZMXZFQGRJU-IAGOWNOFSA-N 437.635 4.164 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCCCO1 1769559856 CHZUXLXSNISJGC-KNQAVFIVSA-N 437.588 4.393 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](OCC(C)C)C1 1769853315 PWPABXYRDAIVSB-QFIPXVFZSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3C[C@@H]3CCCSC3)CC2)cc1F 1770259717 WWEQYIIIMHIDLP-KRWDZBQOSA-N 433.597 4.019 10 10 IICE COC[C@H](F)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1 1770784253 LODFVCXFWTXQPX-FUHIMQAGSA-N 425.552 4.429 10 10 IICE COC(=O)c1c(NC(=O)C(=O)N[C@@H]2CCCC[C@@H]2C)sc(C)c1-c1ccc(C)cc1 1860760991 LQWSMSJCOTYESC-WMLDXEAASA-N 428.554 4.452 10 10 IICE O=C(N[C@@]1(c2ccc(F)cc2O)C[C@H]1C(=O)O)OCC1c2ccccc2-c2ccccc21 1952760659 HBBBMIQHAYLFOM-SQJMNOBHSA-N 433.435 4.370 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(c2cc(C(=O)O)cc(C(=O)O)c2)C1=O 2041467714 UNTFIFMQLBMFIN-UHFFFAOYSA-N 425.487 4.435 10 10 IICE Cc1ccc([C@@H](n2nc(C(C)C)c(CN)c2I)C2(C)CC2)c(O)c1 2078982460 AXMVNIVXNVTWSU-QGZVFWFLSA-N 439.341 4.473 10 10 IICE COc1ccc([C@@H](C2CC2)n2nc(C(F)(F)F)c(C(=O)O)c2Br)c(O)c1 2079846041 XIRFYLLPASAKEN-GFCCVEGCSA-N 435.196 4.076 10 10 IICE CC[C@H](c1cc(C)c(C)cc1O)n1nc(C(F)F)c(CN)c1I 2079849018 QRXSHUZNXIJCKT-GFCCVEGCSA-N 435.256 4.206 10 10 IICE CCCOC(=O)c1cccc(N2C(=O)C(=Cc3ccc4c(c3)OCCO4)SC2=S)c1 2321718023 KHHNUTJKOFRIJJ-UHFFFAOYSA-N 441.530 4.430 10 10 IICE CCOc1ccc(C=C2SC(=S)N(c3cccc(C(=O)OC)c3)C2=O)cc1OC 2321718214 CLCFFSRASBPQGC-UHFFFAOYSA-N 429.519 4.286 10 10 IICE COc1ccc([C@H](CN2C(=O)C(=Cc3ccc(F)cc3F)SC2=S)N(C)C)cc1 2323879965 ZMNLVOWGWBYWDF-SFHVURJKSA-N 434.533 4.478 10 10 IICE CC[C@@H](CNC(=O)OC(C)(C)C)CC(=O)NCc1ccc(C)c(Br)c1O 2352637279 JMLYTSNQUCCSRS-CYBMUJFWSA-N 429.355 4.020 10 10 IICE Cc1ccc(CNC[C@@H]2C[C@@H](C)CN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2352942068 ZEOCYMFCYJKSPB-HIFRSBDPSA-N 427.383 4.446 10 10 IICE Cc1ccc(CNC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c1Br 2381133175 KZNNGXPUPMCYFY-CQSZACIVSA-N 441.366 4.117 10 10 IICE COc1cc(/C=C2/C=C(c3ccc(Br)cc3)OC2=O)c([N+](=O)[O-])cc1OC 33410859 QXOBHMWBLOCXKP-QPEQYQDCSA-N 432.226 4.356 10 10 IICE Cc1cc(N2CCOCC2)ccc1/C=C1/NC(=O)N(Cc2ccc(Cl)c(Cl)c2)C1=O 33457434 PUHWKVXKOKFASV-UDWIEESQSA-N 446.334 4.231 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)Nc3ccccc3C)c3ccco3)CC2)cc1 38637871 FQDANXURLIDWAF-QHCPKHFHSA-N 434.540 4.282 10 10 IICE CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C/c1cc(OC)c(OC)c(OC)c1 58883776 YPNITJORWMBNQH-XDHOZWIPSA-N 437.492 4.288 10 10 IICE CCOc1ccc(NC(=O)CCCN2C(=O)/C(=C\c3cccc(O)c3)SC2=S)cc1 210721757 CRXXVRXTHAJVFN-XMHGGMMESA-N 442.562 4.411 10 10 IICE O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N(Cc1ccccc1O)C[C@H]1CCCO1 732469133 AAYYNWNKPQRBMN-AAZCMCCISA-N 449.595 4.278 10 10 IICE C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 763488156 VSUGFRTZYBGESF-LJQANCHMSA-N 447.583 4.053 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)C1 768070181 FYXUMVVMJQHORV-BVZFJXPGSA-N 437.559 4.175 10 10 IICE Cc1nn(Cc2ccccc2)c(C)c1CNCc1ccc(N2CCN(CC3CC3)CC2)cc1 768670264 PCDCDFOVPSALAG-UHFFFAOYSA-N 443.639 4.370 10 10 IICE Cc1cc(C(=O)CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)c(C)n1-c1ccccc1 771467120 LSHCVXZURFFMJJ-XMMPIXPASA-N 433.596 4.391 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cccnc3-n3ccnc3)cc2Cl)C1 799863556 WXKPSVTXGZJJPS-QGZVFWFLSA-N 438.963 4.156 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@@H](C4CC4)C3)n2C[C@H]2CCOC2)c(C)n1-c1ccccc1 802756565 RRPXMKRTZMSNPZ-HYBUGGRVSA-N 447.583 4.004 10 10 IICE O=C(COc1ccc(Cl)c2cccnc12)NCc1ccc(N2CCSCC2)cc1 917385799 FMVQZUPTDHVXGH-UHFFFAOYSA-N 427.957 4.137 10 10 IICE C[C@H](NC(=O)c1cccc2nc(O)n(CC(C)(C)C)c12)c1ccc(N2CCOCC2)cc1 1125518897 NOKBORHKEIBKSH-KRWDZBQOSA-N 436.556 4.116 10 10 IICE Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1127267831 NEHLVCCLHINHDL-IBGZPJMESA-N 442.003 4.264 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3cc(Br)cc(C(F)(F)F)c3)C2)cc1 1130827159 VDJDGFSJDHRTFU-OAHLLOKOSA-N 443.263 4.485 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cn(-c3ccc(Cl)c(Cl)c3)cn2)N(C)C)cc1 1134881608 AXNOMTSBJMGEQH-NRFANRHFSA-N 446.382 4.278 10 10 IICE CNC(=O)c1cc(Oc2cc(NC(=O)c3cc4cc(O)c(O)cc4s3)ccc2C)ccn1 1137132711 GRHRUJCYKCTESM-UHFFFAOYSA-N 449.488 4.420 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3c(F)cccc3F)CC2)cc1 1163103268 BJDHHFOMBRJLOQ-UHFFFAOYSA-N 437.490 4.076 10 10 IICE C=CC(=O)N1CCC(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)(c2ccccc2)CC1 1170859574 WAMUOBGPFCDLCL-UHFFFAOYSA-N 441.575 4.457 10 10 IICE CC(C)Oc1ccc([C@H](CNC(=O)NCc2c(O)ccc3c2CCCC3)N(C)C)cc1 1229503509 MGHVZMFZCNOGBG-QHCPKHFHSA-N 425.573 4.160 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CC[C@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1230301352 XRRIKCHNPYYORK-MSOLQXFVSA-N 443.975 4.388 10 10 IICE CC(C)c1nnc(N2CC[C@H](C)[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1287192297 IOEPMRCCDKGGLR-VQTJNVASSA-N 425.621 4.141 10 10 IICE CC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnccn1)OC 1292175967 WYTUOIKPKUHYLJ-JOCHJYFZSA-N 445.571 4.204 10 10 IICE CC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)C[C@H](C)O1 1293579282 QJMDTQHDBHYUJE-UGKGYDQZSA-N 434.588 4.075 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(N4CC[C@@H](N(C)C)C4)cn3)c2C)c1 1295249030 PTQMLOVFUIRQCX-JOCHJYFZSA-N 431.584 4.499 10 10 IICE COCCNc1nc(CC(=O)N(Cc2ccccc2O)[C@H](C)c2ccccc2)cs1 1295590621 MHAURSGMCARIBG-QGZVFWFLSA-N 425.554 4.240 10 10 IICE C[C@H](NC(=O)NC[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F)c1ccc(N(C)C)cc1 1312534846 HUWBDGUQNGDLJX-DOTOQJQBSA-N 440.535 4.005 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3CCc3ccsc3)CC2)cc1F 1315512041 HEOWDXXJGZIKOB-UHFFFAOYSA-N 443.592 4.354 10 10 IICE Cc1cc(F)ccc1-n1ccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1 1350933640 PZOHNODMUYFLRC-CALCHBBNSA-N 440.494 4.003 10 10 IICE Cc1cc(Br)c(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)s1 1435574653 WZVCWALFLALYQI-UHFFFAOYSA-N 448.430 4.281 10 10 IICE Cc1cccc(COc2cccc(C(=O)NCc3ccc(N4CCN(C)CC4)cc3)c2)c1 1438888480 VFBBYTCXJXBEHJ-UHFFFAOYSA-N 429.564 4.256 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC[C@H]3CCC4(CCOCC4)CO3)ccc21 1439216822 QSYCFXLASPKYHC-OAQYLSRUSA-N 428.573 4.000 10 10 IICE COc1cccc(CN(CCN(C)C)C(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1466880783 MNKOWPNGILESRZ-UHFFFAOYSA-N 433.552 4.119 10 10 IICE COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1466964042 LPKQHKRUOXGXKK-DEOSSOPVSA-N 429.520 4.398 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1470539494 NLSRNFGOZUYFKZ-PKOBYXMFSA-N 443.544 4.390 10 10 IICE COC(=O)/C=C/c1ccc(N2CC[C@@H]3[C@@H](CCCN3Cc3ccccc3)C2)c([N+](=O)[O-])c1 1472722445 SCMGBCGZJMBAAS-PNXDNICKSA-N 435.524 4.272 10 10 IICE C[C@@H]1CCN(CC(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)[C@H](C(F)(F)F)C1 1473901444 DELVBKYNZRDKIY-ACJLOTCBSA-N 430.426 4.063 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2Cc2nnc(C(C)(C)C)s2)n1 1492500078 OGVWYGFMHLZFRA-UHFFFAOYSA-N 449.584 4.188 10 10 IICE CC[C@@H](C)CN(CC)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1496065931 MCYZQUZQJVHYCP-GOSISDBHSA-N 431.600 4.472 10 10 IICE CC[C@](C)(O)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCSC[C@@H]1C 1512653759 TZTCARKOYMTSCL-UUOWRZLLSA-N 439.629 4.455 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc4cccc(Cl)c4nc3C)CC2)c(OC)c1 1530968768 YPKWPCFGNXIYCJ-UHFFFAOYSA-N 425.916 4.176 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3cccc(F)c3)C2)sc2c1CCCC2 1533779150 ZCXNVLIUYYRVSB-AWEZNQCLSA-N 444.528 4.323 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CN(C(=O)OC(C)(C)C)CC34CC4)ccc21 1539827981 ZTNXTUFYKUOIKR-NRFANRHFSA-N 441.572 4.034 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)c1 1543454938 LRCSYQQCKQEYPX-QHCPKHFHSA-N 431.492 4.276 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2CCCCC2(F)F)NC(=O)OC(C)(C)C)cc1 1544267141 CMMGXPZWFNGGRE-ZWKOTPCHSA-N 425.520 4.260 10 10 IICE CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2ccccc2-n2c(C)cc(C=O)c2C)c1 1544346920 ARDCGIDBEBIBOH-QGZVFWFLSA-N 431.536 4.365 10 10 IICE CC/C=C/Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCNC(=O)[C@H]1CC 1546780793 PHZBLMXAXHDYAN-ICKBMGCOSA-N 432.572 4.034 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](CC)Cc1ccccc1Br 1557115332 SOKQTFPYRYIFSH-INIZCTEOSA-N 448.357 4.315 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CCCCCN1C(=O)OC(C)(C)C 1565445387 XUONQDDIIDWFCA-OAQYLSRUSA-N 432.609 4.464 10 10 IICE Cc1cc(CC(=O)N[C@H](C)C(=O)NCCc2ccccc2)c(C)n1-c1ccc(Cl)cc1 1584385943 MFDQVPQCGYMBBI-GOSISDBHSA-N 437.971 4.154 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cnc3ncc(Br)cc3c2)cc1F 1585698595 RQYWJKFLTJXMSI-UHFFFAOYSA-N 431.309 4.308 10 10 IICE O=C(NCc1cc(O)ccc1O)[C@H](Oc1cccc(Br)c1)c1ccccc1 1593872900 FWINADMNLMOJDE-HXUWFJFHSA-N 428.282 4.297 10 10 IICE CC[C@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(C)=O 1614160036 AGNMXUKDLNJADO-NRFANRHFSA-N 434.588 4.258 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)c2cc(Cl)cc(Br)c2F)N(C)C)cc1 1616867270 STEVLBKCWXHVQI-KRWDZBQOSA-N 442.760 4.340 10 10 IICE COC(=O)COc1ccc(N(C)Cc2cccc(Br)c2OC(F)F)cc1 1617141452 VNQPZBQGAZWPAH-UHFFFAOYSA-N 430.245 4.239 10 10 IICE CCOC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)c1cc2cc(O)c(O)cc2s1 1625666523 DRJLTXQGWLSVKZ-GOSISDBHSA-N 435.501 4.370 10 10 IICE O=C(NC1(c2ccccc2Cl)CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1627290227 WEMJBHOYHIYGGO-UHFFFAOYSA-N 448.953 4.327 10 10 IICE CCN(CC)c1ccc(CNC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2)cc1F 1628769886 NNZIXHRZEXLIMF-UHFFFAOYSA-N 440.968 4.194 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cccc2cc(O)ccc12 1630368349 FJAAVCZVMNCMAP-UHFFFAOYSA-N 430.426 4.331 10 10 IICE COc1cccc(-c2cc(C(=O)N(Cc3ccc(N(C)C)cc3)C[C@@H]3CCCO3)on2)c1 1631612354 MVYXCONMHCTWLK-QFIPXVFZSA-N 435.524 4.238 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)Nc1ccc(O)cc1Cl 1632717452 BSSIGVOHLBEDML-SXGWCWSVSA-N 436.917 4.415 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1(Cc2ccc(F)cc2)CCOCC1 1636263226 NFUGBIVYPFXFHG-LJQANCHMSA-N 427.564 4.222 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(Cc2ccccc2)ccc1O 1637549813 JZZZFBFDOITHNW-UHFFFAOYSA-N 438.474 4.028 10 10 IICE Cc1cc(C(=O)N2CCCCC[C@H]2C[C@@H](C)O)c(C)n1-c1ccc(Br)cn1 1640432424 DFWHOVHCBRPLIM-QAPCUYQASA-N 434.378 4.407 10 10 IICE CCOc1ccc(N2CCN([C@@H](C)C(=O)Nc3ccc(C)cc3Br)CC2)cc1 1642353813 DPOGWAFIMFQMFF-KRWDZBQOSA-N 446.389 4.305 10 10 IICE Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NCc3cccc(Cl)c3O)c2)c1 1648606728 WSTNRMFXUJDAMI-UHFFFAOYSA-N 430.913 4.085 10 10 IICE CC(=O)N(c1ccc(NC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1)[C@H]1C[C@H]1C 1670258218 HQDRXIKZLAIPAM-VSDWSMLSSA-N 437.540 4.367 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1C[C@H](OCc2ccccc2)C1(C)C 1686204526 FOMWWLTZTOJPTG-ZEQRLZLVSA-N 437.584 4.049 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccnc(N(C)C)c4C3)cc2Cl)C1 1686269804 ZLESASZYYSGBDV-QGZVFWFLSA-N 442.007 4.305 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c([C@H]2CCCO2)nnc1N(C)Cc1cc(Cl)ccn1 1724235564 PQDDBLICKBLCPA-OAQYLSRUSA-N 440.979 4.237 10 10 IICE COCC(C)(C)Cn1c(Cc2ccccn2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1749286618 KFGDDQSDUHAQQR-UHFFFAOYSA-N 448.615 4.173 10 10 IICE CC[C@H](C)c1nnc(N2C[C@H](C)O[C@@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)c(F)c1 1763557153 DPCSDQODZOLHJO-SUNYJGFJSA-N 443.489 4.201 10 10 IICE Cc1ccc2c(C)c(C(=O)N[C@H](c3ccc(N(C)C)cc3)c3nccn3C)c(=O)oc2c1C 1866290915 PFKAZFXFFRKHOP-JOCHJYFZSA-N 444.535 4.037 10 10 IICE CCC(=O)Nc1ccc(NC(=O)c2c3c(n4ccccc24)C(=O)c2ccccc2C3=O)cc1 1873948921 IFXAOSSCMPWHJY-UHFFFAOYSA-N 437.455 4.316 10 10 IICE COc1ccc([C@H](C2CCC2)n2nc(C3CC3)c(N)c2I)c(O)c1 2080012652 RWKJAOSZLSBALL-KRWDZBQOSA-N 439.297 4.051 10 10 IICE O=C(CCCN1C(=O)C(=Cc2cccs2)SC1=S)Nc1ccccc1C(=O)O 2296881339 BMPHXHKWICNJIR-UHFFFAOYSA-N 432.548 4.066 10 10 IICE O=C1c2ccccc2C(=O)c2cc(S(=O)(=O)Nc3ccc(O)c4ccccc34)ccc21 8833753 XQAFHEUXSGRXMW-UHFFFAOYSA-N 429.453 4.122 10 10 IICE CSc1ccc([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@@H]3C=CC[C@H]32)cc1 20758847 MCXYKLOUFZBCQH-VIZSFHNOSA-N 442.606 4.256 10 10 IICE CCOc1ccc(Br)cc1/C=C1\SC(=S)N(CCCC(=O)OC)C1=O 40888826 ZGQVKIXWUKMWPM-UVTDQMKNSA-N 444.372 4.002 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/NC2Cc3ccccc3C2)cc1 104047455 IIMKSJVTTBMVMC-KOEQRZSOSA-N 439.515 4.096 10 10 IICE Cc1cccc2[nH]cc(CCNC(=O)NCc3ccc(N4C[C@H](C)O[C@H](C)C4)c(F)c3)c12 728596968 LCSQGSDKXRLQLZ-HDICACEKSA-N 438.547 4.271 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1COc2c1ccc(Cl)c2Cl 743683209 LPMPZTPKZVOQMJ-SFHVURJKSA-N 436.339 4.105 10 10 IICE O=C(Cc1c[nH]c2cc(Cl)ccc12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768532331 AYGKDYWCFVEMCG-UHFFFAOYSA-N 436.987 4.212 10 10 IICE C[C@H](NCc1ccccc1CS(=O)(=O)N1CCCC1)c1cc(Cl)c(Cl)cc1O 774267651 YODDTWVAMXSXGK-AWEZNQCLSA-N 443.396 4.475 10 10 IICE Cc1cc(C(=O)N2CC[C@@]3(CCCN(C(=O)OC(C)(C)C)C3)C2)c(C)n1-c1ccccn1 802323555 LDVOMYKNPNRZNV-VWLOTQADSA-N 438.572 4.352 10 10 IICE Cc1c(NCc2ccc(OCc3ccccc3)cc2O)cccc1N1C(=O)N[C@H](C)C1=O 809787131 ULVBHAWEQLEICL-QGZVFWFLSA-N 431.492 4.336 10 10 IICE CC(=O)Nc1cccc(N2C(=O)/C(=C/c3ccccc3-c3ccnn3C)SC2=S)c1 814185503 IQYKUKQRTUDULS-NDENLUEZSA-N 434.546 4.451 10 10 IICE COc1ccc(C2(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)CCC2)cc1 1137438962 ZIALJZHORVMCEE-HXUWFJFHSA-N 428.960 4.257 10 10 IICE COc1ccc(C(=O)N(Cc2ccccc2O)[C@@H](C)c2ccccc2)cc1N1CCNC1=O 1137816076 DERSDFQKUNCLGT-SFHVURJKSA-N 445.519 4.334 10 10 IICE Cc1cc(C(=O)NC[Si](C)(C)c2ccccc2)c(C)n1-c1ccc(Br)cn1 1153945144 XWDNSMAABFBLFP-UHFFFAOYSA-N 442.433 4.136 10 10 IICE O=C(CN1CCN(CCc2ccncc2)CC1)Nc1ccc(N=Nc2ccccc2)cc1 1175400466 QKYQGFWJJJYOKH-UHFFFAOYSA-N 428.540 4.296 10 10 IICE COc1ccc2c(c1)OC[C@@H](NC(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)C2 1225636824 MNYKMIYJJXNSBV-APWZRJJASA-N 443.975 4.388 10 10 IICE Cc1cc(C(=O)NC2CN(C(=O)OC(C)(C)C)C2)c(C)n1-c1cccc(Br)c1 1293332851 LDEMVTXSZWWDIP-UHFFFAOYSA-N 448.361 4.206 10 10 IICE CCN(CC)[C@@H](C)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1295390574 QTPXMUNPTLGGAS-CZTZKLFOSA-N 443.636 4.269 10 10 IICE Cc1cc(C(=O)N[C@@H]2[C@@H](C)CCN(C(=O)OC(C)(C)C)[C@H]2C)c(C)n1-c1ccccn1 1297536602 AAILZWXBXQMFCJ-UQASEVPWSA-N 426.561 4.253 10 10 IICE O=C(N[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1)c1cc2cc(O)c(O)cc2s1 1297551814 XIXMNVCTDUOZLT-HXUWFJFHSA-N 437.439 4.463 10 10 IICE Cc1ccc(C(=O)N[C@@H](C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)C(C)C)cc1 1350629034 QSOSTWXJERJUAS-HSZRJFAPSA-N 440.499 4.164 10 10 IICE CO[C@H](c1ccccc1F)[C@H](C)NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1357641661 WEDMBDAVVLFZDY-QYBDOPJKSA-N 437.559 4.439 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccccc4C)cn3)cc2F)CC1 1360094168 SXRPBCNXOJNLIZ-UHFFFAOYSA-N 448.542 4.393 10 10 IICE Cc1cc(CNC(=O)c2cn3c(Br)cnc3s2)c(C)n1-c1ccccc1 1438307689 ZHMGDAQEEHCDHK-UHFFFAOYSA-N 429.343 4.496 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1c(F)ccnc1F 1460582894 AQMZCZVWMUVTLQ-XFXZXTDPSA-N 425.507 4.041 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCC3(c4c(F)cccc4F)CCC3)C2)cc1 1470526109 VBJNQNORJRJZCC-KRWDZBQOSA-N 429.511 4.221 10 10 IICE C[C@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccc1O 1471195025 SLOIFZSDBKRNLQ-VLURKWGBSA-N 432.592 4.313 10 10 IICE COC(C)(C)c1nsc(NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1472776086 OEOMYASZZJVDCO-INIZCTEOSA-N 435.594 4.164 10 10 IICE COc1ccc2cc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cnc2c1 1514714284 BIWLSTZSHBQZSE-KRWDZBQOSA-N 427.451 4.244 10 10 IICE COCCC1(Cn2c(C(C)C)nnc2N2CCN(c3ccc(OC)c(F)c3)CC2)CCC1 1518976209 XHJHUDZUHYIIQU-UHFFFAOYSA-N 445.583 4.083 10 10 IICE CC(C)(C)c1ncc(/C=C\C(=O)N(CCN2CCOCC2)c2ccccc2Cl)s1 1535294798 PBSOGTFCPWTDPF-HJWRWDBZSA-N 434.005 4.473 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)Nc1cc(F)c(F)c(F)c1F)c2[N+](=O)[O-] 1535949493 CXLNSFHANIEAAA-UHFFFAOYSA-N 444.296 4.179 10 10 IICE COc1ccc(N2CCN(CCNC(=O)CCCc3ccc4ccccc4c3)CC2)cc1 1544314869 IBCAAJKUDKNYNR-UHFFFAOYSA-N 431.580 4.110 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@](CO)(c3ccccc3)C2)c(C)n1-c1ccccc1 1565162285 RGBWIVZNABQCDV-MHZLTWQESA-N 431.580 4.372 10 10 IICE Cc1cc(CNC(=O)N[C@H](C)c2ccccc2NS(C)(=O)=O)c(C)n1-c1ccccc1 1565193125 PJJXRSPEWVODSI-QGZVFWFLSA-N 440.569 4.026 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 1566849298 JQTIUCRSBPPLIS-UHFFFAOYSA-N 440.805 4.361 10 10 IICE O=C(CN1CCC[C@@H]1C(=O)NCc1ccco1)Nc1ccc(N=Nc2ccccc2)cc1 1615466316 WXBKUKVHQFERMS-JOCHJYFZSA-N 431.496 4.414 10 10 IICE C[C@H](N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc(F)cc1F 1616806684 CGXYISIVVYKEJS-UONOGXRCSA-N 434.442 4.418 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]2C)c(C)n1-c1ccccc1 1624064400 FMVJPEJGOYMKBW-MOPGFXCFSA-N 425.573 4.493 10 10 IICE Cc1cc(C(=O)N2CCCNC(=O)[C@H]2Cc2ccccc2)c(C)n1-c1cccc(Cl)c1 1625199593 FFQAPWBVTIXMKN-HSZRJFAPSA-N 435.955 4.321 10 10 IICE Cc1cc(C(=O)N[C@@H](C)[C@H](C)C(=O)Nc2ncccc2O)c(C)n1-c1ccc(Cl)cc1 1627092123 VSFDEYYFJZXXKR-GJZGRUSLSA-N 440.931 4.241 10 10 IICE CC1CCN(c2ccc(CNC(=O)C3(NC(=O)NCc4ccccc4)CCCC3)cc2)CC1 1627463335 RMLHQBOWHZGOGI-UHFFFAOYSA-N 448.611 4.351 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F 1628954611 NKESCSFCGFIHOM-LJQANCHMSA-N 437.531 4.138 10 10 IICE Cc1ccc(C(=O)N[C@H](CC(N)=O)c2cccc(Cl)c2)cc1-n1c(C)cc(C=O)c1C 1629322340 WCWRCDLCQYZKHO-OAQYLSRUSA-N 437.927 4.215 10 10 IICE Cc1cc(C(=O)N2CC[C@H]3[C@@H](CCCN3C)C2)c(C)n1-c1cccc(Br)c1 1629819314 QQUMNWKVVCNNRU-UWJYYQICSA-N 430.390 4.413 10 10 IICE CCS(=O)(=O)Nc1ccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1OC 1630663954 HOTNEZRSKVRYHR-UHFFFAOYSA-N 441.553 4.046 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCCCn1cnc2c(N)ncnc21 1631531399 QJVQYNLBFVXBCL-GOSISDBHSA-N 444.539 4.074 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCC[C@@H]1CC1CCCC1 1631661310 JCMKFYVUWCOXHH-QGZVFWFLSA-N 434.583 4.439 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1 1635304156 NEJLPDKVKQVNND-QGZVFWFLSA-N 428.492 4.371 10 10 IICE CNC(=O)CC[C@@H]1CCCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1636028068 VNHFPXJHFXWJDB-SFHVURJKSA-N 446.389 4.378 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCCc3cc(OC)ccc32)sc(C(C)=O)c1C 1653810944 UAUIJWMJHUGTAD-UHFFFAOYSA-N 444.553 4.226 10 10 IICE CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCCN([C@H](C)c2ccccc2F)C1=O 1672983622 HCSYEWJZPOISQY-UTKZUKDTSA-N 427.520 4.205 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccc(OC(F)(F)F)c3)CC2)cc1F 1683852487 RFLCDRSGXNXIBN-AWEZNQCLSA-N 441.425 4.326 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCc3nc(-c4ccccc4)sc3C2)N(C)C)cc1 1685610030 SVCVFLDOKBBHIX-QFIPXVFZSA-N 449.624 4.247 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)CC(C)(C)CNC(=O)OC(C)(C)C 1686826448 IKKODUGRAZOXNK-SFHVURJKSA-N 434.625 4.184 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(-n2nc(C)cc2C)nc1 1693998468 PMDILKGDDZEBID-QGZVFWFLSA-N 445.571 4.379 10 10 IICE CCOCCN(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc(N(C)C)cc1C 1696419187 RWBZNTHBNRETGY-FGZHOGPDSA-N 443.636 4.092 10 10 IICE C[C@H](CN(C)C(=O)OC(C)(C)C)Cn1c(C2CC2)nnc1N(C)Cc1ccccc1O 1723810151 LRYCHJDTNQAYQB-MRXNPFEDSA-N 429.565 4.001 10 10 IICE CCc1nnc(N2CCN(C3CCC(C)CC3)CC2)n1CCCSc1nccs1 1727607449 AWDAYWBXIQIFLV-UHFFFAOYSA-N 434.679 4.180 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CC3C[C@H](C)O[C@@H](C)C3)CC2)cc1F 1730179705 BZOLRZLVMCCSIB-ROUUACIJSA-N 445.583 4.079 10 10 IICE CC[C@@H]1CN(c2nnc(CC(C)(C)C)n2Cc2ccc3c(c2)CCCN3C)C[C@H](C)O1 1745029923 GSVNYSJSFPDSDG-GHTZIAJQSA-N 425.621 4.301 10 10 IICE CCc1nnc(N2C[C@@H](C)O[C@H](c3ccsc3)C2)n1Cc1ccc(N(C)C)cc1C 1762931387 UIQZOWATSKVXJJ-UTKZUKDTSA-N 425.602 4.291 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H]1CCO[C@@H](C)C1 1763747506 GXXRYURNCYQGEV-GBESFXJTSA-N 445.583 4.081 10 10 IICE CCC[C@@H](C)CN(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc2c(c1)CCCN2C 1765496077 XOWJVTFQGQQUSH-KNQAVFIVSA-N 425.621 4.475 10 10 IICE CCC[C@H]1CN(c2nnc(COCC)n2Cc2ccc(N3CCC(C)CC3)cc2)CCO1 1765657269 XFMSSYDNAQIACK-QHCPKHFHSA-N 441.620 4.105 10 10 IICE C[C@@H](Oc1cccnc1NC(=O)Oc1ccc(N)cc1)C(=O)Nc1ccc(Cl)cc1 1858685314 LCTDFLUPIFRCLT-CYBMUJFWSA-N 426.860 4.334 10 10 IICE COc1ccc(N2CCN(c3cc(N4CCCCCC4)nc(-c4cccnc4)n3)CC2)cc1 1868001984 ZQOKLSMFBYXARA-UHFFFAOYSA-N 444.583 4.254 10 10 IICE COc1ccc(N2CCN(c3nc(Nc4cccc(C)c4C)ncc3[N+](=O)[O-])CC2)cc1 1871311868 QUKBMMVJBIBQKG-UHFFFAOYSA-N 434.500 4.080 10 10 IICE CN(C)c1ccc([C@@H](CN)N(CCCNC(=O)OC(C)(C)C)Cc2ccccc2)cc1 2018744257 PGHLNLRHVXFTCK-HSZRJFAPSA-N 426.605 4.169 10 10 IICE CN1CCc2cc([C@H](CN)N(CCCNC(=O)OC(C)(C)C)Cc3ccccc3)ccc21 2074285220 SICDYGVLVWSWOL-DEOSSOPVSA-N 438.616 4.096 10 10 IICE Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccc1O 2296203771 NPULGNPAIZDACZ-UHFFFAOYSA-N 435.867 4.120 10 10 IICE Cc1ccc(N2CCN(C3=NC(=O)C(=Cc4cccc([N+](=O)[O-])c4)S3)CC2)cc1Cl 2296758968 JXBPFGJFZFEPHM-UHFFFAOYSA-N 442.928 4.349 10 10 IICE Cc1ccc(S(=O)(=O)Oc2ccc3ccccc3c2C=C2SC(=S)NC2=O)cc1 2297349226 AMMLRJXASLDSNQ-UHFFFAOYSA-N 441.555 4.405 10 10 IICE Cc1ccccc1NC(=O)[C@H](C)N1C(=O)C(=Cc2ccc([N+](=O)[O-])cc2)SC1=S 2314836197 BKEKRQQXDIOUGM-ZDUSSCGKSA-N 427.507 4.132 10 10 IICE COc1ccc(C=C2SC(=S)N([C@H](C)C(=O)Nc3ccccc3C)C2=O)cc1OC 2314836824 KRZDGMJBFBBGLN-CQSZACIVSA-N 442.562 4.241 10 10 IICE CC[C@@H](Oc1ccccc1C=C1SC(=S)N(c2ccccc2OC)C1=O)C(=O)O 2314931905 JBWSXMHFBLOBMQ-OAHLLOKOSA-N 429.519 4.343 10 10 IICE Cc1ccc(CNC2[C@H](C)CN(C(=O)OC(C)(C)C)C[C@H]2C)c(O)c1Br 2352948334 ZNFDDUOTBWODNN-ZIAGYGMSSA-N 427.383 4.444 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1O)N2 14475874 AWNWHHYDURMGII-WHSLLNHNSA-N 443.525 4.204 10 10 IICE COc1ccc(Br)cc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 27548741 DRFPRIMNKAWUEL-UHFFFAOYSA-N 436.261 4.485 10 10 IICE CCOc1ccc(NCN2C(=O)/C(=C\c3cc(OC)ccc3OC)SC2=S)cc1 59377533 WLHBYMVMKPXQKV-XDHOZWIPSA-N 430.551 4.373 10 10 IICE COC(=O)/C=C\c1ccc(N2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)c([N+](=O)[O-])c1 747621045 SCQGPHVMFLTYBI-MONCILHSSA-N 436.386 4.378 10 10 IICE Cc1cc(O)c(C(C)C)cc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Br 768509872 WNHGHBNXXHROCC-UHFFFAOYSA-N 429.292 4.296 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc(Br)ccc1Br 772318143 IVZMUSMOZZMELG-UHFFFAOYSA-N 440.135 4.301 10 10 IICE Cc1cc(Br)c(O)c(CNCc2cc(Br)c3c(c2)OCCO3)c1 781629308 VAODPKJLWHWWBY-UHFFFAOYSA-N 443.135 4.287 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1cccc(Cl)c1Br 808525472 BBQUYJOQMWGZPY-UHFFFAOYSA-N 430.736 4.422 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)[C@@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1 810075271 IVWOOWAAHGQDBP-NRFANRHFSA-N 445.535 4.079 10 10 IICE CSCc1cccnc1C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 811439106 NTTDFULFEVABRE-UHFFFAOYSA-N 438.505 4.121 10 10 IICE CCOC(=O)c1ccccc1NCN1C(=O)S/C(=C\c2ccc(N(C)C)cc2)C1=O 1084187647 PXNKQVAXQJEAQB-UYRXBGFRSA-N 425.510 4.035 10 10 IICE O=C(CCc1ccc(-c2ccccc2)[nH]1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129661080 DZJYMKXUIVCBMO-UHFFFAOYSA-N 425.479 4.046 10 10 IICE Cc1cc(C(=O)NC[C@@H](C)CN2CCCCC2)c(C)n1-c1ccc(Br)cn1 1136335262 UJYWDJLGCAQBHR-OAHLLOKOSA-N 433.394 4.103 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H](NC(C)=O)c1cccc(Br)c1 1155704905 SBJJRBZDQCTZAD-HXUWFJFHSA-N 433.346 4.161 10 10 IICE COC(=O)[C@@H]1CN(C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)Cc2ccccc21 1233974269 MULYPMMLKGWJAR-XMMPIXPASA-N 431.536 4.119 10 10 IICE Cc1nc(Cc2nnc(N3CC[C@@H](C)[C@H]3C)n2Cc2ccc(N(C)C)c(F)c2)cs1 1290415575 TWQRSDLQFQDRKU-HUUCEWRRSA-N 428.581 4.122 10 10 IICE Cc1noc(C)c1[C@@H](C)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1304877314 JVUOLKIPHOALCD-INIZCTEOSA-N 432.528 4.014 10 10 IICE O=C1NCCCN1c1ccc(CNC(=O)N(Cc2ccccc2O)C2CCCCC2)cc1 1313079123 RRGFBZOJMXROAY-UHFFFAOYSA-N 436.556 4.356 10 10 IICE CN(Cc1nccs1)c1nnc(-c2ccccn2)n1CCCSc1nccs1 1314774044 GSSGIVHLDITQLS-UHFFFAOYSA-N 429.600 4.072 10 10 IICE CCCCNS(=O)(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccccc3)c2C)c1 1350635286 OXQIYVOXIQCPLQ-UHFFFAOYSA-N 439.581 4.354 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ocnc1-c1ccccc1 1350761165 QMGUZFBAVJLBQJ-UHFFFAOYSA-N 431.414 4.127 10 10 IICE COc1ccc([C@H](OC)[C@@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1357782156 AGPVSNWDAGPGOH-XHCCPWGMSA-N 449.595 4.309 10 10 IICE Cc1cc(CCNC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)c(C)n1-c1ccccc1 1438177359 LNHLZZSUOCLRIE-UHFFFAOYSA-N 429.480 4.161 10 10 IICE CCOC(=O)c1cccc(N(CC)C(=O)/C=C/[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1 1441971463 RDQSFPHHYXNGFH-JKGDOXCYSA-N 430.545 4.420 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(C)(C)n1ccc(NC(=O)OC(C)(C)C)n1 1451666104 HJVVQIYAEOFGAQ-KRWDZBQOSA-N 443.592 4.087 10 10 IICE C[C@@H]1c2ccc(C(=O)NCc3ccc4c(c3)CCCN4C)n2CCN1C(=O)OC(C)(C)C 1464517907 HCLSJDNLIWPGPZ-QGZVFWFLSA-N 438.572 4.112 10 10 IICE COc1cc(C)cc(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)c1C 1465324417 DSVPZJLCBVBTOP-NRFANRHFSA-N 441.572 4.374 10 10 IICE CC1CCN(c2ccc(C(=O)NCc3cccc(Br)c3O)cc2[N+](=O)[O-])CC1 1467761209 NHNWCLMEONEYFM-UHFFFAOYSA-N 448.317 4.229 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)C1 1470539490 NLSRNFGOZUYFKZ-IEBWSBKVSA-N 443.544 4.390 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CC[C@H](c4cc(C)c(Cl)cc4O)C3)C2)cc1 1470774214 XYOUBAVFXSPTIY-DLBZAZTESA-N 429.948 4.140 10 10 IICE COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)NCc2c(O)ccc3ccccc23)cc1OC 1472086151 NYMVDSPTXFHGRJ-RHSMWYFYSA-N 434.492 4.087 10 10 IICE C[C@H](NC(=O)N1CCC[C@@](O)(c2ccc(Br)cc2)C1)c1ccc(N(C)C)cc1 1478470999 LRSVWISHOFYBQP-AOMKIAJQSA-N 446.389 4.269 10 10 IICE CC(C)=CCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@](C)(C(N)=O)C1 1508741811 PRAMZRYBPLFFJQ-SANMLTNESA-N 446.599 4.411 10 10 IICE CC[C@@H](C)c1nnc(N(C)CC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512815828 NJKDKVXJLQOMSO-GOSISDBHSA-N 429.584 4.442 10 10 IICE COc1ccc(-c2nnc(N3CCCC3)n2CCCSc2nccs2)c(OC)c1 1518158763 YOOLREKGUARHOT-UHFFFAOYSA-N 431.587 4.201 10 10 IICE CC(C)n1cc(Br)c(C(=O)N(Cc2ccc(N(C)C)cc2)CC(F)(F)F)n1 1520961357 KUWCVYDLMHFOMU-UHFFFAOYSA-N 447.299 4.497 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NC1(Cc2ccccc2)CC1 1523646430 SGGVQMBTHVSXFO-RGEXLXHISA-N 440.565 4.309 10 10 IICE CCCc1nccnc1NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S 1532023286 IVHXUXILRITSLB-NTCAYCPXSA-N 432.596 4.111 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)c(Br)c1 1533991950 HQUGHIBNOSAVTL-UHFFFAOYSA-N 446.364 4.050 10 10 IICE CCCc1c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1cccc(C)c1 1535558182 KUOYJSOCGONWLE-FQEVSTJZSA-N 432.568 4.461 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3ccc(Cn4ccccc4=O)o3)cc2Cl)C1 1538421048 ILRFLKGNCDSAHW-QGZVFWFLSA-N 439.943 4.309 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1 1542618316 WVMOUDLTPJIBFG-UHFFFAOYSA-N 435.543 4.179 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)OC2CCCC2)cc1F 1552830614 GPSBKZWHSCPAOV-UHFFFAOYSA-N 429.565 4.494 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC(Cc4ccccc4C(F)(F)F)C3)C2)cc1 1564961967 ASNWHKARHLIRKN-KRWDZBQOSA-N 447.501 4.424 10 10 IICE CCOc1ccc(N2CCN(C(=O)C(C)(C)c3ccccc3Br)CC2)cc1 1566562318 GTHDOAAOSFRSPF-UHFFFAOYSA-N 431.374 4.474 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)NCCc3cc(Cl)c4c(c3)OCCO4)c2C)cc1 1587696624 UENIFFGLDUNVQH-UHFFFAOYSA-N 440.927 4.500 10 10 IICE CCC[C@@H](C)C(=O)NCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)CC 1614348274 VLDSZFVSRPPCHL-GOSISDBHSA-N 436.604 4.361 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3sc(Cc4ccc(F)cc4)nc3C)C2)cc1 1617263185 SGKBVKJQSIGWKP-SFHVURJKSA-N 425.529 4.199 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)C2(Oc3ccccc3)CC2)NC(=O)OC(C)(C)C)cc1 1618252246 BTRDKYFCFUUGOD-OAQYLSRUSA-N 439.556 4.046 10 10 IICE CN(c1ccc(CNC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1)C1CCCCC1 1625905669 YOWSMZLMUKVBCQ-UHFFFAOYSA-N 433.512 4.479 10 10 IICE CNC(=O)[C@]1(C(F)(F)F)CCN(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)C1 1628354515 NIBQAODAVTWVBU-QFIPXVFZSA-N 435.490 4.358 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)NC1CCC(c2ccc(F)cc2)CC1 1634146229 GZMYHTBGPBXLIQ-UHFFFAOYSA-N 447.501 4.466 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(c3ccccc3F)C[C@H]2C)cc1 1635774086 UWSPIXOSDIUYOQ-LJQANCHMSA-N 433.527 4.326 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3C[C@@H](C)C[C@@H](C(=O)OC(C)(C)C)C3)ccc21 1638264777 FTCFLQRWFRPFPX-OXJNMPFZSA-N 428.573 4.344 10 10 IICE O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CN(Cc2ccccc2)C[C@H]1c1cccc(F)c1 1638749480 OFOIJUMTRDHVGG-BUHQFNOLSA-N 432.495 4.035 10 10 IICE CC(C)(C)OC(=O)NCc1ccc(CNC(=O)c2cc3cc(O)c(O)cc3s2)c(F)c1 1640716762 HEWACVZJBQUWQT-UHFFFAOYSA-N 446.500 4.406 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN[C@H](c3ccccc3)C3CCC3)cc2F)C[C@@H](C)O1 1644930821 VCQABFUCIFDHDA-UYXZNNOOSA-N 439.575 4.187 10 10 IICE CCOC(=O)c1c(NC(=O)CSCC(=O)N(CC)CC)sc(C)c1-c1ccccc1 1651892781 XODWYRIKOPCFTK-UHFFFAOYSA-N 448.610 4.440 10 10 IICE COC(=O)c1oc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1C 1681828661 WOVZVGZAGCUENA-CQSZACIVSA-N 433.936 4.264 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](c1ccc(F)c(F)c1)c1nccn1C 1685690134 LEMPQMNXHVTXAH-NRFANRHFSA-N 427.499 4.085 10 10 IICE CC(C)Cc1nnc(N2CCC(c3ccnn3C)CC2)n1CCCSc1nccs1 1706394760 DKJJZGQYOJVXOF-UHFFFAOYSA-N 445.662 4.233 10 10 IICE CCO[C@H]1C[C@H](N(C)c2nnc(-c3ccc[nH]3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728920007 BIXKBCDPKFSEHN-VXKWHMMOSA-N 436.604 4.336 10 10 IICE CC[C@H](C)[C@](C)(O)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743513372 BUVKWQLSHCCEKZ-UWUFEASWSA-N 441.620 4.163 10 10 IICE COc1ccc(CCN2C(=O)/C(=C\c3c(C)nc4scc(C)n34)SC2=S)cc1 1858586405 GKKGXNQPUNIGTP-LICLKQGHSA-N 429.592 4.465 10 10 IICE COc1cccc(Cn2nc(C(C)(C)C)c(C3CC3)c2I)c1O 2079806487 LSLNRZRTYHOWPN-UHFFFAOYSA-N 426.298 4.425 10 10 IICE COc1ccc2ccc(OC)c(C=C3C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)c2c1 2293452771 AYBHIURUOCQREW-UHFFFAOYSA-N 430.460 4.140 10 10 IICE Nc1ccc(OCCOc2cc(Br)cc(I)c2)cc1 2338672760 JVDTYKDGFGZAJA-UHFFFAOYSA-N 434.071 4.094 10 10 IICE O=[N+]([O-])c1cccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@H]32)c1 14471724 UBEIWOQSWLPNQS-NNMXDRDESA-N 425.510 4.206 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3ccc(F)cc3)C(=O)N=C2O)cc(Br)c1O 59106213 VENZUHWOXRWBIW-QPEQYQDCSA-N 449.232 4.199 10 10 IICE C[C@H](NC(=O)c1ccccc1SC[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1 109179971 RIPOVRQLWVHHQQ-GHTZIAJQSA-N 426.582 4.285 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)/C2=C(\C)Nc2ncccc2C)cc1 205965024 SSGFISQIIDZYIR-LTGZKZEYSA-N 443.463 4.444 10 10 IICE Cc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1NC(=O)N(C)C 478627777 GMPJVUUHUDJANK-UHFFFAOYSA-N 447.583 4.448 10 10 IICE COc1cccc(C[C@@H](C)NC(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)c1 732998703 FHHBJECEKSCGPM-MRXNPFEDSA-N 433.499 4.196 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCc2ccc(C)cc2OC[C@@H]2CCOC2)cc1 755127272 OWYTZYLQEZNIEN-OAQYLSRUSA-N 425.573 4.256 10 10 IICE C[C@H](NCc1ccc(CN2CCOCC2)cc1)c1cc(Br)cc(Cl)c1O 756365183 ZSUVYEQKEDETLQ-AWEZNQCLSA-N 439.781 4.491 10 10 IICE CN1CC[C@@H](NC(=O)NCc2cccc(Br)c2O)[C@H]1c1ccc(Cl)cc1 764798171 ASYOLIFHAKSING-IAGOWNOFSA-N 438.753 4.053 10 10 IICE Cc1ccc(NC(=O)C[C@@H](C)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)c(C)c1 773143585 BKJXLNIZYCADFJ-JOCHJYFZSA-N 434.628 4.342 10 10 IICE COc1cc(Br)ccc1[C@@H](C)NC(=O)NCc1ccc(N2CC=CC2)cc1 786776964 HNCMKBZKROTOAW-OAHLLOKOSA-N 430.346 4.394 10 10 IICE CN(c1ccc(CNC(=O)c2cc([N+](=O)[O-])ncc2Br)cc1)C1CCCCC1 798166368 WTYORQIJFKVFON-UHFFFAOYSA-N 447.333 4.451 10 10 IICE O=C(N[C@@H]1C[C@H]1C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1)OCc1ccccc1 814177174 XXEVBKGAUNDJNA-IZZNHLLZSA-N 449.595 4.050 10 10 IICE COc1cc(Cl)cc(CNC[C@@H]2CN(Cc3ccccc3)CC23CCOCC3)c1O 816644037 ZUMOCVSTMNBTRD-HXUWFJFHSA-N 430.976 4.073 10 10 IICE O=C(Nc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)cs2)cc1)C(F)(F)F 917846701 ZKSAHBUPDICPHF-UHFFFAOYSA-N 433.458 4.173 10 10 IICE COc1ccc(CCC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(Br)c1 1125518449 GGZDERDOQIAGSB-INIZCTEOSA-N 447.373 4.104 10 10 IICE CCCOc1nc2ccccc2cc1C(=O)N1CCN(c2ccc(OC)cc2OC)CC1 1132036656 UPLYRVWXPPHGGP-UHFFFAOYSA-N 435.524 4.003 10 10 IICE CC[C@@H](C)Oc1cccc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)n1 1132805972 ATTNCCWGNNGRJA-CYBMUJFWSA-N 445.431 4.195 10 10 IICE C[C@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1134686727 UGHSPYZJNSPGSW-IERDGZPVSA-N 437.506 4.249 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)C2([C@H](C)NC(=O)OC(C)(C)C)CCOCC2)cc1 1135946399 QNLLADLLNQTWTI-IBGZPJMESA-N 447.620 4.201 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2ccc3n2CCN(C(=O)OC(C)(C)C)[C@@H]3C)c1 1137473790 VYHCEVJERDGAPC-LSDHHAIUSA-N 429.517 4.005 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCCOc1cc(C)ccc1C 1137816793 RNDNQSFHLWABII-UHFFFAOYSA-N 433.932 4.413 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3c[nH]nc3-c3ccc(Cl)s3)cc2F)CC1 1144592132 DFQZEGGDYQNISD-UHFFFAOYSA-N 447.967 4.003 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1-n1c(C)cc(C=O)c1C 1147366506 CLXFBRLDCOSZKQ-QFIPXVFZSA-N 449.938 4.404 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCC[C@@H]3COc3ccc(Cl)cc3)C2)cc1 1230859246 UVFKPFJBZISXOG-UYAOXDASSA-N 429.948 4.180 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(OCc4ccccc4)ccc3O)CC2)cc1F 1294825044 ZHMCJEDTKVNNEJ-UHFFFAOYSA-N 436.483 4.081 10 10 IICE C[C@@H]1[C@@H](NC(=O)c2cc3cc(O)c(O)cc3s2)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C 1302197393 IPENGSBOIQQXJH-REBRKWNGSA-N 432.542 4.219 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCOC3)nnc2N2CCSC[C@H]2C)cc1 1313678188 BSXOEHGWIGNKDX-UYAOXDASSA-N 429.634 4.008 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)sc2c1CCCC2 1349326862 FYRSLGVNNYGLGI-ZDUSSCGKSA-N 446.956 4.449 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H](Cc3cccnc3)C3CCCC3)cc2F)C[C@@H](C)O1 1355131727 YLXWMEKPVBNGPH-SELNLUPBSA-N 439.575 4.500 10 10 IICE C[C@H](NC(=O)[C@H]1CCCCC[C@H]1NC(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 1357928356 NLGVVIXVJJTUPY-YUXAGFNASA-N 445.604 4.174 10 10 IICE O=C(CCCOc1ccccc1Cl)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1435572464 JTXPVUOYTLDNRF-UHFFFAOYSA-N 442.003 4.347 10 10 IICE CCCN(C)C(=O)[C@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C 1464679590 QWOPKOIRHWDDIQ-HXUWFJFHSA-N 434.005 4.060 10 10 IICE Cc1cc(CCNC(=O)N2CCC(Oc3ncccc3F)CC2)c(C)n1-c1ccccc1 1479063597 HNPSSHJDJGSCJM-UHFFFAOYSA-N 436.531 4.424 10 10 IICE COC(=O)[C@H](CC1CCCCC1)NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1516034988 ZJCMRPAYEBQQEU-NRFANRHFSA-N 426.557 4.157 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)CC1 1517892727 PEFLMRBRYIQVRK-OAQYLSRUSA-N 444.630 4.374 10 10 IICE Cc1ccc(NC(=O)Cc2ccc(O)c(O)c2)cc1S(=O)(=O)Nc1ccccc1Cl 1539538847 AQCIXTSCOUDKTR-UHFFFAOYSA-N 446.912 4.042 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H](C)CC(N)=O)n2Cc2cccs2)c(C)n1-c1ccccc1 1542179296 AWRHDSVKFTWPCU-INIZCTEOSA-N 448.596 4.163 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CCCN2CCCC[C@@H]2C)n1 1542564145 SOSQVSJVANXKPX-FQEVSTJZSA-N 434.588 4.255 10 10 IICE O=[N+]([O-])c1cccc(-c2nnc(N3CCSCC3)n2CCCSc2nccs2)c1 1556038038 IYZSUGXCUQGZHS-UHFFFAOYSA-N 448.599 4.045 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)CCCC1 1557180279 BRLVUFHILGJQJF-DLBZAZTESA-N 443.588 4.337 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2ccccn2)c1C)Cc1ccc2ccccc2c1 1565706917 LGWFHLVDFGVVMR-QHCPKHFHSA-N 441.531 4.404 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccc(COc2ccccc2Br)cc1 1593873444 PNEDXGWWHPUTIZ-UHFFFAOYSA-N 428.282 4.369 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C[C@@H](c3ccc(O)cc3)C3CC3)cc2F)C[C@@H](C)O1 1596693990 ATXMUXZFOQVYES-HYFFOGBASA-N 426.532 4.345 10 10 IICE CCOC(=O)C[C@@H]1CCN(C(=O)C2=CC[C@@H](NC(=O)OC(C)(C)C)C2)c2ccccc21 1616616652 UWSQDSZUMHPDKP-FUHWJXTLSA-N 428.529 4.074 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC=C(c2cn(C(C)C)nn2)CC1 1624930049 JYDLOXVYISDXPK-UHFFFAOYSA-N 431.540 4.399 10 10 IICE CS(=O)(=O)Nc1ccc(O)c(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)c1 1625449834 VTKNFNRPFCAOPH-HXUWFJFHSA-N 444.940 4.131 10 10 IICE Cc1cc(C(=O)N2CC(C)(C)[C@H]2[C@H]2CCCO2)c(C)n1-c1ccc(Br)cn1 1625680341 VCUMCNUXCQZQIR-IEBWSBKVSA-N 432.362 4.281 10 10 IICE CCOc1ccccc1C(=O)NCC(=O)NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1 1626169212 QGIHPGXWAUMHNM-QGZVFWFLSA-N 443.975 4.021 10 10 IICE COC(=O)[C@@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1cc(F)ccc1F 1627680149 NIVKOUAXTGROML-QFIPXVFZSA-N 440.446 4.137 10 10 IICE Cc1nc(-c2ccco2)ccc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1630257174 QBHDQTZFRHJPKK-SFHVURJKSA-N 425.916 4.403 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2n[nH]c(C3CC3)c2Br)cc1 1631512764 OABUFUTYHIEHSX-UHFFFAOYSA-N 445.283 4.320 10 10 IICE CC[C@@H](Cc1cn(C)c2ccccc12)NC(=O)NCc1cccc(Br)c1O 1637517190 ZQIMGBYEUZUZAS-INIZCTEOSA-N 430.346 4.467 10 10 IICE COc1cc(C(=O)NCc2ccc(O)cc2O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 1638351750 FQWDCVZOJPUHLX-UHFFFAOYSA-N 444.827 4.390 10 10 IICE Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NCc3cc(Cl)ccc3O)cc2)c1 1639965226 HQUGZIRDGPMEQX-UHFFFAOYSA-N 444.940 4.393 10 10 IICE CCN(CC(=O)Nc1sc2c(c1C(=O)OC)CC[C@H](C)C2)c1ccc(OC)c(OC)c1 1644917480 SANKRZPTAONNIG-AWEZNQCLSA-N 446.569 4.142 10 10 IICE CCN(CC)c1ccc(CNc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cc1 1651397053 KCCYCFMHAPLKPK-UHFFFAOYSA-N 431.436 4.347 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN[C@@H](C)c3ccc(SC(C)C)cc3)CC2)cc1 1653010972 HFWOTMDYXGACNO-NZQKXSOJSA-N 443.657 4.029 10 10 IICE C[C@@H](NC(=O)NC[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2)c1ccc(N(C)C)cc1 1671851952 NLNUMFFPERVXKA-WSCWJOSJSA-N 430.593 4.293 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CC(Oc4ccc([N+](=O)[O-])cc4)C3)c2C)c1 1684600591 VUCMUGHCNICMAK-UHFFFAOYSA-N 434.496 4.284 10 10 IICE CC(C)c1ccc(CN(C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C2CC2)cc1 1687632006 JBSSWEDQRRTCAJ-UHFFFAOYSA-N 448.611 4.386 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N2C[C@H](C)O[C@@H](C(F)(F)F)C2)nnc1C(C)(C)C 1707305896 PSVCSCVURLCQRQ-MAUKXSAKSA-N 439.526 4.154 10 10 IICE Cc1cc(-c2nnc(N(C)Cc3nccs3)n2C[C@H](C)N(C)C)c(C)n1-c1ccccc1 1724197663 ILGDEALASIHRGZ-SFHVURJKSA-N 449.628 4.396 10 10 IICE Cc1ccc(-c2nnc(N(C)Cc3ccc(N4CCCC4)cc3)n2C[C@](C)(O)C(C)C)o1 1742181173 QVASJXGYZUDKED-VWLOTQADSA-N 437.588 4.490 10 10 IICE CCc1nnc(N2CCC[C@@H](c3noc(C(C)C)n3)C2)n1CCCSc1nccs1 1744656124 DHLHHQZQELSXNK-OAHLLOKOSA-N 447.634 4.370 10 10 IICE CCC[C@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccc(N(CC)CC)cc2)CCO1 1763957380 JRKYZTGESXLSFY-QFIPXVFZSA-N 434.588 4.240 10 10 IICE COc1ccc2c(c1)c(/C=C1/SC(=S)N(Cc3ccc4c(c3)OCO4)C1=O)cn2C 1858589215 RLAQZZMEPIKGBX-DNTJNYDQSA-N 438.530 4.317 10 10 IICE C[C@@H]1CCCN(C(=O)Cn2c3c(c4ccccc42)CCN2C(=O)c4ccccc4N(C)[C@@H]32)C1 1860347511 SMFAOHRBFXMGTM-WXTAPIANSA-N 442.563 4.047 10 10 IICE Cc1ccc(-c2ccc(=O)n([C@@H](C)C(=O)NCc3ccc(N4C[C@H]5CC[C@H]4C5)cc3)n2)cc1 1890691291 QSGCPYORGZBYEU-PTLVVNQVSA-N 442.563 4.085 10 10 IICE O=C(NC1(C(=O)O)CC(c2cccc(O)c2O)C1)OCC1c2ccccc2-c2ccccc21 1952491193 FBBVHIPFDQVMCQ-UHFFFAOYSA-N 445.471 4.337 10 10 IICE O=C(O)c1nn(Cc2cccc(C(F)(F)F)c2O)c(C(F)(F)F)c1Br 2079142708 KFMCJQHPGSTTEZ-UHFFFAOYSA-N 433.102 4.135 10 10 IICE [N-]=[N+]=NC[C@H]1CCCN(C(=O)CC[C@H](NC(=O)OCc2ccccc2)C(F)(F)F)C1 2180964110 SLBBUVXCYIMAOU-CVEARBPZSA-N 427.427 4.173 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1C[C@H]2CC[C@H]1[C@H](NCc1cc(Br)ccc1O)C2 2232281991 NPXSFUXFGZVIHC-KKBVYLPWSA-N 425.367 4.326 10 10 IICE CCCN(CCC)c1nc2ccccn2c(=O)c1C=C1SC(=S)N([C@@H](C)CC)C1=O 2296546337 VJPJIKOJOFDNSY-HNNXBMFYSA-N 444.626 4.321 10 10 IICE COc1ccc(C2=NN(c3ccc([N+](=O)[O-])cc3)C(=O)C2=C(C)Nc2ccccn2)cc1 2313682331 AFQKESOVKJRGMA-UHFFFAOYSA-N 429.436 4.135 10 10 IICE CCN(CC)C(=O)COc1ccc(C=C2SC(=S)N(c3ccccc3O)C2=O)cc1 2321664167 LWAWOMARDSVVHU-UHFFFAOYSA-N 442.562 4.045 10 10 IICE Cc1cc(C(=O)COC(=O)c2cccc(C[S@@](C)=O)c2)c(C)n1-c1ccc(F)cc1 10236499 BIEDSQQBOKOUFI-PMERELPUSA-N 427.497 4.151 10 10 IICE CC[C@H](C)N1C(=O)/C(=C\c2cc3cc(C)ccc3nc2N2CCOCC2)SC1=S 208279822 FCWKYZIWHVLXCT-SJPXOZHESA-N 427.595 4.380 10 10 IICE CC(C)(C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc([N+](=O)[O-])cc1)N2 226791820 WKGVFLPSQQEGBS-DBXWQHBBSA-N 427.526 4.498 10 10 IICE CCCCOc1ccc(-c2nc3sc(=Cc4ccc(N(CC)CC)cc4)c(=O)n3n2)cc1 252675082 SWKKUMHGKVWUBL-UHFFFAOYSA-N 448.592 4.391 10 10 IICE CCN(CC)c1ccc(CNC(=O)NCc2cccc(COC3CCOCC3)c2)cc1F 732247608 IUDLLECGLIIOQB-UHFFFAOYSA-N 443.563 4.367 10 10 IICE CC(C)n1cc(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)cn1 743046774 QXTWYUKOOTVRPR-UHFFFAOYSA-N 433.378 4.212 10 10 IICE O=C(NCc1cc(-c2ccccc2)no1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743613241 DZQUYUSNAHQOQZ-KRWDZBQOSA-N 442.466 4.411 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3COc4c3ccc(Cl)c4Cl)CC2)cc1 743681713 FBZVKCPZRKRPGI-SFHVURJKSA-N 436.339 4.357 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3cc(C)oc3C)cs2)cc1Cl 749737648 JFTAOTYSLJEEAE-UHFFFAOYSA-N 426.903 4.261 10 10 IICE C[C@H](N[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Br)cc1O 757637839 MVSXXJLIKHZLHP-LRDDRELGSA-N 431.309 4.218 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2C)cc1 763565620 CLYANRGQSFFIJF-NQIIRXRSSA-N 432.609 4.320 10 10 IICE O=C(CCc1ccc(OC(F)F)cc1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768533748 SHTLZCMXLUAFIU-UHFFFAOYSA-N 443.538 4.069 10 10 IICE O=C(CSc1nccc2ccccc12)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768914198 CFKUCQDSTKJIMP-UHFFFAOYSA-N 446.620 4.175 10 10 IICE COc1cc([C@H](C)NCC(=O)NCc2ccc(N(C)C)cc2)ccc1OC1CCCC1 775007555 DTVQWCUKEOTHOE-SFHVURJKSA-N 425.573 4.050 10 10 IICE COc1ccc(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccc(Cl)cc2)c(O)c1 794378562 YPZZFRWGABERLI-CZAAIQMYSA-N 442.943 4.144 10 10 IICE Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)NCc1cc(Br)ccc1O 806232735 GEECJGPLTUTGAE-UHFFFAOYSA-N 446.345 4.457 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccn(-c4cccc(Cl)c4)n3)cc2F)C[C@H](C)O1 918161649 LOTFBPKIDJDUCU-HOTGVXAUSA-N 442.922 4.208 10 10 IICE Cc1nc(-c2ccccc2)ncc1C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1126584244 WFLAHWOIASQHLS-SFHVURJKSA-N 438.478 4.452 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4c(Br)cccc4cn3)C2)cc1 1130185761 QJFBYBIWAUXSSI-HNNXBMFYSA-N 440.341 4.262 10 10 IICE CN1CCCc2cc(CNC(=O)c3cc(-c4ccc(Br)cc4)[nH]n3)ccc21 1136436072 HVFOSJIEORSNJH-UHFFFAOYSA-N 425.330 4.152 10 10 IICE O=C(NCCCSc1nccs1)[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1 1136661902 TZAXGKFGYJHJNT-SFHVURJKSA-N 430.517 4.410 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC(=O)OCc3ccc(Cl)cc3)ccc21 1137794137 OJTIZPNULOLDPK-UHFFFAOYSA-N 428.916 4.031 10 10 IICE CCOC(=O)C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1ccc(Br)cc1 1153447860 NAPUUGSXBJKXDP-INIZCTEOSA-N 447.289 4.036 10 10 IICE O=C(Nc1ccc(C(=O)NCc2cccc(Cl)c2O)c(O)c1)c1cc(F)cc(F)c1 1159034405 VEJWRBZETWYUQW-UHFFFAOYSA-N 432.810 4.212 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@H](c2ccc(C)cc2)c2cccs2)ccc1N(C)C 1166714727 XQGYLPHFYQBVTB-HSZRJFAPSA-N 438.549 4.194 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@](C)(O)c3cccc(F)c3)cc2Cl)C1 1227207080 CAPHXNXNRKSKTQ-MWTRTKDXSA-N 433.955 4.422 10 10 IICE CC(C)c1nnc(N2CCN(Cc3ccsc3)CC2)n1CCCSc1nccs1 1287223137 LLNBBDMNTATHRL-UHFFFAOYSA-N 448.687 4.424 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(-n2ccnc2C)nc1 1291446069 ZHFBLOMHYZMEOK-KRWDZBQOSA-N 431.544 4.071 10 10 IICE CC[C@H](C)c1nnc(N2CC[C@@H](C)[C@H]2C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291492011 QBLSQGNXMDLEDH-XUVXKRRUSA-N 425.621 4.283 10 10 IICE Cc1cc(C(=O)NCCCCN2CCC[C@H](C)C2)c(C)n1-c1ccc(Br)cn1 1291559079 MORLBNKUNMWKOW-INIZCTEOSA-N 447.421 4.494 10 10 IICE Cc1cccc(OC[C@H](O)CNC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1294565344 UKWHDZAZSZJTJX-JOCHJYFZSA-N 426.944 4.155 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2nc(-c3ccccc3)n(-c3ccc(F)cc3)n2)c1 1294937802 TWMSYYIYMQVCCN-HNNXBMFYSA-N 432.455 4.279 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)CCCNC(=O)OC(C)(C)C)c1 1298460323 CKOOSNFLXFHRGD-INIZCTEOSA-N 427.545 4.330 10 10 IICE CC(C)CCN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1303048927 IFBJBAVJVVSROP-UHFFFAOYSA-N 448.615 4.079 10 10 IICE CCc1nnc(N(C)Cc2ccccc2O)n1C[C@@H]1CCCN(C)[C@H]1c1cccs1 1306080543 MJBPYVOCZWOGFD-PGRDOPGGSA-N 425.602 4.327 10 10 IICE CCc1ccc(CNC(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)s1 1307528646 JFRKEGPTPLSFPT-UHFFFAOYSA-N 428.579 4.466 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCc2ccc(OCc3ccccc3)cc2)N(C)C)cc1 1313086850 QFHCVYHUGHZIHI-AREMUKBSSA-N 446.595 4.434 10 10 IICE NC(=O)C1CCN(c2cccc(NC(=O)c3c(Cl)cccc3Br)c2)CC1 1354022642 DVNWOOFDOLRSHM-UHFFFAOYSA-N 436.737 4.057 10 10 IICE COc1ccc([C@@H](OC)[C@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 1357782144 AGPVSNWDAGPGOH-PPHZAIPVSA-N 449.595 4.309 10 10 IICE C[C@H](NC(=O)[C@@H]1C[C@]1(C)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1 1357927976 LEKJCIBGABGOQZ-JFJYTDJESA-N 443.385 4.441 10 10 IICE Cc1cc(-c2nnc(N3CC[C@H](C)[C@H](C)C3)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1361048673 FZPNTYWDXPZKIU-RBUKOAKNSA-N 448.615 4.313 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cccnc2)nnc1N1CC[C@H](OCC(C)C)C1 1361096217 XGGAGXUWNZXPRY-QHCPKHFHSA-N 434.588 4.014 10 10 IICE Cc1ccccc1CN1CCN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC1 1440432697 HUJTVEPDTUGSTQ-UHFFFAOYSA-N 429.564 4.481 10 10 IICE CCOC(=O)c1sc2ncnc(NC[C@@H]3CCN(c4ccc(OC)cc4)C3)c2c1C 1458443814 VOXRRWMPOOADBT-HNNXBMFYSA-N 426.542 4.123 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)Cc1c(F)ccc(Br)c1F 1459689753 YCMKYDJXPVAREX-UHFFFAOYSA-N 434.664 4.262 10 10 IICE C[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1460727467 QNZBGQBUVISLAH-GJZGRUSLSA-N 443.459 4.048 10 10 IICE Cc1ccc(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)cc1-n1c(C)cc(C=O)c1C 1464442340 OLZRXDKTRVVKLN-UHFFFAOYSA-N 430.483 4.470 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2cccc3nc(C(F)F)[nH]c23)cc1 1464601410 DRUSDRIEEYKNOM-QGZVFWFLSA-N 428.483 4.388 10 10 IICE CCCc1c(C(=O)N2CCN(c3ccc(OCC)cc3)CC2)cnn1-c1ccc(F)cc1 1466208816 RLRKLAXWNLLHEI-UHFFFAOYSA-N 436.531 4.325 10 10 IICE Cc1cc(C(=O)NCc2cnc(N3CCOCC3)s2)c(C)n1-c1ccc(C(C)C)cc1 1467595258 WQDVNVOGRKKGIA-UHFFFAOYSA-N 438.597 4.441 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C2CC2)cc1 1469685618 RLZKTIKUYJWENG-OAQYLSRUSA-N 444.938 4.025 10 10 IICE Cc1ccccc1-c1nnc(N(C)CCn2cccn2)n1CCCSc1nccs1 1492559578 GUSONKDZOHMKFK-UHFFFAOYSA-N 439.614 4.225 10 10 IICE CC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@@H]1CCOC1)OC 1497193689 OCSJKPXOFORIIM-UNMCSNQZSA-N 437.588 4.250 10 10 IICE COc1ccc(N2CCN(c3nnc(CC(C)C)n3CCSC(C)C)CC2)cc1F 1504296893 SHXQLLARYQUTCT-UHFFFAOYSA-N 435.613 4.093 10 10 IICE CCCC1(Cn2c(C(=O)Nc3ccccn3)nnc2N(C)Cc2ccccc2O)CCC1 1514355353 GETYJBSCXMLEOY-UHFFFAOYSA-N 434.544 4.238 10 10 IICE Cc1cc(C(F)F)n2ncc(C(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)c2n1 1526371121 ZPBAKAPXIDXKBS-UHFFFAOYSA-N 439.466 4.477 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)cc1 1545517041 HAODRJHPHIWXMM-VWLOTQADSA-N 434.536 4.086 10 10 IICE Cc1cc(C(=O)NC[C@H](CO)C2CCCCC2)c(C)n1-c1ccc(Br)cn1 1556807626 LWODCRKFZVSSRS-QGZVFWFLSA-N 434.378 4.170 10 10 IICE Cc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(Cc4cc(Cl)ccc4O)C3)n[nH]2)cc1C 1566356792 OACNHNJHDRLTKA-HXUWFJFHSA-N 438.959 4.447 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(Nc2nccs2)cc1F 1586863878 ABPUCNXUZJBCFB-UHFFFAOYSA-N 444.507 4.056 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NCCNc2ccc(C(F)(F)F)cn2)CCCC1 1597900630 FDGOAIHVILQLEU-UHFFFAOYSA-N 446.473 4.171 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1C[C@H](C)O[C@@H](C(F)(F)F)C1 1611963528 SPUDLGVQZVUEFF-QFBILLFUSA-N 439.526 4.055 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 1615770688 AZXIILMVDXODRP-RTBURBONSA-N 442.627 4.183 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1CCC1=CCCCC1 1616684245 OZCPPAJYGTVDJK-UHFFFAOYSA-N 439.604 4.178 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccc[nH]4)n3CCC(C)(F)F)CC2)cc1 1619301695 VFGTZVVQTCQKCB-UHFFFAOYSA-N 430.503 4.044 10 10 IICE CSCC[C@@H](CC(=O)N(C)Cc1ccc(N2CCCC2)cc1)NC(=O)OC(C)(C)C 1623549485 DCZXBCGVAMZRIK-IBGZPJMESA-N 435.634 4.282 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)CCc1ccc(-c2ccccc2F)o1 1627014106 RZNKEIOSUWAGCC-UHFFFAOYSA-N 425.456 4.316 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)c1 1629809799 FAAQMKCZMQYGML-ZHRRBRCNSA-N 439.556 4.282 10 10 IICE CC(C)(C)OC(=O)CC[C@H]1C[C@@H](C(=O)N(Cc2ccco2)Cc2ccccc2O)CO1 1629944019 ZCXBYKFFSSHHNV-MOPGFXCFSA-N 429.513 4.041 10 10 IICE CCOC(=O)[C@H](Cc1cc(Cl)cc(Cl)c1)NC(=O)c1ccc(N=NC(N)=O)cc1 1631392822 OUMKOVAACWYDRP-INIZCTEOSA-N 437.283 4.060 10 10 IICE O=C(N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1)[C@H](c1ccncc1)C1CCCC1 1631425348 CMFDMABYBOSMJU-GMAHTHKFSA-N 427.976 4.495 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NCCCCN2C(=O)c3ccccc3C2=O)c1C 1633751262 ONHOTYNBUMXKGV-UHFFFAOYSA-N 429.520 4.209 10 10 IICE Cc1cc(C)cc(C(=O)NCC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1634023046 UYMNWXFEMDRFRF-MRXNPFEDSA-N 427.976 4.239 10 10 IICE C[C@@H](NC(=O)N1C[C@H](CCNC(=O)C(F)(F)F)c2ccccc21)c1ccc(N(C)C)cc1 1634434370 BJDSLGDIBUZSHO-WBVHZDCISA-N 448.489 4.196 10 10 IICE COC[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc(C)n(-c2cccc(C)c2)c1C 1637190770 GBKFUVJTLJYYSO-OAQYLSRUSA-N 441.572 4.110 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)cc1 1638384758 RXMHZVOFNAYKGR-LJQANCHMSA-N 448.361 4.059 10 10 IICE COc1cncc(C(=O)N[C@@H]2CCCc3c2cc(C)n3-c2cccc(C(F)(F)F)c2)n1 1650744340 WKBIZWRDVGSJKQ-QGZVFWFLSA-N 430.430 4.411 10 10 IICE CCN(CC(=O)NCCc1ccc(OC(C)C)cc1)Cc1cc(Br)ccc1O 1652595460 KQMJDBBJVZUZAA-UHFFFAOYSA-N 449.389 4.123 10 10 IICE CCN(C)c1ccc(CN2CCC[C@H](C(=O)Nc3ccc(Br)cn3)C2)cc1 1652865116 KYOSWBGWKWUCLV-KRWDZBQOSA-N 431.378 4.151 10 10 IICE CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1673472359 IUPSUJVTHJNTPL-FQEVSTJZSA-N 431.527 4.273 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)N[C@@H](c1ccc(F)c(F)c1)c1nccn1C 1676658806 NZERJQXOAUTFLA-QFIPXVFZSA-N 439.510 4.230 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 1680702688 AYCSEWWCDMHVCK-KRWDZBQOSA-N 446.954 4.271 10 10 IICE COC(=O)CCC1CCN(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)CC1 1681827844 LOCJPHGIHACYRA-KRWDZBQOSA-N 435.996 4.451 10 10 IICE CC[C@H](C)c1nnc(N(C)Cc2cc(C)on2)n1Cc1ccc(N2CCSCC2)cc1 1694001520 YAYUCWVJKGPHJA-KRWDZBQOSA-N 440.617 4.326 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCN1CCCC(C)(C)C1 1698264801 QDWFYOHOIUMUCV-UHFFFAOYSA-N 436.604 4.472 10 10 IICE CCN(CC)c1ccc(Cn2c(C3CCC3)nnc2N(C)CC2COC(C)(C)OC2)cc1 1710026790 PMSWCVWXCJRJLD-UHFFFAOYSA-N 441.620 4.275 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccsc3)nnc2N2CC[C@H](OC)C2)cc1 1728384066 JHEIFTOGPMSUEJ-NRFANRHFSA-N 425.602 4.050 10 10 IICE CC(C)Cc1nnc(N2CCC([C@H]3CCOC3)CC2)n1CCCSc1nccs1 1741451690 MDOFGTXWDYUWAZ-SFHVURJKSA-N 435.663 4.368 10 10 IICE CC(C)c1nnc(N(Cc2ccco2)C[C@@H]2CCCO2)n1Cc1ccc(N(C)C)c(F)c1 1750617106 RABIVDCHZWPASN-FQEVSTJZSA-N 441.551 4.434 10 10 IICE Cc1cccc(-c2nnc(N3CCO[C@@H](C(C)(C)C)C3)n2Cc2ccc(N(C)C)cc2C)n1 1751623561 QVMSSNPAPWQWPS-HSZRJFAPSA-N 448.615 4.323 10 10 IICE Cc1nc(Cc2nnc(N(C)Cc3ccco3)n2Cc2ccc(N(C)C)cc2C)cs1 1762265817 AVMIYKOALFLHLX-UHFFFAOYSA-N 436.585 4.286 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CCOC(C)(C)[C@H]2C)cc1 1766610963 XLGCOGZTYORTPG-LJQANCHMSA-N 434.588 4.238 10 10 IICE CCOC(=O)c1c(NC(=O)C(=O)Nc2ncccc2C)sc(C)c1-c1ccc(F)cc1 1860746800 FIURKIJSZTWGHD-UHFFFAOYSA-N 441.484 4.320 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(-c4ccc5ccccc5c4)nn3C)CC2)cc1 1892027568 VDBBPUJSEZCEFW-UHFFFAOYSA-N 426.520 4.211 10 10 IICE COC(=O)c1c(C(F)F)nn([C@@H](c2ccc(OC)cc2O)C2CC2)c1Br 2079875123 OVHYQRGQWSDUPS-CQSZACIVSA-N 431.233 4.083 10 10 IICE NCc1ccc(N2CCN(Cc3ccccc3)C[C@@H]2C(F)(F)F)c(Br)c1 2130167560 GGJJFVAADJFAGP-GOSISDBHSA-N 428.296 4.161 10 10 IICE Cc1cc(C=C2C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)c(C)n1Cc1ccccc1 2296398176 YRSFZWTVVRFCKN-UHFFFAOYSA-N 431.443 4.335 10 10 IICE Cc1ccc(CN(C)C(=O)CCN(C(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2380759319 MWROUAVEGSQNEF-UHFFFAOYSA-N 443.382 4.457 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cc(Cl)ccc2O)SC1=S)NCc1ccccc1 15043664 KVCMXHJCTXTBSN-PDGQHHTCSA-N 446.981 4.343 10 10 IICE CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C/c1cc(C)n(-c2ccc(C)c(C)c2)c1C 101495342 LXIVKPPZHDKFDR-HZHRSRAPSA-N 436.552 4.420 10 10 IICE COc1ccc(N2CCCN(C(=O)C3(c4ccc(Cl)cc4)CCOCC3)CC2)cc1 108938545 QXSLGKGTARDKGZ-UHFFFAOYSA-N 428.960 4.136 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)c2cnn(C(C)C)c2n1 117528410 ORXDYEYCMQSFAD-UHFFFAOYSA-N 439.535 4.041 10 10 IICE CCN(Cc1ccccc1NC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)C(C)=O 435558026 USEXSVFPSNNSQR-UHFFFAOYSA-N 446.595 4.415 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)[C@@H]2CCCN(C3CCC3)C2)C1 436026699 KBYRJOHCBPFQTA-LEWJYISDSA-N 436.644 4.177 10 10 IICE COc1ccc(NC(=O)CSc2ccccc2C(=O)N2CCSC[C@@H]2C)cc1OC 737709979 PSNBMIDVYYHQPR-HNNXBMFYSA-N 446.594 4.012 10 10 IICE CC(C)[C@H](C)CNC(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S 739631753 YNBZWLFAEKVAHC-AZZDOICSSA-N 441.416 4.059 10 10 IICE CN(CCCC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)C(=O)OC(C)(C)C 742806923 VEUWZXYBFFFIFL-INIZCTEOSA-N 441.519 4.020 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)Nc1ccc(OC)c(OC)c1OC 743139570 HIZSLHHNFWDUSG-UHFFFAOYSA-N 439.306 4.235 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H]1C[C@H]1C 764894389 GSTAFOUYAVQTRM-VQIMIIECSA-N 439.556 4.027 10 10 IICE COc1cccc(N2CC[C@@H](CN[C@H](C)c3ccc(N4CCOCC4)cc3Cl)C2)c1 765638785 QJPIKTRMXYMBPQ-MOPGFXCFSA-N 429.992 4.362 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COC(=O)c3csc(Cl)n3)c2C)cc1 781221851 YTNQSPPWTXUOPM-UHFFFAOYSA-N 432.885 4.030 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)Cc2cnc3ccccc3c2)NC(=O)OC(C)(C)C)cc1 784420401 DWBCFNSQMIBTHG-HSZRJFAPSA-N 448.567 4.226 10 10 IICE CN(CCC(F)(F)F)[C@@H](CNCc1cc2c(cc1O)OCO2)c1ccc(Cl)cc1 790602410 VQEPBQNIIQJYGX-INIZCTEOSA-N 430.854 4.489 10 10 IICE COc1ccc(CNC(=O)C(C)(C)[C@@H](O)c2ccc(OCc3ccccc3)cc2)c(O)c1 794390692 OTKZDDYIVUSZKU-DEOSSOPVSA-N 435.520 4.356 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N[C@H]1C[C@@H]1c1ccccc1OC(F)F 798057468 NYEURMJEVJWCKK-MOPGFXCFSA-N 433.524 4.197 10 10 IICE Cc1cc(/C=C2/C(=O)NC(=S)N(c3ccccc3F)C2=O)c(C)n1-c1cccc(F)c1 1084439894 NOGOQFQLWIJUIL-WQRHYEAKSA-N 437.471 4.204 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)N(C)C)cc1 1134681988 PKYIIJJNKZRGDE-OAQYLSRUSA-N 446.382 4.278 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3c(Cl)cccc3Br)CC2)cc1F 1137422461 CHTRSABLHDHSSZ-UHFFFAOYSA-N 441.728 4.142 10 10 IICE O=C(NCc1cc2c(s1)CCCC2)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1141844915 OJRYVEXWQRGHNT-UHFFFAOYSA-N 448.591 4.125 10 10 IICE CCc1nc2ccc(Cl)cn2c1C(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1142712545 CPCPONGTOSUMQN-HXUWFJFHSA-N 440.975 4.438 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@H]2CO)c1C 1150369403 VEMZTPVSGCHATC-ZCYQVOJMSA-N 431.580 4.015 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1 1152396196 VAYXAICBSXGNSH-HYBUGGRVSA-N 443.547 4.429 10 10 IICE Cc1cc(C(=O)NCC(C)(C)C2(O)CCCC2)c(C)n1-c1ccc(Br)cn1 1161880528 BTAFHPMLCLBQPL-UHFFFAOYSA-N 434.378 4.313 10 10 IICE CC(C)(C)OC(=O)N1[C@H](CCC(=O)NCc2ccc(N3CCCCC3)cc2)COC1(C)C 1162801303 XGBPOGVDZJNDKL-OAQYLSRUSA-N 445.604 4.445 10 10 IICE CC(C)(C)c1ccc2c(c1)CCN(C(=O)NCc1cc(F)c(N3CCOCC3)c(F)c1)C2 1251750989 SMCAXAMAPGCIML-UHFFFAOYSA-N 443.538 4.367 10 10 IICE CCOC(=O)c1c(NC(=O)c2cn(C)nc2COC)sc(C)c1-c1ccc(C)cc1 1264262902 BBPMFMXJMAUORI-UHFFFAOYSA-N 427.526 4.341 10 10 IICE O=C(C/C=C\c1ccc(Br)cc1)NCc1ccc(N2CCOCC2)c(F)c1 1264687792 KAIOCULACDDZNF-UPHRSURJSA-N 433.321 4.145 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CCC[C@H]1[C@H]1CCCO1 1289423166 HDYRXNOTRNSKHK-FCHUYYIVSA-N 425.621 4.437 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCN(C(=O)CCc4ccccc4)C3)c2C)c1 1295040821 AKSXPFPFWCQKPT-HSZRJFAPSA-N 429.564 4.366 10 10 IICE Cc1ccc(C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)cc1-n1c(C)cc(C=O)c1C 1298023466 BDPJZAYHNLOVCD-JRFVFWCSSA-N 448.567 4.339 10 10 IICE COC[C@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@@H](C)[C@@H](C)C1)OC 1315795323 JVXPZIYXMWKMDO-SVMVAKDDSA-N 437.588 4.106 10 10 IICE C[C@@H]1CN(c2nnc(C3CCC3)n2Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(F)(F)F 1316491878 UGCRECLCQJNAGQ-CZUORRHYSA-N 425.474 4.434 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)[C@H](c1ccc(Br)cc1)N1CCCC1 1360274179 WFHIUHGLDBXEQB-NRFANRHFSA-N 430.390 4.277 10 10 IICE CCC[C@@H](C)C(=O)NCCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1450025277 SXLLPYWSMAWTTD-CQSZACIVSA-N 434.378 4.139 10 10 IICE Cc1cc(CNC(=O)[C@H]2[C@@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1454622753 CUVWANBOUPKNPJ-WIYYLYMNSA-N 441.572 4.471 10 10 IICE COc1cccc(C2=NO[C@@H](C(=O)NCc3ccc(N4CCC[C@H](C)C4)c(Cl)c3)C2)c1 1459579165 LEQYKXGQXFOCCQ-QMHKHESXSA-N 441.959 4.394 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2CC2(N(C)C)CCCCC2)n1 1492500093 PEYRSEVXTODKRX-UHFFFAOYSA-N 434.588 4.255 10 10 IICE CCC[C@@H]1CN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)CCO1 1500232219 JHPTVXDKSKBUKR-DENIHFKCSA-N 443.661 4.398 10 10 IICE CS[C@@H]1CCCCN(c2nnc([C@H]3CCOC3)n2CCCSc2nccs2)C1 1505221486 YSGUSBJVNQIATK-JKSUJKDBSA-N 439.676 4.143 10 10 IICE Cc1cc(-c2nnc(N3CCN(C)C(=O)[C@H]3C)n2CCC(C)C)c(C)n1-c1ccccc1 1510618328 JOACZZNTOJGXRK-HXUWFJFHSA-N 434.588 4.066 10 10 IICE COc1ccc(N2CCCN(c3nnc(C4CCCC4)n3C[C@H](C)SC)CC2)cc1 1518308991 NWJOGHUQWGVTCL-SFHVURJKSA-N 429.634 4.413 10 10 IICE COC(=O)c1cc(C(C)(C)NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)no1 1524198928 VDYLFLJYEYEQOR-UHFFFAOYSA-N 429.904 4.116 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1[C@H]2c3ccc(Br)cc3C[C@H]21 1536550937 VLFHOTJCNBPEBN-ITGOXPRASA-N 427.386 4.457 10 10 IICE Cc1cc(CC(=O)N[C@H]2CCN(C3CCCCC3)C2=O)c(C)n1-c1ccc(Cl)cc1 1557610199 KGDUGFPTZVJXLS-QFIPXVFZSA-N 427.976 4.340 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@]3(Cc4ccc(Cl)cc4)CCCOC3)C2)cc1 1565055826 LQONRJBALYANEJ-GBXCKJPGSA-N 443.975 4.018 10 10 IICE CCOc1ccc(N2CCN(C(=O)CCOc3ccc(C)cc3Br)CC2)cc1 1566562962 QNNDMHLDRRMEPW-UHFFFAOYSA-N 447.373 4.274 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)Nc1cnn(Cc2ccc(Br)cc2Cl)c1 1570158742 IRNOZQNYTXTEMA-KXFIGUGUSA-N 448.704 4.410 10 10 IICE O=C(c1cc(NS(=O)(=O)c2cccs2)ccc1O)N1CCCC[C@@H]1CC1CCC1 1585376070 IEQVWMYBEDIIKC-QGZVFWFLSA-N 434.583 4.439 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)N(C)C)cc1 1586055074 UUOFVRHCQMMROZ-NRFANRHFSA-N 442.510 4.038 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]3C)ccc21 1597789345 VAMHUDNNUOTQCW-RBUKOAKNSA-N 443.588 4.374 10 10 IICE COC(=O)C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccc(C(F)(F)F)cc1 1603555358 PMYQXSBYEKPQOM-CYBMUJFWSA-N 439.411 4.366 10 10 IICE Cc1cc(C(=O)NCc2nc(C(F)(F)F)no2)c(C)n1-c1ccccc1Br 1611398504 XUKIWANVPXZQAC-UHFFFAOYSA-N 443.223 4.188 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2CO)c1C 1623202235 AAGGHCLKRRHWGA-ZCYQVOJMSA-N 431.580 4.015 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccccc2Cn2cccn2)cc1 1624706410 ACAWDNPYCMSJCQ-UHFFFAOYSA-N 426.520 4.010 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccc3ccncc3c2)NC(=O)OC(C)(C)C)cc1 1628496364 XDYWSTSQMBWXSP-JOCHJYFZSA-N 434.540 4.297 10 10 IICE CCn1cc(C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(-c2ccccc2)n1 1630263422 WWFAIAZAAWTSLE-HXUWFJFHSA-N 438.959 4.323 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](O)c1ccc(C(F)(F)F)cc1 1630280331 KACJNPRPAUOTLZ-CRAIPNDOSA-N 444.400 4.125 10 10 IICE Cc1cc(C(=O)N[C@H](C2CCOCC2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 1631241106 YODUUYPIHPFXNO-JOCHJYFZSA-N 430.976 4.435 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 1631562851 DJFYGMQUHZOCSN-UHFFFAOYSA-N 427.844 4.355 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@]3(O)CCCN(Cc4ccccc4)C3)c2C)c1 1631793815 HZDATJFXVSXCDL-HHHXNRCGSA-N 431.580 4.046 10 10 IICE O=C(Cc1nc(C(F)(F)F)cs1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1634752909 ALPXHSVQUIRTIO-LLVKDONJSA-N 435.418 4.091 10 10 IICE CC(C)CNS(=O)(=O)c1cc(C(=O)N[C@@H](C)c2ccccc2O)c(Cl)cc1Cl 1635798835 DHNIMQDFRBIGRD-LBPRGKRZSA-N 445.368 4.124 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H]([C@H]3CCCO3)C2)sc(C)c1-c1ccccc1 1648269567 BXTKFVYAZFSNJC-RBUKOAKNSA-N 442.581 4.340 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N1CCc2cc(O)ccc2C1 1648941168 NMJGLIDBCACBQR-PDGQHHTCSA-N 444.603 4.020 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N3CCN(c4ccc(Cl)cc4Cl)CC3)C2)cc1 1682647485 XVQOVSDMUAKUIB-QGZVFWFLSA-N 449.382 4.113 10 10 IICE CC(C)(C)OC(=O)NCCCCCCNC(=O)NCc1cccc(Br)c1O 1683348743 FGTAZJATTFCYPX-UHFFFAOYSA-N 444.370 4.039 10 10 IICE CCN(CC(C)C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1728337371 CAALSCLDMBEFCS-UHFFFAOYSA-N 429.584 4.442 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCCCO2)n1CCCCCN1CCCC1 1729420153 IMAAZPYKEPKTLF-QFIPXVFZSA-N 427.593 4.128 10 10 IICE Cc1nc(Cc2nnc(N(C)CC3CC(F)C3)n2Cc2ccc(N(C)C)cc2C)cs1 1742567019 KEPOOJPUXVVYBD-UHFFFAOYSA-N 442.608 4.241 10 10 IICE C[C@H]1C[C@@H]1n1c([C@@H]2CCCN2C(=O)OC(C)(C)C)nnc1N(C)Cc1ccccc1O 1752054210 XPNIQPYALJPLMY-SZMVWBNQSA-N 427.549 4.273 10 10 IICE CNC(=O)CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H]1CC[C@H](C)C1 1767766290 DNPNAMLOTYJVPL-RXVVDRJESA-N 448.615 4.361 10 10 IICE O=C(O)[C@H](Cc1ccc(O)cc1)N1C(=O)/C(=C\c2c(F)cccc2Cl)SC1=S 1858591956 DLPYNADYUZVDAG-WNLSXJKCSA-N 437.901 4.082 10 10 IICE COc1ccc(C2=NN(c3ccc(OC)cc3)C(=O)/C2=C/c2cccc(OC)c2O)cc1 1865658621 PEBTXKFVQPDSGS-RCCKNPSSSA-N 430.460 4.253 10 10 IICE CCOc1cc(/C=C2\C(=O)N(CC(C)C)N=C2C(F)(F)F)cc(Br)c1O 1865667134 GORHCOPXRLSUKA-WZUFQYTHSA-N 435.240 4.353 10 10 IICE CC(C)c1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2CCO[C@@H](C)C2)n1 1868227993 IRWCGBFUYJKEAW-INIZCTEOSA-N 442.519 4.344 10 10 IICE CCOC(=O)c1ccc(CN2C(=O)C(O)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)cc1 1872956238 FUNJXGCOQWNIND-UHFFFAOYSA-N 444.487 4.109 10 10 IICE CCCCN1C(=O)C(NCc2ccccn2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873163885 AZJZGASIKNQATI-UHFFFAOYSA-N 428.536 4.159 10 10 IICE Cc1ccc([C@H](C(C)C)n2nc(C3CCC3)c(CN)c2I)c(O)c1 2079006004 UBBOVJUVVCRZLH-SFHVURJKSA-N 439.341 4.473 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@@H]1NCc1c(O)cccc1Br 2144130940 SRSDMIWWBWSAKT-PKOBYXMFSA-N 433.346 4.435 10 10 IICE CC(C)(C)OC(=O)NC1(c2csc(=NCc3ccc(Br)cc3O)[nH]2)CC1 2224314296 IVKOAUBJEXJADO-UHFFFAOYSA-N 440.363 4.159 10 10 IICE COc1cc(C=C2SC(NC(C)=O)=NC2=O)cc(Cl)c1OCc1ccccc1F 2293188506 QBKVGEIORPJMJK-UHFFFAOYSA-N 434.876 4.173 10 10 IICE COc1cccc(C=C2SC(=S)N(NC(=O)c3ccc(C)cc3Cl)C2=O)c1OC 2294216537 XPVOFAOSVHCNEU-UHFFFAOYSA-N 448.953 4.212 10 10 IICE O=C(CCCN1C(=O)C(=Cc2ccc(F)cc2)SC1=S)Nc1cccc(C(=O)O)c1 2296881414 GFFQDVIYYUBYKB-UHFFFAOYSA-N 444.509 4.144 10 10 IICE CCOc1cc(C=C2C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCOc1cccc(C)c1 2297347407 DHDWHGLADFKKNM-UHFFFAOYSA-N 447.491 4.302 10 10 IICE COc1cc(C=C2SC(=S)N(Nc3nc4ccccc4s3)C2=O)cc(OC)c1O 2314818131 AJMHIDRHKKJJKL-UHFFFAOYSA-N 445.547 4.247 10 10 IICE CN(C)c1ccc([C@H](NC(=O)C=Cc2ccc(Br)cc2)c2nccn2C)cc1 2329604521 XNVTWUVYHAFDBR-NRFANRHFSA-N 439.357 4.168 10 10 IICE Cc1ccc(C)c(S(=O)(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)c1 17026509 NHTYOULLGQNBTG-VWLOTQADSA-N 449.620 4.452 10 10 IICE CC(=O)N(C(=O)C(=O)Nc1ccc(-c2nc3ccc(C)cc3s2)cc1)c1ccc(N)cc1 170318975 XKLFRYSSSOZRHX-UHFFFAOYSA-N 444.516 4.372 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)[C@@H]3C[C@@H]3c3cccc4ccccc34)CC2)cc1 730769381 FDPAVVJIXDFGML-KAYWLYCHSA-N 443.591 4.280 10 10 IICE C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 754143817 XEQAZGXVKJHOSR-GNBKXHOFSA-N 427.476 4.067 10 10 IICE CN1CC[C@H](NC(=O)NCc2ccc(N3CCCC3)cc2)[C@@H]1c1ccc(Cl)c(F)c1 754842989 WNNHPHZPKIMWDU-VXKWHMMOSA-N 430.955 4.324 10 10 IICE O=C(O)CCCCCN1C(=O)/C(=C\c2ccc(Br)c(F)c2)SC1=S 763114705 SSICNCUFJYRRAP-UKTHLTGXSA-N 432.336 4.434 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Nc3cnn(CC(C)C)c3C(C)C)cc2F)CC1 766521869 KBDDABLMKNTSRI-UHFFFAOYSA-N 444.599 4.265 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)O[C@@H](C)C(=O)c2c[nH]c3ncccc23)C1 769662366 AKUJTWIXOBDHFJ-KRWDZBQOSA-N 444.535 4.099 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)[C@H]1CCCc2cccnc21 776118227 NSIKVIDLAOFEBT-QHCPKHFHSA-N 440.563 4.181 10 10 IICE C[C@H](NC(=O)N1CCCC[C@H]1c1nnc(CC(F)(F)F)o1)c1ccc(N(C)C)cc1 812200065 NTWIEUNWKKSJFT-BBRMVZONSA-N 425.455 4.238 10 10 IICE COc1ccc(N2CCC(NC[C@@H]3CN(Cc4ccccc4)CC34CCOCC4)CC2)cc1 815149328 JBEITSZMUOBECP-XMMPIXPASA-N 449.639 4.182 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OC)c(OC)cc2NC(=O)[C@H]2C[C@@H]2C)cc1 918625370 YXQWEWPEGLMGFN-LPHOPBHVSA-N 439.556 4.075 10 10 IICE CCCOc1ccc(OC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)cc1 1124175198 LNGOXSZBHFZMSB-UHFFFAOYSA-N 431.400 4.378 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cnc(OCC4CC4)c(Cl)c3)cc2F)C[C@@H](C)O1 1125259226 XVKPAMZHEJMIKF-HUUCEWRRSA-N 447.938 4.207 10 10 IICE Cc1c(Cl)cncc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1129452278 JZVDCMPGNXIZSA-LZYBPNLTSA-N 435.933 4.413 10 10 IICE COc1ccc(N2CCCN(C(=O)[C@]3(C)CC(c4cccc(Cl)c4F)=NO3)CC2)cc1 1141984991 BDOKCCYLMFFSOI-QHCPKHFHSA-N 445.922 4.110 10 10 IICE COCCN1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)C(C)(C)C1 1144645475 YCAQXMQYHIQZNH-UHFFFAOYSA-N 448.405 4.039 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cccc(C(F)(F)F)c1N 1156287327 MTUPWOYQMTXDRO-UHFFFAOYSA-N 437.462 4.290 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCCC1 1176055494 PBSMUTDJTHYMRQ-JOCHJYFZSA-N 446.469 4.397 10 10 IICE C[C@@H](NC(=O)N1CCN(c2ccc(Br)cc2)CC1)c1ccc(N(C)C)cc1 1226648037 YLTNYWVHNBGBSB-MRXNPFEDSA-N 431.378 4.108 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3nc4c(s3)COCC4)cc2Cl)C1 1235833253 JXMKWSVTELXRTA-CQSZACIVSA-N 434.993 4.105 10 10 IICE C[C@@H](NC(=O)NC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1O 1251848881 JLHJVVVZAUUUCW-OAHLLOKOSA-N 432.362 4.180 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1nc(C2CC2)cs1 1295352466 JINBAJJLDYVJKX-SXGWCWSVSA-N 447.582 4.067 10 10 IICE CS[C@@H]1CCCCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1 1316428960 VYGCVXJJMYUYBI-OAQYLSRUSA-N 436.629 4.485 10 10 IICE Cc1cccc(CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)Cc2cccc(C)n2)n1 1341604598 LDBWQGBHQRDBFO-UHFFFAOYSA-N 433.575 4.187 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1F 1350662747 JJWLALUKZJYIKF-LICLKQGHSA-N 434.489 4.203 10 10 IICE CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@@H](CC)CN1C(=O)OCc1ccccc1 1444317957 HBBUIHBKTYJFEC-OALUTQOASA-N 426.513 4.058 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc4c(Br)cncc4s3)CC2)cc1 1446420028 ONFUUJFHCNDELA-UHFFFAOYSA-N 446.370 4.420 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CC=C(c2ccccc2)C1 1446737866 FNEQIUDGFVGBEC-ZHZULCJRSA-N 438.549 4.343 10 10 IICE COC(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)s1 1451851172 PHIMWRBCBITNLD-UHFFFAOYSA-N 448.342 4.030 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CC[C@]3(CO[C@H](C)[C@@H]3C)O2)c(C)n1-c1ccc(Cl)cc1 1462838652 HMINLPVUKQKIAT-GMFNRUBGSA-N 430.976 4.379 10 10 IICE CC(C)OC(=O)C[C@@H](NC(=O)c1cc2cc(O)c(O)cc2s1)c1ccccc1[N+](=O)[O-] 1463784375 MGWIVIHNOLYXHI-CQSZACIVSA-N 444.465 4.034 10 10 IICE CCN1CCN(Cc2ccc(CNC(=O)c3cc(C)ccc3-n3c(C)ccc3C)cc2)CC1 1464157247 FSGGDWZGKGHIAX-UHFFFAOYSA-N 444.623 4.470 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H](C)Oc3ccc(C)cc3Br)CC2)cc1 1466208367 HGZSBXRKDCZBJI-QGZVFWFLSA-N 447.373 4.272 10 10 IICE CCO[C@@H]1C[C@H](NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)[C@H]1Oc1ccccc1 1467367751 QHYITCAJVDWATM-ZWEKWIFMSA-N 446.547 4.190 10 10 IICE Cc1cccc(-c2nnc(N(C)CC3CC(F)C3)n2Cc2ccc(N(C)C)c(F)c2)n1 1492501606 RFTVJESRIKUCML-UHFFFAOYSA-N 426.515 4.086 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)[C@H](C)c2ccc([S@](C)=O)cc2)CCCC1 1515298357 RHLSVNOJTMXPGG-INZIPBBXSA-N 438.593 4.486 10 10 IICE Cc1cc(CNC(=O)[C@@H]2CO[C@@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1535142457 BILBLVGQJWMVBA-UNMCSNQZSA-N 426.557 4.237 10 10 IICE CC(C)(C)OC(=O)N1CCc2cc(C(=O)NCCCSc3nccs3)sc2C1 1542957690 DWVXJDLUYFIAQZ-UHFFFAOYSA-N 439.628 4.410 10 10 IICE CCC[C@H](C)N(C)c1nnc([C@@]2(OC(C)C)CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1546880101 UACWKTQNYWLLLX-MHECFPHRSA-N 447.599 4.197 10 10 IICE CC(=O)N1CC[C@H](C)c2ccc(S(=O)(=O)N(Cc3ccc(N(C)C)cc3)C(C)C)cc21 1561150273 AZUIJPYBFPOMOE-SFHVURJKSA-N 443.613 4.212 10 10 IICE Cc1cccc2c1C[C@@H](C(=O)NCCCSc1nccs1)N2C(=O)OC(C)(C)C 1565620551 VTFCEGSNTZRONT-KRWDZBQOSA-N 433.599 4.416 10 10 IICE COc1cccc([C@@H](C)N2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)c1 1565679842 CMZKTWPUEHOQPJ-HXUWFJFHSA-N 445.563 4.434 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1cc(Cl)c(OCC(C)C)c(OC)c1 1570514711 MBIRKUMZWPOFBI-UHFFFAOYSA-N 449.931 4.295 10 10 IICE Cc1cc(C(=O)NCc2cc3n(n2)CCCC3)c(C)n1-c1ccccc1Br 1570914299 AEOCVCHNLOHLGN-UHFFFAOYSA-N 427.346 4.319 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)c(C)n1[C@H]1CCCOC1 1598290934 IFUGGXZUXRZJOD-BJKOFHAPSA-N 439.600 4.344 10 10 IICE CCN(CC)c1ccc(Cn2c(Cn3nc(C)cc3C)nnc2N2CC[C@@H](C)[C@@H]2C)cc1 1615381989 JLITZYGKKACQTK-NQIIRXRSSA-N 435.620 4.269 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCSc2ccccn2)NC(=O)OC(C)(C)C)cc1 1618253563 OONDEJJGZBGNFC-IBGZPJMESA-N 444.601 4.012 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1ccc(C)nc1 1619863457 KCMIKYCGSVASFR-UHFFFAOYSA-N 430.556 4.187 10 10 IICE COc1cnc([C@H]2CCCN2CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)nc1O 1620648097 LORYYCPBHSLEKO-LJQANCHMSA-N 432.484 4.382 10 10 IICE CCCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)C1 1631211077 CKROANCZMVERKL-MOPGFXCFSA-N 439.600 4.072 10 10 IICE CC[C@@](C)(NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccccc1 1633755183 LVDJQZCWTBLXQK-OAQYLSRUSA-N 430.551 4.310 10 10 IICE O=C(CCOc1ccccc1I)NCc1c(O)ccc2ccccc12 1635969575 TWNOUVKGYSYUKM-UHFFFAOYSA-N 447.272 4.235 10 10 IICE COC(=O)c1cc(OCC(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)ccc1N(C)C 1644178169 DQVNABBRAQDOCZ-GFCCVEGCSA-N 425.312 4.102 10 10 IICE CCOC(=O)c1cc(C(C)C)nc(N(Cc2ccc(N(C)C)cc2)C[C@H]2CCCO2)n1 1650933564 BAKIYIIVIXDWHH-HXUWFJFHSA-N 426.561 4.028 10 10 IICE Cn1c(-c2ccccc2)cnc1SCCNC(=O)NC(C)(C)COCc1ccccc1 1651686391 QUGOYOPWTADEAM-UHFFFAOYSA-N 438.597 4.474 10 10 IICE Cc1cc(C(=O)Cn2cnc(C3CCC3)cc2=O)c(C)n1-c1ccc(OC(F)F)cc1 1652755207 ZCAYQLOJAKJOFO-UHFFFAOYSA-N 427.451 4.403 10 10 IICE CCN(CC(=O)NCCOc1ccc(C(C)C)cc1)Cc1cc(Br)ccc1O 1653469491 QNXJCSRTYXJMDA-UHFFFAOYSA-N 449.389 4.295 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1 1683424556 FIODHMUAKSEKHM-GOSISDBHSA-N 425.548 4.436 10 10 IICE Cc1cc(CNC(=O)N2CCC(OC[C@@H]3CCCCO3)CC2)c(C)n1-c1ccccc1 1684604645 RXKZGYPPYURTAU-DEOSSOPVSA-N 425.573 4.354 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCc4ccc(Cl)c(Cl)c4C3)cc2)CC1 1687441492 ORFZFKZQRNFBSO-UHFFFAOYSA-N 433.383 4.013 10 10 IICE CSCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOCC1 1698416720 FIFNVPQUJXTVLW-UHFFFAOYSA-N 425.602 4.332 10 10 IICE CCC(C)(C)Cn1c(C(=O)NC(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743424114 AHSKWSLUVZIFJE-UHFFFAOYSA-N 426.609 4.089 10 10 IICE CCC[C@@H]1CN(c2nnc(-c3cccn3C)n2Cc2ccc(N(CC)CC)cc2)CCO1 1745341154 DBGLDKPIGLJFAQ-JOCHJYFZSA-N 436.604 4.183 10 10 IICE CCC[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1cnnn1 1763802407 KCDSAMDKXBFZOQ-SFHVURJKSA-N 447.591 4.054 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCSC(C)(C)C2)cc1F 1766911761 JLRBKAYXAKSUJM-LJQANCHMSA-N 433.597 4.105 10 10 IICE CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)CCN1C(=O)CSC1=S 1865767912 IEPKSYJOJAIKRH-UHFFFAOYSA-N 448.591 4.089 10 10 IICE COCCN1C(=O)C(Nc2ccc(F)cc2)=C(c2ccc(-n3c(C)ccc3C)cc2)C1=O 1873420622 RMZANPXGRVZOLG-UHFFFAOYSA-N 433.483 4.072 10 10 IICE COc1cccc(Cn2nc(C(C)C)c(C3(C)CC3)c2I)c1O 2079730276 LUZXQKKJTZXNQB-UHFFFAOYSA-N 426.298 4.425 10 10 IICE COc1cccc(C=C2SC(=S)N(NC(=O)c3ccc(Br)cc3)C2=O)c1 2314717360 IAXWWQKOBLZXBX-UHFFFAOYSA-N 449.351 4.004 10 10 IICE O=C(O)CCCCCNC(=O)CCCCCN1C(=O)C(=Cc2ccccc2)SC1=S 2314831875 URILOQPCDSDMBL-UHFFFAOYSA-N 448.610 4.209 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)c2C)cc1C 8634494 XAMZSNUGDJNBBX-SANMLTNESA-N 429.520 4.361 10 10 IICE COc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCCSc1ccccc1 20236409 YMBOVJKRXBNNNJ-KQFRZDRCSA-N 435.505 4.317 10 10 IICE COc1cc(C)ccc1OCCOc1c(/C=C2/SC(=S)N(C)C2=O)cccc1OC 33447304 UHWXURPLMIAQFM-CPNJWEJPSA-N 445.562 4.301 10 10 IICE COc1ccc(N2CCN([C@@H](CNC(=O)Nc3cccc(C)c3)c3ccco3)CC2)cc1 38637877 DGLFRGSRJKLIHF-QHCPKHFHSA-N 434.540 4.282 10 10 IICE Cc1ccc(C(=O)N2CCN(CC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)CC2)cc1C 62694576 FRSQEJABOFELKR-UHFFFAOYSA-N 447.554 4.491 10 10 IICE COc1ccc(N2CCCN([C@@H](C)C(=O)N3CCC(Cc4ccccc4)CC3)CC2)cc1 108088744 DNPPETATCIBSKJ-QFIPXVFZSA-N 435.612 4.077 10 10 IICE Cc1cc(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(C)n1-c1ccc(F)cc1 110458332 YCBVGHWIXNSWRC-OALUTQOASA-N 427.564 4.195 10 10 IICE COc1cccc(CNC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)c1O 727761252 QBIALAZTQKBBLT-KRWDZBQOSA-N 439.339 4.169 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc3c(c2)C(=O)OC3)nc1-c1c(F)cc(F)cc1F 729112116 GLQZXXYFXXIYGU-UHFFFAOYSA-N 440.424 4.007 10 10 IICE Cc1sc(NS(=O)(=O)c2ccc([N+](=O)[O-])s2)nc1-c1c(F)cc(F)cc1F 729114649 PPTBVJWEJHZDSF-UHFFFAOYSA-N 435.430 4.306 10 10 IICE CC(C)N(CCc1nccs1)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 754569804 MANHCMYSBQZQQI-CALCHBBNSA-N 434.581 4.059 10 10 IICE CC(C)(C)n1nc(-c2ccccc2)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1 761859446 GMCUKMYHZZGBIB-UHFFFAOYSA-N 445.567 4.160 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccc([N+](=O)[O-])cc1Cl 768390123 COTXULZTDRBRJS-UHFFFAOYSA-N 443.935 4.102 10 10 IICE COCCc1nnc(-c2cccc(C(=O)N(C)Cc3ccc(N4CCCCC4)cc3)c2)o1 778557704 SYSMGLAWTGYNOQ-UHFFFAOYSA-N 434.540 4.188 10 10 IICE CN(c1ccc(CNC(=O)C(=O)Nc2nc(C(F)(F)F)cs2)cc1)C1CCCCC1 792968446 JXZJUMGFAMMUQZ-UHFFFAOYSA-N 440.491 4.186 10 10 IICE O=C1/C(=C\c2cccs2)SC(=S)N1CCCC(=O)N1CCCC[C@@H]1C(F)F 800209054 PXOKKWIEXJPLGL-MBFWDRTGSA-N 430.567 4.376 10 10 IICE CC(C)Oc1ccc(NC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)cc1Cl 918031442 BJYYJDWJYJPTQM-QGZVFWFLSA-N 444.963 4.151 10 10 IICE CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)s1 918740393 QAHFVQUJMMTCOD-JTQLQIEISA-N 425.532 4.009 10 10 IICE C[C@@H](NC(=O)Cc1ccc(Br)cc1Cl)c1ccc(N2CCOCC2)cc1 1125518729 KYUYCPSKCQOGGP-CQSZACIVSA-N 437.765 4.359 10 10 IICE COc1ccc(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cc1OC 1126510082 AYMRETAOYFENMM-WOJGMQOQSA-N 447.509 4.040 10 10 IICE CC[C@H](C)[C@H](NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2)C(=O)OC(C)(C)C 1127755058 GDUVDJOXFDVQBW-HJPURHCSSA-N 428.573 4.401 10 10 IICE CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1128138411 WVLILKYPVQTFSS-SIBVEZHUSA-N 431.580 4.467 10 10 IICE Cc1cc(NC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n(Cc2ccccn2)n1 1137149670 DDHYKMWPFVGXOK-UHFFFAOYSA-N 427.508 4.036 10 10 IICE O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cc2cc(O)c(O)cc2s1 1137853641 UNACSPUVXKZDDH-ZDUSSCGKSA-N 437.304 4.155 10 10 IICE CCOCc1nc(Cl)cc(NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)n1 1163225132 QASBQCHKXLDDJX-KRWDZBQOSA-N 449.983 4.410 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@]3(CCCOC3)C2)sc(C)c1-c1ccccc1 1196083971 YGXQNBYCZGBARF-XMMPIXPASA-N 442.581 4.341 10 10 IICE CCN(CCNC(=O)OC(C)(C)C)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 1253807913 LDFJJVBGTHKYDA-UHFFFAOYSA-N 428.577 4.193 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CC[C@@H](Oc3ccccn3)C2)cc1 1295411620 VXGPRRMFVCJYSB-JOCHJYFZSA-N 434.588 4.349 10 10 IICE CC(C)N1CCC[C@H](Cn2c(CC3CCCC3)nnc2N(C)Cc2ccccc2O)C1 1303305520 SEGBAESUZIWYFG-NRFANRHFSA-N 425.621 4.473 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H](OC)C(C)(C)C 1305384813 VRWZAITWVSPYSD-KNQAVFIVSA-N 443.636 4.326 10 10 IICE CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H](c1cccc(Br)c1)N1CCCC1 1435286583 MEAVOLFXJBLRAS-OAQYLSRUSA-N 444.373 4.078 10 10 IICE O=C(c1cc(Br)cn(C2CC2)c1=O)N(Cc1ccco1)Cc1ccccc1O 1445638419 IWDUMIKIEMNGIB-UHFFFAOYSA-N 443.297 4.087 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N(C)[C@@H](C(N)=O)c2cccc(Br)c2)cc1 1458346063 DOEIESBIIBRRLY-HXUWFJFHSA-N 440.341 4.155 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C[C@H]2CCCC[C@@H]2O)sc(C)c1-c1ccccc1 1459840654 PBJBIRYNUOBMNB-MOPGFXCFSA-N 444.597 4.322 10 10 IICE COc1ccc(O)c([C@@H](C)N[C@@H]2CCCN(c3ccc(Br)c(C)c3)C2=O)c1 1459850543 NEYFFBBZFWLYMZ-AUUYWEPGSA-N 433.346 4.318 10 10 IICE CCCCOc1ccc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)cn1 1467371507 OPXANBZZYMDYDQ-UHFFFAOYSA-N 447.538 4.081 10 10 IICE CN(Cc1ccccc1O)C(=O)NCC[C@@H]1CN(C(=O)OC(C)(C)C)c2ccccc21 1471069181 ODWKGDJWUQADHO-QGZVFWFLSA-N 425.529 4.463 10 10 IICE CC(C)(C)c1cc(NC(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)n[nH]1 1472394184 UIWNFHRUZNFOBF-RAXLEYEMSA-N 434.612 4.389 10 10 IICE C[C@@H]1CCC[C@](Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1512122481 XMRZELIGNKSAOE-IBVKSMDESA-N 448.615 4.116 10 10 IICE C[C@@H]1CN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)C[C@@H](C)O1 1512499409 DVUYQPWQIKLBIZ-QZTJIDSGSA-N 443.642 4.316 10 10 IICE CNC(=O)c1cc(Br)ccc1NC(=O)c1ccc(-n2c(C)ccc2C)cc1 1519178292 LINDNNPDBNXMER-UHFFFAOYSA-N 426.314 4.469 10 10 IICE O=C(CCc1ccc(Cl)c(F)c1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1519556551 YGSBPNZMTFELHN-UHFFFAOYSA-N 429.967 4.260 10 10 IICE C[C@H](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)[C@H]1C[C@H]2CC[C@H]1C2 1525904036 RWISMDJZZMQMKD-LZBPHBNGSA-N 432.586 4.358 10 10 IICE CCNC(=O)COc1cccc(CNC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)c1 1545224080 ZPLNNGDICALVQT-UHFFFAOYSA-N 439.943 4.192 10 10 IICE CC[C@H]1CCCN1c1nnc([C@H]2OCC[C@H]2COC)n1Cc1ccc(N(CC)CC)cc1 1546680592 MHEIIELNUJIUDN-FUDKSRODSA-N 441.620 4.275 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)CC2CCOCC2)cc1F 1552834516 UJYQBYBSCMKMSL-UHFFFAOYSA-N 443.592 4.047 10 10 IICE Cc1ccc(C(=O)NCc2c(O)cccc2F)cc1S(=O)(=O)Nc1cccc(Cl)c1 1558454906 GZXYDYKLQUQWOY-UHFFFAOYSA-N 448.903 4.224 10 10 IICE Brc1ncn(CCSc2ncc(-c3ccccc3)n2Cc2ccco2)n1 1559353575 KDGVUIHKDCKTFV-UHFFFAOYSA-N 430.331 4.338 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)NCCCCN3C(=O)c4ccccc4C3=O)c2C)c1 1565769443 CYWSMICOWLJSDF-UHFFFAOYSA-N 429.520 4.209 10 10 IICE C[C@H]1CN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)CC(C)(C)C1 1612945203 YVJIGIYFLCZRIQ-MJGOQNOKSA-N 429.584 4.298 10 10 IICE CCOCc1nnc(N2CC[C@@H](C)[C@H]2CC)n1Cc1ccc(N2CCSCC2)cc1 1616775718 VXLVJYWORJFZFW-WIYYLYMNSA-N 429.634 4.041 10 10 IICE Cc1c(Br)ccc2[nH]c(C(=O)N(C)Cc3ccc(N4CCOCC4)cc3)cc12 1623451632 KRQHDURVESMGQM-UHFFFAOYSA-N 442.357 4.348 10 10 IICE COc1cc(CCC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)cc(OC)c1O 1625905647 XKZNYVPWYOVWQA-UHFFFAOYSA-N 426.557 4.427 10 10 IICE Cc1nn(-c2ccc(Br)cc2)cc1C(=O)NCc1ccc(N(C)C)c(F)c1 1625951927 PXRUKEYENVPVKW-UHFFFAOYSA-N 431.309 4.078 10 10 IICE COc1ccc(CCCCC(=O)NCc2ccc(N3CCSCC3)cc2)cc1OC 1625970275 XMNGYWYGPDVZBW-UHFFFAOYSA-N 428.598 4.286 10 10 IICE CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)C(=O)NCc1cccc(Br)c1O 1626822511 POSXBANYZZSLNE-FQEVSTJZSA-N 443.382 4.348 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc(Cn4cc(Br)cn4)cc3)ccc21 1626940179 AWCZFPHFYJXQFC-UHFFFAOYSA-N 439.357 4.006 10 10 IICE Cc1cc(C(=O)N2CCN(c3ncccc3[N+](=O)[O-])CC2)c(C)n1-c1cccc(C(C)C)c1 1629293546 YVBPBYIPQAYAPB-UHFFFAOYSA-N 447.539 4.483 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCc3cc4cc(Br)ccc4o3)C2)cc1 1636853839 LGXKHNVGXGNIQZ-INIZCTEOSA-N 444.329 4.282 10 10 IICE O=C(c1c(F)ccc(O)c1O)N1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 1638154102 YOEWVOIHIOXAHO-UHFFFAOYSA-N 430.476 4.063 10 10 IICE C[C@@H]1OC[C@]2(CC[C@@H](CNC(=O)N(Cc3ccc(N(C)C)cc3)Cc3ccco3)O2)[C@@H]1C 1638513277 JWBYKOGIJGSXRU-SNGUERLCSA-N 441.572 4.030 10 10 IICE CCC[C@H](C(=O)NCc1ccc(N2CCN(C(C)=O)CC2)cc1)c1ccc(Cl)cc1 1638587861 VHMVPUDXXROARZ-QHCPKHFHSA-N 427.976 4.209 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC[C@@H](c3ccc(F)c(F)c3)C2)N(C)C)cc1 1638918248 SOPXOXKOTTVHHT-XXBNENTESA-N 430.543 4.223 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O 1639522072 GKAXDXFMOKRRPB-UHFFFAOYSA-N 443.588 4.048 10 10 IICE Cc1cc(C(=O)N(C)C[C@@H](O)c2cccc(Br)c2)c(C)n1-c1ccccn1 1642634687 NKBMTHUSSCMQNU-LJQANCHMSA-N 428.330 4.057 10 10 IICE COC[C@H](SCC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1652237257 IDBKOQVVJVBLGT-PNCHPQGNSA-N 446.588 4.176 10 10 IICE COc1ccc(N(C)CCN(C)CC(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)cc1 1654114032 DTAFNASOLJFGNP-UHFFFAOYSA-N 441.959 4.293 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN3CCC(C)(C)CC(C)(C)C3)cc2F)C[C@@H](C)O1 1654194098 LLPROURMLHUIQY-RTBURBONSA-N 433.612 4.204 10 10 IICE COC1CCN(c2ccc(CN3C[C@H]4C[C@@H](NC(=O)OC(C)(C)C)C[C@H]3C4)cc2)CC1 1655848773 UUHFJVUHFYBCEX-TUNNFDKTSA-N 429.605 4.179 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1 1683254664 RTAVGDPWASOABJ-CTUHWIOQSA-N 436.600 4.032 10 10 IICE CN(C)c1ccc(CN(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)CC2(C)C)C2CC2)cc1 1684496102 WYDFUUWYPYNCMP-OAQYLSRUSA-N 444.620 4.462 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC1([S@@](C)=O)CC1)C(C)C 1709932949 CMLCRZMFUTZWJF-WJOKGBTCSA-N 439.629 4.498 10 10 IICE CC[C@@H](C)c1nnc(N2CCCC[C@@H](SC)C2)n1Cc1ccc(N2CCOCC2)cc1 1726983076 WXXXBWSCWXJKFM-DENIHFKCSA-N 443.661 4.398 10 10 IICE CCC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)CC1 1727751775 HWPDHNUPUPMCOW-UHFFFAOYSA-N 429.584 4.226 10 10 IICE CO[C@H]1CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOC(C)C)C1 1730369714 SQCFBWRLGCGYEW-QFIPXVFZSA-N 437.588 4.393 10 10 IICE CCN(Cc1cccs1)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1746231904 FFBVDEPQKQGGSV-QGZVFWFLSA-N 429.565 4.123 10 10 IICE COCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H](OC)C(C)(C)C 1749750671 UVAVHWPYIVGLST-JOCHJYFZSA-N 439.604 4.496 10 10 IICE COc1cc(/C=C2\C(=O)N(Cc3ccc(F)cc3)N=C2C(F)(F)F)cc(OC)c1OC 1865668011 APAQMLOSTARLMH-NVNXTCNLSA-N 438.377 4.196 10 10 IICE COc1ccc(N2CCN(C(=O)Cc3c(C)nn(-c4ccccc4Cl)c3C)CC2)cc1 1869930570 BMWNMUQADBXIJN-UHFFFAOYSA-N 438.959 4.042 10 10 IICE CN(Cc1ccccc1O)C(=O)C1(NC(=O)OCC2c3ccccc3-c3ccccc32)CC1 1963341997 QWKHQLSNLMMYCO-UHFFFAOYSA-N 442.515 4.422 10 10 IICE CC(C)(C)OC(=O)N[C@H](CNCc1ccc(Br)cc1O)CC(F)(F)F 2053661520 GCKVTHJMVHGNBS-LBPRGKRZSA-N 427.261 4.090 10 10 IICE COc1cccc(Cn2nc(C(C)C)c(C(F)(F)F)c2I)c1O 2079827792 WWSJWTGLFUWMSX-UHFFFAOYSA-N 440.203 4.392 10 10 IICE Oc1c(F)cc(Br)cc1CNCc1cccc(I)c1 2119243279 WCRUQBUKSBYLQL-UHFFFAOYSA-N 436.062 4.188 10 10 IICE CN(CCCN=[N+]=[N-])C(=O)[C@@H](Cc1ccc(Br)cc1)NC(=O)OC(C)(C)C 2180954391 LMNOILMVBKNCNV-OAHLLOKOSA-N 440.342 4.044 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2cc(Br)ccc2OCc2cccc(F)c2)S1 2293438566 RBSQBOICCBDZBV-UHFFFAOYSA-N 449.301 4.274 10 10 IICE COc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc(Cl)c1OC(C)C 2294095097 IZKLAQOKJMLESP-UHFFFAOYSA-N 442.899 4.419 10 10 IICE COc1cc(C=C2C=C(c3ccc(Br)cc3)OC2=O)c([N+](=O)[O-])cc1OC 2294277059 QXOBHMWBLOCXKP-UHFFFAOYSA-N 432.226 4.356 10 10 IICE Cc1cccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C(=O)NC2=S)c1 2296938422 MHPNWXCWIYCGBB-UHFFFAOYSA-N 433.508 4.373 10 10 IICE COc1ccc(C=C2SC(=S)N([C@@H](CC(=O)O)c3ccccc3)C2=O)cc1OC 2297554745 XEPSCNHVKJUICU-HNNXBMFYSA-N 429.519 4.121 10 10 IICE Cc1ccc(NC(=O)[C@H](C)N2C(=O)C(=Cc3cccc([N+](=O)[O-])c3)SC2=S)cc1 2314836257 BZNPKPCJIWRHFS-ZDUSSCGKSA-N 427.507 4.132 10 10 IICE Cc1ccc(CN(C)C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)c(O)c1Br 2380770136 YWUBXHDTGQTMIN-LJQANCHMSA-N 431.374 4.334 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)OCCCc2ccccc2)sc2c1CCC2 13998349 WTCBUTUXTZKDJA-UHFFFAOYSA-N 429.538 4.308 10 10 IICE Cc1cc(C)c([C@@H]2Nc3ccc(S(=O)(=O)N4CCOCC4)cc3[C@H]3C=CC[C@@H]32)c(C)c1 14457787 UMFXZUOSQDYRFL-STWLZBDKSA-N 438.593 4.459 10 10 IICE CC(C)N1C(=O)/C(=C\c2c(Sc3ccccc3)nc3ccccn3c2=O)SC1=S 33313646 QJIXDXGWMHJEQN-FOWTUZBSSA-N 439.587 4.455 10 10 IICE CCOC(=O)c1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3)C(C(=O)OC)=C2C)cc1 33332211 WVDAGLQRGDBZAU-CPNJWEJPSA-N 425.868 4.394 10 10 IICE CCCCCCN1C(=O)/C(=C\c2c(N3CCCC3)nc3ccccn3c2=O)SC1=S 33438203 QHKGVZPVRGUVQZ-BMRADRMJSA-N 442.610 4.076 10 10 IICE COc1ccc(N2CCN(C(=O)CSCc3ccc(OC(F)(F)F)cc3)CC2)cc1 71842211 LLJCVNIUPOISBU-UHFFFAOYSA-N 440.487 4.176 10 10 IICE COc1ccc2[nH]cc(/C=C3/SC(=S)N([C@@H](Cc4ccccc4)C(=O)O)C3=O)c2c1 97513874 UEEILFGJBHVNAT-JHBOHYQCSA-N 438.530 4.074 10 10 IICE CCc1ccc(N2C(=O)/C(=C/c3ccc(OC)c(OC)c3C(=O)O)SC2=S)cc1 210401616 KBIUAVAULQQLQX-WJDWOHSUSA-N 429.519 4.370 10 10 IICE CC[C@H](Cc1cccc(Br)c1)C(=O)N1CCN(c2ccc(OC)cc2)CC1 303683523 NEEKCRVXEGQVRR-GOSISDBHSA-N 431.374 4.375 10 10 IICE Cc1nc(-c2ccc(C)c(NC(=O)Cn3c4c(c5ccccc53)CN(C(C)C)CC4)c2)n[nH]1 444277982 NHIHHKUNTVZSGH-UHFFFAOYSA-N 442.567 4.448 10 10 IICE O=S(=O)(Nc1nc(-c2ccc(-n3cccn3)cc2)cs1)c1cccc2ncccc12 732911395 XXNHUQXCAUUBHQ-UHFFFAOYSA-N 433.518 4.345 10 10 IICE CN(Cc1ccc(Cl)cc1)C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 748010957 QZTSSPXWBSGJHP-UHFFFAOYSA-N 436.942 4.180 10 10 IICE COc1ccc(O)c(CNC(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)c1 764223981 OBFIPJWXCCXTND-UHFFFAOYSA-N 429.480 4.029 10 10 IICE CCCc1c(NC(=O)/C=C/c2ccc(O)c(O)c2)cnn1-c1cc(F)c(OC)cc1F 797766218 WVXDPPRSLIYROZ-SOFGYWHQSA-N 429.423 4.175 10 10 IICE CN(C)c1ccc(CN(C(=O)[C@H]2CCO[C@@H]2c2cnn(-c3ccccc3F)c2)C2CC2)cc1 808112890 OPYVSUNUODBHDB-WIOPSUGQSA-N 448.542 4.346 10 10 IICE CC(=O)C(=O)COC(=O)c1cc2c(C)nn(Cc3c(Cl)cccc3Cl)c2s1 808495984 WBOZNYQZIDQPML-UHFFFAOYSA-N 425.293 4.076 10 10 IICE Cc1cccc2c1CN(C(=O)CCN1C(=O)/C(=C\c3ccc(F)cc3)SC1=S)CC2 1127937650 WXDLYUMERLTGQU-DEDYPNTBSA-N 440.565 4.310 10 10 IICE O=C(CCOc1ccc2ccccc2c1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1129549217 FHHCCECLTIYRJD-UHFFFAOYSA-N 426.463 4.040 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Oc2cnn3c2CN(C(=O)OC(C)(C)C)CC3)cc1 1135162092 RGPBIYAMWBVLGT-UHFFFAOYSA-N 436.512 4.261 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(=O)c4ccc(Cl)cc4o3)cc2F)C[C@@H](C)O1 1136310966 BTCWIYMKTVIYSJ-ZIAGYGMSSA-N 444.890 4.129 10 10 IICE C[C@@H](NC(=O)c1ccc(Nc2nccs2)cc1F)c1ccc(N2CCOCC2)cc1 1136442705 AESIRCVWFXHUBY-OAHLLOKOSA-N 426.517 4.353 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCCNc2ncnc3ccc([N+](=O)[O-])cc23)cc1 1139605594 MLBFOIURFXRWGD-UHFFFAOYSA-N 444.495 4.178 10 10 IICE Cc1cc(C(=O)Nc2cccc(C(=O)N(C)C)c2)c(C)n1-c1ccc(Br)cn1 1141264841 LSEPHQHXRZJIHQ-UHFFFAOYSA-N 441.329 4.206 10 10 IICE COC(=O)[C@@H]1CN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)C[C@@H]1c1ccccc1 1160873369 YPGSBLOGPAWZOI-DNQXCXABSA-N 444.531 4.244 10 10 IICE C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1229782672 YNIOKQHIGZMLJF-HTAPYJJXSA-N 429.511 4.279 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(C)c(OC)c4)CCCC3)CC2)c(OC)c1 1287478335 PQVIPJWSQBWFIT-UHFFFAOYSA-N 438.568 4.181 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2ccc(Cl)nc2)nnc1N1C[C@@H](C)O[C@H](C)C1 1289424565 YIFXBQSGHQYVMJ-IAGOWNOFSA-N 440.979 4.030 10 10 IICE CCC(CC)C(=O)N1CCC(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CC1 1291777868 MTYNNQYVPFOIHT-UHFFFAOYSA-N 439.600 4.072 10 10 IICE CCc1nc2ccccc2n1CCC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294161703 RYBJIGFXMZCJRB-QGZVFWFLSA-N 442.510 4.375 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)N1CCC[C@@]2(C1)CC2(F)F 1300222167 LRXLOIWTNMLYKQ-XATQLNLPSA-N 440.512 4.065 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CCOc1cccc(C(F)(F)F)n1 1302847339 IFFNFKZNWOCQIV-UHFFFAOYSA-N 449.477 4.311 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1312388720 AKECFUPDQZCMFS-LJQANCHMSA-N 435.355 4.006 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)NCC/C=C\c3ccc(Br)cc3)C2)cc1 1312995276 UMDDVWIRQCHHIB-GHMGLMHVSA-N 444.373 4.439 10 10 IICE C[C@@](NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)(C1CC1)C(F)(F)F 1354755269 POCQQQJEMXUMGH-PMXLPMHFSA-N 446.491 4.264 10 10 IICE COc1c(Cl)cccc1CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2 1439728403 WHDDGDKYJIKXPQ-UHFFFAOYSA-N 425.960 4.386 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CCOc3ccc(Cl)c(F)c3)cc2F)C[C@@H](C)O1 1441792834 ZYGWFFMUVILVMW-HUUCEWRRSA-N 438.902 4.317 10 10 IICE Cc1cc(C(=O)Cn2cnc(C3CC3)cc2=O)c(C)n1-c1ccc(Br)cc1 1459303288 ZKRSKMIWNHGHOD-UHFFFAOYSA-N 426.314 4.174 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NC1(C(F)F)CCCC1 1460615074 BYWRNDFGYUUMJF-SDNWHVSQSA-N 428.501 4.111 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cc1cccc(I)c1 1463783137 FYUPMPNEBWLLHT-UHFFFAOYSA-N 448.348 4.483 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1F 1465006477 NUMLRQCDEMKNOI-QHCPKHFHSA-N 441.547 4.479 10 10 IICE C[C@@H]1CCCC[C@H]1OCCn1c(Cc2cccnc2)nnc1N(C)Cc1ccccc1O 1493610951 NMWWXNUDTCWTKR-AUSIDOKSSA-N 435.572 4.201 10 10 IICE CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N[C@H]3CCCC[C@@H]32)sc2c1CCCC2 1522411118 PVIWKUGSIPOFPW-BMFZPTHFSA-N 432.586 4.216 10 10 IICE CC1(C)COc2c(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)cccc21 1527246234 SDXPKZONCILDDG-UHFFFAOYSA-N 434.458 4.142 10 10 IICE Cc1ccc(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)cc1Br 1527481149 GBVQWRHKPYOHRZ-HOTGVXAUSA-N 449.364 4.369 10 10 IICE O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)[C@H](C[C@@H]1CCCO1)C(F)(F)F 1531503079 JPWKFUZSCBRIEN-COXVUDFISA-N 436.421 4.121 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](Cc3cc4ccccc4o3)C(=O)OC)ccc21 1537824119 QDFSKHDOFLYJGC-JOCHJYFZSA-N 448.519 4.165 10 10 IICE CCN1CCN(Cc2ccccc2CNC(=O)c2cc(C)ccc2-n2c(C)ccc2C)CC1 1540930894 HCQNAEJZIXIXQA-UHFFFAOYSA-N 444.623 4.470 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)(C)C)nnc1N1CC[C@H]([C@@H]2CCOC2)C1 1542226947 NPMYXCOQRNGHLV-LEWJYISDSA-N 425.621 4.152 10 10 IICE Cc1ccc(NC(=O)N2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)cc1Cl 1544396176 ZTGDAHLBXWIBQN-UHFFFAOYSA-N 445.928 4.264 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1545617465 HMMBEQJQFOEMTI-SFHVURJKSA-N 436.604 4.313 10 10 IICE CCN(CC)C1CCN(c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)CC1 1547470671 IMSIGZHAKCXGPN-UHFFFAOYSA-N 447.631 4.073 10 10 IICE COc1ccc(CNC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)c(OC)n1 1556881602 UADKBBHDJMBAEG-UHFFFAOYSA-N 444.329 4.199 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H]2CCC(=O)N(c3ccc(C)c(C)c3)C2)cc1F 1585698721 XDSMHFNEEKUHJA-HXUWFJFHSA-N 425.548 4.348 10 10 IICE Cc1cc(C(=O)N[C@H](Cc2ccccc2)c2nc(O)n[nH]2)c(C)n1-c1ccc(Cl)cc1 1587153441 BDZBZAABLKWWCK-HXUWFJFHSA-N 435.915 4.285 10 10 IICE Cc1onc(-c2cccnc2)c1C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2ccccc21 1595762374 APOYKDPDJFEEQB-KRWDZBQOSA-N 448.523 4.389 10 10 IICE Cc1cc(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c(C)n1-c1ccccc1Br 1623757220 ISCIGAHFXMRLFB-IRXDYDNUSA-N 448.405 4.086 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cc(Oc2cccc(Br)c2)ccn1 1632681984 YWHCLHHPJWUIHS-ZDUSSCGKSA-N 443.297 4.409 10 10 IICE CN(CCCOc1cccc(Cl)c1)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1638918464 VPGITPPMWHIRFH-JOCHJYFZSA-N 432.996 4.119 10 10 IICE CC[C@@H]1CN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)C[C@@H](CC)O1 1643170982 LPACSVXVMFRGDC-FNBYNPPRSA-N 438.640 4.146 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccccc4)c3C)C2=O)c(C)c1 1643806374 RUYRJXMAFMHPAL-AREMUKBSSA-N 429.520 4.361 10 10 IICE CC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccccc1OC 1654581918 SDSVGVFBQHQEHW-FQEVSTJZSA-N 428.488 4.150 10 10 IICE COc1ccc(N(C)CCN(C)[C@@H](C)C(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1 1659280418 FHZXSCFQFITGDL-INIZCTEOSA-N 442.560 4.353 10 10 IICE COc1ccc(OC)c2c1CN(C(=O)NCc1cc(C)n(-c3cccc(C)c3)c1C)C[C@H]2O 1675108195 LJQVJNQGHDQDJM-JOCHJYFZSA-N 449.551 4.179 10 10 IICE C[C@H](NC(=O)N[C@@H]1CC[C@H]2CCN(C(=O)OC(C)(C)C)[C@H]1C2)c1ccc(N(C)C)cc1 1680279976 HCPZNTOSJOGEDK-PZBISTMVSA-N 430.593 4.291 10 10 IICE Cc1cc(CCNC(=O)NCCCNC(=O)/C=C\c2ccccc2)c(C)n1-c1ccccc1 1680541206 IVEQEWWUZOOATM-PFONDFGASA-N 444.579 4.156 10 10 IICE Cc1cc(CCNC(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)c(C)n1-c1ccccc1 1681187672 DUJOGWWRAXYCPP-WXFUMESZSA-N 449.599 4.330 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2CC[C@@H](c3cnn(C)c3)C2)cc1 1695627704 ZSIKZCNUGMVWMV-OAQYLSRUSA-N 435.620 4.099 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@@H](C)CN(C)C(=O)OC(C)(C)C 1706767237 CGUCIFCFXQSBJB-KRWDZBQOSA-N 431.581 4.247 10 10 IICE Cc1nnc(N2CCC(CN3CCCCCC3)CC2)n1CCCSc1nccs1 1707884059 WXNNHIJSIJGLDY-UHFFFAOYSA-N 434.679 4.318 10 10 IICE CCc1nnc(N2CCO[C@H](c3cccc(OC)c3)C2)n1CCCSc1nccs1 1709157278 YZSUOHUWYPXRMK-SFHVURJKSA-N 445.614 4.066 10 10 IICE CN(C)CC(C)(C)Cn1c(-c2cccn2C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1711008984 FNPYWWOSABCTOG-UHFFFAOYSA-N 449.647 4.108 10 10 IICE COCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCO[C@@H](C(C)(C)C)C1 1712457646 GRNNJTBMUFUPPZ-JOCHJYFZSA-N 437.588 4.250 10 10 IICE Cc1occc1CN(C)c1nnc(Cc2cccnc2)n1CCCSc1nccs1 1742067052 BVPIIWUCUXTZKB-UHFFFAOYSA-N 440.598 4.441 10 10 IICE COC[C@H]1CCCCN(c2nnc(-c3cccn3C)n2CCCSc2nccs2)C1 1769400144 BWQHYDAQJBQVND-KRWDZBQOSA-N 446.646 4.175 10 10 IICE Cc1ccc2c(c1)c1c(n2C)[C@@H](NC(=O)CCc2nn(CC3CC3)c3c2COCC3)CCC1 1857521704 XTBUSRCHIDILCK-QHCPKHFHSA-N 446.595 4.292 10 10 IICE CCc1sc(NS(=O)(=O)c2ccc3nc(O)oc3c2)nc1-c1ccc(OC)cc1 1858034577 ZLRRTFRKXXCTLJ-UHFFFAOYSA-N 431.495 4.029 10 10 IICE CN(Cc1ccccc1)c1nc(=Nc2ccccc2O)nc(N(C)Cc2ccccc2)[nH]1 1871730221 MNCVAANMQOIVLX-UHFFFAOYSA-N 426.524 4.016 10 10 IICE O=C(NOCCCNCc1ccc(O)cc1O)OCC1c2ccccc2-c2ccccc21 1928759902 IVGZLTFUGLZSIS-UHFFFAOYSA-N 434.492 4.048 10 10 IICE Cc1cc(O)c([C@H](C2CCC2)n2nc(C(F)F)c(C(N)=O)c2Br)cc1C 2080056551 VGJRYGXGFPDSOE-HNNXBMFYSA-N 428.277 4.394 10 10 IICE COc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccccc3C)C2=O)cc1OC 2297330128 BCMMVXPBTUDXDQ-UHFFFAOYSA-N 442.562 4.242 10 10 IICE COc1cc(C)ccc1OCCOc1c(C=C2SC(=S)N(C)C2=O)cccc1OC 2297358680 UHWXURPLMIAQFM-UHFFFAOYSA-N 445.562 4.301 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(c3ccccc3C(N)=O)C2=O)cc1OC 2314539621 XFFXYKDNGWBAHO-UHFFFAOYSA-N 442.562 4.379 10 10 IICE CCOc1cc(C=C2SC(=S)N(c3ccc(CC(=O)O)cc3)C2=O)ccc1OC 2321585773 HLMIPVKZWDEGSZ-UHFFFAOYSA-N 429.519 4.127 10 10 IICE CC1CCN(S(=O)(=O)c2ccc3c(c2)[C@@H]2C=CC[C@@H]2[C@H](c2ccc(O)cc2O)N3)CC1 13639870 HAEWHHKKTAJPCU-YDIMBITNSA-N 440.565 4.345 10 10 IICE CCc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3ccccc3OC)C2=O)cc1 33413903 BWCZPFZSZNXLJC-XMHGGMMESA-N 426.563 4.488 10 10 IICE O=C(Nc1ccc(N2CCCN(Cc3ccccc3O)CC2)nc1)c1ccc(F)cc1F 34681914 YUVRXXMSMFMEPA-UHFFFAOYSA-N 438.478 4.030 10 10 IICE CCc1ccc(Oc2nc3c(C)cccn3c(=O)c2/C=C2/SC(=S)N(C)C2=O)cc1 39835921 YNLRYIKSYUDUBQ-SFQUDFHCSA-N 437.546 4.189 10 10 IICE O=S(=O)(CCCN(Cc1cccs1)c1ccc2c(c1)OCCO2)c1ccccc1 116730156 QTXFOBXWGYNVPA-UHFFFAOYSA-N 429.563 4.390 10 10 IICE COc1cc(/C=C2\SC(Nc3ccc(C)c(C)c3)=NC2=O)ccc1OCCC(=O)O 210449764 VFHJXSRIMQAKIP-UNOMPAQXSA-N 426.494 4.248 10 10 IICE Cc1cc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)ccc1C(=O)N(C)C 435870937 QGNOLXQKKKXLTE-UHFFFAOYSA-N 432.568 4.057 10 10 IICE CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)c1 747751418 LJTRDPSUEMLVBE-UHFFFAOYSA-N 439.921 4.105 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)c1ccn(-c2c(F)cccc2F)n1 749540988 XLPWTBNZTDLEDU-UHFFFAOYSA-N 436.256 4.281 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3cc([N+](=O)[O-])c(C)cc3C)n2)cc1OC 755085299 QGWCNCRIASIAJS-UHFFFAOYSA-N 449.510 4.153 10 10 IICE CC(C)(C)OC(=O)N1CCc2cccc(/C=C3/SC(=S)N(CCCC(=O)O)C3=O)c21 757527027 OLPXTYVYEGJUQY-NTCAYCPXSA-N 448.566 4.050 10 10 IICE Cc1cc(C(=O)N[C@H](C)Cn2ncc3ccccc3c2=O)c(C)n1-c1cccc(Cl)c1 765249685 NSZFFRQSTCCZRA-OAHLLOKOSA-N 434.927 4.276 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)cc1 772465263 VGGKSCIAGMKGHM-FQEVSTJZSA-N 432.524 4.183 10 10 IICE C[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1ccc2ncsc2c1 776817903 ZDQXHKIPHKTFEB-AWEZNQCLSA-N 441.512 4.361 10 10 IICE CCN1CC[C@H](NC(=O)NCCCSc2nccs2)[C@H]1c1cc(F)c(F)c(F)c1 782732841 NMUMRXROTOXIDK-DOTOQJQBSA-N 444.548 4.177 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[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)cc1 787682359 FUSBWYKLCYWCQP-QLVMRMBKSA-N 442.563 4.407 10 10 IICE O=C1N[C@@H](Cc2cccc(Cl)c2)C(=O)N1[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 804174527 GLFKBORFZXCWHY-HKUYNNGSSA-N 449.885 4.073 10 10 IICE COc1cc(OC)c(NC(=O)c2cc3ccccc3cc2OCC(=O)C(C)=O)cc1Cl 808012843 SXIIOOKMBJIERN-UHFFFAOYSA-N 441.867 4.300 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2OCC[C@H]2c2ccccc2)n1C[C@@H]1CCCO1 812289185 ZFBDEGAPLIZHQI-FUDKSRODSA-N 434.540 4.044 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cnn(-c2ccccc2F)c1C(F)(F)F 819755275 FJULWTPIERKQMR-UHFFFAOYSA-N 428.382 4.152 10 10 IICE CC(C)c1cc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1C(C)(C)C 917711293 FOPRKEYZXLORDD-IRXDYDNUSA-N 430.568 4.444 10 10 IICE C[C@@H](NC(=O)C(F)(F)c1ccc(Br)cc1)c1ccc(N2CCOCC2)cc1 1125518218 BBXRSAXHGOPZFF-CQSZACIVSA-N 439.300 4.255 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@@]3(C)Cc4ccccc4C(=O)O3)cc2Cl)C1 1128490450 SXQTUQACALFFKD-UPCLLVRISA-N 426.944 4.364 10 10 IICE CC(C)(F)c1cc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)no1 1135374013 URPRXVBANDHJBG-LCYFTJDESA-N 437.493 4.248 10 10 IICE Cc1cc(C(=O)NCc2ccccc2N2CCN(C)CC2)c(C)n1-c1ccc(Cl)cc1 1136716043 JZCQZDNRBIIFHS-UHFFFAOYSA-N 436.987 4.429 10 10 IICE Cc1ccc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1NS(C)(=O)=O 1142339997 PMWVFKRJZKROTN-UHFFFAOYSA-N 439.537 4.147 10 10 IICE COC1(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(N(C)C)cc2)CCCCCC1 1147504785 HDDGDWOFJRJORD-FQEVSTJZSA-N 433.593 4.174 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)[C@H]1CC[C@H]1c1ccc(Cl)cc1F 1147838440 WSVJNLLEJYCXIW-UNMCSNQZSA-N 430.951 4.498 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCCN2C[C@@H]3CCCCN3C2=O)cc1 1148605734 HXTFURRBNFPUHX-FQEVSTJZSA-N 434.544 4.188 10 10 IICE Cc1cc(CN2CCC(C(=O)NCCCN3CCCCC3)CC2)ccc1N1CCCCC1 1168338981 KBYFPTVYMFTANW-UHFFFAOYSA-N 440.676 4.190 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@@H](C)C3)n2CCOC(C)C)c(C)n1-c1ccccc1 1289358902 HDKUHMOIVAVUHL-PMACEKPBSA-N 437.588 4.391 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 1292719697 KMGOISRJSUNVRW-DEOSSOPVSA-N 438.474 4.327 10 10 IICE CCC[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc(C)n(-c2ccccn2)c1C 1296254266 LJPOTGXJDMECDH-LJQANCHMSA-N 426.561 4.351 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3cc(O)ncc3Br)cc2Cl)C1 1297009293 FWRNQTGRTGVGEO-GFCCVEGCSA-N 438.753 4.369 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)c1nnc([C@@H]2CCCCO2)n1CCCOC(F)F 1298315710 ZXNAZDPHGDFEPG-FQEVSTJZSA-N 449.546 4.386 10 10 IICE Cc1cccc(-c2nnc(N3CCS[C@H](C)C3)n2CCCSc2nccs2)n1 1304483162 DGMLPJGUAPOYQP-OAHLLOKOSA-N 432.644 4.229 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3c(Cl)cccc3Cl)CC2)c([N+](=O)[O-])c1 1307089478 AJBVCCJGJNEUAU-VURMDHGXSA-N 436.295 4.414 10 10 IICE CCN1CCCC[C@H]1Cn1c(-c2ccc(Cl)nc2)nnc1N(C)Cc1ccccc1O 1313909253 QEVMYPSUPPSSME-IBGZPJMESA-N 440.979 4.210 10 10 IICE CNC(=O)CCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC(C)=C(C)C1 1315041893 BIPXUGXCCFMREZ-UHFFFAOYSA-N 432.572 4.035 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ncc(Br)cc2Br)cc1 1350864571 MKLGLUONSVQOJA-UHFFFAOYSA-N 441.167 4.383 10 10 IICE Cc1cc(C(=O)N[C@@H](C)Cc2cccc(O)c2)c(C)n1-c1ccc(Br)cn1 1449473862 PXPCPWMZUNEYFD-ZDUSSCGKSA-N 428.330 4.318 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCN(C(=O)c3cc4cc(O)c(O)cc4s3)C2)C1 1449702081 NRDNXPWCCHOVJP-CABCVRRESA-N 446.569 4.422 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCCCCN1CCN(c2ccccc2)CC1 1464280428 GQGBNVLZAJIOBB-UHFFFAOYSA-N 436.625 4.488 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc(Cl)cc(Br)c1F 1470448063 SULDPCCAYOYFQR-UHFFFAOYSA-N 441.728 4.133 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@H](C(=O)NCc2cccc(O)c2O)C1 1471642169 MMNCJNLJFPWGKR-MSOLQXFVSA-N 446.931 4.018 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1479533564 HDRTYETWZZREFJ-VWLOTQADSA-N 437.632 4.187 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@H]2CC2(O)CCCCC2)N(C)C)cc1 1479535651 YAYXILPNKVZPDX-GOTSBHOMSA-N 430.637 4.005 10 10 IICE CC[C@H](C)c1nnc(N(C)CC2CCCC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1512815833 NJKDKVXJLQOMSO-SFHVURJKSA-N 429.584 4.442 10 10 IICE CC(=O)N[C@H]1Cc2ccccc2N(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1536311958 JFFRQRDTPWBPTQ-QFIPXVFZSA-N 435.955 4.384 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CCCOc2cccc(Br)c2)N(C)C)cc1 1537477778 KRKAPDIUTUAJIY-NRFANRHFSA-N 448.405 4.093 10 10 IICE O=C(/C=C\c1nccs1)Nc1c(-c2ccccn2)nc2ccc(Br)cn12 1539360671 DZZGYDPKBAWVOK-SREVYHEPSA-N 426.299 4.267 10 10 IICE CC(C)N(C)CC1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N(C)C)c(F)c2)CC1 1541597851 BFLHKBXJDWWQSU-UHFFFAOYSA-N 444.643 4.386 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCc2ccc(OCC(F)(F)F)nc2)c1 1544057081 OZVIMKGKJYQEPV-UHFFFAOYSA-N 431.414 4.173 10 10 IICE O=C([C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)N(Cc1ccco1)Cc1ccccc1O 1545496450 MCHXGUREYAUSOQ-INIZCTEOSA-N 442.874 4.360 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2CCC[C@H](C(F)(F)F)C2)cc1F 1552838746 YYFOJNYWOPJKSE-MAUKXSAKSA-N 441.473 4.162 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CC=CCC3)CC2)cc1F 1554959925 SVARWFIVGCDSAO-SFHVURJKSA-N 427.568 4.406 10 10 IICE Cc1ccc(C(=O)N2CCN(c3nccc(C(C)C)n3)CC2)cc1-n1c(C)cc(C=O)c1C 1556099732 ZRQIAZAIOSJGEC-UHFFFAOYSA-N 445.567 4.091 10 10 IICE Cc1cc(CCNC(=O)N(C)CCN(C)C(=O)OC(C)(C)C)c(C)n1-c1ccccc1 1565162163 NTKIFZVSPQCFSY-UHFFFAOYSA-N 428.577 4.145 10 10 IICE CN1CCCc2cc(CNC(=O)c3ccc(OC(F)F)c(Br)c3)ccc21 1583627769 GXCYEXAJYPLFEJ-UHFFFAOYSA-N 425.273 4.363 10 10 IICE COC(=O)[C@H](Cc1cncs1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1583832248 NRHMIQGOJAYASJ-FQEVSTJZSA-N 437.525 4.139 10 10 IICE Cc1ccc(C(=O)NC2CCN(Cc3cccnc3)CC2)cc1-n1c(C)cc(C=O)c1C 1586367419 AQTMHVAVUCTLGT-UHFFFAOYSA-N 430.552 4.004 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)c1 1611449876 BMWGCMFWUPWQLW-UHFFFAOYSA-N 445.563 4.288 10 10 IICE CCOC(=O)CCN(C(=O)c1cc(C)n(-c2cccc(Br)c2)c1C)C1CC1 1625501799 DSSYRYRRYXMJCP-UHFFFAOYSA-N 433.346 4.414 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)cc1 1631612830 ZONMZRQMFIESEX-NRFANRHFSA-N 445.947 4.455 10 10 IICE C[C@H](NC(=O)c1ccc(Br)cc1I)c1ccccc1O 1632250594 XNZZPFVKQKYJQV-VIFPVBQESA-N 446.082 4.250 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCCN(C(=O)Cc4cccc(F)c4)CC3)c2C)c1 1635395302 KXTNXVCKKUBCCT-UHFFFAOYSA-N 447.554 4.459 10 10 IICE O=C(Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2)c1cc2cc(O)c(O)cc2s1 1636442814 KEKYKJKZNXZUGB-UHFFFAOYSA-N 436.461 4.269 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)cc1 1637594756 RNCUTZODABYFON-KRWDZBQOSA-N 442.519 4.419 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(NCCc4ccccn4)cc3)C2)cc1 1638649392 HRUARCBBYMAXSX-FQEVSTJZSA-N 430.552 4.001 10 10 IICE COC(=O)c1cc2n(n1)CCC[C@@H]2NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1648426481 YPICLTIHMCSRJJ-NRFANRHFSA-N 434.540 4.466 10 10 IICE O=C(Cc1ccc(Br)c(Br)c1)NCc1cccc(Cl)c1O 1648609160 SEEXGTKEYLIPHG-UHFFFAOYSA-N 433.527 4.430 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)COc3cc([N+](=O)[O-])c(F)cc3F)c2C)cc1 1652033699 XNNQNNVBLZTWIZ-UHFFFAOYSA-N 444.390 4.329 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1c(O)cccc1F)c1cccc(Br)c1 1652295280 FWVVJVXDLSOVPO-UHFFFAOYSA-N 443.272 4.476 10 10 IICE C[C@@H]1CC[C@@H](NC(=O)N(Cc2ccc(N(C)C)cc2)C2CC2)CN1C(=O)OC(C)(C)C 1675001288 IGFXYXCOCDVLDF-IEBWSBKVSA-N 430.593 4.215 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3nc(-c4ccc(Cl)cc4)no3)C2)cc1 1682645338 CXXTWSZVKLBJFF-YOEHRIQHSA-N 441.919 4.038 10 10 IICE CC(C)NC(=O)c1nnc(N2C[C@H](C)[C@H]3CCCC[C@@H]32)n1CCCSc1nccs1 1692511976 SSZXXILNVYRYFC-BBWFWOEESA-N 448.662 4.070 10 10 IICE C#C[C@@H](C)N(C)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1Cc1ccc2c(c1)CCCN2C 1705505435 KLSVATQHPGNZBN-JMUQELJHSA-N 435.616 4.085 10 10 IICE CC1=CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCC(=O)N(C)C)C1 1707690747 JARUNQNIHREGER-UHFFFAOYSA-N 446.599 4.377 10 10 IICE CC[C@H](C)c1nnc(N2C[C@@H](C)O[C@H](CC)C2)n1Cc1ccc(N2CCSCC2)cc1 1709316018 FZAVNYOSZSJIDV-NNMXDRDESA-N 443.661 4.397 10 10 IICE CC(C)CO[C@@H]1CCN(c2nnc(-c3ccccn3)n2CCCSc2nccs2)C1 1723496113 WDFKTPKNJALDOR-QGZVFWFLSA-N 444.630 4.230 10 10 IICE Cc1cscc1Cn1c(C(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1725122832 UYLHALRYRJJGJK-UHFFFAOYSA-N 425.602 4.293 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)CCOC(C)(C)C)cc1 1746089339 LYPOZSOXFVNDSK-UHFFFAOYSA-N 438.620 4.429 10 10 IICE COCCO[C@H](C)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1749987382 UKBYZLNRCLSZMZ-AZUAARDMSA-N 429.609 4.051 10 10 IICE CC(C)Cc1nnc(N(CC(C)C)C(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1761000030 PIDMVIIMZPMOML-UHFFFAOYSA-N 431.600 4.371 10 10 IICE CC[C@@H](C)c1nnc(N2CC[C@@H](CN(CC)CC)C2)n1Cc1ccc(N(C)C)cc1C 1763608940 GLOFFNGYCGYXME-CTNGQTDRSA-N 426.653 4.382 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccn3C)nnc2N(C)C[C@@H]2CCCOC2)cc1 1764936014 VYMHKMUAQDYTLT-NRFANRHFSA-N 436.604 4.041 10 10 IICE O=C(OCc1ccccc1)N1C[C@@H](NCc2cccc(Br)c2O)C2(CCC2)C1 2028689392 KFOAWSWWHVZCFH-LJQANCHMSA-N 445.357 4.436 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2[C@@](C)(CN)COCc1ccccc1 2074326580 WKYZRKOKPTVXLN-SANMLTNESA-N 439.600 4.398 10 10 IICE COc1ccc(N2C(=O)C(=Cc3cccc(OCc4ccccc4)c3)C(=O)NC2=S)cc1 2294259213 SRMFCIVXWYBWMY-UHFFFAOYSA-N 444.512 4.106 10 10 IICE Cc1ccc(N2C(=O)C[C@@H](N3C(=O)C(=Cc4ccc(Cl)cc4)SC3=S)C2=O)cc1 2296741697 LQYKGZNJNUAIKR-MRXNPFEDSA-N 442.949 4.182 10 10 IICE CCn1c(C=Cc2ccccc2[N+](=O)[O-])nc2ccc(I)cc2c1=O 2297369810 OOAGIFZMNTXUQI-UHFFFAOYSA-N 447.232 4.100 10 10 IICE CCN1C(=O)NC(=O)C(=Cc2cn(Cc3ccc(Cl)c(Cl)c3)c3ccccc23)C1=O 2313631447 NLHGKCFXQALGEI-UHFFFAOYSA-N 442.302 4.478 10 10 IICE CC[C@@H](C)N1C(=O)C(=Cc2c(NC3CCCCC3)nc3ccccn3c2=O)SC1=S 2314413904 LJUHYEZKISXVTC-CQSZACIVSA-N 442.610 4.439 10 10 IICE Cc1ccc(C(=O)NN2C(=O)C(=Cc3ccc(O)c(Br)c3)SC2=S)cc1 2314764437 CEPBZXJUMJHFMD-UHFFFAOYSA-N 449.351 4.009 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CCC[C@@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380747674 WOJBKFKEANDRKV-VBKZILBWSA-N 441.366 4.163 10 10 IICE CN(C)c1ccc([C@H]2Nc3ccc(Cl)cc3C(=O)N2NC(=O)Cc2ccccc2)cc1 39919613 WVWMZAMADHCGFA-QHCPKHFHSA-N 434.927 4.246 10 10 IICE COC(=O)CCN1C(=O)/C(=C/c2ccc(OCc3ccc(C)cc3)cc2)SC1=S 40937944 CINCVSYPIUHLFX-UYRXBGFRSA-N 427.547 4.338 10 10 IICE CNC(=O)c1ccccc1OCC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C 106261871 MWMSTERSJIGBLF-UHFFFAOYSA-N 428.435 4.317 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc([N+](=O)[O-])c1)N2 226697147 NTABJDONIMPISH-ZFGGDYGUSA-N 434.540 4.493 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2(c3ccc(F)cc3)CCOCC2)C1 490579808 NSAPMUXXBMBBTE-UHFFFAOYSA-N 449.570 4.369 10 10 IICE COC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(Cl)s3)cs2)c(C)c1 727242130 RZOAHMPIPJRZMG-UHFFFAOYSA-N 428.944 4.421 10 10 IICE CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)NCc1ccc3c(c1)CCCN3C)O[C@H](C)C2 730828691 WZMWCYSNDUAXQI-BUVFEPMLSA-N 435.568 4.146 10 10 IICE Cc1ccc([C@@H](Cn2ccnc2)NC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c(C)c1 749798161 OEEQRJHGOMNHKL-SQJMNOBHSA-N 447.583 4.138 10 10 IICE Cc1noc(C)c1CCCNC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 753665411 XXNROAGOOVIXGZ-ATVHPVEESA-N 449.623 4.083 10 10 IICE Cc1cc(NC(=O)C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)n(-c2ccccc2C)n1 761882779 WKTDLQAUCXXJGT-UHFFFAOYSA-N 445.567 4.077 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(Br)cn1 794819060 XCJRQWZGEZEUTL-QGZVFWFLSA-N 429.406 4.227 10 10 IICE COc1ccc2c(c1)c1c(n2Cc2nc([C@@H]3CCC(=O)N(CC4CCC4)C3)no2)CCCC1 856538245 QSUMGUPAVUXASH-GOSISDBHSA-N 448.567 4.466 10 10 IICE Cc1cc(C(F)(F)F)nn1CC(=O)NCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1 1128385418 WPXSNYCTGBUDLY-ZDUSSCGKSA-N 428.886 4.416 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@H]3CC(=O)N(C)[C@@H]3c3cccc(F)c3)c2C)c1 1132044126 PNEXLJYXYNADEG-UKILVPOCSA-N 433.527 4.377 10 10 IICE Cc1noc(C[C@H]2CCCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)n1 1134484015 LWXHSXNVHNMZQX-GOSISDBHSA-N 426.948 4.463 10 10 IICE C[C@H](NC(=O)Cc1ccc(O)c(O)c1)c1nc(-c2ccc(Br)cc2)cs1 1137324511 GCUGBPWTWRNMPG-NSHDSACASA-N 433.327 4.404 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CC[C@@](CO)(Cc2ccc(F)cc2)C1 1141638647 VDAGKRTUPTUBPA-AREMUKBSSA-N 434.511 4.113 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1C[C@H]2C[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C2 1230200357 IWMHYGOTLLJPAS-BAYUQKDNSA-N 444.620 4.079 10 10 IICE Cc1cc(CC(=O)NCC(=O)Nc2ccc(F)c(F)c2)c(C)n1-c1ccc(Cl)cc1 1264346420 AHZDJGGVTUBSMS-UHFFFAOYSA-N 431.870 4.323 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)c2csc(N3CCCCC3)n2)cc1 1265001688 FWYKGTRMTUQMRQ-UHFFFAOYSA-N 426.508 4.404 10 10 IICE COCCOc1cccc(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1 1270439101 JFTBUIFCDQHYFM-GOSISDBHSA-N 430.976 4.460 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3cccc(C(=O)N4CCOCC4)c3)c2C)c1 1291595975 NATOBYVQRKYUTJ-UHFFFAOYSA-N 431.536 4.436 10 10 IICE CC(C)C[C@@H](CC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1)NC(=O)OC(C)(C)C 1295406878 YOKYCZTUBYIAKN-PMACEKPBSA-N 434.577 4.229 10 10 IICE CN(C)c1ccc(Cn2c([C@H]3CCCOC3)nnc2N2CC[C@@H](C(C)(C)C)C2)cc1F 1298055425 DAPMGBMXNYGHOO-RBUKOAKNSA-N 429.584 4.298 10 10 IICE CSC[C@@H]1CCCN1c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1302705986 HKITYRVHQSWZAN-NRFANRHFSA-N 443.661 4.083 10 10 IICE Cc1nnc(N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)n1CCCSc1nccs1 1304786171 BNVMVLFOBWLNEJ-GMYLUUGSSA-N 435.644 4.160 10 10 IICE CC[C@@H](C)CN(CC)c1nnc([C@H]2CCCCO2)n1Cc1ccc(N2CCOCC2)cc1 1305611480 WBTVWCUKMGYXSJ-NFBKMPQASA-N 441.620 4.277 10 10 IICE COC(=O)c1cccnc1SCC(=O)c1cc(C)n(-c2ccc3c(c2)OCCO3)c1C 1307288066 IJRPOWYPHASBPR-UHFFFAOYSA-N 438.505 4.022 10 10 IICE Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)cc1 1313304110 CPOAJKFCBLECFW-NLFFAJNJSA-N 448.611 4.380 10 10 IICE CCOC(=O)c1c(NC(=O)C[C@@H]2C(=O)Nc3c(F)cccc32)sc2c1CCCCC2 1350512361 SYQFBWOJSGUKPE-AWEZNQCLSA-N 430.501 4.397 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cccc(F)c3OC(F)(F)F)cc2F)C[C@@H](C)O1 1354659618 XAAZAXYHFJUZQN-BETUJISGSA-N 444.400 4.407 10 10 IICE COc1ccc2c(c1)CC[C@@H](C(=O)N[C@@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 1361062930 IJLHOTCGBFUEFH-RTBURBONSA-N 430.495 4.187 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@H]1C[C@H](C)S(=O)(=O)c2sccc21 1450772850 MISDAOJJUQQMDB-LIRRHRJNSA-N 442.562 4.005 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@]3(F)CCN(C(=O)OC(C)(C)C)C3)c2C)c1 1454622540 FLVFOORHHVETSR-DEOSSOPVSA-N 429.536 4.368 10 10 IICE COc1ccc(C(=O)C[C@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1465952036 TXXRYTFHRYKXNR-OXJNMPFZSA-N 444.959 4.044 10 10 IICE COc1c(N)c(C(=O)NCc2c(O)ccc3c2CCCC3)cc(Cl)c1Br 1465958155 HNNKHKQYRHYBLV-UHFFFAOYSA-N 439.737 4.208 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC(Oc2cncc(Cl)n2)CC1 1467360044 ICTYROFSGHBYDQ-UHFFFAOYSA-N 438.915 4.034 10 10 IICE CO[C@H]1CCN(c2nnc(-c3ccc(Cl)cc3)n2CCCSc2nccs2)C1 1505109789 YMAUHZHRFYHBSY-INIZCTEOSA-N 436.006 4.463 10 10 IICE CO[C@@H]1CCCN(c2nnc(CCc3ccccc3)n2CCCSc2nccs2)C1 1518598308 SOBJHUWMNQXQQB-LJQANCHMSA-N 443.642 4.317 10 10 IICE COCCOC1(CNC(=O)c2ccccc2N=Nc2ccc(N(C)C)cc2)CCOCC1 1526051522 DNCWOVCLIDSEPO-UHFFFAOYSA-N 440.544 4.110 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cnc(CCC(F)(F)F)s3)cc2F)C[C@@H](C)O1 1527482237 VPZNYBKNJGIWGB-CHWSQXEVSA-N 445.482 4.321 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccc(OCC(=O)OC(C)(C)C)cc1 1528932241 GXTGKKOFRIVXMB-GOSISDBHSA-N 426.557 4.143 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Nc2cccc(Cl)c2S(C)(=O)=O)CCCC1 1532937519 DQCYOPQGHGLOIB-UHFFFAOYSA-N 446.956 4.224 10 10 IICE Cc1cc(CNC(=O)[C@@H]2CO[C@H](CCC(=O)OC(C)(C)C)C2)c(C)n1-c1ccccc1 1535142456 BILBLVGQJWMVBA-RBBKRZOGSA-N 426.557 4.237 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3c[nH]nc3-c3cccc(Cl)c3)cc2F)C[C@@H](C)O1 1542112802 FJNWOLXJVHDWAB-HUUCEWRRSA-N 442.922 4.413 10 10 IICE CN(c1ccc(CNC(=O)c2cc(F)ccc2N2CCOCC2)cc1)C1CCCCC1 1542410898 VAIOSDFQMXRTRI-UHFFFAOYSA-N 425.548 4.361 10 10 IICE Nc1cc(Br)ccc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1542703986 LGQOQRVIXTZFEN-UHFFFAOYSA-N 440.288 4.032 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)[C@H](O)c3ccc(Cl)c(Cl)c3)cc2F)C[C@@H](C)O1 1543234199 YVFBHJOUKIOGFI-VFGMZZLHSA-N 441.330 4.096 10 10 IICE Cc1noc(C)c1C[C@@H](C)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1544109111 SJWMWFZQJWQFQD-LLVKDONJSA-N 431.334 4.217 10 10 IICE Cc1cc(C(=O)Nc2cc(CC(C)C)nn2C)c(C)n1-c1ccc(Br)cn1 1544316220 YFAJCZMRSHLXEL-UHFFFAOYSA-N 430.350 4.436 10 10 IICE COc1cc(Br)cc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 1544529294 CMYVLLOLRKFFEE-FQEVSTJZSA-N 447.373 4.345 10 10 IICE COc1cc(OC)cc(OCCNC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)c1 1545397475 OTDISKLGCQVFCC-UHFFFAOYSA-N 436.508 4.041 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 1546150755 XBFRGGSZEIWWEB-KRWDZBQOSA-N 443.463 4.285 10 10 IICE CCc1nnc(N2CCO[C@@H](c3ccccc3C)C2)n1CCCSc1nccs1 1546549285 IKVBKZJLJGHWAA-GOSISDBHSA-N 429.615 4.366 10 10 IICE CCCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)[C@@H]1CCCC[C@H]1OC 1559836885 FNCWIPUHUPYJFO-DHIUTWEWSA-N 448.563 4.460 10 10 IICE CCOC(=O)[C@H](Cc1cc(Cl)cc(Cl)c1)NCc1ccc(N2CCOCC2)cc1 1560053475 XZLMDYICIGVEGA-NRFANRHFSA-N 437.367 4.094 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1oc(=O)c2ccccc2c1C 1568378663 JEZNXWDNVHLLJU-UHFFFAOYSA-N 436.508 4.104 10 10 IICE CCOC(=O)C1=C(CN(CC)c2ccc(OC)cc2)NC(=O)N[C@@H]1c1ccc(Cl)cc1 1616007407 SFDIIIDGIFFSRN-OAQYLSRUSA-N 443.931 4.046 10 10 IICE CO[C@H](CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C)Cc1ccccc1 1624529640 JVBNKAARVYKORX-IBGZPJMESA-N 442.357 4.239 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](C)[C@@H]3CN(Cc4ccccc4)CCO3)c2C)c1 1628542983 QIXOBCHMSRQGIU-LVXARBLLSA-N 431.580 4.422 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)c1C 1629008396 TYIOMPKUPIDWBO-RUZDIDTESA-N 435.543 4.345 10 10 IICE Cc1cccc(CN2CCO[C@H](CNC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2)c1 1632291772 CYJIGJUHLJNTII-RUZDIDTESA-N 431.580 4.342 10 10 IICE O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1634753792 RHGZQZKYTQWBNE-AWEZNQCLSA-N 439.846 4.177 10 10 IICE CCOc1ccccc1[C@@](N)(C(=O)NCc1ccc(N2CCCCC2)cc1)C(F)(F)F 1641656784 NLUKMURGKCMSEI-JOCHJYFZSA-N 435.490 4.108 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN3CCC(Sc4ccc(Cl)cc4)CC3)nc12 1653814937 GWUKYYFXVFIUIH-UHFFFAOYSA-N 446.960 4.022 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@H](CN(C)C(=O)OC(C)(C)C)C1 1683253295 GTTWMGLTAQYSLS-VQTJNVASSA-N 446.636 4.281 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@H]2Cc2ccccc2F)N(C)C)cc1 1685610233 WLIRGQCSBXOIDI-UPVQGACJSA-N 426.580 4.301 10 10 IICE Cc1cccc(OC[C@H](O)CN(C(=O)N[C@@H](C)Cc2ccc(N(C)C)cc2C)C(C)C)c1 1686826443 IHLJBWBYEUEGPU-XUZZJYLKSA-N 441.616 4.160 10 10 IICE CCCN(C)c1nnc(Cc2ccsc2)n1Cc1ccc(N2CCSCC2)cc1 1695286292 HSRVWUAQTGZPTQ-UHFFFAOYSA-N 427.643 4.378 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1C[C@H](C)CN(C)C(=O)OC(C)(C)C 1706767238 CGUCIFCFXQSBJB-QGZVFWFLSA-N 431.581 4.247 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CCC[C@H](c3ccnn3C)C2)cc1 1710023977 JKPVAFPRXAXPKY-NRFANRHFSA-N 435.620 4.414 10 10 IICE CCN(CCC1CC1)c1nnc(CC(C)(C)C)n1Cc1ccc(N2CCOCC2)cc1 1710139256 RSLKJHKQBPUAHZ-UHFFFAOYSA-N 425.621 4.378 10 10 IICE COC[C@@H]1CCO[C@@H]1c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N(C)C)cc1C 1712644457 AVCYVGPSVYHMSH-HARLFGEKSA-N 441.620 4.051 10 10 IICE C[C@@H]1C[C@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1 1726486906 QHMUSOKFCDGAPZ-YSHGAJCASA-N 441.576 4.047 10 10 IICE CCc1nnc(N(C)[C@@H](C)c2ccc([S@@](C)=O)cc2)n1CCCSc1nccs1 1744523817 VNMRAHMIMBWYOU-PEGYKEAPSA-N 449.671 4.414 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)c1nnc(C(C)(C)C)n1C[C@H]1CC[C@H](F)C1 1747719886 DEBZSBYOSNTCTF-PMACEKPBSA-N 429.584 4.187 10 10 IICE CC[C@H](C)c1nnc(N2CCCN(C(C)(C)C)CC2)n1Cc1ccc(N(C)C)c(F)c1 1761842957 OTNZMNPNENGFFM-SFHVURJKSA-N 430.616 4.356 10 10 IICE C[C@H]1CCC[C@@H]1Cn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 1762875682 KJKAVLAMXRKGGG-DLBZAZTESA-N 439.585 4.048 10 10 IICE Cc1ccc([C@H](n2nc(C(F)F)c(N)c2I)C2(C)CC2)c(O)c1 2079051601 HWYNGEGNBYGWBD-ZDUSSCGKSA-N 433.240 4.411 10 10 IICE COc1ccc([C@H](n2nc(C3CC3)c(N)c2I)C(C)(C)C)c(O)c1 2080012765 UAPLKRGQYIBFQN-INIZCTEOSA-N 441.313 4.297 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](CNCc1cc(Br)cc(F)c1O)C2 2117677803 PHKMMXPXIYPSMM-WPGHFRTFSA-N 429.330 4.171 10 10 IICE CCOc1ccc(-n2cccc2C=C2C(=N)N3N=C(C(F)(F)F)SC3=NC2=O)cc1 2297346787 DCGDZUKHTCNDHA-UHFFFAOYSA-N 433.415 4.057 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2cccc(OCc3ccccc3C)c2)SC1=S 2314766733 BRCMFVHJGMUDEW-UHFFFAOYSA-N 427.547 4.338 10 10 IICE Cc1ccc(CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)c(O)c1Br 2380762191 MDXBSJYGSPKVSS-UHFFFAOYSA-N 429.236 4.480 10 10 IICE COc1ccc(/C=C2\SC(=S)N([C@H](CC(=O)O)c3ccccc3)C2=O)cc1OC 8765564 XEPSCNHVKJUICU-JQFNYASXSA-N 429.519 4.121 10 10 IICE O=C1NN(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(-c2ccccc2C(=O)O)o1 8872534 MMXKHPDFFPKFKN-XNTDXEJSSA-N 443.242 4.413 10 10 IICE Cc1cccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)SC2=S)c1 47152306 AMHASEITIXXMAK-GPLLRDDGSA-N 427.507 4.132 10 10 IICE O=C1N=C(O)/C(=C/c2ccc(Br)o2)C(=O)N1c1cccc(Br)c1 59198321 DDRNOGQHGMGSCP-XFFZJAGNSA-N 440.047 4.311 10 10 IICE Cc1cc(C)c(NC(=O)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C)c1 435604543 AMKHTNNHMFOYQY-UHFFFAOYSA-N 446.595 4.088 10 10 IICE COc1ccc(N2CCC(NC(=O)N3CCC(N4c5ccccc5C[C@H]4C)CC3)CC2)cc1 728751100 IDTKHEMAOPYWJJ-HXUWFJFHSA-N 448.611 4.289 10 10 IICE Cc1cccc(CC2CN(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)C2)c1 752862711 GGZBSITZYQFGQW-UHFFFAOYSA-N 447.501 4.235 10 10 IICE CC(C)N(CCc1nccs1)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 754569807 MANHCMYSBQZQQI-IRXDYDNUSA-N 434.581 4.059 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1cnc(CC2CC2)nc1 791325605 NUFMXCFKBWQHKB-YBEGLDIGSA-N 444.607 4.111 10 10 IICE O=C(N[C@H]1C[C@H]1C1CCN(Cc2c(O)ccc3ccncc23)CC1)OCc1ccccc1 793667476 JBTZTANDCKPZLW-URXFXBBRSA-N 431.536 4.467 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1c(Br)cccc1Br 798427353 OOJPNFSIEOEIBQ-UHFFFAOYSA-N 440.135 4.301 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)Nc2cn(Cc3ccccc3)nn2)cc1 801729621 MAEFRKPUSVWEQV-UHFFFAOYSA-N 430.512 4.220 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Oc2cccc3c2CCCC(=O)N3)C1 803088610 HEWJHECISZVAHP-UHFFFAOYSA-N 431.536 4.288 10 10 IICE COc1ccc(N2CCN(CCCNC(=O)C(C)(C)Cc3cccc(Cl)c3)CC2)cc1 1124515374 DEWAYIUSWLGEQI-UHFFFAOYSA-N 444.019 4.246 10 10 IICE Cc1cc(CNC(=O)c2cc(S(=O)(=O)C(C)C)ccc2F)c(C)n1-c1ccccc1 1132264643 YWVVQFSHKBYOLC-UHFFFAOYSA-N 428.529 4.345 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N[C@@H](c1ccncc1)C1CC1 1134646185 ICXCPZQWZFBSOM-MTGKDYNDSA-N 441.553 4.080 10 10 IICE Cc1cc(C(=O)NCc2cc(C3CC3)n(C)n2)c(C)n1-c1ccccc1Br 1156939235 XKVPBSBSKKDKGZ-UHFFFAOYSA-N 427.346 4.398 10 10 IICE C[C@H](CO)n1c(C(F)(F)F)nc2cc(NC(=O)c3ccc(N=NC(N)=O)cc3)ccc21 1158510931 OVSBYSJCJKKACJ-SNVBAGLBSA-N 434.378 4.023 10 10 IICE COc1ccc(NS(C)(=O)=O)cc1NC(=O)c1cc(C)n(-c2cccc(Cl)c2)c1C 1158958272 RJJBRFWIEACKPO-UHFFFAOYSA-N 447.944 4.380 10 10 IICE Cc1ccncc1/C=C/C(=O)N1C[C@H](CNC(=O)OC(C)(C)C)Cc2cc(F)ccc21 1178393999 BLHIBICTZAKXRI-JZLODUJNSA-N 425.504 4.273 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CC(C)(C)Oc2ccc(F)cc21 1230650257 WKEWIWRYKCJUJJ-OAQYLSRUSA-N 427.520 4.106 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCN(C4CCC(C(C)C)CC4)CC3)C2)cc1 1252115265 JDHFZCHFCYLYAH-UVKLAMSESA-N 442.648 4.064 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3C[C@@H](c4ccccc4)[C@](F)(CO)C3)c2C)c1 1254073448 IBRCZSBAZSBESX-AZGAKELHSA-N 435.543 4.412 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](Oc3cccc(Cl)c3)C(C)C)cc2F)CC1 1265012227 SESXVYMLCXMLPD-QHCPKHFHSA-N 447.982 4.341 10 10 IICE C[C@@H](NC(=O)c1cnc(Br)c(Br)c1)c1ccc(N(C)C)cc1 1269588675 TYROMHGCNQHBGV-SNVBAGLBSA-N 427.140 4.164 10 10 IICE CC(C)Cc1nnc(N2CC[C@H](C3CCOCC3)C2)n1CCCSc1nccs1 1287405891 CJZNAUDRMPOCSE-SFHVURJKSA-N 435.663 4.368 10 10 IICE Cc1nccnc1CCn1c(N(C)Cc2ccc(N3CCCC3)cc2)nnc1C(C)(C)C 1290536789 UTKCNRMJERDYKT-UHFFFAOYSA-N 433.604 4.153 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)cc1 1292879463 ANRQMXCGZCRLIK-VWLOTQADSA-N 444.531 4.184 10 10 IICE C[C@@H]1C[C@@H](C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1304921669 WVSXYZPSHUSCAJ-QZTJIDSGSA-N 429.584 4.082 10 10 IICE Cc1cc(C(=O)N[C@H]2CCc3ncc(Br)n3C2)c(C)n1-c1cccc(Cl)c1 1305276945 CGSPANWQYZXIFG-HNNXBMFYSA-N 447.764 4.451 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)cc1C 1305740803 RBAZUWKAJGYSLU-PKOBYXMFSA-N 440.636 4.244 10 10 IICE CC[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)cc2C)C[C@H](C)O1 1306454543 XGSNEFZQFFARKT-CVDCTZTESA-N 425.621 4.437 10 10 IICE COC(=O)/C=C\c1ccc(N2CCN(c3cc(Cl)ccc3Cl)CC2)c([N+](=O)[O-])c1 1307158951 WJHKMQSLVNKBGK-CLTKARDFSA-N 436.295 4.414 10 10 IICE CSc1cc(Br)ccc1C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1350933545 OVFYFLPSKGPQRE-UHFFFAOYSA-N 439.350 4.077 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)C(=O)c3cnn(-c4ccccc4)c3)cc2Cl)C1 1436046703 GAYIDIBECHYLSM-KRWDZBQOSA-N 436.943 4.261 10 10 IICE O=Cc1ccc(-c2ccc(C(=O)NCc3ccc(N4CCC(CO)CC4)cc3)cc2)cc1 1444666367 SRIWUIGUELVGKY-UHFFFAOYSA-N 428.532 4.305 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C2(C(F)(F)F)CCN(C(=O)OC(C)(C)C)CC2)c1 1445968426 MFUKGRXVTBBKOL-CYBMUJFWSA-N 446.466 4.158 10 10 IICE COC(=O)c1ccc(OC)c(CN2CCCc3cc(CNC(=O)OC(C)(C)C)ccc32)c1 1459465538 MRLHDQMKCBGXIC-UHFFFAOYSA-N 440.540 4.459 10 10 IICE Cc1cc(CN2CCNC(=O)[C@H]2c2ccccc2Br)ccc1N1CCCCC1 1459897247 RUNNHCHLGFQWIG-JOCHJYFZSA-N 442.401 4.421 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@](O)(C3CC3)C2)sc(C)c1-c1ccccc1 1460389404 KNLMLOMASVLZMP-DEOSSOPVSA-N 442.581 4.076 10 10 IICE O=C(Nc1ccccc1C(=O)NCc1ccc(O)cc1O)c1ccccc1Br 1469160932 WQMSFESHULVVSW-UHFFFAOYSA-N 441.281 4.043 10 10 IICE Cc1sc(CNC(=O)OC(C)(C)C)nc1C(=O)NCc1ccc(N2CCCCC2)cc1 1469303785 YHQXZPBHSJMUCT-UHFFFAOYSA-N 444.601 4.397 10 10 IICE Cc1ccc(N(CC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC2CC2)cc1 1473791903 KHYSNRHLGNLJKI-PMACEKPBSA-N 439.575 4.281 10 10 IICE COc1ccc([C@H](CO)CNC(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1478528223 MTENUJFYQBIXJY-PXNSSMCTSA-N 445.991 4.160 10 10 IICE Cc1nc(Cc2nnc(N3CCC[C@@H](C)C3)n2Cc2ccc(N(C)C)c(F)c2)cs1 1511541273 CODFKKSKLKSFMI-OAHLLOKOSA-N 428.581 4.124 10 10 IICE CC[C@@H](C)c1nnc(N2CCC(CCCO)CC2)n1Cc1ccc2c(c1)CCCN2C 1512891451 KKSHZCHDJJZHGV-LJQANCHMSA-N 425.621 4.211 10 10 IICE CCS(=O)(=O)c1ccc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)c(Cl)c2)cc1 1524254559 KDINOIHROPTKSA-INIZCTEOSA-N 434.989 4.300 10 10 IICE CCCOc1cc(OC)ccc1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 1527481225 GOJIKNIRXQGCKZ-IAGOWNOFSA-N 430.520 4.167 10 10 IICE Cc1cc(CC(=O)N2C[C@@H](C)N(C(=O)OC(C)(C)C)[C@H](C)C2)c(C)n1-c1ccccc1 1529519919 WHOBCYLEJAYPKY-RTBURBONSA-N 425.573 4.493 10 10 IICE COc1ccc2c(c1)CN(C(=O)CCCN1C(=O)/C(=C\c3cccs3)SC1=S)C2 1530024516 MDEXPKPGLFDHFS-WOJGMQOQSA-N 444.603 4.281 10 10 IICE CC(C)Cc1nnc(N(C)CCCc2ccccn2)n1Cc1ccc2c(c1)CCCN2C 1541431850 JKDYFBSLDUKXKE-UHFFFAOYSA-N 432.616 4.371 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2cc(OC)c(OC)cc2Br)cc1F 1543251553 SGVRBADZODFDFU-UHFFFAOYSA-N 439.325 4.382 10 10 IICE Cc1cc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c(C)n1[C@@H]1CCCOC1 1545632310 IBZPYNFKHJPPPQ-LEWJYISDSA-N 445.991 4.210 10 10 IICE CCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCN(C(C)=O)C1 1547019926 IMGDRMLPILULRZ-JOCHJYFZSA-N 448.615 4.457 10 10 IICE C[C@H](NC(=O)N1CCCC[C@H]1c1ncc(Br)cn1)c1ccc(N(C)C)cc1 1564596673 FDAMKCIUXLZSRZ-KSSFIOAISA-N 432.366 4.303 10 10 IICE Cc1cc(CNC(=O)N[C@@H]2CCN(C(=O)Nc3ccccc3)C2)c(C)n1-c1ccccc1 1564636489 JDOAVVCANUOLNA-JOCHJYFZSA-N 431.540 4.200 10 10 IICE CSc1ccc(O[C@@H](C)C(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1 1566356461 FQMHWDPCFITVEN-MAUKXSAKSA-N 434.989 4.316 10 10 IICE COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)C1 1583504271 DOJGRDZNSMYWOG-GCJKJVERSA-N 439.600 4.221 10 10 IICE COCCOC(=O)Nc1cccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)c1 1597365582 UYEGZAIKECYRQL-UHFFFAOYSA-N 435.480 4.354 10 10 IICE COCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 1597949302 CTFCWMYOEYFZSX-OAQYLSRUSA-N 433.593 4.002 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccc(Oc4ccc(F)c(F)c4)cc3)cc2)CC1 1598277814 ZCLDNRKPDGUJHH-UHFFFAOYSA-N 437.490 4.439 10 10 IICE CC[C@@H]1CCC[C@H]1Cn1c(N(C)Cc2ccccc2O)nnc1[C@]1(OC(C)C)CCOC1 1614134703 BDXRHQBCGWSQKG-RNHFSVANSA-N 442.604 4.487 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl 1623451425 AXOHCBYIXUWOGH-UHFFFAOYSA-N 442.274 4.150 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)C1C[C@@H]2CCC[C@H](C1)C2NC(=O)OC(C)(C)C 1623573595 CJWFCXAAFQUWPS-HLVUACMISA-N 437.577 4.214 10 10 IICE Cc1ccc(NC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)c(N(C)C)n1 1623701144 BKUUBVFBDZFDIP-UHFFFAOYSA-N 428.334 4.273 10 10 IICE COc1ccccc1[C@H](CNC(=O)c1cc2cc(O)c(O)cc2s1)N1CCCCC1 1626252536 UBADOJYIWSVIGP-KRWDZBQOSA-N 426.538 4.278 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)C2CC(O)(c3cccc(Cl)c3)C2)cc1 1627205333 NPTOTCCZMKHKTL-VMQIMYIWSA-N 442.987 4.211 10 10 IICE COC(=O)[C@H](CNC(=O)c1cc(C)n(-c2cccc(C(C)C)c2)c1C)Cc1ccncc1 1628408751 BBUUHWRFKNIGIN-QFIPXVFZSA-N 433.552 4.374 10 10 IICE CCc1ccc(-c2nc(CC(=O)NCc3ccc(N4CCC(O)CC4)cc3)cs2)cc1 1630282979 MPXBIDMBLKXRHF-UHFFFAOYSA-N 435.593 4.193 10 10 IICE CC(C)([C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)c1ccc(F)c(F)c1)N1CCCC1 1632651798 MVCYWQOFWYUVQF-IBGZPJMESA-N 429.471 4.473 10 10 IICE Cc1cc(C(=O)NCc2ccn(C3CCCC3)n2)c(C)n1-c1ccc(Br)cn1 1635710648 ODWWVOFJUOKAIX-UHFFFAOYSA-N 442.361 4.493 10 10 IICE Cc1ccc(C(=O)Nc2cccc(-n3cnnc3O)c2C)cc1-n1c(C)cc(C=O)c1C 1637158026 NDBPLDXGKSKNDR-UHFFFAOYSA-N 429.480 4.062 10 10 IICE CCOC(=O)c1ccn(-c2cccc(CNC(=O)c3sccc3-n3c(C)ccc3C)c2)n1 1639995654 MQNPFZASUIWALJ-UHFFFAOYSA-N 448.548 4.448 10 10 IICE CCN(c1ccccc1)S(=O)(=O)c1ccc(N2Cc3cccc(O)c3C2)c([N+](=O)[O-])c1 1640307757 PCDXVWUJALMRDG-UHFFFAOYSA-N 439.493 4.036 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(NC(=O)[C@@H](C)Sc2ncc(C(C)(C)C)s2)c1 1643776018 SDMAAFAMHXWJIJ-LLVKDONJSA-N 436.555 4.133 10 10 IICE COc1cc2c(c(OC)c1)N(CC(=O)Nc1ncc(Cc3ccc(F)cc3)s1)CCC2 1646203021 DBFRIDATXMUDSE-UHFFFAOYSA-N 441.528 4.282 10 10 IICE CCOC(=O)Cc1cccc(N(C)C(=O)c2ccccc2CCNC(=O)OC(C)(C)C)c1 1648692774 AMKIJEZYNUMJNI-UHFFFAOYSA-N 440.540 4.136 10 10 IICE CC(C)N(CC(=O)NCCOc1cccc(C(F)(F)F)c1)Cc1ccc(N(C)C)cc1 1652317294 ZKRYXOWTXQSDJK-UHFFFAOYSA-N 437.506 4.177 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O 1681080279 STZBHGCRAGGZTB-IBGZPJMESA-N 448.350 4.183 10 10 IICE CN1CC[C@@H](CNC(=O)NCc2cccc(Cl)c2O)[C@H]1c1ccc(Cl)c(F)c1 1681171548 ZQQAOXHLXUIDAH-SCLBCKFNSA-N 426.319 4.330 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N(C)[C@@H]1CCSC1 1693005249 GBZLFVPSRMGVOH-HXUWFJFHSA-N 427.643 4.295 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2scnc2C)n1Cc1ccc(N2CCOCC2)cc1 1693992057 USFMJUCMDJNXJS-QGZVFWFLSA-N 440.617 4.078 10 10 IICE C[C@@H](CC#N)N(C)c1nnc(-c2ccc(Cl)nc2)n1CCCSc1nccs1 1706744057 OMTFCJIZLDJGRD-ZDUSSCGKSA-N 433.994 4.371 10 10 IICE CCN(CCC1CC1)c1nnc(C(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1710135308 DMCYWIDFOHZRNB-UHFFFAOYSA-N 425.621 4.285 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1763802130 HTLZSDLZLBMMRS-GOSISDBHSA-N 436.604 4.456 10 10 IICE CCOCCN(CC)c1nnc(Cc2ccsc2)n1Cc1ccc2c(c1)CCCN2C 1766573230 YFQVHLBLXODHMI-UHFFFAOYSA-N 439.629 4.224 10 10 IICE COc1ccccc1-c1nnc(N2C[C@@H](C)O[C@H](C)C2)n1CCCSc1nccs1 1770391990 KSHJADLZSLUMGZ-HZPDHXFCSA-N 445.614 4.206 10 10 IICE CON(C)c1nnc(-c2ccc(Br)s2)n1Cc1ccc(N(C)C)cc1C 1771312847 WEAKCDJQWJFQST-UHFFFAOYSA-N 436.379 4.189 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CCCN(C(=S)NC)C2)sc(C)c1-c1ccccc1 1860668118 VCSBOOHOIJIJTN-INIZCTEOSA-N 445.610 4.055 10 10 IICE [N-]=[N+]=NC[C@H]1CCCN(C(=O)c2cc(I)ccc2Br)C1 1912147226 HPVILHOICBIAFR-SECBINFHSA-N 449.090 4.216 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCc2ccccc2)[C@H]1c1cc(Br)cc(F)c1O 1952850193 CSUJEDLWBQBODS-CZUORRHYSA-N 438.249 4.078 10 10 IICE C[C@H](OCc1ccccc1)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](N=[N+]=[N-])CC1 2010392239 YGEQZVDYFDMTFY-QXAKKESOSA-N 431.537 4.176 10 10 IICE C[C@@H](c1ccccc1O)N(C)C(=O)C[C@@H](COCc1ccccc1)NC(=O)OC(C)(C)C 2060163210 CVELSKQIHZRWGZ-ICSRJNTNSA-N 442.556 4.412 10 10 IICE O=C(Cn1cc(C=C2C(=O)Nc3cc(Cl)ccc32)c2ccccc21)NC[C@H]1CCCO1 2297319117 PYGUOUXPSNUWBQ-QGZVFWFLSA-N 435.911 4.083 10 10 IICE COc1ccc(OCC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N2CCc3ccccc32)cc1 9569185 BYQCTOJYJCRQOD-SANMLTNESA-N 445.563 4.060 10 10 IICE CC(=O)c1ccc(N2C(=O)/C(=C\c3cccc(OCCC(=O)O)c3)SC2=S)cc1 16908152 JGNXSDKIIOXCMM-LDADJPATSA-N 427.503 4.149 10 10 IICE COc1ccc(N2CCN(C(=O)c3csc(Nc4cc(C)ccc4OC)n3)CC2)cc1 38511961 KIQLLMYOPZNDEM-UHFFFAOYSA-N 438.553 4.175 10 10 IICE COc1ccc(N2CCN(c3ncnc(Oc4cccc5ccc(C)nc45)c3N)CC2)cc1 40727669 SUIXJRBMJJTQBD-UHFFFAOYSA-N 442.523 4.043 10 10 IICE CCCCN1C(=O)/C(=C2\SC(=S)N(CCCCCC(=O)O)C2=O)c2ccccc21 40927740 WAQXPJCFTBQZMA-ZCXUNETKSA-N 432.567 4.050 10 10 IICE Brc1cc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)ccc1CNC1CC1 707850185 YBNNRQIPPSNIRE-PMACEKPBSA-N 426.402 4.269 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N(C[C@@H]1CCCO1)C1CCCC1 749564491 KSWUPWVIYTXYKB-NRFANRHFSA-N 437.531 4.390 10 10 IICE C[C@H](NCCc1cnc(C2CC2)nc1)c1cc(Br)cc(Br)c1O 756769768 NGISOTCSQRCKJU-JTQLQIEISA-N 441.167 4.478 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1 769279877 FXONQHGUALTPTH-UIFIKXQLSA-N 426.944 4.478 10 10 IICE Cc1cc(NC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)n(C2CCOCC2)n1 771512500 UMUNGRFVRSHPPC-UHFFFAOYSA-N 437.544 4.436 10 10 IICE O=C(Nc1cccc(N2CCOCC2)c1)c1cc(OCc2ccccc2)ccc1[N+](=O)[O-] 783210712 MCRFWNWVGYLYOG-UHFFFAOYSA-N 433.464 4.263 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)CCc3nc(-c4ccncc4)no3)cc2Cl)C1 800050236 QQSUVFGKCBPRQE-MRXNPFEDSA-N 439.947 4.270 10 10 IICE O=C(NCc1ccnc(Oc2ccccc2F)c1)NCc1cc(Br)ccc1O 805383783 OUZVSDCBXFFOAJ-UHFFFAOYSA-N 446.276 4.481 10 10 IICE Cc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCCO4)c2C)c(Cl)n1 919256871 VDYNHLUWASXYCF-UHFFFAOYSA-N 440.883 4.262 10 10 IICE C[C@H]1c2ccccc2C[C@H]1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1130926947 SJVQPJNVEHSNBS-FEYHVGAQSA-N 440.565 4.262 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)N[C@@H]1CC[C@@H]2[C@H](C1)C2(F)F 1131084697 APQSKENCMKXGPR-BUYWVOCWSA-N 442.578 4.280 10 10 IICE CC(C)c1nccnc1NC(=O)CCCN1C(=O)/C(=C/c2cccs2)SC1=S 1134035028 ZWRIGYMKUKUFCD-KAMYIIQDSA-N 432.596 4.282 10 10 IICE COc1cc(C[C@@H](CO)CNC(=O)c2cc(C)n(-c3cccc(C)c3)c2C)cc(OC)c1 1137498723 FDRGGIDNKVBULO-OAQYLSRUSA-N 436.552 4.001 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@@H](NC(=O)c2ccccc2)c2ccccc2)cc1F 1144977087 AEMVKKLVOLHXKI-DEOSSOPVSA-N 433.527 4.459 10 10 IICE C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccc(OC(F)(F)F)cc1Br 1154026803 OBUYMQKWWZWULD-VIFPVBQESA-N 434.208 4.120 10 10 IICE CC[C@@H](COCC(F)(F)F)NC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1159228795 CDRZLFHZLRMGQE-AWEZNQCLSA-N 448.283 4.339 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1cc(C(F)(F)F)ccc1Cl 1275224767 XWYQPSZZFBKTNR-UHFFFAOYSA-N 434.792 4.404 10 10 IICE CC[C@H](C)[C@H](Cn1c([C@@H]2CCOC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1)OC 1291419623 NSYDCRQRGYUIQH-WPYKKVEZSA-N 441.620 4.080 10 10 IICE Cc1cc(C(=O)N2CCOC[C@H]2C[C@@H]2CCOC2)c(C)n1-c1ccccc1Br 1304201353 ZWESKFUFJGDGTP-ZWKOTPCHSA-N 447.373 4.124 10 10 IICE COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCN(c2ccc(OC)c(F)c2)CC1 1307573651 IGVXOSRLCZZFMI-LJQANCHMSA-N 427.303 4.177 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)Cc2ccco2)cc1F 1314658741 HZLJNDFHQHHBDG-UHFFFAOYSA-N 425.533 4.413 10 10 IICE CCn1c(=O)c2ccccc2n(CC(=O)Nc2ccc(N=Nc3ccccc3)cc2)c1=O 1353790253 NPQDHHSEPCOQDF-UHFFFAOYSA-N 427.464 4.237 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1 1443168378 QGWXUSHNOZNECU-SFHVURJKSA-N 425.876 4.091 10 10 IICE COCc1ccc([C@H]2COCCN2C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)o1 1456032614 YHPDJMQRACOIOH-HSZRJFAPSA-N 436.508 4.168 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@@H]3[C@H]2CCCN3C)sc(C)c1-c1ccccc1 1460731265 QUHSMZRCXHXHJE-RTBURBONSA-N 441.597 4.007 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H](CC(C)(C)C(N)=O)C2)c(C)n1-c1ccc(Cl)cc1 1468199721 UEPABFPLELNRED-GOSISDBHSA-N 429.992 4.430 10 10 IICE O=C(NCCCc1c(Cl)cccc1Cl)NCc1ccc(N2CCC(O)CC2)cc1 1470647483 AZEFYPBKUOLTMK-UHFFFAOYSA-N 436.383 4.387 10 10 IICE Cc1cc(-c2nnc(N(C)[C@@H]3CCC[C@@H](C)C3)n2CC(=O)N(C)C)c(C)n1-c1ccccc1 1510600406 CPYJQRFFOZODOI-XMSQKQJNSA-N 448.615 4.456 10 10 IICE CC[C@H]1CCc2c(sc(NC(=O)[C@H]3CC(=O)N(C4CC4)C3)c2C(=O)OC(C)(C)C)C1 1523612863 CPRNRXJFQHOXMV-KBPBESRZSA-N 432.586 4.168 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3cc4cc(C(F)(F)F)ccc4n3C)C2)cc1 1537108759 DGXYLAHBUCNGMG-HNNXBMFYSA-N 431.458 4.462 10 10 IICE CO[C@H]1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1(C)C 1543807841 JFPYACJCEISASV-STTHAQSSSA-N 438.640 4.003 10 10 IICE CCCN(C(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@@H](CC)c1ccccc1 1544179873 JPTFHSZFAXOILQ-DACFSCGWSA-N 449.595 4.290 10 10 IICE Cc1cc(C(=O)Nc2cn3cc(Br)ncc3n2)c(C)n1-c1ccc(F)cc1 1556294055 QXRHLSFXKFYMDF-UHFFFAOYSA-N 428.265 4.291 10 10 IICE CCOCc1nc(Cl)cc(NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 1559072694 MACDXKGRCNDVNN-UHFFFAOYSA-N 430.858 4.134 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)C(F)(F)c2ccccc2Br)cc1 1585449071 FCTGIEWBAGMSPA-UHFFFAOYSA-N 427.289 4.144 10 10 IICE CCn1nc(C(F)(F)F)c(C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)c1C(F)F 1585665942 XGROKRBPNSEBRL-GFCCVEGCSA-N 446.420 4.124 10 10 IICE Cc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1S(=O)(=O)N1CCCCC1 1586856527 PZRKNRVDIZYDFA-UHFFFAOYSA-N 446.550 4.048 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N(C)[C@H](C)c2ccc([S@@](C)=O)cc2)cc1 1587686550 ALYSFWTVNLFMBO-WTPASJBYSA-N 436.577 4.406 10 10 IICE Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1597144904 YCGWURVEHPOZLX-UHFFFAOYSA-N 426.494 4.425 10 10 IICE Cc1cc(Br)cc(Cl)c1C(=O)NCc1ccc(N2CCN(C)CC2)cc1 1598277487 QEFWDUXBKKIPHS-UHFFFAOYSA-N 436.781 4.093 10 10 IICE CN(C)c1ccc([C@@H](CNc2ncnc(-c3ccccc3)n2)NC(=O)OC(C)(C)C)cc1 1612346008 ZMFVXLKTZXVLAW-HXUWFJFHSA-N 434.544 4.283 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)c(F)c1 1625794936 YLXNWGKMDWKOTR-XMSQKQJNSA-N 431.939 4.113 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1631398822 NYSDLYLJPVENRL-SFHVURJKSA-N 429.521 4.101 10 10 IICE Cc1cc(CC(=O)NC[C@@H]2CN(c3ccc(Cl)cc3)CCO2)c(C)n1-c1ccccc1 1632972654 LNUJFNGDVVSQQQ-XMMPIXPASA-N 437.971 4.312 10 10 IICE Cc1cc(CC(=O)N(C)Cc2nnc3n2CCC[C@@H]3C(F)(F)F)c(C)n1-c1ccccc1 1634467682 NTOIEGHULUPPQG-IBGZPJMESA-N 445.489 4.326 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2 1635801031 AWJPWOIENHUAQL-GHTZIAJQSA-N 444.620 4.081 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@@H](C)Cc3cn(C)c4ccc(F)cc34)CC2)cc1 1636112704 BIFQPLUNWGQKLK-SFHVURJKSA-N 438.547 4.179 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1 1636262479 HKQQSNWORCCEOL-CRAIPNDOSA-N 435.494 4.348 10 10 IICE C[C@@H]1C[C@@H](C)N(C(=O)c2cc3cc(O)c(O)cc3s2)C[C@H]1CNC(=O)OC(C)(C)C 1639532750 ULFCAOFSEGIUPM-UMVBOHGHSA-N 434.558 4.324 10 10 IICE COc1ccc(N(CC(=O)Nc2cccc(CN3CCSCC3)c2)CC2CC2)cc1 1643140329 SULDFVHYHKFYIQ-UHFFFAOYSA-N 425.598 4.099 10 10 IICE CCN(CCc1cccs1)[C@@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1657081181 XCEQORIKDWFGJP-INIZCTEOSA-N 432.545 4.415 10 10 IICE CN(Cc1ccccc1)C1(CNC(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)CCC1 1682443430 BLJSOYQEVSHMMH-QHCPKHFHSA-N 437.584 4.138 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C 1683252996 CHRBJQIWEOCXAY-CMKODMSKSA-N 432.609 4.079 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(CCO)Cc3cccnc3Cl)c2C)c1 1683302758 AQTNKYXOXFEKAJ-UHFFFAOYSA-N 426.948 4.155 10 10 IICE CC(C)[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCC(CO)CC3)cc2)C1 1706337696 PZLSDICCWBVGRJ-QFIPXVFZSA-N 439.648 4.315 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccncc3)nnc2N(C)C[C@H]2CCCOC2)cc1 1728383828 FUMFSTYWLSVCHV-HSZRJFAPSA-N 448.615 4.021 10 10 IICE CCO[C@@H]1C[C@@H](N(C)c2nnc(-c3ccccn3)n2Cc2ccc(N(C)C)cc2C)C1(C)C 1728920999 DWEXEZDGXHCENO-DHIUTWEWSA-N 448.615 4.403 10 10 IICE CCO[C@]1(c2nnc(N3CCC[C@H](C)C3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1746714895 LZADUKCCYVIYED-NBGIEHNGSA-N 441.620 4.061 10 10 IICE CC(C)NC(=O)CCn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1750981585 DEOBDHISJJZDPS-UHFFFAOYSA-N 438.620 4.087 10 10 IICE CC[C@@H](C)c1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1Cc1c(C)noc1C 1763712772 XQMNWOFBRFYZJQ-QGZVFWFLSA-N 438.576 4.170 10 10 IICE CN(C)c1ccc(Cn2c(Cc3ccsc3)nnc2N(C)CC2CC(F)C2)cc1F 1768496804 RZOGFWFLVVZVGU-UHFFFAOYSA-N 431.556 4.368 10 10 IICE CC[C@H](c1ccc(C)cc1O)n1nc(C2(C)CC2)c(CO)c1I 2079025516 NRUQEOKXMZVEHH-CQSZACIVSA-N 426.298 4.045 10 10 IICE CC[C@@H](NC[C@H](CCOC)NC(=O)OC(C)(C)C)c1cc(Br)ccc1O 2225569035 LLYFUQUPJJLNRE-GOEBONIOSA-N 431.371 4.125 10 10 IICE CC[C@@H](C)NCc1ccc(N(CC(=O)N(C)C)Cc2ccccc2)c(Br)c1 2240054833 ZBMAJWXZNWOAMO-QGZVFWFLSA-N 432.406 4.432 10 10 IICE Cc1ccc(N2C(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C(=O)NC2=S)cc1 2296937106 PXKFXSILOJRNSH-UHFFFAOYSA-N 433.508 4.373 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)CCC[C@H]2NC(=O)OC(C)(C)C)c(O)c1Br 2380747673 WOJBKFKEANDRKV-JLTOFOAXSA-N 441.366 4.163 10 10 IICE Cc1ccccc1NC(=O)CCCN1C(=O)/C(=C\c2cccc3c2OCO3)SC1=S 6973905 BASPXQUIJQAOQF-LDADJPATSA-N 440.546 4.344 10 10 IICE O=C(O)Cc1ccc(N2C(=O)/C(=C/c3cccc(Br)c3)SC2=S)cc1 16930565 FQGNKBJOVHNNBG-DHDCSXOGSA-N 434.336 4.482 10 10 IICE COc1ccc(N2CCN(C(=O)c3cccc(-c4nc(-c5ccccc5)no4)c3)CC2)cc1 21707703 MSJGXFYVZYQKJB-UHFFFAOYSA-N 440.503 4.375 10 10 IICE CCOC(=O)c1cccc(N2C(=O)/C(=C\c3cc(OC)ccc3OC)SC2=S)c1 33313668 VBRQOLDSEXXEPI-LDADJPATSA-N 429.519 4.286 10 10 IICE CN(C)c1ccc(/C=C2/C(=O)N(c3ccc(F)cc3)C(=S)N=C2O)cc1Br 33659549 NZCZIQLDHULBOM-NTEUORMPSA-N 448.317 4.326 10 10 IICE O=C(CCCOc1ccccc1[N+](=O)[O-])Nc1cccc2c1C(=O)c1ccccc1C2=O 96746796 QPKUFGGNWFWURC-UHFFFAOYSA-N 430.416 4.168 10 10 IICE O=S(=O)(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1Cl)N2)N1CCOCC1 250206860 VPUUIAYDDUFWLK-HYFFOGBASA-N 430.957 4.187 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C(C)(C)c2cccs2)NC(=O)OC(C)(C)C)cc1 742755135 WAWHKEXISBUXLJ-SFHVURJKSA-N 431.602 4.474 10 10 IICE CN1C(=O)C[C@@H](NCc2cccc(Br)c2O)[C@H]1c1ccc(Cl)c(F)c1 754832667 JRTQIGDEIXGHBU-NVXWUHKLSA-N 427.701 4.009 10 10 IICE Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 766595698 KEGDICXWNWQUPJ-BBWFWOEESA-N 445.583 4.260 10 10 IICE C[C@H](NC(=O)Nc1ccccc1C(=O)OC(C)(C)C)c1ccc(N2CCOCC2)cc1 775360175 MFUGLNNNIFOVFG-KRWDZBQOSA-N 425.529 4.361 10 10 IICE CCOc1ccc(-c2csc(NS(=O)(=O)c3ccc(C(F)(F)F)nc3)n2)cc1 782261181 KIYAROPPHNZUPE-UHFFFAOYSA-N 429.445 4.423 10 10 IICE Cc1cc(NC(=O)c2ccc3c(c2[N+](=O)[O-])C(=O)c2ccccc2C3=O)nn1[C@H](C)C1CC1 784115618 JNIVFPRFFUKJFW-CYBMUJFWSA-N 444.447 4.098 10 10 IICE C[C@@H](NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(Br)cc1O 798935511 QAERYCFFHRGPOR-CYBMUJFWSA-N 425.754 4.496 10 10 IICE Cc1cc(C(=O)N[C@@H](c2cnn(C)c2)C2(CO)CCC2)c(C)n1-c1ccc(Cl)cc1 820168419 OWHFDGYKDBXEJP-NRFANRHFSA-N 426.948 4.115 10 10 IICE COc1ccc(N(CC(=O)N2[C@@H](C)CCC[C@@H]2C)CC(=O)N2[C@@H](C)CCC[C@H]2C)cc1 914866984 CNMYTDJSDXBLNF-XSDIEEQYSA-N 429.605 4.081 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C[C@]2(C)CC2(Cl)Cl)NC(=O)OC(C)(C)C)cc1 1136903510 FRSLBFJJURMOMH-OXJNMPFZSA-N 444.403 4.409 10 10 IICE CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC1(S(C)(=O)=O)CCCCC1 1188392680 LRPIRKCPZLBXSZ-UHFFFAOYSA-N 436.599 4.181 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCCC[C@@H]2[C@H](C)O)sc(C)c1-c1ccccc1 1190865565 XKEIMISQLXNBSU-MAUKXSAKSA-N 430.570 4.074 10 10 IICE CN(C)c1ccc2c(c1)OCCN2CC(=O)N(C)[C@@H](c1ccccc1)c1ccc(F)cc1 1192940076 YYKZSRBEFKLNEG-SANMLTNESA-N 433.527 4.339 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 1230195212 LCDPKKPMLDVZFV-INIZCTEOSA-N 437.510 4.254 10 10 IICE CC(C)(C)Cc1nnc(N2CCC(F)(F)C2)n1Cc1ccc(N2CCSCC2)cc1 1287023943 JBCQAMCPOZAXPM-UHFFFAOYSA-N 435.588 4.314 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@](C)(O)c1ccco1 1287359150 JPQJGQKFVDGYBO-VWLOTQADSA-N 437.588 4.214 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)OCc1cccc(C)c1 1297228150 BLTDXUNMRFABCZ-LJQANCHMSA-N 426.557 4.289 10 10 IICE COC(=O)[C@]12CCC[C@H]1N(C(=O)c1cc(C)n(-c3ccc(Br)cc3)c1C)CC2 1303363175 LJRQVOPDYCTNHX-KNQAVFIVSA-N 445.357 4.414 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2C[C@](C)(O)CC)CCO1 1306396655 JFXSOYKLOJCLPL-PXDATVDWSA-N 437.588 4.129 10 10 IICE CC[C@@H]1c2ccc(OC)c(OC)c2CCN1c1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-] 1307158738 SIGBBVPPBJGWNA-JGZYNSJSSA-N 426.469 4.312 10 10 IICE CO[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCCSC)C1 1316314192 MMGHBLLZWLNYTK-HXUWFJFHSA-N 425.602 4.331 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)NCCCc1ccccc1 1349514661 LQKJKIXSXOIKKD-XDJHFCHBSA-N 428.554 4.166 10 10 IICE CC[C@H](NC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)c1C)c1cccc(S(N)(=O)=O)c1 1467236633 HHDQYRLFPPKVQI-QHCPKHFHSA-N 439.581 4.239 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)NCc2cccc(Cl)c2O)CC1 1471582991 KAMOMQFUWHJTNP-HNNXBMFYSA-N 425.957 4.272 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)Cc1nc2ccccc2n1-c1ccc(OC)cc1 1473572150 AVNYYVULMLMJFT-UHFFFAOYSA-N 445.519 4.305 10 10 IICE CC[C@@H]1CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCSCC3)cc2)C[C@H](C)O1 1499652726 PVVHNLCOCAJBJK-GHTZIAJQSA-N 443.661 4.181 10 10 IICE CCOC(C)(C)Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1502566408 CRDNQRVGKXTXSD-UYAOXDASSA-N 430.593 4.354 10 10 IICE CCOCc1nnc(N2CCC[C@H](C)CC2)n1Cc1ccc(N2CCSCC2)cc1 1503082426 TVEXAFUIDWLBEO-IBGZPJMESA-N 429.634 4.043 10 10 IICE CC[C@H](C)c1nnc(N(CC)CC2CC2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1512834232 GLEKEIAXUQWHGO-IBGZPJMESA-N 425.621 4.285 10 10 IICE Cc1ccnc(Oc2ccc(C(=O)Nc3cccc(N4CCC(C(N)=O)CC4)c3)cc2)c1 1530278023 XYBFQODDPVPSCU-UHFFFAOYSA-N 430.508 4.136 10 10 IICE Cc1cc(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)c(C)n1-c1ccc(Cl)cc1 1540613148 GNDZQNXQQNCFII-UHFFFAOYSA-N 443.956 4.441 10 10 IICE Cc1cc(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)c(C)n1-c1cnn(C)c1 1540800327 MVKIGUYWXVEIRY-UHFFFAOYSA-N 431.540 4.329 10 10 IICE CC(C)Cc1nnc(N2CCCC2(C)C)n1Cc1ccc(N2CCC(CO)CC2)cc1 1541462829 HJUNILSMADKHKO-UHFFFAOYSA-N 425.621 4.112 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)CC(F)(F)C(F)(F)F)NC(=O)OC(C)(C)C)cc1 1544269379 SAJLTSNGRDVVEQ-AWEZNQCLSA-N 439.425 4.022 10 10 IICE CC(C)Cc1nnc(NC(=O)CN(Cc2cccs2)c2ccc3c(c2)OCCO3)s1 1559599707 SDKLAYYDGMQUJZ-UHFFFAOYSA-N 444.582 4.215 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc2cc(Br)ccc2o1 1585536011 MZYYGOIEGVETAF-UHFFFAOYSA-N 429.314 4.086 10 10 IICE Cc1cc(-c2nnc(Nc3cnn(C)c3)n2CC(C)(C)CN(C)C)c(C)n1-c1ccccc1 1611936313 WIWUNSFTYOGUPD-UHFFFAOYSA-N 446.603 4.418 10 10 IICE CC[C@@H](C)c1nnc(N2C[C@H](OC)C(C)(C)C2)n1Cc1ccc(N2CCSCC2)cc1 1613206822 JPKQNTVPUJRACY-NQIIRXRSSA-N 443.661 4.254 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)Cc2ccc(OCc3ccccc3)cc2)N(C)C)cc1 1618643735 NFDICRAIDBBZDB-SANMLTNESA-N 431.580 4.293 10 10 IICE COc1ccc(F)cc1CN1CCN(C(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)CC1 1624414057 OTJYKHYHHAHYOY-UHFFFAOYSA-N 439.506 4.339 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NCC2(N3CCSCC3)CCCCC2)c1 1629011445 WFZQPTIBYLZJRG-UHFFFAOYSA-N 439.625 4.388 10 10 IICE O=C(/C=C/c1ccccc1OCc1ccccc1)NCc1ccc(N2CCOCC2)cc1 1631070329 VCHHRINRHKTZJA-NTCAYCPXSA-N 428.532 4.432 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCn3c(nnc3C(F)F)C2)cc1 1635514095 QTYQNZWNKNYPAO-UHFFFAOYSA-N 425.443 4.353 10 10 IICE Cc1cc(C(=O)NC[C@H]2CS(=O)(=O)c3ccccc32)c(C)n1-c1cccc(Cl)c1 1637373576 CYAAEPZXMBKACW-INIZCTEOSA-N 428.941 4.048 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@]1(C)CCOC2(CCC2)C1 1638543183 USPIFFXSYNFCMA-LJQANCHMSA-N 425.367 4.426 10 10 IICE C[C@H]1NC(=O)N(CCSc2ncc(-c3ccc(Cl)cc3)n2Cc2ccccc2)C1=O 1643465082 WXKGGYLPEAJEKF-OAHLLOKOSA-N 440.956 4.284 10 10 IICE CCOC(=O)CN(CCC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1O 1646331647 VHJYYZDXLKIREY-UHFFFAOYSA-N 425.312 4.093 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)c1c[nH]nc1[N+](=O)[O-] 1648493401 FEEVPXIMWBZOPG-INIZCTEOSA-N 433.390 4.243 10 10 IICE COC(=O)c1cc(OCc2csc(CC(=O)Nc3ccccc3C)n2)ccc1N(C)C 1653034043 RSEOLXLURVMOSN-UHFFFAOYSA-N 439.537 4.064 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@H](C)Cc3cn(C)c4ccc(F)cc34)C2)cc1 1681963967 MQJSMNFQUMOHBS-MSOLQXFVSA-N 438.547 4.083 10 10 IICE Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)C1 1683195818 PGNDOTIQTDDASO-HKUYNNGSSA-N 429.511 4.197 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)NC[C@H]2CC[C@H](C(F)(F)F)O2)cc1 1685139797 INEFRTHOFGEPSX-IEBWSBKVSA-N 425.451 4.167 10 10 IICE CC[C@@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CC1(CCOC)CC1 1694134123 MECYAHXHGUAKIF-GOSISDBHSA-N 445.583 4.083 10 10 IICE C#CCN(CC#C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@H]1OC 1705574476 FAEZOGQBAVBMBU-WIOPSUGQSA-N 441.579 4.241 10 10 IICE C#C[C@]1(C)CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@@](=O)CC 1705669231 GUCFRWOYRAOIML-GOXGLGGOSA-N 449.624 4.113 10 10 IICE CCc1nnc(N2CCO[C@@H](c3cccc(OC)c3)C2)n1CCCSc1nccs1 1709157277 YZSUOHUWYPXRMK-GOSISDBHSA-N 445.614 4.066 10 10 IICE CCOCCN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCC(C)CC2)cc1 1747341944 JKBCGBVSLNFVQQ-UHFFFAOYSA-N 448.615 4.406 10 10 IICE CN(C[C@@H]1CC=CCC1)c1nnc(C(C)(C)C)n1Cc1ccc(N2CCOCC2)c(F)c1 1747822534 AUWKBNKRZPFPCO-LJQANCHMSA-N 441.595 4.392 10 10 IICE CO[C@@H](Cn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCOCC2)cc1)C(C)C 1748440427 ZCHOCQNGYOREOL-QFIPXVFZSA-N 443.636 4.011 10 10 IICE CC(C)SCCn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1761330035 AHOIAZBEOLVCAQ-UHFFFAOYSA-N 431.650 4.190 10 10 IICE CC[C@@H]1CCN(c2nnc([C@H]3OCC[C@H]3COC)n2Cc2ccc(N(CC)CC)cc2)C1 1765204522 JMGOYNVUDWDVJT-NWSQWKLXSA-N 441.620 4.133 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3CCc3ccsc3)CC2)cc1 1768703128 BXQZKKUURZZGNE-UHFFFAOYSA-N 425.602 4.431 10 10 IICE COC(=O)c1c(NC(=O)C(=O)NCCc2ccccc2)sc(C)c1-c1ccc(C)cc1 1860760986 LIJYVASLPFGFMQ-UHFFFAOYSA-N 436.533 4.116 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(Nc3ccc4nc[nH]c4c3)C(=O)N(C3CC3)C2=O)cc1 1873422354 SDSPRJSNEYRKKC-UHFFFAOYSA-N 437.503 4.325 10 10 IICE CSCC[C@@H](C(=O)O)N1C(=O)C(=Cc2ccc(-c3ccccc3F)o2)SC1=S 2040480255 LQGYHWGWEKPFSS-AWEZNQCLSA-N 437.539 4.493 10 10 IICE CC[C@H](NC[C@@H]1CO[C@H](CNC(=O)OC(C)(C)C)C1)c1cc(Br)ccc1O 2159115557 XCGDBCWRNCSNRZ-KMFMINBZSA-N 443.382 4.125 10 10 IICE CN(Cc1csc(=NCc2c(O)cccc2Br)[nH]1)C(=O)OC(C)(C)C 2217855269 VGLNPSUZMCZZCI-UHFFFAOYSA-N 428.352 4.012 10 10 IICE CSc1nc2ccccc2n1C(=O)CCN1C(=O)C(=Cc2ccco2)SC1=S 2296703406 GGLZVCARTOPPLC-UHFFFAOYSA-N 429.548 4.283 10 10 IICE CCN1C(=O)C(=CC=CC2=C3N(CCC2)c2ccccc2C3(C)C)C(=O)N(CC)C1=S 2297612555 CVFYDBZPVYXUDQ-UHFFFAOYSA-N 435.593 4.310 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(CCc3ccc(O)cc3)C2=O)cc1)C(=O)O 2314928684 AETRCFIWMHTDET-GOSISDBHSA-N 443.546 4.078 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(C)c3)C2=O)ccc1OCCC(=O)O 2314933147 UGQFRKTVEUSYRG-UHFFFAOYSA-N 429.519 4.263 10 10 IICE C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)SC1=S 47152314 TYZFVOUQVNMBCV-OKHBPPCESA-N 447.925 4.477 10 10 IICE COC(=O)c1ccc(C(=O)OC)c(N[C@@H](c2ccco2)c2ccc3cccnc3c2O)c1 54620954 XZMVWLNGHJIQMU-OAQYLSRUSA-N 432.432 4.308 10 10 IICE Cc1cc(C(=O)CN2CCN(C(=O)Nc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 62694625 ZVYRMDVCSCMJBF-UHFFFAOYSA-N 434.515 4.266 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCC(CN4C[C@H](C)O[C@H](C)C4)CC3)c2C)cc1 110413011 HOCPFLZYYPRDQH-BGYRXZFFSA-N 439.600 4.064 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3ccc(OC)c(OC)c3)[C@@H]2c2ccc(O)c(O)c2)c1 526383571 YQIQZSLLPSWSQK-HSZRJFAPSA-N 449.459 4.181 10 10 IICE CCCN(Cc1ccccc1O)C(=O)NCC1(c2cc(C)ccc2OC)CCOCC1 731284487 WPQIGFOQSKLWMZ-UHFFFAOYSA-N 426.557 4.379 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N(C)c2cccc(Br)n2)C1 766893883 XDNYSJVWSUNEMA-UHFFFAOYSA-N 441.373 4.228 10 10 IICE CC(C)Oc1ccc([C@@H](O)CNC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1 768047425 SQURDWOFVCPDDO-SANMLTNESA-N 449.595 4.045 10 10 IICE C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 771544382 IDFVPGXTYOUNQU-AOMKIAJQSA-N 445.510 4.290 10 10 IICE CCC(CC)[C@@H]1C[C@@H](NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CCO1 778748803 MMMAJIJMDGVYLK-ZCYQVOJMSA-N 442.648 4.002 10 10 IICE CC(C)(C)OC(=O)NCc1cccc(C(=O)NCc2cc(Br)ccc2O)c1 804732842 DJAABDVWEYPMOS-UHFFFAOYSA-N 435.318 4.109 10 10 IICE C[C@H](NC(=O)NCc1cc(Br)ccc1O)c1ccc(NC(=O)C2CC2)cc1 806404416 IEHMSUOPUNDNSZ-LBPRGKRZSA-N 432.318 4.064 10 10 IICE CC(C)(C)OC(=O)N[C@H](CCC(=O)NCCc1ccc(O)c(O)c1)CC1CCCCC1 1137464536 DTABWXOOPRGWSI-LJQANCHMSA-N 434.577 4.400 10 10 IICE O=C(/C=C\c1ccc(O)c(O)c1)NCCOc1c(Cl)cc(Br)cc1Cl 1137955842 OMILFOUHTLKSLL-RQOWECAXSA-N 447.112 4.376 10 10 IICE NC(=O)N=Nc1ccc(C(=O)N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)cc1 1141566474 NWJJPDDXPZFTQR-RTWAWAEBSA-N 449.511 4.016 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)Nc3ccc(OCCN(C)C)c(F)c3)ccc21 1142010030 GEDRWKXLHFFXNH-UHFFFAOYSA-N 427.520 4.236 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1cc2c(N(C)C)ncnc2n1C 1152402506 ZCCFUTLZDSGGPQ-KRWDZBQOSA-N 429.524 4.144 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H](C)[C@@H]2CCO)sc(C)c1-c1ccccc1 1171833893 KYKRRFKKBFENFF-APWZRJJASA-N 444.597 4.322 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCC(O)CC2)cc1)[C@H]1C[C@@H](OCC)C12CCCC2 1233605513 XKIBLWPNHWOZHD-BJKOFHAPSA-N 443.632 4.307 10 10 IICE Cc1cccc([C@H]2C(=O)NCCN2C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1 1280388036 YCZRNCIOGOQCNN-DEOSSOPVSA-N 435.955 4.298 10 10 IICE COCCOC(=O)c1c(C)[nH]c(C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)c1C 1287659669 ACVPUCGSKVKENB-UHFFFAOYSA-N 437.540 4.081 10 10 IICE COC[C@@H]1CCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CC(F)(F)F)C1 1301298728 WMKKYUNCFNUQQA-QGZVFWFLSA-N 433.478 4.388 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)c(C)n1-c1ccccc1 1301988242 AHBARYHAOIYSGU-DEOSSOPVSA-N 430.552 4.449 10 10 IICE Cc1noc(C)c1[C@H](C)Cn1c(Cc2ccncc2)nnc1N(C)Cc1ccccc1O 1304877315 JVUOLKIPHOALCD-MRXNPFEDSA-N 432.528 4.014 10 10 IICE CC[C@H](C)N[C@H](CNC(=O)Cn1c2c(c3ccccc31)CN(C(C)C)CC2)c1ccco1 1306840155 PHQBUVRZOQSNIU-SIKLNZKXSA-N 436.600 4.246 10 10 IICE COc1cc2oc(=O)cc(C)c2cc1CCC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1349120843 YZHXASANHVTCFO-UHFFFAOYSA-N 434.536 4.301 10 10 IICE CC(C)OC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)sc2c1CC[C@H](C)C2 1354327561 YCBIJIHIKGVGHA-LSDHHAIUSA-N 432.586 4.168 10 10 IICE Cc1oc(Br)cc1C(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 1359864608 BHOVQDKOACQLDU-UHFFFAOYSA-N 429.261 4.351 10 10 IICE COc1ccc(C(=O)NCCCC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)cc1 1438310744 HULVCWDQQOHISJ-UHFFFAOYSA-N 433.552 4.238 10 10 IICE C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1C(=O)NCc1cc(Cl)cc(Cl)c1O 1450720830 DKGUTKFOCQCNKL-QMTHXVAHSA-N 433.332 4.076 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H](COC)C2)sc(C)c1-c1ccccc1 1459479502 KJDWFNRTYFXYAR-QGZVFWFLSA-N 430.570 4.197 10 10 IICE Cc1cc(C(=O)N2CCN(CCOC(C)C)CC2)c(C)n1-c1cccc(Br)c1 1465675840 YGNAWMIOOVXNNF-UHFFFAOYSA-N 448.405 4.039 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)N(C)C)cc1 1479534199 MCHGUINQJVJYOB-HWBMXIPRSA-N 436.600 4.139 10 10 IICE CCCCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@@H](OC)C1 1514540177 HFQZBPHVXTWSIJ-JOCHJYFZSA-N 437.588 4.394 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3c(C)ccc(Br)c3OC)C2)cc1 1529708053 OQAQPMUNHMHMTR-OAHLLOKOSA-N 433.346 4.031 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2cccc(N(C)S(C)(=O)=O)c2)c1 1539811225 AIIMNNVAUIQODJ-UHFFFAOYSA-N 445.972 4.073 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C/C(=O)N[C@H](CC(C)(C)C)c3ccccc3)CC2)cc1 1540817980 JTIUHMZBJFOFME-DKUDOZJNSA-N 449.595 4.194 10 10 IICE CC(C)Cc1nnc(N2CCN(c3ccccc3)CC2)n1CCCSc1nccs1 1541471035 JLXIOQSNYHDASH-UHFFFAOYSA-N 442.658 4.442 10 10 IICE Cc1cc(CC(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)c(C)n1-c1ccccc1 1542904668 PYBQTCDETYXZKV-UHFFFAOYSA-N 433.527 4.150 10 10 IICE C[C@H]1CCCCN1CCCCn1c([C@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1544019553 ZWISLBQDTQPFFD-UNMCSNQZSA-N 441.620 4.169 10 10 IICE O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(Br)c(F)c1 1544720736 IPWMKVYEGXSWTK-UHFFFAOYSA-N 446.364 4.050 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccnc3)nnc2N2C[C@@H](C)OC(C)(C)C2)cc1 1547443759 HEPCTAXFVOGYCU-LJQANCHMSA-N 434.588 4.238 10 10 IICE COc1ccc(N2CCCN(c3nnc(C)n3CCc3ccc(Cl)s3)CC2)cc1 1554959168 JUBQZYWMGJVWOA-UHFFFAOYSA-N 431.993 4.269 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccnc1SCc1cccc(Br)c1 1557084803 OYCFUHRKEIMOQU-UHFFFAOYSA-N 445.338 4.478 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NCCCCN1C(=O)c2ccccc2C1=O 1559107960 VHGHYZVCEUGEDJ-UHFFFAOYSA-N 443.459 4.314 10 10 IICE CC(=O)Nc1ccccc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1587637636 UBCQYGLUXOODTM-LDADJPATSA-N 443.525 4.014 10 10 IICE Cc1cc(C(=O)Cn2cc([N+](=O)[O-])c(-c3ccc(F)cn3)n2)c(C)n1-c1ccc(F)cc1 1613817949 ZTWCKTGUGZOKQZ-UHFFFAOYSA-N 437.406 4.422 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N2CCC[C@H](CC(=O)OC(C)(C)C)C2)CCCC1 1621984441 AROFSXZUMROLNY-GOSISDBHSA-N 440.584 4.499 10 10 IICE COc1ccc(Cl)cc1[C@H](O)CNC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1627482540 IIAFITUYPULAKJ-JOCHJYFZSA-N 440.927 4.340 10 10 IICE CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc3cc(O)c(O)cc3s2)CC12CCC2 1628497946 LJWXUUTZGYCWKN-AWEZNQCLSA-N 432.542 4.365 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3C[C@@H](NC(=O)OC(C)(C)C)C3(C)C)cc2)CC1 1628608491 FEFCKFBYUCPXMM-LEWJYISDSA-N 429.605 4.479 10 10 IICE Cc1nc2cc(O)nn2c(C)c1CC(=O)N(Cc1ccccc1O)[C@H](C)c1ccccc1 1632697285 KBIOZEHQJZNTGC-QGZVFWFLSA-N 430.508 4.090 10 10 IICE CCCCN(C(=O)/C=C\C(=O)N1CCN(c2ccc(OC)cc2)CC1)[C@H](C)c1ccccc1 1634241995 MHPHTIDNOGYNKU-XOAGPTPASA-N 449.595 4.290 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H]3c4c[nH]nc4CN3C(=O)OC(C)(C)C)c2C)c1 1635327147 PFCMORZVFDNYKB-QFIPXVFZSA-N 449.555 4.234 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1ccc(Cn2ccc(C(F)(F)F)n2)cc1 1638573370 UAXCOGIOUQSPES-UHFFFAOYSA-N 426.398 4.134 10 10 IICE Cn1nc2cc(Br)ccc2c1C(=O)NCc1ccc(N2CCCCC2)cc1 1638693354 AXRHHPMNYOYXTO-UHFFFAOYSA-N 427.346 4.256 10 10 IICE O=Cc1ccc(-c2ccc(C(=O)NCc3cc(F)c(N4CCOCC4)c(F)c3)cc2)s1 1642297840 TUZJMLIWCLEYCO-UHFFFAOYSA-N 442.487 4.272 10 10 IICE CCN(CC(=O)NC(c1ccc(OC)cc1)c1ccc(OC)cc1)c1ccc(OC)cc1 1644855916 QBSANKCQRFICCB-UHFFFAOYSA-N 434.536 4.445 10 10 IICE CCOC(=O)C[C@H](c1ccccc1)C1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 1653695953 LZYTVULSHSKABQ-AREMUKBSSA-N 436.596 4.472 10 10 IICE CCOc1ccc(N(CC)CC(=O)N2c3ccccc3NC(=O)C[C@H]2C(F)(F)F)cc1 1653718332 NPFNTTQNFZOONQ-IBGZPJMESA-N 435.446 4.218 10 10 IICE Cn1ccnc1[C@@H](Cc1ccccc1)NC(=O)N(Cc1ccco1)Cc1ccccc1O 1683570415 QFEHISFIFCIRDJ-JOCHJYFZSA-N 430.508 4.415 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCCC[C@H]2CCC(=O)OC(C)(C)C)N(C)C)cc1 1684612107 NOHOGMAZVMDLEQ-VXKWHMMOSA-N 446.636 4.041 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)N[C@@H](C)c3ccc(Br)cc3OC)C2)cc1 1686130671 ZFGDNSDLNMCEEW-GOEBONIOSA-N 448.361 4.105 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(C(=O)Nc2ccccn2)nnc1N1CCCCCCC1 1693005425 WOUCHPWCYCFCGA-UHFFFAOYSA-N 447.587 4.119 10 10 IICE Cc1cnc([C@@H](C)Cn2c(Cc3ccncc3)nnc2N(C)Cc2ccccc2O)s1 1707712832 DBAHWCLCPYOWGW-INIZCTEOSA-N 434.569 4.175 10 10 IICE Cc1noc(C2CCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)cc3C)CC2)n1 1707942597 XLHZXOMUCQEIKD-UHFFFAOYSA-N 437.592 4.074 10 10 IICE CCC[C@H]1CN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CCO1 1709553984 IYIGNZQSKOFSIB-QFIPXVFZSA-N 434.588 4.077 10 10 IICE CCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCc1noc(CC)n1 1709682306 GLOMJKSQRIEXQW-UHFFFAOYSA-N 433.560 4.387 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(CC)C[C@@H]2CCCO2)cc1 1710026200 ALFWUMQFWVAVKM-GOTSBHOMSA-N 441.620 4.420 10 10 IICE CCOCc1nnc(N2CCCc3sccc3C2)n1CCCSc1nccs1 1710719820 VSCQYTVMXLCQCV-UHFFFAOYSA-N 435.644 4.468 10 10 IICE CCOCc1nnc(N2CCS[C@H](C)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1729090828 ZLFLGBPSIZLIEV-LJQANCHMSA-N 429.634 4.041 10 10 IICE CC[C@H](C)CN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NCC1CC1 1743817091 FDHOYBAFYALUBY-SFHVURJKSA-N 448.615 4.361 10 10 IICE CCN(CC)c1ccc(Cn2c(C(=O)Nc3ccccn3)nnc2N(C)CC2CCC2)cc1 1746086638 QDUMFLGBDGKLSO-UHFFFAOYSA-N 447.587 4.056 10 10 IICE CON(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CSCCS1 1750160515 YQCDJKCZYCUJPT-GOSISDBHSA-N 429.615 4.199 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N(C)Cc2ccccn2)cc1 1764937979 APVBJBDITQDZEU-HSZRJFAPSA-N 434.588 4.446 10 10 IICE CCOC(=O)N1CCC(N2C(=O)/C(=C\c3c(F)cccc3Cl)SC2=S)CC1 1858591726 XFZUIMATZKELPV-XNTDXEJSSA-N 428.938 4.301 10 10 IICE C[C@H]1C[C@@H](C)CN(c2nc(=Nc3cc(Cl)ccc3O)nc(N3C[C@H](C)C[C@@H](C)C3)[nH]2)C1 1871732292 AYPBGQYPPFTKCN-VQHPVUNQSA-N 445.011 4.361 10 10 IICE Cc1ccc(CNC2=C(c3ccc(-n4c(C)ccc4C)cc3)C(=O)N(C3CC3)C2=O)cc1 1873166687 WOTSEEWLLYPCNE-UHFFFAOYSA-N 425.532 4.435 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2cc(Br)ccc2OCc2ccc(F)cc2)S1 2293519236 HRSQYDQPWORHHB-UHFFFAOYSA-N 449.301 4.274 10 10 IICE COc1ccc(C2=NN(c3ccccc3)C(=O)C2=C(C)NCCc2ccc(O)cc2)cc1 2313682382 BJWRODMJKAJTTB-UHFFFAOYSA-N 427.504 4.258 10 10 IICE COC(=O)CCN1C(=O)C(=Cc2ccccc2OCc2ccc(C)cc2)SC1=S 2314770112 ZJFPXZFDOMASNY-UHFFFAOYSA-N 427.547 4.338 10 10 IICE CCOc1ccc(NC(=O)[C@@H](C)N2C(=O)C(=Cc3ccccc3O)SC2=S)cc1 2314837596 UQCZMVXREWAXJQ-CYBMUJFWSA-N 428.535 4.019 10 10 IICE COc1ccc(C=C2SC(=S)N(c3ccc(C)c(C)c3)C2=O)c(C(=O)O)c1OC 2314930008 WDRJETCKKUGJSJ-UHFFFAOYSA-N 429.519 4.425 10 10 IICE CCOc1ccccc1N1C(=O)C(=Cc2ccccc2OCCC(=O)O)SC1=S 2314932981 QUTHEMIBPCYNEN-UHFFFAOYSA-N 429.519 4.345 10 10 IICE Cc1cc(C)c(NC(=O)CNC(=O)CN2CCCc3cc(OC(F)(F)F)ccc32)c(C)c1 29923273 WNEYLIGUYMUPNH-UHFFFAOYSA-N 449.473 4.018 10 10 IICE COc1ccc(N2CCN(c3ncnc(Oc4ccc(Cl)c(C)c4)c3N)CC2)cc1 40727889 MGGCNUIGPZHXPO-UHFFFAOYSA-N 425.920 4.148 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccccc3SCc3nc(C)no3)CC2)cc1 108428301 DAKJILHGXHGZCN-UHFFFAOYSA-N 438.553 4.031 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(c2ccc3c(c2)OCO3)CCCCC1 109137996 CFOBCPVJVROLEW-UHFFFAOYSA-N 436.552 4.112 10 10 IICE COc1cc(/C=C2\SC(=S)N(CCC(=O)O)C2=O)ccc1OCc1cccc(C)c1 206825876 AFBKMMWASUHTSA-UNOMPAQXSA-N 443.546 4.259 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)Nc2ccccc2O[C@@H]2CCOC2)C1 435811141 VOQUKCFKYQQGQA-LJQANCHMSA-N 433.552 4.214 10 10 IICE COc1ccc(C2=C(O)C(=O)N(c3ccc(F)cc3)[C@H]2c2ccc(O)c(O)c2)cc1OC 526176229 TZHDTQLIVIGKSN-QFIPXVFZSA-N 437.423 4.311 10 10 IICE CC(C)NC(=O)Nc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1 586609588 IVZBGJIACGDPRR-UHFFFAOYSA-N 427.460 4.244 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N2CC[C@@]3(C)[C@H](C2)C3(Cl)Cl)C1 791191268 FJJXODUYRBPEOX-UNMCSNQZSA-N 434.411 4.450 10 10 IICE Cc1oc2c(CN3CC(C)(C)O[C@@]4(CCOC4)C3)c(O)ccc2c(=O)c1-c1ccccc1 794695579 RWVAMYQAIRJNGB-SANMLTNESA-N 435.520 4.244 10 10 IICE Cc1cccc(NC(=O)NCc2cc(Br)ccc2O)c1C(=O)N1CCCC1 806203476 YLWAPJKGCXZDMN-UHFFFAOYSA-N 432.318 4.021 10 10 IICE C[C@H](NC(=O)N1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CC1)c1ccc(N(C)C)cc1 814383479 UOYHHCSUYQLFNA-YSIASYRMSA-N 430.593 4.102 10 10 IICE COCCNC(=O)c1ccc2c(c1)C(=O)N(c1ccc(N=Nc3ccccc3)cc1)C2=O 1084416305 OFRCUPZJZHFCRT-UHFFFAOYSA-N 428.448 4.279 10 10 IICE CC[C@@H]1CCCC[C@H]1OCC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F 1125130943 CNBXAOWWJMKPDY-OXQOHEQNSA-N 428.495 4.144 10 10 IICE Cc1cc(CC(=O)NCc2c(Br)cnn2C)c(C)n1-c1ccc(Cl)cc1 1132121867 OAKJBSNIQPKDAP-UHFFFAOYSA-N 435.753 4.102 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)Cc2ccc(I)cc2)cc1 1135732914 LKZCEQARFNSIQG-UHFFFAOYSA-N 436.337 4.339 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cn(-c3ccc(C)cc3)nn2)cc1 1144704595 PZQLRXPKZZKDHN-UHFFFAOYSA-N 441.535 4.497 10 10 IICE COCCOc1ccc(NC(=O)c2cc3cc(O)c(O)cc3s2)cc1Br 1179761938 DMDVLJFJWZSLPU-UHFFFAOYSA-N 438.299 4.353 10 10 IICE COc1ccc(N2CCN(C[C@H](O)CN3CCCC[C@@H]3c3cccc(C)c3C)CC2)cc1 1191212601 BWJHMZQXRVUYDK-RPLLCQBOSA-N 437.628 4.022 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCNC(=O)C[C@@H]3c3ccccc3)c2C)c1 1234325205 BDYNDIKJJIYOSI-XMMPIXPASA-N 430.552 4.175 10 10 IICE Cc1ccc(-c2nnc(N3CC[C@H](OCC(C)C)C3)n2Cc2ccc(N(C)C)c(F)c2)o1 1289576307 HSRONNIWGWVEHS-IBGZPJMESA-N 441.551 4.351 10 10 IICE CCOC(=O)[C@@H]1[C@H](C)C[C@@H](C)N(C(=O)c2ccc3c(c2)c(C)c(C)n3CCOC)[C@@H]1C 1289761616 JEDSLJMXKATYLK-ZYFHCTRVSA-N 428.573 4.343 10 10 IICE CCCCNC(=O)c1ccc(CNC(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)cc1 1290925929 IMNBGQLWWXBBAX-UHFFFAOYSA-N 445.563 4.295 10 10 IICE CC[C@H](C)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N2CCOCC2)c(F)c1 1291531352 AVBMZJAVMDWCAL-SFHVURJKSA-N 429.584 4.442 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1csc(NC2CCCCC2)n1 1293929453 XDHIIOJZSMSVNP-UHFFFAOYSA-N 428.602 4.026 10 10 IICE COc1ccc(Cl)cc1C(C)(C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1313063688 FAIMYTKSYURHNW-UHFFFAOYSA-N 431.964 4.044 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)C)n3CCCC(F)(F)F)CC2)cc1F 1315513014 RPAWJSAGDDZLNC-UHFFFAOYSA-N 429.462 4.218 10 10 IICE CC(C)Oc1ncc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1Cl 1356036588 KDCPBVAXQNDJGC-HUUCEWRRSA-N 435.927 4.205 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(NC(=O)CC(C)C)ccc3Cl)CC2)cc1 1356447346 RVWRKFAETDDFLP-UHFFFAOYSA-N 429.948 4.296 10 10 IICE CC[C@H](Oc1ccccc1Cl)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1 1360091514 VVQUTTSZFKNFMV-NRFANRHFSA-N 433.955 4.095 10 10 IICE Cc1cccc(NC[C@@H]2CCCN2C(=O)Cc2ccc(-n3c(C)cc(C=O)c3C)cc2)n1 1443882096 XJOLDSWBGKNGEC-DEOSSOPVSA-N 430.552 4.256 10 10 IICE Cc1ccc(Oc2ccc(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)cc2)nc1 1444860980 STPFYNXVVOCDSI-UHFFFAOYSA-N 435.499 4.213 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cnc(-c2ccccc2)cc1=O 1446803829 LBEZOEGWRYYIAX-FQEVSTJZSA-N 439.515 4.406 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCN2CC(F)F)c(C)n1-c1cccc(Br)c1 1453483489 YYHGEIOUHZWXLL-KRWDZBQOSA-N 440.332 4.316 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)COC1CCN(C)CC1 1457571464 BISNQMJCPQYXCH-NRFANRHFSA-N 449.517 4.409 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(CCN(C)C)CC2CCCCC2)CCCC1 1464473706 CROOULPDZORMNH-UHFFFAOYSA-N 425.617 4.499 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)[C@H](C)Oc1cc(C(C)C)ccc1C 1466398236 FGMCFIBIHCUPGT-INIZCTEOSA-N 433.932 4.447 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)OC(C)(C)C)cc1 1469681249 BQDZCFGIZUVDEU-QHCPKHFHSA-N 434.536 4.483 10 10 IICE O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCN(C(=O)C(F)(F)F)C1 1472818346 FRVXJYKDUWROBO-AWEZNQCLSA-N 435.402 4.039 10 10 IICE C[C@@H]1CCCC[C@H]1OCCn1c([C@@H]2CCCOC2)nnc1N(C)Cc1ccccc1O 1493597490 FNUOGKZQVMMYND-SYYKKAFVSA-N 428.577 4.109 10 10 IICE CO[C@]1(C)CCCN(c2nnc(Cc3ccsc3)n2Cc2ccc(N(C)C)c(F)c2)C1 1517899580 SIOLHAIQUVAMOA-HSZRJFAPSA-N 443.592 4.189 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)CCCCOc3ccc(Br)cc3)C2)cc1 1532106101 QOEMVUPHSAEGNH-SFHVURJKSA-N 447.373 4.402 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cnc(NC(=O)OC(C)(C)C)cn3)c2C)c1 1535136111 HOVOIMLEVHUYKT-UHFFFAOYSA-N 435.528 4.470 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(N3CCSCC3)cc2)cc1 1541081167 VEFRFRHYECKRJK-UHFFFAOYSA-N 447.604 4.319 10 10 IICE Cc1cc(C(=O)N(C)C2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]23)c(C)n1-c1ccc(F)cc1 1558829639 NDTMUTKWJWBHSK-PMACEKPBSA-N 427.520 4.171 10 10 IICE CC(=O)c1cc(F)cc(CN[C@H]2CC(=O)N(C(C)C)[C@H]2c2ccc(Cl)c(F)c2)c1O 1559751101 YMZONURECFLPME-FPOVZHCZSA-N 436.886 4.367 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CC[C@H](O)CC23CCC3)sc(C)c1-c1ccccc1 1559925642 YMJYDDYODFEVEV-SFHVURJKSA-N 442.581 4.218 10 10 IICE CC(C)Oc1cc(Cl)ccc1CNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 1565287060 QOTVRQWOOSLSNO-UHFFFAOYSA-N 445.991 4.335 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c1 1566408448 YHTZTDZIXICKFM-QHCPKHFHSA-N 429.564 4.366 10 10 IICE Cc1cc(C(=O)N[C@H](CC(N)=O)c2ccccc2)c(C)n1-c1cccc(Br)c1 1569648027 CKYRRPRFLWCPMW-HXUWFJFHSA-N 440.341 4.203 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnn(-c2ccc(Br)cc2)c1 1570418364 MVWYGWGTNRYQNC-MRXNPFEDSA-N 441.373 4.370 10 10 IICE CC(=O)N(C)c1ccc(NC(=O)c2cc(C)n(-c3cccc(Br)c3)c2C)cn1 1570496720 HIISHLIMGHEFGN-UHFFFAOYSA-N 441.329 4.487 10 10 IICE O=C1c2ccccc2C(=O)c2c1ccc(C(=O)NCCC[C@@H]1CC1(Cl)Cl)c2[N+](=O)[O-] 1585166079 MVCBEVCHFLYYBG-LLVKDONJSA-N 447.274 4.074 10 10 IICE CC(C)(C)Cc1nnc(N2CCC(C)(C)CC2)n1Cc1ccc(N2CCOCC2)cc1 1597233517 PXBHHEGJPGITNK-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCO[C@@H]1CCCC[C@H]1C 1614012351 QZCSJEROFYYPCS-NFBKMPQASA-N 441.620 4.161 10 10 IICE C[C@H](CC(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1620752771 BDUQAYIEOSVWJT-QAPCUYQASA-N 434.458 4.421 10 10 IICE CC(C)(CNC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O)c1ccc(F)cc1 1627077715 YBPNKGKWVAZWGP-UHFFFAOYSA-N 448.541 4.101 10 10 IICE CC(C)n1c(O)nc2ccc(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)cc21 1629055906 VGSYCYKHTXPCHC-INIZCTEOSA-N 444.482 4.323 10 10 IICE CCOC(=O)CN(Cc1ccccc1O)C(=O)c1ccc2c(c1)nc(C)n2-c1ccccc1 1630481634 WWLKGGSOBMLHCN-UHFFFAOYSA-N 443.503 4.245 10 10 IICE Cc1cc(CC(=O)N2C[C@H](C)N(C(=O)OC(C)(C)C)C[C@H]2C)c(C)n1-c1ccccc1 1632965120 UEOVWADZNYRJDV-MOPGFXCFSA-N 425.573 4.493 10 10 IICE CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Br)cc3)CC2)cc1 1636702317 MLVJQZXHDCMDPN-LEWJYISDSA-N 429.358 4.300 10 10 IICE Cc1cccc(C)c1OC[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)c1ccccc1 1653883221 CZYSAWXNCNFYIA-RUZDIDTESA-N 431.580 4.396 10 10 IICE COc1ccc(N2CCCN(C(=O)N[C@H]3C[C@H](OCc4ccccc4)C3(C)C)CC2)cc1 1671953974 MDJIASNEBXVNMM-ZEQRLZLVSA-N 437.584 4.301 10 10 IICE COc1ccc(CN(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)[C@H](C)C2CC2)cc1 1676653828 YPNLCJZIMCWFFT-CLOONOSVSA-N 438.616 4.374 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCCO3)nnc2N2CCC[C@](C)(OC)C2)cc1 1710026246 BIFLEMAOGRVWCA-RDGATRHJSA-N 441.620 4.420 10 10 IICE COCC1(Cn2c(-c3ccc(Cl)nc3)nnc2N(C)Cc2ccccc2O)CCC1 1712200147 WSJOCEXDCJPRCJ-UHFFFAOYSA-N 427.936 4.152 10 10 IICE COC[C@H]1CCCCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)C1 1712242654 KWFMDELAPLUEIX-DLBZAZTESA-N 437.635 4.021 10 10 IICE CC[C@H](C)N(C)CCn1c([C@H](C)CC)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1726985514 KFALRLJFFLMRLB-RTWAWAEBSA-N 442.652 4.247 10 10 IICE CCSc1cc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)ccn1 1729252862 CCVFQJDCCOVPQU-FQEVSTJZSA-N 439.585 4.417 10 10 IICE CN(c1nnc(C(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1)[C@H]1CCSC1 1747612430 WMFPHZCFTFKMAZ-IBGZPJMESA-N 431.675 4.119 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@@H](C(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1749972018 PPMUNUWKDBOIOT-AZUAARDMSA-N 447.599 4.128 10 10 IICE Cc1ccc(C)c2c(=O)c(C(=O)NC[C@H](c3ccc(N(C)C)cc3)N3CCCCC3)c[nH]c12 1866417417 CSNVYGWLRHLFEW-HSZRJFAPSA-N 446.595 4.168 10 10 IICE Cc1nc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc(N2C[C@@H](C)OCC2(C)C)n1 1868478479 AXSUPPFWRIMHTJ-OAHLLOKOSA-N 442.519 4.308 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1C[C@H]2NCc1cc(Cl)cc(Br)c1O 1912301859 IUZCTXIIMQIOOS-OSAQELSMSA-N 431.758 4.296 10 10 IICE CC(C)(C)OC(=O)NCCC(CCNC(=O)OC(C)(C)C)Nc1c(N)cccc1F 1994791329 NEGRXIBDDZXXEF-UHFFFAOYSA-N 426.533 4.018 10 10 IICE CC(C)(C)OC(=O)NCCN(Cc1ccccc1)C[C@@H](N)c1ccc(N2CCCC2)cc1 2044757449 YMZDCDMZBNJEKS-XMMPIXPASA-N 438.616 4.314 10 10 IICE NCc1cc(F)c(N2CC[C@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1Br 2148931782 COCJEHATVQNEML-IEBWSBKVSA-N 432.381 4.395 10 10 IICE O=C(COc1ccc(C=C2SC(=S)NC2=O)cc1)Nc1ccccc1C(F)(F)F 2314488364 WXBOFLIIOJJAHZ-UHFFFAOYSA-N 438.452 4.212 10 10 IICE CCN1C(=O)C(=Cc2c(Oc3ccccc3C)nc3c(C)cccn3c2=O)SC1=S 2314508266 OHSFEYAQIPITOD-UHFFFAOYSA-N 437.546 4.325 10 10 IICE CCCN1N=C(C(F)(F)F)C(=Cc2cc(Br)c(OCC)c(OC)c2)C1=O 2332125846 VRUAIDJYFJUDBN-UHFFFAOYSA-N 435.240 4.410 10 10 IICE Cc1ccc(CNC2C[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2)c(O)c1Br 2352944641 KMJYTFFWFJCFGW-GJZGRUSLSA-N 425.367 4.198 10 10 IICE Cc1ccc(CNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1Br 2381132482 BMMNCJLPMAULOZ-UHFFFAOYSA-N 441.366 4.117 10 10 IICE O=C1NN=C(c2ccccc2)/C1=C1\SC(C(=O)c2cccs2)=NN1c1ccccc1 8636961 OGTSQOPTAKEMMN-OQKWZONESA-N 430.514 4.243 10 10 IICE C[C@@H](C(=O)Nc1ccc(C(=O)O)cc1)N1C(=O)/C(=C/C=C/c2ccccc2)SC1=S 15047300 XEQBBNFFVROLEV-KWOGSNDASA-N 438.530 4.169 10 10 IICE CCN(c1cccc2c1C(=O)c1ccccc1C2=O)S(=O)(=O)c1ccc(Cl)cc1 586216125 LVLSPFCNWSJQAT-UHFFFAOYSA-N 425.893 4.331 10 10 IICE Nc1cc(F)cc([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c1O 687755732 GGNRLSWQFQZGTH-OAQYLSRUSA-N 436.439 4.168 10 10 IICE NC(=O)CN1C(=O)/C(=C/c2cccc(Oc3cccc(C(F)(F)F)c3)c2)SC1=S 727175948 JICYXOVVCRXSLN-NVNXTCNLSA-N 438.452 4.184 10 10 IICE COc1cccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2Br)c1O 727763024 YBZLRFJNPOWTEN-UHFFFAOYSA-N 447.260 4.420 10 10 IICE Cc1cc(C(=O)CN2CCC[C@H](c3nncn3C(C)C)C2)c(C)n1-c1ccc2c(c1)OCO2 746450591 NAOZLLUOCAIEOZ-IBGZPJMESA-N 449.555 4.058 10 10 IICE CN(Cc1ccc(N2CCOCC2)c(F)c1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 769106355 RYKVNPVQPAYXPX-YOFSQIOKSA-N 433.568 4.025 10 10 IICE COc1c(NCc2cc(C)cc(Br)c2O)cc(Cl)cc1C(=O)N(C)C 790653000 NKDPDTJDVYFPNB-UHFFFAOYSA-N 427.726 4.439 10 10 IICE CC[C@H](C)c1ccc(C(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)cc1 1125313576 WIZDVDVGLWGVJK-IBGZPJMESA-N 447.558 4.386 10 10 IICE COc1ccc(C)cc1N1C[C@H](C(=O)N(C)Cc2ccc(N3CCCCC3)cc2)CC1=O 1135744560 IAHWSHRGHAIUCT-OAQYLSRUSA-N 435.568 4.005 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)C1CC2(C1)C[C@H](NC(=O)OC(C)(C)C)CCS2 1135914516 ITXYZISWYNFOQQ-IQJRZOLZSA-N 447.645 4.280 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2 1136428176 OASSLNBPCYNKCF-QFIPXVFZSA-N 429.973 4.384 10 10 IICE COc1cccc(F)c1C(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1 1137815034 WEATUJZWPMJLFX-UHFFFAOYSA-N 433.527 4.451 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1 1150146447 NQSOQKAUAARPEJ-MRXNPFEDSA-N 438.471 4.344 10 10 IICE NC(=O)c1ccc(NCc2ccccc2)c(NC(=O)c2cc3cc(O)c(O)cc3s2)c1 1153540297 VLSCIDJYWXFFJS-UHFFFAOYSA-N 433.489 4.276 10 10 IICE Cc1cc(C(=O)Nc2cc(C(=O)OC(C)C)[nH]n2)c(C)n1-c1ccccc1Br 1157100141 MHRACDOCBJIBHY-UHFFFAOYSA-N 445.317 4.397 10 10 IICE Cc1cc(C(=O)N2CCN(C3CCCC3)[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1177712627 HWRNZDRSYMZIJZ-INIZCTEOSA-N 445.405 4.341 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)NCC2(c3ccc(F)cc3Cl)CC2)N(C)C)cc1 1225548631 HIVHVBTUEIORFG-OAQYLSRUSA-N 432.971 4.179 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CC[C@H](Oc4ccc(Cl)cc4)C3)C2)cc1 1252117898 YTEIULQXKSKIRN-JTSKRJEESA-N 429.948 4.038 10 10 IICE O=C(CSc1ccc(Br)cc1)NCc1cc(Br)ccc1O 1258149209 JSKGOCPIHTUQRR-UHFFFAOYSA-N 431.149 4.326 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@H]1CCCCS1 1287179698 OIABFYADQJPFSZ-NRFANRHFSA-N 429.634 4.160 10 10 IICE C[C@H]1CCN(c2nnc(Cc3ccccn3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1291170740 XKKRFWNOIMMVHS-SFHVURJKSA-N 436.579 4.390 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)c1 1294446485 FLUQJQOUVILXPA-XMMPIXPASA-N 429.564 4.366 10 10 IICE Cn1cc([C@@H]2CCCN2c2nnc(C(C)(C)C)n2CCCSc2nccs2)cn1 1298820649 URSMRXBKDHCKMU-INIZCTEOSA-N 431.635 4.290 10 10 IICE O=C(CCCc1ncc(-c2ccccc2)o1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1299100579 UHOLOKJTEQZWJW-UHFFFAOYSA-N 441.478 4.096 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1C[C@@H](OC)C(C)(C)C 1305526104 JJELAMAHWBAZOQ-LAUBAEHRSA-N 447.599 4.327 10 10 IICE Cc1cc(CCNC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H]3C[C@H]32)c(C)n1-c1ccccc1 1313099196 BSBPFVBVCOYWSC-FGZHOGPDSA-N 438.572 4.040 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2cccnc2)n1C[C@@H]1CCCO[C@@H]1C(C)(C)C 1314753219 MTNLFPNAAHEYDB-URXFXBBRSA-N 449.599 4.447 10 10 IICE CC(C)(C)OC(=O)N[C@H]1CC=C(C(=O)N2CCCc3cc(Br)cc(F)c32)C1 1352289860 PEROTZVUKRQZEB-HNNXBMFYSA-N 439.325 4.481 10 10 IICE Cc1ccc(-n2nc(C(=O)NCc3cccc(Br)c3O)c3c2CCC3)c(F)c1 1448964576 PMBSHBIXOPOFQM-UHFFFAOYSA-N 444.304 4.207 10 10 IICE CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C1CCN(C(=O)c2ccc(N=NC(N)=O)cc2)CC1 1449592122 OHHSZDJZECXZSF-SFHVURJKSA-N 443.548 4.347 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)Nc1c(C)n(C)n(C2CCCCC2)c1=O 1452731616 JRXKJPHCMYOKAR-UHFFFAOYSA-N 434.540 4.473 10 10 IICE CC(C)(C)OC(=O)N1CCC(c2ncc(C(=O)NCc3cccc(Cl)c3O)o2)CC1 1457034419 FXELWMFGGUYULQ-UHFFFAOYSA-N 435.908 4.078 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3csc(-c4ccc(Cl)s4)n3)cc2)CC1 1462467063 LREUVNGHMDIIKM-UHFFFAOYSA-N 433.002 4.207 10 10 IICE CC(C)(C)OC(=O)Nc1cnn2c1N(C(=O)/C=C/c1cnc(C(C)(C)C)s1)CCC2 1462909440 AJQCYVLAHLZETQ-CMDGGOBGSA-N 431.562 4.434 10 10 IICE CO[C@H](CC(=O)Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C(F)(F)F 1463210749 YEBWCZWAZFMEFX-GFCCVEGCSA-N 443.223 4.065 10 10 IICE CCOc1ccc(N2CCN(C(=O)Cc3c[nH]c4ccc(Br)cc34)CC2)cc1 1466210089 CXXNNWRLCYPKFJ-UHFFFAOYSA-N 442.357 4.220 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1noc2c1CC(C)(C)CC2 1467630924 HOJSUKMMJQPXHM-UHFFFAOYSA-N 427.545 4.192 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)c3c(C)nn(Cc4ccc(Cl)cc4)c3C)C2)cc1 1470020209 NEPOZIQYPNEQJJ-HXUWFJFHSA-N 438.959 4.219 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@H]21 1470555049 ALWKUZUFIWPJKV-HFKLLZPISA-N 442.401 4.392 10 10 IICE CN(C)c1ccc(CN(C(=O)NCCC2(CNC(=O)OC(C)(C)C)CC2)C2CC2)cc1 1470708845 RNDXQFAFZDZLIV-UHFFFAOYSA-N 430.593 4.122 10 10 IICE Cc1cccc(C)c1[C@@H]1CCCN1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478786774 WDOTUFVAYQBYRA-NRFANRHFSA-N 429.511 4.465 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](OCC3CC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1495597153 GRUKDGDMYLWTQV-XLIONFOSSA-N 429.584 4.440 10 10 IICE CCCC(=O)N[C@@H]1CCCN(c2nnc([C@@H](C)CC)n2Cc2ccc(N(C)C)cc2C)C1 1499876255 SVWYKCGODOAMIK-GHTZIAJQSA-N 440.636 4.099 10 10 IICE CCCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC[S@](=O)CC 1500735419 ZIUFHEDJPOEADO-SSEXGKCCSA-N 427.618 4.358 10 10 IICE COCC(C)(C)Cn1c([C@H]2CCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1504557488 SAMDAIASNBYKQC-OAQYLSRUSA-N 427.593 4.039 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H](c2cccs2)N(C)C)n1 1511083109 IUHOKCNFZCMOQB-FQEVSTJZSA-N 448.596 4.355 10 10 IICE C[C@H]1CCC[C@@](Cn2c(Cc3ccccn3)nnc2N(C)Cc2ccccc2O)(N(C)C)C1 1512122490 XMRZELIGNKSAOE-RXFWQSSRSA-N 448.615 4.116 10 10 IICE CC[C@@H](C)c1nnc(N2CCS[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1513094546 UCDKSESKQSYGTM-DENIHFKCSA-N 443.661 4.254 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)C[C@H]2CCCOC2)cc1 1515530512 CJMMRGDCEQZPNY-GGAORHGYSA-N 441.620 4.277 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)cc2F)C[C@H](C)O1 1526004011 VTZYNUQKWIFXRU-IRXDYDNUSA-N 441.503 4.086 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)Oc2cc([S@@](C)=O)c(C)cc2OC)CCCC1 1526114596 UUDZFAAOGCMKDX-WJOKGBTCSA-N 441.549 4.189 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCCC(F)(F)CC1 1529019352 KBQIGBSPEBMWFN-WYMLVPIESA-N 430.567 4.377 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@H](C)c3ccc(Br)cc3)cc2F)CC1 1530377426 SINCNULSRRCENY-MRXNPFEDSA-N 448.380 4.150 10 10 IICE CCc1c(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)nnn1Cc1ccccc1 1533209104 AHNCTVPLFJKING-UHFFFAOYSA-N 443.551 4.390 10 10 IICE CC(C)(C)Sc1cc(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)ccn1 1535560874 GLGKIKZKOOPIID-UHFFFAOYSA-N 438.641 4.434 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F 1536551338 ZFWKSTLAIKOIHJ-OAHLLOKOSA-N 431.462 4.022 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)[C@@H](O)c2ccccc2C(F)(F)F)cc1 1542490641 UHAZKEBKFALXRO-NQIIRXRSSA-N 436.474 4.013 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@@H](OC)C1 1554592521 OCBUSOWZOKDVHX-GWJPWWOOSA-N 437.588 4.249 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CCCN(C(=O)c3ccc(N=NC(N)=O)cc3)C2)CC1 1567616948 XRSGMRSKGGXWNJ-UHFFFAOYSA-N 429.521 4.102 10 10 IICE CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](NC(=O)Cc1ccc(O)c(O)c1)CC(C)(C)O2 1569885044 HVFNLNVVJVQDTM-QGZVFWFLSA-N 442.512 4.406 10 10 IICE Cc1nnc(CCCn2c(Cc3ccsc3)nnc2N(C)Cc2ccccc2O)s1 1612518905 ORSOXXBMJMRGOC-UHFFFAOYSA-N 440.598 4.065 10 10 IICE COC1CCN(c2ccc(CN3CC[C@@H](Oc4cncc(Br)c4)C3)cc2)CC1 1618958439 FDRCXADSVHCENJ-OAQYLSRUSA-N 446.389 4.113 10 10 IICE O=C(NCc1c(O)ccc2c1CCCC2)[C@@H](c1ccc(Cl)cc1Cl)N1CCOCC1 1622664585 YPLZFAPRXGGAKX-JOCHJYFZSA-N 449.378 4.268 10 10 IICE CC(C)[C@H](NC(=O)Cc1ccc2ccccc2c1)C(=O)NCc1ccc2c(c1)CCCN2C 1626940169 ASRFCWPDDADSBN-MHZLTWQESA-N 443.591 4.222 10 10 IICE COC(=O)N1CCC(CNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)CC1 1626998603 LFAXKFDITOLORA-UHFFFAOYSA-N 448.361 4.065 10 10 IICE CCc1cc(N2CCC[C@H](NC(=O)c3cc(C)n(-c4ccc(Cl)cc4)c3C)C2)ncn1 1627388513 IWYFTZHOYKUSCK-FQEVSTJZSA-N 437.975 4.499 10 10 IICE Cc1ccc(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)cc1-n1c(C)cc(C=O)c1C 1628053039 MGRCYXIHQGCXDJ-NRFANRHFSA-N 449.938 4.404 10 10 IICE COc1ccc(-c2cc(C(=O)NCc3ccc(O)cc3O)c3ccccc3n2)cc1OC 1630301816 JKHSWPJMMDJBMQ-UHFFFAOYSA-N 430.460 4.260 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)C2CC(NC(=O)OC(C)(C)C)C2)CCCC1 1635770245 KBZGKADUKQKABT-UHFFFAOYSA-N 441.572 4.043 10 10 IICE CCC1(NC(=O)OC(C)(C)C)CCN(c2ccc(/C=C\C(=O)OC)cc2[N+](=O)[O-])CC1 1643120919 DQIVNQCZSDWCTL-NTMALXAHSA-N 433.505 4.055 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN3CC[C@H](C)[C@@H]3c3ccccc3)cc2F)C[C@@H](C)O1 1644453083 RTQHQJSHCLZDJQ-QBKLZVOZSA-N 439.575 4.139 10 10 IICE Cc1cccc(NCCNC(=O)c2cc(C)n(-c3ccc(Br)cc3)c2C)n1 1645179462 BNPWPEBDMCOXEZ-UHFFFAOYSA-N 427.346 4.402 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2[C@H](C)CN(C)C)c(C)n1-c1ccc(Br)cn1 1647771268 ZLWFHLYGOMZKPC-FOIQADDNSA-N 447.421 4.444 10 10 IICE CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 1653489150 NZLJQHGZWJSECU-AWEZNQCLSA-N 434.886 4.261 10 10 IICE CC(C)(C)O[C@@H]1C[C@H](NC(=O)N(Cc2ccco2)Cc2ccccc2O)[C@H]1n1cccn1 1682610124 ZWIPZLFKUHRBMJ-KSEOMHKRSA-N 438.528 4.091 10 10 IICE Cc1cc(CCNC(=O)NCC(=O)N2CCCCc3ccccc32)c(C)n1-c1ccccc1 1684443543 AAZLVCQDSDCUAQ-UHFFFAOYSA-N 444.579 4.305 10 10 IICE C[C@@H](NC(=O)NCc1ccc(I)cc1Cl)c1ccccc1O 1686230159 FONDZBLHZZBRTO-SNVBAGLBSA-N 430.673 4.211 10 10 IICE CC[C@@H](C)c1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@@](C)(OC)C1CC1 1694001039 XEOVZZBUYZSOSS-KBMIEXCESA-N 441.620 4.080 10 10 IICE CCCN(C)C[C@H]1CCN(c2nnc([C@@H](C)CC)n2Cc2ccc3c(c2)CCCN3C)C1 1695292629 MSKYKLSDBBNIHQ-RBBKRZOGSA-N 438.664 4.390 10 10 IICE CC[C@@H](C)CN(C)c1nnc(-c2ccc(C)o2)n1Cc1ccc(N2CCOCC2)c(F)c1 1727049681 RNHPUCPANZYQKB-QGZVFWFLSA-N 441.551 4.353 10 10 IICE C[C@@H](C1CCCCC1)N(C)c1nnc([C@@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1731138123 PFHAUXWCCDEQGT-FXAWDEMLSA-N 429.584 4.440 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)OC(C)(C)C1 1748379961 HSIMJFJUISXDJF-MOPGFXCFSA-N 437.588 4.391 10 10 IICE Cc1cc(Cl)cc2c(O)cc(C(=O)N[C@@H](c3ccc(N(C)C)cc3)c3nccn3C)nc12 1866511242 OXWQXWCZBSQNAP-QFIPXVFZSA-N 449.942 4.221 10 10 IICE Cc1nn(Cc2c(O)cccc2Br)c(I)c1C1CC1 2079620459 IREWUGXXXGFGNH-UHFFFAOYSA-N 433.087 4.190 10 10 IICE CC(=O)NC1=NC(=O)C(=Cc2ccc(OCc3ccc(Br)cc3)cc2)S1 2293682602 JCVBCEDIEHEPCW-UHFFFAOYSA-N 431.311 4.135 10 10 IICE O=C(CCN1C(=O)C(=Cc2cccc(Br)c2)SC1=S)NC1CCCC1 2296881383 DWIAAJSTYNWQTR-UHFFFAOYSA-N 439.400 4.099 10 10 IICE Cc1csc2nc(Cl)c(C=C3SC(=S)N([C@H](C(=O)O)c4ccccc4)C3=O)n12 2323865289 FQVIZWQXRJIUGL-ZDUSSCGKSA-N 449.966 4.385 10 10 IICE CCOc1cc(/C=C2/SC(Nc3ccc(C)cc3)=NC2=O)ccc1OCCC(=O)O 16920023 LOWRWSFOPKRPPZ-CPNJWEJPSA-N 426.494 4.330 10 10 IICE CCCNc1nc2ccc(C)cn2c(=O)c1/C=C1/SC(=S)N(C2CCCCC2)C1=O 33526206 CANDMXSPABOMLM-SFQUDFHCSA-N 442.610 4.359 10 10 IICE CN(C)c1ccc([C@H]2CC(c3ccc(F)cc3)=NN2C(=O)COc2ccccc2C=O)cc1 72413298 FIHKZNRICDHTTD-XMMPIXPASA-N 445.494 4.461 10 10 IICE C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c1 110145130 FHGKJELCVLRWPF-DKLXNKCPSA-N 435.568 4.169 10 10 IICE CCCCCS(=O)(=O)CC(=O)N[C@H](c1ccccc1)c1c(O)ccc2ccccc12 110850428 UDGAUBIYADERGD-XMMPIXPASA-N 425.550 4.356 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1[N+](=O)[O-])N2 226885667 XQUBCKFRSLPEOD-IECBHUPTSA-N 434.540 4.493 10 10 IICE CCOC(=O)C1=C(C)N(C)C2=S=C(c3ccccc3)C(=O)N2[C@H]1c1ccc(Cl)cc1 584906367 IMLQLXOAOITFOR-IBGZPJMESA-N 440.952 4.047 10 10 IICE COc1ccc(Cl)c(S(=O)(=O)Nc2nc(-c3ccc(OC)c(OC)c3)cs2)c1 732909650 CZVYILWMUFVREW-UHFFFAOYSA-N 440.930 4.290 10 10 IICE C[C@H](NC(=O)N1CCc2cccc(Br)c2C1)c1ccc(N2CCOCC2)cc1 735681091 LMUDLBWNKZYDEW-INIZCTEOSA-N 444.373 4.115 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(O)nc2ccc(Br)cc12 737819778 XONAAHYDWYZMRT-UHFFFAOYSA-N 428.330 4.431 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccc(OCC(F)(F)F)n1 742804782 BKBJWEZPWAYOQR-ZDUSSCGKSA-N 445.388 4.023 10 10 IICE CO[C@@H](C)c1noc(CN(C)Cc2c(O)ccc3c(=O)c(-c4ccccc4)c(C)oc23)n1 748095136 UBVBFEURZHEEGN-HNNXBMFYSA-N 435.480 4.196 10 10 IICE CCN(C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1)[C@@H](C)Cc1ccsc1 779654390 BQGSFIFJPNHKIC-FQEVSTJZSA-N 440.657 4.443 10 10 IICE CCO[C@@H]1C[C@@](NCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)(C(=O)OC)C1(C)C 781997819 PBPMPPLWLVNFAT-HYBUGGRVSA-N 438.528 4.377 10 10 IICE C[C@H](NC(=O)C(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccc(-n2cccn2)cc1 807753547 CRSHDRMRLXMIEV-IBGZPJMESA-N 446.551 4.117 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(N(C)C(=O)OC(C)(C)C)s3)CC2)cc1 809940250 GTIMRPCIGVIILC-UHFFFAOYSA-N 431.558 4.090 10 10 IICE C[C@H](NCC(=O)Nc1ccc(N=Nc2ccccc2)cc1)c1ccc(S(N)(=O)=O)cc1 916148527 XXGPZFKPVCKFBM-INIZCTEOSA-N 437.525 4.039 10 10 IICE C/C=C/c1ccc(OCC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c(OC)c1 917710594 NPIVVJLPMFKDFY-ZBKUBXTQSA-N 442.531 4.176 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(CNC(=O)OC(C)(C)C)cc3)CC2)cc1 917822374 VQIHOPVMXXALAU-UHFFFAOYSA-N 439.556 4.072 10 10 IICE CC[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1141985234 LLPNSMDUQINJKI-GHTZIAJQSA-N 433.593 4.063 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCCc3c[nH]c4c(Cl)cccc34)C2)cc1 1230300634 HMGYHKNAIMPVRU-MRXNPFEDSA-N 426.948 4.198 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N(C)Cc3ccc(Br)c(F)c3)C2)cc1 1230859456 ZRFDKBCIWMGVBY-HNNXBMFYSA-N 436.325 4.017 10 10 IICE CN(C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccc(F)c(F)c1 1264800096 GQVODYRCNSBHNI-YVLHZVERSA-N 436.480 4.358 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccccc3OCc3csc(C)n3)C2)cc1 1276831693 BPUWHDUQSDNSAH-SFHVURJKSA-N 437.565 4.295 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)O[C@H](C)C3)n2CCOC(C)C)c(C)n1-c1ccccc1 1289358901 HDKUHMOIVAVUHL-BGYRXZFFSA-N 437.588 4.391 10 10 IICE Cc1nnc(N(C)Cc2cccc(OC(F)F)c2)n1CCCSc1nccs1 1290719431 SDJAJJGOZWDQHG-UHFFFAOYSA-N 425.530 4.463 10 10 IICE CC[C@H](C)c1nnc(N2CCN(c3cccs3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1291608287 LZPQCGJAOKMMQF-KRWDZBQOSA-N 442.608 4.433 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2ccc(-n3ccnc3)c(F)c2)cc1 1292037876 OFASCNBRMZWKFE-UHFFFAOYSA-N 430.483 4.090 10 10 IICE Cc1ccc(C(=O)NC2CCN(C(=O)c3cccc(-n4c(C)cc(C=O)c4C)c3)CC2)s1 1292416573 DWEVITYQJVLMHY-UHFFFAOYSA-N 449.576 4.311 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccc[nH]3)nnc2N(C)Cc2c(C)nn(C)c2C)cc1 1295412582 AVDGUWDRXTXEIY-UHFFFAOYSA-N 446.603 4.154 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC[C@@H](C)COCc2ccccc2)C1 1357122560 HVAGRLMATZODTR-OAQYLSRUSA-N 433.596 4.377 10 10 IICE Cc1cc(CC(=O)Nc2ccc(N3CCC(N(C)C)CC3)cn2)c(C)n1-c1ccccc1 1435475440 CBKDIALKFYZILK-UHFFFAOYSA-N 431.584 4.201 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@H]1OCc2ccccc21 1440132746 DPVADRRLWXKEKJ-AUUUKSDWSA-N 444.603 4.117 10 10 IICE COC(=O)C[C@@](C)(NC(=O)c1cc(-n2c(C)ccc2C)ccc1Cl)c1cccnc1 1440302571 VHOYUGKHLWAPPE-HSZRJFAPSA-N 425.916 4.351 10 10 IICE CC(C)(C)OC(=O)N[C@@](C)(C(=O)NCc1cc(Cl)ccc1O)c1cccc([N+](=O)[O-])c1 1452936803 RWGMXGABENLZPY-OAQYLSRUSA-N 449.891 4.010 10 10 IICE Cc1cc(CCNC(=O)c2cc(Br)c3nccn3c2)c(C)n1-c1ccccc1 1461967802 MIZXMYIOSFEYJQ-UHFFFAOYSA-N 437.341 4.477 10 10 IICE O=C(NCc1ccc(O)cc1O)c1cccc(OCc2ccccc2Br)c1 1469161390 ZIWBEUQLERFYBD-UHFFFAOYSA-N 428.282 4.369 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3sc(C)c(Br)c3OC)C2)cc1 1469280850 RULOMMLTQTZOEZ-ZDUSSCGKSA-N 439.375 4.093 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2ccccc2NC(=O)c2ccccc2)N(C)C)cc1 1472281252 SUAPFHXAHHHAIY-XMMPIXPASA-N 430.552 4.038 10 10 IICE CCOC(=O)c1c(NC(=O)CN[C@]2(C)CCO[C@@H]2C2CC2)sc(C)c1-c1ccccc1 1473373264 RSGNYJXTRXKBFJ-ZJSXRUAMSA-N 442.581 4.386 10 10 IICE CC[C@@H](Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1)OC 1497328709 NCYWTCXDWZRMJI-FQEVSTJZSA-N 429.609 4.017 10 10 IICE CCCN(CCC)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1500841972 QZVPMAMJFXMPLA-NRFANRHFSA-N 443.661 4.400 10 10 IICE CCO[C@@H]1CCCN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1502979523 ONNLOKUBGKWWPW-HXUWFJFHSA-N 429.584 4.270 10 10 IICE C[C@@H](CCc1ccco1)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1524802691 DDGFHROWVCPAHU-RAOBZKRQSA-N 432.542 4.148 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccccc3OC(F)(F)F)cc2F)C[C@@H](C)O1 1527481767 QPWWTKSSDDEOOH-OKILXGFUSA-N 426.410 4.268 10 10 IICE C[C@H]1CCCCN1CCCn1c([C@@H]2CCCCO2)nnc1N(C)Cc1ccccc1O 1544027912 ZABIITVSGKHQQP-UGKGYDQZSA-N 427.593 4.126 10 10 IICE CCOC(=O)[C@H](NC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C)[C@@H]1CCCOC1 1567449548 BFNATLQBXXIRRU-NFBKMPQASA-N 426.557 4.306 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)C1SCCCS1 1585834742 PFQLRYAVOQCCQK-UHFFFAOYSA-N 435.372 4.294 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)[C@H](Oc3ccc(F)c(F)c3)c3ccccc3)C2)cc1 1587112562 HBHWKUZPIJLBHA-HOYKHHGWSA-N 438.474 4.489 10 10 IICE Cc1cc(C(=O)NC[C@@H](c2ccccc2)N(C)C)c(C)n1-c1ccc(Br)cn1 1587215846 YIEPUBQEXHOFBP-FQEVSTJZSA-N 441.373 4.284 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1606711122 KDXJZDFZBYHNFP-NRFANRHFSA-N 425.621 4.333 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCNC(C)=O 1614160037 AGNMXUKDLNJADO-OAQYLSRUSA-N 434.588 4.258 10 10 IICE COc1ccccc1Nc1ccc(C(=O)Nc2cccc(N3CCN(C(C)=O)CC3)c2)cc1 1616450598 FGFTZQWVAZEMEZ-UHFFFAOYSA-N 444.535 4.360 10 10 IICE CC(=O)N1CCN(c2ccc(CNC(=O)Cc3ccc(C4CCCCC4)cc3)cc2)CC1 1625198683 JSPZFXSJAVRSHS-UHFFFAOYSA-N 433.596 4.262 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@H]3CCN(C(=O)OCc4ccccc4)C3)cc2)CC1 1627468128 VHUUSRIHJMCZPM-QHCPKHFHSA-N 435.568 4.198 10 10 IICE Cc1cc(C(=O)N2CCC[C@H](C3(C)OCCO3)C2)c(C)n1-c1ccc(Br)cc1 1637040517 WSKXYNBMJYDNOV-KRWDZBQOSA-N 447.373 4.472 10 10 IICE C[C@@H]1C[C@H](C(=O)Nc2c(-c3ccccn3)nc3ccccn23)CCN1C(=O)OC(C)(C)C 1637108538 RIZGDFMAAZVUIW-IAGOWNOFSA-N 435.528 4.370 10 10 IICE COC(=O)c1cccc2c1CCN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)C2 1637315993 QRQQXMXICYHNKZ-UHFFFAOYSA-N 430.504 4.200 10 10 IICE COc1ccc(N2CCN(CCCNc3cc(-c4cccc(Cl)c4)ncn3)CC2)cc1 1639204623 MLAVRXBDQKTLQV-UHFFFAOYSA-N 437.975 4.430 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NC[C@@H](CO)Cc2ccncc2Cl)c1 1639912763 FJVXPOGKKJNZCN-INIZCTEOSA-N 432.351 4.377 10 10 IICE O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)NCc1ccc2cccnc2c1O 1643283197 KPHDRVYQGQHLPX-QFIPXVFZSA-N 425.488 4.118 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CN(Cc3ccsc3)C(C)(C)C)cc2F)C[C@@H](C)O1 1654201808 MKSLINHDCTZCHZ-HDICACEKSA-N 447.620 4.418 10 10 IICE CC(C)C[C@H]1CCN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1692268114 FXKCEOYWWDCQKY-HXUWFJFHSA-N 443.611 4.472 10 10 IICE CCC[C@H](C)CN(C)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1695060618 DCRCPALNYYNPBO-FQEVSTJZSA-N 434.588 4.097 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](CNC(C)=O)C2)n1Cc1ccc(N(CC)CC)cc1 1708491073 FPXWMYKUPDLOON-DENIHFKCSA-N 440.636 4.039 10 10 IICE CCO[C@]1(c2nnc(N3CCC(C)CC3)n2Cc2ccc(N(CC)CC)cc2)CCOC1 1710455044 XTQYDMHSZWGBTI-RUZDIDTESA-N 441.620 4.061 10 10 IICE CCSCC[C@@H](C)N(C)c1nnc([C@H]2CCCOC2)n1Cc1ccc(N(C)C)c(F)c1 1710955825 KVRFJAOKBAJBBG-MJGOQNOKSA-N 449.640 4.393 10 10 IICE CC(C)=CCCn1c(-c2ccccn2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1723048689 TZNULQPHOWSUNP-UHFFFAOYSA-N 432.572 4.169 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1Cc1ccc(OC(C)(C)C)nc1 1729418271 BZGFCNGYBKOQSS-UHFFFAOYSA-N 444.539 4.303 10 10 IICE CC(C)NC(=O)CCn1c(CC(C)(C)C)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1741688694 AXNSMPRDEINZLC-UHFFFAOYSA-N 440.636 4.018 10 10 IICE Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1cccc(Br)n1 1742755886 LFFQARVTXHFDEY-UHFFFAOYSA-N 441.377 4.029 10 10 IICE CC[C@@H]1CCCN1c1nnc(Cn2nc(C)cc2C)n1CCCSc1nccs1 1744924975 LONZTIQYOFFNEQ-QGZVFWFLSA-N 431.635 4.157 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCCC(C)(C)C2)n1Cc1ccc(N(C)C)c(F)c1 1764145223 OHANBEDPRUFBQZ-UHFFFAOYSA-N 444.599 4.076 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCOC3)nnc2N(C)CC2CC(F)(F)C2)cc1 1766613085 BFQHYHIBMNUCTG-IBGZPJMESA-N 433.547 4.158 10 10 IICE Cc1ccc(Cn2cccc(C(=O)Nc3cccc4c3C(=O)c3ccccc3C4=O)c2=O)cc1 1861857527 IQRGMPVIZPRIAO-UHFFFAOYSA-N 448.478 4.233 10 10 IICE CNC(=O)[C@H]1CCCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccc(C)cc2)c1C(=O)OC 1866193014 NVKNKSUGPOWESY-IRXDYDNUSA-N 428.554 4.309 10 10 IICE CN(C)c1cccc(NC(=O)c2ccc(CN3CCN(Cc4ccccc4)CC3)cc2)c1 1872880519 VGLAFTSIRWPGKJ-UHFFFAOYSA-N 428.580 4.323 10 10 IICE CCOC(=O)c1ccc(NC(=O)c2c3c(n4ccccc24)C(=O)c2ccccc2C3=O)cc1 1873950810 CAJPOGWQVBNGBH-UHFFFAOYSA-N 438.439 4.144 10 10 IICE Cc1cc(O)c([C@H](C)n2nc(C(F)(F)F)c(C=O)c2I)cc1C 2080030731 QWJHKGBECNVJGK-VIFPVBQESA-N 438.187 4.251 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](F)[C@H](NCc1cc(Br)cc(F)c1O)C2 2193314633 UOMXYRQLWGYAND-DRPJVOAASA-N 447.320 4.262 10 10 IICE COc1ccc(Br)c(CN[C@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)c1O 2236055471 QCIFEVWJUCBYGQ-IHRRRGAJSA-N 441.366 4.041 10 10 IICE Cc1ccc(CN2CCC[C@H](NC(=O)OCc3ccccc3)C2)c(O)c1Br 2307565016 HKKSCCNEDMZVRU-SFHVURJKSA-N 433.346 4.354 10 10 IICE O=C(CCCCCN1C(=O)/C(=C/c2ccc(O)cc2O)SC1=S)Nc1ccccc1 15043755 BMHHOSHULFZBPN-UYRXBGFRSA-N 442.562 4.498 10 10 IICE CCOC(=O)CCC(=O)Nc1sc2c(c1C(=O)OCC)CC[C@H](c1ccccc1)C2 22672100 ONJBQSAYYJAURP-INIZCTEOSA-N 429.538 4.479 10 10 IICE COc1cccc(C2=C(O)C(=O)N(c3cc(C)ccc3OC)[C@@H]2c2ccc(O)c(O)c2)c1 526445924 ITRKXNDCRRGEII-HSZRJFAPSA-N 433.460 4.481 10 10 IICE COc1ccccc1CC1CCN(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CC1 726613674 JGBOETSHNDUQTA-FQEVSTJZSA-N 437.584 4.257 10 10 IICE Cc1cc(C(=O)COC(=O)C2CCC(=O)CC2)c(C)n1-c1ccc(OC(F)(F)F)cc1 751679367 KOOYUSZKYGIFOK-UHFFFAOYSA-N 437.414 4.478 10 10 IICE CO[C@@H]1CC[C@H]2OCCN(Cc3c(O)ccc4c(=O)c(-c5ccccc5)c(C)oc34)[C@H]2C1 754800044 UJTTZSWBAOHIFP-RZFNWQHOSA-N 435.520 4.242 10 10 IICE C[C@H](NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)c1cc(Br)cc(F)c1O 756418310 SIPSRCXIZALDTM-MCIONIFRSA-N 438.341 4.153 10 10 IICE C[C@@H](NCC1(N2CCCCC2)CCN(C)CC1)c1cc(Br)cc(Cl)c1O 756610897 UMICYLCYKDJFQA-OAHLLOKOSA-N 444.845 4.409 10 10 IICE C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)N(Cc1ccco1)Cc1ccccc1O 779706668 VWWDNPVAZLFRSY-XLIONFOSSA-N 443.544 4.343 10 10 IICE O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 781618190 IMXLNRNEXHVRBI-UHFFFAOYSA-N 438.342 4.224 10 10 IICE COc1ccc(N2CCCN(C(=O)NCc3ccccc3CN3CCCCC3)CC2)cc1 918003415 WKJUMBPQIUVLBX-UHFFFAOYSA-N 436.600 4.103 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCS(=O)(=O)C3(CCCCC3)C2)c1 1137492737 YAZZEPIYOKNGIN-UHFFFAOYSA-N 434.989 4.321 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3ccc4c(c3)c(C)c(C)n4CCOC)CC2)cc1 1137658746 UQZTZMVTDKAMER-UHFFFAOYSA-N 435.568 4.266 10 10 IICE CCc1nsc(N2CCN(C(=O)Cc3cc(C)n(-c4ccc(Cl)cc4)c3C)CC2)n1 1148426809 GXUVZOCGDVGEQP-UHFFFAOYSA-N 444.004 4.053 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CN(Cc3ccccc3)CC[C@H]2CO)c1C 1150369402 VEMZTPVSGCHATC-UKILVPOCSA-N 431.580 4.015 10 10 IICE CCOC(=O)[C@@]1(F)CN(C(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)CC12CCC2 1166337769 NODGGBPJPNLHAH-VWLOTQADSA-N 440.515 4.113 10 10 IICE CC(C)Nc1ccccc1NC(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1167093518 XUFHDNIJXHXNRK-UHFFFAOYSA-N 431.539 4.327 10 10 IICE COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)N[C@H](C)c2ccccc2O)c1 1171723443 RDSFOIDGHIFEFJ-MRXNPFEDSA-N 440.521 4.001 10 10 IICE Cc1cc(C(=O)Nc2nc(-c3ccco3)n[nH]2)c(C)n1-c1ccccc1Br 1182280808 GYTIKRLKQLDELG-UHFFFAOYSA-N 426.274 4.487 10 10 IICE COC(=O)[C@@]12CCCC[C@@H]1CN(C(=O)NCc1ccc(N3CCC[C@@H](C)C3)c(Cl)c1)C2 1227207428 GQLPFAIIRRIDPH-ROMRWMGNSA-N 448.007 4.451 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@H]1COc1ccc(Cl)cc1 1233605778 ZVXMOZMVTNYEIS-NRFANRHFSA-N 443.975 4.054 10 10 IICE Cn1nc(C(=O)NC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1-c1ccc(F)cc1 1264992631 FUNVSMQJPVXVMJ-UHFFFAOYSA-N 444.457 4.226 10 10 IICE C[C@H](CSCc1ccccc1)C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 1266259035 OOCARKRDRGRWEX-OAQYLSRUSA-N 437.653 4.404 10 10 IICE CC(=O)NCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](C)C1 1286944941 FFOLOMRTMIEDDQ-GOSISDBHSA-N 434.588 4.115 10 10 IICE CC(C)c1nnc(N2CCCC[C@H](C)C2)n1Cc1ccc(N2CCC(CO)CC2)cc1 1291089324 CFFJTKMHSNKVPN-FQEVSTJZSA-N 425.621 4.285 10 10 IICE CC[C@H](C)c1nnc(N2CCC[C@@H](COC)C2)n1Cc1ccc(N2CCSCC2)cc1 1291538147 MFUINCUEKYUMRQ-PZJWPPBQSA-N 443.661 4.256 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1 1294532256 SAYACHZPJAOVHX-NRFANRHFSA-N 443.547 4.189 10 10 IICE Cc1cc(C(=O)N[C@H]2COc3ccccc3[C@@H]2O)c(C)n1-c1cccc(Br)c1 1298767513 QGKPOEHTEDWWBS-FPOVZHCZSA-N 441.325 4.081 10 10 IICE C[C@H](NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)c1ccccc1O 1302533074 ZSOAVSLTMLLIHS-AWEZNQCLSA-N 430.913 4.337 10 10 IICE Brc1cc(CN[C@@H]2CCCC[C@@H]2N2CCOCC2)ccc1N1CCCCC1 1308305581 QHLAPKMYKOVWDF-IRLDBZIGSA-N 436.438 4.172 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NCc3cccc(Br)c3C)C2)cc1 1312902694 OKUBYMCJDXLKPW-INIZCTEOSA-N 432.362 4.092 10 10 IICE Cc1c(OC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cccc1[N+](=O)[O-] 1351048834 ZBQZKWUYNYLUDK-GZTJUZNOSA-N 446.481 4.239 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCc2sccc2C1 1352437997 CKNDNTVFLHEWQM-BOPFTXTBSA-N 432.567 4.063 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)oc1Br 1357836240 QLQKDYXDHJTFJO-CHWSQXEVSA-N 425.298 4.033 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)C1=Cc2ccccc2O[C@@H]1C(F)(F)F 1441630649 KYAACIGWMLGOJJ-FQEVSTJZSA-N 434.483 4.263 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3ccc(Cl)c(Cl)c3N)cc2F)C[C@@H](C)O1 1441788164 SFHGKDSZFBUWQU-VXGBXAGGSA-N 426.319 4.258 10 10 IICE Cc1cc(Cl)cc(NC(=O)c2cc(NS(=O)(=O)c3cccs3)ccc2O)c1O 1447089292 WGAPGYQWRQUDEG-UHFFFAOYSA-N 438.914 4.174 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)c(Cl)c1 1449116520 FVZDMRMZZVEWKB-YJYMSZOUSA-N 442.339 4.021 10 10 IICE CC(C)(C)OC(=O)NCc1ncc(C(=O)NCc2cc(Cl)cc(Cl)c2O)s1 1450720117 DWGRCLKPJDAMDD-UHFFFAOYSA-N 432.329 4.110 10 10 IICE O=C(NCc1ccc(NC(=O)c2c(F)ccc(O)c2O)cc1)c1ccc(C(F)(F)F)cc1 1457656199 XPFURJWADNRFBO-UHFFFAOYSA-N 448.372 4.438 10 10 IICE Cc1cc(C(=O)Cn2c(C)nn(C(C)(C)C)c2=O)c(C)n1-c1ccc(Br)cc1 1459032111 IJONQDNZPMIBCC-UHFFFAOYSA-N 445.361 4.161 10 10 IICE CCCN(C(=O)NCc1ccc(N2CCN(C)CC2)cc1)[C@@H]1C[C@@H](OCC)C12CCCC2 1471191248 OBMSPZBHXJJSIQ-DNQXCXABSA-N 442.648 4.098 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(N2N=C(Cc3ccccc3)CC2=O)cc1 1472508139 SNHCEXRIPPMOHM-UHFFFAOYSA-N 440.547 4.326 10 10 IICE CCN(CC)c1ccc(Cn2c([C@H]3CCCO3)nnc2N2C[C@@H](C)S[C@H](C)C2)cc1 1501847029 ALMOZPCMJQMTSN-DBXWQHBBSA-N 429.634 4.354 10 10 IICE Cc1ncc(CN(C)c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)c(F)c2)s1 1511584311 IPGFSPBYBMXZQI-HXUWFJFHSA-N 444.580 4.174 10 10 IICE O=C(CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S)OCc1coc(C2CC2)n1 1531798591 AQPHLVAQRRUDTK-CXUHLZMHSA-N 432.498 4.026 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)NC[C@@H]1C[C@H]1C(F)(F)F 1534462405 YAUXERUCVUWWKJ-IBCHTDFDSA-N 434.530 4.044 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCc3cc4ccc(C(=O)OC)cc4o3)ccc21 1539546077 TWOKIBYIGKEAAR-UHFFFAOYSA-N 448.519 4.410 10 10 IICE CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cc2c(cc1Br)OCO2 1540543309 IFNBXFNAELGHFS-UHFFFAOYSA-N 431.330 4.440 10 10 IICE Cc1cc(=O)c(C(=O)NCc2ccc(N(C)C3CCCCC3)cc2)nn1-c1ccccc1F 1542412122 OCYBLZRWRJNWIZ-UHFFFAOYSA-N 448.542 4.379 10 10 IICE Cc1cc(C(=O)N2CCN(CCN(C)Cc3ccccc3)CC2)c(C)n1-c1ccc(F)cc1 1543046988 UIFAGVZFFCNHEU-UHFFFAOYSA-N 448.586 4.123 10 10 IICE CSCCCn1c(C2CCCC2)nnc1N(C)Cc1ccc(N2CCOCC2)cc1 1555936041 ZYMDYMQRZGWRPV-UHFFFAOYSA-N 429.634 4.162 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCC[C@@H]2NS(C)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1556539972 MSURPOQEKIDUBJ-REWPJTCUSA-N 445.629 4.055 10 10 IICE Cc1ccc(-c2nc(C)sc2CC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1 1557640858 VQCCBKIKQQNREE-UHFFFAOYSA-N 435.593 4.247 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)Cn3ccc(C(=O)OC(C)C)cc3=O)c2C)c1 1559389072 MDIQALHHYKCZOA-UHFFFAOYSA-N 438.549 4.426 10 10 IICE C[C@@H](N[C@H](C)c1ccc(F)cc1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1559704061 CGXYISIVVYKEJS-ZIAGYGMSSA-N 434.442 4.418 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)Cc2cnn(-c3ccccc3)n2)cc1 1565655975 JRPRCAIFLUAEMM-UHFFFAOYSA-N 441.535 4.118 10 10 IICE Cc1ccc(-c2cc(C(=O)N[C@H]3CCCN(Cc4cc(Cl)ccc4O)C3)n[nH]2)cc1C 1566356791 OACNHNJHDRLTKA-FQEVSTJZSA-N 438.959 4.447 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H]2[C@@H](O)C(F)(F)F)c(C)n1-c1cccc(Br)c1 1566636713 LPKHSIUYVNSAEF-IAGOWNOFSA-N 445.279 4.384 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@H]2[C@H](C)OC(C)(C)N2C(=O)OC(C)(C)C)cc1 1587460319 VFNWHMWMHPLMMC-FXAWDEMLSA-N 433.593 4.252 10 10 IICE CCOc1ccc(N2CCN(C(=O)C[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)CC2)cc1 1596733466 RZVXHPLXCSYEEK-FQEVSTJZSA-N 447.620 4.311 10 10 IICE CCc1ccc(-c2nnc(N3CC[C@@H](C)[C@@H](O)C3)n2CCCSc2nccs2)cc1 1613789658 FLCVESWAOGDCBY-APWZRJJASA-N 443.642 4.354 10 10 IICE Cc1cc(NC(=O)CN(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1Br 1616179512 FWLUJKVJYDZYAV-SFHVURJKSA-N 433.346 4.083 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnn(-c3ccccc3)n2)cc1 1616619800 FHSJXKROLVFDIT-UHFFFAOYSA-N 427.508 4.189 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N3CCCC[C@H]3COC(=O)NC(C)C)c2C)cc1 1627002525 ITTMZAWAHUIQKC-FQEVSTJZSA-N 427.545 4.232 10 10 IICE Cc1cc(C(=O)NCc2nc3ccc(F)cc3[nH]2)c(C)n1-c1ccc(Br)cn1 1628766931 GGNZDKCFDARZTQ-UHFFFAOYSA-N 442.292 4.197 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](O)c1ccccc1C(F)(F)F 1635676940 RRTWHCBQJAUIAO-MRXNPFEDSA-N 432.236 4.256 10 10 IICE COCc1ccc([C@@H]2COCCN2C(=O)NCCc2cc(C)n(-c3ccccc3)c2C)o1 1637410475 NADXNGCJUNHJGK-QHCPKHFHSA-N 437.540 4.159 10 10 IICE C[C@@H](NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1)c1cc(Cl)cc2c1OCC2 1638652172 XBEBINGORFKFAK-DNVCBOLYSA-N 430.932 4.432 10 10 IICE Cc1cc(C(=O)N2CCOC3(CCCCC3)C2)c(C)n1-c1ccc(Br)cn1 1640091780 LWOBFHFPVKXION-UHFFFAOYSA-N 432.362 4.427 10 10 IICE COC(=O)c1cc(NC(=O)c2cc3cc(O)c(O)cc3s2)c(C)cc1Br 1640196330 TXFAHCWQKBCQHD-UHFFFAOYSA-N 436.283 4.422 10 10 IICE CSc1cc(Br)ccc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1642155517 VLBCDTRFAXZRRY-UHFFFAOYSA-N 435.387 4.062 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1cc(Cl)ccc1O)c1ccc(F)cc1F 1644590440 AEBDFODEZJXHFC-QGZVFWFLSA-N 426.847 4.206 10 10 IICE CCOC(=O)c1c(NC(=O)CN2CCC[C@@H](N(C)C)CC2)sc(C)c1-c1ccccc1 1645278025 FMPZFJXDSCSHSB-LJQANCHMSA-N 443.613 4.255 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)NCCc2ccc(Br)cc2Cl)c1 1673182966 XIEXPTGTRFMCTE-NSHDSACASA-N 427.726 4.420 10 10 IICE Cc1cccc(C2=CCN(C(=O)NCc3ccc(N4CCC(C(N)=O)CC4)cc3)CC2)c1C 1676130352 GEOQLHZAIQWNLM-UHFFFAOYSA-N 446.595 4.004 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(-c2cnn(C)c2)nnc1N(C)[C@@H](C)c1cccs1 1693006200 ROPYZUVGSZPRCO-KRWDZBQOSA-N 435.601 4.360 10 10 IICE CC[C@H](C)c1nnc(N2CCSC3(CCOCC3)C2)n1Cc1ccc(N(C)C)c(F)c1 1694153474 QFPKKAWUHBHDBF-KRWDZBQOSA-N 447.624 4.147 10 10 IICE CS[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCOC[C@H]1C 1698335715 YZKYPZJKWKAGBE-QZTJIDSGSA-N 425.602 4.329 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@](C)(OC)C1 1748382353 YTMYHMWWEYSMEF-CLOONOSVSA-N 437.588 4.393 10 10 IICE COCCO[C@H](C)c1nnc(N2C[C@H](C)CC[C@H]2C)n1Cc1ccc(N(C)C)cc1C 1749937446 DFHBTZNFJZFKHG-MISYRCLQSA-N 429.609 4.050 10 10 IICE C[C@H]1COC(C)(C)CN1c1nnc(CC2CCCC2)n1Cc1ccc(N(C)C)c(F)c1 1771507787 QVFFPWUVXOJYGL-KRWDZBQOSA-N 429.584 4.268 10 10 IICE CCOC(=O)c1c(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)sc(C)c1-c1ccccc1 1860647039 UXXIJYNDGCEFSH-SFHVURJKSA-N 440.565 4.487 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)CCc2ccc(Br)cc2)c2nccn2C)cc1 1866089927 ORUWWFOBRXNURW-OAQYLSRUSA-N 441.373 4.087 10 10 IICE CCCCCOc1cn(CCC)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870676232 QFTZXPYWLLTLTF-UHFFFAOYSA-N 427.589 4.158 10 10 IICE CC[C@H](Nc1cnn(CCNC(=O)OC(C)(C)C)c1)c1cc(Br)ccc1O 2237656443 WQWSCUFUOODUFO-INIZCTEOSA-N 439.354 4.439 10 10 IICE C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1C(=O)C(=Cc2ccccc2)SC1=S 2296885386 RTIAZHYTOJDMRG-HNNXBMFYSA-N 435.574 4.117 10 10 IICE COc1ccc(C=C2SC(=O)N(CCC(=O)Nc3cccc(C(=O)O)c3)C2=S)cc1 2297450040 CSDPVALUPNPXER-UHFFFAOYSA-N 442.518 4.259 10 10 IICE CCCOc1cccc(C=C2SC(=S)N([C@H](Cc3ccc(O)cc3)C(=O)O)C2=O)c1 2323812681 UDGAVSGMHHUXHT-GOSISDBHSA-N 443.546 4.078 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@@H]2CNCc1cc(Br)cc(F)c1O 2330512295 PHKMMXPXIYPSMM-XFJVYGCCSA-N 429.330 4.171 10 10 IICE CCOc1cc(C=C2C(=O)N(c3ccccc3)N=C2C)ccc1OCC(=O)N(CC)CC 2332139643 CTZTUKCKFWTROV-UHFFFAOYSA-N 435.524 4.139 10 10 IICE Cc1ccc(CNC(=O)CC(C)(C)[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1Br 2380748714 HIMLSJHYZBJVCE-CYBMUJFWSA-N 443.382 4.409 10 10 IICE CC(=O)CSC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1c1ccc(OC(F)F)cc1 9636607 ANSKGOBEDWUTCM-UNOMPAQXSA-N 445.491 4.420 10 10 IICE COc1cc(/C=C2\SC(=S)N(CNc3cccc(F)c3)C2=O)cc(OC)c1OC 33747621 ITGJIAQANMFIDY-MFOYZWKCSA-N 434.514 4.122 10 10 IICE CCN(C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1)[C@@H](C)Cc1ccc(OC)cc1 731403566 OVMVSRFKSJXVSW-VQTJNVASSA-N 425.573 4.256 10 10 IICE O=C(NC[C@@H]1CCCCN1Cc1ccccc1)N(Cc1ccccc1O)C[C@@H]1CCCO1 743358988 PLKDNLUQZNURKP-ZEQRLZLVSA-N 437.584 4.138 10 10 IICE C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1cc(Br)c(F)cc1O 756760951 KULQZSMYSRHRNT-RFAUZJTJSA-N 433.115 4.441 10 10 IICE Cc1cccnc1-c1noc(CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 761574146 FVIWQIYMJAVPMH-SDNWHVSQSA-N 428.564 4.336 10 10 IICE COC(=O)c1ccc(CNC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)nc1C1CC1 781026394 KVWXFQRENXFIFL-UHFFFAOYSA-N 433.508 4.092 10 10 IICE COc1cc(Br)ccc1/C=C1\SC(=S)N(CC(C)(C)CN(C)C)C1=O 781550148 MOPNLUDKCQPANG-NVNXTCNLSA-N 443.432 4.247 10 10 IICE Fc1ccccc1C1CC(NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)C1 783548788 CVMZDJIRXKCTOW-UHFFFAOYSA-N 435.522 4.117 10 10 IICE O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)Nc1cccc(OCC(F)(F)F)c1 797739604 GVGIXZPHCKEDON-UHFFFAOYSA-N 432.782 4.105 10 10 IICE CC(C)(C)OC(=O)N[C@@](C)(C(=O)NCc1cc(Br)ccc1O)c1ccccc1 804736198 MYRQJFYVIUMHHV-OAQYLSRUSA-N 449.345 4.211 10 10 IICE COc1ccc(N2CCCN(c3nnc(CCC(C)C)n3C[C@@H]3CCCCO3)CC2)cc1 812430848 SPBVELNKXPTEFC-QHCPKHFHSA-N 441.620 4.161 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NCc3cc(-c4ccccc4)no3)cc2F)C[C@H](C)O1 918214620 GRHYXFBQDKGUPL-IRXDYDNUSA-N 438.503 4.094 10 10 IICE COc1cc(/C=C2/SC(=S)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc(OC)c1O 1084313371 GXERRFZRYFRWJX-LZYBPNLTSA-N 432.479 4.032 10 10 IICE O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(Sc2nc3ccccc3[nH]2)o1 1084503364 DXOQQJKVIZFCNG-PTNGSMBKSA-N 448.435 4.113 10 10 IICE O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1CCC(=O)N(CC(F)F)C1CCC1 1133832626 PNAMGCYFNLCHTI-GDNBJRDFSA-N 428.501 4.063 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1 1136025396 ISBVNJJOOKSBLJ-SANMLTNESA-N 435.568 4.294 10 10 IICE CSc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(Cl)ccc3O)C2)cc1[N+](=O)[O-] 1137438244 JHNMXVZDYSGGJT-INIZCTEOSA-N 435.933 4.070 10 10 IICE CCOCn1nc(C)c(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)c1C 1139139593 XJLANXHBEPBVEH-MRXNPFEDSA-N 432.996 4.243 10 10 IICE Cc1cc(S(N)(=O)=O)ccc1CNC(=O)c1cc(C)n(-c2ccc(C(C)C)cc2)c1C 1139196374 XAJMBVKDJLHPNM-UHFFFAOYSA-N 439.581 4.103 10 10 IICE O=C(N[C@@H]1CCCc2ccc(F)cc21)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1140004724 GXJZPLWDZSETIO-GOSISDBHSA-N 446.525 4.201 10 10 IICE Cc1cc(NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)n(C2CCN(C)CC2)n1 1148793201 MKVWMCCOXSMEKU-UHFFFAOYSA-N 433.556 4.239 10 10 IICE CN(C)c1ccc(CN(CC(=O)Nc2ccc3nc(C(F)(F)F)[nH]c3c2)C2CC2)cc1 1167108839 VGFBVEWTZWTUPK-UHFFFAOYSA-N 431.462 4.251 10 10 IICE Cc1ccc(-n2c(C)cc(C(=O)Cn3cnc4c(cnn4C(C)(C)C)c3=O)c2C)cc1C 1188906981 AMLIVVGNMNJIDS-UHFFFAOYSA-N 431.540 4.255 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCS(=O)(=O)C4(CCCCC4)C3)c2C)c1 1254074639 SONSTKIPDYTLGF-UHFFFAOYSA-N 443.613 4.045 10 10 IICE Cc1ccc(NC(=O)CS[C@H](C)C(=O)N(C)Cc2ccc(N3CCCC3)cc2)cc1 1264286664 UKZBQIVEGVDWRD-LJQANCHMSA-N 425.598 4.314 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccnc(Oc4ccc(F)cc4F)c3)C2)cc1 1276832099 NHBQKNWFOHXWBS-INIZCTEOSA-N 439.462 4.417 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)NC2(CNC(=O)OC(C)(C)C)CCCC2)c1 1293515658 VVVCKNOFTWXVPX-UHFFFAOYSA-N 439.556 4.474 10 10 IICE CC[C@@H]1CCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(=O)NC(C)C 1306345191 GURJHFOADKWDEG-HXUWFJFHSA-N 434.588 4.256 10 10 IICE CCn1cc(CN(C)c2nnc(-c3ccc(C)o3)n2CCCSc2nccs2)cn1 1313835265 FLSXWOIXNRSIOG-UHFFFAOYSA-N 443.602 4.338 10 10 IICE Cc1cc(CC(=O)N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)c(C)n1-c1ccccc1 1350637396 JWPYFAZDKWQBDK-UHFFFAOYSA-N 449.982 4.204 10 10 IICE CCN(CC)c1ccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1 1354542166 VSVMGOPEKBSSIP-QFIPXVFZSA-N 425.573 4.285 10 10 IICE Cc1ccc2c(n1)N(C(=O)CCCN1C(=O)/C(=C/c3cccs3)SC1=S)CCC2 1439031745 GJDFROFLNFXRLH-LGMDPLHJSA-N 443.619 4.412 10 10 IICE C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cc2cc(O)c(O)cc2s1 1443045252 NOOKVSPGZJCOST-AWEZNQCLSA-N 439.537 4.060 10 10 IICE Cc1c(O)nc2ccccc2c1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1445880168 FPVKZQBQUVLTRJ-QGZVFWFLSA-N 425.916 4.002 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@@H]2CCCN(Cc3ncon3)C2)cc1 1449359673 UBEXXKLUYXDKQS-SFHVURJKSA-N 447.543 4.193 10 10 IICE CCCN(Cc1ccccc1O)[C@H](C)C(=O)Nc1ccc(I)cc1 1459552630 AKDAHOSLCIOFEJ-CQSZACIVSA-N 438.309 4.236 10 10 IICE COC(=O)[C@@H]1CN(Cc2ccc(N3CCC(OC)CC3)cc2)C[C@H]1c1ccc(Cl)cc1 1460311766 BYHCRIOQZVIUQC-BJKOFHAPSA-N 442.987 4.344 10 10 IICE CCCOc1c(OC)cc(CCNC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1OC 1468129949 FVMZBMFILLHOKZ-UHFFFAOYSA-N 437.540 4.268 10 10 IICE Cc1cc(CCNC(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)c(C)n1-c1ccccc1 1470968718 FLXMHQGQMAHXMC-SANMLTNESA-N 447.627 4.305 10 10 IICE Cc1cc(CN2CCC(Oc3ccc(C(=O)N(C)C)cn3)CC2)ccc1N1CCCCC1 1473633497 UOWCKLLEZJTXBR-UHFFFAOYSA-N 436.600 4.126 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@H]1CC[C@](C)(CC)O1 1503013920 HNLHGQBYBIWTIE-RDGATRHJSA-N 441.620 4.399 10 10 IICE CN(CC1CC(F)(F)C1)c1nnc([C@@H]2CCCOC2)n1CCCSc1nccs1 1503524567 SHUWWQXHRYIDLP-OAHLLOKOSA-N 443.589 4.293 10 10 IICE CCN(c1nnc(Cn2nc(C)cc2C)n1Cc1ccc(N(C)C)cc1C)C1CCCC1 1515443721 UAWHCXOUKIYSMH-UHFFFAOYSA-N 435.620 4.331 10 10 IICE COc1ccc2c(c1)C[C@H](C(=O)NCc1ccc(N3CCC[C@H](C)C3)c(Cl)c1)CO2 1524245223 KLAUHZVFVJNQIG-LPHOPBHVSA-N 428.960 4.452 10 10 IICE Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)CC2)cc1 1540819835 TYPIWILZZFEXNH-UHFFFAOYSA-N 443.547 4.122 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cc(C)sc3-n3cccc3)cc2F)CC1 1543070789 SCXOEXKEKHFENG-UHFFFAOYSA-N 426.561 4.058 10 10 IICE CN(Cc1ccccc1O)c1nnc(Cc2ccncc2)n1C[C@@H]1CCCO[C@@H]1C(C)(C)C 1554175105 HUZCOPPBGJVWDD-URXFXBBRSA-N 449.599 4.447 10 10 IICE COC(=O)c1cc(CN(Cc2ccco2)c2ccc(OC)c(F)c2)cc(C(=O)OC)c1 1559600096 LPIZMRGIBVGUDD-UHFFFAOYSA-N 427.428 4.207 10 10 IICE Cc1cc(CCNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c(C)n1-c1ccccc1 1587461621 RYFFXJQBNWWVTQ-RUZDIDTESA-N 443.591 4.234 10 10 IICE O=C(NCc1cc(O)ccc1O)c1ccccc1OCc1ccccc1Br 1593873517 RCECCMQNQNPCCC-UHFFFAOYSA-N 428.282 4.369 10 10 IICE CCc1c(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cnn1CCC(C)C 1596695347 QZAFGTXVHSXAMU-QZTJIDSGSA-N 430.568 4.174 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CN(Cc4ccccc4)C[C@H]3CC(C)C)C2)cc1 1598363561 GUHMSIWFRQFXFV-FKCDAAJZSA-N 449.639 4.432 10 10 IICE CO[C@@]1(C)CCCN(c2nnc([C@H]3CCCCO3)n2Cc2ccc(N(C)C)cc2C)CC1 1619027837 VIBNBQOVHBLMAP-RDGATRHJSA-N 441.620 4.338 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CCCCC[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1624892662 MYAZVALMSPVJGE-LEWJYISDSA-N 447.645 4.330 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc(Cl)cc(Cl)c2N)c1 1633083987 RJRMDKGRZNTLJB-UHFFFAOYSA-N 443.334 4.320 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2c2ccccc2)c1 1638767974 RDXFCMSRGBFFAA-PNTFMKQHSA-N 445.563 4.429 10 10 IICE COc1ccc(N(CC(=O)N2c3ccccc3NC(=O)C[C@H]2C(F)(F)F)CC2CC2)cc1 1643139823 JHMHBVQEOYSXJB-FQEVSTJZSA-N 447.457 4.218 10 10 IICE C[C@H]1CN(c2ccc(NC(=O)CN3CCCc4cc(OC(F)F)ccc43)cc2)C[C@@H](C)O1 1644806997 XYRUJLHULWGURD-CALCHBBNSA-N 445.510 4.293 10 10 IICE Cc1cc(C(=O)Cn2cnc3ccccc3c2=O)c(C)n1-c1ccc(Br)cc1 1652445390 ZCFSQQRFEMZUKQ-UHFFFAOYSA-N 436.309 4.449 10 10 IICE COc1ccc(N(C)CCN(C)[C@@H]2CCCN(Cc3cccc(C(F)(F)F)c3)C2=O)cc1 1654947037 HHWFTOHBWZPFNV-JOCHJYFZSA-N 449.517 4.273 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)NCc3cccc(Br)c3Cl)C2)cc1 1683182871 KDYJOZSIOJJOPF-CQSZACIVSA-N 438.753 4.189 10 10 IICE CN(Cc1ccc(C(C)(C)C)cc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1686724173 LFZJZMVWGHRTON-UHFFFAOYSA-N 431.527 4.441 10 10 IICE CCOC[C@H]1CCN(c2nnc([C@H](C)CC)n2Cc2ccc(N3CCSCC3)cc2)C1 1696380918 TXTVQIGIWAHUEB-CTNGQTDRSA-N 443.661 4.256 10 10 IICE C#CCN(CC#CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCCOC 1705590803 WVEGQEWZFOUDET-UHFFFAOYSA-N 429.568 4.242 10 10 IICE CC[C@H](C)[C@H](Cn1c(C2CCC2)nnc1N1CCN(c2ccc(OC)c(F)c2)CC1)OC 1708375365 UGEBHDGVTNCSNB-JTSKRJEESA-N 445.583 4.081 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@]1(N(C)C)CCSC1 1728273267 XXJSAWQRCGQRHT-DEOSSOPVSA-N 438.645 4.246 10 10 IICE CCOCCN(C)c1nnc(Cc2ccccn2)n1Cc1ccc(N2CCC(C)CC2)cc1 1729144172 PXYAOIHIOUYAER-UHFFFAOYSA-N 448.615 4.021 10 10 IICE CCOCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1C[C@H](C)O[C@H](C)C1 1747325684 FJECPDCVKHATRX-BGYRXZFFSA-N 437.588 4.393 10 10 IICE CC(C)c1nnc(N(C)Cc2ccc3c(c2)OCCO3)n1CCCSc1nccs1 1760897308 XLWMKHLOHKIRJF-UHFFFAOYSA-N 445.614 4.448 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CC[C@@H](C)[C@@H](OC)C2)cc1 1766613615 HYTIWIBWFQWSCE-YKSBVNFPSA-N 448.615 4.020 10 10 IICE CCN(CC)c1ccc(Cn2c(CC(C)C)nnc2N2C[C@H](C)N(CC)C[C@@H]2C)cc1 1766614663 OFOLKSORSRJCNQ-SFTDATJTSA-N 426.653 4.290 10 10 IICE Cc1ccc(C)n1-c1ccc(C2=C(O)C(=O)N(c3ccc(Cl)cc3[N+](=O)[O-])C2=O)cc1 1872958054 PFHNNRXVNAQLDL-UHFFFAOYSA-N 437.839 4.498 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNCc2cc(Cl)cc(Br)c2O)C1 2031662755 MHPDQRTYMSPUIP-SGTLLEGYSA-N 431.758 4.155 10 10 IICE O=C(C(=Cc1ccc(N2CCCCCC2)cc1)c1nc2ccccc2[nH]1)N1CCOCC1 2059847778 FPXYNMZKXISJLX-UHFFFAOYSA-N 430.552 4.343 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(CCNCc2cccc(Br)c2O)C1 2140326527 BJAYPIBNJRQKOA-YWZLYKJASA-N 425.367 4.282 10 10 IICE COC(=O)CC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)Nc1cccc(Cl)c1C 2313683158 SUNBNBFQSLBGPA-UHFFFAOYSA-N 427.888 4.309 10 10 IICE Cc1ccc(CNC[C@H](NC(=O)OC(C)(C)C)c2ccco2)c(O)c1Br 2352674968 AYYFVIVNJNFKPI-AWEZNQCLSA-N 425.323 4.412 10 10 IICE Cc1ccc(CN[C@@H]2CSC3(C2)CN(C(=O)OC(C)(C)C)C3)c(O)c1Br 2352687603 PWVGHFBYIZAFMW-AWEZNQCLSA-N 443.407 4.048 10 10 IICE CCC[C@H](CNC(=O)OC(C)(C)C)C(=O)N(C)Cc1ccc(C)c(Br)c1O 2380760565 YQFBPCMCHFVJTF-CQSZACIVSA-N 443.382 4.363 10 10 IICE Cc1ccc(CN(C)C(=O)C[C@H](NC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380794304 ZFMJLHYYNNKIBM-HNNXBMFYSA-N 441.366 4.115 10 10 IICE COc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3c[nH]c4ccccc34)SC2=S)cc1 15046861 MTCWKZVYMLIXOE-LPXFMOJISA-N 437.546 4.405 10 10 IICE CCOc1cc(/C=C2\C(=O)N(c3cccc(Br)c3)C(=O)N=C2O)ccc1O 38173543 CEYHZGUFDKHRDJ-ZSOIEALJSA-N 431.242 4.060 10 10 IICE COC[C@@]1(CNCc2c(O)cccc2Br)CCCCN1C(=O)OC(C)(C)C 706846650 ORSWFCNGSHHACN-FQEVSTJZSA-N 443.382 4.051 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 727032033 LQDODSABFZVIEJ-UHFFFAOYSA-N 443.454 4.175 10 10 IICE C[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C[C@@H](c2ccccc2)O1 745903848 JDYIJQIRTDGFQC-LZNRXBQRSA-N 445.510 4.428 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc3nc(C4CC4)oc3c2)c(C)n1-c1ccccc1 751010049 CGBFNIRIFFCQNY-UHFFFAOYSA-N 442.519 4.410 10 10 IICE CCOC(=O)c1c(NC(=O)CCN2[C@@H](C)C[C@H](O)C[C@H]2C)sc(C)c1-c1ccccc1 759484661 VNMLVMXRCUCNMX-HGKCTWBKSA-N 444.597 4.463 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N[C@H](c1cccnc1)C1CC1 760012062 PHIDSDBOKZQBQP-WPNIOXTASA-N 443.619 4.392 10 10 IICE NC(=O)[C@@H]1CCCN(c2ccc(CN[C@H]3CCCOc4cc5c(cc43)CCCC5)cc2)C1 768508969 NULXNXYZXFPHRP-RDGATRHJSA-N 433.596 4.271 10 10 IICE Cc1nc(-c2ccccc2)oc1C(=O)NCc1ccc(N2CCN(CC3CC3)CC2)cc1 768913698 PPZQHWHWVMPEQX-UHFFFAOYSA-N 430.552 4.112 10 10 IICE COc1ccc(N2CCN(C(=O)Nc3cc(Br)cc([N+](=O)[O-])c3C)CC2)cc1 797683240 ISDXWMODGMZWMO-UHFFFAOYSA-N 449.305 4.028 10 10 IICE O=C(NC[C@@H]1CCCN(C(=O)c2cc3cc(O)c(O)cc3s2)C1)OCc1ccccc1 1139799213 SVNITRHDDIWKES-INIZCTEOSA-N 440.521 4.091 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)cc1 1150827843 SHEFLFHQGWNGJJ-UHFFFAOYSA-N 425.872 4.327 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccn(-c2cccc(F)c2)n1 1156286481 CIRKSZAWPBGMGE-UHFFFAOYSA-N 438.503 4.014 10 10 IICE Cc1cc(C(=O)N[C@@H]2CC[C@H]3CCN(C(=O)OC(C)(C)C)[C@H]2C3)c(C)n1-c1ccccn1 1159887013 XWNXXZNCWNVMCQ-TYPHKJRUSA-N 438.572 4.397 10 10 IICE Cc1cc(C(=O)Nc2ccc([C@H]3NC(=O)NC3=O)cc2)c(C)n1-c1ccc(C(C)C)cc1 1168364617 JLGCWDVNRHGOPB-JOCHJYFZSA-N 430.508 4.350 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1 1298839836 VGFYPOJVILWISI-ZDUSSCGKSA-N 427.715 4.017 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccccc1CNC(=O)OC(C)(C)C 1299479579 YHMQCWYULRRCNQ-GOSISDBHSA-N 425.573 4.447 10 10 IICE COCCC1CCN(C(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)CC1 1301326262 YBAUINHXALKZPZ-SAPNQHFASA-N 438.640 4.005 10 10 IICE Cc1cc(C(=O)NC[C@H](O)Cc2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 1303697769 SYFZLZGDWKSJTF-HXUWFJFHSA-N 445.332 4.329 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN[C@@](C)(Cc3ccc(Cl)cc3)C(C)C)nc12 1307795489 ZUEFDFKTXBQDNQ-QFIPXVFZSA-N 430.936 4.012 10 10 IICE Cc1ccc(C2(NCC(=O)NCc3ccc(N4C[C@@H](C)O[C@H](C)C4)c(F)c3)CCC2)cc1 1307897676 RVPFSXNKDYLDGX-WOJBJXKFSA-N 439.575 4.033 10 10 IICE CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)NCc2cc(C)n(-c3ccccc3)c2C)C1 1312524446 GHSSSUODOZLADV-ICSRJNTNSA-N 426.561 4.150 10 10 IICE COc1ccc(-c2csc(NS(=O)(=O)c3ccc4nc(C)oc4c3)n2)cc1OC 1321768688 BXFTWTUGFYIYTH-UHFFFAOYSA-N 431.495 4.078 10 10 IICE Cc1nc2c(F)cccc2cc1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1354659293 VARSTRQPXJAJRE-GJZGRUSLSA-N 425.479 4.365 10 10 IICE CN(C)c1ccc(CN(C(=O)CC[C@@H]2COC(C)(C)N2C(=O)OC(C)(C)C)C2CC2)cc1 1441133015 SBIHGGGLKYWQEG-OAQYLSRUSA-N 445.604 4.396 10 10 IICE CCN(CC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)Cc1ccc(Cl)cc1 1459384121 DLNWWUIKJPWPKM-QZTJIDSGSA-N 447.982 4.231 10 10 IICE CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)c1c(F)cccc1F 1464076263 DTZZTSKMQKDJIM-OAQYLSRUSA-N 445.510 4.447 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)/C=C/COc2ccccc2)NC(=O)OC(C)(C)C)cc1 1465324839 JKBPMQKZLOMLMY-RUCTVCJSSA-N 439.556 4.070 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCC[C@@H]1Cc1ccccc1Cl 1470904056 CSTSDXZBLIPKTB-OAQYLSRUSA-N 427.976 4.218 10 10 IICE CCCN(CC(F)(F)F)C(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S 1514953331 KDFJJBSRAONUSJ-UVTDQMKNSA-N 434.480 4.218 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)CCCOc2ccc3c(c2)OCO3)cc1 1528642710 JGQCMCILSKURCV-UHFFFAOYSA-N 438.446 4.231 10 10 IICE CCOC(=O)Nc1ccc(F)c(C(=O)Nc2cccc(N3CCN(CC4CC4)CC3)c2)c1 1542287136 KJARRMUBCBYDKJ-UHFFFAOYSA-N 440.519 4.178 10 10 IICE CN(C)CCn1c(O)nc2ccc(C(=O)NCc3ccc(N(C)C4CCCCC4)cc3)cc21 1542411882 DCHMUXSEBJSUKJ-UHFFFAOYSA-N 449.599 4.002 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H](O)C2CCCCCCC2)NC(=O)OC(C)(C)C)cc1 1544269058 PCPPYNKNJFUALL-FCHUYYIVSA-N 447.620 4.156 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@H](n3cncn3)C2)n1Cc1ccc(N(CC)CC)cc1 1545484629 UESPDPGDOIMTQB-KNQAVFIVSA-N 436.608 4.119 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C 1545508397 ACXYOCUMSSJGIK-MRXNPFEDSA-N 441.366 4.293 10 10 IICE CCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCOC[C@@H]1CCCO1 1547325723 XZXBTYKBOIHKIA-QFIPXVFZSA-N 437.588 4.394 10 10 IICE O=C(NCCN1CCC2(CCCCC2)CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 1564642681 UMHALLFVONAJNJ-JOCHJYFZSA-N 429.605 4.129 10 10 IICE CCN(CC)CCO[C@H]1CCN(C(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)C1 1566250569 XXRXMWDJTOUUTR-QHCPKHFHSA-N 432.008 4.249 10 10 IICE COC(=O)[C@H](NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1)c1cc(C)cc(C)c1 1567906066 DVAUAYUUNBZLDQ-XMMPIXPASA-N 432.520 4.476 10 10 IICE CCCO[C@@H]1CCCN(c2nnc(CC)n2Cc2ccc(N3CCSCC3)cc2)CC1 1615035057 VOKVEYNIFIIQTI-JOCHJYFZSA-N 443.661 4.228 10 10 IICE Cc1cc(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)nc(-c2ccc(Cl)cc2)n1 1618644420 XVDUWZUBLVNSNT-JOCHJYFZSA-N 437.975 4.204 10 10 IICE Cc1cc(C(=O)N[C@H](C(=O)N2CCCC2)C(C)C)c(C)n1-c1cccc(Br)c1 1627507067 MWQXIWRAVQRYEK-FQEVSTJZSA-N 446.389 4.233 10 10 IICE O=C(CN[C@H](c1ccccc1)C(F)(F)F)Nc1c(-c2ccccn2)nc2ccccn12 1629108137 VEGQGBHFTWTSLQ-HXUWFJFHSA-N 425.414 4.228 10 10 IICE Cc1ccc(C(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)cc1-n1c(C)cc(C=O)c1C 1635540886 FFNSZXNIIYIHQC-XMMPIXPASA-N 444.531 4.329 10 10 IICE CCOC(=O)c1c(NC(=O)CN2C[C@H](CC)OC[C@@H]2C)sc(C)c1-c1ccccc1 1643670863 ZAKKBUJLCCVFSB-YJBOKZPZSA-N 430.570 4.338 10 10 IICE COc1ccnc(CNC(=O)c2cc(C)n(-c3ccccc3Br)c2C)c1F 1645657574 IPJPBXWONXAJMY-UHFFFAOYSA-N 432.293 4.329 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ccc(Oc2cccc(Cl)c2)cn1 1646432369 XIYPIVLOKPDTQP-UHFFFAOYSA-N 437.927 4.418 10 10 IICE CC1(C)CN(C(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)[C@@H]2CCC[C@@H]21 1653290760 ZDQOYQRBGBREOC-CVAFCFIJSA-N 432.586 4.454 10 10 IICE CCN(Cc1cc(Br)ccc1O)C[C@H](O)COc1cc(C)ccc1Cl 1657431369 LORXGMVBSIQJSO-INIZCTEOSA-N 428.754 4.378 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N(CCN(C)C)Cc3ccco3)cc2Cl)C1 1680561702 DRSIAZVTHMOZIA-SFHVURJKSA-N 432.996 4.443 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1 1680667964 QLLAAALHFUDFHV-UHFFFAOYSA-N 445.007 4.180 10 10 IICE Cc1cc(CCNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)c(C)n1-c1ccccc1 1681211697 JFXLEDBSQVHJGV-QFIPXVFZSA-N 440.588 4.239 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)N3CCO[C@](C)(C(F)(F)F)C3)cc2Cl)C1 1682023659 ICSBKEMKYYHTGQ-KUHUBIRLSA-N 433.902 4.439 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1 1684762378 LDJVJRIGQXASAF-GOSISDBHSA-N 432.609 4.320 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC2CCCC2)nnc1N(C)C[C@@H]1CCCOC1 1693004822 COLYZRPSFFKMLM-NRFANRHFSA-N 425.621 4.296 10 10 IICE C#C[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1Cc1cnn(CC)c1 1705478358 ADIREAZULFXWTK-SFHVURJKSA-N 427.556 4.075 10 10 IICE CSCC[C@H](C)N(C)c1nnc(-c2cccnc2)n1Cc1ccc(N(C)C)c(F)c1 1731100590 HSPPOEWUVFFUMR-INIZCTEOSA-N 428.581 4.171 10 10 IICE Cc1cc(-c2nnc(N3CCSC[C@H]3C)n2CCC(C)(C)O)c(C)n1-c1ccccc1 1742120083 QJHQFXBGYPJTEM-GOSISDBHSA-N 439.629 4.455 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@](C)(O)CCOC)C1CC1 1745933676 FHSWMBGEJQCPTL-VWLOTQADSA-N 437.588 4.129 10 10 IICE COCCO[C@@H](C)c1nnc(N2CCC[C@H](C(C)C)C2)n1Cc1ccc(N(C)C)c(F)c1 1749972019 PPMUNUWKDBOIOT-ICSRJNTNSA-N 447.599 4.128 10 10 IICE CS[C@H]1CCCCN(c2nnc([C@@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1771433578 LYWBKNDUVPDSBA-MOPGFXCFSA-N 447.624 4.147 10 10 IICE Cc1cc(I)ccc1N1C(=O)/C(=C\c2ccc[nH]2)SC1=S 1860087088 YNDRXEBDCCMTPC-MDWZMJQESA-N 426.304 4.334 10 10 IICE O=C(CNCc1ccc(Cl)cc1Cl)Nc1cccc2c1C(=O)c1ccccc1C2=O 1860717909 MPHHMHPEBMJIPA-UHFFFAOYSA-N 439.298 4.497 10 10 IICE CN(C)c1ccc([C@@H](NC(=O)[C@@H]2CCCN2c2ccc(Cl)cc2)c2nccn2C)cc1 1866145324 KNQAFPBYEQJGRL-FCHUYYIVSA-N 437.975 4.014 10 10 IICE CCc1nn(Cc2c(O)cccc2Cl)c(I)c1C(F)(F)F 2079678572 WVFXHMYMWTUNFR-UHFFFAOYSA-N 430.595 4.476 10 10 IICE O=C1Nc2cc(N(CCC(F)(F)F)Cc3ccccc3)c(Br)cc2[C@@H]1O 2095871780 IQJGJMOMGNXAQA-INIZCTEOSA-N 429.236 4.394 10 10 IICE C[C@@H](NCc1c(O)cccc1Br)[C@H](NC(=O)OC(C)(C)C)c1ccco1 2116239056 PHQCMFTYDMQSAA-PXAZEXFGSA-N 425.323 4.492 10 10 IICE Cc1ccc(C2=NN3C(=N)C(=Cc4ccc(Br)cc4)C(=O)N=C3S2)cc1 2293674579 MLMOHJZBLQOFJI-UHFFFAOYSA-N 425.311 4.425 10 10 IICE CCOC(=O)CCCN1C(=O)C(=Cc2ccc(OC(C)C)c(OCC)c2)SC1=S 2314759631 DWSTYMCCOJOEEE-UHFFFAOYSA-N 437.583 4.417 10 10 IICE CCN(CC)CCNC(=O)c1ccc(N=NN2CCN(c3cccc(C)c3C)CC2)cc1 2330149576 VPDKHDGZSZOARC-UHFFFAOYSA-N 436.604 4.196 10 10 IICE Cc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)CC2(F)F)c(O)c1Br 2352942260 BQEFAFJYBCKYIL-ZDUSSCGKSA-N 435.309 4.197 10 10 IICE CC1=NN(c2cccc(C(=O)O)c2)C(=O)/C1=C/c1ccc(-c2cc([N+](=O)[O-])ccc2O)o1 100147465 HSPDXBGLNANXNI-GZTJUZNOSA-N 433.376 4.065 10 10 IICE CCN(CC)S(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(OC)c(O)c1)N2 226669126 HMRJNLLOXFBFOO-PMAPCBKXSA-N 428.554 4.258 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)N[C@@H](C)[C@H]2CCCN(C3CCC3)C2)C1 436026702 KBYRJOHCBPFQTA-SFTDATJTSA-N 436.644 4.177 10 10 IICE CCc1ccc(S(=O)(=O)N(CCF)c2cccc3c2C(=O)c2ccccc2C3=O)cc1 586240169 QDAIGHSHECFHHG-UHFFFAOYSA-N 437.492 4.189 10 10 IICE CC[C@H](C)OC(=O)[C@@H]1CC=CC[C@H]1C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 725395953 QLRZZMNXCMFWJZ-KFKAGJAMSA-N 431.488 4.325 10 10 IICE CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2nc3c(s2)CCc2ccccc2-3)c1 747752108 VUTVCQHOLCZLSU-UHFFFAOYSA-N 447.969 4.065 10 10 IICE Oc1cc(OCc2ccccc2)ccc1CN1CCOC[C@H]1C[C@@H](O)c1cccs1 753548053 AMZIYZLNGHMRMZ-NFBKMPQASA-N 425.550 4.357 10 10 IICE COC(=O)c1cc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)ccc1Cl 757498979 CJSMBXOGVMMYTQ-UHFFFAOYSA-N 426.878 4.190 10 10 IICE CCN1CCN(c2ccc(CN[C@H](C)c3ccc(N4CCCCC4)c(F)c3)cn2)CC1 764996487 WLFWYRRNPIPBLS-HXUWFJFHSA-N 425.596 4.204 10 10 IICE CC(=O)NCCc1ccc(-c2csc(NS(=O)(=O)c3cc(C)ccc3Cl)n2)cc1 765535945 SKOPZKXTTCMABQ-UHFFFAOYSA-N 449.985 4.251 10 10 IICE C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc(NS(=O)(=O)c2cccs2)ccc1O 775940085 FUITZYQPBPKAIE-RISCZKNCSA-N 448.488 4.058 10 10 IICE CC1CCN(c2cccc(NC(=O)c3cc4c(cc3Br)NC(=O)CO4)c2)CC1 782709402 RHDMGWXWCCRRCI-UHFFFAOYSA-N 444.329 4.269 10 10 IICE Cc1cc(F)cc([C@@]2(F)CCN(C(=O)NCc3ccc(N4CCC(O)CC4)c(F)c3)C2)c1 800701648 TZUQVTFSHCRZKO-XMMPIXPASA-N 447.501 4.015 10 10 IICE CSc1cccc(-n2c(C)cc(C(=O)COC(=O)COCc3cc(C)no3)c2C)c1 801460727 VQMWZSCGWLZEMX-UHFFFAOYSA-N 428.510 4.055 10 10 IICE O=C(NCc1cccc(COC2CCOCC2)c1)NCc1cc(Cl)cc(Cl)c1O 805105130 KZPLPJOBECNCIM-UHFFFAOYSA-N 439.339 4.394 10 10 IICE CCOc1cc(CNCc2ccc(N3CCC(CO)CC3)cc2)cc(Br)c1O 920182491 PDAYZCQWWLSISO-UHFFFAOYSA-N 449.389 4.052 10 10 IICE Cc1nn(C(F)F)c(C)c1CC(=O)OCC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 920917057 SKTNTURTQHHZOG-UHFFFAOYSA-N 433.430 4.410 10 10 IICE CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCN(CC(F)(F)F)c3ccccc32)CC1 1137164591 CKZVRSNRIXNIHP-UHFFFAOYSA-N 439.478 4.359 10 10 IICE C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)Cn1cc(C(N)=O)c2ccccc21 1137817008 XWUWENCNPXJKHS-GOSISDBHSA-N 427.504 4.236 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCc3cc(-c4ccccc4OC)no3)ccc21 1148937853 RXHPEATZJQGRTB-UHFFFAOYSA-N 433.508 4.498 10 10 IICE CCc1cc(N2CCC[C@H](Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)C2)ncn1 1162450195 IGZXVENWCFOXBV-IBGZPJMESA-N 431.496 4.259 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(Nc4nccs4)cc3F)CC2)c(OC)c1 1169973850 FPZVAHMLIDTXRY-UHFFFAOYSA-N 442.516 4.005 10 10 IICE C[C@H](N[C@H](C)c1cccc(F)c1F)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1192803163 PEUNRARMVMHOAF-KGLIPLIRSA-N 434.442 4.418 10 10 IICE C[C@H](NC(=O)NC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1O 1230034265 JLHJVVVZAUUUCW-HNNXBMFYSA-N 432.362 4.180 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N(C)Cc3nc(O)c4sccc4n3)c2C)c1 1234325386 CWQTXESSBASJGA-UHFFFAOYSA-N 435.553 4.454 10 10 IICE COC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(c3c(C)cc(C)cc3C)C2)sc2c1CCCC2 1264290806 XRCPPHQFJQEEQA-MRXNPFEDSA-N 440.565 4.330 10 10 IICE Cc1cc(CC(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)c(C)n1-c1ccccc1 1266706992 JIBOKLUEZXWZQP-JOCHJYFZSA-N 439.918 4.351 10 10 IICE O=C(C[C@@H]1CCc2sccc2C1=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 1294161601 PMGLQAVQKQLUMW-GJZGRUSLSA-N 434.508 4.270 10 10 IICE CCOCn1nc(C)c(C[C@H](C)C(=O)N(Cc2ccco2)Cc2ccccc2O)c1C 1294673141 ZLNMIANCMPWSMS-KRWDZBQOSA-N 425.529 4.200 10 10 IICE Cc1cc(CC(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)c(C)n1-c1ccc(Cl)cc1 1295283301 ZUWGHWKTMUBARV-JOCHJYFZSA-N 438.959 4.288 10 10 IICE O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2 1298842758 VULDRWXLUVNBPW-VGOFRKELSA-N 449.334 4.364 10 10 IICE O=C(C[C@](O)(c1nc2ccccc2s1)C(F)(F)F)NCc1ccc2cccnc2c1O 1299721459 LKTBLEIIQGFJPM-FQEVSTJZSA-N 447.438 4.007 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2c(C)nn(Cc3ccccc3Cl)c2C)cc1 1300282755 XNWQSHHSFXJJPM-UHFFFAOYSA-N 440.975 4.419 10 10 IICE COc1ccc(N2CCCN(c3nnc(-c4ccccn4)n3CCC(C)(F)F)CC2)cc1 1315516085 YCHGJNKBABPLLZ-UHFFFAOYSA-N 442.514 4.111 10 10 IICE Cc1cc(O[C@@H](C)C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)ccc1Cl 1356037190 UOCVBAZCFRNMSG-BBWFWOEESA-N 434.939 4.485 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)C1(S(=O)(=O)c2ccccc2)CCCCC1 1356268161 UWFHWKCDASUVAS-UHFFFAOYSA-N 440.609 4.422 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3cc(-c4ccc(F)cc4)on3)cc2F)C[C@H](C)O1 1357836553 XNTQCPVCIUQNRK-GJZGRUSLSA-N 427.451 4.163 10 10 IICE COc1cc([C@@H](C)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc(OC)c1OC 1441506773 DZYGGKKCZXPANV-MRXNPFEDSA-N 436.508 4.423 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)[C@]3(C)CCc4c(C)c(O)c(C)c(C)c4O3)C2)cc1 1452036459 YEULQFFEFHICSA-BCHFMIIMSA-N 438.568 4.052 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CSCc3cccc(F)c3F)cc2F)C[C@@H](C)O1 1459255082 XIJHGAIQCXARSL-GASCZTMLSA-N 438.515 4.267 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NC[C@H](n2cncn2)C(F)(F)F)cc1 1462159939 UTGNFYDAYRHPOP-SFHVURJKSA-N 431.422 4.293 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3ccccc3COCc3ccccc3)cc2)CC1 1462484525 HQKSJEZJDUQTNP-UHFFFAOYSA-N 429.564 4.085 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)C2CC(NC(=O)OC(C)(C)C)C2)c1 1468155870 ZVFUECRCWJZQDH-UHFFFAOYSA-N 425.529 4.034 10 10 IICE COc1ccc(CNC(=O)N[C@@H](Cc2cccc(Br)c2)CC2CC2)c(O)c1 1478456109 KPAJDLFHTKPHRY-GOSISDBHSA-N 433.346 4.374 10 10 IICE C[C@H](NC(=O)N1C[C@@H]2CCC[C@]2(CNC(=O)OC(C)(C)C)C1)c1ccc(N(C)C)cc1 1478470786 JGOPNHKGHDAZSQ-KDLAUNOPSA-N 430.593 4.150 10 10 IICE CCC(CC)NC(=O)c1nnc(N2C[C@H]3CCC[C@H]32)n1Cc1ccc(N(CC)CC)cc1 1496787476 HMRSQNUQJYQLKT-DENIHFKCSA-N 438.620 4.080 10 10 IICE Cc1cnc([C@@H](C)Cn2c(Cc3cccnc3)nnc2N(C)Cc2ccccc2O)s1 1511442806 WVWLMMBLYBHINL-INIZCTEOSA-N 434.569 4.175 10 10 IICE C[C@@H]1COCC[C@@H]1Cn1c([C@@H]2CCO[C@H]2C(C)(C)C)nnc1N(C)Cc1ccccc1O 1512544094 UHFKQZGNVDJCAT-RMEPHLEKSA-N 442.604 4.211 10 10 IICE CCN(c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CC(C)(C)C(=O)NC)C(C)C 1515385333 XODLHSIRVJNTOU-UHFFFAOYSA-N 436.604 4.360 10 10 IICE CCCc1c(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)cnn1-c1ccc(C)cc1 1528555155 XHMBZYAYWJSAKO-FQEVSTJZSA-N 432.568 4.461 10 10 IICE COc1ccc(C)cc1N1C[C@H](C(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1=O 1531604582 MXILBRPNVNDUQH-JOCHJYFZSA-N 445.563 4.389 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Cl)c(Br)c1 1535345789 ONXZVNHPRISBCU-UHFFFAOYSA-N 445.691 4.147 10 10 IICE Cc1cc(C(=O)N2CCN(Cc3cccc(F)c3)C(=O)C2)c(C)n1-c1ccc(Cl)cc1 1543938152 DFBKDCHMCCCNQR-UHFFFAOYSA-N 439.918 4.371 10 10 IICE COc1ncc(Br)cc1CNC(=O)N(Cc1ccco1)Cc1ccccc1O 1565086155 ITKLYKODLXGFLF-UHFFFAOYSA-N 446.301 4.063 10 10 IICE COC(=O)[C@@H](CNC(=O)c1cc(C)n(-c2ccccn2)c1C)Cc1cccc2ccccc12 1565704840 UVQCMWUNUOAPDJ-JOCHJYFZSA-N 441.531 4.404 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCC3(c4ccccc4)CCN(C)CC3)ccc21 1587291046 ODMOIQHSNWVODQ-UHFFFAOYSA-N 433.596 4.298 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1Cl 1611432163 WYISOKKADNUYIO-CYBMUJFWSA-N 434.920 4.388 10 10 IICE COc1ccc(CNC(=O)c2csc(-c3ccc(Br)s3)n2)c(O)c1 1617752892 LBRNZCGDLSVOJZ-UHFFFAOYSA-N 425.329 4.278 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)CC2CC(OC(C)(C)C)C2)NC(=O)OC(C)(C)C)cc1 1618253245 LMPWVRDHCAGXKU-FBPXKMNZSA-N 447.620 4.418 10 10 IICE C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)N(C(=O)OC(C)(C)C)C1CC1 1626105475 DHGGPOBOANIWFN-AVRDEDQJSA-N 445.604 4.048 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1cc(N(C)C)nc2ccccc12 1626511955 UDGRQGOELHOQAX-UHFFFAOYSA-N 448.567 4.303 10 10 IICE Cc1cc(Br)cc(C)c1N1CCC[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 1627048424 UKRKZHXZGDSTHY-JHTBKMLMSA-N 445.357 4.276 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC[C@H](CO)Cc3ccc(F)cc3)cc2Cl)C1 1634720399 VLIQFCWOERBIBQ-YLJYHZDGSA-N 447.982 4.366 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1cnn(C2CCC2)c1 1635925394 ULSALUUFOMRZDR-MHWRWJLKSA-N 432.596 4.290 10 10 IICE O=C(CCOc1ccc(F)cc1Cl)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 1635941771 VOLZROCCJBHPPX-QGZVFWFLSA-N 441.330 4.388 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)Cc1cnc2ccccc2n1 1639827284 NUHRJPAQXQEQNG-SFHVURJKSA-N 448.567 4.197 10 10 IICE CC(C)(C)OC(=O)N1CCOc2ccccc2[C@@H]1C(=O)NCc1cc(Cl)ccc1O 1640924925 WRALAFBNRCBGTI-LJQANCHMSA-N 432.904 4.033 10 10 IICE Cc1ccc(F)c(CN(C)[C@H](C)C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)c1 1645447863 SWPLMZMMSGMELH-MRXNPFEDSA-N 430.479 4.369 10 10 IICE Cc1ccc(C)n1-c1ccsc1C(=O)NCC1(OCCO)CCC(C(F)F)CC1 1645768000 UHQOXUYPJAWWSE-UHFFFAOYSA-N 426.529 4.088 10 10 IICE COC(=O)c1cnc(SCC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)s1 1652854268 ZBGUINRMEJNDOL-SFHVURJKSA-N 430.576 4.258 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N2CC[C@@H](c3nccc(C(F)(F)F)n3)C2)c1 1652946536 RSQRGXVOFIRNJF-QGZVFWFLSA-N 442.441 4.345 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)N(C)C)cc1 1676653176 HEGHMWRLLLCVQJ-DEOSSOPVSA-N 444.570 4.298 10 10 IICE COc1cc(N2CCN(C(=O)NCC3CC(C)(C)CC(C)(C)C3)CC2)cc(OC)c1OC 1682559427 XEGHARXLTAIGRG-UHFFFAOYSA-N 447.620 4.397 10 10 IICE CCc1ccccc1[C@@H](CNC(=O)NCc1ccc(OC)cc1O)NC(=O)OC(C)(C)C 1683069279 VJYHLIBIKSRCSV-HXUWFJFHSA-N 443.544 4.028 10 10 IICE CN(Cc1c(Cl)cccc1Cl)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1683196085 ZDWBYALNHSLQGR-UHFFFAOYSA-N 444.309 4.450 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CC[C@@H](c3ccccc3F)C2(C)C)N(C)C)cc1 1685686976 UHXATCGJWODQTJ-JTHBVZDNSA-N 426.580 4.472 10 10 IICE Cc1csc(N2CCN(C(=O)NCc3ccc(N4CCC[C@@H](C)C4)c(Cl)c3)CC2)n1 1686269784 YZJKCXXIZFLXAJ-MRXNPFEDSA-N 448.036 4.373 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1 1686826576 KWBRSUXCPOPZQB-SFHVURJKSA-N 432.609 4.033 10 10 IICE CO[C@H]1CN(c2nnc(CC3CCCC3)n2Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C 1697691684 DKNNUANBMHNLAN-VGSWGCGISA-N 429.584 4.125 10 10 IICE Cc1ccc(-c2nnc(N3CCN(CC(C)C)CC3)n2CCCSc2nccs2)o1 1707371003 AQOLRYFOUUXPMA-UHFFFAOYSA-N 446.646 4.263 10 10 IICE C[C@@H]1CCN(c2nnc(Cc3ccncc3)n2Cc2ccc(N(C)C)c(F)c2)CC1(C)C 1708129371 ACSOPMNXNUFXOE-GOSISDBHSA-N 436.579 4.390 10 10 IICE CN(Cc1ccccc1O)c1nnc(C2CCC2)n1Cc1cccnc1OCC(F)(F)F 1711095118 BEUCVXICBKQMDP-UHFFFAOYSA-N 447.461 4.272 10 10 IICE C[C@H]1CN(C(C)(C)Cn2c(C3CCCC3)nnc2N(C)Cc2ccccc2O)C[C@@H](C)O1 1726646419 WHMIWTPYADYJNY-KDURUIRLSA-N 441.620 4.166 10 10 IICE COc1cc(OC)cc(-c2nnc(N3CCCC3)n2CCCSc2nccs2)c1 1730022327 WPPNYUSGWBMPDT-UHFFFAOYSA-N 431.587 4.201 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCC(=O)N3)nnc2N(CC)[C@H](C)C2CCC2)cc1 1746090309 UGMIGHUOBOBVLN-GCJKJVERSA-N 438.620 4.139 10 10 IICE CCN(Cc1cccs1)c1nnc([C@H]2CCOC2)n1Cc1ccc(N(C)C)c(F)c1 1746231903 FFBVDEPQKQGGSV-KRWDZBQOSA-N 429.565 4.123 10 10 IICE CSC1(Cn2c(CC(C)(C)C)nnc2N(C)Cc2ccc(N3CCOCC3)cc2)CC1 1750263193 KFRZVXQFBPFZAW-UHFFFAOYSA-N 443.661 4.235 10 10 IICE Cc1nnc(N2CC[C@@H](COCc3ccccc3)C2)n1CCCSc1nccs1 1751905413 QCEOQMIXIPSTSJ-LJQANCHMSA-N 429.615 4.269 10 10 IICE CCCN(CC1CC1)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC(=O)N(C)C 1764328747 PGJZOVIXXNQBHT-UHFFFAOYSA-N 448.615 4.457 10 10 IICE COC[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)C[C@H]1CCCO1 1769197050 BJOFCZZEKANQOL-XMSQKQJNSA-N 437.588 4.250 10 10 IICE COc1ccccc1-c1nnc(N2CCC[C@H](OC)C2)n1CCCSc1nccs1 1770406834 UCUSMEVLCTXOCQ-INIZCTEOSA-N 445.614 4.208 10 10 IICE O=C1c2ccccc2C(=O)c2c(NC(=O)[C@H]3CCCN(Cc4ccc(F)cc4)C3)cccc21 1861858412 RBPIUTWYMWMYHN-SFHVURJKSA-N 442.490 4.452 10 10 IICE COC(=O)c1c(NC(=O)[C@H](N)C(C)C)sc(C)c1-c1ccc(Br)cc1 1865915460 FZFIBNRULWWZKB-OAHLLOKOSA-N 425.348 4.194 10 10 IICE COc1ccc(CN2C(=O)C(NC3CC3)=C(c3ccc(-n4c(C)ccc4C)cc3)C2=O)cc1 1873167074 QVPJBINPHOTFOV-UHFFFAOYSA-N 441.531 4.135 10 10 IICE COc1ccc(Cn2nc(C(C)C)c(C(F)(F)F)c2I)c(O)c1 2079826074 JMGWSWJBHMTOKE-UHFFFAOYSA-N 440.203 4.392 10 10 IICE COc1ccc([C@@H](C2CC2)n2nc(C3CCC3)c(N)c2I)c(O)c1 2080043144 QDSYFMOTLXHBCF-QGZVFWFLSA-N 439.297 4.051 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H](NCc2cc(Br)cc(F)c2O)CC2(CC2)C1 2098587712 LREVIBNHJFZLLQ-AWEZNQCLSA-N 429.330 4.173 10 10 IICE CC1(C)CN(Cc2ccccc2)[C@@H](CNCc2cc(Br)cc(F)c2O)CO1 2194639830 ZMBOVJDNCPMIIU-SFHVURJKSA-N 437.353 4.063 10 10 IICE O=C1NN(c2cccc(Br)c2)C(=O)C1=Cc1ccc(-c2ccccc2F)o1 2297335007 CAGMLCFVBGMYSY-UHFFFAOYSA-N 427.229 4.310 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](NCc3cc(Cl)cc(Br)c3O)[C@H]1C2 2308469869 WLEIWTXHUROHFJ-WKPIXPDZSA-N 431.758 4.296 10 10 IICE Cc1cc(C(=O)Cn2nc(C(=O)O)c3ccccc3c2=O)c(C)n1-c1ccc(Cl)cc1 3341662 XEPMLQFKEBTJEN-UHFFFAOYSA-N 435.867 4.039 10 10 IICE aggregator CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)c2cc(C)n(-c3cccc(F)c3)c2C)C1=O 8644668 LCQFOGQVTSBXDQ-VWLOTQADSA-N 433.483 4.273 10 10 IICE COc1ccc([C@H]2Nc3ccc(S(=O)(=O)N4CCCC4)cc3[C@H]3C=CC[C@@H]32)cc1O 14457128 RCGJMINTISAEHC-IUKKYPGJSA-N 426.538 4.012 10 10 IICE CC1=CC2=NC(=O)/C(=C\c3cn(CCOc4cccc(C)c4)c4ccccc34)C(=N)N2O1 20236018 JUWIWLRUEMPBNV-UDYULTBOSA-N 426.476 4.479 10 10 IICE CCOc1cc(/C=C2/C(=N)N3OC(C)=CC3=NC2=O)ccc1OCc1ccc([N+](=O)[O-])cc1 20236869 QVWFWGUEWLLGRZ-DGOGAKRRSA-N 448.435 4.023 10 10 IICE Cc1cc(/C=c2/sc3nc4ccccc4n3c2=O)c(C)n1-c1ccc(C(=O)O)c(Cl)c1 59678174 NMIJTFBUVBZUFF-KEBDBYFISA-N 449.919 4.216 10 10 IICE CCc1ccc(N2C(=O)/C(=C\c3cccn3-c3ccc(C(=O)O)cc3)C(O)=NC2=S)cc1 96850666 DFBWJMOUHMTVAA-ZHZULCJRSA-N 445.500 4.410 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2Cc2nc(-c3ccc4c(c3)CCC(=O)N4)no2)C1 584079564 NTYWTGNLBFRUSN-UHFFFAOYSA-N 441.535 4.391 10 10 IICE Cc1csc([C@@H](C)NC(=O)CCCN2C(=O)/C(=C\c3cccs3)SC2=S)n1 727669178 HUBMQYBSPTZHJF-ZMTLZGASSA-N 437.637 4.372 10 10 IICE CN(C(=O)NCCCSc1nccs1)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 752689306 RDENWPTWBJMPTB-XYPWUTKMSA-N 440.635 4.197 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N1CCO[C@@H](C2CCCCC2)C1 758450009 QDLVLKFFELPORS-OAQYLSRUSA-N 437.531 4.248 10 10 IICE O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@H](c1ccccc1)[C@H]1CCOC1 772458963 GNINDRHMZQLQOL-PGRDOPGGSA-N 445.510 4.334 10 10 IICE C[C@@H](NCc1cc(Br)cc(Br)c1O)c1nnc2n1CCCCC2 775935056 AAYISJVAOONFMT-SNVBAGLBSA-N 444.171 4.086 10 10 IICE O=C(NCc1ccc(N2CCSCC2)cc1)N1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 780821685 WEVLZRDALSQIOV-OAQYLSRUSA-N 448.596 4.072 10 10 IICE O=C(CN1C(=O)c2c(F)cccc2S1(=O)=O)Nc1ccc(N=Nc2ccccc2)cc1 799311930 JRVDFBYPRBRCCM-UHFFFAOYSA-N 438.440 4.024 10 10 IICE COc1ccc(N2CCN(c3nnc(-c4ccoc4)n3Cc3ccccc3)CC2)cc1F 802100460 PJIWWUTTWQYRHE-UHFFFAOYSA-N 433.487 4.061 10 10 IICE Cn1ccc([C@H](NC(=O)NCc2cc(Br)ccc2O)c2ccc(Cl)cc2)n1 807111892 LVPLRDNYVJEKHL-GOSISDBHSA-N 449.736 4.130 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@H]2OCC[C@H]2c2ccccc2)n1C[C@H]1CCCCO1 812438025 JLJBNOMEKFQSHT-GPXNEJASSA-N 448.567 4.434 10 10 IICE Cc1cc(C(=O)N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)c(C)n1-c1ccccn1 817750952 GMNAFNHVVUPHNW-BGYRXZFFSA-N 438.572 4.208 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cc(Cl)c4cc(Cl)ccc4n3)cc2)CC1 1132899463 VVBFKADZBPANKF-UHFFFAOYSA-N 429.351 4.223 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)COC(c2ccccc2)c2ccccc2)N(C)C)cc1 1134881587 AIPGRUWVCMCZKG-RUZDIDTESA-N 431.580 4.278 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)[C@H](C)CC(=O)c3ccc(F)cc3)cc2F)C[C@@H](C)O1 1141901655 JUFMGSRMOPBJEX-ZACQAIPSSA-N 430.495 4.104 10 10 IICE CC(C)c1ncc(OCc2ccccc2)c(C(=O)NCc2ccc3cccnc3c2O)n1 1142730598 ANJGTVTZXUNZNN-UHFFFAOYSA-N 428.492 4.363 10 10 IICE O=C(CCc1nc2cc(Cl)ccc2s1)NCc1ccc(N2CCC(O)CC2)cc1 1148701192 MGCAVGFYWNEDBY-UHFFFAOYSA-N 429.973 4.160 10 10 IICE CC(C)(C)OC(=O)NCCCOCCNC(=O)N(Cc1ccccc1O)C1CCCCC1 1234204313 YUFUYBZLPJSDAY-UHFFFAOYSA-N 449.592 4.168 10 10 IICE COc1cccc2c(C(=O)NCc3ccc(N4CCOCC4)cc3C(F)(F)F)coc12 1264640796 IVXOGMRKMRQXPG-UHFFFAOYSA-N 434.414 4.227 10 10 IICE COc1ccc(N2CCN(C(=O)C3(c4ccc(C(F)(F)F)cc4)CC3)CC2)c(OC)c1 1287484437 INYAENXQYBACOM-UHFFFAOYSA-N 434.458 4.103 10 10 IICE CO[C@@H]1CCC[C@@H](C(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)C1 1289511110 ZDKCBWPUYXFZQC-UKRRQHHQSA-N 429.318 4.303 10 10 IICE Cc1nnc(N2C[C@H](C)O[C@H](C(F)(F)F)C2)n1Cc1ccc(N2CCC(C)CC2)cc1 1290755485 PNHVJLPWJRNWPD-JXFKEZNVSA-N 437.510 4.027 10 10 IICE CC(C)(C)OC(=O)NC[C@H]1Cc2ccccc2N(C(=O)c2ccc(N=NC(N)=O)cc2)C1 1302677266 SEXWEEZDPBQHFP-OAHLLOKOSA-N 437.500 4.193 10 10 IICE COC(=O)[C@H](c1cccc(Br)c1)N(C)Cc1cc(Cl)cc(C(C)=O)c1O 1307585137 IVHSOPCSHPALPY-KRWDZBQOSA-N 440.721 4.357 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 1312527442 FRZHYBPCJRSEFJ-SXLOBPIMSA-N 432.609 4.127 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C1CCC(NC(=O)OC(C)(C)C)CC1 1312886348 UITCBDBWSPZHHO-KMFTYDHNSA-N 446.636 4.469 10 10 IICE CSCCCN(C)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N(C)C)c(F)c1 1316469012 YTLCYPQJAHQDDM-UHFFFAOYSA-N 428.581 4.091 10 10 IICE O=C(NC1CCC(C2CCC2)CC1)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1453729102 CAXZJGVYYIQZPZ-UHFFFAOYSA-N 434.583 4.343 10 10 IICE CN1CCN(c2ccc(CNC(=O)c3cccc4cccc(Br)c34)cc2)CC1 1462484534 HRXPASVOQYLOOC-UHFFFAOYSA-N 438.369 4.284 10 10 IICE O=C(N[C@@H]1CCN(c2ccc(Cl)cc2F)C1)N(Cc1ccccc1O)C[C@@H]1CCCO1 1471005146 QYGYFZYWJHSHLJ-MOPGFXCFSA-N 447.938 4.154 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)Cc2c[nH]nc2C)sc(C)c1-c1ccccc1 1473699804 FSGCIXFEAOBPTR-UHFFFAOYSA-N 426.542 4.002 10 10 IICE CCOCC(C)(C)Cn1c(N(C)Cc2ccc(N3CCOCC3)cc2)nnc1C(C)(C)C 1502995544 ZRVYKCIJALUERU-UHFFFAOYSA-N 443.636 4.111 10 10 IICE CSCCCN(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@H](C)N(C)C 1505252693 QCIHEHMIMHSHSQ-IBGZPJMESA-N 440.661 4.492 10 10 IICE CCSCC[C@H](C)NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1523667028 DGTXAGSPPFDJHX-HKJJFUAXSA-N 426.604 4.065 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cnc(-c4c(F)cccc4F)s3)CC2)cc1 1528111456 WMYCBTSIZWKJSA-UHFFFAOYSA-N 429.492 4.496 10 10 IICE COC(=O)[C@]1(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)CCCC(C)(C)C1 1532623369 WFORIPRYZJGIBH-VWLOTQADSA-N 426.557 4.157 10 10 IICE CCOC(=O)N1[C@H](C(=O)NCc2ccc(N(CC)CC)cc2)CC[C@H]1c1ccc(C)o1 1534245585 FSMNQOPNSSGFKZ-SFTDATJTSA-N 427.545 4.413 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1 1539467817 FAUKCUKSJFMBRW-AREMUKBSSA-N 441.575 4.287 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CC(=O)N(c3cccc(SC)c3)C2)cc1 1540459490 KAVZBBOZQHABFM-LJQANCHMSA-N 425.598 4.266 10 10 IICE COc1ccc(N2CCN(C(=O)c3cnn(CC(C)C)c3-c3ccccc3)CC2)c(OC)c1 1543632916 RZUYGNCWVWODCK-UHFFFAOYSA-N 448.567 4.186 10 10 IICE CC[C@H](Nc1cccnc1Cl)C(=O)N(CC)Cc1cc(Br)ccc1O 1545508463 CEGSXWFTNDHFJZ-AWEZNQCLSA-N 426.742 4.442 10 10 IICE CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1Cc1cccnc1OCC(F)(F)F 1554174608 GOGKOUALHAKHOT-UHFFFAOYSA-N 449.477 4.302 10 10 IICE Cc1cc(C(=O)N[C@H]2C[C@@H](N(C)C)C23CCC3)c(C)n1-c1ccc(Br)cc1 1557697612 WJDKWAJJVYOBTF-VQTJNVASSA-N 430.390 4.459 10 10 IICE CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1C[C@H](OC(C)(C)C)[C@@H]1n1cccn1 1564771467 QYACLCSFFXXKIA-BHIFYINESA-N 427.593 4.066 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@]3(C)CC3(Br)Br)cc2)CC1 1565663550 HERWCXOQDFWVRN-KRWDZBQOSA-N 444.211 4.435 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)N2CCC(CN3CCNC3=O)CC2)cc1 1585426006 DXKKFICXLROADR-UHFFFAOYSA-N 434.544 4.045 10 10 IICE Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N[C@@H](C)Cc3ccc(N(C)C)cc3C)C2)c1 1597799542 CWAACZUHUWUWBM-GMAHTHKFSA-N 435.612 4.277 10 10 IICE COCCCN(Cc1cc2c(C)cc(=O)oc2c(C)c1O)C[C@@H]1CCCN2CCCC[C@@H]12 1614472675 BHCZOCAGPZUNOC-REWPJTCUSA-N 442.600 4.218 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCCOC(F)F 1617941403 QAPWCEJXAVJJTK-SJLPKXTDSA-N 438.519 4.168 10 10 IICE Cc1cc(C(=O)N[C@H](C)c2nc(C(C)(C)C)no2)c(C)n1-c1ccc(Br)cn1 1620989241 WAOWYJOJCLONBE-GFCCVEGCSA-N 446.349 4.423 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C 1623451585 IXFVVCSYQYDLIL-OAQYLSRUSA-N 447.620 4.153 10 10 IICE CN1CCCc2cc(CNC(=O)Cc3cccc4c3CCN(C(=O)OC(C)(C)C)C4)ccc21 1626940931 QXRVZWOWYZAXIH-UHFFFAOYSA-N 449.595 4.221 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)cc1 1628399352 SFODEMQLTRWZLW-QHCPKHFHSA-N 449.938 4.024 10 10 IICE CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)NCc2cc(Cl)ccc2O)CC1 1628667622 YLOUCBUIDDUCTG-UHFFFAOYSA-N 433.936 4.349 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N(C)c2ccc(OCCN(C)C)cc2)CCCC1 1628975979 UEINZACTJTUGBG-UHFFFAOYSA-N 435.568 4.132 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)[C@H](CN1CCCC1)c1ccccc1 1629972290 QXGLNLNVFUMRHO-HXUWFJFHSA-N 431.374 4.383 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CSCc1cccc(Cl)c1 1632701388 DAOQDEAOACOGOK-UHFFFAOYSA-N 428.337 4.134 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc(-n2ccc(C)n2)cc1 1635489102 JCMQYEOVMDFDKM-UHFFFAOYSA-N 434.540 4.183 10 10 IICE O=C(NCc1c(O)cccc1O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl 1635846840 CCDASYRRPOKOEO-UHFFFAOYSA-N 427.844 4.202 10 10 IICE COC(=O)[C@H]1C[C@H](C)CCN1C(=O)c1cc(C)n(-c2ccccc2Br)c1C 1639165630 DOZCXASKZOSXGR-BFUOFWGJSA-N 433.346 4.270 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)Nc2ccc3c(c2)nc(C)n3[C@H](C)CO)cc1 1640679652 RQTYJLPGHGQTKH-QGZVFWFLSA-N 444.535 4.299 10 10 IICE C[C@@]1(C(=O)NCc2cc(Cl)cc(Cl)c2O)CCN(C(=O)OCc2ccccc2)C1 1641997692 VJUYNKXOODNNLH-OAQYLSRUSA-N 437.323 4.364 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)Cn3nnc(-c4ccc(Cl)cc4)n3)c2C)c1 1643365827 FCYSCKBTOHSEOY-UHFFFAOYSA-N 434.931 4.026 10 10 IICE COC(=O)CN(Cc1cccc(Br)c1)Cc1cc(Cl)cc(C(C)=O)c1O 1658512740 YMWZWHQAWHSORL-UHFFFAOYSA-N 440.721 4.186 10 10 IICE Cc1ccccc1CN1CCCN(C(=O)CN(C)c2ccc(-c3nccs3)cc2)CC1 1658928091 LHECCBORUBICRR-UHFFFAOYSA-N 434.609 4.289 10 10 IICE CCOC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)o1 1672133656 ZPDGXYTZTLRYRR-OAHLLOKOSA-N 433.936 4.345 10 10 IICE O=C(NCc1cc(F)c(Br)cc1F)NCc1c(O)ccc2c1CCCC2 1687239966 XCNIWFYPANWXBN-UHFFFAOYSA-N 425.273 4.311 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@@H]2CCCN(CC(C)C)C2)n1 1707582723 CNWAMQDHKDLQGK-OAQYLSRUSA-N 448.615 4.359 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CC3)nnc2N(C)Cc2ncc(Cl)n2C)cc1 1728384197 KNPRBDPJCSJAAF-UHFFFAOYSA-N 442.011 4.148 10 10 IICE CCCOc1ccc(Cn2c([C@@H]3CCCCO3)nnc2N(C)Cc2ccccc2O)cn1 1766295478 FJGISZMJQBNJRM-NRFANRHFSA-N 437.544 4.094 10 10 IICE CCOCc1nnc(N2CCC[C@H](C(F)(F)F)C2)n1Cc1ccc(N(C)C)cc1C 1766347792 WOKHYQGFOSMKEK-KRWDZBQOSA-N 425.499 4.016 10 10 IICE CCOCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N(C)Cc1cnn(C)c1C 1768137780 MWVDXVZCUUITGQ-UHFFFAOYSA-N 447.587 4.067 10 10 IICE COc1ccc(S(=O)(=O)Nc2nc(-c3cccs3)c(CCC(=O)O)s2)c(C)c1 1858070067 DTJMOXSIEYTELG-UHFFFAOYSA-N 438.552 4.007 10 10 IICE CC(C)(C)OC(=O)N1C[C@H](NCc2c(O)cccc2Br)[C@@H]2CCCC[C@@H]21 2122811905 MBHJJSBQUZVEAQ-JQFCIGGWSA-N 425.367 4.422 10 10 IICE COc1cc(C=C2SC(=S)N(c3cccc(Cl)c3)C2=O)ccc1OCC(=O)O 2293559161 BELYFASQOBLJNC-UHFFFAOYSA-N 435.910 4.218 10 10 IICE Cc1cc(C=C2C(=O)NC(=O)N(CCc3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 2296196261 INFQZPUNNLBNLO-UHFFFAOYSA-N 447.922 4.452 10 10 IICE COc1ccc(Cl)c2ccc(C=C3SC(=S)N([C@H](C(=O)O)C(C)C)C3=O)nc12 2297500907 RHFBJJRBXZQROT-INIZCTEOSA-N 436.942 4.207 10 10 IICE CCN(CC)CCNC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1[N+](=O)[O-])N2 14478426 XQUBCKFRSLPEOD-AXHZCLLHSA-N 434.540 4.493 10 10 IICE COc1cc(NC(=O)C(c2ccccc2)c2ccccc2)c(N2CCOCC2)cc1OC 20496286 WKXBUVOULCRVHE-UHFFFAOYSA-N 432.520 4.311 10 10 IICE O=C(O)CN1C(=O)/C(=C\c2ccc3noc(-c4ccc(Cl)cc4)c3c2)SC1=S 39895731 OKJBNIWFOGVMPG-OVCLIPMQSA-N 430.894 4.434 10 10 IICE COc1ccc(N2CCN(c3ncnc(Nc4cc(Cl)ccc4Cl)c3N)CC2)cc1 40727739 ZNMYJNSADWLGFD-UHFFFAOYSA-N 445.354 4.444 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)N3CCN(C(=O)c4ccc(F)c(F)c4)CC3)c2C)c1 105904961 RYVCBPDSNYRQIX-UHFFFAOYSA-N 437.490 4.279 10 10 IICE O=C(N[C@@H](c1ccccc1)c1c(O)ccc2ccccc12)[C@@H]1CCCN(C(=O)C2CC2)C1 109915405 OKNFPPDLNZZEFR-BWKNWUBXSA-N 428.532 4.400 10 10 IICE CC[C@H](C)NS(=O)(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(O)c(OC)c1)N2 251315367 FRKPVXNEQIVIQP-ZFTZODIFSA-N 428.554 4.304 10 10 IICE Cc1cc2c(n1-c1ccc(I)cc1Br)CCC[C@@H]2N 388652998 NXDUCLSZKAUXDH-ZDUSSCGKSA-N 431.115 4.489 10 10 IICE C[C@H]1C(=O)N([C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)C(=O)N1Cc1ccccc1 761637837 VQPRCPUNFINVIH-QFBILLFUSA-N 429.467 4.110 10 10 IICE CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(F)cc1F 769281411 ALABGPVIJLEERJ-NQERJWCQSA-N 428.479 4.102 10 10 IICE C[C@@H](NCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ncc(Br)cc1F 779041430 RLQOETKFMWFRFN-MRXNPFEDSA-N 447.396 4.366 10 10 IICE Cc1occc1-c1cc(NC(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)no1 786213778 GINSTFKNMGENDQ-UHFFFAOYSA-N 435.528 4.097 10 10 IICE CCOC(=O)c1c(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)noc1C 809953618 PKXZHISCFKZVAJ-QGZVFWFLSA-N 427.526 4.495 10 10 IICE COC(=O)/C=C\c1ccc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 918736249 UPHPBEWVISBNGZ-USKJLILSSA-N 426.313 4.348 10 10 IICE CCOC(=O)COc1ccc(NC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1127508246 SWFWLPCGXBFYRL-UHFFFAOYSA-N 436.508 4.109 10 10 IICE CN(C)c1ccc(CNC(=O)Cc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)cc1F 1136454273 RJCOQPVKLLAIQR-UHFFFAOYSA-N 441.547 4.044 10 10 IICE Cc1cc(C(=O)Nn2cc(Br)cn2)c(C)n1-c1cccc(Br)c1 1151918480 RNMTVRSGNJODLA-UHFFFAOYSA-N 438.123 4.200 10 10 IICE Cc1cc(C(=O)CSc2nncn2CC(F)(F)F)c(C)n1-c1ccc(Cl)cn1 1188700759 NRNCCFXWOVPNDG-UHFFFAOYSA-N 429.855 4.271 10 10 IICE O=C(NCc1ccc(N2CCOCC2)c(F)c1)[C@H](OCC1CCCC1)c1ccccc1 1264688128 YEQPZOBGTWDESR-XMMPIXPASA-N 426.532 4.227 10 10 IICE CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C 1287659687 APEWPNNAVXAWIS-NSKACUHBSA-N 425.598 4.277 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)c2C)c1 1287660202 MEAZCJLKDACGJL-UHFFFAOYSA-N 439.581 4.019 10 10 IICE CN(C)c1ccc(CN(C[C@H]2CCCO2)C(=O)c2ccn3cc(C(F)(F)F)nc3c2)cc1 1292382120 MYYIPUNJPVSYNC-LJQANCHMSA-N 446.473 4.241 10 10 IICE CC[C@@H]1CN(c2nnc(-c3cccnc3)n2Cc2ccc(N(CC)CC)cc2)C[C@@H](C)O1 1293571600 OGTQKFVYZJVWQH-AUSIDOKSSA-N 434.588 4.238 10 10 IICE COC(=O)[C@H](Cc1ccncc1)NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 1298477563 QIXXQTZJDBWZMY-QFIPXVFZSA-N 431.496 4.077 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)cc1 1300279629 JLLNJGQDJSDLKR-UHFFFAOYSA-N 431.508 4.390 10 10 IICE Cc1cccc(-c2nnc(N(C)Cc3ccccc3O)n2C[C@H](C)c2c(C)noc2C)n1 1304455885 KCDZWAVWVMNECE-HNNXBMFYSA-N 432.528 4.399 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1c2ccccc2C[C@H]1NCc1c(O)cccc1Br 1308537279 SRSDMIWWBWSAKT-IEBWSBKVSA-N 433.346 4.435 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cc(OCc4ccccc4)ccn3)cc2F)C[C@@H](C)O1 1354658484 PCHHKCDEUHTTCE-RTBURBONSA-N 449.526 4.343 10 10 IICE Cc1cc(O[C@H](C)C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)ccc1Cl 1356037197 UOCVBAZCFRNMSG-YESZJQIVSA-N 434.939 4.485 10 10 IICE C[C@@H](NC(=O)c1cc(F)c(Cl)c([N+](=O)[O-])c1Cl)c1ccc(N2CCOCC2)cc1 1442412867 PMMOTFQEFSHXNU-LLVKDONJSA-N 442.274 4.368 10 10 IICE O=C(N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1)c1cc(-c2ccccc2Cl)[nH]n1 1445880059 FMRJKTDQOPYBSA-MRXNPFEDSA-N 445.350 4.484 10 10 IICE COc1ccc(N(C)CC(=O)Nc2nc(C)c(Cc3ccc(C)cc3)s2)c(OC)c1 1459800564 SUVZFJFRXFPAPO-UHFFFAOYSA-N 425.554 4.443 10 10 IICE CCCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(C)cc1 1463276950 BHLXVZGRMWJJPS-RUZDIDTESA-N 433.600 4.232 10 10 IICE Cc1cc(C(=O)NCC2(C(=O)N(C)C)CCCC2)c(C)n1-c1ccc(Br)cc1 1465088260 AUMLWYNUIBWWSJ-UHFFFAOYSA-N 446.389 4.235 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N[C@@H](C)c3cc(Cl)cc4c3OCC4)C2)cc1 1470592196 AIHNQRWIYUCUIN-HOTGVXAUSA-N 429.948 4.170 10 10 IICE C[C@H](NC(=O)N1CCC[C@H]([C@H]2CCN(C(=O)OC(C)(C)C)C2)C1)c1ccc(N(C)C)cc1 1478471024 MDCIQUUMCAQRFV-JBACZVJFSA-N 444.620 4.492 10 10 IICE O=C(CCCc1ccccc1)NCCNC(=O)N(Cc1ccccc1O)C1CCCCC1 1478855907 AZHOTRLUJGRMGJ-UHFFFAOYSA-N 437.584 4.376 10 10 IICE CC[C@H](C)c1nnc(N2CCS[C@@H](C(C)C)C2)n1Cc1ccc(N2CCOCC2)cc1 1513094549 UCDKSESKQSYGTM-SIKLNZKXSA-N 443.661 4.254 10 10 IICE COc1ccc(N2CCN(c3nnc([C@@H]4CCCCO4)n3CCC(C)C)CC2)cc1F 1518309652 GSGKTNBGXURFHV-NRFANRHFSA-N 431.556 4.040 10 10 IICE Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)Cc2cc(C)n(-c3ccccc3)c2C)cc1 1520855902 OIYIPZDPYRFLDT-QHCPKHFHSA-N 433.577 4.485 10 10 IICE O=C(Nc1c(Cl)ccc2nonc12)c1ccc(Cn2cc(Br)cn2)s1 1525081272 PCOYBWUSCGDREC-UHFFFAOYSA-N 438.694 4.197 10 10 IICE CN(C)c1ccc(CNC(=O)C[C@@H]2c3ccccc3CN2C(=O)OC(C)(C)C)cc1F 1527014349 XTESYCJJJGLPCZ-OAQYLSRUSA-N 427.520 4.390 10 10 IICE COCCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCC[C@@H](OC)C1 1555467047 WDIFUZAXQOONON-JOCHJYFZSA-N 437.588 4.394 10 10 IICE CCOC(=O)c1csc([C@@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(N(C)C)cc2C)n1 1564945952 IQOZGTIYQJIYMB-UZLBHIALSA-N 444.601 4.172 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3ccnc(Oc4ccccc4)c3)C2)cc1 1564962891 PWCNLHGHCXHUKE-HXUWFJFHSA-N 432.524 4.208 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2)cnc1Br 1566154772 HRSUUGDDIYQLCA-CQSZACIVSA-N 440.288 4.153 10 10 IICE NC(=O)N=Nc1ccc(C(=O)Nc2ccnn2Cc2ccc(OC(F)(F)F)cc2)cc1 1567278248 GCUOJKCBXYRTLD-UHFFFAOYSA-N 432.362 4.245 10 10 IICE Cc1cc(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)c(C)n1-c1ccc(F)cc1 1567495896 UBVYWQAUNKQZKY-DEOSSOPVSA-N 435.543 4.120 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3csc(-c4c(F)cccc4F)n3)C2)cc1 1598363025 CHVWTJHPGVDVPU-AWEZNQCLSA-N 429.492 4.353 10 10 IICE COc1ccc2c(c1)c1c(n2CC(=O)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)CCCC1 1624453050 JCGCHDSKPFYSBQ-FQEVSTJZSA-N 446.469 4.397 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)[C@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)cc1 1628469339 XDFMJXOYMZYJJZ-FQEVSTJZSA-N 435.609 4.262 10 10 IICE Cc1cc(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c(C)n1-c1ccc(F)cc1 1631736602 IXNGUYCNQCFTJQ-QFIPXVFZSA-N 433.527 4.197 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)[C@H]1Cc2ccc(Br)cc2C(=O)O1 1634012801 XJJBYHGKEJTUBX-LJQANCHMSA-N 432.314 4.065 10 10 IICE COC[C@@H]1CC[C@H]([C@H]2COCCN2C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)O1 1635549810 RLMFKILLZCGFPU-ICDZXHCJSA-N 440.584 4.253 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2N1C(=O)OC(C)(C)C 1636058615 KBKWBYGKDGQXRK-BZSNNMDCSA-N 437.577 4.452 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2(C)C)c1 1639618533 ZNADPWWBXLKDNG-NHCUHLMSSA-N 439.556 4.328 10 10 IICE CCSCCSCC(=O)c1cc(C)n(-c2cc(C(=O)OC)cc(C(=O)OC)c2)c1C 1651911918 MUCXODLUCJCISA-UHFFFAOYSA-N 449.594 4.336 10 10 IICE CCc1ccc([C@@H](NC(=O)CN2CCOc3cc(N(C)C)ccc32)c2cccs2)cc1 1653144942 RKVFEMRYAMPABH-RUZDIDTESA-N 435.593 4.481 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](C)NC(=O)OC(C)(C)C 1682101866 VXJMHLFPRGTQBT-NNMXDRDESA-N 446.636 4.469 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCc4cccc(C(F)(F)F)c4C3)C2)cc1 1683504521 WCQZOCASMAIGOP-INIZCTEOSA-N 433.474 4.308 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCc4ccnc(N(C)C)c4C3)cc2Cl)C1 1686269803 ZLESASZYYSGBDV-KRWDZBQOSA-N 442.007 4.305 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)NCc1cccc(S(=O)(=O)C(F)(F)F)c1 1687877588 IZVFLNBDUFOERX-UHFFFAOYSA-N 444.475 4.198 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3ccccn3)nnc2N2CC[C@@H](OCC(C)C)C2)cc1 1728380143 OOHNGCWPTYSASP-HSZRJFAPSA-N 448.615 4.486 10 10 IICE CC(C)NC(=O)c1nnc(N(C)[C@H]2CCC[C@H](C)C2)n1CCCSc1nccs1 1743021876 MGVAVKFOEYITFQ-HOTGVXAUSA-N 436.651 4.070 10 10 IICE CC[C@@H](C)c1nnc(N2CCC[C@@H](C)CC2)n1Cc1ccc(N2CCOCC2)c(F)c1 1752742264 JIEBKHIBZNYLQC-RTBURBONSA-N 429.584 4.442 10 10 IICE CCN(CC)c1ccc(Cn2c([C@@H]3CCOC3)nnc2N2CCSC(C)(C)C2)cc1 1764939948 ZHIBUBBQCJAAQE-LJQANCHMSA-N 429.634 4.008 10 10 IICE CCCNC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(CCc2ccccc2)C1=O 1873164762 QYQXUWVFYSSZPC-UHFFFAOYSA-N 427.548 4.416 10 10 IICE C[C@](CC(=O)O)(NC(=O)OCc1ccccc1)c1cc(Cl)cc(Br)c1O 1951971840 WNIGZMQSMGJDGP-GOSISDBHSA-N 442.693 4.424 10 10 IICE O=C(O)[C@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@@H]1c1cc(O)ccc1O 1952824081 ROIUWVQTTVQKPC-RDPSFJRHSA-N 445.471 4.495 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@H](C2(NCc3cccc(Br)c3O)CC2)C1 2097027948 RNRONMMZSKLIPK-HNNXBMFYSA-N 425.367 4.424 10 10 IICE O=C(OCc1ccccc1)N1CCC2(CC1)C[C@H](NCc1cccc(Cl)c1O)CO2 2160178401 AQZNRAATUXEHQT-IBGZPJMESA-N 430.932 4.096 10 10 IICE CC(C)(C)OC(=O)N1CCN(c2ccc([C@@H](O)c3ccnn3Cc3ccccc3)cc2)CC1 2270556842 LPIWPPGAFHAIMA-XMMPIXPASA-N 448.567 4.070 10 10 IICE CCc1cc([N+](=O)[O-])ccc1-c1ccc(C=C2C(=O)NC(=O)N(c3cccc(C)c3)C2=O)o1 2313553262 ZFUQJACUUMKMRK-UHFFFAOYSA-N 445.431 4.392 10 10 IICE CCCOC(=O)[C@H](c1ccccc1)N1C(=O)C(=Cc2ccc(C(=O)O)cc2)SC1=S 2314767743 HUKZTCOSDCZCQB-SFHVURJKSA-N 441.530 4.281 10 10 IICE CN1CCN(c2ccc(N3C(=O)C(=Cc4ccc(F)c(F)c4)SC3=S)cc2)CC1 2321684625 AEQXJQFFTVDROC-UHFFFAOYSA-N 431.533 4.122 10 10 IICE Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C/c3cc(Cl)cc(Br)c3O)C2=O)c1 59426663 HJEGDPLYPFWVOM-AUWJEWJLSA-N 449.688 4.091 10 10 IICE COc1ccc(C2=NC3(CCN(C)CC3)N[C@@H](c3cc(Br)ccc3O)C2)cc1 65298100 QYKKQVXOEFLKML-HXUWFJFHSA-N 444.373 4.109 10 10 IICE biogenic CCS(=O)(=O)c1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(F)cc3)c2C)cc1 746598104 ABYISQYFXOPIRF-UHFFFAOYSA-N 443.496 4.067 10 10 IICE Cc1ccc([C@H]2CCN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)cc1 753206424 HRJLUUPNQWPGOD-KRWDZBQOSA-N 442.562 4.193 10 10 IICE Cc1cc(-c2nnc(N3CCO[C@H](C4CC4)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802678976 GLVRPBABJPFSFW-UPVQGACJSA-N 447.583 4.147 10 10 IICE O=C(NCc1cc(Br)ccc1O)NCc1ccncc1OCc1ccccc1 805764932 HQXZNBFQNSSZPI-UHFFFAOYSA-N 442.313 4.128 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1nnc(Cc2ccc(F)cc2)s1 806259253 QXSRSNVXHYPUCT-UHFFFAOYSA-N 437.294 4.058 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1 808094781 DMLUHGHHERSETR-UHFFFAOYSA-N 425.510 4.117 10 10 IICE COc1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c(OC)c1 1124243642 BNMVNNJODWKTDE-WQRHYEAKSA-N 446.525 4.073 10 10 IICE O=C(CCCN1C(=O)/C(=C\c2cccs2)SC1=S)N1CCC(F)(C2CC2)CC1 1134691360 OYHJKCQEJGWOJC-DTQAZKPQSA-N 438.615 4.470 10 10 IICE COc1cc(CCC(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)cc(OC)c1O 1136185271 TZCBJBKWXBPNBA-UHFFFAOYSA-N 438.524 4.230 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NCCCCN2C[C@@H](C)C[C@H](C)C2)C1 1136255381 RXICMRXYJHDLQE-VXKWHMMOSA-N 438.660 4.282 10 10 IICE COc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(C)c(-n2c(C)cc(C=O)c2C)c1 1136332845 DOKPHEPUKKOGQH-UHFFFAOYSA-N 433.508 4.178 10 10 IICE Cc1cc(C(=O)N(C)Cc2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)c(C)n1-c1ccccn1 1144312094 BWQYKPDGDHFNBD-OYRHEFFESA-N 446.595 4.371 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2cnn3c(OC)cccc23)cc1 1144711591 PIZHUBPMNDJDAU-UHFFFAOYSA-N 430.508 4.265 10 10 IICE CCC(CC)[C@H](NC(=O)/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1)c1ccccc1 1147517089 CLFKBXFUMRZXIC-VHRAYMLOSA-N 449.595 4.194 10 10 IICE COc1ccc(-n2c(C)cc(C(=O)N[C@H]3CCCN(c4ccc(C)cc4)C3=O)c2C)cc1 1148223941 HOQMJEAXZPTJCW-DEOSSOPVSA-N 431.536 4.337 10 10 IICE Cc1cc(C(=O)NC2([C@H]3CCCCO3)CCC2)c(C)n1-c1ccc(Br)cn1 1152879169 KPHSBNVLQNNNME-GOSISDBHSA-N 432.362 4.473 10 10 IICE CCO[C@@H]1C[C@H](N(C)C(=O)NC[C@H]2CCN(c3ccc(OC)cc3)C2)C12CCCCC2 1230301188 TYSMNPWQKHBGDA-WTIAFYNJSA-N 429.605 4.291 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)NC[C@H](Cc2ccccc2)c2ccccn2)cc1 1251639441 BYZSVEZMRKALTQ-QFIPXVFZSA-N 432.568 4.194 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)CCc3c(Cl)cccc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 1264689481 VXLWFAGIKKHINF-GASCZTMLSA-N 449.910 4.250 10 10 IICE COc1cc(C2(C(=O)N[C@H]3CCCN(c4ccc(OC(F)F)cc4)C3)CC2)ccc1C 1265564803 WBLYCFQGXRTBJT-SFHVURJKSA-N 430.495 4.422 10 10 IICE Cc1ccc(CN(C)c2nnc(-c3cccn3C)n2CCCSc2nccs2)o1 1289641904 POQBTMZNXDLSPN-UHFFFAOYSA-N 428.587 4.460 10 10 IICE CC[C@H](C)CN(CC)c1nnc(-c2cccnc2)n1Cc1ccc(N2CCOCC2)cc1 1291736393 HJHZEHZELHLQSK-FQEVSTJZSA-N 434.588 4.097 10 10 IICE O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1c[nH]nc1-c1c(F)cccc1F 1294162122 XPFRSVIBAWTKBY-ZDUSSCGKSA-N 448.420 4.355 10 10 IICE Cc1cc(C(=O)NCc2cc(F)cnc2Cl)c(C)n1-c1ccc(Br)cn1 1298682437 VWGQNWFSGMEMLM-UHFFFAOYSA-N 437.700 4.369 10 10 IICE CC(C)(C)OC(=O)NC[C@@H](C(=O)NCc1ccc2cccnc2c1O)c1ccc(F)cc1 1299724724 HZDBYWNMZKPEQE-LJQANCHMSA-N 439.487 4.004 10 10 IICE COC[C@@H]1CCCN(c2nnc(-c3ccccc3)n2CCCSc2nccs2)C1 1301263811 NKBJTMNZQKOKSA-QGZVFWFLSA-N 429.615 4.447 10 10 IICE CN(C)c1ccc(CNC(=O)CNC2(c3cc(C(F)(F)F)ccc3Cl)CC2)cc1 1307744023 GZKRLDOTQZRGDY-UHFFFAOYSA-N 425.882 4.320 10 10 IICE CC[C@](C)(NCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1ccc(F)cc1 1307992194 XEOQQZVOWUKTBC-SANMLTNESA-N 430.479 4.455 10 10 IICE CC(C)N1C(=O)C[C@H](NC(=O)N[C@@H](C)c2ccccc2O)[C@@H]1c1ccc(Cl)c(F)c1 1312364905 JRPAZZGNZBBDNG-FPSMJMQUSA-N 433.911 4.296 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N[C@H](c3nccn3C)C(F)(F)F)cc2Cl)C1 1312590607 MSRFUQBLVIHALU-SUMWQHHRSA-N 443.901 4.413 10 10 IICE CN(CCOC(C)(C)C)c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1314880377 HUXLEAJNDOGBQD-OAHLLOKOSA-N 425.624 4.020 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)c3cccc(OC(F)(F)F)c3)cc2F)C[C@@H](C)O1 1354657141 JWMOPBONJNEPLD-ZIAGYGMSSA-N 426.410 4.268 10 10 IICE CC(C)(C)c1ncc(NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)cn1 1434895433 GKASJINTVCLTNZ-MHWRWJLKSA-N 444.557 4.143 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1ccc(NCc2ccsc2)cc1 1444875069 YBZXEFSGKCRVSW-UHFFFAOYSA-N 439.556 4.390 10 10 IICE Cc1cc(C(=O)N2CCC[C@@H](C)[C@H]2CNC(=O)OC(C)(C)C)c(C)n1-c1ccccn1 1445158656 OONHPMKZFUJJLX-OXQOHEQNSA-N 426.561 4.255 10 10 IICE CCC(CC)(NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccc(Cl)cc1 1459662362 FOFFGIVVOXUABO-HSZRJFAPSA-N 446.035 4.137 10 10 IICE COc1ccc(N2CCN([C@H](C)C(=O)N[C@@H](C)c3ccc4ccccc4c3)CC2)cc1F 1459745904 BJDOGXCSWGNXLD-RBUKOAKNSA-N 435.543 4.375 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc(F)ccc1I 1460979103 AQXOEODXEMEMJA-ZDUSSCGKSA-N 440.300 4.166 10 10 IICE CC(C)(C)c1nc(CN2CCN(C(=O)c3cc4cc(O)c(O)cc4s3)CC2)cs1 1464518980 CDBHCRMCWZTAIG-UHFFFAOYSA-N 431.583 4.025 10 10 IICE COC(=O)Nc1ccc(C(=O)N(Cc2ccc(N(C)C)cc2)C[C@@H]2CCCO2)c(Cl)c1 1464605320 OHZPEJIHYPFDJF-IBGZPJMESA-N 445.947 4.406 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)NCc3ccncc3OCCC(C)(C)C)C2)cc1 1478763217 FYFMKDFTBKEMJX-LJQANCHMSA-N 440.588 4.231 10 10 IICE CC1CCN(c2ccc(Cn3c(C(C)C)nnc3N(C)CCc3cnccn3)cc2)CC1 1493872359 CWFVJHIMCPRGLU-UHFFFAOYSA-N 433.604 4.155 10 10 IICE CCN1C[C@@H](C)N(c2nnc(CC(C)(C)C)n2Cc2ccc(N(C)C)cc2C)C[C@@H]1C 1502257549 MBZSSKVSGXQFCK-VQTJNVASSA-N 426.653 4.208 10 10 IICE CC(C)OC1CCN(c2nnc([C@H]3CCCO3)n2CCCSc2nccs2)CC1 1509840080 XRBFUFDEBMJLGI-QGZVFWFLSA-N 437.635 4.162 10 10 IICE Cc1ncc(CN(C)c2nnc(-c3cccn3C)n2CCCSc2nccs2)s1 1511583950 LEDZGSFLTBJCMH-UHFFFAOYSA-N 445.643 4.324 10 10 IICE COCCc1ccc(OCCCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1 1525595313 ZVAZNRVIUZMUEX-UHFFFAOYSA-N 443.499 4.449 10 10 IICE O=C(NCc1cc(F)c(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1C(F)(F)F 1528262037 UGOYUWAOQHXDMS-UHFFFAOYSA-N 434.792 4.404 10 10 IICE COc1ccc(N2CCN(C(=O)/C=C(\C)c3ccccc3C(F)(F)F)CC2)c(OC)c1 1530968524 QOVBPIBAMOQDNX-JQIJEIRASA-N 434.458 4.475 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3cc(C(F)(F)F)ccc3Cl)c2)CC1 1538714298 FYCOAFBYPSUMOO-UHFFFAOYSA-N 425.838 4.280 10 10 IICE Cc1cc(C(=O)N2CCN(C(=O)N3CCCCC3)CC2)c(C)n1-c1ccc(Cl)cc1 1540669711 FISMMGSFXSQQBX-UHFFFAOYSA-N 428.964 4.111 10 10 IICE CO[C@H]1CCN(C(=O)CCCN2C(=O)/C(=C/c3cccs3)SC2=S)CC1(C)C 1543807837 JFPYACJCEISASV-IRVMHKCDSA-N 438.640 4.003 10 10 IICE CCc1nnc(N(C)Cc2ncc(Cl)n2C)n1Cc1ccc(N2CCC(C)CC2)cc1 1546423559 JQSHYAAJVZAYIH-UHFFFAOYSA-N 442.011 4.148 10 10 IICE Cc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)NCc1cc(Cl)ccc1O 1557385665 HFMRUYNBWJVWPP-UHFFFAOYSA-N 448.903 4.224 10 10 IICE C[C@@H](NC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)c1ccccc1O 1557967249 YDHSPOJVENGZGE-CYBMUJFWSA-N 435.480 4.010 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)C1CC(OCc2ccccc2)C1 1568378689 KAFWEUWWYVYXSX-UHFFFAOYSA-N 438.568 4.370 10 10 IICE CCCc1c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)cnn1-c1ccc(F)cc1 1586061952 YMMAIBFLRKWOGI-XMMPIXPASA-N 437.563 4.063 10 10 IICE CC(C)Cc1nnc(N(C)CCOC(C)(C)C)n1Cc1ccc(N2CCSCC2)cc1 1603355350 LCXJDHYZBNAXRN-UHFFFAOYSA-N 445.677 4.329 10 10 IICE CCc1nnc(N2CCCN(c3ccc(OC)cc3)CC2)n1CCO[C@H]1CCCC[C@@H]1C 1614012358 QZCSJEROFYYPCS-REWPJTCUSA-N 441.620 4.161 10 10 IICE CC1CCN(c2ccc(CNC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4F)n3)cc2)CC1 1616693929 BRKVCVIIBJKPPY-UHFFFAOYSA-N 437.475 4.086 10 10 IICE Cc1ccc(OCCNC(=O)c2cc(C)n(-c3ccc(Br)cn3)c2C)cc1 1624993580 LPMQBEJLJAITBN-UHFFFAOYSA-N 428.330 4.369 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 1628565469 OHFWKJXKXXVUPR-OAQYLSRUSA-N 443.547 4.348 10 10 IICE Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(I)cc1Cl 1632681956 YFTSMVBPAOCSJR-SNVBAGLBSA-N 445.684 4.025 10 10 IICE Cc1cc(C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c(C)n1-c1ccc(Br)cc1 1632752524 FPRXPZCPJIAYLQ-HOCLYGCPSA-N 446.389 4.376 10 10 IICE CCN(CC)c1ccc(CNC(=O)CN(C)c2ccc(C(F)(F)F)cc2C=O)cc1F 1633259561 RRXAKTOGYCHKDK-UHFFFAOYSA-N 439.453 4.256 10 10 IICE CC(C)(C)OC(=O)[C@@H]1c2ccccc2CCN1C(=O)c1cc2cc(O)c(O)cc2s1 1633389332 VZBZVAZSTAXVQD-FQEVSTJZSA-N 425.506 4.394 10 10 IICE O=C(NCc1ccc2cccnc2c1O)c1cc(Br)sc1Br 1639621911 ZPWLULVPOYYBBI-UHFFFAOYSA-N 442.132 4.457 10 10 IICE CC(C)(C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1cccc(Br)c1O 1640084239 OQFWELDEZYPOMR-GOSISDBHSA-N 449.345 4.112 10 10 IICE CC[C@H](NCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)c1cc(F)ccc1OC 1644586558 OKBBPISGRKHYPP-FQEVSTJZSA-N 446.478 4.289 10 10 IICE CCOC(=O)c1cnn2c(O)cc(CN(CC)[C@@H](C)c3cccc(C(F)(F)F)c3)nc12 1653360803 VJTZRELGLXIVKY-ZDUSSCGKSA-N 436.434 4.214 10 10 IICE CCN(CC)c1ccc(CN(C)C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(C(=O)OC(C)(C)C)C3)cc1 1675779967 IGVCXBQQDGXPPR-VWPQPMDRSA-N 444.620 4.462 10 10 IICE C[C@H]1CN(Cc2ccc(CN(C)C(=O)N[C@H](C)c3ccc(N(C)C)cc3)cc2)C[C@@H](C)O1 1681550874 BAKZQGGWSWTTNT-QHAWAJNXSA-N 438.616 4.264 10 10 IICE Cc1ccc(O)c(CNC(=O)NCc2cc(Br)ccc2Br)c1 1681753411 RXZLRWVUQDKXFM-UHFFFAOYSA-N 428.124 4.225 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCOC[C@@H]3C[C@@H](O)c3ccccc3)c2C)c1 1684478903 MEWRCZIRWRVJEC-IZZNHLLZSA-N 447.579 4.437 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCC(CC#N)CC1 1707305889 PPUBPAJPPFUDIX-UHFFFAOYSA-N 434.613 4.483 10 10 IICE Cc1cc(-c2nnc(N3C[C@H](C)[C@@H](C)C3)n2CCCC(=O)N(C)C)c(C)n1-c1ccccc1 1742120215 WOBDCVABUSYTKY-OALUTQOASA-N 448.615 4.313 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)C)n3Cc3c(C)coc3C)CC2)cc1 1748849443 QIRDRXJYGIOIIO-UHFFFAOYSA-N 437.588 4.460 10 10 IICE COc1ccc(N2CCCN(c3nnc(Cc4cccnc4)n3CCC=C(C)C)CC2)cc1 1748849669 UOMQOQJPNPAHBB-UHFFFAOYSA-N 446.599 4.346 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(N(C)CC(C)(C)C)nnc1[C@]1(OC(C)C)CCOC1 1751432856 OHHWDXJSYVZIQI-VWLOTQADSA-N 443.636 4.224 10 10 IICE CC(C)CC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)n1 1860549263 XQBSTBKFAXVCSW-UHFFFAOYSA-N 427.460 4.094 10 10 IICE O=C(O)c1ccc(/C=C2\C(=O)N(c3ccc(Br)cc3)N=C2C(F)(F)F)cc1 1865675735 XLGNWXDMWMZIRB-ZROIWOOFSA-N 439.187 4.496 10 10 IICE CCCCCCOc1cn(CC)c(CN2CCN(c3ccc(OC)cc3)CC2)cc1=O 1870673892 AKWSGMWQMWDUAU-UHFFFAOYSA-N 427.589 4.158 10 10 IICE CNC(=O)COc1cn(CCC(C)C)c(CNc2ccc(Nc3ccccc3)cc2)cc1=O 1871016310 ASBIJFGZCISGMD-UHFFFAOYSA-N 448.567 4.375 10 10 IICE COc1ccc(N2CCN(C(=O)c3ccc(COc4cccc(OC)c4)cc3)CC2)cc1 1872871030 DYPVATAQABWCNC-UHFFFAOYSA-N 432.520 4.245 10 10 IICE CN[C@@H]1C(=O)Nc2cc(N(Cc3ccccc3)C(C)(C)COC)c(Br)cc21 1915488535 XUKIZBMMHFJSBF-IBGZPJMESA-N 432.362 4.093 10 10 IICE CCc1nn([C@H](c2cc(C)c(C)cc2O)C(C)(C)C)c(I)c1CN 2079953763 YTOSHXYKTBJTSY-QGZVFWFLSA-N 441.357 4.467 10 10 IICE CN[C@@H]1C(=O)Nc2cc(N(Cc3ccccc3)CC(F)(F)F)c(Br)cc21 2095861385 GQLLPVQWNDGDKG-INIZCTEOSA-N 428.252 4.231 10 10 IICE COc1ccc(Br)c(CNCC[C@H](C)CCNC(=O)OC(C)(C)C)c1O 2268698237 JNGCERAKZSXZNP-ZDUSSCGKSA-N 431.371 4.194 10 10 IICE COc1cc(C=C2SC(=S)N(CC(=O)O)C2=O)ccc1OCc1ccccc1Cl 2293026466 YQJKLHKSEXGWOT-UHFFFAOYSA-N 449.937 4.213 10 10 IICE O=C1C(=Cc2cccs2)SC(=S)N1CC(=O)N1CCCC[C@H]1c1cccnc1 2296557183 WHDBAOTXDSVWFQ-INIZCTEOSA-N 429.592 4.098 10 10 IICE CC(=Cc1ccccc1)C=C1SC(=S)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C1=O 2296808139 WSGKQVVMELCKIC-UHFFFAOYSA-N 439.518 4.381 10 10 IICE COc1ccc(CN2C(=O)C(=Cc3cc(OC)c(OC)cc3[N+](=O)[O-])SC2=S)cc1 2297343825 FHHHQJOOTQUNHE-UHFFFAOYSA-N 446.506 4.022 10 10 IICE COc1ccccc1CN1C(=O)C(=Cc2cc(OC)c(OC)c(OC)c2)SC1=S 2323759237 ATQQXLHHOXOTHB-UHFFFAOYSA-N 431.535 4.122 10 10 IICE CCOC(=O)c1c(NC(=O)CCC(=O)OCCc2ccccc2)sc2c1CCCC2 14010597 OYPWWWYRAPRVSO-UHFFFAOYSA-N 429.538 4.308 10 10 IICE Cc1cc(C)c2c(-n3cccc3)nn(CCCC(=O)NCc3ccc(N(C)C)cc3)c2n1 15735988 TUEFGWAVWCIAMA-UHFFFAOYSA-N 430.556 4.001 10 10 IICE CCOc1ccc(/C=C2/SC(=S)N(CCC(=O)N(C)Cc3ccccc3)C2=O)cc1 34895065 DPNCGSYSIUCYJG-HMMYKYKNSA-N 440.590 4.335 10 10 IICE FC(F)(F)c1cccc(CN2CCC(NCc3ccc(N4CCOCC4)cc3)CC2)c1 237743739 ZJSDUNWAXVWSAQ-UHFFFAOYSA-N 433.518 4.296 10 10 IICE CCOC(=O)c1cccc(-n2c(C)cc(C=c3sc4nc5ccccc5n4c3=O)c2C)c1 254701763 TVBNMVOPPHSHKS-UHFFFAOYSA-N 443.528 4.041 10 10 IICE Cc1cc(O)c([C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)c(O)c1 687746979 WEGJWXTVSVCQMB-HXUWFJFHSA-N 433.460 4.461 10 10 IICE COc1ccccc1C(=O)N1[C@H](C(=O)NCc2ccc(N(C)C)cc2C)C[C@@H]2CCCC[C@H]21 734401915 GKTLDGZUXFJUFH-IEXUWNMDSA-N 449.595 4.159 10 10 IICE CN(C)c1ccc(CNc2nc(NCc3ccc(N(C)C)cc3)c([N+](=O)[O-])s2)cc1 735486969 NDUBCBMHLJCJST-UHFFFAOYSA-N 426.546 4.408 10 10 IICE Cc1cc(CCNC(=O)C(=O)Nc2ccc(F)cc2OC(F)F)c(C)n1-c1ccccc1 743882460 XJSVEWBGRHNTJQ-UHFFFAOYSA-N 445.441 4.132 10 10 IICE O=C(NCc1cc(O)nc2ccccc12)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 754372200 CTHCKNFRJLHMCU-MRXNPFEDSA-N 442.466 4.010 10 10 IICE COc1cc(N2CCN(C(=O)c3ccccc3Cc3ccccc3)CC2)cc(OC)c1OC 759220945 KZFAPMXRBZROFF-UHFFFAOYSA-N 446.547 4.266 10 10 IICE C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C)c1ccc(N2CCOCC2)cc1Cl 762642235 KYCIFXOESDTJGZ-WWMYMODYSA-N 438.012 4.473 10 10 IICE Cc1cc(C(=O)N[C@@H](C)Cn2ncc3ccccc3c2=O)c(C)n1-c1cccc(Cl)c1 765249683 NSZFFRQSTCCZRA-HNNXBMFYSA-N 434.927 4.276 10 10 IICE COc1ccc(Cn2nc(C)c(CN3CCCN(c4ccc(OC)cc4)CC3)c2C)cc1 768511312 YIHLFEPPINRGNL-UHFFFAOYSA-N 434.584 4.278 10 10 IICE Cc1ccc(OCc2nc(CC(=O)NCc3cc(Br)ccc3O)cs2)cc1 804733746 LZPNEZSZOCDZGA-UHFFFAOYSA-N 447.354 4.358 10 10 IICE Cc1cc2c(n1-c1cccc(C(F)(F)F)c1)CCC[C@@H]2NC(=O)[C@@H]1CCNC(=O)CC1 815042092 GYCRFQPPJBDJPY-KXBFYZLASA-N 433.474 4.214 10 10 IICE COc1ccc([C@H](CC(=O)NCCc2cc(C)n(-c3ccccc3)c2C)NC(C)=O)cc1 822093807 OVJFXALWCALSSV-VWLOTQADSA-N 433.552 4.029 10 10 IICE Cc1cc(CC(=O)Oc2ccc(NC(=O)c3cnn(C)c3)cc2)c(C)n1-c1ccccc1 1125948737 RCGAURPKZVEKGT-UHFFFAOYSA-N 428.492 4.228 10 10 IICE Cc1cc(C(=O)N2CCS(=O)(=O)C3(CCCCC3)C2)c(C)n1-c1cccc(Cl)c1 1137491752 FMCCXAKAYKOXNS-UHFFFAOYSA-N 434.989 4.321 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1 1137816523 JKEVVHGQEDBGKX-SFHVURJKSA-N 447.491 4.210 10 10 IICE Cc1ccccc1NS(=O)(=O)c1cc(C(=O)NCc2ccccc2O)ccc1Cl 1150535484 ABULDESMXFFTRD-UHFFFAOYSA-N 430.913 4.085 10 10 IICE CCOC(=O)[C@]1(Cc2ccccc2)CCCN1C(=O)c1cc(C)n(-c2ccccn2)c1C 1154177343 GUWDYFNWYQEWGM-AREMUKBSSA-N 431.536 4.270 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3CCCN(Cc4cccnc4)C3)cc2Cl)C1 1155726272 FGCWZIMHRXMSDK-UGKGYDQZSA-N 441.019 4.500 10 10 IICE C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NCc2c(O)ccc3ccccc23)cc1 1179029793 SVQXGHANMANKMT-KRWDZBQOSA-N 438.549 4.039 10 10 IICE CSc1ncc(I)c(N(C)Cc2ccc(N3CCCC3)cc2)n1 1184711191 RCUWVWKFMDBMBO-UHFFFAOYSA-N 440.354 4.040 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCN(c4ccccn4)CC3)cc2Cl)C1 1227207242 FPBQFWAMLQBVBL-SFHVURJKSA-N 427.980 4.003 10 10 IICE C[C@@H]1COCCN1c1nnc(CCCc2ccccc2)n1CCCSc1nccs1 1291306063 REXITFJTNJKBJM-GOSISDBHSA-N 443.642 4.317 10 10 IICE Cc1cc(CC(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)c(C)n1-c1ccc(Cl)cc1 1295283307 ZUWGHWKTMUBARV-QFIPXVFZSA-N 438.959 4.288 10 10 IICE CCN(CC)c1ccc(Cn2c(CC3CCCC3)nnc2N2CC[C@@H](C)[C@@H](O)C2)cc1 1295420058 VTMNTTBGOSDQGR-XXBNENTESA-N 425.621 4.112 10 10 IICE CO[C@H](C)Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CCS[C@@H](C)C1 1299538088 IFYHHKVFIGYKSR-MSOLQXFVSA-N 425.602 4.329 10 10 IICE COc1c(C)cccc1CNC(=O)c1cc(C)n(-c2ccc(Br)cn2)c1C 1300116059 JGWJUGWHHQWGQN-UHFFFAOYSA-N 428.330 4.499 10 10 IICE Cc1ccc(C(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1-n1c(C)cc(C=O)c1C 1303748697 SXBUZNSGALRFAY-NRFANRHFSA-N 439.556 4.344 10 10 IICE CN(Cc1ccc(N2CCCC2)cc1)C(=O)c1cc(F)ccc1I 1352614619 HMKJDSYHYLVAOK-UHFFFAOYSA-N 438.284 4.303 10 10 IICE CCOC(=O)c1c(NC(=O)CCSCC(=O)OC)sc(C)c1-c1ccc(C)cc1 1353525662 DKLPZLPTTARWOC-UHFFFAOYSA-N 435.567 4.443 10 10 IICE Cc1ccc(-n2cnnc2SCC(=O)NCc2cc(C)n(-c3ccccc3)c2C)cc1 1438296786 DMYFXABRSZDJCV-UHFFFAOYSA-N 431.565 4.392 10 10 IICE CC[C@@H](C(=O)N(CC)Cc1cc(Br)ccc1O)N(C)C(=O)OC(C)(C)C 1445653802 IWJGJVYWCZYQQX-HNNXBMFYSA-N 429.355 4.149 10 10 IICE CCS(=O)(=O)Nc1ccc(NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1C 1464346052 ACTSOACIMQKTGT-UHFFFAOYSA-N 439.537 4.229 10 10 IICE CCN1CCN(c2ccc(CNC(=O)Cc3nc(C4CCCCC4)cs3)cc2F)CC1 1464946281 RLIUHAHRALYOKT-UHFFFAOYSA-N 444.620 4.331 10 10 IICE Cc1cc(C(=O)N2CC[C@H](Cc3nccs3)C2)c(C)n1-c1ccc(Br)cn1 1472315352 YADMEMYQKZHXJK-OAHLLOKOSA-N 445.386 4.413 10 10 IICE COc1ccc(C[C@@H](C)NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)cc1OC 1523860512 GKDCFLCTGXJQAA-LJQANCHMSA-N 449.595 4.172 10 10 IICE O=C(CSCc1ccc(Cl)cc1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1524851545 XQINPCXWTRMHRF-UHFFFAOYSA-N 426.916 4.004 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)C(=O)N3c4ccccc4C[C@@H]3C)ccc21 1526200170 LDIPFIKPCHTWMP-FUHWJXTLSA-N 433.552 4.001 10 10 IICE CC(=O)[C@@H]1CC(C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)=NN1c1ccccc1 1526364360 XQEFJXTWHSVJKE-VWLOTQADSA-N 444.535 4.098 10 10 IICE Cc1nc(SC2CCCC2)sc1CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 1527482285 XIRNKTHKXDUGMY-UHFFFAOYSA-N 449.617 4.321 10 10 IICE COc1ccc(N2CCCN(C(=O)c3ccc(O[C@H](C)C(F)(F)F)nc3C)CC2)cc1 1534519219 RGRIVBGSXQWYBF-MRXNPFEDSA-N 437.462 4.081 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)Cc2ccc(Cl)cc2Br)cc1 1538159725 DJNMTYARUHKIOD-UHFFFAOYSA-N 425.754 4.248 10 10 IICE CC(C)c1nnc(N(C)Cc2ccccc2O)n1Cc1ccc(OCC(F)(F)F)nc1 1541326459 LDDTUHSGJUYWBB-UHFFFAOYSA-N 435.450 4.128 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(Cc2ccsc2)nnc1N1CCO[C@@H](C(C)C)C1 1542228336 GYRTYDUCHUTUIL-JOCHJYFZSA-N 439.629 4.214 10 10 IICE COc1ccc(N2CCN(C[C@@H](O)CN3CCCCC[C@@H]3c3cccc(C)c3)CC2)cc1 1559553542 FYDMLIKHDINBKG-XNMGPUDCSA-N 437.628 4.104 10 10 IICE COC1CCN(c2ccc(CN3CCN(Cc4c(F)cccc4Cl)CC3)cc2)CC1 1559742436 MPPUOHNIMZYKEW-UHFFFAOYSA-N 431.983 4.412 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc(-c3ccc(Br)cc3)no2)cc1 1586649568 OICOVYDVZSMPAJ-UHFFFAOYSA-N 444.329 4.321 10 10 IICE CC(C)(C)OC(=O)N1CCCC(C)(C)[C@@H]1C(=O)NCc1ccc(N2CCSCC2)cc1 1596359445 SKBHZMFWDKMCOL-FQEVSTJZSA-N 447.645 4.282 10 10 IICE CCOc1ccc2ccccc2c1C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1596683467 CCTUWOGSKMFXTO-UHFFFAOYSA-N 426.463 4.283 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC2CCCC2)n1CCC(=O)NC1CCCCC1 1617941402 PXLFGIWIGGRMAX-UHFFFAOYSA-N 439.604 4.192 10 10 IICE Cc1ccc(C)c(C(=O)CCC(=O)N[C@@H]2CCCN(Cc3cc(Cl)ccc3O)C2)c1 1622634815 JIQSGAIMZMGNHN-HXUWFJFHSA-N 428.960 4.406 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)c3ccc(OCc4ccccc4)nc3)cc2F)C[C@H](C)O1 1625090765 YAOJPPYTGAOMII-OALUTQOASA-N 449.526 4.343 10 10 IICE O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CN(Cc2ccccc2)CCC1(F)F 1627209291 BNGWFTVBCYBONS-QHCPKHFHSA-N 427.539 4.451 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)cc1 1630382763 YQPYXUQAHVIHNH-UHFFFAOYSA-N 433.508 4.496 10 10 IICE COC(=O)N1CCC([C@H](C)NC(=O)NCc2cc(C)n(-c3cccc(C)c3)c2C)CC1 1634430633 IWIMCEBFONMCSU-SFHVURJKSA-N 426.561 4.069 10 10 IICE COc1ccc(N(CCc2ccccc2)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1 1644865709 FDOXBNIPECIGDP-UHFFFAOYSA-N 435.480 4.300 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cc(OCc3ccccc3)ccc2O)N(C)C)cc1 1647080431 DUTZWYOMWGZUJY-XMMPIXPASA-N 433.552 4.070 10 10 IICE Cc1cc(C(=O)N[C@@H]2CCc3ncc(Br)n3C2)c(C)n1-c1ccc(Cl)cc1 1648684554 AMNNWHWPHXPILO-OAHLLOKOSA-N 447.764 4.451 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCCCC[C@@H](NC(=O)OC(C)(C)C)C1 1683425255 NEZPSZIUSQNJHK-TZIWHRDSSA-N 446.636 4.471 10 10 IICE C#C[C@H](C)N(C)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1C[C@@H]1CCC[C@H](O)C1 1705478514 CRDHPJQKYXOTJN-ZEYPLWLESA-N 431.584 4.362 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cnccn3)nnc2N(C)C[C@@H]2CC=CCC2)cc1 1710025865 PVVASLNQBSJCSP-HXUWFJFHSA-N 431.588 4.422 10 10 IICE COCCCn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC[C@H](C)[C@H](OC)C1 1712389957 KSUULAGOUKRJPD-FDDCHVKYSA-N 437.588 4.250 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2CC(C)(C)O[C@]3(CCOC3)C2)cc1 1746086065 ICLFQTQECBWSAB-RUZDIDTESA-N 441.620 4.070 10 10 IICE COc1ccc(N2CCCN(c3nnc(CC(C)(C)C)n3C[C@H]3CCSC3)CC2)cc1 1770257712 HBMSVEHSPVYKEI-LJQANCHMSA-N 443.661 4.345 10 10 IICE O=C(O)c1cc(N2C(=O)/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)ccc1O 1860085340 FLQJLPFGIQQSHP-MKMNVTDBSA-N 436.854 4.058 10 10 IICE CC[C@H](C)NC1=C(c2ccc(-n3c(C)ccc3C)cc2)C(=O)N(Cc2ccccn2)C1=O 1873168038 HFHDUMYNTPXXHD-KRWDZBQOSA-N 428.536 4.157 10 10 IICE CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCc3cc(Br)cc(F)c3O)C[C@H]2C1 2102638193 QLRJXCFEZWVGPU-AGGWBTHJSA-N 429.330 4.029 10 10 IICE CCN[C@H](c1ccccc1O)c1ccc(Br)cc1I 2142279955 WZXXBLYYHCDRKJ-HNNXBMFYSA-N 432.099 4.458 10 10 IICE CC(C)(C)OC(=O)N1CCC(NCc2c(O)cccc2Br)(C(F)F)CC1 2227498419 DOTVVEIGVNQMSC-UHFFFAOYSA-N 435.309 4.279 10 10 IICE CC[C@@H](Oc1ccc(C=C2SC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc1)C(=O)O 2314927547 HBJICPNKYQESTK-MRXNPFEDSA-N 443.502 4.033 10 10 IICE COc1ccc(CCN2C(=O)C(=Cc3c(C)nc4ccccn34)SC2=S)cc1OC 2323790477 JRUOZKNMBAIPIQ-UHFFFAOYSA-N 439.562 4.104 10 10 IICE Cc1ccc(CNCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C)c(O)c1Br 2352672700 TUOCOFLYOLPLTO-GDBMZVCRSA-N 427.383 4.446 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](CNC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380722842 RNGZESCOWZGWDR-HNNXBMFYSA-N 441.366 4.020 10 10 IICE Cc1ccc(CN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)C2(C)CC2)c(O)c1Br 2381129273 HVDRBAQJMBWJCE-INIZCTEOSA-N 441.366 4.115 10 10 IICE COC(=O)C1=CN(c2cccc(Cl)c2)c2cc(Br)ccc2S1(=O)=O 64979277 HMNXAEBAMRSQNM-UHFFFAOYSA-N 428.691 4.042 10 10 IICE CCCCCOc1ccc(/C=C2/SC(=S)N(CCC(=O)OCC)C2=O)cc1OC 206456588 GMZFAMXCKHINCS-NBVRZTHBSA-N 437.583 4.419 10 10 IICE Cc1cccc(C2=C(O)C(=O)N(c3ccc4c(c3)OCCO4)[C@@H]2c2ccc(O)c(O)c2)c1 526159719 AVJURZNHCWKPML-HSZRJFAPSA-N 431.444 4.235 10 10 IICE CCn1cc(-c2nn(C)cc2C(=O)N2C[C@@H](C)N(Cc3ccccc3)c3ccccc32)cn1 527091408 IRSYEZPMKFKEQY-LJQANCHMSA-N 440.551 4.359 10 10 IICE CCN(CC)c1ccc(CNC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)cc1F 731345288 LFWKVOCVBNXTMV-UHFFFAOYSA-N 435.499 4.493 10 10 IICE Cc1cc(CCNC(=O)N2CCC[C@@H](CNC(=O)C(C)(C)C)C2)c(C)n1-c1ccccc1 733038783 QGOLPHFSDJTWSP-NRFANRHFSA-N 438.616 4.221 10 10 IICE CCOc1ccc(-c2nc(NS(=O)(=O)c3ccc(CC(=O)OC)cc3)sc2C)cc1 733730693 DBKZUYTXYYKPOC-UHFFFAOYSA-N 446.550 4.034 10 10 IICE NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2ccc(N3CCCCC3)cc2)c1 746518074 LYZCOMSVOSWUDN-UHFFFAOYSA-N 442.563 4.421 10 10 IICE CC(=O)N1CCN(c2cccc(NC(=O)c3ccc(C(C)(C)C(F)(F)F)cc3)c2)CC1 764891509 HCPVMAVGJPSJNO-UHFFFAOYSA-N 433.474 4.447 10 10 IICE C[C@H](NC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccc(N2CCOCC2)cc1 788757125 UDJWEOWEMCEEOH-DJJJIMSYSA-N 425.426 4.168 10 10 IICE CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccc(F)cc1 792036788 YADAANZHZRKQBU-NRFANRHFSA-N 429.536 4.159 10 10 IICE COc1c(C)cc(C)cc1S(=O)(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1 800930001 AWBHPBSVHDHQJZ-UHFFFAOYSA-N 431.539 4.195 10 10 IICE Cc1cc(C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)c(C)n1-c1ccc(C(C)C)cc1 849165330 HTWSAQJNGFZHJP-KRWDZBQOSA-N 439.581 4.356 10 10 IICE C[C@H](CNC(=O)CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)c1ccccc1 1127837686 AFRISHXHBWTQPF-JPVKTXQWSA-N 428.554 4.337 10 10 IICE Cc1cc(C(=O)N(C)CCN2CCOC(C)(C)C2)c(C)n1-c1ccc(Br)cc1 1139733238 YPPGYTVMAMLFCH-UHFFFAOYSA-N 448.405 4.039 10 10 IICE Cc1cc([N+](=O)[O-])nn1Cc1cccc(C(=O)NCc2ccc(N3CCCCC3)cc2)c1 1162800119 AONQJUZPRKXECU-UHFFFAOYSA-N 433.512 4.068 10 10 IICE COc1ccc(N2CCN(Cc3csc(COc4ccc(C)cc4)n3)CC2)c(OC)c1 1175523954 RRZCLZPLAACVHZ-UHFFFAOYSA-N 439.581 4.370 10 10 IICE O=C(NCc1c(O)ccc2ccccc12)C1CCN(C(=O)c2ccc(Cl)s2)CC1 1179030084 ZMHQHRDLTDJNTC-UHFFFAOYSA-N 428.941 4.429 10 10 IICE COC1CCN(c2ccc(CN3CCC[C@H]3c3ncc(Br)cn3)cc2)CC1 1198010174 FGZVWMRNRQQCCQ-FQEVSTJZSA-N 431.378 4.191 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N3CCc4c(F)ccc(C(=O)OC)c4C3)ccc21 1279406083 JZZXTKTZVBYNTA-UHFFFAOYSA-N 438.499 4.029 10 10 IICE CC[C@H](C)c1nnc(N2CCC(OCC3CC3)CC2)n1Cc1ccc(N(C)C)c(F)c1 1291518659 OXFCOQOICFNVRW-KRWDZBQOSA-N 429.584 4.440 10 10 IICE Cc1cc(C(=O)NCCCCN2CCC[C@@H](C)C2)c(C)n1-c1ccc(Br)cn1 1291559080 MORLBNKUNMWKOW-MRXNPFEDSA-N 447.421 4.494 10 10 IICE CCN(CC)c1ccc(Cn2c(Cc3ccccn3)nnc2N2CCO[C@@](C)(CC)C2)cc1 1295420176 NLMXPQRMHJOJIX-SANMLTNESA-N 448.615 4.164 10 10 IICE CCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(C)n(-c2ccc(Br)cc2)c1C 1296740372 CECYOAOFIGLZBW-INIZCTEOSA-N 433.268 4.242 10 10 IICE Cc1cc(C)nc(Nc2ccc(O)c(C(=O)NCc3ccc(N4CCCCC4)cc3)c2)n1 1299788373 LLOZGTRSPDAFSS-UHFFFAOYSA-N 431.540 4.463 10 10 IICE CSC[C@@H]1CCCN1c1nnc([C@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1302699908 DTOUQSNWCBGEKH-FXAWDEMLSA-N 433.597 4.105 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1CCc1cc(C(F)(F)F)ccn1 1302846991 BMFXAEJIJWGHPO-UHFFFAOYSA-N 433.478 4.475 10 10 IICE CCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1Cc1csc([C@@H](C)OC)n1 1306078388 SGQQHYBSIGAFLZ-QGZVFWFLSA-N 440.617 4.289 10 10 IICE COc1cc(N(C)CCCc2cc(-c3ccc(F)cc3)n(C)n2)c([N+](=O)[O-])cc1OC 1306957864 FXHFVWOLQJWTFX-UHFFFAOYSA-N 428.464 4.221 10 10 IICE CCN(Cc1cc(Br)ccc1O)C(=O)NC[C@H](C(=O)OC(C)(C)C)C(C)C 1312926146 LMFOSPGNURAEEI-INIZCTEOSA-N 443.382 4.300 10 10 IICE CSC[C@H]1CCCN1c1nnc([C@H]2CCCO2)n1CCCSc1nccs1 1316441967 GUMASPIJJBNBIR-HUUCEWRRSA-N 425.649 4.100 10 10 IICE CCc1ccccc1N1C[C@H](C(=O)N(Cc2ccc(N(C)C)cc2)Cc2ccco2)CC1=O 1353487052 CSTNUTYNTYQOBC-JOCHJYFZSA-N 445.563 4.490 10 10 IICE CC(C)(C)c1ccc(NC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)nn1 1435268475 SKUAPKPICPISDU-QINSGFPZSA-N 444.557 4.143 10 10 IICE Cc1ccc(C(=O)NCc2ccc(Br)cn2)cc1-n1c(C)cc(C=O)c1C 1454896606 UJCPUDMQJNKODM-UHFFFAOYSA-N 426.314 4.303 10 10 IICE COc1cc(NC(=O)CN(C)C(=O)c2cc(C)n(-c3cc(C)cc(C)c3)c2C)cc(OC)c1 1468657100 NBMXMYUNRILIEO-UHFFFAOYSA-N 449.551 4.439 10 10 IICE CCOc1ccc(N2CCN(CC(=O)Nc3ccc(N=Nc4ccccc4)cc3)CC2)nn1 1473662977 IQIQBJOKTJYXKB-UHFFFAOYSA-N 445.527 4.051 10 10 IICE O=C(NCc1ccc(N2CCC(O)CC2)cc1)N(Cc1ccccc1O)C1CCCCC1 1479030072 CNOWOWZSHOKFQJ-UHFFFAOYSA-N 437.584 4.398 10 10 IICE Cc1cccc(-n2c(C)cc(CNC(=O)N3CCN(Cc4csc(C)n4)CC3)c2C)c1 1479099437 IKDKJPPYPYIWIU-UHFFFAOYSA-N 437.613 4.195 10 10 IICE Cc1noc([C@H]2CCCN(c3nnc(C(C)(C)C)n3Cc3ccc(N(C)C)cc3C)C2)n1 1493103909 UNBDGPFVODXULF-IBGZPJMESA-N 437.592 4.074 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cc(Br)c[nH]2)n1C[C@H]1CCC=CO1 1503486884 GJTIWMTUXUDGLD-MRXNPFEDSA-N 444.333 4.070 10 10 IICE CO[C@]1(C)CCCN(c2nnc(-c3cccc(C)n3)n2Cc2ccc(N(C)C)cc2C)CC1 1517883828 LDEWHPJCCXKDJQ-AREMUKBSSA-N 448.615 4.467 10 10 IICE Cc1csc([C@H](C)CNC(=O)CCN2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)n1 1521500933 IUENIMNCCSGLMQ-DZZSIBQASA-N 449.598 4.102 10 10 IICE CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC[S@](=O)CC(F)(F)F)cc1 1528439099 CSMZBEBBXAOLNY-LJAQVGFWSA-N 426.464 4.209 10 10 IICE CC[C@@H](Cc1cccc(Br)c1)C(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1 1531730119 QNQHCROLGATZGC-HKUYNNGSSA-N 431.374 4.422 10 10 IICE CC(=O)c1ccc(F)cc1NC(=O)CCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S 1536675744 YUVPENDSAWKBHR-VCHYOVAHSA-N 446.500 4.397 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)c3csc(COc4ccc(F)cc4)n3)C2)cc1 1537110660 ZZHYKJSQOFTVNG-MRXNPFEDSA-N 441.528 4.126 10 10 IICE Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)Cc1cc(C)n(-c2ccccc2)c1C 1537396442 BGEZYMYJNBUGEP-QHCPKHFHSA-N 433.577 4.485 10 10 IICE CN(C)c1ccc(CN(CC(F)(F)F)C(=O)[C@@H]2CCCn3cc(C(F)(F)F)nc32)cc1 1537497363 GBOCOQBKTUROSK-OAHLLOKOSA-N 448.411 4.436 10 10 IICE CN(c1ccc(CNC(=O)C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1)C1CCCCC1 1544245424 BOXLNPUGWMYVHO-JOCHJYFZSA-N 445.604 4.098 10 10 IICE CCC1(Cn2c(C(C)C)nnc2N2CCCN(c3ccc(OC)cc3)CC2)CCOCC1 1546123986 HREUWXLWSFLFIU-UHFFFAOYSA-N 441.620 4.334 10 10 IICE Cc1cc(C(=O)N2CCCN2C(=O)OC(C)(C)C)c(C)n1-c1ccc(Br)cn1 1556092161 SHGKWHAKCXQANT-UHFFFAOYSA-N 449.349 4.250 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)[C@H]3Cc4cc(F)ccc4NC3=O)cc2Cl)C1 1556369233 JILCPMPVLCKFCO-KBXCAEBGSA-N 429.923 4.143 10 10 IICE Cc1cc(C(=O)N[C@@H]2C[C@H](N(C)C)C23CCC3)c(C)n1-c1cccc(Br)c1 1557693388 GVXULLDCWXIWRP-UXHICEINSA-N 430.390 4.459 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)CCOc1ccc(Br)cc1 1564945315 NICJBOPYULCBBS-QGZVFWFLSA-N 448.405 4.475 10 10 IICE Cc1ccnc(-c2n[nH]c([C@H](C)NC(=O)NCCc3cc(C)n(-c4ccccc4)c3C)n2)c1 1565162745 YVCCMEYXJUVHEQ-SFHVURJKSA-N 443.555 4.186 10 10 IICE CN1CCN(c2ccc(CNC(=O)N3CCSC[C@@H]3c3ccc(Cl)cc3)cc2)CC1 1565271850 YMIYHQCLIWNAJH-JOCHJYFZSA-N 445.032 4.092 10 10 IICE C[C@H]1CCC[C@@H](C2CN(C(=O)c3cc(NS(=O)(=O)c4cccs4)ccc3O)C2)C1 1587787125 FFHXBCHNMIABDW-LSDHHAIUSA-N 434.583 4.153 10 10 IICE COC(=O)c1ccc2c(c1)CCN(C(=O)c1ccc(C)c(-n3c(C)cc(C=O)c3C)c1)C2 1593620136 ASBBTBVCHNQFCP-UHFFFAOYSA-N 430.504 4.200 10 10 IICE Cc1ncsc1CN(C)c1nnc([C@@H]2CCCCO2)n1Cc1ccc(N(C)C)c(F)c1 1611867412 FPJKRCSNLKEESW-IBGZPJMESA-N 444.580 4.174 10 10 IICE Cc1cc(N(C)C)ccc1CNC(=O)c1cc(Br)c(O)c(Br)c1 1617046640 FVLZSBDDUFRBHQ-UHFFFAOYSA-N 442.151 4.222 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NCCNc3ncccc3C(F)(F)F)ccc21 1626058031 QUPDSEWXGFUVJZ-UHFFFAOYSA-N 434.462 4.160 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3(C)C)ccc21 1627064657 ZIQHONINBQKIAK-SFTDATJTSA-N 443.588 4.326 10 10 IICE Cc1cc(C(=O)Nc2nc(C3(C)CC3)ns2)c(C)n1-c1ccc(Br)cn1 1629838201 SZXKTVACGHXIEM-UHFFFAOYSA-N 432.347 4.407 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N[C@H](C)C[C@@H](C)NC(=O)OC(C)(C)C)cc1 1630950595 IZMVSXZQBHTJRE-IAGOWNOFSA-N 441.572 4.257 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cccc3c2CN(C(=O)OC(C)(C)C)C3)cc1 1639814109 KMROMYWFCXZPCM-UHFFFAOYSA-N 439.556 4.154 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2cc3c(C)c(Br)ccc3[nH]2)cc1 1639814176 MZCLATOVLDGNGR-UHFFFAOYSA-N 430.346 4.456 10 10 IICE C[C@@H]1CN(c2ccc(CNC(=O)CN[C@@H](c3ccccc3)C3CCC3)cc2F)C[C@@H](C)O1 1644930820 VCQABFUCIFDHDA-UDCNLSRBSA-N 439.575 4.187 10 10 IICE CC(C)C[C@@H](NCC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)c1ccccc1 1653919480 ZWFDKKHAYXUQKT-JXALWOEJSA-N 441.591 4.433 10 10 IICE O=C(NCCCCc1ccc(Cl)s1)NCc1cc(F)c(N2CCOCC2)c(F)c1 1682475685 QVEGDWFUJVCYPC-UHFFFAOYSA-N 443.947 4.338 10 10 IICE CC(C)CCN1CCC(Cn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)CC1 1692369405 DFYQJYDSFAIQJC-UHFFFAOYSA-N 448.615 4.440 10 10 IICE Cc1nnc(N2CCO[C@@H](c3ccc(Cl)s3)C2)n1Cc1ccc(N(C)C)c(F)c1 1693517202 VYRYPDGNDHMAHM-QGZVFWFLSA-N 435.956 4.133 10 10 IICE C#CCN(CC)c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCCn1cccn1 1705606024 VUELRULRBBJGHW-UHFFFAOYSA-N 427.556 4.099 10 10 IICE Cc1cc(N(C)C)ccc1Cn1c(CC(C)C)nnc1N1CCC[C@H](c2ccnn2C)C1 1707304650 BLCHWIHNKZPNFK-NRFANRHFSA-N 435.620 4.017 10 10 IICE C[C@H]1CCCN1c1nnc(-c2cccc([N+](=O)[O-])c2)n1CCCSc1nccs1 1726580147 QQJAMTWSHSXCIT-AWEZNQCLSA-N 430.559 4.481 10 10 IICE Cn1nccc1[C@@H]1CCCN(c2nnc(C(C)(C)C)n2CCCSc2nccs2)C1 1748067389 LTXXBCMFQCQOLL-MRXNPFEDSA-N 445.662 4.332 10 10 IICE C[C@H]1CCC[C@H]1Cn1c(CNC(=O)c2cccs2)nnc1N(C)Cc1ccccc1O 1762875684 KJKAVLAMXRKGGG-IRXDYDNUSA-N 439.585 4.048 10 10 IICE CC[C@@H](C)c1nnc(N(C)C[C@@H]2CCCOC2)n1Cc1ccc(N2CCSCC2)cc1 1763515220 BHDSOIOQGMKIPQ-CTNGQTDRSA-N 443.661 4.256 10 10 IICE COC[C@@H](C)Cn1c([C@H]2CCCCO2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1770739215 PWTBDZVPWOBZOT-SIKLNZKXSA-N 427.593 4.039 10 10 IICE CC1(C)C[C@H](N(Cc2ccccc2)c2cc3c(cc2Br)[C@H](O)C(=O)N3)CO1 1915453954 HTVUGSPBFIAMOR-LIRRHRJNSA-N 431.330 4.009 10 10 IICE CCOC(=O)N1CCC(N2C(=O)C(=Cc3cccc(OC(C)C)c3)SC2=S)CC1 2323858206 SLQGPZWNWAKSGK-UHFFFAOYSA-N 434.583 4.296 10 10 IICE Cc1ccc(CNC(=O)C[C@@H](CNC(=O)OC(C)(C)C)C(C)C)c(O)c1Br 2381139921 CNLHBSOQEJCCHX-HNNXBMFYSA-N 443.382 4.266 10 10 IICE O=C(CCN1C(=O)/C(=C/c2cccs2)SC1=S)NCc1nc2ccccc2s1 40324144 SEQRJSODDQDNAX-GDNBJRDFSA-N 445.616 4.266 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4ccccc4nc3N3CCCC3)CC2)cc1 111165837 SMEFQUFVOLFZLO-UHFFFAOYSA-N 430.552 4.242 10 10 IICE CC(C)N1CCc2c(c3ccccc3n2CC(=O)NC2CCN(C3CCCCC3)CC2)C1 435821974 KPPNFSLGVJOYCN-UHFFFAOYSA-N 436.644 4.321 10 10 IICE O=C(NCc1ccc(N2CCC(CO)CC2)cc1)c1cc2c(Br)cccc2[nH]1 725887111 AFDGVOZJDOIZMT-UHFFFAOYSA-N 442.357 4.069 10 10 IICE COc1ccc2nc(Cl)ccc2c1S(=O)(=O)Nc1nc(-c2ccccn2)cs1 727245803 DPGSGIJVUXHILB-UHFFFAOYSA-N 432.914 4.216 10 10 IICE C[C@H](NC(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1)c1ccc(N2CCOCC2)cc1 743564752 PDYMEJXURBYTMK-LEDOBFOHSA-N 442.629 4.028 10 10 IICE CCOC(=O)c1csc(CCNC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)n1 787460196 DVQIYRPKJJNIFX-UHFFFAOYSA-N 431.945 4.353 10 10 IICE C[C@@H](NC[C@H]1CCN(S(=O)(=O)c2cccs2)C1)c1cc(Cl)c(Cl)cc1O 797022904 XWDXCYUJXTXHHX-VXGBXAGGSA-N 435.398 4.122 10 10 IICE Cc1noc(C)c1C(C)(C)C(=O)OCC(=O)c1cc(C)n(-c2ccc3c(c2)OCO3)c1C 797508644 LACJNZXLQYOVSL-UHFFFAOYSA-N 438.480 4.131 10 10 IICE C[C@@H](N[C@H]1CCN(C(=O)COc2ccccc2)C1)c1ccc(N2CCCCC2)c(F)c1 800993686 MSHJKKRVZQHDFB-CTNGQTDRSA-N 425.548 4.147 10 10 IICE Cc1cc(-c2nnc(N(C)CC3CCOCC3)n2C[C@H]2CCCO2)c(C)n1-c1ccccc1 802686817 AZAAASFNHVRJFY-HSZRJFAPSA-N 449.599 4.394 10 10 IICE COc1cc(F)c(F)cc1NC(=O)C(=O)N(c1ccc(N)cc1)[C@@H](C)c1ccccc1 810392906 HHYGBHWCXCBYNW-AWEZNQCLSA-N 425.435 4.289 10 10 IICE COc1cc(O)c(CN[C@H](Cc2ccc(F)cc2)[C@H]2COc3ccccc3O2)cc1OC 814178232 IJOODWMQWWWKJT-KBMIEXCESA-N 439.483 4.089 10 10 IICE CC(C)c1csc(NC(=O)NCc2ccc(N3CCOCC3)cc2C(F)(F)F)n1 916671878 WYJBWWIPLPOEKZ-UHFFFAOYSA-N 428.480 4.444 10 10 IICE CCOC(=O)c1c(NC(=O)c2cccc(C(=O)NC)n2)sc(C)c1-c1ccc(C)cc1 1124551905 GIMLBPHOSQJYJN-UHFFFAOYSA-N 437.521 4.216 10 10 IICE CCN(CC)C(=O)c1ccc(CNC(=O)Cn2c3c(c4cc(OC)ccc42)CCCC3)cc1 1124964933 YOVOWWFDLWVJPQ-UHFFFAOYSA-N 447.579 4.327 10 10 IICE COc1ccc(N2CCCN(C(=O)C3(C(=O)OC(C)(C)C)CCCCCC3)CC2)cc1 1125251653 XANYDXVFGHAHGL-UHFFFAOYSA-N 430.589 4.416 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)c1 1135978610 RZFVPPZJKAAKMN-HSZRJFAPSA-N 430.483 4.299 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O 1142419107 NPTHEPPUKAQBRX-HNAYVOBHSA-N 448.394 4.468 10 10 IICE CC(C)(C)OC(=O)NC[C@@H]1CCCc2ccc(C(=O)NCCc3ccc(O)c(O)c3)cc21 1150487581 GEIPQOMYKHZLHD-IBGZPJMESA-N 440.540 4.015 10 10 IICE Cc1cc(CNC(=O)c2cc([N+](=O)[O-])ncc2Br)c(C)n1-c1ccccc1 1161721526 YYGDPGHPIYYITE-UHFFFAOYSA-N 429.274 4.090 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CSc4ccc(Br)cc43)C2)cc1 1248182871 HNRZRLODSMOAMZ-KSSFIOAISA-N 448.386 4.183 10 10 IICE O=C(NCc1cccc(Br)c1O)NC[C@H]1CCN(c2ccccc2Cl)C1 1252900940 LHIVKFAKNLXOGH-CYBMUJFWSA-N 438.753 4.134 10 10 IICE C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1312365995 SJPKSIXHGFAZNA-MRXNPFEDSA-N 435.490 4.097 10 10 IICE CCN(CC)c1ccc(CN(C)c2nnc(Cc3ccccn3)n2C[C@@H]2CCCCO2)cc1 1321327378 XEMBIPFMJCUWOD-DEOSSOPVSA-N 448.615 4.316 10 10 IICE COCCOc1ccc(F)cc1NC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 1361164796 UVPYCYDILOAPKR-UHFFFAOYSA-N 426.488 4.332 10 10 IICE Cc1cc(CNC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)c(C)n1-c1ccccc1 1438301373 KAMWHHLTRGXCMA-UHFFFAOYSA-N 432.499 4.028 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)c1 1448224107 JPZDUNPPYSDNAL-HSZRJFAPSA-N 429.564 4.366 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)cc1 1464100777 XYLRRCFNQNYJCG-SANMLTNESA-N 430.596 4.203 10 10 IICE Cc1ccc(C(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1-n1c(C)cc(C=O)c1C 1470049153 XAZOEGSGEDQYMX-LOSJGSFVSA-N 430.548 4.453 10 10 IICE COc1cc(OC)c(C[C@@H](C)NC(=O)N(C)Cc2ccc(N3CCCC3)cc2)c(OC)c1 1478667818 VCDYDUHUKHZIKS-GOSISDBHSA-N 441.572 4.085 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)N1CCCC(F)(F)CC1 1532338064 PXXKXTHBVZSTAN-QINSGFPZSA-N 428.501 4.065 10 10 IICE Cc1ccccc1-n1c(C)cc(C(=O)Nc2ccc(C(=O)NCCN3CCCC3)cc2)c1C 1543413206 ITOOXABBFZDUQG-UHFFFAOYSA-N 444.579 4.480 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@@H](O)C2CCCCCCC2)NC(=O)OC(C)(C)C)cc1 1544269062 PCPPYNKNJFUALL-VXKWHMMOSA-N 447.620 4.156 10 10 IICE COc1ccc(N2CCN(CCNC(=O)CCCc3csc4ccccc34)CC2)cc1 1544315462 QHZZRPODSZKPPL-UHFFFAOYSA-N 437.609 4.171 10 10 IICE CC(C)N(CCC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1)C(=O)OC(C)(C)C 1544524003 MIILJPILOPIPSW-QFIPXVFZSA-N 447.620 4.296 10 10 IICE Cc1ccc(C(=O)NC[C@@H](O)c2c(F)cccc2Cl)cc1-n1c(C)cc(C=O)c1C 1545526634 LIFGLRLSBQUMAJ-OAQYLSRUSA-N 428.891 4.471 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N(C)Cc2cc(Br)cn2C)c1 1545778592 LMNLDOFETQJTBY-UHFFFAOYSA-N 428.330 4.280 10 10 IICE O=C(Cc1ccc(O)c(O)c1)N1CCN([C@H](c2ccccc2)c2ccccc2Cl)CC1 1546216380 PSXOFZFDSOZOKO-RUZDIDTESA-N 436.939 4.228 10 10 IICE CCc1nc(CCn2c([C@@H](C)CC)nnc2N(C)Cc2ccc(N3CCCC3)cc2)no1 1546368318 UNCQPYYAUZPVRH-SFHVURJKSA-N 437.592 4.216 10 10 IICE CC[C@@H]1C(=O)NCCN1c1nnc(-c2cc(C)n(-c3ccccc3)c2C)n1CCC=C(C)C 1546576038 UPDZIZPZYYVNDQ-HSZRJFAPSA-N 446.599 4.424 10 10 IICE CCCC1(Cn2c(N(C)Cc3ccccc3O)nnc2[C@@]2(OC(C)C)CCOC2)CC1 1546935974 MXPDFMSPSVGQPR-XMMPIXPASA-N 428.577 4.241 10 10 IICE COc1ccc(NC(=O)CN(Cc2ccccc2)c2ccc(OC)c(OC)c2)cc1OC 1560239791 KOTNDGIBJPBYMC-UHFFFAOYSA-N 436.508 4.366 10 10 IICE Cc1ccccc1Oc1cc(F)cc(F)c1NC(=O)c1cc(NS(C)(=O)=O)ccc1O 1585021883 JNNMVCDMXJJBER-UHFFFAOYSA-N 448.447 4.395 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCOCCN(C)C(=O)OC(C)(C)C)c1 1587664905 OZIBNESESJACEQ-UHFFFAOYSA-N 449.979 4.361 10 10 IICE COc1cccc([C@@H](C)CCCC(=O)N2CCN(c3ccc(OC)cc3OC)CC2)c1 1595996201 CEVSVKQBSRUIRO-IBGZPJMESA-N 426.557 4.335 10 10 IICE O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc2c(cc1O)CCCC2 1596392148 DXEDRGGRQXIOGZ-UHFFFAOYSA-N 434.458 4.056 10 10 IICE CCOc1ccc(N2CCN(C(=O)c3cc(Cl)cc(Br)c3N)CC2)cc1 1596733377 QHTIBNVWNRSKLQ-UHFFFAOYSA-N 438.753 4.046 10 10 IICE COc1ccc(N2CCC(NC(=O)c3cc4ccc(C(F)(F)F)cc4nc3O)CC2)cc1 1611011067 CTVFONYMXYZHRQ-UHFFFAOYSA-N 445.441 4.367 10 10 IICE CCOC(=O)c1nc(N2CC=C(c3c[nH]c4ncccc34)CC2)ccc1Br 1611768499 STDKRZPQWYOWRC-UHFFFAOYSA-N 427.302 4.191 10 10 IICE CCN(CCCNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1)C(=O)OC(C)(C)C 1615912323 SYYZBPUXVCYGSI-UHFFFAOYSA-N 441.572 4.212 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)[C@H]2CCc3cc(F)ccc32)NC(=O)OC(C)(C)C)cc1 1618253959 UXXPBNXKQFYPKG-VXKWHMMOSA-N 441.547 4.304 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)NCCOc1cccc(Br)c1 1625416586 QIGWLGXSIWYCMR-UHFFFAOYSA-N 441.325 4.478 10 10 IICE CN(C)c1ccc(CN(C(=O)/C=C\[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C2CC2)cc1 1629697436 HFHSYSBZLARPLJ-XZGNNNQISA-N 427.589 4.447 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCN(C(=O)CCC3CCCC3)CC2)cc1 1629738210 YRAGQUXFMNKEPX-UHFFFAOYSA-N 449.595 4.090 10 10 IICE CCc1csc([C@H](C)NC(=O)CCN2C(=O)/C(=C\c3ccc(F)cc3)SC2=S)n1 1630684007 MCSDTEIGIHXXGW-SEJMYLSOSA-N 449.598 4.313 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)N(C)C[C@]3(O)CCN(Cc4ccccc4)C3)c2C)c1 1630831808 UMDZJSACAUMTBS-MUUNZHRXSA-N 445.607 4.420 10 10 IICE COc1ccc(N(Cc2ccc(N(C)C)cc2)C(=O)c2c(Br)cnn2C)cc1 1633065763 ASCMDYJHDKCEBO-UHFFFAOYSA-N 443.345 4.104 10 10 IICE CC1CCN(c2ccc(CNC(=O)[C@@H]3CC(=O)N(C)[C@@H]3c3cccc(Cl)c3)cc2)CC1 1633110905 LJWJXIRLRPKYPA-ISKFKSNPSA-N 439.987 4.412 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCSC[C@H]2c2nccs2)cc1 1633348241 KCKOBERUJBLWNB-FQEVSTJZSA-N 425.579 4.222 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)NC[C@@H]3CC(c4ccc(C)c(C)c4)=NO3)ccc21 1633764223 DDVALCISQSUHTG-QFIPXVFZSA-N 433.552 4.444 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)[C@@H](C)CC(=O)c1ccccc1F 1635489048 HKLCJUNZRPTJQX-KRWDZBQOSA-N 442.531 4.423 10 10 IICE COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H]2c3ccccc3CN2C(=O)OC(C)(C)C)c1 1636061836 YVFVFMYWNSUMCE-FOIQADDNSA-N 426.513 4.460 10 10 IICE O=C(N[C@H]1c2ccccc2CC[C@@H]1F)c1cc(NS(=O)(=O)c2cccs2)ccc1O 1636613439 OUHKWSQOVBTPNQ-PXNSSMCTSA-N 446.525 4.010 10 10 IICE COc1ccc(N(CC(=O)Nc2ccccc2C(=O)NCc2ccccc2)CC2CC2)cc1 1643140495 XGVHXSMIGUWFLP-UHFFFAOYSA-N 443.547 4.480 10 10 IICE COc1ccc(CN(C)[C@@H](C)C(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1C 1652445712 MKPXPEJZOUKBSF-KRWDZBQOSA-N 442.515 4.238 10 10 IICE COc1ccc(-c2csc(NC(=O)[C@@H](C)N3CCOc4cc(N(C)C)ccc43)n2)cc1 1653144524 DOWDNIZEMNAOPP-OAHLLOKOSA-N 438.553 4.111 10 10 IICE Cc1cccc(CN(CC(C)C)C(=O)NCc2cc(F)c(N3CCOCC3)c(F)c2)c1 1683014129 HJMSXOVGBKEXDD-UHFFFAOYSA-N 431.527 4.478 10 10 IICE CN1CCN(c2ccc(CNC(=O)N[C@@H](c3ccc(F)cc3)c3cccs3)cc2)CC1 1684875113 ZURIYNDOEQWKRC-QHCPKHFHSA-N 438.572 4.228 10 10 IICE CSCC[C@H](C)N(C)c1nnc([C@H]2CCCO2)n1Cc1ccc2c(c1)CCCN2C 1698409727 YMCRFNJIVLTNRM-LAUBAEHRSA-N 429.634 4.138 10 10 IICE CC(C)C[C@@H]1CCN(c2nnc([C@H]3CCCOC3)n2Cc2ccc(N(C)C)c(F)c2)C1 1723358400 QXQRBRLEWBWETL-PMACEKPBSA-N 429.584 4.298 10 10 IICE Cc1nnc(CCCn2c(C(C)C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)s1 1726264190 VPWXXFFQNXYWIU-UHFFFAOYSA-N 439.633 4.431 10 10 IICE CCc1nnc(N2CCC(N(CC)CC)CC2)n1Cc1ccc(N2CCC(C)CC2)cc1 1727558255 VWAIDFBKESAZEZ-UHFFFAOYSA-N 438.664 4.436 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1C[C@H]1CCCCS1 1741433453 KKHZRDZFTDGIHQ-JOCHJYFZSA-N 443.661 4.235 10 10 IICE CC(C)CCN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1761072798 FUUDOFGEDXXOKD-UHFFFAOYSA-N 425.621 4.378 10 10 IICE CCc1nn(C)c(CC)c1Cn1c(CC2CCCC2)nnc1N(C)Cc1ccccc1O 1762808865 CGNYAVFHXBNEQP-UHFFFAOYSA-N 436.604 4.259 10 10 IICE CCc1nnc(N2CCN(c3ccc(OC)c(F)c3)CC2)n1CCCSCC(C)C 1764914096 UKYLVVXZSPPKTE-UHFFFAOYSA-N 435.613 4.094 10 10 IICE CCN(CC)C1CCN(c2nnc(-c3cccnc3)n2Cc2ccc(N(C)C)cc2C)CC1 1766642767 OYTKNVKMNCFBRI-UHFFFAOYSA-N 447.631 4.073 10 10 IICE CC(C)Oc1cccc(/C=C2/SC(=S)N(c3cc(C(=O)O)cc(C(=O)O)c3)C2=O)c1 1860073495 KRFNMYFNERDMJP-REZTVBANSA-N 443.502 4.276 10 10 IICE Cc1coc2c(C)c3oc(=O)c(CCC(=O)NCCc4ccc(O)c(O)c4)c(C)c3cc12 1860281485 GBRYCJBGHZDEFQ-UHFFFAOYSA-N 435.476 4.167 10 10 IICE CCCC1=NN(CCC)C(=O)/C1=C/c1ccc(OCC(=O)N(CC)CC)c(OCC)c1 1865677352 FMJXKASIQFPUPI-XDJHFCHBSA-N 429.561 4.124 10 10 IICE O=C(O)[C@@H]1CCN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]1c1cccc(O)c1O 1952822970 FXBSRZPUOXDWSG-OFNKIYASSA-N 445.471 4.495 10 10 IICE CC(C)(C)OC(=O)N[C@H](COCc1ccccc1)C(=O)N1CCCC[C@@H](CN=[N+]=[N-])C1 2010397260 RJXKHQGNMQJKPG-RBUKOAKNSA-N 431.537 4.036 10 10 IICE CCOC(=O)c1ccc(-n2c(C)cc(C=C3NC(=O)N(c4ccccc4)C3=O)c2C)cc1 2293296184 LNYBVVAWQFBBFT-UHFFFAOYSA-N 429.476 4.368 10 10 IICE CCCCN1C(=O)C(=Cc2ccc3c(c2)CCCN3Cc2ccccc2)C(=O)NC1=S 2296173563 SJSYZGWBIDLWLU-UHFFFAOYSA-N 433.577 4.066 10 10 IICE Cc1ccc(CNC2CCN(C(=O)OCc3ccccc3)CC2)c(O)c1Br 2307480133 PRTGBURFFUJZEZ-UHFFFAOYSA-N 433.346 4.354 10 10 IICE COC(=O)CCCN1C(=O)C(=Cc2ccc(OCCc3ccccc3)cc2)SC1=S 2314760547 LBJFYOCDWMQAJA-UHFFFAOYSA-N 441.574 4.463 10 10 IICE COC(=O)c1ccc(Cl)c(N2C(=O)C(=Cc3ccccc3[N+](=O)[O-])SC2=S)c1 2321683273 CKRUKFUXZPVDDP-UHFFFAOYSA-N 434.882 4.441 10 10 IICE Cc1ccc(CNC(=O)[C@]2(NC(=O)OC(C)(C)C)CC[C@H](C)C2)c(O)c1Br 2380754045 MMJQEBYTBCMAGC-YUNKPMOVSA-N 441.366 4.163 10 10 IICE Cc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=C(N5CCCC5)SC4=NC3=O)c2C)cc1 20356337 KPULISZFHKSTMJ-HRGNJQJKSA-N 432.553 4.075 10 10 IICE C[C@H]1Oc2ccccc2C=C1/C=C1\SC(N2CCN(Cc3ccccc3)CC2)=NC1=O 34967983 MWCKZGZQIYNGJF-MPGAHLTBSA-N 431.561 4.182 10 10 IICE CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)cc1Cl 90759731 KCXXZQJKVDAHPK-UHFFFAOYSA-N 428.897 4.330 10 10 IICE CCOc1cccc(N2C(=O)N=C(O)/C(=C/c3cccn3-c3ccc(OC)cc3)C2=O)c1 96594583 ZHTTYPMVXPJXPC-QNGOZBTKSA-N 431.448 4.391 10 10 IICE COc1ccc(N2CCCN(C(=O)/C=C\c3ccc(OCC(C)C)c(OC)c3)CC2)cc1 209667934 QBESFOIBFRCCHM-QPEQYQDCSA-N 438.568 4.491 10 10 IICE COC[C@]1(CNCc2cccc(Br)c2O)CCCCN1C(=O)OC(C)(C)C 380518517 QWWLQZWKSSTQHU-HXUWFJFHSA-N 443.382 4.051 10 10 IICE O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc(-c3sccc3Br)cs2)cc1 727248288 NISFFHFMDDJBRK-UHFFFAOYSA-N 446.329 4.343 10 10 IICE COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)c1 751061580 XEMJNDWHTLZKPR-ZDUSSCGKSA-N 430.302 4.148 10 10 IICE COc1cc(N2CCN(C(=O)Nc3c(Cl)ccc(C)c3C)CC2)cc(OC)c1OC 765422252 ZXPCIJLVTLNMAU-UHFFFAOYSA-N 433.936 4.337 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NC3CCN(c4ccccn4)CC3)cc2Cl)C1 799883545 HLUATPRLKYMGGZ-GOSISDBHSA-N 442.007 4.440 10 10 IICE Cc1sc(NS(=O)(=O)c2cccnc2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 808529496 FZEPNQWRILKZMR-UHFFFAOYSA-N 444.416 4.241 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)Cc2cscc2Br)cc1 814679911 RHTJPCIFTRTEQG-SFHVURJKSA-N 437.403 4.327 10 10 IICE Cc1nc(NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2c3c(sc2n1)C[C@H](C)CC3 917391484 VYQIJOCPHXOOBA-CRAIPNDOSA-N 449.624 4.438 10 10 IICE Cc1nc(CC(=O)Nc2c(-c3ccccn3)nc3ccc(Br)cn23)cs1 1134750559 DSNDJJOLCHPSSA-UHFFFAOYSA-N 428.315 4.105 10 10 IICE Cc1ccc(CNC(=O)N[C@H](CC(C)C)C(=O)NCc2c(O)ccc3c2CCCC3)cc1 1137443470 QZXZUVYNPWKTHY-HSZRJFAPSA-N 437.584 4.110 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccccc1C(=O)N[C@@H]1CCC[C@H](NC(=O)OC(C)(C)C)C1 1138333037 XPNRZVSDHXIOAU-UXHICEINSA-N 439.556 4.472 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCc1cccc2cc[nH]c12 1154344305 BYUWOQGMZRVRPC-PDGQHHTCSA-N 439.537 4.215 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)NCc3cccc4c3OCCO4)cc2Cl)C1 1227210334 ZNLAVMOKGRCORX-MRXNPFEDSA-N 429.948 4.347 10 10 IICE CC[C@H](NC(=O)NCc1cc(C)n(-c2cccc(C)c2)c1C)C(=O)NCc1cccs1 1254073536 IZLJLEZDUJNHBB-QFIPXVFZSA-N 438.597 4.358 10 10 IICE O=C(Nc1c(-c2ccccn2)nc2ccc(Br)cn12)c1ncc(F)cc1F 1289511078 XTZSLGJAZGVOQF-UHFFFAOYSA-N 430.212 4.084 10 10 IICE COC(=O)Cc1sc(NC(=O)c2cc3cc(O)c(O)cc3s2)nc1-c1ccccc1 1292048036 QLGLLYVWBDABKB-UHFFFAOYSA-N 440.502 4.404 10 10 IICE COCCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCC[C@@H](NC(=O)OC(C)(C)C)C3)ccc21 1296625794 SYSZWAGROOKRDX-VQTJNVASSA-N 443.588 4.470 10 10 IICE C[C@H]1C[C@H](C)CN(c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)c(F)c2)C1 1304921670 WVSXYZPSHUSCAJ-ROUUACIJSA-N 429.584 4.082 10 10 IICE Cc1cccc(-n2c(C)cc(C(=O)Cn3c(-c4ccc([N+](=O)[O-])cc4)noc3=O)c2C)c1 1307294120 CKZMPVLQOZXNLI-UHFFFAOYSA-N 432.436 4.010 10 10 IICE CCS[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O 1307700567 SHXXTUJVZPZNBA-QFIXIFRTSA-N 436.577 4.443 10 10 IICE CSCCCN(C)c1nnc(C2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1316470321 CTZWMBKFZMVWJW-UHFFFAOYSA-N 429.634 4.010 10 10 IICE CCCOc1nc2ccccc2cc1/C=C\C(=O)N1C[C@@H](C(=O)OC)Oc2ccccc21 1349686227 SHXABHCWOYRKCA-MLUDITRGSA-N 432.476 4.004 10 10 IICE Cc1cc(Br)cc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1 1357835976 LRVAMIQVFUXDBC-HUUCEWRRSA-N 435.337 4.440 10 10 IICE CCN1CCN(c2ccc(CNC(=O)CCc3ccc(F)c4c3CCCC4)cc2F)CC1 1360093458 FOTWHWMLWMRYJI-UHFFFAOYSA-N 441.566 4.235 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)c3ccc(C)c(NC(=O)c4ccco4)c3)C2)cc1 1436971187 LZCRMFFWUHESSO-SFHVURJKSA-N 433.508 4.105 10 10 IICE C[C@H](Cc1ccc(Br)cc1)C(=O)NCc1ccc(N2CCSCC2)cc1 1441632027 QVZQSUHTKDQHSK-MRXNPFEDSA-N 433.415 4.497 10 10 IICE CCN(CC)[C@H](C)Cn1c(-c2cccnc2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1501978553 UWZQALSYKGXPNX-OAQYLSRUSA-N 447.631 4.307 10 10 IICE O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccc2c(n1)CCC2 1521773750 WSJGUZKDIJSCRO-VBKFSLOCSA-N 429.592 4.252 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)N2CCCc3c(OCC(N)=O)cccc32)c1 1526310243 LVTCTYHIOKZTJW-UHFFFAOYSA-N 437.927 4.205 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)N(C)C)cc1 1537478215 XVVDFCOUBIFKKM-OAQYLSRUSA-N 446.382 4.278 10 10 IICE CCN1CCN(c2ccc(CNC(=O)c3cnn(C(C)C)c3-c3ccccc3)cc2F)CC1 1537534491 BIUVUIRTBJGKKN-UHFFFAOYSA-N 449.574 4.342 10 10 IICE Cc1cc(CC(=O)Nc2ccc(S(C)(=O)=O)c3ccncc23)c(C)n1-c1ccccc1 1538141932 GMKCKDCEWJJMHR-UHFFFAOYSA-N 433.533 4.227 10 10 IICE COc1ccc(N2CCN(c3nnc([C@H]4CCCCO4)n3CCC=C(C)C)CC2)cc1F 1554960937 SKGSXEUGRMFSJK-JOCHJYFZSA-N 443.567 4.350 10 10 IICE CCOc1cc(C(=O)NCc2ccc3cccnc3c2O)ccc1OCc1cccnc1 1557121176 ILFZYTBZCCCWJK-UHFFFAOYSA-N 429.476 4.243 10 10 IICE CN(C)c1ccc(CN(C(=O)NCCc2cnc(SC3CCCC3)nc2)C2CC2)cc1 1564838075 HUTVLAQDTOHXOF-UHFFFAOYSA-N 439.629 4.494 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC[C@@H]1COC(=O)NC1CCCCC1 1564946963 ZLJKCUGYCUZMAP-WMZHIEFXSA-N 444.620 4.225 10 10 IICE COC(=O)C[C@H](CNC(=O)c1cc(C)n(-c2ccccc2Br)c1C)C1CC1 1584557308 SGERSCTZKYYAGM-MRXNPFEDSA-N 433.346 4.176 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CC(C)(C)CC(=O)c1ccccc1 1597567720 VBJRJZQZJDFFHZ-UHFFFAOYSA-N 431.916 4.237 10 10 IICE O=C(CCN1C(=O)/C(=C/c2ccc(F)cc2)SC1=S)NCC[C@H]1CCC2(CCC2)O1 1611085218 HKQVHLHMXWPUOL-OLCHLOJWSA-N 448.585 4.025 10 10 IICE C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CNC(=O)OC(C)(C)C)C1CCCCCC1 1611430870 HTXOLROMDDEMSX-APWZRJJASA-N 434.577 4.256 10 10 IICE CN1C(=O)c2ccc(-c3ccc(F)cc3F)cc2O[C@@H]2CN(Cc3ccccc3O)C[C@H]21 1615262375 FQMQTMUPTNHBPF-ZJSXRUAMSA-N 436.458 4.055 10 10 IICE CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1Cc1cccc(C(F)(F)F)n1 1617939977 KJBCNOLFKVZTGJ-UHFFFAOYSA-N 442.445 4.088 10 10 IICE CCON(Cc1ccccc1)[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 1618582286 BMYSQAQALLBQOE-QGZVFWFLSA-N 428.488 4.243 10 10 IICE CO[C@H](C)c1nc(Cn2c(C)nnc2N(C)Cc2ccc(N3CCCC3)cc2)cs1 1618925917 NWGFAIZQMOJKEV-MRXNPFEDSA-N 426.590 4.035 10 10 IICE Cc1cc(C(=O)NC[C@@H](O)c2ccc(F)cc2)c(C)n1-c1ccccc1Br 1626454563 UQPSWUUZXULRLR-HXUWFJFHSA-N 431.305 4.459 10 10 IICE CCc1ccccc1[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)NC(=O)OC(C)(C)C 1629144378 DURJRSHIEGZYBL-QXFGJRORSA-N 426.513 4.056 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)[C@@H](CC(C)(C)C)N(C)C(=O)OC(C)(C)C)C2)cc1 1630618667 DFRRQVBIJSFQST-GHTZIAJQSA-N 447.620 4.309 10 10 IICE Cc1ccc2c(c1)[C@@H](NC(=O)c1cc(C)n(-c3ccc(Br)cn3)c1C)CO2 1631105300 IVQWNFWNHFELBZ-SFHVURJKSA-N 426.314 4.424 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)NC3(C(C)(C)c4ccc(F)cc4)CC3)C2)cc1 1636354304 WSMDGMGWLLDULE-SFHVURJKSA-N 425.548 4.470 10 10 IICE Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccccc3CNS(C)(=O)=O)c2C)c1 1650656607 ZKXPRPRDNFRUGQ-UHFFFAOYSA-N 425.554 4.012 10 10 IICE COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOc4cc(Cl)ccc43)CC2)c(OC)c1 1680772380 RVTUJLJXLSYZQC-LJQANCHMSA-N 445.947 4.103 10 10 IICE COc1ccc(N2CC[C@@H](CNC(=O)N3CCC[C@H]3COc3ccc(Cl)cc3)C2)cc1 1682188009 DBZZAKLJKAFAHD-RXVVDRJESA-N 443.975 4.428 10 10 IICE C[C@@H]1C[C@H](NC(=O)NCc2ccc(N3CCC(C(N)=O)CC3)cc2)C[C@H](c2ccccc2)C1 1683300710 UHADICKTVCFEGB-IEXUWNMDSA-N 448.611 4.160 10 10 IICE Cc1cnn([C@@H]2CCCN(c3nnc(C(C)C)n3Cc3ccc(N(C)C)c(F)c3)C2)c1 1693297296 LHIPJDWSECPQAH-LJQANCHMSA-N 425.556 4.001 10 10 IICE C[C@@H]1CN(c2nnc(CC3CC3)n2CCCSc2nccs2)C[C@@H](C(F)(F)F)O1 1726715026 OGRUBCDCQSCNHN-OCCSQVGLSA-N 447.552 4.026 10 10 IICE CCc1ccc([C@H]2CN(c3nnc(C)n3CCCSc3nccs3)CCO2)cc1 1744354530 NEZHBOCJUQFJQR-LJQANCHMSA-N 429.615 4.366 10 10 IICE CCN(CC)c1ccc(Cn2c(C)nnc2N2CCC(Oc3cc(C)ccn3)CC2)cc1 1766609478 ZJIPBXWNIQTGEX-UHFFFAOYSA-N 434.588 4.232 10 10 IICE CCCOC(=O)c1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCCO4)SC2=S)cc1 1860076571 KZJBHABWURONCL-CPNJWEJPSA-N 441.530 4.430 10 10 IICE Cc1csc2nc(Cl)c(/C=C3/SC(=S)N(c4cccc(C(=O)O)c4)C3=O)n12 1860084608 WPXJPIPDADWIKC-WUXMJOGZSA-N 435.939 4.462 10 10 IICE CCC[C@@H](N)C(=O)Nc1sc(C)c(-c2ccc(Br)cc2)c1C(=O)OC 1866017611 MZKOGJCHRRBRNV-CYBMUJFWSA-N 425.348 4.339 10 10 IICE CCN(CC)c1ccc(-c2nc3cc(C(=O)N4CCC5(CC4)OCCO5)ccc3[nH]2)cc1 1873506297 CRAFBLMQPNQASM-UHFFFAOYSA-N 434.540 4.055 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(CCNCc2c(O)cccc2Br)C1 2140328798 IGERNQWZVGFKDO-XOBRGWDASA-N 425.367 4.282 10 10 IICE COCC[C@@]1(NCc2cccc(Br)c2O)CCCN(C(=O)OC(C)(C)C)C1 2157555122 VXOOQUUVJBPULS-FQEVSTJZSA-N 443.382 4.051 10 10 IICE COc1ccc(Br)c(CN[C@@H](C)CCCN(C)C(=O)OC(C)(C)C)c1O 2227751924 SNQMNBZEQVYONU-ZDUSSCGKSA-N 431.371 4.289 10 10 IICE CCN(CC)c1ccc(C=C2SC(=O)N(CC(=O)Nc3ccccc3F)C2=O)cc1 2294010858 OMKADZKFXQXGOX-UHFFFAOYSA-N 427.501 4.347 10 10 IICE COc1ccc(C2=NN(c3nc4ccccc4s3)C(=O)C2=CNCc2ccccn2)cc1 2297313696 REFYQLXNPRJQQI-UHFFFAOYSA-N 441.516 4.125 10 10 IICE CSC1=NSC2=NC(=O)C(=Cc3ccc(OC(=O)c4ccc(C)cc4)cc3)C(=N)N12 2297333810 ULJJPJQFVCKCDY-UHFFFAOYSA-N 436.518 4.154 10 10 IICE CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1[C@@H]2CNCc1cc(Cl)cc(Br)c1O 2311871300 JWCRJHKMXDQYQT-LNSITVRQSA-N 431.758 4.153 10 10 IICE COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)C1=Cc1ccc(OC)c([N+](=O)[O-])c1 2313499192 XGWQVIHKJVZQJZ-UHFFFAOYSA-N 428.828 4.134 10 10 IICE O=C1C(=CNC2Cc3ccccc3C2)C(C(F)(F)F)=NN1c1nc2ccccc2s1 2313710599 JNTWXYBYIYVRMS-UHFFFAOYSA-N 428.439 4.202 10 10 IICE CCCCOc1ccc(C=C2SC(=S)N(CCCC(=O)OC)C2=O)cc1OCC 2314759953 HNWPOKSYRHSCBY-UHFFFAOYSA-N 437.583 4.419 10 10 IICE CC[C@H](Oc1ccccc1C=C1SC(=S)N([C@@H](CC(C)C)C(=O)O)C1=O)C(C)=O 2314928473 WLWXDLWPFVEKKL-HOTGVXAUSA-N 435.567 4.134 10 10 IICE COc1cc(C=C2SC(=S)N(c3ccc(C)cc3)C2=O)ccc1O[C@@H](C)C(=O)O 2314931709 HSKLVJUFVOBLNL-ZDUSSCGKSA-N 429.519 4.261 10 10 IICE Cc1ccc(CNC(=O)c2cccc(NC(=O)OC(C)(C)C)n2)c(O)c1Br 2380719080 CFAQWEUNUSWZBK-UHFFFAOYSA-N 436.306 4.135 10 10 IICE Cc1ccc(CNC(=O)C[C@H](CNC(=O)OC(C)(C)C)C2CC2)c(O)c1Br 2380722843 RNGZESCOWZGWDR-OAHLLOKOSA-N 441.366 4.020 10 10 IICE Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)N(CCO)c3ccccc3)C2=O)cc1 35643870 XXPHCFWUPCCCRH-CAPFRKAQSA-N 440.590 4.002 10 10 IICE COc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)cc1 39570417 MTBRBCKJIMDRFN-AREMUKBSSA-N 445.519 4.061 10 10 IICE CC1=NN(c2ccc(C)cc2C)C(=O)/C1=C/NNc1ccc(I)cc1 101123106 OYBLDXFWWSDEIG-GZTJUZNOSA-N 446.292 4.131 10 10 IICE CN(C)c1ccc(/C=C2/S[C@@]3(C(=O)Nc4ccccc43)N(c3ccc(O)cc3)C2=O)cc1 206590098 JSOFTMXDNWGVIX-DIXABZHVSA-N 443.528 4.384 10 10 IICE CC(=O)NCc1ccc(N[C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)cc1 733321393 BRDPEJLQAXFJMX-HSZRJFAPSA-N 441.491 4.482 10 10 IICE CC(=O)NCc1ccc(C(=O)OCC(=O)c2cc(C)n(-c3ccc(C)c(F)c3)c2C)s1 743153624 ZVPNVTFWIKTIDN-UHFFFAOYSA-N 442.512 4.279 10 10 IICE C[C@H]1CN(c2ccc(CNC(=O)NC[C@H](C)c3ccc(F)cc3F)cc2F)C[C@@H](C)O1 743555008 OJADPKOVQKOBKY-HRCADAONSA-N 435.490 4.320 10 10 IICE C[C@@H](N[C@H](C)c1cc(Br)cc(F)c1O)c1cccc(NS(C)(=O)=O)c1 756494781 NSRURCFVHVEQPH-GHMZBOCLSA-N 431.327 4.077 10 10 IICE C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1ccc(N2CCOCC2)cc1Cl 773062214 BMPLWXNWISTZOW-JLTOFOAXSA-N 439.781 4.323 10 10 IICE Cc1cc(Cl)cc(CNCc2ccc(Br)cc2N2CCOCC2)c1O 776249972 AYKPEJYZLMZZKJ-UHFFFAOYSA-N 425.754 4.243 10 10 IICE COc1cccc([C@@H]2[C@H](N[C@@H](C)c3ccc(N4CCOCC4)c(F)c3)CCN2C2CC2)c1 779176989 BLJGBVBQVBZQGP-GJECAEJISA-N 439.575 4.300 10 10 IICE Cc1cc(Br)c(O)c(CN[C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)c1 781637503 WRQNMJJABBHEDR-MOPGFXCFSA-N 439.781 4.278 10 10 IICE O=S(=O)(Nc1nc(-c2ccccn2)cs1)c1ccc(Cl)cc1Br 799183596 VARREAQRXNKDPD-UHFFFAOYSA-N 430.736 4.422 10 10 IICE CC(=O)NCCN(Cc1ccsc1)C(=O)NCCc1cc(C)n(-c2ccccc2)c1C 801968822 CZBRUIBQNVDMIF-UHFFFAOYSA-N 438.597 4.046 10 10 IICE Cc1cc(-c2nnc(N3CCOC(C)(C)C3)n2C[C@@H]2CCCO2)c(C)n1-c1ccccc1 802694151 FWROSQAHOPWMAZ-NRFANRHFSA-N 435.572 4.147 10 10 IICE CN(C)c1ccc(CN2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)c(C(F)(F)F)c1 809690418 PXDHEJAKFXOFPS-ZDUSSCGKSA-N 425.417 4.052 10 10 IICE COc1ccc([C@H](C)NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)cc1F 918195403 REKMTYJDRBGHFZ-OAGGEKHMSA-N 433.499 4.147 10 10 IICE CCOc1cc(/C=C2\SC(=S)N(C)C2=O)ccc1OC(=O)c1ccc([N+](=O)[O-])cc1 1084519148 KOWZPTZMDSFXSU-BOPFTXTBSA-N 444.490 4.044 10 10 IICE CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N2CCCc3cc(OC(F)(F)F)ccc32)C1 1124988788 UEMVJTFDTVCIIG-OAHLLOKOSA-N 426.435 4.478 10 10 IICE COC(=O)C[C@](C)(NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1cccnc1 1135204945 IEQNGVKWXDOTIG-DEOSSOPVSA-N 439.943 4.280 10 10 IICE CCCCN(Cc1ccccc1O)C(=O)c1nnn(-c2ccccc2Br)c1C 1139124610 WFEQIGISYCNXLO-UHFFFAOYSA-N 443.345 4.486 10 10 IICE Cc1cc(C(=O)NCC[C@]2(O)C(=O)Nc3ccccc32)c(C)n1-c1ccc(C(C)C)cc1 1153786865 RBXUNLMTRMMVFB-AREMUKBSSA-N 431.536 4.177 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)N2CCC(c3cccc(F)c3F)CC2)N(C)C)cc1 1251500101 CJRGBVJVNPYCOS-JOCHJYFZSA-N 430.543 4.223 10 10 IICE CN(C)c1ccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(Nc3ccn(C)n3)cc2)cc1 1292382792 VUYRMCRCOMAWJL-QHCPKHFHSA-N 433.556 4.051 10 10 IICE CC(C)(C)OC(=O)N1CC[C@@](C(=O)NCCCSc2nccs2)(c2ccccc2)C1 1292997790 QLAZDNQUPFYQBT-QFIPXVFZSA-N 447.626 4.320 10 10 IICE CCCOc1cc(N2CCC(O)CC2)ccc1NC(=O)c1ccc2oc(S)nc2c1 1297228300 FAAJHTLOKUNHRS-UHFFFAOYSA-N 427.526 4.119 10 10 IICE O=C(NCc1ccc(O)cc1O)c1ccc(COc2ccccc2Br)cc1 1299573967 MNHXYEODJKHEBV-UHFFFAOYSA-N 428.282 4.369 10 10 IICE CC(C)(C)OC(=O)N1CCC(Cc2ncc(C(=O)N3Cc4cccc(O)c4C3)s2)CC1 1302788473 XBDXRURDLGZHBT-UHFFFAOYSA-N 443.569 4.194 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CC[C@H]1CCCCO1 1314753037 KUQAVYGJCLEKJJ-KCZVDYSFSA-N 442.604 4.498 10 10 IICE Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1 1351944049 TUXDPOUIUSIAES-UHFFFAOYSA-N 431.945 4.250 10 10 IICE COc1ccc2c(c1)CC[C@H](C(=O)N[C@H]1CCCN(c3ccc(OC(F)F)cc3)C1)C2 1361062927 IJLHOTCGBFUEFH-OALUTQOASA-N 430.495 4.187 10 10 IICE C[C@H](NC(=O)c1cc(Br)nn1-c1ncccc1Cl)c1ccc(N(C)C)cc1 1435954044 PCZFCNHATNWARN-LBPRGKRZSA-N 448.752 4.240 10 10 IICE COc1ccc(N(C)CCN(C)C(=O)c2nn(-c3cc(C)ccc3F)c3c2CCC3)cc1 1437384846 XPPUUFDXVGQVRH-UHFFFAOYSA-N 436.531 4.026 10 10 IICE COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)CCCOc1ccc(Cl)c(C)c1 1446808457 XGUQRPANLBRFGW-UHFFFAOYSA-N 440.323 4.368 10 10 IICE CCO[C@@H]1C[C@@](NC(=O)c2cc(C)n(-c3cccc(Cl)c3)c2C)(C(=O)OC)C1(C)C 1447836835 XNSAFCJYSFGHLO-AUSIDOKSSA-N 432.948 4.224 10 10 IICE CCOC(=O)c1c(NC(=O)CN(C)C[C@@H]2CCCC[C@H]2O)sc(C)c1-c1ccccc1 1459840663 PBJBIRYNUOBMNB-RBUKOAKNSA-N 444.597 4.322 10 10 IICE Cc1cc(CC(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)c(C)n1-c1ccc(Cl)cc1 1465834351 KUXHROMCSQMXMI-FCHUYYIVSA-N 442.943 4.234 10 10 IICE CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nn(-c2cc(Cl)ccc2F)c2c1CCC2 1467839706 CLEPJFVQOHZCCC-UHFFFAOYSA-N 434.895 4.275 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)OC(C)(C)C)C3)cc2Cl)C1 1469959984 MPHXYYFOUBFNCQ-FUHWJXTLSA-N 435.996 4.450 10 10 IICE COc1ccc(N2CC[C@H](CNC(=O)N3CCC(Cc4c(F)cccc4F)CC3)C2)cc1 1470592228 APMZUBBJJQEWDT-LJQANCHMSA-N 443.538 4.464 10 10 IICE O=C(N[C@H]1CCN(c2ccc(Cl)cc2F)C1)N(Cc1ccccc1O)C[C@H]1CCCO1 1471005151 QYGYFZYWJHSHLJ-RBUKOAKNSA-N 447.938 4.154 10 10 IICE CC[C@H](C)c1nnc(N2CCC(O)(C(F)(F)F)CC2)n1Cc1ccc(N(C)C)cc1C 1495489002 FEGBGXAJPGKVGJ-HNNXBMFYSA-N 439.526 4.108 10 10 IICE COC[C@@H](Cn1c(-c2cc(C)n(-c3ccccc3)c2C)nnc1N1CC=C(C)CC1)OC 1504577171 CYPTZULEDKFRIL-JOCHJYFZSA-N 435.572 4.170 10 10 IICE CC1=CCCN(c2nnc(-c3cc(C)n(-c4ccccc4)c3C)n2CCOCCN(C)C)C1 1511370308 LXURJPYDILIRGJ-UHFFFAOYSA-N 448.615 4.087 10 10 IICE C[C@H]1CCC[C@H](N(C)c2nnc(C(C)(C)C)n2Cc2ccc(N3CCOCC3)cc2)C1 1512115604 YBDCJHQCHFFPOW-UGKGYDQZSA-N 425.621 4.475 10 10 IICE Cc1cc(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)sc1-c1ccccc1 1527735526 VKHISKKRDJTOJC-FQEVSTJZSA-N 433.577 4.355 10 10 IICE CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1ccc(OC(F)(F)F)c(Cl)c1 1540536812 SIPUKKBCXHZMSL-UHFFFAOYSA-N 428.838 4.347 10 10 IICE CN(C)c1ccc(CN(Cc2ccco2)C(=O)CN2CC[C@H](c3ccccc3)NC2=O)cc1 1540800054 DFEKIFBOAUWTJU-XMMPIXPASA-N 446.551 4.031 10 10 IICE CNS(=O)(=O)c1cccc(NC(=O)Cc2cc(C)n(-c3ccc(Cl)cc3)c2C)c1C 1545432777 LCFIVOCNSIQJGR-UHFFFAOYSA-N 445.972 4.145 10 10 IICE O=C(Cc1cccc(I)c1)N(Cc1ccco1)Cc1ccccc1O 1545496682 WBMJKGYNPXAVAC-UHFFFAOYSA-N 447.272 4.361 10 10 IICE Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c1 1557429767 QKMXXAFAYISBSC-QFIPXVFZSA-N 437.971 4.244 10 10 IICE CN(C)c1ccc([C@@H](CNc2nc3ccc([N+](=O)[O-])cc3[nH]2)NC(=O)OC(C)(C)C)cc1 1559183817 JXFTXYNEEYDWCZ-LJQANCHMSA-N 440.504 4.215 10 10 IICE Cc1cc(C(=O)NCCCNc2ccccn2)c(C)n1-c1ccccc1Br 1565985355 CAPFVEVUQSBNTC-UHFFFAOYSA-N 427.346 4.484 10 10 IICE Cc1cc(C=O)c(C)n1-c1cccc(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1 1566240452 IVWMYVKNCANEGE-KRWDZBQOSA-N 428.492 4.371 10 10 IICE Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CCO[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1 1566255189 IRAPBMQTIVPMBD-SIKLNZKXSA-N 441.572 4.157 10 10 IICE CCOC(=O)C(C)(C)n1cc(NC(=O)c2cc(C)n(-c3ccc(Cl)cc3)c2C)cn1 1566291900 BQGOSSXQWXZQFQ-UHFFFAOYSA-N 428.920 4.495 10 10 IICE COC(=O)c1ccc(-n2c(C)cc(C(=O)Cn3c(=O)oc4cc(Cl)ccc43)c2C)cc1 1613399208 SNFKKQUPTSRBGV-UHFFFAOYSA-N 438.867 4.325 10 10 IICE CN(Cc1ccccc1O)c1nnc([C@@H]2CCO[C@H]2C(C)(C)C)n1CCc1nccs1 1617941578 UJKVRGXOCAXGLH-YLJYHZDGSA-N 441.601 4.238 10 10 IICE COc1ccc(N2CCN(c3nnc(C(C)(C)C)n3C[C@H]3CC[C@H](C)C3)CC2)cc1F 1619302480 RGQIXFOWHNIJRC-ROUUACIJSA-N 429.584 4.486 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3ccc(C)c(-n4c(C)cc(C=O)c4C)c3)C2)cc1 1629084249 NODCOYJNTZYVDR-QFIPXVFZSA-N 431.536 4.232 10 10 IICE CC(C)C[C@H](NC(=O)c1cc(NS(C)(=O)=O)ccc1O)c1cccc(C(F)(F)F)c1 1632167909 LEYINSJXGSVUKR-KRWDZBQOSA-N 444.475 4.300 10 10 IICE Cc1cc(C(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c(C)n1-c1ccc(Br)cc1 1632752522 FPRXPZCPJIAYLQ-GOEBONIOSA-N 446.389 4.376 10 10 IICE CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C[C@](C)(O)C(F)(F)C(F)(F)F 1641743911 SLTQEFKUMLBMQS-SFHVURJKSA-N 438.437 4.413 10 10 IICE CC(C)(C)OC(=O)N1CCC[C@@]2(C[C@H]2C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 1641997639 SYMUQFFZCPOOAC-VBKZILBWSA-N 429.344 4.352 10 10 IICE CCc1c(Br)cc(C(=O)NCc2cccc(O)c2O)cc1Br 1644711329 XRTYXQJJUWACID-UHFFFAOYSA-N 429.108 4.115 10 10 IICE Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 1651540323 NBHJBWRGZKWLPR-AREMUKBSSA-N 429.520 4.361 10 10 IICE Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)C2)n1 1684478522 ACCNGSBZVCMICR-NRFANRHFSA-N 445.567 4.358 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)N(C)[C@H]2C[C@@H](Oc3ccccc3)C2(C)C)N(C)C)cc1 1687807573 UNFWAPNDNCMPCA-KMDXXIMOSA-N 438.616 4.243 10 10 IICE C[C@@H]1C[C@@H](C)CN(CCCn2c(-c3ccccn3)nnc2N(C)Cc2ccccc2O)C1 1693572889 QUIXZLADTBCNBV-WOJBJXKFSA-N 434.588 4.050 10 10 IICE CCC[C@@H](C)N(C)c1nnc(-c2noc3c2COCC3)n1CCCSc1nccs1 1709487716 JTHBCYHTWFCDDP-CQSZACIVSA-N 448.618 4.270 10 10 IICE COc1ccc(N2CCCN(c3nnc(C(C)C)n3C[C@@H](OC)C(C)(C)C)CC2)cc1 1711865185 LTAWBAQABDORII-OAQYLSRUSA-N 429.609 4.188 10 10 IICE CC[C@@H](C)[C@](C)(O)Cn1c(-c2ccc[nH]2)nnc1N(C)Cc1ccc(N2CCCC2)cc1 1743493158 GLRRGLNJTDMEKB-KBMIEXCESA-N 436.604 4.307 10 10 IICE CCN(CC)c1ccc(Cn2c(C(C)C)nnc2N2C[C@@H](C)O[C@@]3(CCCOC3)C2)cc1 1746087588 ZWSTUZHNYRFBMG-NLFFAJNJSA-N 441.620 4.070 10 10 IICE CCOCc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@H]1CCCCS1 1747030319 RPPULOKIPPMMKF-NRFANRHFSA-N 429.634 4.337 10 10 IICE Cc1cc(-c2nnc(N(C)CCC(F)F)n2C[C@@H](C)N(C)C)c(C)n1-c1ccccc1 1751409424 BZMXSKPNHHSJNW-QGZVFWFLSA-N 430.547 4.394 10 10 IICE CCCN(CC)c1nnc(-c2cccc(C)n2)n1Cc1ccc(N2CCSCC2)cc1 1765969169 YAKFFIFJTSDZTJ-UHFFFAOYSA-N 436.629 4.486 10 10 IICE COc1ccc(N2CCN(C(=O)c3cc(Br)ccc3-n3cccc3)CC2)cc1 1873831507 PQSOHEGNAFKTFS-UHFFFAOYSA-N 440.341 4.211 10 10 IICE O=C(NCc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cnc2ncc(Br)cc2c1 1890633671 GUQVOLBUMKAPNS-YWZLYKJASA-N 437.341 4.311 10 10 IICE [N-]=[N+]=N[C@H]1CCCN(C(=O)c2ccc(I)c(Br)c2)CC1 2155560743 NIUMHPNWIVMAQO-JTQLQIEISA-N 449.090 4.359 10 10 IICE COc1ccc(Br)c(CNC[C@@H]2CN(C(=O)OC(C)(C)C)C(C)(C)C2)c1O 2236043866 MXSDVLRSGAVHPL-CYBMUJFWSA-N 443.382 4.289 10 10 IICE CC[C@H](C)NCc1ccc(N(C)C[C@H](O)COCc2ccccc2)cc1Br 2240022790 ALIKBXHPJJGQMU-UWJYYQICSA-N 435.406 4.351 10 10 IICE COc1ccc2nc(NC(=O)CN3C(=O)C(=Cc4cccs4)SC3=S)sc2c1 2314563201 XVMPWKPQBFQCGU-UHFFFAOYSA-N 447.588 4.206 10 10 IICE CC[C@H](Oc1cccc(C=C2SC(=S)N(c3cccc(OC)c3)C2=O)c1)C(=O)O 2314930524 FLEPXUOQGFQMJU-KRWDZBQOSA-N 429.519 4.343 10 10 IICE CCC1=NN(Cc2cccc(Cl)c2)C(=O)C1=Cc1cc2c(cc1[N+](=O)[O-])OCCO2 2332140978 AFIHQFFJFWWHEN-UHFFFAOYSA-N 427.844 4.211 10 10 IICE Cc1ccc(CNC(=O)[C@]2(C)C=CCCN2C(=O)OC(C)(C)C)c(O)c1Br 2381137473 NVXRBORQBQKCDQ-FQEVSTJZSA-N 439.350 4.035 10 10 IICE O=C(NC[C@@H]1CCCO1)c1cccc2c1N[C@@H](c1cc([N+](=O)[O-])ccc1O)[C@H]1CC=C[C@H]21 14475976 WAVNCFHPGJQZAM-MCLIINAXSA-N 435.480 4.036 10 10 IICE Cc1ccc(NC(=O)[C@@H](C)N2C(=O)/C(=C/c3cccc([N+](=O)[O-])c3)SC2=S)cc1 47152308 BZNPKPCJIWRHFS-GPLLRDDGSA-N 427.507 4.132 10 10 IICE COc1ccc(N2CCN([C@H](CNC(=O)c3ccc(Cl)s3)c3ccco3)CC2)cc1 49486414 WTGSJDJRTHNDQS-GOSISDBHSA-N 445.972 4.296 10 10 IICE CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(CN2C(=O)c3ccccc3C2=O)cc1 105714745 ZGFGTWFAISWPJO-UHFFFAOYSA-N 441.531 4.211 10 10 IICE CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2CNCc1ccc(Br)cc1O 704004801 MFKHPEKYNDBRHD-HNNXBMFYSA-N 425.367 4.282 10 10 IICE CCc1ccc(-c2csc(NS(=O)(=O)c3c(C)oc(C)c3C(=O)OC)n2)s1 727245128 CPLKXVUOYJLIFC-UHFFFAOYSA-N 426.541 4.231 10 10 IICE COc1cc(N(C)CC(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)cc(OC)c1OC 741794974 FUDGBAMZDNXWQG-UHFFFAOYSA-N 444.915 4.378 10 10 IICE O=C(NCc1cc(-c2ccccc2)no1)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 743613242 DZQUYUSNAHQOQZ-QGZVFWFLSA-N 442.466 4.411 10 10 IICE CC[C@@H](NC(=O)NCCc1cc(C)n(-c2ccccc2)c1C)c1nnc2n1CCCCC2 749541476 CQVFRGQVEXZKTM-JOCHJYFZSA-N 434.588 4.405 10 10 IICE CN(C)c1ccc(CNC(=O)N2CCC[C@@H]([C@H]3CCCN3C(=O)OC(C)(C)C)C2)cc1 749705994 LOAZBJQFADQUOK-TZIWHRDSSA-N 430.593 4.074 10 10 IICE COCCN(Cc1c(O)ccc2c(=O)c(-c3ccccc3Cl)c(C)oc12)[C@H]1CCOC1 782962840 PKJBTCAAIYOPMG-INIZCTEOSA-N 443.927 4.365 10 10 IICE COc1ccc(OC)c(-c2csc(NS(=O)(=O)c3c(C)n(C)c4ccccc34)n2)c1 789727300 KUUFNZONUZWSIN-UHFFFAOYSA-N 443.550 4.428 10 10 IICE CC(C)(CNC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)C(F)(F)F 800997564 RWRXQSPNWFFOSX-FMIVXFBMSA-N 436.546 4.434 10 10 IICE O=C(NCc1cc(Br)ccc1O)Nc1ccc(-c2noc(C(F)F)n2)cc1 806250849 GASPLEPXNPDUGW-UHFFFAOYSA-N 439.216 4.464 10 10 IICE CN(C)c1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(Cl)c2)cc1F 1125535246 UHNMOHBFXDCTEU-VBKZILBWSA-N 438.330 4.034 10 10 IICE Cc1ccc(O[C@H](C)C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)c(Br)c1 1134682174 YYAJCTRUCYOVFA-OXQOHEQNSA-N 448.405 4.010 10 10 IICE O=C(CN1CCCc2cc(OC(F)F)ccc21)NCCOc1ccc(C(F)(F)F)cc1 1191655358 MVLRTXSJWPMRED-UHFFFAOYSA-N 444.400 4.255 10 10 IICE COc1ccc(N2CCN(C(=O)NCc3ccc(-c4ccccc4)s3)CC2)c(OC)c1 1253503255 XKXJYUNQSGEQNH-UHFFFAOYSA-N 437.565 4.464 10 10 IICE Cc1cc(CNC(=O)c2cccc(S(=O)(=O)C(F)(F)F)c2)c(C)n1-c1ccccc1 1287662319 XKXKYQHKBACJPW-UHFFFAOYSA-N 436.455 4.318 10 10 IICE Cc1cc(-c2nnc(N3C[C@@H](C)CC[C@@H]3C)n2CCC(=O)N(C)C)c(C)n1-c1ccccc1 1289360011 YPHWAIRGVOCXAE-OALUTQOASA-N 448.615 4.456 10 10 IICE CC[C@@H](C)CN(C)c1nnc(CC2CCCC2)n1Cc1ccc(N2CCOCC2)cc1 1291726072 MXAPKOLMBKVKLB-HXUWFJFHSA-N 425.621 4.378 10 10 IICE COc1ccc(N2CC[C@@H](NC(=O)C(C)(C)[C@@H](O)c3cc(Cl)cc(Cl)c3)C2)cc1 1300632693 BRVOUWRVBRCYER-XLIONFOSSA-N 437.367 4.457 10 10 IICE CC[C@H]1CCC[C@@H]1Cn1c(C(=O)Nc2ccccn2)nnc1N(C)Cc1ccccc1O 1306306606 KSKFYXXJJOJWEE-ZWKOTPCHSA-N 434.544 4.094 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)N3CCOc4ccc(O)cc4C3)cc2Cl)C1 1312591756 ZGONVHLMYJIIRC-INIZCTEOSA-N 429.948 4.386 10 10 IICE CCN1CCN(c2ccc(CNC(=O)[C@@H](Oc3ccccc3)c3ccccc3)cc2F)CC1 1352960757 NSLXNPUMMAXQTE-SANMLTNESA-N 447.554 4.404 10 10 IICE COc1ccc(N2CCC(NC(=O)CN(C(=O)c3ccccc3)c3ccccc3)CC2)cc1 1359815986 BKXUOZLHCHNVME-UHFFFAOYSA-N 443.547 4.127 10 10 IICE CCc1ccc(NC(=O)Cn2c3c(c4ccccc42)CN(C(C)C)CC3)c(C(=O)OC)c1 1435172955 PCEHEUVZZNDXDQ-UHFFFAOYSA-N 433.552 4.396 10 10 IICE Cc1ccc(N2C[C@@H](C(=O)NCCc3cc(C)n(-c4ccccc4)c3C)CC2=O)cc1C 1438177266 HOCXILNPVLQFQJ-QHCPKHFHSA-N 429.564 4.423 10 10 IICE COC(=O)COc1ccc([C@@H](C)NC(=O)c2ccc(C)c(-n3c(C)cc(C=O)c3C)c2)cc1 1447456619 SKNHICFHGFZGHU-GOSISDBHSA-N 448.519 4.258 10 10 IICE CN(Cc1ccccc1)C(=O)N1CCC(C(=O)NCc2c(O)ccc3ccccc23)CC1 1456308019 FWFIOLRFXUEWQD-UHFFFAOYSA-N 431.536 4.126 10 10 IICE C[C@@H]1CCCN(c2ccc(CNC(=O)c3coc4c3C(=O)NCC(C)(C)C4)cc2Cl)C1 1459590790 XOIPYVOMLMHRKE-OAHLLOKOSA-N 443.975 4.411 10 10 IICE CN(C)c1ccc([C@H](CNC(=O)C2(c3cccc(OC(F)(F)F)c3)CCC2)N(C)C)cc1 1463279449 IFATWQIMTFEMPR-NRFANRHFSA-N 449.517 4.492 10 10 IICE CN(Cc1cc(Cl)cc(Cl)c1)C(=O)NCc1ccc(N2CCC(C(N)=O)CC2)cc1 1471369184 HBMVQBNWYMTUQA-UHFFFAOYSA-N 449.382 4.037 10 10 IICE C[C@H](C1CC1)N(Cc1ccccc1)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 1478785954 CBPLHLJAFLALQO-QGZVFWFLSA-N 429.511 4.312 10 10 IICE Cc1csc([C@@H](C)Cn2c([C@@H]3CCCOC3)nnc2N(C)Cc2ccccc2O)n1 1492638984 KXFSWCZFMOKGDA-MAUKXSAKSA-N 427.574 4.083 10 10 IICE CCN(CC)c1ccc(Cn2c(-c3cccc(C)n3)nnc2N2CCO[C@H](C(C)C)C2)cc1 1501839445 RORPHEQYZRTOLW-DEOSSOPVSA-N 448.615 4.404 10 10 IICE CC(C)Cc1nnc(N(C)Cc2ccc(N3CCCC3)cc2)n1C[C@@]1(O)CCC[C@H]1C 1509131982 JPEJGNCQKIECBG-NLFFAJNJSA-N 425.621 4.264 10 10 IICE COc1ccc(N2CC[C@H](NC(=O)c3cc(-c4cc(OC)ccc4Cl)no3)C2)cc1 1531740848 LMNDEETZIBOTKV-AWEZNQCLSA-N 427.888 4.021 10 10 IICE C[C@H]1CCCN(c2ccc(CNC(=O)c3cc(C4CCOCC4)nn3C)cc2Cl)C1 1539911933 FXANFKHSIXETGY-INIZCTEOSA-N 430.980 4.134 10 10 IICE CC[C@H](C(=O)N(CC)Cc1ccc(N(C)C)cc1)n1nnc(-c2ccc(Cl)cc2)n1 1544094400 SRLICLARUPCVOE-HXUWFJFHSA-N 426.952 4.059 10 10 IICE Cc1cc(C(=O)Nc2cncnc2N2CCCC2)c(C)n1-c1cccc(Br)c1 1545511031 USHAPWFOIJJEBO-UHFFFAOYSA-N 440.345 4.499 10 10 IICE Cc1ccc(C(=O)NCCc2nnc(-c3ccccc3)o2)cc1-n1c(C)cc(C=O)c1C 1545691341 YTMOAAOHNOSSCY-UHFFFAOYSA-N 428.492 4.238 10 10 IICE CCC(O)(CC)Cn1c(CC(C)(C)C)nnc1N1CCCN(c2ccc(OC)cc2)CC1 1546035792 ZQIGKZOGXDVQGI-UHFFFAOYSA-N 443.636 4.143 10 10 IICE CCC(CC)NC(=O)c1nnc(N2CCC[C@H](CC)C2)n1Cc1ccc(N(C)C)c(F)c1 1546651838 PXJVIQWUNANFNB-KRWDZBQOSA-N 444.599 4.076 10 10 IICE Cc1cc(C(=O)NC[C@@H]2CCCC[C@H]2NS(C)(=O)=O)c(C)n1-c1cccc(C(C)C)c1 1556539970 MSURPOQEKIDUBJ-NZQKXSOJSA-N 445.629 4.055 10 10 IICE C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 1566846577 YQVNEXNKQFAYIS-HFZDXXHNSA-N 430.548 4.383 10 10 IICE CN(C)c1ccc([C@@H](CNC(=O)[C@@H]2C[C@]2(C)c2ccccc2)NC(=O)OC(C)(C)C)cc1 1586619619 LBKFXPXEWQLZNG-VVZHRXSXSA-N 437.584 4.412 10 10 IICE Cc1cc(C(=O)N2CCCC[C@@H]2c2ccnn2C)c(C)n1-c1ccc(Br)cn1 1617453630 ZZRRSQOLPKZYCW-LJQANCHMSA-N 442.361 4.353 10 10 IICE Cc1ccc([C@H](CN2CCOCC2)NC(=O)c2cccc(-n3c(C)cc(C=O)c3C)c2)cc1 1624580807 DOYVDOIYAPISMD-SANMLTNESA-N 445.563 4.018 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CC[C@H](C2CC2)N1C(=O)OC(C)(C)C 1630181026 RENKSIZOFAYYHK-MTNREXPMSA-N 429.605 4.286 10 10 IICE CCOC(=O)c1cc2n(n1)C[C@@H](C)N(C(=O)c1cc(C)n(-c3cccc(Cl)c3)c1C)C2 1635115620 FEOKRDSKQIDZKH-OAHLLOKOSA-N 440.931 4.165 10 10 IICE CC[C@@H](NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S)c1ccccn1 1638409478 BLZOFVAFZQCTFD-OVGFGYAMSA-N 431.608 4.392 10 10 IICE Cc1cc(C=O)c(C)n1-c1ccc(CC(=O)N2CCC[C@H](O)[C@@H]2CCc2ccccc2)cc1 1640093222 ULOOCKNTPAGRNZ-SVBPBHIXSA-N 444.575 4.434 10 10 IICE Cc1cc(C(=O)Nc2ccc(CO)c(CO)c2)c(C)n1-c1ccccc1Br 1642412839 PRMWPBSGJJWFAM-UHFFFAOYSA-N 429.314 4.094 10 10 IICE Cc1cc(CN2CCC([C@H]3OCCC[C@H]3NC(=O)OC(C)(C)C)CC2)ccc1N(C)C 1643326388 UOAJWLHXOGYGBQ-FYYLOGMGSA-N 431.621 4.345 10 10 IICE Cc1cc(O)nc(N2CCC(NC(=O)c3cc(C)n(-c4cccc(C(C)C)c4)c3C)CC2)n1 1652481925 IYOOSVLHUMXDRA-UHFFFAOYSA-N 447.583 4.420 10 10 IICE Cc1[nH]c2ccccc2c1SCCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1 1674718144 JZTIZQQNLBYYAE-UHFFFAOYSA-N 438.597 4.029 10 10 IICE Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)C1 1680689977 QDOSAUQDBQHNKL-NLWGTHIKSA-N 432.609 4.079 10 10 IICE O=C(NCc1cc(-c2ccc(F)cc2F)on1)NCc1cccc(Br)c1O 1684957947 FTCPTJRQLRHOOR-UHFFFAOYSA-N 438.228 4.087 10 10 IICE Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CCN(C(=O)OC(C)(C)C)C(C)(C)C1 1686826275 FFLJELQCFKUDEF-GOSISDBHSA-N 432.609 4.033 10 10 IICE CSCC[C@H](C)N(C)c1nnc(C2CCC2)n1Cc1ccc(N2CCOCC2)cc1 1712798425 VMRGLALSCIVYHA-SFHVURJKSA-N 429.634 4.008 10 10 IICE CCc1nnc(N2CCC[C@H](OCC(F)(F)F)C2)n1CCCSc1nccs1 1727587931 WCNNGMXFCMJPSZ-ZDUSSCGKSA-N 435.541 4.027 10 10 IICE CN(Cc1ccccc1O)c1nnc(CC(C)(C)C)n1CCOCC(F)(F)C(F)F 1747754619 UIGRZNMKHOFTNR-UHFFFAOYSA-N 432.462 4.126 10 10 IICE Cc1cc(C)n(Cc2nnc(N3C[C@@H](C)CC[C@@H]3C)n2Cc2ccc(N(C)C)cc2C)n1 1751843723 RRLCDSWSOMLNAA-PXNSSMCTSA-N 435.620 4.187 10 10 IICE CO[C@@H]1CCCN(c2nnc(CC(C)C)n2Cc2ccc(N3CCC(C)CC3)cc2)C1 1770604862 KUYCADAGCGSUFS-HSZRJFAPSA-N 425.621 4.376 10 10 IICE CCOC(=O)c1c(NC(=O)[C@@H]2CCCN(C(=O)CC)C2)sc(C)c1-c1ccccc1 1860645723 FLIVVSVOGHFAIS-QGZVFWFLSA-N 428.554 4.487 10 10 IICE O=C(O)C=Cc1ccc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)cc1Br 1911927884 IEAMOZGPYMJVRV-KDURUIRLSA-N 427.342 4.115 10 10 IICE COCCNCc1ccc(N(C)[C@H]2CC[C@@H]2OCc2ccccc2)cc1Br 2156444830 KJLPZILIZROKMM-VXKWHMMOSA-N 433.390 4.369 10 10 IICE CC[C@H](NC[C@@]1(O)CCCN(Cc2ccccc2)C1)c1cc(Br)ccc1O 2157531049 ZVSVLZSCVKYJEN-UNMCSNQZSA-N 433.390 4.223 10 10 IICE CCc1ccc(C=C2SC(=S)N(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2=O)cc1 2296881368 DFYQWNZJFAJQAF-UHFFFAOYSA-N 441.534 4.387 10 10 IICE CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](NCc1c(O)cccc1Br)[C@@H]2F 2333274433 IVIAUTWDKGZDHT-ZUFFMMDNSA-N 429.330 4.123 10 10 IICE CC[C@@H](C(=O)N(C)Cc1ccc(C)c(Br)c1O)N(C)C(=O)OC(C)(C)C 2352658322 XNYXIGPITCIRFR-AWEZNQCLSA-N 429.355 4.067 10 10 IICE